A0A3Q0KGV8_SCHMA Loading...

RING-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KGV8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 483 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
1M29Very low30.8Very low225 Ų225128.5 Ų128.5100%1.10864%0.64SS**  01070-90.5179148.800108.3
2I29.6Very low30.7Very low177 Ų177122.7 Ų122.791%0.90861%0.612SS**  trans-90105177.8-61.3168.6000106.5
3W29.3Very low30.6Very low169 Ų169118.9 Ų118.964%0.6460%0.599SS**  trans-71135.5173.2-78.928.9000109.1
4S34.6Very low30.7Very low67 Ų67116.1 Ų116.147%0.46959%0.593SS.*  trans-63.6141.8178.579.80000111N6 S7 I8S4-N6 PolarHBondContact O-N 3.19Å; S4-N6 VanDerWaalsContact O-N 3.1Å; S4-S7 VanDerWaalsContact O-CB 3.32Å; S4-S7 WeakPolarHBondContact O-CB 3.37Å; S4-S7 PolarHBondContact O-N 3.4Å; S4-S7 PolarHBondContact OG-OG 2.89Å; S4-I8 PolarHBondContact O-N 3.01Å
5W32.8Very low30.4Very low178 Ų178115.1 Ų115.167%0.67460%0.599SS**Hα-helixtrans-54.9-28177.5-91.697.3000113.5S7 I8 A9W5-S7 VanDerWaalsContact C-N 3.3Å; W5-S7 PolarHBondContact O-N 3.31Å; W5-I8 PolarHBondContact O-N 2.92Å; W5-A9 WeakPolarHBondContact O-CB 3.35Å; W5-A9 PolarHBondContact O-N 3.1Å
6N31.3Very low30.3Very low130 Ų130117.1 Ų117.170%0.69561%0.605SS**Hα-helixtrans-66.3-29174.1-93.4-14.7000113.5S4 K10S4-N6 PolarHBondContact O-N 3.19Å; S4-N6 VanDerWaalsContact O-N 3.1Å; N6-K10 PolarHBondContact O-N 3.45Å
7S31.8Very low30.4Very low52 Ų52115.1 Ų115.136%0.36460%0.599SS.*Hα-helixtrans-74.5-35.2175.1-49.20000111.4S4 W5 L11S4-S7 VanDerWaalsContact O-CB 3.32Å; S4-S7 WeakPolarHBondContact O-CB 3.37Å; S4-S7 PolarHBondContact O-N 3.4Å; S4-S7 PolarHBondContact OG-OG 2.89Å; W5-S7 VanDerWaalsContact C-N 3.3Å; W5-S7 PolarHBondContact O-N 3.31Å; S7-L11 PolarHBondContact O-N 2.72Å
8I30.5Very low30.4Very low61 Ų61113.5 Ų113.531%0.31359%0.591SS.*Hα-helixtrans-72.1-42.2177.2-59.1173.3000110.2S4 W5 K10 L11 L12S4-I8 PolarHBondContact O-N 3.01Å; W5-I8 PolarHBondContact O-N 2.92Å; I8-K10 VanDerWaalsContact C-N 3.33Å; I8-K10 PolarHBondContact O-N 3.38Å; I8-L11 WeakPolarHBondContact O-CB 3.22Å; I8-L11 PolarHBondContact O-N 3.15Å; I8-L11 VanDerWaalsContact O-N 3.09Å; I8-L12 HydrophobicContact CG2-CD1 4.22Å; I8-L12 PolarHBondContact O-N 2.96Å
9A29.2Very low30.4Very low55 Ų55113.6 Ų113.646%0.45559%0.592SS.*Hα-helixtrans-65-31179.100000113.7W5 L12W5-A9 WeakPolarHBondContact O-CB 3.35Å; W5-A9 PolarHBondContact O-N 3.1Å; A9-L12 PolarHBondContact O-N 3Å
10K32.3Very low30.4Very low177 Ų177110.2 Ų110.277%0.7758%0.58SS**Hα-helixtrans-76.9-19.8172.7-76.5-177.4176.9-178.60113.7N6 I8 L12N6-K10 PolarHBondContact O-N 3.45Å; I8-K10 VanDerWaalsContact C-N 3.33Å; I8-K10 PolarHBondContact O-N 3.38Å; K10-L12 VanDerWaalsContact C-N 3.33Å
11L28.6Very low30.6Very low123 Ų123107.5 Ų107.564%0.64457%0.568SS**Hα-helixtrans-78.6-20.7171.6-127.396.3000112.2S7 I8 V13S7-L11 PolarHBondContact O-N 2.72Å; I8-L11 WeakPolarHBondContact O-CB 3.22Å; I8-L11 PolarHBondContact O-N 3.15Å; I8-L11 VanDerWaalsContact O-N 3.09Å; L11-V13 VanDerWaalsContact C-N 3.32Å; L11-V13 PolarHBondContact O-N 3.25Å; L11-V13 VanDerWaalsContact O-N 3.14Å
12L29.4Very low30.9Very low58 Ų58104 Ų10430%0.30455%0.547SS..  trans-82.771.3173.9-81.2144.8000109.9I8 A9 K10 P14 L72 T76I8-L12 HydrophobicContact CG2-CD1 4.22Å; I8-L12 PolarHBondContact O-N 2.96Å; A9-L12 PolarHBondContact O-N 3Å; K10-L12 VanDerWaalsContact C-N 3.33Å; L12-P14 HydrophobicContact CB-CG 4.43Å; L12-P14 WeakPolarHBondContact O-CD 3.43Å; L12-P14 WeakPolarHBondContact O-CG 3.5Å; L12-L72 HydrophobicContact CD2-CD1 4.47Å; L12-L72 HydrophobicContact CD2-CD2 4.46Å; L12-T76 HydrophobicContact CD2-CG2 3.96Å
13V29.9Very low31.1Very low74 Ų7499.7 Ų99.745%0.44853%0.525SS..  trans-95.586.5161.8-178.80000107L11 C15 E16L11-V13 VanDerWaalsContact C-N 3.32Å; L11-V13 PolarHBondContact O-N 3.25Å; L11-V13 VanDerWaalsContact O-N 3.14Å; V13-C15 PolarHBondContact O-N 2.95Å; V13-E16 HydrophobicContact CG1-CB 4.28Å; V13-E16 HydrophobicContact CG1-CG 4.28Å
14P31.4Very low31.7Very low79 Ų7994.1 Ų94.151%0.51351%0.507SS..THydrogen-bonded Turntrans-90.71.6-159.5-325.9000113.4L12L12-P14 HydrophobicContact CB-CG 4.43Å; L12-P14 WeakPolarHBondContact O-CD 3.43Å; L12-P14 WeakPolarHBondContact O-CG 3.5Å
15C26.1Very low31.7Very low101 Ų10197.9 Ų97.968%0.68252%0.516SS*.THydrogen-bonded Turntrans-107.5-35.5-177.4-71.60000113.5V13 L19V13-C15 PolarHBondContact O-N 2.95Å; C15-L19 PolarHBondContact O-N 3.11Å; C15-L19 VanDerWaalsContact O-N 3.12Å
16E29.9Very low31.6Very low148 Ų14892.4 Ų92.469%0.69250%0.504SS*.Hα-helixtrans-76.8-37.8-178.6-65.9-176.9167.100112.3V13 L18 L19 A20V13-E16 HydrophobicContact CG1-CB 4.28Å; V13-E16 HydrophobicContact CG1-CG 4.28Å; E16-L18 VanDerWaalsContact C-N 3.33Å; E16-L18 PolarHBondContact O-N 2.71Å; E16-L19 PolarHBondContact O-N 3.11Å; E16-A20 VanDerWaalsContact O-CB 3.31Å; E16-A20 WeakPolarHBondContact O-CB 3.31Å; E16-A20 PolarHBondContact O-N 3.15Å
17V30.7Very low31.7Very low83 Ų8389 Ų8950%0.50349%0.486SS..Hα-helixtrans-69.1-33.3175.9-176.80000111.4A20 T21V17-A20 PolarHBondContact O-N 3.41Å; V17-T21 HydrophobicContact CG1-CG2 4.49Å; V17-T21 WeakPolarHBondContact O-CB 3.41Å; V17-T21 WeakPolarHBondContact O-CG2 3.37Å; V17-T21 PolarHBondContact O-N 3.44Å; V17-T21 PolarHBondContact O-OG1 3.18Å
18L30.4Very low31.8Very low86 Ų8690.6 Ų90.645%0.4549%0.489SS..Hα-helixtrans-71-36.8176.5-151.5110.2000111.5E16 T21 K22 F69E16-L18 VanDerWaalsContact C-N 3.33Å; E16-L18 PolarHBondContact O-N 2.71Å; L18-T21 WeakPolarHBondContact CA-OG1 3.43Å; L18-T21 PolarHBondContact O-OG1 3.34Å; L18-K22 WeakPolarHBondContact O-CB 3.46Å; L18-K22 PolarHBondContact O-N 3.15Å; L18-K22 VanDerWaalsContact O-N 3.09Å; L18-F69 HydrophobicContact CD1-CE2 4.4Å
19L30.4Very low31.9Very low116 Ų11690.6 Ų90.661%0.60750%0.495SS*.Hα-helixtrans-68.6-43.4173-146.699.8000111C15 E16 K22 L23C15-L19 PolarHBondContact O-N 3.11Å; C15-L19 VanDerWaalsContact O-N 3.12Å; E16-L19 PolarHBondContact O-N 3.11Å; L19-K22 PolarHBondContact O-N 3.25Å; L19-L23 HydrophobicContact CD2-CD1 4.14Å; L19-L23 VanDerWaalsContact O-CB 3.29Å; L19-L23 WeakPolarHBondContact O-CB 3.26Å; L19-L23 PolarHBondContact O-N 2.82Å
20A31.8Very low32Very low44 Ų4493.7 Ų93.736%0.36450%0.498SS..Hα-helixtrans-65.8-42.617900000112.4E16 V17 L23 I24E16-A20 VanDerWaalsContact O-CB 3.31Å; E16-A20 WeakPolarHBondContact O-CB 3.31Å; E16-A20 PolarHBondContact O-N 3.15Å; V17-A20 PolarHBondContact O-N 3.41Å; A20-L23 PolarHBondContact O-N 3.37Å; A20-I24 WeakPolarHBondContact O-CB 3.35Å; A20-I24 WeakPolarHBondContact O-CD1 3.22Å; A20-I24 WeakPolarHBondContact O-CG1 3.32Å; A20-I24 PolarHBondContact O-N 2.99Å
21T34Very low32Very low54 Ų5488.5 Ų88.533%0.33148%0.483SS..Hα-helixtrans-68.7-39.8176.144.40000112.3V17 L18 I24 F25V17-T21 HydrophobicContact CG1-CG2 4.49Å; V17-T21 WeakPolarHBondContact O-CB 3.41Å; V17-T21 WeakPolarHBondContact O-CG2 3.37Å; V17-T21 PolarHBondContact O-N 3.44Å; V17-T21 PolarHBondContact O-OG1 3.18Å; L18-T21 WeakPolarHBondContact CA-OG1 3.43Å; L18-T21 PolarHBondContact O-OG1 3.34Å; T21-I24 PolarHBondContact O-N 3.28Å; T21-F25 WeakPolarHBondContact O-CB 3.49Å; T21-F25 PolarHBondContact O-N 3.49Å
22K35.3Very low32.1Very low151 Ų15190.9 Ų90.966%0.65749%0.488SS*.Hα-helixtrans-60.8-44.1169.4-92.7-173.2171.4-177.80112L18 L19 F25 C26L18-K22 WeakPolarHBondContact O-CB 3.46Å; L18-K22 PolarHBondContact O-N 3.15Å; L18-K22 VanDerWaalsContact O-N 3.09Å; L19-K22 PolarHBondContact O-N 3.25Å; K22-F25 PolarHBondContact O-N 3.47Å; K22-C26 VanDerWaalsContact O-CB 3.25Å; K22-C26 WeakPolarHBondContact O-CB 3.43Å; K22-C26 PolarHBondContact O-N 2.96Å
23L34.1Very low32.2Very low88 Ų8892.6 Ų92.646%0.46150%0.504SS..Hα-helixtrans-60.9-48.3176-101.1151.3000111.1L19 A20 F25 C26 L27L19-L23 HydrophobicContact CD2-CD1 4.14Å; L19-L23 VanDerWaalsContact O-CB 3.29Å; L19-L23 WeakPolarHBondContact O-CB 3.26Å; L19-L23 PolarHBondContact O-N 2.82Å; A20-L23 PolarHBondContact O-N 3.37Å; L23-F25 VanDerWaalsContact C-N 3.34Å; L23-F25 PolarHBondContact O-N 2.82Å; L23-C26 PolarHBondContact O-N 3.23Å; L23-L27 HydrophobicContact CD2-CD1 4.41Å; L23-L27 VanDerWaalsContact O-CB 3.23Å; L23-L27 WeakPolarHBondContact O-CB 3.3Å; L23-L27 VanDerWaalsContact O-CD1 3.31Å; L23-L27 WeakPolarHBondContact O-CD1 3.28Å; L23-L27 WeakPolarHBondContact O-CG 3.41Å; L23-L27 PolarHBondContact O-N 3.32Å
24I42.3Very low32.3Very low51 Ų5193.2 Ų93.226%0.26250%0.504SS..Hα-helixtrans-62.1-41.4178.3-67.7161.2000111A20 T21 L27 L28 F58 M62A20-I24 WeakPolarHBondContact O-CB 3.35Å; A20-I24 WeakPolarHBondContact O-CD1 3.22Å; A20-I24 WeakPolarHBondContact O-CG1 3.32Å; A20-I24 PolarHBondContact O-N 2.99Å; T21-I24 PolarHBondContact O-N 3.28Å; I24-L27 PolarHBondContact O-N 3.22Å; I24-L28 HydrophobicContact CG2-CD1 3.71Å; I24-L28 HydrophobicContact CG2-CG 4.43Å; I24-L28 WeakPolarHBondContact O-CB 3.33Å; I24-L28 WeakPolarHBondContact O-CD1 3.23Å; I24-L28 VanDerWaalsContact O-CG 3.27Å; I24-L28 WeakPolarHBondContact O-CG 3.42Å; I24-L28 PolarHBondContact O-N 3.39Å; I24-F58 HydrophobicContact CG2-CZ 4.48Å; I24-M62 HydrophobicContact CG2-CE 3.61Å; I24-M62 HydrophobicContact CG2-SD 4.04Å
25F33.8Very low32.4Very low146 Ų14693.1 Ų93.164%0.6450%0.496SS*.Hα-helixtrans-68-40.5177.1-141.8-87.6000111.8T21 K22 L23 L28 S29T21-F25 WeakPolarHBondContact O-CB 3.49Å; T21-F25 PolarHBondContact O-N 3.49Å; K22-F25 PolarHBondContact O-N 3.47Å; L23-F25 VanDerWaalsContact C-N 3.34Å; L23-F25 PolarHBondContact O-N 2.82Å; F25-L28 PolarHBondContact O-N 3.24Å; F25-S29 WeakPolarHBondContact CD1-OG 3.11Å; F25-S29 WeakPolarHBondContact O-CB 3.26Å; F25-S29 PolarHBondContact O-N 3.18Å; F25-S29 PolarHBondContact O-OG 3.32Å
26C30.3Very low32.8Very low64 Ų6493.8 Ų93.843%0.43250%0.501SS..Hα-helixtrans-62.7-42.4172.5-98.60000112.3K22 L23 F30 L34K22-C26 VanDerWaalsContact O-CB 3.25Å; K22-C26 WeakPolarHBondContact O-CB 3.43Å; K22-C26 PolarHBondContact O-N 2.96Å; L23-C26 PolarHBondContact O-N 3.23Å; C26-F30 PolarHBondContact O-N 2.87Å; C26-L34 VanDerWaalsContact C-CD1 3.43Å; C26-L34 HydrophobicContact CB-CD1 3.72Å; C26-L34 VanDerWaalsContact O-CD1 3.3Å; C26-L34 WeakPolarHBondContact O-CD1 3.45Å
27L33.3Very low33Very low59 Ų5996.7 Ų96.731%0.30951%0.507SS..Hα-helixtrans-64.4-39.1176.9-73.6164.3000112.2L23 I24 L34 F35L23-L27 HydrophobicContact CD2-CD1 4.41Å; L23-L27 VanDerWaalsContact O-CB 3.23Å; L23-L27 WeakPolarHBondContact O-CB 3.3Å; L23-L27 VanDerWaalsContact O-CD1 3.31Å; L23-L27 WeakPolarHBondContact O-CD1 3.28Å; L23-L27 WeakPolarHBondContact O-CG 3.41Å; L23-L27 PolarHBondContact O-N 3.32Å; I24-L27 PolarHBondContact O-N 3.22Å; L27-L34 HydrophobicContact CD2-CD1 4.49Å; L27-F35 HydrophobicContact CD2-CD2 4.26Å; L27-F35 HydrophobicContact CD2-CE1 4.41Å; L27-F35 HydrophobicContact CD2-CE2 3.08Å; L27-F35 HydrophobicContact CD2-CZ 3.17Å
28L35.4Very low33.4Very low84 Ų8495.1 Ų95.144%0.4450%0.5SS..Hα-helixtrans-79.3-35.9178.9-73.2166.2000113.2I24 F25 F49 F58I24-L28 HydrophobicContact CG2-CD1 3.71Å; I24-L28 HydrophobicContact CG2-CG 4.43Å; I24-L28 WeakPolarHBondContact O-CB 3.33Å; I24-L28 WeakPolarHBondContact O-CD1 3.23Å; I24-L28 VanDerWaalsContact O-CG 3.27Å; I24-L28 WeakPolarHBondContact O-CG 3.42Å; I24-L28 PolarHBondContact O-N 3.39Å; F25-L28 PolarHBondContact O-N 3.24Å; L28-F49 HydrophobicContact CD2-CZ 4.39Å; L28-F58 HydrophobicContact CD1-CE1 4.16Å; L28-F58 HydrophobicContact CD1-CZ 4.42Å; L28-F58 HydrophobicContact CD2-CE1 4.28Å
29S32.3Very low34Very low61 Ų6197.1 Ų97.143%0.42752%0.516SS..Hα-helixtrans-81.9-28.3-176.1-520000112.5F25F25-S29 WeakPolarHBondContact CD1-OG 3.11Å; F25-S29 WeakPolarHBondContact O-CB 3.26Å; F25-S29 PolarHBondContact O-N 3.18Å; F25-S29 PolarHBondContact O-OG 3.32Å
30F30.5Very low34.3Very low120 Ų12096.5 Ų96.553%0.52652%0.517SS..  trans-138.264.7-178.5-62.1-83.3000112C26 K32 C33C26-F30 PolarHBondContact O-N 2.87Å; F30-K32 PolarHBondContact O-N 3.41Å; F30-C33 HydrophobicContact CB-CB 3.73Å; F30-C33 HydrophobicContact CG-CB 4.41Å; F30-C33 PolarHBondContact O-N 3.06Å
31P31.7Very low34.5Very low69 Ų6996.8 Ų96.845%0.44851%0.512SS..Hα-helixtrans-58.7-25.6176.323.8-32.6000111.8
32K32.3Very low34.4Very low172 Ų17297.9 Ų97.975%0.74852%0.522SS*.Hα-helixtrans-82.3-17.2177.6-69.7-176.3178.3178.80114.9F30F30-K32 PolarHBondContact O-N 3.41Å
33C31.4Very low34.4Very low95 Ų9597.6 Ų97.664%0.64252%0.521SS*.Hα-helixtrans-100.6-13.2-174.4-57.40000114F30F30-C33 HydrophobicContact CB-CB 3.73Å; F30-C33 HydrophobicContact CG-CB 4.41Å; F30-C33 PolarHBondContact O-N 3.06Å
34L32.1Very low34.6Very low87 Ų8797.3 Ų97.346%0.45552%0.523SS..Hα-helixtrans-110.9-12-174.1-77158.3000114.8C26 L27C26-L34 VanDerWaalsContact C-CD1 3.43Å; C26-L34 HydrophobicContact CB-CD1 3.72Å; C26-L34 VanDerWaalsContact O-CD1 3.3Å; C26-L34 WeakPolarHBondContact O-CD1 3.45Å; L27-L34 HydrophobicContact CD2-CD1 4.49Å
35F31.8Very low34.5Very low77 Ų7797.9 Ų97.934%0.33853%0.525SS..  trans-128.5116.3-179.5-62.7-75.2000110.9L27 Y37 L41L27-F35 HydrophobicContact CD2-CD2 4.26Å; L27-F35 HydrophobicContact CD2-CE1 4.41Å; L27-F35 HydrophobicContact CD2-CE2 3.08Å; L27-F35 HydrophobicContact CD2-CZ 3.17Å; F35-Y37 PolarHBondContact O-N 3.44Å; F35-Y37 VanDerWaalsContact O-N 3.15Å; F35-L41 HydrophobicContact CB-CD2 3.64Å; F35-L41 HydrophobicContact CD1-CD1 4.05Å; F35-L41 HydrophobicContact CD1-CD2 3.59Å; F35-L41 HydrophobicContact CD1-CG 4.46Å; F35-L41 HydrophobicContact CD2-CD2 3.36Å; F35-L41 HydrophobicContact CE1-CD1 3.92Å; F35-L41 HydrophobicContact CE1-CD2 3.98Å; F35-L41 HydrophobicContact CE2-CD2 3.73Å; F35-L41 HydrophobicContact CG-CD2 3.24Å; F35-L41 HydrophobicContact CG-CG 4.5Å; F35-L41 HydrophobicContact CZ-CD1 4.3Å; F35-L41 HydrophobicContact CZ-CD2 4.03Å
36S36.3Very low34.5Very low114 Ų11492.8 Ų92.880%0.79751%0.514SS*.  trans-52.3119.5156.238.90000107.6S38S36-S38 PolarHBondContact O-N 3.47Å
37Y32.6Very low34.6Very low209 Ų20992.6 Ų92.682%0.8251%0.513SS*.  trans-44.197.7-177.6-113.2-98.7000110.8F35F35-Y37 PolarHBondContact O-N 3.44Å; F35-Y37 VanDerWaalsContact O-N 3.15Å
38S40.7Very low34.8Very low50 Ų5093.3 Ų93.335%0.3552%0.516SS..  trans-110.4129.6165.5710000108.2S36 T40 L41 S42S36-S38 PolarHBondContact O-N 3.47Å; S38-T40 PolarHBondContact O-N 2.79Å; S38-T40 VanDerWaalsContact O-N 3.11Å; S38-T40 PolarHBondContact OG-OG1 3.49Å; S38-L41 PolarHBondContact O-N 3.46Å; S38-S42 PolarHBondContact O-N 3.49Å
39V40.9Very low34.9Very low128 Ų12895 Ų9578%0.77652%0.52SS*.Hα-helixtrans-54.5-31.5-178.4178.70000111.3F43V39-F43 PolarHBondContact O-N 2.69Å; V39-F43 VanDerWaalsContact O-N 3.09Å
40T37.2Very low35Very low103 Ų10396.2 Ų96.263%0.63253%0.529SS*.Hα-helixtrans-65.2-39.1176.138.50000113.7S38 F43 V44S38-T40 PolarHBondContact O-N 2.79Å; S38-T40 VanDerWaalsContact O-N 3.11Å; S38-T40 PolarHBondContact OG-OG1 3.49Å; T40-F43 PolarHBondContact O-N 3.18Å; T40-V44 WeakPolarHBondContact O-CG2 3.14Å; T40-V44 PolarHBondContact O-N 3.42Å
41L35.4Very low35.4Very low50 Ų5092.2 Ų92.226%0.26252%0.516SS..Hα-helixtrans-76.8-35.6-179.1-157.3103.9000111.7F35 S38 F43 V44 I45F35-L41 HydrophobicContact CB-CD2 3.64Å; F35-L41 HydrophobicContact CD1-CD1 4.05Å; F35-L41 HydrophobicContact CD1-CD2 3.59Å; F35-L41 HydrophobicContact CD1-CG 4.46Å; F35-L41 HydrophobicContact CD2-CD2 3.36Å; F35-L41 HydrophobicContact CE1-CD1 3.92Å; F35-L41 HydrophobicContact CE1-CD2 3.98Å; F35-L41 HydrophobicContact CE2-CD2 3.73Å; F35-L41 HydrophobicContact CG-CD2 3.24Å; F35-L41 HydrophobicContact CG-CG 4.5Å; F35-L41 HydrophobicContact CZ-CD1 4.3Å; F35-L41 HydrophobicContact CZ-CD2 4.03Å; S38-L41 PolarHBondContact O-N 3.46Å; L41-F43 PolarHBondContact O-N 2.91Å; L41-V44 PolarHBondContact O-N 2.83Å; L41-I45 HydrophobicContact CD2-CD1 3.72Å; L41-I45 HydrophobicContact CG-CD1 4.17Å; L41-I45 WeakPolarHBondContact O-CB 3.22Å; L41-I45 VanDerWaalsContact O-CG1 3.26Å; L41-I45 WeakPolarHBondContact O-CG1 3.39Å; L41-I45 PolarHBondContact O-N 2.99Å
42S33.3Very low35.8Very low77 Ų7791.7 Ų91.754%0.53851%0.512SS..Hα-helixtrans-58.2-38.8168.6152.10000111.6S38 G46S38-S42 PolarHBondContact O-N 3.49Å; S42-G46 WeakPolarHBondContact O-CA 3.32Å; S42-G46 PolarHBondContact O-N 3.01Å
43F35.7Very low36Very low146 Ų14687.9 Ų87.964%0.6450%0.499SS*.Hα-helixtrans-69.8-43.4177.8-162.3-95.2000112V39 T40 L41 G46 C47V39-F43 PolarHBondContact O-N 2.69Å; V39-F43 VanDerWaalsContact O-N 3.09Å; T40-F43 PolarHBondContact O-N 3.18Å; L41-F43 PolarHBondContact O-N 2.91Å; F43-G46 CarbonylContact O-C 3.58Å; F43-G46 WeakPolarHBondContact O-CA 3.37Å; F43-G46 PolarHBondContact O-N 3.02Å; F43-C47 VanDerWaalsContact CE1-SG 3.59Å; F43-C47 WeakPolarHBondContact O-CB 3.33Å; F43-C47 PolarHBondContact O-N 3.32Å; F43-C47 PolarHBondContact O-SG 3.2Å
44V37.7Very low36.4Very low81 Ų8186 Ų8649%0.49149%0.485SS..Hα-helixtrans-67.2-44178.41740000111.9T40 L41 G46 C47 I48T40-V44 WeakPolarHBondContact O-CG2 3.14Å; T40-V44 PolarHBondContact O-N 3.42Å; L41-V44 PolarHBondContact O-N 2.83Å; V44-G46 VanDerWaalsContact C-N 3.31Å; V44-C47 PolarHBondContact O-N 3.23Å; V44-I48 HydrophobicContact CG1-CD1 3.86Å; V44-I48 VanDerWaalsContact O-CG1 3.29Å; V44-I48 WeakPolarHBondContact O-CG1 3.33Å; V44-I48 PolarHBondContact O-N 3.44Å
45I40.1Very low36.6Very low63 Ų6384.5 Ų84.532%0.32348%0.479SS..Hα-helixtrans-61-45.3172.3-67.7170.4000109L41 C47 I48 F49L41-I45 HydrophobicContact CD2-CD1 3.72Å; L41-I45 HydrophobicContact CG-CD1 4.17Å; L41-I45 WeakPolarHBondContact O-CB 3.22Å; L41-I45 VanDerWaalsContact O-CG1 3.26Å; L41-I45 WeakPolarHBondContact O-CG1 3.39Å; L41-I45 PolarHBondContact O-N 2.99Å; I45-C47 VanDerWaalsContact C-N 3.31Å; I45-C47 PolarHBondContact O-N 3.17Å; I45-I48 PolarHBondContact O-N 3.21Å; I45-F49 HydrophobicContact CG2-CD2 3.62Å; I45-F49 HydrophobicContact CG2-CE2 3.87Å; I45-F49 WeakPolarHBondContact O-CB 3.18Å; I45-F49 VanDerWaalsContact O-CD2 3.22Å; I45-F49 WeakPolarHBondContact O-CD2 3.34Å; I45-F49 PolarHBondContact O-N 2.76Å
46G33.4Very low37Very low39 Ų3982.6 Ų82.640%0.40247%0.471SS..Hα-helixtrans-53.8-44.2173.100000113S42 F43 V44 F49 S50S42-G46 WeakPolarHBondContact O-CA 3.32Å; S42-G46 PolarHBondContact O-N 3.01Å; F43-G46 CarbonylContact O-C 3.58Å; F43-G46 WeakPolarHBondContact O-CA 3.37Å; F43-G46 PolarHBondContact O-N 3.02Å; V44-G46 VanDerWaalsContact C-N 3.31Å; G46-F49 CarbonylContact O-C 3.53Å; G46-S50 WeakPolarHBondContact O-CA 3.38Å; G46-S50 WeakPolarHBondContact O-CB 3.23Å; G46-S50 PolarHBondContact O-N 3.48Å; G46-S50 PolarHBondContact O-OG 3.44Å
47C33.6Very low37.3Very low60 Ų6080 Ų8041%0.40545%0.452SS..Hα-helixtrans-71.8-34178.4-70.70000113.9F43 V44 I45 S50F43-C47 VanDerWaalsContact CE1-SG 3.59Å; F43-C47 WeakPolarHBondContact O-CB 3.33Å; F43-C47 PolarHBondContact O-N 3.32Å; F43-C47 PolarHBondContact O-SG 3.2Å; V44-C47 PolarHBondContact O-N 3.23Å; I45-C47 VanDerWaalsContact C-N 3.31Å; I45-C47 PolarHBondContact O-N 3.17Å; C47-S50 WeakPolarHBondContact CA-OG 3.25Å; C47-S50 PolarHBondContact O-OG 2.87Å
48I36.3Very low37.7Very low75 Ų7574 Ų7439%0.38543%0.431SS..Hα-helixtrans-71-36.7176.4-68166000110.3V44 I45 T54V44-I48 HydrophobicContact CG1-CD1 3.86Å; V44-I48 VanDerWaalsContact O-CG1 3.29Å; V44-I48 WeakPolarHBondContact O-CG1 3.33Å; V44-I48 PolarHBondContact O-N 3.44Å; I45-I48 PolarHBondContact O-N 3.21Å; I48-T54 WeakPolarHBondContact O-CB 3.48Å; I48-T54 PolarHBondContact O-OG1 2.87Å
49F38Very low37.7Very low118 Ų11876.2 Ų76.252%0.51843%0.434SS..Hα-helixtrans-92.2-5.7179-71.4-77.2000114.3L28 I45 G46 V55L28-F49 HydrophobicContact CD2-CZ 4.39Å; I45-F49 HydrophobicContact CG2-CD2 3.62Å; I45-F49 HydrophobicContact CG2-CE2 3.87Å; I45-F49 WeakPolarHBondContact O-CB 3.18Å; I45-F49 VanDerWaalsContact O-CD2 3.22Å; I45-F49 WeakPolarHBondContact O-CD2 3.34Å; I45-F49 PolarHBondContact O-N 2.76Å; G46-F49 CarbonylContact O-C 3.53Å; F49-V55 HydrophobicContact CD1-CG2 3.85Å
50S35.1Very low37.7Very low88 Ų8872.1 Ų72.162%0.61541%0.408SS*.Hα-helixtrans-77.5-25.9-178.261.10000113.4G46 C47G46-S50 WeakPolarHBondContact O-CA 3.38Å; G46-S50 WeakPolarHBondContact O-CB 3.23Å; G46-S50 PolarHBondContact O-N 3.48Å; G46-S50 PolarHBondContact O-OG 3.44Å; C47-S50 WeakPolarHBondContact CA-OG 3.25Å; C47-S50 PolarHBondContact O-OG 2.87Å
51S38.1Very low37.8Very low36 Ų3670.8 Ų70.825%0.25240%0.4SS..  trans-106.8127.5177.7105.40000111.1I53 T54 V55S51-I53 PolarHBondContact O-N 3.25Å; S51-I53 VanDerWaalsContact O-N 3.17Å; S51-T54 WeakPolarHBondContact CB-OG1 3.45Å; S51-T54 PolarHBondContact O-N 3.3Å; S51-T54 PolarHBondContact O-OG1 2.92Å; S51-T54 WeakPolarHBondContact OG-CB 3.5Å; S51-T54 VanDerWaalsContact OG-CG2 3.23Å; S51-T54 WeakPolarHBondContact OG-CG2 3.11Å; S51-T54 PolarHBondContact OG-N 3.32Å; S51-T54 PolarHBondContact OG-OG1 2.98Å; S51-V55 WeakPolarHBondContact O-CG2 3.24Å; S51-V55 PolarHBondContact O-N 3.13Å
52P38.9Very low38.1Very low57 Ų5770.6 Ų70.637%0.3740%0.398SS..Hα-helixtrans-60.6-25.517517-24.2000112.2F56 V128P52-F56 VanDerWaalsContact O-CB 3.24Å; P52-F56 WeakPolarHBondContact O-CB 3.49Å; P52-F56 PolarHBondContact O-N 2.74Å; P52-V128 HydrophobicContact CB-CG2 4.28Å; P52-V128 HydrophobicContact CG-CG2 3.81Å
53I38.3Very low38.5Very low92 Ų9269.6 Ų69.647%0.47239%0.387SS..Hα-helixtrans-70.6-41.5177.2-60.6170.2000111.6S51 F56 S57S51-I53 PolarHBondContact O-N 3.25Å; S51-I53 VanDerWaalsContact O-N 3.17Å; I53-F56 PolarHBondContact O-N 2.94Å; I53-S57 WeakPolarHBondContact O-CB 3.49Å; I53-S57 PolarHBondContact O-N 2.84Å; I53-S57 PolarHBondContact O-OG 2.77Å
54T38.7Very low38.9Very low57 Ų5769.7 Ų69.735%0.3538%0.383SS..Hα-helixtrans-70.3-39.1177.947.10000111.2I48 S51 S57 F58I48-T54 WeakPolarHBondContact O-CB 3.48Å; I48-T54 PolarHBondContact O-OG1 2.87Å; S51-T54 WeakPolarHBondContact CB-OG1 3.45Å; S51-T54 PolarHBondContact O-N 3.3Å; S51-T54 PolarHBondContact O-OG1 2.92Å; S51-T54 WeakPolarHBondContact OG-CB 3.5Å; S51-T54 VanDerWaalsContact OG-CG2 3.23Å; S51-T54 WeakPolarHBondContact OG-CG2 3.11Å; S51-T54 PolarHBondContact OG-N 3.32Å; S51-T54 PolarHBondContact OG-OG1 2.98Å; T54-S57 PolarHBondContact O-N 3.37Å; T54-F58 VanDerWaalsContact O-CB 3.27Å; T54-F58 WeakPolarHBondContact O-CB 3.06Å; T54-F58 PolarHBondContact O-N 3.15Å
55V37.5Very low39Very low54 Ų5469.2 Ų69.233%0.32738%0.377SS..Hα-helixtrans-63.4-44.3172.9178.90000111F49 S51 F58 F59F49-V55 HydrophobicContact CD1-CG2 3.85Å; S51-V55 WeakPolarHBondContact O-CG2 3.24Å; S51-V55 PolarHBondContact O-N 3.13Å; V55-F58 PolarHBondContact O-N 3.42Å; V55-F59 WeakPolarHBondContact O-CB 3.36Å; V55-F59 PolarHBondContact O-N 3.1Å
56F39.7Very low38.9Very low37 Ų3768.2 Ų68.216%0.16238%0.376CS..Hα-helixtrans-63.5-44.7176.4179.8-107.3000112.6P52 I53 F59 L60 V131 F135P52-F56 VanDerWaalsContact O-CB 3.24Å; P52-F56 WeakPolarHBondContact O-CB 3.49Å; P52-F56 PolarHBondContact O-N 2.74Å; I53-F56 PolarHBondContact O-N 2.94Å; F56-F59 PolarHBondContact O-N 2.89Å; F56-L60 HydrophobicContact CD1-CD1 3.86Å; F56-L60 HydrophobicContact CE1-CD1 3.29Å; F56-L60 HydrophobicContact CE1-CG 4.45Å; F56-L60 HydrophobicContact CE2-CD1 4.27Å; F56-L60 HydrophobicContact CZ-CD1 3.54Å; F56-L60 HydrophobicContact CZ-CG 4.38Å; F56-L60 WeakPolarHBondContact O-CB 3.22Å; F56-L60 PolarHBondContact O-N 2.71Å; F56-V131 HydrophobicContact CB-CG1 3.8Å; F56-V131 HydrophobicContact CD1-CG1 4.36Å; F56-V131 HydrophobicContact CD2-CG1 3.4Å; F56-V131 VanDerWaalsContact CD2-CG1 3.4Å; F56-V131 HydrophobicContact CE2-CG1 3.99Å; F56-V131 HydrophobicContact CG-CG1 3.61Å; F56-F135 HydrophobicContact CD2-CD2 4.42Å; F56-F135 HydrophobicContact CE2-CB 4.09Å; F56-F135 AromaticContact CE2-CD2 4Å; F56-F135 HydrophobicContact CE2-CD2 4Å
57S41.7Very low39.3Very low59 Ų5973 Ų7341%0.41338%0.383SS..Hα-helixtrans-63.1-43177.6-580000111.3I53 T54 L60 V61I53-S57 WeakPolarHBondContact O-CB 3.49Å; I53-S57 PolarHBondContact O-N 2.84Å; I53-S57 PolarHBondContact O-OG 2.77Å; T54-S57 PolarHBondContact O-N 3.37Å; S57-L60 PolarHBondContact O-N 3.07Å; S57-V61 VanDerWaalsContact O-CG2 3.3Å; S57-V61 WeakPolarHBondContact O-CG2 3.29Å; S57-V61 PolarHBondContact O-N 3.49Å
58F41.2Very low39.6Very low84 Ų8475.8 Ų75.837%0.36839%0.386SS..Hα-helixtrans-62.8-43.8175.8-174.4-99000111.6I24 L28 T54 V55 V61 M62I24-F58 HydrophobicContact CG2-CZ 4.48Å; L28-F58 HydrophobicContact CD1-CE1 4.16Å; L28-F58 HydrophobicContact CD1-CZ 4.42Å; L28-F58 HydrophobicContact CD2-CE1 4.28Å; T54-F58 VanDerWaalsContact O-CB 3.27Å; T54-F58 WeakPolarHBondContact O-CB 3.06Å; T54-F58 PolarHBondContact O-N 3.15Å; V55-F58 PolarHBondContact O-N 3.42Å; F58-V61 PolarHBondContact O-N 3.07Å; F58-M62 HydrophobicContact CD1-CG 4.15Å; F58-M62 HydrophobicContact CE1-CG 3.84Å; F58-M62 HydrophobicContact CZ-CG 4.07Å; F58-M62 HydrophobicContact CZ-SD 4.28Å; F58-M62 WeakPolarHBondContact O-CB 3.37Å; F58-M62 VanDerWaalsContact O-CG 3.28Å; F58-M62 WeakPolarHBondContact O-CG 3.47Å; F58-M62 PolarHBondContact O-N 2.62Å
59F40Very low39.6Very low96 Ų9676.7 Ų76.742%0.42139%0.387SS..Hα-helixtrans-65.7-38.7177.7-161.3-89.4000112.6V55 F56 M62 N63 F135V55-F59 WeakPolarHBondContact O-CB 3.36Å; V55-F59 PolarHBondContact O-N 3.1Å; F56-F59 PolarHBondContact O-N 2.89Å; F59-M62 PolarHBondContact O-N 2.97Å; F59-N63 WeakPolarHBondContact CE1-ND2 3.4Å; F59-N63 WeakPolarHBondContact O-CB 3.18Å; F59-N63 PolarHBondContact O-N 3.28Å; F59-F135 AromaticContact CD1-CE2 3.51Å; F59-F135 HydrophobicContact CD1-CE2 3.51Å; F59-F135 AromaticContact CD1-CZ 3.9Å; F59-F135 HydrophobicContact CD1-CZ 3.9Å; F59-F135 AromaticContact CE1-CE2 3.43Å; F59-F135 HydrophobicContact CE1-CE2 3.43Å; F59-F135 VanDerWaalsContact CE1-CE2 3.43Å; F59-F135 AromaticContact CE1-CZ 3.37Å; F59-F135 HydrophobicContact CE1-CZ 3.37Å; F59-F135 HydrophobicContact CZ-CE2 4.5Å; F59-F135 HydrophobicContact CZ-CZ 4.06Å
60L40.9Very low39.6Very low42 Ų4278.4 Ų78.422%0.2239%0.391CS..Hα-helixtrans-62-45.2173-103.6164.3000112F56 S57 N63 W64 F138F56-L60 HydrophobicContact CD1-CD1 3.86Å; F56-L60 HydrophobicContact CE1-CD1 3.29Å; F56-L60 HydrophobicContact CE1-CG 4.45Å; F56-L60 HydrophobicContact CE2-CD1 4.27Å; F56-L60 HydrophobicContact CZ-CD1 3.54Å; F56-L60 HydrophobicContact CZ-CG 4.38Å; F56-L60 WeakPolarHBondContact O-CB 3.22Å; F56-L60 PolarHBondContact O-N 2.71Å; S57-L60 PolarHBondContact O-N 3.07Å; L60-N63 PolarHBondContact O-N 3.48Å; L60-W64 WeakPolarHBondContact O-CB 3.45Å; L60-W64 PolarHBondContact O-N 2.56Å; L60-F138 HydrophobicContact CD2-CE2 4.42Å; L60-F138 HydrophobicContact CD2-CZ 4.2Å
61V41.2Very low39.9Very low76 Ų7677.5 Ų77.546%0.46138%0.379SS..Hα-helixtrans-63.2-43.2176.5171.50000110.7S57 F58 W64 L65S57-V61 VanDerWaalsContact O-CG2 3.3Å; S57-V61 WeakPolarHBondContact O-CG2 3.29Å; S57-V61 PolarHBondContact O-N 3.49Å; F58-V61 PolarHBondContact O-N 3.07Å; V61-W64 PolarHBondContact O-N 3.27Å; V61-L65 HydrophobicContact CG1-CD1 3.91Å; V61-L65 HydrophobicContact CG1-CG 4.45Å; V61-L65 WeakPolarHBondContact O-CB 3.24Å; V61-L65 VanDerWaalsContact O-CG 3.25Å; V61-L65 WeakPolarHBondContact O-CG 3.36Å; V61-L65 PolarHBondContact O-N 2.96Å
62M40.6Very low39.9Very low46 Ų4678.9 Ų78.923%0.22738%0.383CS..Hα-helixtrans-65.9-38.6177.8-70.7-59.6-67.200112.8I24 F58 F59 L65 S66I24-M62 HydrophobicContact CG2-CE 3.61Å; I24-M62 HydrophobicContact CG2-SD 4.04Å; F58-M62 HydrophobicContact CD1-CG 4.15Å; F58-M62 HydrophobicContact CE1-CG 3.84Å; F58-M62 HydrophobicContact CZ-CG 4.07Å; F58-M62 HydrophobicContact CZ-SD 4.28Å; F58-M62 WeakPolarHBondContact O-CB 3.37Å; F58-M62 VanDerWaalsContact O-CG 3.28Å; F58-M62 WeakPolarHBondContact O-CG 3.47Å; F58-M62 PolarHBondContact O-N 2.62Å; F59-M62 PolarHBondContact O-N 2.97Å; M62-L65 HydrophobicContact SD-CD1 4.38Å; M62-S66 WeakPolarHBondContact O-CB 3.41Å; M62-S66 PolarHBondContact O-N 2.68Å
63N41.7Very low39.7Very low56 Ų5678.4 Ų78.430%0.29938%0.379SS..Hα-helixtrans-72.8-33.5174.3-94.9-21.8000113.3F59 L60 S66 Y67F59-N63 WeakPolarHBondContact CE1-ND2 3.4Å; F59-N63 WeakPolarHBondContact O-CB 3.18Å; F59-N63 PolarHBondContact O-N 3.28Å; L60-N63 PolarHBondContact O-N 3.48Å; N63-S66 WeakPolarHBondContact CA-OG 3.48Å; N63-S66 PolarHBondContact O-N 3.32Å; N63-S66 PolarHBondContact O-OG 3.48Å; N63-Y67 WeakPolarHBondContact O-CB 3.44Å; N63-Y67 PolarHBondContact O-N 2.95Å
64W44.1Very low39.5Very low147 Ų14779.8 Ų79.856%0.55738%0.382SS*.Hα-helixtrans-64.8-44.2172.3-174.672.8000110.7L60 V61 Y67 Y68L60-W64 WeakPolarHBondContact O-CB 3.45Å; L60-W64 PolarHBondContact O-N 2.56Å; V61-W64 PolarHBondContact O-N 3.27Å; W64-Y67 PolarHBondContact O-N 3.3Å; W64-Y68 HydrophobicContact CD2-CD2 4.04Å; W64-Y68 HydrophobicContact CD2-CE2 4.13Å; W64-Y68 AromaticContact CE2-CD2 3.75Å; W64-Y68 AromaticContact CE2-CE2 3.35Å; W64-Y68 HydrophobicContact CG-CD2 4.37Å; W64-Y68 HydrophobicContact CH2-CE2 4.23Å; W64-Y68 HydrophobicContact CZ2-CD2 4.06Å; W64-Y68 AromaticContact CZ2-CE2 3.42Å; W64-Y68 HydrophobicContact CZ2-CE2 3.42Å; W64-Y68 VanDerWaalsContact CZ2-CE2 3.42Å; W64-Y68 AromaticContact NE1-CD2 3.91Å; W64-Y68 AromaticContact NE1-CE2 3.43Å; W64-Y68 WeakPolarHBondContact O-CD2 3.32Å; W64-Y68 PolarHBondContact O-N 2.85Å
65L39.8Very low39.4Very low72 Ų7281 Ų8138%0.37739%0.385SS..Hα-helixtrans-63.7-39.7173.5-73.3168.7000112.2V61 M62 Y68 F69V61-L65 HydrophobicContact CG1-CD1 3.91Å; V61-L65 HydrophobicContact CG1-CG 4.45Å; V61-L65 WeakPolarHBondContact O-CB 3.24Å; V61-L65 VanDerWaalsContact O-CG 3.25Å; V61-L65 WeakPolarHBondContact O-CG 3.36Å; V61-L65 PolarHBondContact O-N 2.96Å; M62-L65 HydrophobicContact SD-CD1 4.38Å; L65-Y68 PolarHBondContact O-N 3.07Å; L65-F69 VanDerWaalsContact O-CB 3.31Å; L65-F69 WeakPolarHBondContact O-CB 3.49Å; L65-F69 PolarHBondContact O-N 2.75Å
66S39.3Very low39Very low42 Ų4280.8 Ų80.829%0.29438%0.384SS..Hα-helixtrans-67.6-40.1176.877.10000111.7M62 N63 F69 Y70M62-S66 WeakPolarHBondContact O-CB 3.41Å; M62-S66 PolarHBondContact O-N 2.68Å; N63-S66 WeakPolarHBondContact CA-OG 3.48Å; N63-S66 PolarHBondContact O-N 3.32Å; N63-S66 PolarHBondContact O-OG 3.48Å; S66-F69 CarbonylContact O-C 3.59Å; S66-F69 WeakPolarHBondContact O-CB 3.04Å; S66-F69 PolarHBondContact O-N 2.74Å; S66-Y70 WeakPolarHBondContact O-CD2 2.92Å; S66-Y70 PolarHBondContact O-N 2.77Å
67Y40.7Very low38.6Very low140 Ų14084.3 Ų84.355%0.54940%0.403SS..Hα-helixtrans-64.4-43.1174.8-170.1-95.1000111.8N63 W64 F69 Y70 L71N63-Y67 WeakPolarHBondContact O-CB 3.44Å; N63-Y67 PolarHBondContact O-N 2.95Å; W64-Y67 PolarHBondContact O-N 3.3Å; Y67-F69 VanDerWaalsContact C-N 3.32Å; Y67-F69 PolarHBondContact O-N 3.35Å; Y67-Y70 PolarHBondContact O-N 3.33Å; Y67-L71 WeakPolarHBondContact O-CB 3.01Å; Y67-L71 PolarHBondContact O-N 3.31Å
68Y40.9Very low38Very low118 Ų11882.3 Ų82.346%0.46339%0.39SS..Hα-helixtrans-62.1-39.1171.6-98.1-84000112W64 L65 L71 L72W64-Y68 HydrophobicContact CD2-CD2 4.04Å; W64-Y68 HydrophobicContact CD2-CE2 4.13Å; W64-Y68 AromaticContact CE2-CD2 3.75Å; W64-Y68 AromaticContact CE2-CE2 3.35Å; W64-Y68 HydrophobicContact CG-CD2 4.37Å; W64-Y68 HydrophobicContact CH2-CE2 4.23Å; W64-Y68 HydrophobicContact CZ2-CD2 4.06Å; W64-Y68 AromaticContact CZ2-CE2 3.42Å; W64-Y68 HydrophobicContact CZ2-CE2 3.42Å; W64-Y68 VanDerWaalsContact CZ2-CE2 3.42Å; W64-Y68 AromaticContact NE1-CD2 3.91Å; W64-Y68 AromaticContact NE1-CE2 3.43Å; W64-Y68 WeakPolarHBondContact O-CD2 3.32Å; W64-Y68 PolarHBondContact O-N 2.85Å; L65-Y68 PolarHBondContact O-N 3.07Å; Y68-L71 PolarHBondContact O-N 2.67Å; Y68-L72 WeakPolarHBondContact O-CB 3.47Å; Y68-L72 PolarHBondContact O-N 3.44Å
69F36.5Very low37.6Very low93 Ų9380.7 Ų80.741%0.40839%0.389SS..Hα-helixtrans-64.5-44.9175-177.2-97.2000111.6L18 L65 S66 Y67 L71 L72 V73L18-F69 HydrophobicContact CD1-CE2 4.4Å; L65-F69 VanDerWaalsContact O-CB 3.31Å; L65-F69 WeakPolarHBondContact O-CB 3.49Å; L65-F69 PolarHBondContact O-N 2.75Å; S66-F69 CarbonylContact O-C 3.59Å; S66-F69 WeakPolarHBondContact O-CB 3.04Å; S66-F69 PolarHBondContact O-N 2.74Å; Y67-F69 VanDerWaalsContact C-N 3.32Å; Y67-F69 PolarHBondContact O-N 3.35Å; F69-L71 VanDerWaalsContact C-N 3.34Å; F69-L71 PolarHBondContact O-N 3.01Å; F69-L72 PolarHBondContact O-N 3.14Å; F69-V73 HydrophobicContact CD1-CG2 3.98Å; F69-V73 HydrophobicContact CD2-CG2 4.47Å; F69-V73 HydrophobicContact CE1-CG2 3.63Å; F69-V73 HydrophobicContact CE2-CG2 4.16Å; F69-V73 HydrophobicContact CG-CG2 4.39Å; F69-V73 HydrophobicContact CZ-CG2 3.73Å; F69-V73 WeakPolarHBondContact O-CB 3.26Å; F69-V73 VanDerWaalsContact O-CG2 3.24Å; F69-V73 WeakPolarHBondContact O-CG2 3.24Å; F69-V73 PolarHBondContact O-N 3.05Å
70Y37.4Very low37.2Very low155 Ų15587.4 Ų87.461%0.60841%0.411SS*.Hα-helixtrans-61.8-41.1173.7-86.2-71.9000112S66 Y67 F74S66-Y70 WeakPolarHBondContact O-CD2 2.92Å; S66-Y70 PolarHBondContact O-N 2.77Å; Y67-Y70 PolarHBondContact O-N 3.33Å; Y70-F74 WeakPolarHBondContact O-CB 3.4Å; Y70-F74 PolarHBondContact O-N 3.45Å
71L41.2Very low36.8Very low69 Ų6988.9 Ų88.936%0.36143%0.425SS..Hα-helixtrans-63.9-42.2174.6-165.390.4000111Y67 Y68 F69 F74 I75Y67-L71 WeakPolarHBondContact O-CB 3.01Å; Y67-L71 PolarHBondContact O-N 3.31Å; Y68-L71 PolarHBondContact O-N 2.67Å; F69-L71 VanDerWaalsContact C-N 3.34Å; F69-L71 PolarHBondContact O-N 3.01Å; L71-F74 PolarHBondContact O-N 2.9Å; L71-I75 HydrophobicContact CD2-CD1 4.04Å; L71-I75 HydrophobicContact CG-CD1 3.98Å; L71-I75 WeakPolarHBondContact O-CB 3.11Å; L71-I75 WeakPolarHBondContact O-CD1 3.31Å; L71-I75 WeakPolarHBondContact O-CG1 3.23Å; L71-I75 PolarHBondContact O-N 2.92Å
72L37.5Very low36.4Very low64 Ų6487.4 Ų87.434%0.33541%0.414SS..Hα-helixtrans-70-40.6179.5-165.9114.9000111.7L12 Y68 F69 I75 T76L12-L72 HydrophobicContact CD2-CD1 4.47Å; L12-L72 HydrophobicContact CD2-CD2 4.46Å; Y68-L72 WeakPolarHBondContact O-CB 3.47Å; Y68-L72 PolarHBondContact O-N 3.44Å; F69-L72 PolarHBondContact O-N 3.14Å; L72-I75 PolarHBondContact O-N 3.08Å; L72-T76 WeakPolarHBondContact O-CB 3.18Å; L72-T76 WeakPolarHBondContact O-CG2 3.44Å; L72-T76 PolarHBondContact O-N 2.82Å; L72-T76 PolarHBondContact O-OG1 3.34Å
73V34.2Very low35.9Very low47 Ų4793.2 Ų93.229%0.28544%0.435SS..Hα-helixtrans-64.6-41.5171.8171.30000110.3F69 T76 I77F69-V73 HydrophobicContact CD1-CG2 3.98Å; F69-V73 HydrophobicContact CD2-CG2 4.47Å; F69-V73 HydrophobicContact CE1-CG2 3.63Å; F69-V73 HydrophobicContact CE2-CG2 4.16Å; F69-V73 HydrophobicContact CG-CG2 4.39Å; F69-V73 HydrophobicContact CZ-CG2 3.73Å; F69-V73 WeakPolarHBondContact O-CB 3.26Å; F69-V73 VanDerWaalsContact O-CG2 3.24Å; F69-V73 WeakPolarHBondContact O-CG2 3.24Å; F69-V73 PolarHBondContact O-N 3.05Å; V73-T76 WeakPolarHBondContact CA-OG1 3.37Å; V73-T76 PolarHBondContact O-N 2.78Å; V73-T76 PolarHBondContact O-OG1 3.28Å; V73-I77 HydrophobicContact CG1-CD1 3.55Å; V73-I77 HydrophobicContact CG1-CG1 4.25Å; V73-I77 WeakPolarHBondContact O-CB 3.23Å; V73-I77 WeakPolarHBondContact O-CG1 3.34Å; V73-I77 PolarHBondContact O-N 3Å
74F35.5Very low35.5Very low122 Ų12293.6 Ų93.654%0.53544%0.442SS..Hα-helixtrans-62.6-48173.8-175.5-96.1000111Y70 L71 T76 S78Y70-F74 WeakPolarHBondContact O-CB 3.4Å; Y70-F74 PolarHBondContact O-N 3.45Å; L71-F74 PolarHBondContact O-N 2.9Å; F74-T76 VanDerWaalsContact C-N 3.34Å; F74-T76 PolarHBondContact O-N 3.29Å; F74-S78 WeakPolarHBondContact O-CA 3.34Å; F74-S78 WeakPolarHBondContact O-CB 3.48Å; F74-S78 PolarHBondContact O-N 3.35Å; F74-S78 PolarHBondContact O-OG 2.88Å
75I35.1Very low35Very low83 Ų8389.9 Ų89.943%0.42643%0.433SS..Hα-helixtrans-62.5-39.1176.8-70.3163.3000111L71 L72 S78 S79L71-I75 HydrophobicContact CD2-CD1 4.04Å; L71-I75 HydrophobicContact CG-CD1 3.98Å; L71-I75 WeakPolarHBondContact O-CB 3.11Å; L71-I75 WeakPolarHBondContact O-CD1 3.31Å; L71-I75 WeakPolarHBondContact O-CG1 3.23Å; L71-I75 PolarHBondContact O-N 2.92Å; L72-I75 PolarHBondContact O-N 3.08Å; I75-S78 CarbonylContact O-C 3.53Å; I75-S79 WeakPolarHBondContact O-CA 3.31Å; I75-S79 WeakPolarHBondContact O-CB 3.21Å; I75-S79 PolarHBondContact O-N 3.1Å; I75-S79 PolarHBondContact O-OG 3.22Å
76T29.7Very low34.7Very low49 Ų4990 Ų9030%0.30143%0.433SS..Hα-helixtrans-72.8-44.1180440000112.5L12 L72 V73 F74 S78 S79 R80L12-T76 HydrophobicContact CD2-CG2 3.96Å; L72-T76 WeakPolarHBondContact O-CB 3.18Å; L72-T76 WeakPolarHBondContact O-CG2 3.44Å; L72-T76 PolarHBondContact O-N 2.82Å; L72-T76 PolarHBondContact O-OG1 3.34Å; V73-T76 WeakPolarHBondContact CA-OG1 3.37Å; V73-T76 PolarHBondContact O-N 2.78Å; V73-T76 PolarHBondContact O-OG1 3.28Å; F74-T76 VanDerWaalsContact C-N 3.34Å; F74-T76 PolarHBondContact O-N 3.29Å; T76-S78 VanDerWaalsContact C-N 3.3Å; T76-S78 PolarHBondContact O-N 3.13Å; T76-S79 WeakPolarHBondContact CA-OG 3.35Å; T76-S79 PolarHBondContact O-N 3.25Å; T76-S79 PolarHBondContact O-OG 3.35Å; T76-R80 PolarHBondContact O-N 3.24Å
77I31.3Very low34.3Very low110 Ų11091 Ų9156%0.56444%0.439SS*.Hα-helixtrans-61.9-43172.1-66.3169.9000109.8V73 S79 R80 S81V73-I77 HydrophobicContact CG1-CD1 3.55Å; V73-I77 HydrophobicContact CG1-CG1 4.25Å; V73-I77 WeakPolarHBondContact O-CB 3.23Å; V73-I77 WeakPolarHBondContact O-CG1 3.34Å; V73-I77 PolarHBondContact O-N 3Å; I77-S79 PolarHBondContact O-N 3.4Å; I77-R80 PolarHBondContact O-N 3.48Å; I77-S81 PolarHBondContact O-N 2.95Å; I77-S81 PolarHBondContact O-OG 3.02Å
78S30.3Very low33.9Very low18 Ų1890.2 Ų90.213%0.12644%0.439CS..Hα-helixtrans-62.9-39.3174.9-63.20000112.2F74 I75 T76 R80 I82F74-S78 WeakPolarHBondContact O-CA 3.34Å; F74-S78 WeakPolarHBondContact O-CB 3.48Å; F74-S78 PolarHBondContact O-N 3.35Å; F74-S78 PolarHBondContact O-OG 2.88Å; I75-S78 CarbonylContact O-C 3.53Å; T76-S78 VanDerWaalsContact C-N 3.3Å; T76-S78 PolarHBondContact O-N 3.13Å; S78-R80 VanDerWaalsContact C-N 3.29Å; S78-R80 PolarHBondContact O-N 2.72Å; S78-I82 VanDerWaalsContact CA-CD1 3.44Å; S78-I82 VanDerWaalsContact CB-CD1 3.42Å; S78-I82 VanDerWaalsContact O-CA 3.22Å; S78-I82 WeakPolarHBondContact O-CA 3.49Å; S78-I82 WeakPolarHBondContact O-CB 3.24Å; S78-I82 WeakPolarHBondContact O-CG1 3.42Å; S78-I82 PolarHBondContact O-N 3.48Å
79S31.3Very low33.5Very low50 Ų5087.9 Ų87.935%0.3543%0.434SS..Hα-helixtrans-71.3-23.7-177.367.90000113.2I75 T76 I77I75-S79 WeakPolarHBondContact O-CA 3.31Å; I75-S79 WeakPolarHBondContact O-CB 3.21Å; I75-S79 PolarHBondContact O-N 3.1Å; I75-S79 PolarHBondContact O-OG 3.22Å; T76-S79 WeakPolarHBondContact CA-OG 3.35Å; T76-S79 PolarHBondContact O-N 3.25Å; T76-S79 PolarHBondContact O-OG 3.35Å; I77-S79 PolarHBondContact O-N 3.4Å
80R31.8Very low33.4Very low236 Ų23689.5 Ų89.589%0.89145%0.446SS*.Hα-helixtrans-91.9-33-178.6-83.5-175171.9178.1-2.2114.3T76 I77 S78T76-R80 PolarHBondContact O-N 3.24Å; I77-R80 PolarHBondContact O-N 3.48Å; S78-R80 VanDerWaalsContact C-N 3.29Å; S78-R80 PolarHBondContact O-N 2.72Å
81S33Very low33.1Very low73 Ų7392.7 Ų92.751%0.5146%0.458SS..Hα-helixtrans-97-26.7174.563.80000113.1I77I77-S81 PolarHBondContact O-N 2.95Å; I77-S81 PolarHBondContact O-OG 3.02Å
82I33.1Very low32.8Very low45 Ų4595.4 Ų95.423%0.23147%0.472CS..Hα-helixtrans-100.22.7-170.8-34.6176.9000112S78 S84 D85 I86S78-I82 VanDerWaalsContact CA-CD1 3.44Å; S78-I82 VanDerWaalsContact CB-CD1 3.42Å; S78-I82 VanDerWaalsContact O-CA 3.22Å; S78-I82 WeakPolarHBondContact O-CA 3.49Å; S78-I82 WeakPolarHBondContact O-CB 3.24Å; S78-I82 WeakPolarHBondContact O-CG1 3.42Å; S78-I82 PolarHBondContact O-N 3.48Å; I82-S84 VanDerWaalsContact C-N 3.35Å; I82-S84 PolarHBondContact O-N 3.19Å; I82-D85 HydrophobicContact CG2-CB 4.03Å; I82-D85 PolarHBondContact O-N 2.6Å; I82-I86 HydrophobicContact CB-CD1 3.59Å; I82-I86 HydrophobicContact CB-CG1 4.11Å; I82-I86 HydrophobicContact CG2-CB 4.1Å; I82-I86 HydrophobicContact CG2-CD1 3.34Å; I82-I86 HydrophobicContact CG2-CG1 3.3Å; I82-I86 WeakPolarHBondContact O-CA 3.39Å; I82-I86 WeakPolarHBondContact O-CB 3.45Å; I82-I86 WeakPolarHBondContact O-CD1 3.15Å; I82-I86 WeakPolarHBondContact O-CG1 3.16Å; I82-I86 PolarHBondContact O-N 2.85Å
83Y29.2Very low32.2Very low168 Ų16895.3 Ų95.366%0.65949%0.487SS*.Hα-helixtrans-65.5-39.2171.6-161.3-95.1000111.9C87Y83-C87 VanDerWaalsContact O-CB 3.25Å; Y83-C87 WeakPolarHBondContact O-CB 3.37Å; Y83-C87 PolarHBondContact O-N 3.32Å; Y83-C87 PolarHBondContact O-SG 2.87Å
84S33.8Very low31.9Very low64 Ų6497.8 Ų97.845%0.44850%0.497SS..Hα-helixtrans-66.2-44.5170.4157.30000111.5I82 K88I82-S84 VanDerWaalsContact C-N 3.35Å; I82-S84 PolarHBondContact O-N 3.19Å; S84-K88 WeakPolarHBondContact O-CG 3.37Å; S84-K88 PolarHBondContact O-N 3.37Å
85D34.1Very low31.5Very low70 Ų7097.5 Ų97.537%0.37451%0.506SS..Hα-helixtrans-86.7-27.4-169.4-66.9-13.3000113.5I82 K88 L89I82-D85 HydrophobicContact CG2-CB 4.03Å; I82-D85 PolarHBondContact O-N 2.6Å; D85-K88 CarbonylContact O-C 3.55Å; D85-K88 PolarHBondContact O-N 3.2Å; D85-L89 WeakPolarHBondContact O-CB 3.3Å; D85-L89 WeakPolarHBondContact O-CD1 3.49Å; D85-L89 WeakPolarHBondContact O-CG 3.41Å; D85-L89 PolarHBondContact O-N 3.31Å
86I32.5Very low31Very low75 Ų7598.8 Ų98.839%0.38552%0.521SS..Hα-helixtrans-71.1-39.5167-80.1148.2000109I82 K88 L89 I90I82-I86 HydrophobicContact CB-CD1 3.59Å; I82-I86 HydrophobicContact CB-CG1 4.11Å; I82-I86 HydrophobicContact CG2-CB 4.1Å; I82-I86 HydrophobicContact CG2-CD1 3.34Å; I82-I86 HydrophobicContact CG2-CG1 3.3Å; I82-I86 WeakPolarHBondContact O-CA 3.39Å; I82-I86 WeakPolarHBondContact O-CB 3.45Å; I82-I86 WeakPolarHBondContact O-CD1 3.15Å; I82-I86 WeakPolarHBondContact O-CG1 3.16Å; I82-I86 PolarHBondContact O-N 2.85Å; I86-K88 VanDerWaalsContact C-N 3.32Å; I86-K88 PolarHBondContact O-N 2.79Å; I86-L89 PolarHBondContact O-N 3.32Å; I86-I90 HydrophobicContact CG2-CD1 3.38Å; I86-I90 HydrophobicContact CG2-CG1 3.96Å; I86-I90 WeakPolarHBondContact O-CB 3.19Å; I86-I90 WeakPolarHBondContact O-CG1 3.43Å; I86-I90 PolarHBondContact O-N 3.44Å
87C31.3Very low30.8Very low62 Ų62105.3 Ų105.342%0.41955%0.545SS..Hα-helixtrans-60.2-44.3170.9-78.20000110.5Y83 Y91Y83-C87 VanDerWaalsContact O-CB 3.25Å; Y83-C87 WeakPolarHBondContact O-CB 3.37Å; Y83-C87 PolarHBondContact O-N 3.32Å; Y83-C87 PolarHBondContact O-SG 2.87Å; C87-Y91 VanDerWaalsContact O-CB 3.26Å; C87-Y91 WeakPolarHBondContact O-CB 3.38Å; C87-Y91 PolarHBondContact O-N 3.32Å
88K32.5Very low30.8Very low124 Ų124104.9 Ų104.954%0.53955%0.547SS..Hα-helixtrans-65.3-39173.3-74173.3-179171.90113.6S84 D85 I86 Y91 L92S84-K88 WeakPolarHBondContact O-CG 3.37Å; S84-K88 PolarHBondContact O-N 3.37Å; D85-K88 CarbonylContact O-C 3.55Å; D85-K88 PolarHBondContact O-N 3.2Å; I86-K88 VanDerWaalsContact C-N 3.32Å; I86-K88 PolarHBondContact O-N 2.79Å; K88-Y91 CarbonylContact O-C 3.59Å; K88-Y91 PolarHBondContact O-N 2.94Å; K88-L92 VanDerWaalsContact O-CB 3.22Å; K88-L92 WeakPolarHBondContact O-CB 3.14Å; K88-L92 WeakPolarHBondContact O-CD1 3.33Å; K88-L92 VanDerWaalsContact O-CG 3.32Å; K88-L92 WeakPolarHBondContact O-CG 3.2Å; K88-L92 PolarHBondContact O-N 3.39Å
89L31.9Very low30.6Very low68 Ų68108.4 Ų108.436%0.35657%0.57SS.*Hα-helixtrans-70.9-35.1178.1-88152.5000112.6D85 I86 L92 G93 I94D85-L89 WeakPolarHBondContact O-CB 3.3Å; D85-L89 WeakPolarHBondContact O-CD1 3.49Å; D85-L89 WeakPolarHBondContact O-CG 3.41Å; D85-L89 PolarHBondContact O-N 3.31Å; I86-L89 PolarHBondContact O-N 3.32Å; L89-L92 PolarHBondContact O-N 3.49Å; L89-G93 PolarHBondContact O-N 2.98Å; L89-I94 HydrophobicContact CD2-CB 3.94Å; L89-I94 HydrophobicContact CD2-CD1 4.07Å; L89-I94 HydrophobicContact CD2-CG2 4.14Å; L89-I94 PolarHBondContact O-N 3.45Å
90I35.6Very low30.4Very low128 Ų128113.1 Ų113.166%0.65658%0.584SS**Hα-helixtrans-70.5-38.3170.5-68.2171.4000109.8I86 L92 G93I86-I90 HydrophobicContact CG2-CD1 3.38Å; I86-I90 HydrophobicContact CG2-CG1 3.96Å; I86-I90 WeakPolarHBondContact O-CB 3.19Å; I86-I90 WeakPolarHBondContact O-CG1 3.43Å; I86-I90 PolarHBondContact O-N 3.44Å; I90-L92 VanDerWaalsContact C-N 3.31Å; I90-L92 PolarHBondContact O-N 3.17Å; I90-G93 PolarHBondContact O-N 2.73Å
91Y31.2Very low30.3Very low221 Ų221105.1 Ų105.187%0.86756%0.562SS**Hα-helixtrans-68-28.6173.4-136.3-91.2000113C87 K88C87-Y91 VanDerWaalsContact O-CB 3.26Å; C87-Y91 WeakPolarHBondContact O-CB 3.38Å; C87-Y91 PolarHBondContact O-N 3.32Å; K88-Y91 CarbonylContact O-C 3.59Å; K88-Y91 PolarHBondContact O-N 2.94Å
92L34.1Very low30Very low126 Ų126107.6 Ų107.666%0.6657%0.569SS**THydrogen-bonded Turntrans-88.73.6178.1-82.1157.1000113.7K88 L89 I90 I94K88-L92 VanDerWaalsContact O-CB 3.22Å; K88-L92 WeakPolarHBondContact O-CB 3.14Å; K88-L92 WeakPolarHBondContact O-CD1 3.33Å; K88-L92 VanDerWaalsContact O-CG 3.32Å; K88-L92 WeakPolarHBondContact O-CG 3.2Å; K88-L92 PolarHBondContact O-N 3.39Å; L89-L92 PolarHBondContact O-N 3.49Å; I90-L92 VanDerWaalsContact C-N 3.31Å; I90-L92 PolarHBondContact O-N 3.17Å; L92-I94 VanDerWaalsContact C-N 3.25Å; L92-I94 HydrophobicContact CB-CD1 4.47Å; L92-I94 HydrophobicContact CB-CG1 4.5Å; L92-I94 PolarHBondContact O-N 3.2Å
93G24.6Very low29.8Very low62 Ų62108.3 Ų108.364%0.63958%0.578SS**THydrogen-bonded Turntrans70.113.2174.800000115.5L89 I90 T95L89-G93 PolarHBondContact O-N 2.98Å; I90-G93 PolarHBondContact O-N 2.73Å; G93-T95 PolarHBondContact O-N 3.41Å
94I27.9Very low30.1Very low100 Ų100103 Ų10351%0.51356%0.561SS.*  trans-88.792.4-178-58173.1000109.1L89 L92 C96L89-I94 HydrophobicContact CD2-CB 3.94Å; L89-I94 HydrophobicContact CD2-CD1 4.07Å; L89-I94 HydrophobicContact CD2-CG2 4.14Å; L89-I94 PolarHBondContact O-N 3.45Å; L92-I94 VanDerWaalsContact C-N 3.25Å; L92-I94 HydrophobicContact CB-CD1 4.47Å; L92-I94 HydrophobicContact CB-CG1 4.5Å; L92-I94 PolarHBondContact O-N 3.2Å; I94-C96 PolarHBondContact O-N 2.84Å; I94-C96 VanDerWaalsContact O-N 3.13Å
95T26.6Very low30Very low116 Ų116104.7 Ų104.771%0.71256%0.564SS**  trans-74.198.2167.157.30000109.6G93 K97G93-T95 PolarHBondContact O-N 3.41Å; T95-K97 VanDerWaalsContact C-N 3.25Å; T95-K97 PolarHBondContact O-N 2.89Å
96C26.1Very low29.9Very low110 Ų110106.8 Ų106.874%0.74357%0.571SS**  trans-6688.2162.2-92.10000109.1I94 V98I94-C96 PolarHBondContact O-N 2.84Å; I94-C96 VanDerWaalsContact O-N 3.13Å; C96-V98 PolarHBondContact O-N 3.48Å
97K25.2Very low30Very low186 Ų186107.3 Ų107.381%0.80957%0.574SS**  trans-68.184.9162.3-75.6-178.3179.3174.20107.7T95 P99T95-K97 VanDerWaalsContact C-N 3.25Å; T95-K97 PolarHBondContact O-N 2.89Å; K97-P99 WeakPolarHBondContact O-CD 3.33Å
98V30.1Very low30.2Very low100 Ų100108.5 Ų108.561%0.60657%0.572SS**  trans-61.6120.3157.6-177.80000105.3C96 F100C96-V98 PolarHBondContact O-N 3.48Å; V98-F100 HydrophobicContact CB-CD2 4.41Å; V98-F100 HydrophobicContact CG1-CD2 3.62Å; V98-F100 HydrophobicContact CG1-CE2 3.98Å; V98-F100 PolarHBondContact O-N 3.42Å
99P27.5Very low30.3Very low93 Ų93106.9 Ų106.960%0.60457%0.569SS**  trans-75.972.3179.132.2-32.4000108.5K97 T101 N104K97-P99 WeakPolarHBondContact O-CD 3.33Å; P99-T101 HydrophobicContact CB-CG2 4.29Å; P99-T101 PolarHBondContact O-N 2.79Å; P99-N104 PolarHBondContact O-ND2 3.39Å
100F27Very low30.3Very low148 Ų148111.2 Ų111.265%0.64958%0.581SS**  trans-76.370.2152.6-91.5-82.9000106.9V98V98-F100 HydrophobicContact CB-CD2 4.41Å; V98-F100 HydrophobicContact CG1-CD2 3.62Å; V98-F100 HydrophobicContact CG1-CE2 3.98Å; V98-F100 PolarHBondContact O-N 3.42Å
101T30.1Very low30.4Very low68 Ų68107 Ų10742%0.41756%0.56SS.*  trans-72.5139.8171.447.40000108.5P99 S103 N104P99-T101 HydrophobicContact CB-CG2 4.29Å; P99-T101 PolarHBondContact O-N 2.79Å; T101-S103 WeakPolarHBondContact CB-OG 3.16Å; T101-S103 PolarHBondContact O-N 3.3Å; T101-S103 PolarHBondContact OG1-OG 3.48Å; T101-N104 WeakPolarHBondContact O-CB 3.44Å; T101-N104 PolarHBondContact O-N 2.93Å
102L26.8Very low30.6Very low125 Ų125102 Ų10265%0.65454%0.54SS*.THydrogen-bonded Turntrans-45.8-31.1173.6-140.291.8000111.9N104 I105 E106L102-N104 PolarHBondContact O-N 2.8Å; L102-I105 PolarHBondContact O-N 3.3Å; L102-E106 PolarHBondContact O-N 3.41Å
103S28Very low30.6Very low60 Ų6099.2 Ų99.242%0.4253%0.529SS..Hα-helixtrans-55.4-29.6174.567.30000114.7T101 L107T101-S103 WeakPolarHBondContact CB-OG 3.16Å; T101-S103 PolarHBondContact O-N 3.3Å; T101-S103 PolarHBondContact OG1-OG 3.48Å; S103-L107 WeakPolarHBondContact O-CB 3.24Å; S103-L107 PolarHBondContact O-N 3Å
104N34.7Very low31Very low57 Ų5798.6 Ų98.631%0.30552%0.515SS..Hα-helixtrans-77-25.3177.7-79.1-32.7000113.1P99 T101 L102 F108 R145P99-N104 PolarHBondContact O-ND2 3.39Å; T101-N104 WeakPolarHBondContact O-CB 3.44Å; T101-N104 PolarHBondContact O-N 2.93Å; L102-N104 PolarHBondContact O-N 2.8Å; N104-F108 WeakPolarHBondContact O-CB 3.14Å; N104-F108 PolarHBondContact O-N 3.32Å; N104-R145 PolarHBondContact O-NH2 2.92Å
105I32.7Very low31.5Very low99 Ų9995 Ų9551%0.50850%0.498SS..Hα-helixtrans-82-42.5173-62.7173.4000108.9L102 F108 I109L102-I105 PolarHBondContact O-N 3.3Å; I105-F108 WeakPolarHBondContact O-CB 3.17Å; I105-F108 PolarHBondContact O-N 3.13Å; I105-I109 HydrophobicContact CG2-CD1 3.83Å; I105-I109 HydrophobicContact CG2-CG1 4.4Å; I105-I109 VanDerWaalsContact O-CG1 3.3Å; I105-I109 WeakPolarHBondContact O-CG1 3.38Å; I105-I109 PolarHBondContact O-N 3.28Å
106E30.9Very low31.9Very low115 Ų11593.4 Ų93.454%0.53748%0.484SS..Hα-helixtrans-61.7-43.5173.9-72.1176168.800112.1L102 F108 I109 Y110L102-E106 PolarHBondContact O-N 3.41Å; E106-F108 VanDerWaalsContact C-N 3.28Å; E106-F108 PolarHBondContact O-N 2.95Å; E106-I109 PolarHBondContact O-N 3.47Å; E106-Y110 WeakPolarHBondContact O-CB 3.4Å; E106-Y110 PolarHBondContact O-N 3.36Å
107L35.3Very low32.2Very low85 Ų8596.1 Ų96.145%0.44548%0.48SS..Hα-helixtrans-62.3-37.9174.7-167.781.8000111.3S103 I111S103-L107 WeakPolarHBondContact O-CB 3.24Å; S103-L107 PolarHBondContact O-N 3Å; L107-I111 HydrophobicContact CD1-CD1 4.48Å; L107-I111 HydrophobicContact CD2-CD1 4.24Å; L107-I111 HydrophobicContact CG-CD1 3.85Å; L107-I111 WeakPolarHBondContact O-CB 3.33Å; L107-I111 WeakPolarHBondContact O-CD1 3.38Å; L107-I111 WeakPolarHBondContact O-CG1 3.47Å; L107-I111 PolarHBondContact O-N 2.81Å
108F36.2Very low32.6Very low87 Ų8793.3 Ų93.338%0.38247%0.468SS..Hα-helixtrans-66.8-46.7176.2-176.8-88.5000111.6N104 I105 E106 Y110 I111 Y112 F138N104-F108 WeakPolarHBondContact O-CB 3.14Å; N104-F108 PolarHBondContact O-N 3.32Å; I105-F108 WeakPolarHBondContact O-CB 3.17Å; I105-F108 PolarHBondContact O-N 3.13Å; E106-F108 VanDerWaalsContact C-N 3.28Å; E106-F108 PolarHBondContact O-N 2.95Å; F108-Y110 VanDerWaalsContact C-N 3.35Å; F108-I111 PolarHBondContact O-N 3.44Å; F108-Y112 WeakPolarHBondContact O-CB 3.49Å; F108-Y112 PolarHBondContact O-N 2.87Å; F108-F138 HydrophobicContact CD2-CE2 4.36Å; F108-F138 HydrophobicContact CE2-CD2 4.42Å; F108-F138 AromaticContact CE2-CE2 3.38Å; F108-F138 HydrophobicContact CE2-CE2 3.38Å; F108-F138 AromaticContact CE2-CZ 3.95Å; F108-F138 HydrophobicContact CE2-CZ 3.95Å; F108-F138 AromaticContact CZ-CE2 3.83Å; F108-F138 HydrophobicContact CZ-CE2 3.83Å; F108-F138 HydrophobicContact CZ-CZ 4.35Å
109I33.4Very low33Very low91 Ų9189.9 Ų89.947%0.46745%0.446SS..Hα-helixtrans-61.9-45176.3-67.8168.3000109.8I105 E106 Y112 T113I105-I109 HydrophobicContact CG2-CD1 3.83Å; I105-I109 HydrophobicContact CG2-CG1 4.4Å; I105-I109 VanDerWaalsContact O-CG1 3.3Å; I105-I109 WeakPolarHBondContact O-CG1 3.38Å; I105-I109 PolarHBondContact O-N 3.28Å; E106-I109 PolarHBondContact O-N 3.47Å; I109-Y112 PolarHBondContact O-N 3.42Å; I109-T113 HydrophobicContact CG2-CG2 4.27Å; I109-T113 WeakPolarHBondContact O-CB 3.48Å; I109-T113 WeakPolarHBondContact O-CG2 3.36Å; I109-T113 PolarHBondContact O-N 3.36Å; I109-T113 PolarHBondContact O-OG1 2.94Å
110Y32.9Very low33.3Very low158 Ų15888.8 Ų88.862%0.6245%0.452SS*.Hα-helixtrans-62.7-44179.3-176.6-95.4000112.4E106 F108 T113 S114E106-Y110 WeakPolarHBondContact O-CB 3.4Å; E106-Y110 PolarHBondContact O-N 3.36Å; F108-Y110 VanDerWaalsContact C-N 3.35Å; Y110-T113 WeakPolarHBondContact CA-OG1 3.19Å; Y110-T113 PolarHBondContact O-OG1 2.77Å; Y110-T113 VanDerWaalsContact O-OG1 3.08Å; Y110-S114 WeakPolarHBondContact O-CB 3.47Å; Y110-S114 PolarHBondContact O-N 3.26Å; Y110-S114 PolarHBondContact O-OG 2.94Å
111I36.9Very low33.6Very low41 Ų4187.3 Ų87.321%0.2145%0.45CS..Hα-helixtrans-67.7-40.5176.3-68.4169.3000110.1L107 F108 S114 T115 I137 L141L107-I111 HydrophobicContact CD1-CD1 4.48Å; L107-I111 HydrophobicContact CD2-CD1 4.24Å; L107-I111 HydrophobicContact CG-CD1 3.85Å; L107-I111 WeakPolarHBondContact O-CB 3.33Å; L107-I111 WeakPolarHBondContact O-CD1 3.38Å; L107-I111 WeakPolarHBondContact O-CG1 3.47Å; L107-I111 PolarHBondContact O-N 2.81Å; F108-I111 PolarHBondContact O-N 3.44Å; I111-S114 PolarHBondContact O-N 3.49Å; I111-T115 HydrophobicContact CG2-CG2 4.41Å; I111-T115 WeakPolarHBondContact O-CB 3.33Å; I111-T115 WeakPolarHBondContact O-CG2 3.41Å; I111-T115 PolarHBondContact O-N 3.32Å; I111-T115 PolarHBondContact O-OG1 3.4Å; I111-I137 HydrophobicContact CG2-CG2 4.44Å; I111-L141 HydrophobicContact CD1-CD1 3.59Å; I111-L141 HydrophobicContact CG2-CD1 4.3Å
112Y36.5Very low33.9Very low114 Ų11486 Ų8645%0.44744%0.44SS..Hα-helixtrans-63.7-46176.1-179.5-102.7000112.6F108 I109 T115 L116F108-Y112 WeakPolarHBondContact O-CB 3.49Å; F108-Y112 PolarHBondContact O-N 2.87Å; I109-Y112 PolarHBondContact O-N 3.42Å; Y112-T115 WeakPolarHBondContact CA-OG1 3.31Å; Y112-T115 PolarHBondContact O-N 2.84Å; Y112-T115 PolarHBondContact O-OG1 3.19Å; Y112-L116 HydrophobicContact CD1-CD1 3.76Å; Y112-L116 HydrophobicContact CE1-CD1 3.26Å; Y112-L116 HydrophobicContact CE1-CG 4.32Å; Y112-L116 HydrophobicContact CE2-CD1 4.15Å; Y112-L116 HydrophobicContact CE2-CG 4.46Å; Y112-L116 HydrophobicContact CG-CD1 4.4Å; Y112-L116 VanDerWaalsContact CZ-CD1 3.48Å; Y112-L116 WeakPolarHBondContact O-CB 3.5Å; Y112-L116 WeakPolarHBondContact O-CG 3.49Å; Y112-L116 PolarHBondContact O-N 3.39Å
113T33.8Very low34.8Very low69 Ų6983 Ų8342%0.42343%0.429SS..Hα-helixtrans-68.3-38.5176.4510000111.6I109 Y110 Y117I109-T113 HydrophobicContact CG2-CG2 4.27Å; I109-T113 WeakPolarHBondContact O-CB 3.48Å; I109-T113 WeakPolarHBondContact O-CG2 3.36Å; I109-T113 PolarHBondContact O-N 3.36Å; I109-T113 PolarHBondContact O-OG1 2.94Å; Y110-T113 WeakPolarHBondContact CA-OG1 3.19Å; Y110-T113 PolarHBondContact O-OG1 2.77Å; Y110-T113 VanDerWaalsContact O-OG1 3.08Å; T113-Y117 WeakPolarHBondContact O-CB 3.17Å; T113-Y117 PolarHBondContact O-N 3.24Å
114S33.1Very low35.5Very low48 Ų4888.9 Ų88.934%0.33645%0.451SS..Hα-helixtrans-68.1-39.2177.2-60.20000111.7Y110 I111 Y117 F118Y110-S114 WeakPolarHBondContact O-CB 3.47Å; Y110-S114 PolarHBondContact O-N 3.26Å; Y110-S114 PolarHBondContact O-OG 2.94Å; I111-S114 PolarHBondContact O-N 3.49Å; S114-Y117 PolarHBondContact O-N 2.78Å; S114-F118 VanDerWaalsContact O-CB 3.31Å; S114-F118 WeakPolarHBondContact O-CB 3.38Å; S114-F118 PolarHBondContact O-N 3.26Å
115T38.1Very low35.8Very low26 Ų2695.5 Ų95.516%0.1648%0.477CS..Hα-helixtrans-69.4-43.1175.543.20000111.6I111 Y112 Y117 F118 L119 C134I111-T115 HydrophobicContact CG2-CG2 4.41Å; I111-T115 WeakPolarHBondContact O-CB 3.33Å; I111-T115 WeakPolarHBondContact O-CG2 3.41Å; I111-T115 PolarHBondContact O-N 3.32Å; I111-T115 PolarHBondContact O-OG1 3.4Å; Y112-T115 WeakPolarHBondContact CA-OG1 3.31Å; Y112-T115 PolarHBondContact O-N 2.84Å; Y112-T115 PolarHBondContact O-OG1 3.19Å; T115-Y117 VanDerWaalsContact C-N 3.34Å; T115-Y117 PolarHBondContact O-N 3.38Å; T115-F118 PolarHBondContact O-N 2.7Å; T115-L119 WeakPolarHBondContact O-CB 3.39Å; T115-L119 WeakPolarHBondContact O-CD1 3.42Å; T115-L119 PolarHBondContact O-N 2.77Å; T115-C134 WeakPolarHBondContact CB-SG 3.35Å; T115-C134 HydrophobicContact CG2-CB 3.74Å; T115-C134 WeakPolarHBondContact CG2-SG 3.22Å
116L35.7Very low36.2Very low82 Ų8295.8 Ų95.843%0.42948%0.476SS..Hα-helixtrans-61.2-40.1172.2-77.7175.2000112.9Y112 L119 G120Y112-L116 HydrophobicContact CD1-CD1 3.76Å; Y112-L116 HydrophobicContact CE1-CD1 3.26Å; Y112-L116 HydrophobicContact CE1-CG 4.32Å; Y112-L116 HydrophobicContact CE2-CD1 4.15Å; Y112-L116 HydrophobicContact CE2-CG 4.46Å; Y112-L116 HydrophobicContact CG-CD1 4.4Å; Y112-L116 VanDerWaalsContact CZ-CD1 3.48Å; Y112-L116 WeakPolarHBondContact O-CB 3.5Å; Y112-L116 WeakPolarHBondContact O-CG 3.49Å; Y112-L116 PolarHBondContact O-N 3.39Å; L116-L119 PolarHBondContact O-N 2.77Å; L116-G120 PolarHBondContact O-N 2.8Å
117Y31Very low36.6Very low167 Ų16791 Ų9166%0.65546%0.455SS*.Hα-helixtrans-65.2-41.5175.4-174.1-99.2000111.5T113 S114 T115 G120 L121T113-Y117 WeakPolarHBondContact O-CB 3.17Å; T113-Y117 PolarHBondContact O-N 3.24Å; S114-Y117 PolarHBondContact O-N 2.78Å; T115-Y117 VanDerWaalsContact C-N 3.34Å; T115-Y117 PolarHBondContact O-N 3.38Å; Y117-G120 PolarHBondContact O-N 2.8Å; Y117-L121 HydrophobicContact CD1-CD1 3.77Å; Y117-L121 HydrophobicContact CE1-CD1 3.44Å; Y117-L121 VanDerWaalsContact CE1-CD1 3.44Å; Y117-L121 HydrophobicContact CE1-CG 4.42Å; Y117-L121 PolarHBondContact O-N 2.87Å
118F33.8Very low36.9Very low127 Ų12789.2 Ų89.256%0.55745%0.448SS*.Hα-helixtrans-66.5-38.2175.2-151.8-91000112S114 T115 L121 L122S114-F118 VanDerWaalsContact O-CB 3.31Å; S114-F118 WeakPolarHBondContact O-CB 3.38Å; S114-F118 PolarHBondContact O-N 3.26Å; T115-F118 PolarHBondContact O-N 2.7Å; F118-L121 PolarHBondContact O-N 3.45Å; F118-L122 HydrophobicContact CD1-CD1 4.14Å; F118-L122 WeakPolarHBondContact O-CD1 3.41Å; F118-L122 WeakPolarHBondContact O-CG 3.35Å
119L39.2Very low37.1Very low27 Ų2789.9 Ų89.914%0.14145%0.451CS..Hα-helixtrans-63.5-38171.8-98.8115.6000112.7T115 L116 L121 L122 V131 C134T115-L119 WeakPolarHBondContact O-CB 3.39Å; T115-L119 WeakPolarHBondContact O-CD1 3.42Å; T115-L119 PolarHBondContact O-N 2.77Å; L116-L119 PolarHBondContact O-N 2.77Å; L119-L121 VanDerWaalsContact C-N 3.3Å; L119-L121 PolarHBondContact O-N 2.89Å; L119-L122 PolarHBondContact O-N 2.93Å; L119-V131 HydrophobicContact CD2-CB 4.49Å; L119-V131 HydrophobicContact CD2-CG2 3.41Å; L119-V131 VanDerWaalsContact CD2-CG2 3.41Å; L119-V131 HydrophobicContact CG-CG2 4.35Å; L119-C134 HydrophobicContact CD1-CB 4.12Å; L119-C134 VanDerWaalsContact CD1-SG 3.57Å
120G32.7Very low37.4Very low70 Ų7085.7 Ų85.772%0.72243%0.429SS*.Hα-helixtrans-72.6-19.4178.500000114.4L116 Y117L116-G120 PolarHBondContact O-N 2.8Å; Y117-G120 PolarHBondContact O-N 2.8Å
121L33Very low37.9Very low117 Ų11778.8 Ų78.861%0.61340%0.404SS*.THydrogen-bonded Turntrans-86.9-13.2176.7-79.7165.1000113.7Y117 F118 L119Y117-L121 HydrophobicContact CD1-CD1 3.77Å; Y117-L121 HydrophobicContact CE1-CD1 3.44Å; Y117-L121 VanDerWaalsContact CE1-CD1 3.44Å; Y117-L121 HydrophobicContact CE1-CG 4.42Å; Y117-L121 PolarHBondContact O-N 2.87Å; F118-L121 PolarHBondContact O-N 3.45Å; L119-L121 VanDerWaalsContact C-N 3.3Å; L119-L121 PolarHBondContact O-N 2.89Å
122L36.3Very low38.2Very low40 Ų4078.2 Ų78.221%0.20940%0.401CS..SBendtrans-86.2133.7-176.2-70.8160.6000110.4F118 L119 E126 G130F118-L122 HydrophobicContact CD1-CD1 4.14Å; F118-L122 WeakPolarHBondContact O-CD1 3.41Å; F118-L122 WeakPolarHBondContact O-CG 3.35Å; L119-L122 PolarHBondContact O-N 2.93Å; L122-E126 HydrophobicContact CB-CB 4.03Å; L122-E126 HydrophobicContact CD2-CB 3.61Å; L122-E126 HydrophobicContact CG-CB 4.39Å; L122-G130 VanDerWaalsContact CD1-CA 3.43Å
123S46.9Very low38.5Very low62 Ų6274.8 Ų74.843%0.43439%0.393SS..  trans-58.8156170.7680000110.4K125 E126 S127S123-K125 PolarHBondContact O-N 3.33Å; S123-E126 PolarHBondContact N-OE2 2.87Å; S123-E126 PolarHBondContact O-N 2.93Å; S123-E126 VanDerWaalsContact OG-CD 3.3Å; S123-E126 WeakPolarHBondContact OG-CG 3.16Å; S123-E126 PolarHBondContact OG-OE2 3.39Å; S123-S127 PolarHBondContact O-N 3.38Å
124E42.1Very low38.9Very low185 Ų18571.9 Ų71.986%0.86438%0.375SS*.THydrogen-bonded Turntrans-48.6-31.3-177.6-77.6-176.7155.200113.5S127E124-S127 PolarHBondContact O-OG 2.89Å
125K42Very low39.4Very low196 Ų19670.8 Ų70.885%0.85237%0.365SS*.THydrogen-bonded Turntrans-79.5-24.6178.5-64.6-177.7-179.5175.60114.3S123S123-K125 PolarHBondContact O-N 3.33Å
126E41.1Very low39.6Very low104 Ų10470.8 Ų70.849%0.48636%0.363SS..THydrogen-bonded Turntrans-98.1-14.4-179.9-62.3168.8144.200112.4L122 S123 V128 F129 G130L122-E126 HydrophobicContact CB-CB 4.03Å; L122-E126 HydrophobicContact CD2-CB 3.61Å; L122-E126 HydrophobicContact CG-CB 4.39Å; S123-E126 PolarHBondContact N-OE2 2.87Å; S123-E126 PolarHBondContact O-N 2.93Å; S123-E126 VanDerWaalsContact OG-CD 3.3Å; S123-E126 WeakPolarHBondContact OG-CG 3.16Å; S123-E126 PolarHBondContact OG-OE2 3.39Å; E126-V128 VanDerWaalsContact C-N 3.27Å; E126-V128 PolarHBondContact O-N 3.48Å; E126-F129 PolarHBondContact O-N 3.47Å; E126-F129 VanDerWaalsContact O-N 3.14Å; E126-G130 PolarHBondContact O-N 2.82Å; E126-G130 VanDerWaalsContact O-N 3.12Å
127S39.1Very low40Very low16 Ų1671.1 Ų71.111%0.11237%0.365CS..Hα-helixtrans-54.8-39.7178.669.60000112.8S123 E124 F129 G130 V131S123-S127 PolarHBondContact O-N 3.38Å; E124-S127 PolarHBondContact O-OG 2.89Å; S127-F129 PolarHBondContact O-N 2.85Å; S127-G130 PolarHBondContact O-N 3.11Å; S127-V131 WeakPolarHBondContact O-CG2 3.34Å; S127-V131 PolarHBondContact O-N 3.4Å
128V40.5Very low40.6Very low47 Ų4765.8 Ų65.829%0.28535%0.345SS..Hα-helixtrans-64.4-40.6179.9-173.70000111.6P52 E126 V131 I132 L190P52-V128 HydrophobicContact CB-CG2 4.28Å; P52-V128 HydrophobicContact CG-CG2 3.81Å; E126-V128 VanDerWaalsContact C-N 3.27Å; E126-V128 PolarHBondContact O-N 3.48Å; V128-V131 PolarHBondContact O-N 3.34Å; V128-I132 HydrophobicContact CG1-CD1 4.07Å; V128-I132 WeakPolarHBondContact O-CD1 3.47Å; V128-I132 VanDerWaalsContact O-CG1 3.26Å; V128-I132 WeakPolarHBondContact O-CG1 3.46Å; V128-I132 PolarHBondContact O-N 2.71Å; V128-I132 VanDerWaalsContact O-N 3.11Å; V128-L190 HydrophobicContact CG1-CD2 3.95Å
129F41.4Very low41.1Very low101 Ų10162.3 Ų62.344%0.44333%0.33SS..Hα-helixtrans-68.4-41.8177.9-171.8-100.3000111E126 S127 V131 I132 C133 T209E126-F129 PolarHBondContact O-N 3.47Å; E126-F129 VanDerWaalsContact O-N 3.14Å; S127-F129 PolarHBondContact O-N 2.85Å; F129-V131 PolarHBondContact O-N 2.71Å; F129-I132 PolarHBondContact O-N 3.49Å; F129-C133 VanDerWaalsContact CE1-SG 3.59Å; F129-C133 PolarHBondContact O-N 2.88Å; F129-C133 PolarHBondContact O-SG 3.35Å; F129-C133 VanDerWaalsContact O-SG 3.4Å; F129-T209 HydrophobicContact CE2-CG2 4.1Å; F129-T209 HydrophobicContact CZ-CG2 4.03Å
130G40Very low41.3Very low2 Ų264 Ų642%0.02134%0.344CS..Hα-helixtrans-58.7-46.1172.600000113.3L122 E126 S127 I132 C133 C134L122-G130 VanDerWaalsContact CD1-CA 3.43Å; E126-G130 PolarHBondContact O-N 2.82Å; E126-G130 VanDerWaalsContact O-N 3.12Å; S127-G130 PolarHBondContact O-N 3.11Å; G130-I132 VanDerWaalsContact C-N 3.3Å; G130-I132 PolarHBondContact O-N 3.03Å; G130-C133 PolarHBondContact O-N 3.45Å; G130-C134 WeakPolarHBondContact O-CB 3.48Å; G130-C134 PolarHBondContact O-N 2.92Å; G130-C134 PolarHBondContact O-SG 2.83Å
131V41.8Very low41.9Very low13 Ų1363.5 Ų63.58%0.07933%0.325CS..Hα-helixtrans-56.2-45.7175.8175.60000110.7F56 L119 S127 V128 F129 C134 F135F56-V131 HydrophobicContact CB-CG1 3.8Å; F56-V131 HydrophobicContact CD1-CG1 4.36Å; F56-V131 HydrophobicContact CD2-CG1 3.4Å; F56-V131 VanDerWaalsContact CD2-CG1 3.4Å; F56-V131 HydrophobicContact CE2-CG1 3.99Å; F56-V131 HydrophobicContact CG-CG1 3.61Å; L119-V131 HydrophobicContact CD2-CB 4.49Å; L119-V131 HydrophobicContact CD2-CG2 3.41Å; L119-V131 VanDerWaalsContact CD2-CG2 3.41Å; L119-V131 HydrophobicContact CG-CG2 4.35Å; S127-V131 WeakPolarHBondContact O-CG2 3.34Å; S127-V131 PolarHBondContact O-N 3.4Å; V128-V131 PolarHBondContact O-N 3.34Å; F129-V131 PolarHBondContact O-N 2.71Å; V131-C134 PolarHBondContact O-N 2.95Å; V131-F135 VanDerWaalsContact O-CB 3.29Å; V131-F135 WeakPolarHBondContact O-CB 3.37Å; V131-F135 PolarHBondContact O-N 3.4Å
132I44Very low42.4Very low30 Ų3060.4 Ų60.415%0.15431%0.312CS..Hα-helixtrans-67.1-42.6-179.4-67165.9000111.2V128 F129 G130 F135 L136 V186 L190V128-I132 HydrophobicContact CG1-CD1 4.07Å; V128-I132 WeakPolarHBondContact O-CD1 3.47Å; V128-I132 VanDerWaalsContact O-CG1 3.26Å; V128-I132 WeakPolarHBondContact O-CG1 3.46Å; V128-I132 PolarHBondContact O-N 2.71Å; V128-I132 VanDerWaalsContact O-N 3.11Å; F129-I132 PolarHBondContact O-N 3.49Å; G130-I132 VanDerWaalsContact C-N 3.3Å; G130-I132 PolarHBondContact O-N 3.03Å; I132-F135 WeakPolarHBondContact O-CB 3.21Å; I132-F135 PolarHBondContact O-N 2.83Å; I132-L136 HydrophobicContact CG2-CD1 4.32Å; I132-L136 WeakPolarHBondContact O-CB 3.44Å; I132-L136 WeakPolarHBondContact O-CG 3.45Å; I132-L136 PolarHBondContact O-N 2.91Å; I132-V186 HydrophobicContact CD1-CG1 4.13Å; I132-L190 HydrophobicContact CD1-CD1 3.25Å
133C42Very low42.9Very low41 Ų4160.4 Ų60.428%0.27731%0.312SS..Hα-helixtrans-64.1-38.3174.5-70.50000112.6F129 G130 L136 I137F129-C133 VanDerWaalsContact CE1-SG 3.59Å; F129-C133 PolarHBondContact O-N 2.88Å; F129-C133 PolarHBondContact O-SG 3.35Å; F129-C133 VanDerWaalsContact O-SG 3.4Å; G130-C133 PolarHBondContact O-N 3.45Å; C133-L136 WeakPolarHBondContact O-CB 3.12Å; C133-L136 PolarHBondContact O-N 2.89Å; C133-I137 WeakPolarHBondContact O-CG1 3.24Å; C133-I137 PolarHBondContact O-N 3.1Å
134C42.2Very low42.8Very low8 Ų864.8 Ų64.85%0.05432%0.32CS..Hα-helixtrans-68.6-40.1176.1-650000111.3T115 L119 G130 V131 L136 I137 F138T115-C134 WeakPolarHBondContact CB-SG 3.35Å; T115-C134 HydrophobicContact CG2-CB 3.74Å; T115-C134 WeakPolarHBondContact CG2-SG 3.22Å; L119-C134 HydrophobicContact CD1-CB 4.12Å; L119-C134 VanDerWaalsContact CD1-SG 3.57Å; G130-C134 WeakPolarHBondContact O-CB 3.48Å; G130-C134 PolarHBondContact O-N 2.92Å; G130-C134 PolarHBondContact O-SG 2.83Å; V131-C134 PolarHBondContact O-N 2.95Å; C134-L136 VanDerWaalsContact C-N 3.31Å; C134-L136 PolarHBondContact O-N 3.3Å; C134-I137 PolarHBondContact O-N 2.92Å; C134-F138 VanDerWaalsContact O-CB 3.31Å; C134-F138 WeakPolarHBondContact O-CB 3.33Å; C134-F138 PolarHBondContact O-N 3.23Å
135F43.5Very low43Very low25 Ų2560.7 Ų60.711%0.1130%0.297CS..Hα-helixtrans-61.4-41.2173.5-169.7-113.8000111.7F56 F59 V131 I132 F138 F139 Y179 W182F56-F135 HydrophobicContact CD2-CD2 4.42Å; F56-F135 HydrophobicContact CE2-CB 4.09Å; F56-F135 AromaticContact CE2-CD2 4Å; F56-F135 HydrophobicContact CE2-CD2 4Å; F59-F135 AromaticContact CD1-CE2 3.51Å; F59-F135 HydrophobicContact CD1-CE2 3.51Å; F59-F135 AromaticContact CD1-CZ 3.9Å; F59-F135 HydrophobicContact CD1-CZ 3.9Å; F59-F135 AromaticContact CE1-CE2 3.43Å; F59-F135 HydrophobicContact CE1-CE2 3.43Å; F59-F135 VanDerWaalsContact CE1-CE2 3.43Å; F59-F135 AromaticContact CE1-CZ 3.37Å; F59-F135 HydrophobicContact CE1-CZ 3.37Å; F59-F135 HydrophobicContact CZ-CE2 4.5Å; F59-F135 HydrophobicContact CZ-CZ 4.06Å; V131-F135 VanDerWaalsContact O-CB 3.29Å; V131-F135 WeakPolarHBondContact O-CB 3.37Å; V131-F135 PolarHBondContact O-N 3.4Å; I132-F135 WeakPolarHBondContact O-CB 3.21Å; I132-F135 PolarHBondContact O-N 2.83Å; F135-F138 PolarHBondContact O-N 3.46Å; F135-F139 VanDerWaalsContact O-CB 3.3Å; F135-F139 WeakPolarHBondContact O-CB 3.21Å; F135-F139 PolarHBondContact O-N 3.38Å; F135-Y179 WeakPolarHBondContact CD1-OH 3.42Å; F135-Y179 AromaticContact CE1-CE2 3.61Å; F135-Y179 HydrophobicContact CE1-CE2 3.61Å; F135-Y179 AromaticContact CE1-CZ 3.7Å; F135-Y179 WeakPolarHBondContact CE1-OH 3.41Å; F135-Y179 HydrophobicContact CZ-CE2 4.2Å; F135-W182 HydrophobicContact CE1-CZ3 4.19Å
136L43.5Very low43.1Very low26 Ų2655.1 Ų55.114%0.13628%0.282CS..Hα-helixtrans-58.8-53.8174-87.6170.1000112.7I132 C133 C134 F138 F139 S140 L183 F212I132-L136 HydrophobicContact CG2-CD1 4.32Å; I132-L136 WeakPolarHBondContact O-CB 3.44Å; I132-L136 WeakPolarHBondContact O-CG 3.45Å; I132-L136 PolarHBondContact O-N 2.91Å; C133-L136 WeakPolarHBondContact O-CB 3.12Å; C133-L136 PolarHBondContact O-N 2.89Å; C134-L136 VanDerWaalsContact C-N 3.31Å; C134-L136 PolarHBondContact O-N 3.3Å; L136-F138 VanDerWaalsContact C-N 3.31Å; L136-F138 PolarHBondContact O-N 3.16Å; L136-F139 PolarHBondContact O-N 3.15Å; L136-S140 WeakPolarHBondContact O-CB 3.36Å; L136-S140 PolarHBondContact O-N 3.5Å; L136-S140 PolarHBondContact O-OG 3.09Å; L136-L183 HydrophobicContact CD1-CD1 4.29Å; L136-L183 HydrophobicContact CD1-CD2 4.21Å; L136-L183 HydrophobicContact CD2-CD1 3.21Å; L136-L183 HydrophobicContact CD2-CD2 3.56Å; L136-L183 HydrophobicContact CD2-CG 3.94Å; L136-L183 HydrophobicContact CG-CD1 3.65Å; L136-L183 HydrophobicContact CG-CD2 4.3Å; L136-L183 HydrophobicContact CG-CG 4.47Å; L136-F212 HydrophobicContact CD1-CE1 4.44Å
137I43.3Very low43.3Very low89 Ų8953.8 Ų53.846%0.45628%0.28SS..Hα-helixtrans-59.9-45.2179.7-68.3166.6000110.2I111 C133 C134 F139 S140 L141I111-I137 HydrophobicContact CG2-CG2 4.44Å; C133-I137 WeakPolarHBondContact O-CG1 3.24Å; C133-I137 PolarHBondContact O-N 3.1Å; C134-I137 PolarHBondContact O-N 2.92Å; I137-F139 PolarHBondContact O-N 3.13Å; I137-S140 PolarHBondContact O-N 3.27Å; I137-L141 HydrophobicContact CG2-CD1 3.83Å; I137-L141 WeakPolarHBondContact O-CB 3.33Å; I137-L141 WeakPolarHBondContact O-CD1 3.2Å; I137-L141 VanDerWaalsContact O-CG 3.24Å; I137-L141 WeakPolarHBondContact O-CG 3.37Å; I137-L141 PolarHBondContact O-N 2.96Å
138F43.8Very low43.7Very low56 Ų5657 Ų5725%0.24630%0.296CS..Hα-helixtrans-60.9-46.1178.8-172.6-91.8000112.2L60 F108 C134 F135 L136 L141 C142L60-F138 HydrophobicContact CD2-CE2 4.42Å; L60-F138 HydrophobicContact CD2-CZ 4.2Å; F108-F138 HydrophobicContact CD2-CE2 4.36Å; F108-F138 HydrophobicContact CE2-CD2 4.42Å; F108-F138 AromaticContact CE2-CE2 3.38Å; F108-F138 HydrophobicContact CE2-CE2 3.38Å; F108-F138 AromaticContact CE2-CZ 3.95Å; F108-F138 HydrophobicContact CE2-CZ 3.95Å; F108-F138 AromaticContact CZ-CE2 3.83Å; F108-F138 HydrophobicContact CZ-CE2 3.83Å; F108-F138 HydrophobicContact CZ-CZ 4.35Å; C134-F138 VanDerWaalsContact O-CB 3.31Å; C134-F138 WeakPolarHBondContact O-CB 3.33Å; C134-F138 PolarHBondContact O-N 3.23Å; F135-F138 PolarHBondContact O-N 3.46Å; L136-F138 VanDerWaalsContact C-N 3.31Å; L136-F138 PolarHBondContact O-N 3.16Å; F138-L141 PolarHBondContact O-N 2.9Å; F138-C142 PolarHBondContact O-N 3.41Å; F138-C142 PolarHBondContact O-SG 3.02Å; F138-C142 VanDerWaalsContact O-SG 3.37Å
139F43.7Very low43.9Very low53 Ų5357.2 Ų57.223%0.23230%0.3CS..Hα-helixtrans-70.2-40.1-178.3-156.5-101.4000111.7F135 L136 I137 L141 C142 L143 Y176 Y179F135-F139 VanDerWaalsContact O-CB 3.3Å; F135-F139 WeakPolarHBondContact O-CB 3.21Å; F135-F139 PolarHBondContact O-N 3.38Å; L136-F139 PolarHBondContact O-N 3.15Å; I137-F139 PolarHBondContact O-N 3.13Å; F139-L141 VanDerWaalsContact C-N 3.3Å; F139-L141 PolarHBondContact O-N 3.39Å; F139-C142 PolarHBondContact O-N 2.73Å; F139-L143 HydrophobicContact CD1-CD1 3.45Å; F139-L143 VanDerWaalsContact CD1-CD1 3.45Å; F139-L143 HydrophobicContact CD1-CG 4.09Å; F139-L143 HydrophobicContact CE1-CD1 3.65Å; F139-L143 HydrophobicContact CE1-CD2 4.32Å; F139-L143 HydrophobicContact CE1-CG 4.09Å; F139-L143 HydrophobicContact CG-CD1 4.45Å; F139-L143 WeakPolarHBondContact O-CB 3.18Å; F139-L143 WeakPolarHBondContact O-CD1 3.34Å; F139-L143 VanDerWaalsContact O-CG 3.25Å; F139-L143 WeakPolarHBondContact O-CG 3.31Å; F139-L143 PolarHBondContact O-N 3.08Å; F139-Y176 HydrophobicContact CE1-CD2 4.26Å; F139-Y179 HydrophobicContact CB-CE1 4.37Å; F139-Y179 AromaticContact CD1-CD1 3.68Å; F139-Y179 HydrophobicContact CD1-CD1 3.68Å; F139-Y179 AromaticContact CD1-CE1 3.27Å; F139-Y179 HydrophobicContact CD1-CE1 3.27Å; F139-Y179 HydrophobicContact CD1-CE2 4.25Å; F139-Y179 HydrophobicContact CD1-CG 4.32Å; F139-Y179 AromaticContact CD1-CZ 3.58Å; F139-Y179 HydrophobicContact CD2-CE2 4.47Å; F139-Y179 AromaticContact CE1-CD1 3.51Å; F139-Y179 HydrophobicContact CE1-CD1 3.51Å; F139-Y179 HydrophobicContact CE1-CD2 4.13Å; F139-Y179 AromaticContact CE1-CE1 3.61Å; F139-Y179 HydrophobicContact CE1-CE1 3.61Å; F139-Y179 HydrophobicContact CE1-CE2 4.19Å; F139-Y179 AromaticContact CE1-CG 3.78Å; F139-Y179 HydrophobicContact CE1-CG 3.78Å; F139-Y179 AromaticContact CE1-CZ 3.94Å; F139-Y179 HydrophobicContact CE2-CE2 4.42Å; F139-Y179 AromaticContact CG-CE1 3.9Å; F139-Y179 HydrophobicContact CG-CE1 3.9Å; F139-Y179 HydrophobicContact CG-CE2 4.39Å; F139-Y179 AromaticContact CG-CZ 3.75Å; F139-Y179 HydrophobicContact CZ-CD1 4.36Å; F139-Y179 HydrophobicContact CZ-CD2 4.2Å; F139-Y179 HydrophobicContact CZ-CE1 4.47Å; F139-Y179 HydrophobicContact CZ-CE2 4.28Å; F139-Y179 HydrophobicContact CZ-CG 4.22Å
140S44.2Very low44.4Very low64 Ų6454.5 Ų54.545%0.44829%0.287SS..Hα-helixtrans-58.1-40.4171.7-640000112.3L136 I137 L143 Y144L136-S140 WeakPolarHBondContact O-CB 3.36Å; L136-S140 PolarHBondContact O-N 3.5Å; L136-S140 PolarHBondContact O-OG 3.09Å; I137-S140 PolarHBondContact O-N 3.27Å; S140-L143 PolarHBondContact O-N 2.93Å; S140-Y144 WeakPolarHBondContact O-CB 3.37Å; S140-Y144 PolarHBondContact O-N 2.95Å
141L45.1Very low44.7Very low59 Ų5960.5 Ų60.531%0.30931%0.312SS..Hα-helixtrans-69-41.6176.2-72.6163.8000112.5I111 I137 F138 F139 L143 Y144 R145I111-L141 HydrophobicContact CD1-CD1 3.59Å; I111-L141 HydrophobicContact CG2-CD1 4.3Å; I137-L141 HydrophobicContact CG2-CD1 3.83Å; I137-L141 WeakPolarHBondContact O-CB 3.33Å; I137-L141 WeakPolarHBondContact O-CD1 3.2Å; I137-L141 VanDerWaalsContact O-CG 3.24Å; I137-L141 WeakPolarHBondContact O-CG 3.37Å; I137-L141 PolarHBondContact O-N 2.96Å; F138-L141 PolarHBondContact O-N 2.9Å; F139-L141 VanDerWaalsContact C-N 3.3Å; F139-L141 PolarHBondContact O-N 3.39Å; L141-L143 VanDerWaalsContact C-N 3.31Å; L141-L143 PolarHBondContact O-N 3.42Å; L141-Y144 PolarHBondContact O-N 3.14Å; L141-R145 WeakPolarHBondContact O-CB 3.35Å; L141-R145 WeakPolarHBondContact O-CG 3.39Å; L141-R145 PolarHBondContact O-N 2.79Å
142C44.5Very low44.8Very low52 Ų5264.3 Ų64.335%0.35134%0.335SS..Hα-helixtrans-60.8-41.6174.4-74.90000111.6F138 F139 R145 C146F138-C142 PolarHBondContact O-N 3.41Å; F138-C142 PolarHBondContact O-SG 3.02Å; F138-C142 VanDerWaalsContact O-SG 3.37Å; F139-C142 PolarHBondContact O-N 2.73Å; C142-R145 WeakPolarHBondContact O-CB 3.31Å; C142-R145 PolarHBondContact O-N 3.24Å; C142-C146 PolarHBondContact O-N 3.34Å
143L46.1Very low44.7Very low40 Ų4065.6 Ų65.621%0.20934%0.342CS..Hα-helixtrans-69.3-42.1177-71.8162.8000112.5F139 S140 L141 R145 C146 V147 Y176F139-L143 HydrophobicContact CD1-CD1 3.45Å; F139-L143 VanDerWaalsContact CD1-CD1 3.45Å; F139-L143 HydrophobicContact CD1-CG 4.09Å; F139-L143 HydrophobicContact CE1-CD1 3.65Å; F139-L143 HydrophobicContact CE1-CD2 4.32Å; F139-L143 HydrophobicContact CE1-CG 4.09Å; F139-L143 HydrophobicContact CG-CD1 4.45Å; F139-L143 WeakPolarHBondContact O-CB 3.18Å; F139-L143 WeakPolarHBondContact O-CD1 3.34Å; F139-L143 VanDerWaalsContact O-CG 3.25Å; F139-L143 WeakPolarHBondContact O-CG 3.31Å; F139-L143 PolarHBondContact O-N 3.08Å; S140-L143 PolarHBondContact O-N 2.93Å; L141-L143 VanDerWaalsContact C-N 3.31Å; L141-L143 PolarHBondContact O-N 3.42Å; L143-R145 PolarHBondContact O-N 3.36Å; L143-C146 WeakPolarHBondContact O-CB 3.4Å; L143-C146 PolarHBondContact O-N 2.81Å; L143-C146 VanDerWaalsContact O-N 3.11Å; L143-V147 WeakPolarHBondContact O-CG2 3.25Å; L143-V147 PolarHBondContact O-N 3.49Å; L143-Y176 HydrophobicContact CD1-CD2 3.32Å; L143-Y176 HydrophobicContact CD1-CE2 3.02Å; L143-Y176 HydrophobicContact CD1-CG 4.37Å; L143-Y176 HydrophobicContact CD2-CD2 3.94Å; L143-Y176 HydrophobicContact CD2-CE2 4.41Å; L143-Y176 HydrophobicContact CD2-CG 4.38Å; L143-Y176 HydrophobicContact CG-CD2 4.27Å; L143-Y176 HydrophobicContact CG-CE2 4.29Å
144Y44.8Very low44.9Very low153 Ų15368.2 Ų68.260%0.635%0.346SS*.Hα-helixtrans-56.8-43.6172.3179.1-96.2000110.7S140 L141 V147 L148S140-Y144 WeakPolarHBondContact O-CB 3.37Å; S140-Y144 PolarHBondContact O-N 2.95Å; L141-Y144 PolarHBondContact O-N 3.14Å; Y144-V147 PolarHBondContact O-N 3.46Å; Y144-L148 HydrophobicContact CE1-CD2 4.43Å; Y144-L148 VanDerWaalsContact O-CB 3.23Å; Y144-L148 WeakPolarHBondContact O-CB 3.45Å; Y144-L148 PolarHBondContact O-N 2.77Å
145R45.9Very low45.1Very low99 Ų9974.6 Ų74.637%0.37438%0.379SS..Hα-helixtrans-63.7-40.9173.7-74.4-179.1174.6-171.9-0.7112.4N104 L141 C142 L143 L148 S149N104-R145 PolarHBondContact O-NH2 2.92Å; L141-R145 WeakPolarHBondContact O-CB 3.35Å; L141-R145 WeakPolarHBondContact O-CG 3.39Å; L141-R145 PolarHBondContact O-N 2.79Å; C142-R145 WeakPolarHBondContact O-CB 3.31Å; C142-R145 PolarHBondContact O-N 3.24Å; L143-R145 PolarHBondContact O-N 3.36Å; R145-L148 PolarHBondContact O-N 2.86Å; R145-S149 VanDerWaalsContact O-CB 3.26Å; R145-S149 WeakPolarHBondContact O-CB 3.34Å; R145-S149 PolarHBondContact O-N 3.48Å; R145-S149 PolarHBondContact O-OG 3.47Å
146C45.1Very low45.3Very low79 Ų7975.2 Ų75.253%0.53439%0.386SS..Hα-helixtrans-61.7-48.1174.1-86.10000111.9C142 L143 L148 S149 W150C142-C146 PolarHBondContact O-N 3.34Å; L143-C146 WeakPolarHBondContact O-CB 3.4Å; L143-C146 PolarHBondContact O-N 2.81Å; L143-C146 VanDerWaalsContact O-N 3.11Å; C146-L148 PolarHBondContact O-N 3.48Å; C146-S149 WeakPolarHBondContact CA-OG 3.34Å; C146-S149 PolarHBondContact O-N 3.46Å; C146-S149 PolarHBondContact O-OG 3.01Å; C146-W150 WeakPolarHBondContact O-CB 3.38Å; C146-W150 PolarHBondContact O-N 2.63Å
147V45.4Very low45.4Very low76 Ų7682.3 Ų82.346%0.46142%0.424SS..Hα-helixtrans-64.8-39.8178.1174.30000111.2L143 Y144 W150 K151L143-V147 WeakPolarHBondContact O-CG2 3.25Å; L143-V147 PolarHBondContact O-N 3.49Å; Y144-V147 PolarHBondContact O-N 3.46Å; V147-W150 PolarHBondContact O-N 2.83Å; V147-K151 WeakPolarHBondContact O-CG 3.47Å; V147-K151 PolarHBondContact O-N 3.2Å
148L45.9Very low45.5Very low83 Ų8382.5 Ų82.544%0.43543%0.426SS..Hα-helixtrans-65-46.4175.3-167.774.8000110.7Y144 R145 C146 W150 K151 V152Y144-L148 HydrophobicContact CE1-CD2 4.43Å; Y144-L148 VanDerWaalsContact O-CB 3.23Å; Y144-L148 WeakPolarHBondContact O-CB 3.45Å; Y144-L148 PolarHBondContact O-N 2.77Å; R145-L148 PolarHBondContact O-N 2.86Å; C146-L148 PolarHBondContact O-N 3.48Å; L148-W150 VanDerWaalsContact C-N 3.3Å; L148-W150 PolarHBondContact O-N 2.84Å; L148-K151 PolarHBondContact O-N 2.9Å; L148-V152 VanDerWaalsContact O-CG2 3.29Å; L148-V152 WeakPolarHBondContact O-CG2 3.49Å; L148-V152 PolarHBondContact O-N 2.97Å
149S46.5Very low45.7Very low52 Ų5286.2 Ų86.236%0.36444%0.444SS..Hα-helixtrans-61.4-39.5175.670.80000111.3R145 C146 V152 L153R145-S149 VanDerWaalsContact O-CB 3.26Å; R145-S149 WeakPolarHBondContact O-CB 3.34Å; R145-S149 PolarHBondContact O-N 3.48Å; R145-S149 PolarHBondContact O-OG 3.47Å; C146-S149 WeakPolarHBondContact CA-OG 3.34Å; C146-S149 PolarHBondContact O-N 3.46Å; C146-S149 PolarHBondContact O-OG 3.01Å; S149-V152 PolarHBondContact O-N 2.86Å; S149-L153 WeakPolarHBondContact O-CB 3.41Å; S149-L153 VanDerWaalsContact O-CD1 3.24Å; S149-L153 WeakPolarHBondContact O-CD1 3.29Å; S149-L153 WeakPolarHBondContact O-CG 3.27Å; S149-L153 PolarHBondContact O-N 3.37Å
150W50.1Low45.4Very low45 Ų4590.8 Ų90.817%0.1746%0.464CS..Hα-helixtrans-62.5-45.6174177.184.3000111.6C146 V147 L148 V152 L153 R154 L165 L169C146-W150 WeakPolarHBondContact O-CB 3.38Å; C146-W150 PolarHBondContact O-N 2.63Å; V147-W150 PolarHBondContact O-N 2.83Å; L148-W150 VanDerWaalsContact C-N 3.3Å; L148-W150 PolarHBondContact O-N 2.84Å; W150-V152 VanDerWaalsContact C-N 3.35Å; W150-V152 PolarHBondContact O-N 3.47Å; W150-L153 PolarHBondContact O-N 2.97Å; W150-R154 VanDerWaalsContact O-CB 3.24Å; W150-R154 WeakPolarHBondContact O-CB 3.21Å; W150-R154 PolarHBondContact O-N 2.91Å; W150-L165 HydrophobicContact CB-CD2 4.39Å; W150-L165 VanDerWaalsContact CD1-CD2 3.5Å; W150-L165 HydrophobicContact CG-CD2 4.3Å; W150-L169 HydrophobicContact CD2-CD1 4.27Å; W150-L169 HydrophobicContact CG-CD1 4.14Å; W150-L169 HydrophobicContact CH2-CD2 4.26Å; W150-L169 HydrophobicContact CZ2-CD2 3.54Å
151K48.3Very low45.2Very low127 Ų12790.1 Ų90.155%0.55246%0.455SS*.Hα-helixtrans-59.9-44174.7-77.3-175.5177.7-177.10111.9V147 L148 L155V147-K151 WeakPolarHBondContact O-CG 3.47Å; V147-K151 PolarHBondContact O-N 3.2Å; L148-K151 PolarHBondContact O-N 2.9Å; K151-L155 WeakPolarHBondContact O-CG 3.38Å; K151-L155 PolarHBondContact O-N 2.9Å
152V42Very low45.3Very low94 Ų9492.6 Ų92.657%0.5746%0.461SS*.Hα-helixtrans-67.5-40.4178.3174.10000111.3L148 S149 W150 L155L148-V152 VanDerWaalsContact O-CG2 3.29Å; L148-V152 WeakPolarHBondContact O-CG2 3.49Å; L148-V152 PolarHBondContact O-N 2.97Å; S149-V152 PolarHBondContact O-N 2.86Å; W150-V152 VanDerWaalsContact C-N 3.35Å; W150-V152 PolarHBondContact O-N 3.47Å; V152-L155 WeakPolarHBondContact O-CB 3.34Å; V152-L155 PolarHBondContact O-N 3.41Å
153L42.5Very low45.2Very low56 Ų5695 Ų9529%0.29347%0.47SS..Hα-helixtrans-74.8-27.8179.7-70.2158.7000112.1S149 W150 L155 S156 L161 L165S149-L153 WeakPolarHBondContact O-CB 3.41Å; S149-L153 VanDerWaalsContact O-CD1 3.24Å; S149-L153 WeakPolarHBondContact O-CD1 3.29Å; S149-L153 WeakPolarHBondContact O-CG 3.27Å; S149-L153 PolarHBondContact O-N 3.37Å; W150-L153 PolarHBondContact O-N 2.97Å; L153-L155 PolarHBondContact O-N 3.26Å; L153-S156 WeakPolarHBondContact O-CB 3.45Å; L153-S156 PolarHBondContact O-N 3.29Å; L153-S156 PolarHBondContact O-OG 3.32Å; L153-L161 HydrophobicContact CB-CD2 3.77Å; L153-L161 HydrophobicContact CD2-CD2 3.48Å; L153-L161 VanDerWaalsContact CD2-CD2 3.48Å; L153-L161 HydrophobicContact CG-CD2 4.15Å; L153-L165 HydrophobicContact CB-CD1 3.51Å; L153-L165 HydrophobicContact CB-CD2 4.4Å; L153-L165 HydrophobicContact CD1-CD1 4.14Å; L153-L165 HydrophobicContact CD1-CD2 4.21Å; L153-L165 HydrophobicContact CG-CD1 4.31Å
154R47Very low44.9Very low96 Ų9697 Ų9736%0.36248%0.48SS..Hα-helixtrans-71.2-21.3172.8-164.7174.3-171.5-173.42.2113W150 S156 R162W150-R154 VanDerWaalsContact O-CB 3.24Å; W150-R154 WeakPolarHBondContact O-CB 3.21Å; W150-R154 PolarHBondContact O-N 2.91Å; R154-S156 VanDerWaalsContact C-N 3.25Å; R154-R162 HydrophobicContact CG-CG 4.47Å; R154-R162 PolarHBondContact O-NE 3.49Å; R154-R162 PolarHBondContact O-NH2 2.88Å
155L45.8Very low45.1Very low143 Ų14391.6 Ų91.675%0.74946%0.461SS*.THydrogen-bonded Turntrans-78.6-7.1168-67.5165.2000112.5K151 V152 L153K151-L155 WeakPolarHBondContact O-CG 3.38Å; K151-L155 PolarHBondContact O-N 2.9Å; V152-L155 WeakPolarHBondContact O-CB 3.34Å; V152-L155 PolarHBondContact O-N 3.41Å; L153-L155 PolarHBondContact O-N 3.26Å
156S47.7Very low45.1Very low37 Ų3789.4 Ų89.426%0.25946%0.457SS..SBendtrans-71.6137.8172.679.40000110.6L153 R154 N158L153-S156 WeakPolarHBondContact O-CB 3.45Å; L153-S156 PolarHBondContact O-N 3.29Å; L153-S156 PolarHBondContact O-OG 3.32Å; R154-S156 VanDerWaalsContact C-N 3.25Å; S156-N158 PolarHBondContact O-N 3.01Å
157N44.9Very low44.7Very low175 Ų17589.2 Ų89.294%0.93646%0.461SS*.SBendtrans-71.38.9175.7-80.6-10.7000113.5
158N46.7Very low44.6Very low93 Ų9392.8 Ų92.850%0.49747%0.466SS..  trans-99.4105.7-170.6-148.6-28.9000111S156 F160 L161 R162S156-N158 PolarHBondContact O-N 3.01Å; N158-F160 VanDerWaalsContact C-N 3.31Å; N158-F160 PolarHBondContact O-N 3.01Å; N158-L161 HydrophobicContact CB-CB 4.08Å; N158-L161 WeakPolarHBondContact O-CB 3.26Å; N158-L161 PolarHBondContact O-N 3.48Å; N158-L161 VanDerWaalsContact O-N 3.14Å; N158-R162 PolarHBondContact O-N 3.02Å; N158-R162 VanDerWaalsContact O-N 3.08Å
159H47.6Very low44.5Very low135 Ų13590.4 Ų90.463%0.62545%0.454SS*.Hα-helixtrans-63.1-34.9-172.3-160.7-65.8000113L161 R162 L163H159-L161 VanDerWaalsContact C-N 3.32Å; H159-L161 PolarHBondContact O-N 3.39Å; H159-R162 WeakPolarHBondContact O-CB 3.38Å; H159-R162 PolarHBondContact O-N 2.97Å; H159-L163 WeakPolarHBondContact ND1-CD1 3.29Å; H159-L163 PolarHBondContact O-N 3.41Å
160F36.7Very low44.2Very low148 Ų14889.3 Ų89.365%0.64945%0.445SS*.Hα-helixtrans-64.1-40.2176.2-173.9-97.1000111.6N158 L163 L164N158-F160 VanDerWaalsContact C-N 3.31Å; N158-F160 PolarHBondContact O-N 3.01Å; F160-L163 PolarHBondContact O-N 2.89Å; F160-L164 HydrophobicContact CE1-CD1 4.03Å; F160-L164 HydrophobicContact CZ-CD1 4.16Å; F160-L164 WeakPolarHBondContact O-CB 3.43Å; F160-L164 PolarHBondContact O-N 2.91Å
161L41.6Very low43.7Very low50 Ų5089.6 Ų89.626%0.26246%0.457SS..Hα-helixtrans-66.7-42.7178-152.4121.3000109.9L153 N158 H159 L164 L165L153-L161 HydrophobicContact CB-CD2 3.77Å; L153-L161 HydrophobicContact CD2-CD2 3.48Å; L153-L161 VanDerWaalsContact CD2-CD2 3.48Å; L153-L161 HydrophobicContact CG-CD2 4.15Å; N158-L161 HydrophobicContact CB-CB 4.08Å; N158-L161 WeakPolarHBondContact O-CB 3.26Å; N158-L161 PolarHBondContact O-N 3.48Å; N158-L161 VanDerWaalsContact O-N 3.14Å; H159-L161 VanDerWaalsContact C-N 3.32Å; H159-L161 PolarHBondContact O-N 3.39Å; L161-L164 PolarHBondContact O-N 3.43Å; L161-L165 HydrophobicContact CD2-CD1 3.39Å; L161-L165 HydrophobicContact CG-CD1 3.97Å; L161-L165 VanDerWaalsContact O-CB 3.31Å; L161-L165 WeakPolarHBondContact O-CB 3.19Å; L161-L165 VanDerWaalsContact O-CD1 3.23Å; L161-L165 WeakPolarHBondContact O-CD1 3.23Å; L161-L165 PolarHBondContact O-N 3.1Å
162R46.9Very low43.5Very low112 Ų11287.2 Ų87.242%0.42346%0.456SS..Hα-helixtrans-58.3-49.2173.6-125.6178.9-157.7-174.25.1112.9R154 N158 H159 L164 L165 D166R154-R162 HydrophobicContact CG-CG 4.47Å; R154-R162 PolarHBondContact O-NE 3.49Å; R154-R162 PolarHBondContact O-NH2 2.88Å; N158-R162 PolarHBondContact O-N 3.02Å; N158-R162 VanDerWaalsContact O-N 3.08Å; H159-R162 WeakPolarHBondContact O-CB 3.38Å; H159-R162 PolarHBondContact O-N 2.97Å; R162-L164 PolarHBondContact O-N 3.31Å; R162-L165 PolarHBondContact O-N 3.22Å; R162-D166 WeakPolarHBondContact O-CB 3.3Å; R162-D166 VanDerWaalsContact O-CG 3.3Å; R162-D166 PolarHBondContact O-N 3.49Å
163L41.5Very low43.6Very low103 Ų10385.2 Ų85.254%0.53944%0.441SS..Hα-helixtrans-60.5-43.6177.2-97.4158.2000112.5H159 F160 L165 D166 A167H159-L163 WeakPolarHBondContact ND1-CD1 3.29Å; H159-L163 PolarHBondContact O-N 3.41Å; F160-L163 PolarHBondContact O-N 2.89Å; L163-L165 VanDerWaalsContact C-N 3.34Å; L163-D166 PolarHBondContact O-N 3.33Å; L163-A167 WeakPolarHBondContact O-CB 3.5Å; L163-A167 PolarHBondContact O-N 2.87Å
164L40.2Very low43.5Very low81 Ų8183.9 Ų83.942%0.42444%0.437SS..Hα-helixtrans-69.6-33.9179.9-157.2118.9000112.1F160 L161 R162 R168F160-L164 HydrophobicContact CE1-CD1 4.03Å; F160-L164 HydrophobicContact CZ-CD1 4.16Å; F160-L164 WeakPolarHBondContact O-CB 3.43Å; F160-L164 PolarHBondContact O-N 2.91Å; L161-L164 PolarHBondContact O-N 3.43Å; R162-L164 PolarHBondContact O-N 3.31Å; L164-R168 WeakPolarHBondContact O-CB 3.15Å; L164-R168 WeakPolarHBondContact O-CG 3.33Å; L164-R168 PolarHBondContact O-N 3.39Å
165L48.5Very low43.2Very low39 Ų3984.9 Ų84.920%0.20445%0.449CS..Hα-helixtrans-71.9-40.6173.1-86.9140.9000111.9W150 L153 L161 R162 L163 R168 L169W150-L165 HydrophobicContact CB-CD2 4.39Å; W150-L165 VanDerWaalsContact CD1-CD2 3.5Å; W150-L165 HydrophobicContact CG-CD2 4.3Å; L153-L165 HydrophobicContact CB-CD1 3.51Å; L153-L165 HydrophobicContact CB-CD2 4.4Å; L153-L165 HydrophobicContact CD1-CD1 4.14Å; L153-L165 HydrophobicContact CD1-CD2 4.21Å; L153-L165 HydrophobicContact CG-CD1 4.31Å; L161-L165 HydrophobicContact CD2-CD1 3.39Å; L161-L165 HydrophobicContact CG-CD1 3.97Å; L161-L165 VanDerWaalsContact O-CB 3.31Å; L161-L165 WeakPolarHBondContact O-CB 3.19Å; L161-L165 VanDerWaalsContact O-CD1 3.23Å; L161-L165 WeakPolarHBondContact O-CD1 3.23Å; L161-L165 PolarHBondContact O-N 3.1Å; R162-L165 PolarHBondContact O-N 3.22Å; L163-L165 VanDerWaalsContact C-N 3.34Å; L165-R168 PolarHBondContact O-N 2.84Å; L165-L169 WeakPolarHBondContact O-CB 3.18Å; L165-L169 PolarHBondContact O-N 3.27Å
166D45.4Very low43.3Very low54 Ų5481.7 Ų81.729%0.28943%0.428SS..Hα-helixtrans-70.1-33.3178.2-75.1-25.6000112R162 L163 P170R162-D166 WeakPolarHBondContact O-CB 3.3Å; R162-D166 VanDerWaalsContact O-CG 3.3Å; R162-D166 PolarHBondContact O-N 3.49Å; L163-D166 PolarHBondContact O-N 3.33Å; D166-P170 WeakPolarHBondContact O-CD 3.45Å
167A37.8Very low43.1Very low75 Ų7580.7 Ų80.762%0.6242%0.423SS*.Hα-helixtrans-73.5-29.8175.600000113.6L163L163-A167 WeakPolarHBondContact O-CB 3.5Å; L163-A167 PolarHBondContact O-N 2.87Å
168R42.4Very low43Very low151 Ų15175.9 Ų75.957%0.5740%0.397SS*.Hα-helixtrans-94.8-20-177.2-69.3-170177.8-166.80.9114.1L164 L165 A171 C172L164-R168 WeakPolarHBondContact O-CB 3.15Å; L164-R168 WeakPolarHBondContact O-CG 3.33Å; L164-R168 PolarHBondContact O-N 3.39Å; L165-R168 PolarHBondContact O-N 2.84Å; R168-A171 PolarHBondContact O-N 2.92Å; R168-C172 PolarHBondContact O-N 2.84Å; R168-C172 PolarHBondContact O-SG 2.84Å
169L44.9Very low42.9Very low32 Ų3273 Ų7317%0.16838%0.379CS..Hα-helixtrans-58.3-42.4178.6-167.874.8000113.4W150 L165 A171 C172 L173 Y238W150-L169 HydrophobicContact CD2-CD1 4.27Å; W150-L169 HydrophobicContact CG-CD1 4.14Å; W150-L169 HydrophobicContact CH2-CD2 4.26Å; W150-L169 HydrophobicContact CZ2-CD2 3.54Å; L165-L169 WeakPolarHBondContact O-CB 3.18Å; L165-L169 PolarHBondContact O-N 3.27Å; L169-A171 VanDerWaalsContact C-N 3.32Å; L169-A171 PolarHBondContact O-N 3.16Å; L169-C172 PolarHBondContact O-N 2.89Å; L169-L173 HydrophobicContact CD2-CD1 4.32Å; L169-L173 HydrophobicContact CG-CD1 3.88Å; L169-L173 HydrophobicContact CG-CG 4.43Å; L169-L173 WeakPolarHBondContact O-CB 3.42Å; L169-L173 WeakPolarHBondContact O-CG 3.37Å; L169-L173 PolarHBondContact O-N 3.48Å; L169-Y238 HydrophobicContact CD2-CE1 4.34Å
170P39.2Very low42.9Very low30 Ų3067.4 Ų67.420%0.19535%0.354CS..Hα-helixtrans-60.9-39.8176.1-24.835.5000112.8D166 L173 S174 I241D166-P170 WeakPolarHBondContact O-CD 3.45Å; P170-L173 PolarHBondContact O-N 3.43Å; P170-S174 WeakPolarHBondContact O-CB 3.39Å; P170-S174 PolarHBondContact O-N 2.78Å; P170-S174 PolarHBondContact O-OG 3.3Å; P170-I241 HydrophobicContact CB-CD1 3.96Å; P170-I241 HydrophobicContact CG-CD1 4.21Å
171A40.2Very low43.2Very low50 Ų5061.9 Ų61.941%0.41333%0.332SS..Hα-helixtrans-70.8-38.6178.200000112.2R168 L169 S174 L175R168-A171 PolarHBondContact O-N 2.92Å; L169-A171 VanDerWaalsContact C-N 3.32Å; L169-A171 PolarHBondContact O-N 3.16Å; A171-S174 WeakPolarHBondContact CA-OG 3.44Å; A171-S174 PolarHBondContact O-N 2.93Å; A171-S174 PolarHBondContact O-OG 3.44Å; A171-L175 WeakPolarHBondContact O-CB 3.48Å; A171-L175 VanDerWaalsContact O-CG 3.26Å; A171-L175 WeakPolarHBondContact O-CG 3.05Å; A171-L175 PolarHBondContact O-N 3.47Å
172C43.3Very low43.4Very low78 Ų7865.4 Ų65.453%0.52734%0.342SS..Hα-helixtrans-67.2-39.2174.4-69.80000112R168 L169 Y176R168-C172 PolarHBondContact O-N 2.84Å; R168-C172 PolarHBondContact O-SG 2.84Å; L169-C172 PolarHBondContact O-N 2.89Å; C172-Y176 WeakPolarHBondContact O-CB 3.3Å; C172-Y176 PolarHBondContact O-N 3.45Å; C172-Y176 VanDerWaalsContact O-N 3.1Å
173L45.5Very low43.4Very low51 Ų5160.7 Ų60.727%0.26733%0.325SS..Hα-helixtrans-68.1-42.3174.6-73.7166.3000111.1L169 P170 Y176 G177 F245L169-L173 HydrophobicContact CD2-CD1 4.32Å; L169-L173 HydrophobicContact CG-CD1 3.88Å; L169-L173 HydrophobicContact CG-CG 4.43Å; L169-L173 WeakPolarHBondContact O-CB 3.42Å; L169-L173 WeakPolarHBondContact O-CG 3.37Å; L169-L173 PolarHBondContact O-N 3.48Å; P170-L173 PolarHBondContact O-N 3.43Å; L173-Y176 CarbonylContact O-C 3.58Å; L173-Y176 WeakPolarHBondContact O-CA 3.34Å; L173-Y176 VanDerWaalsContact O-CB 3.27Å; L173-Y176 WeakPolarHBondContact O-CB 3.22Å; L173-Y176 PolarHBondContact O-N 3.3Å; L173-G177 PolarHBondContact O-N 3.32Å; L173-F245 HydrophobicContact CB-CZ 4.3Å; L173-F245 VanDerWaalsContact O-CZ 3.23Å; L173-F245 WeakPolarHBondContact O-CZ 3.29Å
174S40.3Very low43.6Very low29 Ų2956.3 Ų56.320%0.20330%0.302CS..Hα-helixtrans-63.1-43178.373.10000112.5P170 A171 Y176 G177 L178P170-S174 WeakPolarHBondContact O-CB 3.39Å; P170-S174 PolarHBondContact O-N 2.78Å; P170-S174 PolarHBondContact O-OG 3.3Å; A171-S174 WeakPolarHBondContact CA-OG 3.44Å; A171-S174 PolarHBondContact O-N 2.93Å; A171-S174 PolarHBondContact O-OG 3.44Å; S174-Y176 PolarHBondContact O-N 3.05Å; S174-G177 PolarHBondContact O-N 3.44Å; S174-L178 PolarHBondContact O-N 2.85Å
175L41.2Very low43.8Very low117 Ų11754.3 Ų54.361%0.61330%0.295SS*.Hα-helixtrans-61.3-35171.6-72.8169.3000111.8A171 Y179A171-L175 WeakPolarHBondContact O-CB 3.48Å; A171-L175 VanDerWaalsContact O-CG 3.26Å; A171-L175 WeakPolarHBondContact O-CG 3.05Å; A171-L175 PolarHBondContact O-N 3.47Å; L175-Y179 WeakPolarHBondContact O-CB 3.37Å; L175-Y179 PolarHBondContact O-N 2.89Å
176Y46.1Very low43.6Very low76 Ų7654 Ų5430%0.29829%0.294SS..Hα-helixtrans-68.7-42.3174.7-179.7-120.1000112.7F139 L143 C172 L173 S174 Y179 I180F139-Y176 HydrophobicContact CE1-CD2 4.26Å; L143-Y176 HydrophobicContact CD1-CD2 3.32Å; L143-Y176 HydrophobicContact CD1-CE2 3.02Å; L143-Y176 HydrophobicContact CD1-CG 4.37Å; L143-Y176 HydrophobicContact CD2-CD2 3.94Å; L143-Y176 HydrophobicContact CD2-CE2 4.41Å; L143-Y176 HydrophobicContact CD2-CG 4.38Å; L143-Y176 HydrophobicContact CG-CD2 4.27Å; L143-Y176 HydrophobicContact CG-CE2 4.29Å; C172-Y176 WeakPolarHBondContact O-CB 3.3Å; C172-Y176 PolarHBondContact O-N 3.45Å; C172-Y176 VanDerWaalsContact O-N 3.1Å; L173-Y176 CarbonylContact O-C 3.58Å; L173-Y176 WeakPolarHBondContact O-CA 3.34Å; L173-Y176 VanDerWaalsContact O-CB 3.27Å; L173-Y176 WeakPolarHBondContact O-CB 3.22Å; L173-Y176 PolarHBondContact O-N 3.3Å; S174-Y176 PolarHBondContact O-N 3.05Å; Y176-Y179 WeakPolarHBondContact O-CB 3.31Å; Y176-Y179 PolarHBondContact O-N 3.04Å; Y176-I180 HydrophobicContact CD1-CD1 3.7Å; Y176-I180 HydrophobicContact CD2-CD1 4.11Å; Y176-I180 HydrophobicContact CD2-CG1 4.39Å; Y176-I180 HydrophobicContact CE1-CD1 3.33Å; Y176-I180 HydrophobicContact CE1-CG1 4.44Å; Y176-I180 HydrophobicContact CE2-CD1 3.72Å; Y176-I180 HydrophobicContact CE2-CG1 3.98Å; Y176-I180 HydrophobicContact CG-CD1 4.11Å; Y176-I180 WeakPolarHBondContact O-CG1 3.21Å; Y176-I180 PolarHBondContact O-N 2.95Å
177G44Very low43.6Very low15 Ų1552.9 Ų52.916%0.15529%0.291CS..Hα-helixtrans-59.3-48.5173.900000112.4L173 S174 Y179 I180 T181L173-G177 PolarHBondContact O-N 3.32Å; S174-G177 PolarHBondContact O-N 3.44Å; G177-Y179 VanDerWaalsContact C-N 3.3Å; G177-Y179 PolarHBondContact O-N 2.86Å; G177-I180 PolarHBondContact O-N 2.87Å; G177-T181 PolarHBondContact O-N 2.82Å; G177-T181 PolarHBondContact O-OG1 3.23Å
178L43.7Very low43.9Very low74 Ų7452.1 Ų52.139%0.38727%0.273SS..Hα-helixtrans-60.7-38.9175.1-77167.2000112.2S174 T181 W182 I292S174-L178 PolarHBondContact O-N 2.85Å; L178-T181 WeakPolarHBondContact CA-OG1 3.25Å; L178-T181 PolarHBondContact O-N 3.23Å; L178-T181 PolarHBondContact O-OG1 2.92Å; L178-W182 WeakPolarHBondContact O-CB 3.43Å; L178-W182 PolarHBondContact O-N 2.96Å; L178-I292 HydrophobicContact CD2-CG2 4.16Å
179Y44.3Very low43.9Very low34 Ų3449.6 Ų49.613%0.13326%0.264CS..Hα-helixtrans-66.4-41.4176.8176.3-93.9000112.2F135 F139 L175 Y176 G177 W182 L183F135-Y179 WeakPolarHBondContact CD1-OH 3.42Å; F135-Y179 AromaticContact CE1-CE2 3.61Å; F135-Y179 HydrophobicContact CE1-CE2 3.61Å; F135-Y179 AromaticContact CE1-CZ 3.7Å; F135-Y179 WeakPolarHBondContact CE1-OH 3.41Å; F135-Y179 HydrophobicContact CZ-CE2 4.2Å; F139-Y179 HydrophobicContact CB-CE1 4.37Å; F139-Y179 AromaticContact CD1-CD1 3.68Å; F139-Y179 HydrophobicContact CD1-CD1 3.68Å; F139-Y179 AromaticContact CD1-CE1 3.27Å; F139-Y179 HydrophobicContact CD1-CE1 3.27Å; F139-Y179 HydrophobicContact CD1-CE2 4.25Å; F139-Y179 HydrophobicContact CD1-CG 4.32Å; F139-Y179 AromaticContact CD1-CZ 3.58Å; F139-Y179 HydrophobicContact CD2-CE2 4.47Å; F139-Y179 AromaticContact CE1-CD1 3.51Å; F139-Y179 HydrophobicContact CE1-CD1 3.51Å; F139-Y179 HydrophobicContact CE1-CD2 4.13Å; F139-Y179 AromaticContact CE1-CE1 3.61Å; F139-Y179 HydrophobicContact CE1-CE1 3.61Å; F139-Y179 HydrophobicContact CE1-CE2 4.19Å; F139-Y179 AromaticContact CE1-CG 3.78Å; F139-Y179 HydrophobicContact CE1-CG 3.78Å; F139-Y179 AromaticContact CE1-CZ 3.94Å; F139-Y179 HydrophobicContact CE2-CE2 4.42Å; F139-Y179 AromaticContact CG-CE1 3.9Å; F139-Y179 HydrophobicContact CG-CE1 3.9Å; F139-Y179 HydrophobicContact CG-CE2 4.39Å; F139-Y179 AromaticContact CG-CZ 3.75Å; F139-Y179 HydrophobicContact CZ-CD1 4.36Å; F139-Y179 HydrophobicContact CZ-CD2 4.2Å; F139-Y179 HydrophobicContact CZ-CE1 4.47Å; F139-Y179 HydrophobicContact CZ-CE2 4.28Å; F139-Y179 HydrophobicContact CZ-CG 4.22Å; L175-Y179 WeakPolarHBondContact O-CB 3.37Å; L175-Y179 PolarHBondContact O-N 2.89Å; Y176-Y179 WeakPolarHBondContact O-CB 3.31Å; Y176-Y179 PolarHBondContact O-N 3.04Å; G177-Y179 VanDerWaalsContact C-N 3.3Å; G177-Y179 PolarHBondContact O-N 2.86Å; Y179-W182 HydrophobicContact CD2-CE3 4.32Å; Y179-W182 HydrophobicContact CE2-CE3 4.21Å; Y179-W182 HydrophobicContact CE2-CZ3 4.19Å; Y179-W182 PolarHBondContact O-N 2.79Å; Y179-L183 HydrophobicContact CE1-CD1 4.06Å; Y179-L183 VanDerWaalsContact O-CB 3.24Å; Y179-L183 WeakPolarHBondContact O-CB 3.37Å; Y179-L183 PolarHBondContact O-N 2.83Å
180I46.5Very low43.9Very low17 Ų1750.2 Ų50.29%0.08727%0.268CS..Hα-helixtrans-63.3-44.3174.3-73.4159.2000110.7Y176 G177 W182 L183 L184 L220Y176-I180 HydrophobicContact CD1-CD1 3.7Å; Y176-I180 HydrophobicContact CD2-CD1 4.11Å; Y176-I180 HydrophobicContact CD2-CG1 4.39Å; Y176-I180 HydrophobicContact CE1-CD1 3.33Å; Y176-I180 HydrophobicContact CE1-CG1 4.44Å; Y176-I180 HydrophobicContact CE2-CD1 3.72Å; Y176-I180 HydrophobicContact CE2-CG1 3.98Å; Y176-I180 HydrophobicContact CG-CD1 4.11Å; Y176-I180 WeakPolarHBondContact O-CG1 3.21Å; Y176-I180 PolarHBondContact O-N 2.95Å; G177-I180 PolarHBondContact O-N 2.87Å; I180-W182 VanDerWaalsContact C-N 3.33Å; I180-W182 PolarHBondContact O-N 2.67Å; I180-L183 PolarHBondContact O-N 3.43Å; I180-L184 HydrophobicContact CG2-CD1 3.89Å; I180-L184 HydrophobicContact CG2-CG 4.34Å; I180-L184 WeakPolarHBondContact O-CB 3.33Å; I180-L184 VanDerWaalsContact O-CG 3.26Å; I180-L184 WeakPolarHBondContact O-CG 3.39Å; I180-L184 PolarHBondContact O-N 3.34Å; I180-L220 HydrophobicContact CB-CD1 4.44Å; I180-L220 HydrophobicContact CD1-CD1 3.74Å; I180-L220 HydrophobicContact CD1-CD2 3.41Å; I180-L220 VanDerWaalsContact CD1-CD2 3.41Å; I180-L220 HydrophobicContact CD1-CG 4.09Å; I180-L220 HydrophobicContact CG1-CD1 4.23Å; I180-L220 HydrophobicContact CG2-CD1 3.46Å; I180-L220 VanDerWaalsContact CG2-CD1 3.46Å
181T43.5Very low44.1Very low31 Ų3150 Ų5019%0.1927%0.271CS..Hα-helixtrans-63-42.5177.65.10000111G177 L178 L183 L184 S185 S252G177-T181 PolarHBondContact O-N 2.82Å; G177-T181 PolarHBondContact O-OG1 3.23Å; L178-T181 WeakPolarHBondContact CA-OG1 3.25Å; L178-T181 PolarHBondContact O-N 3.23Å; L178-T181 PolarHBondContact O-OG1 2.92Å; T181-L183 PolarHBondContact O-N 2.87Å; T181-L184 PolarHBondContact O-N 3.19Å; T181-S185 WeakPolarHBondContact O-CB 3.45Å; T181-S185 PolarHBondContact O-N 3.35Å; T181-S252 WeakPolarHBondContact CG2-OG 3.4Å
182W46.5Very low44Very low125 Ų12548.5 Ų48.547%0.47326%0.257SS..Hα-helixtrans-59.1-46.8172.5176.881.1000111.4F135 L178 Y179 I180 L184 S185 V186F135-W182 HydrophobicContact CE1-CZ3 4.19Å; L178-W182 WeakPolarHBondContact O-CB 3.43Å; L178-W182 PolarHBondContact O-N 2.96Å; Y179-W182 HydrophobicContact CD2-CE3 4.32Å; Y179-W182 HydrophobicContact CE2-CE3 4.21Å; Y179-W182 HydrophobicContact CE2-CZ3 4.19Å; Y179-W182 PolarHBondContact O-N 2.79Å; I180-W182 VanDerWaalsContact C-N 3.33Å; I180-W182 PolarHBondContact O-N 2.67Å; W182-L184 PolarHBondContact O-N 3.42Å; W182-S185 WeakPolarHBondContact O-CB 3.43Å; W182-S185 PolarHBondContact O-N 3.4Å; W182-S185 VanDerWaalsContact O-N 3.14Å; W182-S185 PolarHBondContact O-OG 3.26Å; W182-V186 HydrophobicContact CD2-CG2 4.03Å; W182-V186 HydrophobicContact CE3-CG2 4.48Å; W182-V186 HydrophobicContact CH2-CG2 4.27Å; W182-V186 HydrophobicContact CZ2-CG2 3.79Å; W182-V186 WeakPolarHBondContact O-CG2 3.08Å; W182-V186 PolarHBondContact O-N 3.46Å
183L47.1Very low43.8Very low13 Ų1349 Ų497%0.06825%0.252CS..Hα-helixtrans-65.6-40.4-178.5-170.4121.6000113L136 Y179 I180 T181 S185 V186 C187L136-L183 HydrophobicContact CD1-CD1 4.29Å; L136-L183 HydrophobicContact CD1-CD2 4.21Å; L136-L183 HydrophobicContact CD2-CD1 3.21Å; L136-L183 HydrophobicContact CD2-CD2 3.56Å; L136-L183 HydrophobicContact CD2-CG 3.94Å; L136-L183 HydrophobicContact CG-CD1 3.65Å; L136-L183 HydrophobicContact CG-CD2 4.3Å; L136-L183 HydrophobicContact CG-CG 4.47Å; Y179-L183 HydrophobicContact CE1-CD1 4.06Å; Y179-L183 VanDerWaalsContact O-CB 3.24Å; Y179-L183 WeakPolarHBondContact O-CB 3.37Å; Y179-L183 PolarHBondContact O-N 2.83Å; I180-L183 PolarHBondContact O-N 3.43Å; T181-L183 PolarHBondContact O-N 2.87Å; L183-S185 VanDerWaalsContact C-N 3.33Å; L183-V186 PolarHBondContact O-N 2.87Å; L183-C187 WeakPolarHBondContact O-CB 3.33Å; L183-C187 PolarHBondContact O-N 3.39Å; L183-C187 PolarHBondContact O-SG 2.95Å
184L45.9Very low43.4Very low11 Ų1151.6 Ų51.66%0.05827%0.265CS..Hα-helixtrans-59-46.2171.2-73.5168.5000110.3I180 T181 W182 V186 C187 F188 L213 H217I180-L184 HydrophobicContact CG2-CD1 3.89Å; I180-L184 HydrophobicContact CG2-CG 4.34Å; I180-L184 WeakPolarHBondContact O-CB 3.33Å; I180-L184 VanDerWaalsContact O-CG 3.26Å; I180-L184 WeakPolarHBondContact O-CG 3.39Å; I180-L184 PolarHBondContact O-N 3.34Å; T181-L184 PolarHBondContact O-N 3.19Å; W182-L184 PolarHBondContact O-N 3.42Å; L184-V186 VanDerWaalsContact C-N 3.35Å; L184-V186 PolarHBondContact O-N 2.91Å; L184-C187 PolarHBondContact O-N 2.92Å; L184-F188 VanDerWaalsContact O-CB 3.24Å; L184-F188 WeakPolarHBondContact O-CB 3.46Å; L184-F188 PolarHBondContact O-N 3.28Å; L184-L213 HydrophobicContact CD2-CD2 3.41Å; L184-L213 VanDerWaalsContact CD2-CD2 3.41Å; L184-H217 WeakPolarHBondContact CD1-CE1 3.48Å; L184-H217 WeakPolarHBondContact CD2-NE2 3.29Å
185S43.7Very low43.2Very low39 Ų3955.3 Ų55.327%0.27328%0.278SS..Hα-helixtrans-62.7-38.7178.679.30000112.9T181 W182 L183 F188 Y189T181-S185 WeakPolarHBondContact O-CB 3.45Å; T181-S185 PolarHBondContact O-N 3.35Å; W182-S185 WeakPolarHBondContact O-CB 3.43Å; W182-S185 PolarHBondContact O-N 3.4Å; W182-S185 VanDerWaalsContact O-N 3.14Å; W182-S185 PolarHBondContact O-OG 3.26Å; L183-S185 VanDerWaalsContact C-N 3.33Å; S185-F188 PolarHBondContact O-N 2.9Å; S185-Y189 VanDerWaalsContact O-CB 3.3Å; S185-Y189 WeakPolarHBondContact O-CB 3.38Å; S185-Y189 PolarHBondContact O-N 2.86Å
186V44.1Very low43Very low32 Ų3253.4 Ų53.419%0.19427%0.271CS..Hα-helixtrans-70.4-46.6178171.60000110.8I132 W182 L183 L184 F188 Y189 L190I132-V186 HydrophobicContact CD1-CG1 4.13Å; W182-V186 HydrophobicContact CD2-CG2 4.03Å; W182-V186 HydrophobicContact CE3-CG2 4.48Å; W182-V186 HydrophobicContact CH2-CG2 4.27Å; W182-V186 HydrophobicContact CZ2-CG2 3.79Å; W182-V186 WeakPolarHBondContact O-CG2 3.08Å; W182-V186 PolarHBondContact O-N 3.46Å; L183-V186 PolarHBondContact O-N 2.87Å; L184-V186 VanDerWaalsContact C-N 3.35Å; L184-V186 PolarHBondContact O-N 2.91Å; V186-F188 PolarHBondContact O-N 3.39Å; V186-Y189 PolarHBondContact O-N 2.82Å; V186-L190 HydrophobicContact CG1-CD1 3.58Å; V186-L190 WeakPolarHBondContact O-CB 3.3Å; V186-L190 WeakPolarHBondContact O-CD1 2.94Å; V186-L190 PolarHBondContact O-N 3.29Å
187C45.8Very low42.5Very low31 Ų3159.8 Ų59.821%0.20929%0.294CS..Hα-helixtrans-59.5-38.1175.9-67.60000111.5L183 L184 G191 L213L183-C187 WeakPolarHBondContact O-CB 3.33Å; L183-C187 PolarHBondContact O-N 3.39Å; L183-C187 PolarHBondContact O-SG 2.95Å; L184-C187 PolarHBondContact O-N 2.92Å; C187-G191 PolarHBondContact O-N 3.43Å; C187-L213 HydrophobicContact CB-CD2 4.28Å
188F44.6Very low42Very low58 Ų5863.5 Ų63.525%0.25431%0.314SS..Hα-helixtrans-72.8-40.9178.9-148.3-110.8000112.4L184 S185 V186 G191 S192 I256 Y259L184-F188 VanDerWaalsContact O-CB 3.24Å; L184-F188 WeakPolarHBondContact O-CB 3.46Å; L184-F188 PolarHBondContact O-N 3.28Å; S185-F188 PolarHBondContact O-N 2.9Å; V186-F188 PolarHBondContact O-N 3.39Å; F188-G191 PolarHBondContact O-N 3.46Å; F188-S192 VanDerWaalsContact O-CB 3.31Å; F188-S192 WeakPolarHBondContact O-CB 3.35Å; F188-S192 PolarHBondContact O-N 3.06Å; F188-S192 PolarHBondContact O-OG 3.39Å; F188-I256 HydrophobicContact CD2-CG2 4.41Å; F188-I256 HydrophobicContact CE2-CG2 3.65Å; F188-I256 HydrophobicContact CZ-CG2 3.79Å; F188-Y259 HydrophobicContact CD1-CD1 4.13Å; F188-Y259 HydrophobicContact CD1-CE1 4.22Å; F188-Y259 AromaticContact CE1-CD1 3.22Å; F188-Y259 HydrophobicContact CE1-CD1 3.22Å; F188-Y259 AromaticContact CE1-CE1 3.67Å; F188-Y259 HydrophobicContact CE1-CE1 3.67Å; F188-Y259 AromaticContact CE1-CG 3.93Å; F188-Y259 HydrophobicContact CE1-CG 3.93Å; F188-Y259 AromaticContact CZ-CD1 3.95Å; F188-Y259 HydrophobicContact CZ-CD1 3.95Å
189Y42Very low41.6Very low98 Ų9868.6 Ų68.638%0.38433%0.333SS..Hα-helixtrans-59.7-49.7172.5-179.4-101.8000111.3S185 V186 S192 H193S185-Y189 VanDerWaalsContact O-CB 3.3Å; S185-Y189 WeakPolarHBondContact O-CB 3.38Å; S185-Y189 PolarHBondContact O-N 2.86Å; V186-Y189 PolarHBondContact O-N 2.82Å; Y189-S192 PolarHBondContact O-N 2.93Å; Y189-S192 PolarHBondContact O-OG 2.98Å; Y189-H193 WeakPolarHBondContact O-CB 3.09Å; Y189-H193 PolarHBondContact O-N 3.03Å
190L44Very low41.1Very low45 Ų4573.9 Ų73.924%0.23636%0.362CS..Hα-helixtrans-63.5-42.9176.6-88135.6000112.7V128 I132 V186 S192 H193 I194V128-L190 HydrophobicContact CG1-CD2 3.95Å; I132-L190 HydrophobicContact CD1-CD1 3.25Å; V186-L190 HydrophobicContact CG1-CD1 3.58Å; V186-L190 WeakPolarHBondContact O-CB 3.3Å; V186-L190 WeakPolarHBondContact O-CD1 2.94Å; V186-L190 PolarHBondContact O-N 3.29Å; L190-S192 VanDerWaalsContact C-N 3.34Å; L190-S192 PolarHBondContact O-N 3.35Å; L190-H193 PolarHBondContact O-N 2.87Å; L190-I194 WeakPolarHBondContact O-CG1 3.26Å; L190-I194 PolarHBondContact O-N 3.49Å; L190-I194 VanDerWaalsContact O-N 3.1Å
191G43Very low40.6Very low26 Ų2677.8 Ų77.827%0.26839%0.391SS..Hα-helixtrans-55.1-52.7172.400000110.4C187 F188 H193 I194 F195C187-G191 PolarHBondContact O-N 3.43Å; F188-G191 PolarHBondContact O-N 3.46Å; G191-H193 VanDerWaalsContact C-N 3.26Å; G191-H193 PolarHBondContact O-N 3.4Å; G191-I194 PolarHBondContact O-N 3.25Å; G191-F195 WeakPolarHBondContact O-CD2 3.41Å; G191-F195 PolarHBondContact O-N 3.38Å; G191-F195 VanDerWaalsContact O-N 3.13Å
192S39.8Very low40.3Very low18 Ų1882 Ų8213%0.12642%0.416CS..Hα-helixtrans-60.2-30.8-178.878.40000114.5F188 Y189 L190 K263F188-S192 VanDerWaalsContact O-CB 3.31Å; F188-S192 WeakPolarHBondContact O-CB 3.35Å; F188-S192 PolarHBondContact O-N 3.06Å; F188-S192 PolarHBondContact O-OG 3.39Å; Y189-S192 PolarHBondContact O-N 2.93Å; Y189-S192 PolarHBondContact O-OG 2.98Å; L190-S192 VanDerWaalsContact C-N 3.34Å; L190-S192 PolarHBondContact O-N 3.35Å; S192-K263 PolarHBondContact O-NZ 2.88Å
193H38Very low39.9Very low90 Ų9079 Ų7942%0.41741%0.414SS..Hα-helixtrans-84.9-24.1-177.9-148.5-54000113.3Y189 L190 G191 T196Y189-H193 WeakPolarHBondContact O-CB 3.09Å; Y189-H193 PolarHBondContact O-N 3.03Å; L190-H193 PolarHBondContact O-N 2.87Å; G191-H193 VanDerWaalsContact C-N 3.26Å; G191-H193 PolarHBondContact O-N 3.4Å; H193-T196 PolarHBondContact O-OG1 3.49Å
194I38.1Very low39.2Very low104 Ų10485 Ų8553%0.53345%0.445SS..Hα-helixtrans-71.8-39.7167.6-66.9166.1000109.3L190 G191 T196 R197 T198L190-I194 WeakPolarHBondContact O-CG1 3.26Å; L190-I194 PolarHBondContact O-N 3.49Å; L190-I194 VanDerWaalsContact O-N 3.1Å; G191-I194 PolarHBondContact O-N 3.25Å; I194-T196 VanDerWaalsContact C-N 3.32Å; I194-T196 PolarHBondContact O-N 3.27Å; I194-R197 PolarHBondContact O-N 2.92Å; I194-T198 PolarHBondContact O-OG1 2.98Å
195F34.5Very low38.6Very low108 Ų10888.7 Ų88.747%0.47447%0.469SS..Hα-helixtrans-61.7-29.8179.6-88.2-73.3000115G191 I206G191-F195 WeakPolarHBondContact O-CD2 3.41Å; G191-F195 PolarHBondContact O-N 3.38Å; G191-F195 VanDerWaalsContact O-N 3.13Å; F195-I206 HydrophobicContact CD1-CD1 4.5Å; F195-I206 HydrophobicContact CE1-CD1 3.5Å; F195-I206 HydrophobicContact CE1-CG1 4.25Å; F195-I206 HydrophobicContact CE2-CD1 4.36Å; F195-I206 HydrophobicContact CE2-CG1 4.25Å; F195-I206 HydrophobicContact CZ-CB 4.36Å; F195-I206 HydrophobicContact CZ-CD1 3.4Å; F195-I206 VanDerWaalsContact CZ-CD1 3.4Å; F195-I206 HydrophobicContact CZ-CG1 3.63Å; F195-I206 HydrophobicContact CZ-CG2 3.79Å
196T37Very low38.2Very low76 Ų7689.4 Ų89.447%0.46647%0.469SS..THydrogen-bonded Turntrans-83.3-6.7-177.549.40000114.2H193 I194H193-T196 PolarHBondContact O-OG1 3.49Å; I194-T196 VanDerWaalsContact C-N 3.32Å; I194-T196 PolarHBondContact O-N 3.27Å
197R37Very low37.7Very low211 Ų21193.3 Ų93.380%0.79649%0.488SS*.THydrogen-bonded Turntrans-117-7.3-175.3-79.7-169.4173.8-178.2-0.7115.9I194I194-R197 PolarHBondContact O-N 2.92Å
198T33.3Very low37.1Very low92 Ų9295.5 Ų95.556%0.56450%0.503SS*.  trans-128.7103.5-177.548.40000111.9I194 I200I194-T198 PolarHBondContact O-OG1 2.98Å; T198-I200 VanDerWaalsContact C-N 3.27Å; T198-I200 PolarHBondContact O-N 3.24Å
199F34.4Very low36.9Very low182 Ų18295.4 Ų95.480%0.79851%0.507SS*.  trans-79.66.5-179-113.1-86.1000115
200I34.2Very low36.8Very low144 Ų14492.6 Ų92.674%0.73851%0.508SS*.SBendtrans-142.9120.8-163.9-51.6177.9000110.3T198T198-I200 VanDerWaalsContact C-N 3.27Å; T198-I200 PolarHBondContact O-N 3.24Å
201S36.2Very low36.5Very low99 Ų9995 Ų9569%0.69252%0.52SS*.  trans63.1111.5175.269.20000115.9P203S201-P203 WeakPolarHBondContact O-CD 3.38Å
202V38.2Very low36.3Very low119 Ų11998.9 Ų98.972%0.72153%0.53SS*.  trans-59.2105.6166.3176.80000107.2I206V202-I206 HydrophobicContact CB-CD1 4.39Å; V202-I206 HydrophobicContact CG1-CB 4.14Å; V202-I206 HydrophobicContact CG1-CD1 3.8Å; V202-I206 HydrophobicContact CG1-CG2 4.43Å
203P36.5Very low36.6Very low64 Ų6499.8 Ų99.842%0.41653%0.533SS..  trans-78.1148.2178.18.110.7000107.4S201 T205 I206S201-P203 WeakPolarHBondContact O-CD 3.38Å; P203-T205 WeakPolarHBondContact CB-OG1 3.41Å; P203-T205 PolarHBondContact O-N 3.06Å; P203-T205 PolarHBondContact O-OG1 3.27Å; P203-I206 PolarHBondContact O-N 2.85Å
204N32.2Very low36.9Very low137 Ų137100.3 Ų100.373%0.73354%0.538SS*.Hα-helixtrans-47.5-16.6176.1-77-29.5000114.2I206 L207 C208N204-I206 VanDerWaalsContact C-N 3.32Å; N204-I206 PolarHBondContact O-N 3.25Å; N204-L207 PolarHBondContact O-N 2.95Å; N204-C208 WeakPolarHBondContact O-CB 3.47Å; N204-C208 PolarHBondContact O-N 3.37Å; N204-C208 PolarHBondContact O-SG 2.86Å
205T34.4Very low37.1Very low89 Ų89101.2 Ų101.255%0.54654%0.54SS..Hα-helixtrans-58.9-32171.449.10000114.4P203 T209P203-T205 WeakPolarHBondContact CB-OG1 3.41Å; P203-T205 PolarHBondContact O-N 3.06Å; P203-T205 PolarHBondContact O-OG1 3.27Å; T205-T209 WeakPolarHBondContact O-CB 3.22Å; T205-T209 WeakPolarHBondContact O-CG2 3.16Å; T205-T209 PolarHBondContact O-N 2.89Å; T205-T209 PolarHBondContact O-OG1 3.47Å
206I35.3Very low37.6Very low54 Ų5497.7 Ų97.728%0.27753%0.527SS..Hα-helixtrans-71.1-43.1177.4-69166000110.9F195 V202 P203 N204 T209 G210F195-I206 HydrophobicContact CD1-CD1 4.5Å; F195-I206 HydrophobicContact CE1-CD1 3.5Å; F195-I206 HydrophobicContact CE1-CG1 4.25Å; F195-I206 HydrophobicContact CE2-CD1 4.36Å; F195-I206 HydrophobicContact CE2-CG1 4.25Å; F195-I206 HydrophobicContact CZ-CB 4.36Å; F195-I206 HydrophobicContact CZ-CD1 3.4Å; F195-I206 VanDerWaalsContact CZ-CD1 3.4Å; F195-I206 HydrophobicContact CZ-CG1 3.63Å; F195-I206 HydrophobicContact CZ-CG2 3.79Å; V202-I206 HydrophobicContact CB-CD1 4.39Å; V202-I206 HydrophobicContact CG1-CB 4.14Å; V202-I206 HydrophobicContact CG1-CD1 3.8Å; V202-I206 HydrophobicContact CG1-CG2 4.43Å; P203-I206 PolarHBondContact O-N 2.85Å; N204-I206 VanDerWaalsContact C-N 3.32Å; N204-I206 PolarHBondContact O-N 3.25Å; I206-T209 WeakPolarHBondContact CA-OG1 3.33Å; I206-T209 PolarHBondContact O-OG1 3.19Å; I206-G210 PolarHBondContact O-N 3.41Å
207L34.2Very low38.2Very low115 Ų11594.9 Ų94.960%0.60251%0.509SS*.Hα-helixtrans-65.3-43.7175.1-16188.2000110N204 G210 I211N204-L207 PolarHBondContact O-N 2.95Å; L207-G210 PolarHBondContact O-N 3.38Å; L207-I211 HydrophobicContact CD2-CD1 3.83Å; L207-I211 HydrophobicContact CG-CD1 3.71Å; L207-I211 HydrophobicContact CG-CG1 4.46Å; L207-I211 VanDerWaalsContact O-CB 3.27Å; L207-I211 WeakPolarHBondContact O-CB 3.5Å; L207-I211 WeakPolarHBondContact O-CD1 3.36Å; L207-I211 WeakPolarHBondContact O-CG1 3.24Å; L207-I211 PolarHBondContact O-N 2.98Å
208C32.8Very low38.3Very low77 Ų7788 Ų8852%0.5249%0.49SS..Hα-helixtrans-65.6-38.9178.7-70.80000113.3N204 F212N204-C208 WeakPolarHBondContact O-CB 3.47Å; N204-C208 PolarHBondContact O-N 3.37Å; N204-C208 PolarHBondContact O-SG 2.86Å; C208-F212 WeakPolarHBondContact O-CB 3.23Å; C208-F212 PolarHBondContact O-N 2.9Å
209T40.9Very low38.8Very low55 Ų5586 Ų8634%0.33748%0.48SS..Hα-helixtrans-71.7-40177.241.60000112.2F129 T205 I206 F212 L213F129-T209 HydrophobicContact CE2-CG2 4.1Å; F129-T209 HydrophobicContact CZ-CG2 4.03Å; T205-T209 WeakPolarHBondContact O-CB 3.22Å; T205-T209 WeakPolarHBondContact O-CG2 3.16Å; T205-T209 PolarHBondContact O-N 2.89Å; T205-T209 PolarHBondContact O-OG1 3.47Å; I206-T209 WeakPolarHBondContact CA-OG1 3.33Å; I206-T209 PolarHBondContact O-OG1 3.19Å; T209-F212 PolarHBondContact O-N 3.33Å; T209-L213 WeakPolarHBondContact O-CB 3.45Å; T209-L213 WeakPolarHBondContact O-CD1 3.46Å; T209-L213 VanDerWaalsContact O-CG 3.24Å; T209-L213 WeakPolarHBondContact O-CG 3.27Å; T209-L213 PolarHBondContact O-N 3.39Å
210G39.5Very low39.4Very low39 Ų3978.3 Ų78.340%0.40245%0.447SS..Hα-helixtrans-63.2-44.5171.700000113I206 L207 L213 L214I206-G210 PolarHBondContact O-N 3.41Å; L207-G210 PolarHBondContact O-N 3.38Å; G210-L213 PolarHBondContact O-N 3.44Å; G210-L214 VanDerWaalsContact O-CB 3.28Å; G210-L214 WeakPolarHBondContact O-CB 3.27Å; G210-L214 PolarHBondContact O-N 3.41Å
211I37.5Very low40Very low96 Ų9674.8 Ų74.849%0.49243%0.429SS..Hα-helixtrans-64-41175.3-69.7166.3000110.8L207 L214 H215L207-I211 HydrophobicContact CD2-CD1 3.83Å; L207-I211 HydrophobicContact CG-CD1 3.71Å; L207-I211 HydrophobicContact CG-CG1 4.46Å; L207-I211 VanDerWaalsContact O-CB 3.27Å; L207-I211 WeakPolarHBondContact O-CB 3.5Å; L207-I211 WeakPolarHBondContact O-CD1 3.36Å; L207-I211 WeakPolarHBondContact O-CG1 3.24Å; L207-I211 PolarHBondContact O-N 2.98Å; I211-L214 PolarHBondContact O-N 2.7Å; I211-H215 VanDerWaalsContact O-CB 3.29Å; I211-H215 WeakPolarHBondContact O-CB 3.39Å; I211-H215 PolarHBondContact O-N 2.98Å
212F39.4Very low40.2Very low108 Ų10874.3 Ų74.347%0.47442%0.418SS..Hα-helixtrans-66.5-44.6177.9-176-97.5000111.9L136 C208 T209 H215 V216L136-F212 HydrophobicContact CD1-CE1 4.44Å; C208-F212 WeakPolarHBondContact O-CB 3.23Å; C208-F212 PolarHBondContact O-N 2.9Å; T209-F212 PolarHBondContact O-N 3.33Å; F212-H215 WeakPolarHBondContact O-CB 3.38Å; F212-H215 PolarHBondContact O-N 2.89Å; F212-V216 HydrophobicContact CD1-CG2 4.16Å; F212-V216 HydrophobicContact CE1-CG2 3.82Å; F212-V216 HydrophobicContact CZ-CG2 4.05Å; F212-V216 WeakPolarHBondContact O-CG2 3.45Å; F212-V216 PolarHBondContact O-N 3.47Å
213L45.8Very low40.5Very low36 Ų3670.8 Ų70.819%0.18840%0.402CS..Hα-helixtrans-62.2-43.2175.1-74.2166.3000111.4L184 C187 T209 G210 H215 V216 H217L184-L213 HydrophobicContact CD2-CD2 3.41Å; L184-L213 VanDerWaalsContact CD2-CD2 3.41Å; C187-L213 HydrophobicContact CB-CD2 4.28Å; T209-L213 WeakPolarHBondContact O-CB 3.45Å; T209-L213 WeakPolarHBondContact O-CD1 3.46Å; T209-L213 VanDerWaalsContact O-CG 3.24Å; T209-L213 WeakPolarHBondContact O-CG 3.27Å; T209-L213 PolarHBondContact O-N 3.39Å; G210-L213 PolarHBondContact O-N 3.44Å; L213-H215 VanDerWaalsContact C-N 3.33Å; L213-H215 PolarHBondContact O-N 2.9Å; L213-V216 PolarHBondContact O-N 3.48Å; L213-H217 WeakPolarHBondContact O-CB 3.11Å; L213-H217 PolarHBondContact O-CD2 3.19Å; L213-H217 PolarHBondContact O-N 2.91Å
214L44.6Very low41Very low102 Ų10268.1 Ų68.153%0.53438%0.384SS..Hα-helixtrans-60.6-43173.4-173.771000111.1G210 I211 H217 V218G210-L214 VanDerWaalsContact O-CB 3.28Å; G210-L214 WeakPolarHBondContact O-CB 3.27Å; G210-L214 PolarHBondContact O-N 3.41Å; I211-L214 PolarHBondContact O-N 2.7Å; L214-H217 PolarHBondContact O-N 2.87Å; L214-V218 HydrophobicContact CD1-CG2 4.47Å; L214-V218 HydrophobicContact CG-CG2 4.39Å; L214-V218 WeakPolarHBondContact O-CB 3.28Å; L214-V218 WeakPolarHBondContact O-CG2 3.49Å; L214-V218 PolarHBondContact O-N 2.92Å
215H41.6Very low41.4Very low122 Ų12265 Ų6557%0.56537%0.367SS*.Hα-helixtrans-64.8-39.6178.1-168.274.3000112.4I211 F212 L213 S219I211-H215 VanDerWaalsContact O-CB 3.29Å; I211-H215 WeakPolarHBondContact O-CB 3.39Å; I211-H215 PolarHBondContact O-N 2.98Å; F212-H215 WeakPolarHBondContact O-CB 3.38Å; F212-H215 PolarHBondContact O-N 2.89Å; L213-H215 VanDerWaalsContact C-N 3.33Å; L213-H215 PolarHBondContact O-N 2.9Å; H215-S219 WeakPolarHBondContact O-CB 3.49Å; H215-S219 PolarHBondContact O-N 3.39Å; H215-S219 PolarHBondContact O-OG 2.96Å
216V45.5Very low41.8Very low35 Ų3567.8 Ų67.821%0.21237%0.372CS..Hα-helixtrans-65.6-48.1175.4170.40000110.6F212 L213 S219 L220F212-V216 HydrophobicContact CD1-CG2 4.16Å; F212-V216 HydrophobicContact CE1-CG2 3.82Å; F212-V216 HydrophobicContact CZ-CG2 4.05Å; F212-V216 WeakPolarHBondContact O-CG2 3.45Å; F212-V216 PolarHBondContact O-N 3.47Å; L213-V216 PolarHBondContact O-N 3.48Å; V216-S219 PolarHBondContact O-N 3.5Å; V216-L220 HydrophobicContact CG1-CD1 3.77Å; V216-L220 WeakPolarHBondContact O-CB 3.25Å; V216-L220 PolarHBondContact O-N 2.87Å
217H47.7Very low42.2Very low17 Ų1769.1 Ų69.18%0.07938%0.379CS..Hα-helixtrans-60.4-46.1175.6-83.4-70.7000112.5L184 L213 L214 S219 L220 I221L184-H217 WeakPolarHBondContact CD1-CE1 3.48Å; L184-H217 WeakPolarHBondContact CD2-NE2 3.29Å; L213-H217 WeakPolarHBondContact O-CB 3.11Å; L213-H217 PolarHBondContact O-CD2 3.19Å; L213-H217 PolarHBondContact O-N 2.91Å; L214-H217 PolarHBondContact O-N 2.87Å; H217-S219 VanDerWaalsContact C-N 3.32Å; H217-S219 PolarHBondContact O-N 2.81Å; H217-L220 PolarHBondContact O-N 3.33Å; H217-I221 WeakPolarHBondContact O-CB 3.48Å; H217-I221 WeakPolarHBondContact O-CD1 3.27Å; H217-I221 VanDerWaalsContact O-CG1 3.23Å; H217-I221 WeakPolarHBondContact O-CG1 3.31Å; H217-I221 PolarHBondContact O-N 3.02Å
218V41Very low42.6Very low66 Ų6667.3 Ų67.340%0.437%0.369SS..Hα-helixtrans-63.4-39.6177170.70000111L214 L220 L222L214-V218 HydrophobicContact CD1-CG2 4.47Å; L214-V218 HydrophobicContact CG-CG2 4.39Å; L214-V218 WeakPolarHBondContact O-CB 3.28Å; L214-V218 WeakPolarHBondContact O-CG2 3.49Å; L214-V218 PolarHBondContact O-N 2.92Å; V218-L220 VanDerWaalsContact C-N 3.35Å; V218-L222 HydrophobicContact CG1-CD1 3.83Å; V218-L222 HydrophobicContact CG1-CG 4.47Å; V218-L222 VanDerWaalsContact O-CB 3.31Å; V218-L222 WeakPolarHBondContact O-CB 3.39Å; V218-L222 WeakPolarHBondContact O-CD1 3.44Å; V218-L222 VanDerWaalsContact O-CG 3.22Å; V218-L222 WeakPolarHBondContact O-CG 3.45Å; V218-L222 PolarHBondContact O-N 3.44Å
219S42.1Very low43Very low51 Ų5169.4 Ų69.436%0.35737%0.374SS..Hα-helixtrans-66.7-36.3177.6-63.40000112.6H215 V216 H217 L222 A223H215-S219 WeakPolarHBondContact O-CB 3.49Å; H215-S219 PolarHBondContact O-N 3.39Å; H215-S219 PolarHBondContact O-OG 2.96Å; V216-S219 PolarHBondContact O-N 3.5Å; H217-S219 VanDerWaalsContact C-N 3.32Å; H217-S219 PolarHBondContact O-N 2.81Å; S219-L222 PolarHBondContact O-N 3.44Å; S219-A223 WeakPolarHBondContact O-CB 3.47Å; S219-A223 PolarHBondContact O-N 3.48Å
220L48.5Very low42.7Very low19 Ų1971.6 Ų71.610%0.09938%0.383CS..Hα-helixtrans-70.6-45.4175.7-94.1151.2000112.4I180 V216 H217 V218 L222 A223 S224 E249I180-L220 HydrophobicContact CB-CD1 4.44Å; I180-L220 HydrophobicContact CD1-CD1 3.74Å; I180-L220 HydrophobicContact CD1-CD2 3.41Å; I180-L220 VanDerWaalsContact CD1-CD2 3.41Å; I180-L220 HydrophobicContact CD1-CG 4.09Å; I180-L220 HydrophobicContact CG1-CD1 4.23Å; I180-L220 HydrophobicContact CG2-CD1 3.46Å; I180-L220 VanDerWaalsContact CG2-CD1 3.46Å; V216-L220 HydrophobicContact CG1-CD1 3.77Å; V216-L220 WeakPolarHBondContact O-CB 3.25Å; V216-L220 PolarHBondContact O-N 2.87Å; H217-L220 PolarHBondContact O-N 3.33Å; V218-L220 VanDerWaalsContact C-N 3.35Å; L220-L222 VanDerWaalsContact C-N 3.27Å; L220-L222 PolarHBondContact O-N 3.43Å; L220-A223 PolarHBondContact O-N 2.94Å; L220-A223 VanDerWaalsContact O-N 3.1Å; L220-S224 WeakPolarHBondContact O-CB 3.42Å; L220-S224 PolarHBondContact O-N 2.97Å; L220-S224 PolarHBondContact O-OG 3.43Å; L220-S224 VanDerWaalsContact O-OG 3.05Å; L220-E249 WeakPolarHBondContact CB-OE1 3.13Å; L220-E249 VanDerWaalsContact CD2-OE1 3.26Å; L220-E249 WeakPolarHBondContact CD2-OE1 3.4Å
221I45.9Very low42.5Very low70 Ų7075.4 Ų75.436%0.35940%0.401SS..Hα-helixtrans-57.1-44.4171.3-68.9165.2000109.9H217 A223 S224 I225H217-I221 WeakPolarHBondContact O-CB 3.48Å; H217-I221 WeakPolarHBondContact O-CD1 3.27Å; H217-I221 VanDerWaalsContact O-CG1 3.23Å; H217-I221 WeakPolarHBondContact O-CG1 3.31Å; H217-I221 PolarHBondContact O-N 3.02Å; I221-A223 PolarHBondContact O-N 3.49Å; I221-S224 PolarHBondContact O-N 3.32Å; I221-I225 HydrophobicContact CG2-CD1 3.61Å; I221-I225 HydrophobicContact CG2-CG1 4.35Å; I221-I225 WeakPolarHBondContact O-CB 3.22Å; I221-I225 WeakPolarHBondContact O-CD1 3.49Å; I221-I225 WeakPolarHBondContact O-CG1 3.48Å; I221-I225 PolarHBondContact O-N 2.93Å
222L40.7Very low42.7Very low89 Ų8973.1 Ų73.147%0.46639%0.391SS..Hα-helixtrans-65.1-37.3176.3-77.5164.6000112.9V218 S219 L220 K226V218-L222 HydrophobicContact CG1-CD1 3.83Å; V218-L222 HydrophobicContact CG1-CG 4.47Å; V218-L222 VanDerWaalsContact O-CB 3.31Å; V218-L222 WeakPolarHBondContact O-CB 3.39Å; V218-L222 WeakPolarHBondContact O-CD1 3.44Å; V218-L222 VanDerWaalsContact O-CG 3.22Å; V218-L222 WeakPolarHBondContact O-CG 3.45Å; V218-L222 PolarHBondContact O-N 3.44Å; S219-L222 PolarHBondContact O-N 3.44Å; L220-L222 VanDerWaalsContact C-N 3.27Å; L220-L222 PolarHBondContact O-N 3.43Å; L222-K226 WeakPolarHBondContact O-CB 3.28Å; L222-K226 VanDerWaalsContact O-CG 3.31Å; L222-K226 WeakPolarHBondContact O-CG 3.24Å; L222-K226 PolarHBondContact O-N 3.12Å
223A44.6Very low42.7Very low46 Ų4678.4 Ų78.438%0.3841%0.414SS..Hα-helixtrans-67.5-43.3175.700000111.4S219 L220 I221 K226 L227S219-A223 WeakPolarHBondContact O-CB 3.47Å; S219-A223 PolarHBondContact O-N 3.48Å; L220-A223 PolarHBondContact O-N 2.94Å; L220-A223 VanDerWaalsContact O-N 3.1Å; I221-A223 PolarHBondContact O-N 3.49Å; A223-K226 PolarHBondContact O-N 3.09Å; A223-L227 WeakPolarHBondContact O-CG 3.12Å; A223-L227 PolarHBondContact O-N 3.09Å
224S45.8Very low42.5Very low7 Ų781.6 Ų81.65%0.04944%0.439CS..Hα-helixtrans-63.2-44175.1-63.10000111.6L220 I221 L227 L228 S242L220-S224 WeakPolarHBondContact O-CB 3.42Å; L220-S224 PolarHBondContact O-N 2.97Å; L220-S224 PolarHBondContact O-OG 3.43Å; L220-S224 VanDerWaalsContact O-OG 3.05Å; I221-S224 PolarHBondContact O-N 3.32Å; S224-L227 WeakPolarHBondContact O-CB 3.37Å; S224-L227 PolarHBondContact O-N 3.24Å; S224-L228 WeakPolarHBondContact O-CB 3.33Å; S224-L228 PolarHBondContact O-N 3.48Å; S224-S242 PolarHBondContact O-OG 2.81Å
225I41.8Very low42.3Very low72 Ų7279 Ų7937%0.36943%0.429SS..Hα-helixtrans-63.4-42.3173.7-70.1167.2000111I221 L227 L228 I229I221-I225 HydrophobicContact CG2-CD1 3.61Å; I221-I225 HydrophobicContact CG2-CG1 4.35Å; I221-I225 WeakPolarHBondContact O-CB 3.22Å; I221-I225 WeakPolarHBondContact O-CD1 3.49Å; I221-I225 WeakPolarHBondContact O-CG1 3.48Å; I221-I225 PolarHBondContact O-N 2.93Å; I225-L227 VanDerWaalsContact C-N 3.29Å; I225-L227 PolarHBondContact O-N 2.88Å; I225-L228 WeakPolarHBondContact O-CB 3.3Å; I225-L228 PolarHBondContact O-N 3.36Å; I225-L228 VanDerWaalsContact O-N 3.13Å; I225-I229 HydrophobicContact CG2-CD1 3.53Å; I225-I229 HydrophobicContact CG2-CG1 4.28Å; I225-I229 VanDerWaalsContact O-CG1 3.24Å; I225-I229 WeakPolarHBondContact O-CG1 3.48Å; I225-I229 PolarHBondContact O-N 3.49Å
226K42.2Very low42.4Very low148 Ų14879.5 Ų79.564%0.64344%0.436SS*.Hα-helixtrans-63.3-34.6175.1-81.4179.8178.4178.80112.6L222 A223 L230L222-K226 WeakPolarHBondContact O-CB 3.28Å; L222-K226 VanDerWaalsContact O-CG 3.31Å; L222-K226 WeakPolarHBondContact O-CG 3.24Å; L222-K226 PolarHBondContact O-N 3.12Å; A223-K226 PolarHBondContact O-N 3.09Å; K226-L230 PolarHBondContact O-N 2.7Å
227L43.8Very low42.2Very low82 Ų8280.6 Ų80.643%0.42944%0.44SS..Hα-helixtrans-67.3-36.4172.6-76.7163.4000111.9A223 S224 I225 L230A223-L227 WeakPolarHBondContact O-CG 3.12Å; A223-L227 PolarHBondContact O-N 3.09Å; S224-L227 WeakPolarHBondContact O-CB 3.37Å; S224-L227 PolarHBondContact O-N 3.24Å; I225-L227 VanDerWaalsContact C-N 3.29Å; I225-L227 PolarHBondContact O-N 2.88Å; L227-L230 HydrophobicContact CD2-CD1 4.27Å
228L42.6Very low41.9Very low76 Ų7682.3 Ų82.340%0.39845%0.446SS..Hα-helixtrans-73.4-28.8178.5-151.8137.8000113S224 I225 S242 T243S224-L228 WeakPolarHBondContact O-CB 3.33Å; S224-L228 PolarHBondContact O-N 3.48Å; I225-L228 WeakPolarHBondContact O-CB 3.3Å; I225-L228 PolarHBondContact O-N 3.36Å; I225-L228 VanDerWaalsContact O-N 3.13Å; L228-S242 WeakPolarHBondContact CD1-OG 3.39Å; L228-T243 HydrophobicContact CD1-CG2 4.26Å
229I40.6Very low42.1Very low122 Ų12286.7 Ų86.763%0.62646%0.456SS*.Hα-helixtrans-82.8-18.2178.8-66.2166.3000112.9I225I225-I229 HydrophobicContact CG2-CD1 3.53Å; I225-I229 HydrophobicContact CG2-CG1 4.28Å; I225-I229 VanDerWaalsContact O-CG1 3.24Å; I225-I229 WeakPolarHBondContact O-CG1 3.48Å; I225-I229 PolarHBondContact O-N 3.49Å
230L36.1Very low42.2Very low100 Ų10086.9 Ų86.952%0.52446%0.455SS..SBendtrans-59.3126.4179-89.2158000110.5K226 L227 V232K226-L230 PolarHBondContact O-N 2.7Å; L227-L230 HydrophobicContact CD2-CD1 4.27Å; L230-V232 HydrophobicContact CB-CG2 4.17Å; L230-V232 PolarHBondContact O-N 2.75Å
231P34.4Very low42.1Very low119 Ų11987.4 Ų87.477%0.77346%0.457SS*.  trans-78.366.8-177.533.4-34.7000109.8K233P231-K233 PolarHBondContact O-N 2.88Å
232V41Very low42.1Very low49 Ų4984.4 Ų84.430%0.29744%0.442SS..  trans-88.788.7171.7-1700000106.9L230 S234 C235 Y238L230-V232 HydrophobicContact CB-CG2 4.17Å; L230-V232 PolarHBondContact O-N 2.75Å; V232-S234 PolarHBondContact O-N 3.33Å; V232-C235 HydrophobicContact CG1-CB 4.15Å; V232-Y238 HydrophobicContact CG1-CD2 4.38Å
233K39.3Very low42.4Very low219 Ų21983.6 Ų83.695%0.95244%0.442SS*.THydrogen-bonded Turntrans-59.6-7.1-179.7-82.9-174.7173.2-177.10114.6P231P231-K233 PolarHBondContact O-N 2.88Å
234S41.6Very low42.4Very low102 Ų10283.3 Ų83.371%0.71344%0.437SS*.THydrogen-bonded Turntrans-125.99.2-164.851.50000116V232V232-S234 PolarHBondContact O-N 3.33Å
235C40.5Very low42.4Very low48 Ų4885 Ų8532%0.32444%0.443SS..  trans-144.492.7-178.6-85.60000112.6V232 L237 Y238V232-C235 HydrophobicContact CG1-CB 4.15Å; C235-L237 PolarHBondContact O-N 2.92Å; C235-L237 VanDerWaalsContact O-N 3.13Å; C235-Y238 HydrophobicContact CB-CD2 3.45Å; C235-Y238 VanDerWaalsContact CB-CD2 3.45Å; C235-Y238 HydrophobicContact CB-CE2 4.13Å; C235-Y238 HydrophobicContact CB-CG 4.43Å; C235-Y238 PolarHBondContact O-N 3.39Å; C235-Y238 VanDerWaalsContact O-N 3.15Å
236N44.4Very low42.8Very low132 Ų13284.4 Ų84.471%0.70644%0.44SS*.Hα-helixtrans-49.8-31.1161.8-77.9-18.8000111.3Y238 R239 V240N236-Y238 PolarHBondContact O-N 3.41Å; N236-R239 PolarHBondContact O-N 3.48Å; N236-R239 VanDerWaalsContact O-N 3.16Å; N236-V240 WeakPolarHBondContact O-CG2 3.44Å; N236-V240 PolarHBondContact O-N 2.98Å
237L42.2Very low43Very low58 Ų5880.3 Ų80.330%0.30443%0.43SS..Hα-helixtrans-55.7-43.9176.4-156.8100.7000113.9C235 R239 V240 I241 L307C235-L237 PolarHBondContact O-N 2.92Å; C235-L237 VanDerWaalsContact O-N 3.13Å; L237-R239 VanDerWaalsContact C-N 3.32Å; L237-R239 PolarHBondContact O-N 3.46Å; L237-V240 PolarHBondContact O-N 2.87Å; L237-I241 HydrophobicContact CD2-CD1 3.7Å; L237-I241 HydrophobicContact CG-CD1 3.92Å; L237-I241 WeakPolarHBondContact O-CB 3.34Å; L237-I241 WeakPolarHBondContact O-CD1 3.49Å; L237-I241 WeakPolarHBondContact O-CG1 3.37Å; L237-I241 PolarHBondContact O-N 3.36Å; L237-L307 HydrophobicContact CD1-CD2 4.41Å; L237-L307 HydrophobicContact CD1-CG 4.44Å
238Y41.4Very low43.1Very low53 Ų5379.2 Ų79.221%0.20842%0.424CS..Hα-helixtrans-69.4-32.7179.7-79.9-72.8000112L169 V232 C235 N236 S242L169-Y238 HydrophobicContact CD2-CE1 4.34Å; V232-Y238 HydrophobicContact CG1-CD2 4.38Å; C235-Y238 HydrophobicContact CB-CD2 3.45Å; C235-Y238 VanDerWaalsContact CB-CD2 3.45Å; C235-Y238 HydrophobicContact CB-CE2 4.13Å; C235-Y238 HydrophobicContact CB-CG 4.43Å; C235-Y238 PolarHBondContact O-N 3.39Å; C235-Y238 VanDerWaalsContact O-N 3.15Å; N236-Y238 PolarHBondContact O-N 3.41Å; Y238-S242 WeakPolarHBondContact O-CB 3.48Å; Y238-S242 PolarHBondContact O-N 3.39Å
239R44.7Very low43.3Very low159 Ų15976.7 Ų76.760%0.641%0.41SS*.Hα-helixtrans-68.2-46172.8-75-177.5178.2175-0.2110.9N236 L237 S242 T243N236-R239 PolarHBondContact O-N 3.48Å; N236-R239 VanDerWaalsContact O-N 3.16Å; L237-R239 VanDerWaalsContact C-N 3.32Å; L237-R239 PolarHBondContact O-N 3.46Å; R239-S242 PolarHBondContact O-N 3.45Å; R239-T243 WeakPolarHBondContact O-CG2 3.26Å; R239-T243 PolarHBondContact O-N 3.12Å; R239-T243 PolarHBondContact O-OG1 3.46Å
240V44.9Very low43.5Very low55 Ų5574.4 Ų74.433%0.33340%0.401SS..Hα-helixtrans-62.6-43178.3173.80000111.7N236 L237 T243 S244N236-V240 WeakPolarHBondContact O-CG2 3.44Å; N236-V240 PolarHBondContact O-N 2.98Å; L237-V240 PolarHBondContact O-N 2.87Å; V240-T243 VanDerWaalsContact CA-OG1 3.29Å; V240-T243 WeakPolarHBondContact CA-OG1 3.43Å; V240-T243 PolarHBondContact O-N 3.14Å; V240-T243 PolarHBondContact O-OG1 2.89Å; V240-S244 WeakPolarHBondContact O-CB 3.24Å; V240-S244 PolarHBondContact O-N 3.31Å; V240-S244 PolarHBondContact O-OG 2.93Å
241I45.4Very low43.9Very low29 Ų2973.3 Ų73.315%0.14940%0.399CS..Hα-helixtrans-63.4-48.5173.4-67163.8000109.8P170 L237 T243 S244 F245P170-I241 HydrophobicContact CB-CD1 3.96Å; P170-I241 HydrophobicContact CG-CD1 4.21Å; L237-I241 HydrophobicContact CD2-CD1 3.7Å; L237-I241 HydrophobicContact CG-CD1 3.92Å; L237-I241 WeakPolarHBondContact O-CB 3.34Å; L237-I241 WeakPolarHBondContact O-CD1 3.49Å; L237-I241 WeakPolarHBondContact O-CG1 3.37Å; L237-I241 PolarHBondContact O-N 3.36Å; I241-T243 VanDerWaalsContact C-N 3.31Å; I241-T243 PolarHBondContact O-N 3.26Å; I241-S244 VanDerWaalsContact CA-OG 3.3Å; I241-S244 WeakPolarHBondContact CA-OG 3.34Å; I241-S244 PolarHBondContact O-N 2.91Å; I241-S244 PolarHBondContact O-OG 3.5Å; I241-F245 HydrophobicContact CG2-CD2 3.75Å; I241-F245 HydrophobicContact CG2-CE2 3.78Å; I241-F245 VanDerWaalsContact O-CD2 3.29Å; I241-F245 WeakPolarHBondContact O-CD2 3.42Å; I241-F245 PolarHBondContact O-N 3.45Å
242S45.4Very low44.4Very low7 Ų768.6 Ų68.65%0.04937%0.369CS..Hα-helixtrans-60.5-38.8178.3-1780000113S224 L228 Y238 R239 L246S224-S242 PolarHBondContact O-OG 2.81Å; L228-S242 WeakPolarHBondContact CD1-OG 3.39Å; Y238-S242 WeakPolarHBondContact O-CB 3.48Å; Y238-S242 PolarHBondContact O-N 3.39Å; R239-S242 PolarHBondContact O-N 3.45Å; S242-L246 WeakPolarHBondContact O-CB 3.43Å; S242-L246 PolarHBondContact O-N 3.31Å
243T46.9Very low44.6Very low73 Ų7370.6 Ų70.645%0.44837%0.373SS..Hα-helixtrans-71.9-34.917847.90000112.5L228 R239 V240 I241 L246 S247L228-T243 HydrophobicContact CD1-CG2 4.26Å; R239-T243 WeakPolarHBondContact O-CG2 3.26Å; R239-T243 PolarHBondContact O-N 3.12Å; R239-T243 PolarHBondContact O-OG1 3.46Å; V240-T243 VanDerWaalsContact CA-OG1 3.29Å; V240-T243 WeakPolarHBondContact CA-OG1 3.43Å; V240-T243 PolarHBondContact O-N 3.14Å; V240-T243 PolarHBondContact O-OG1 2.89Å; I241-T243 VanDerWaalsContact C-N 3.31Å; I241-T243 PolarHBondContact O-N 3.26Å; T243-L246 PolarHBondContact O-N 3.36Å; T243-S247 WeakPolarHBondContact O-CB 3.48Å; T243-S247 PolarHBondContact O-N 2.82Å; T243-S247 PolarHBondContact O-OG 3.5Å
244S45.4Very low44.7Very low39 Ų3965 Ų6527%0.27335%0.354SS..Hα-helixtrans-71.9-35.3175.648.20000112.1V240 I241 S247 M248V240-S244 WeakPolarHBondContact O-CB 3.24Å; V240-S244 PolarHBondContact O-N 3.31Å; V240-S244 PolarHBondContact O-OG 2.93Å; I241-S244 VanDerWaalsContact CA-OG 3.3Å; I241-S244 WeakPolarHBondContact CA-OG 3.34Å; I241-S244 PolarHBondContact O-N 2.91Å; I241-S244 PolarHBondContact O-OG 3.5Å; S244-S247 WeakPolarHBondContact CA-OG 3.24Å; S244-S247 PolarHBondContact O-N 3.11Å; S244-S247 PolarHBondContact O-OG 3.17Å; S244-M248 WeakPolarHBondContact O-CB 3.35Å; S244-M248 WeakPolarHBondContact O-CG 3.26Å; S244-M248 PolarHBondContact O-N 3.2Å
245F46Very low44.8Very low42 Ų4264 Ų6418%0.18434%0.34CS..Hα-helixtrans-62.8-46.3169.1-93.4-95.3000112.3L173 I241 S247 M248 E249L173-F245 HydrophobicContact CB-CZ 4.3Å; L173-F245 VanDerWaalsContact O-CZ 3.23Å; L173-F245 WeakPolarHBondContact O-CZ 3.29Å; I241-F245 HydrophobicContact CG2-CD2 3.75Å; I241-F245 HydrophobicContact CG2-CE2 3.78Å; I241-F245 VanDerWaalsContact O-CD2 3.29Å; I241-F245 WeakPolarHBondContact O-CD2 3.42Å; I241-F245 PolarHBondContact O-N 3.45Å; F245-S247 VanDerWaalsContact C-N 3.33Å; F245-S247 PolarHBondContact O-N 2.9Å; F245-M248 PolarHBondContact O-N 3.4Å; F245-E249 WeakPolarHBondContact O-CG 3.23Å; F245-E249 PolarHBondContact O-N 2.89Å
246L49.5Very low45.1Very low60 Ų6063.8 Ų63.831%0.31434%0.335SS..Hα-helixtrans-61.1-41.9178-158.793.4000111.5S242 T243 E249 V250S242-L246 WeakPolarHBondContact O-CB 3.43Å; S242-L246 PolarHBondContact O-N 3.31Å; T243-L246 PolarHBondContact O-N 3.36Å; L246-E249 PolarHBondContact O-N 3.48Å; L246-V250 WeakPolarHBondContact O-CB 3.08Å; L246-V250 VanDerWaalsContact O-CG2 3.22Å; L246-V250 WeakPolarHBondContact O-CG2 3.38Å; L246-V250 PolarHBondContact O-N 3.42Å
247S47Very low45.1Very low62 Ų6261.3 Ų61.343%0.43432%0.321SS..Hα-helixtrans-67-41.3178.369.30000112.1T243 S244 F245 E249 V250 V251T243-S247 WeakPolarHBondContact O-CB 3.48Å; T243-S247 PolarHBondContact O-N 2.82Å; T243-S247 PolarHBondContact O-OG 3.5Å; S244-S247 WeakPolarHBondContact CA-OG 3.24Å; S244-S247 PolarHBondContact O-N 3.11Å; S244-S247 PolarHBondContact O-OG 3.17Å; F245-S247 VanDerWaalsContact C-N 3.33Å; F245-S247 PolarHBondContact O-N 2.9Å; S247-E249 VanDerWaalsContact C-N 3.35Å; S247-E249 PolarHBondContact O-N 3.43Å; S247-V250 PolarHBondContact O-N 2.76Å; S247-V251 WeakPolarHBondContact O-CB 3.17Å; S247-V251 VanDerWaalsContact O-CG2 3.26Å; S247-V251 WeakPolarHBondContact O-CG2 3.37Å; S247-V251 PolarHBondContact O-N 2.93Å
248M46.1Very low45Very low59 Ų5961.6 Ų61.629%0.29133%0.328SS..Hα-helixtrans-64.2-38.6176.3-70.6-72.6-74.300112.1S244 F245 S252 I292S244-M248 WeakPolarHBondContact O-CB 3.35Å; S244-M248 WeakPolarHBondContact O-CG 3.26Å; S244-M248 PolarHBondContact O-N 3.2Å; F245-M248 PolarHBondContact O-N 3.4Å; M248-S252 VanDerWaalsContact O-CB 3.29Å; M248-S252 WeakPolarHBondContact O-CB 3.29Å; M248-S252 PolarHBondContact O-N 3.19Å; M248-S252 PolarHBondContact O-OG 2.83Å; M248-I292 HydrophobicContact CE-CB 4.48Å; M248-I292 HydrophobicContact CE-CD1 4.46Å; M248-I292 HydrophobicContact CE-CG1 3.92Å; M248-I292 HydrophobicContact CE-CG2 4.03Å
249E47.3Very low45Very low23 Ų2361.8 Ų61.811%0.10733%0.329CS..Hα-helixtrans-67.6-41.4174.5-76.6-176.5-169.500112.3L220 F245 L246 S247 S252 F253L220-E249 WeakPolarHBondContact CB-OE1 3.13Å; L220-E249 VanDerWaalsContact CD2-OE1 3.26Å; L220-E249 WeakPolarHBondContact CD2-OE1 3.4Å; F245-E249 WeakPolarHBondContact O-CG 3.23Å; F245-E249 PolarHBondContact O-N 2.89Å; L246-E249 PolarHBondContact O-N 3.48Å; S247-E249 VanDerWaalsContact C-N 3.35Å; S247-E249 PolarHBondContact O-N 3.43Å; E249-S252 PolarHBondContact O-N 3.27Å; E249-F253 VanDerWaalsContact O-CB 3.25Å; E249-F253 WeakPolarHBondContact O-CB 3.34Å; E249-F253 PolarHBondContact O-N 3.41Å
250V44.3Very low44.9Very low74 Ų7456.5 Ų56.545%0.44832%0.316SS..Hα-helixtrans-64.6-44.1175.9170.20000111.1L246 S247 F253 L254L246-V250 WeakPolarHBondContact O-CB 3.08Å; L246-V250 VanDerWaalsContact O-CG2 3.22Å; L246-V250 WeakPolarHBondContact O-CG2 3.38Å; L246-V250 PolarHBondContact O-N 3.42Å; S247-V250 PolarHBondContact O-N 2.76Å; V250-F253 PolarHBondContact O-N 2.98Å; V250-L254 HydrophobicContact CG1-CD1 3.94Å; V250-L254 HydrophobicContact CG1-CG 4.39Å; V250-L254 WeakPolarHBondContact O-CB 3.39Å; V250-L254 VanDerWaalsContact O-CG 3.29Å; V250-L254 WeakPolarHBondContact O-CG 3.49Å; V250-L254 PolarHBondContact O-N 3.39Å
251V44.2Very low44.5Very low78 Ų7856.1 Ų56.147%0.47332%0.319SS..Hα-helixtrans-62.9-43.9175.9171.30000110.6S247 F253 L254 L255S247-V251 WeakPolarHBondContact O-CB 3.17Å; S247-V251 VanDerWaalsContact O-CG2 3.26Å; S247-V251 WeakPolarHBondContact O-CG2 3.37Å; S247-V251 PolarHBondContact O-N 2.93Å; V251-F253 VanDerWaalsContact C-N 3.35Å; V251-F253 PolarHBondContact O-N 2.9Å; V251-L254 PolarHBondContact O-N 3.05Å; V251-L255 HydrophobicContact CG1-CD1 3.87Å; V251-L255 HydrophobicContact CG1-CG 4.43Å; V251-L255 WeakPolarHBondContact O-CB 3.41Å; V251-L255 VanDerWaalsContact O-CG 3.31Å; V251-L255 WeakPolarHBondContact O-CG 3.29Å; V251-L255 PolarHBondContact O-N 2.71Å
252S45Very low44.2Very low19 Ų1960.4 Ų60.413%0.13333%0.334CS..Hα-helixtrans-61.5-43.7175.7-59.70000111.5T181 M248 E249 L255 I256T181-S252 WeakPolarHBondContact CG2-OG 3.4Å; M248-S252 VanDerWaalsContact O-CB 3.29Å; M248-S252 WeakPolarHBondContact O-CB 3.29Å; M248-S252 PolarHBondContact O-N 3.19Å; M248-S252 PolarHBondContact O-OG 2.83Å; E249-S252 PolarHBondContact O-N 3.27Å; S252-L255 PolarHBondContact O-N 2.94Å; S252-I256 WeakPolarHBondContact O-CB 3.42Å; S252-I256 WeakPolarHBondContact O-CD1 3.4Å; S252-I256 WeakPolarHBondContact O-CG1 3.31Å; S252-I256 PolarHBondContact O-N 3.48Å
253F44.9Very low44Very low91 Ų9164.1 Ų64.140%0.39935%0.349SS..Hα-helixtrans-63.5-43.2177-178.4-105.8000112.2E249 V250 V251 I256 L257E249-F253 VanDerWaalsContact O-CB 3.25Å; E249-F253 WeakPolarHBondContact O-CB 3.34Å; E249-F253 PolarHBondContact O-N 3.41Å; V250-F253 PolarHBondContact O-N 2.98Å; V251-F253 VanDerWaalsContact C-N 3.35Å; V251-F253 PolarHBondContact O-N 2.9Å; F253-I256 PolarHBondContact O-N 3.22Å; F253-L257 HydrophobicContact CD1-CD1 3.69Å; F253-L257 HydrophobicContact CE1-CD1 3.18Å; F253-L257 HydrophobicContact CE1-CG 4.47Å; F253-L257 HydrophobicContact CE2-CD1 4.23Å; F253-L257 HydrophobicContact CG-CD1 4.41Å; F253-L257 HydrophobicContact CZ-CD1 3.49Å; F253-L257 VanDerWaalsContact CZ-CD1 3.49Å; F253-L257 HydrophobicContact CZ-CG 4.47Å; F253-L257 WeakPolarHBondContact O-CB 3.47Å; F253-L257 PolarHBondContact O-N 3.45Å
254L41.5Very low43.5Very low102 Ų10269.8 Ų69.853%0.53437%0.368SS..Hα-helixtrans-66.7-37.7176.6-72.8172.1000112.4V250 V251 L257 S258V250-L254 HydrophobicContact CG1-CD1 3.94Å; V250-L254 HydrophobicContact CG1-CG 4.39Å; V250-L254 WeakPolarHBondContact O-CB 3.39Å; V250-L254 VanDerWaalsContact O-CG 3.29Å; V250-L254 WeakPolarHBondContact O-CG 3.49Å; V250-L254 PolarHBondContact O-N 3.39Å; V251-L254 PolarHBondContact O-N 3.05Å; L254-L257 PolarHBondContact O-N 2.73Å; L254-S258 WeakPolarHBondContact O-CB 3.26Å; L254-S258 PolarHBondContact O-N 2.91Å; L254-S258 PolarHBondContact O-OG 2.88Å
255L44.9Very low42.9Very low81 Ų8178 Ų7842%0.42439%0.394SS..Hα-helixtrans-68-37.5174.2-75169000112.2V251 S252 S258 Y259 V288V251-L255 HydrophobicContact CG1-CD1 3.87Å; V251-L255 HydrophobicContact CG1-CG 4.43Å; V251-L255 WeakPolarHBondContact O-CB 3.41Å; V251-L255 VanDerWaalsContact O-CG 3.31Å; V251-L255 WeakPolarHBondContact O-CG 3.29Å; V251-L255 PolarHBondContact O-N 2.71Å; S252-L255 PolarHBondContact O-N 2.94Å; L255-S258 WeakPolarHBondContact CA-OG 3.37Å; L255-S258 PolarHBondContact O-OG 3.28Å; L255-Y259 WeakPolarHBondContact O-CB 3.14Å; L255-Y259 PolarHBondContact O-N 2.92Å; L255-V288 HydrophobicContact CD1-CG2 4.16Å
256I45.8Very low42.2Very low43 Ų4378.4 Ų78.422%0.22140%0.398CS..Hα-helixtrans-65.9-45.4173.7-72.1164.4000110.2F188 S252 F253 Y259 S260F188-I256 HydrophobicContact CD2-CG2 4.41Å; F188-I256 HydrophobicContact CE2-CG2 3.65Å; F188-I256 HydrophobicContact CZ-CG2 3.79Å; S252-I256 WeakPolarHBondContact O-CB 3.42Å; S252-I256 WeakPolarHBondContact O-CD1 3.4Å; S252-I256 WeakPolarHBondContact O-CG1 3.31Å; S252-I256 PolarHBondContact O-N 3.48Å; F253-I256 PolarHBondContact O-N 3.22Å; I256-Y259 PolarHBondContact O-N 3.39Å; I256-S260 VanDerWaalsContact O-CB 3.3Å; I256-S260 WeakPolarHBondContact O-CB 3.41Å; I256-S260 PolarHBondContact O-N 3.35Å; I256-S260 PolarHBondContact O-OG 3.36Å
257L44Very low41.7Very low80 Ų8078.7 Ų78.742%0.41941%0.405SS..Hα-helixtrans-60.5-45.9174.8-102.3155.7000111.5F253 L254 S260 A261F253-L257 HydrophobicContact CD1-CD1 3.69Å; F253-L257 HydrophobicContact CE1-CD1 3.18Å; F253-L257 HydrophobicContact CE1-CG 4.47Å; F253-L257 HydrophobicContact CE2-CD1 4.23Å; F253-L257 HydrophobicContact CG-CD1 4.41Å; F253-L257 HydrophobicContact CZ-CD1 3.49Å; F253-L257 VanDerWaalsContact CZ-CD1 3.49Å; F253-L257 HydrophobicContact CZ-CG 4.47Å; F253-L257 WeakPolarHBondContact O-CB 3.47Å; F253-L257 PolarHBondContact O-N 3.45Å; L254-L257 PolarHBondContact O-N 2.73Å; L257-S260 WeakPolarHBondContact CA-OG 3.23Å; L257-S260 PolarHBondContact O-N 2.86Å; L257-S260 PolarHBondContact O-OG 2.86Å; L257-A261 WeakPolarHBondContact O-CB 3.29Å; L257-A261 PolarHBondContact O-N 3.48Å
258S39.9Very low41.4Very low64 Ų6481.3 Ų81.345%0.44841%0.41SS..Hα-helixtrans-67.6-39-179.969.10000112.3L254 L255 A261 W262L254-S258 WeakPolarHBondContact O-CB 3.26Å; L254-S258 PolarHBondContact O-N 2.91Å; L254-S258 PolarHBondContact O-OG 2.88Å; L255-S258 WeakPolarHBondContact CA-OG 3.37Å; L255-S258 PolarHBondContact O-OG 3.28Å; S258-A261 PolarHBondContact O-N 3.3Å; S258-W262 WeakPolarHBondContact O-CB 3.44Å; S258-W262 PolarHBondContact O-N 2.87Å
259Y42.8Very low41.1Very low57 Ų5782.6 Ų82.622%0.22443%0.425CS..Hα-helixtrans-66.8-43.5173.1-177.2-82.7000111.8F188 L255 I256 A261 W262 K263 I284F188-Y259 HydrophobicContact CD1-CD1 4.13Å; F188-Y259 HydrophobicContact CD1-CE1 4.22Å; F188-Y259 AromaticContact CE1-CD1 3.22Å; F188-Y259 HydrophobicContact CE1-CD1 3.22Å; F188-Y259 AromaticContact CE1-CE1 3.67Å; F188-Y259 HydrophobicContact CE1-CE1 3.67Å; F188-Y259 AromaticContact CE1-CG 3.93Å; F188-Y259 HydrophobicContact CE1-CG 3.93Å; F188-Y259 AromaticContact CZ-CD1 3.95Å; F188-Y259 HydrophobicContact CZ-CD1 3.95Å; L255-Y259 WeakPolarHBondContact O-CB 3.14Å; L255-Y259 PolarHBondContact O-N 2.92Å; I256-Y259 PolarHBondContact O-N 3.39Å; Y259-A261 VanDerWaalsContact C-N 3.33Å; Y259-A261 PolarHBondContact O-N 2.91Å; Y259-W262 HydrophobicContact CD2-CE3 4.26Å; Y259-W262 PolarHBondContact O-N 2.81Å; Y259-K263 HydrophobicContact CE1-CD 4.1Å; Y259-K263 WeakPolarHBondContact O-CB 3.34Å; Y259-K263 PolarHBondContact O-N 2.84Å; Y259-I284 HydrophobicContact CD2-CD1 4.43Å; Y259-I284 HydrophobicContact CE2-CD1 4.28Å
260S41.8Very low40.6Very low48 Ų4883.2 Ų83.234%0.33643%0.432SS..Hα-helixtrans-62.7-42.4177.171.10000111I256 L257 K263 F264I256-S260 VanDerWaalsContact O-CB 3.3Å; I256-S260 WeakPolarHBondContact O-CB 3.41Å; I256-S260 PolarHBondContact O-N 3.35Å; I256-S260 PolarHBondContact O-OG 3.36Å; L257-S260 WeakPolarHBondContact CA-OG 3.23Å; L257-S260 PolarHBondContact O-N 2.86Å; L257-S260 PolarHBondContact O-OG 2.86Å; S260-K263 PolarHBondContact O-N 3.48Å; S260-F264 WeakPolarHBondContact O-CB 3.29Å; S260-F264 PolarHBondContact O-N 2.91Å
261A36.6Very low40.2Very low48 Ų4883 Ų8340%0.39743%0.428SS..Hα-helixtrans-64.4-44.1174.700000111.4L257 S258 Y259 K263 F264 Y265L257-A261 WeakPolarHBondContact O-CB 3.29Å; L257-A261 PolarHBondContact O-N 3.48Å; S258-A261 PolarHBondContact O-N 3.3Å; Y259-A261 VanDerWaalsContact C-N 3.33Å; Y259-A261 PolarHBondContact O-N 2.91Å; A261-K263 PolarHBondContact O-N 3.44Å; A261-F264 PolarHBondContact O-N 2.9Å; A261-Y265 WeakPolarHBondContact O-CB 3.27Å; A261-Y265 PolarHBondContact O-N 3.44Å
262W38.8Very low39.8Very low119 Ų11987.5 Ų87.545%0.45145%0.446SS..Hα-helixtrans-61.9-43.4177.7-174.340.8000112S258 Y259 L266 I279 I284S258-W262 WeakPolarHBondContact O-CB 3.44Å; S258-W262 PolarHBondContact O-N 2.87Å; Y259-W262 HydrophobicContact CD2-CE3 4.26Å; Y259-W262 PolarHBondContact O-N 2.81Å; W262-L266 VanDerWaalsContact CD1-CD1 3.41Å; W262-L266 HydrophobicContact CG-CD1 4.3Å; W262-L266 WeakPolarHBondContact O-CB 3.36Å; W262-L266 PolarHBondContact O-N 3.33Å; W262-I279 HydrophobicContact CH2-CD1 4.41Å; W262-I284 HydrophobicContact CH2-CD1 4.27Å; W262-I284 HydrophobicContact CZ3-CD1 3.61Å
263K42.3Very low39.4Very low85 Ų8594.9 Ų94.937%0.3748%0.478SS..Hα-helixtrans-71.4-28.5176.3-163177.9-179.5179.50112.8S192 Y259 S260 A261S192-K263 PolarHBondContact O-NZ 2.88Å; Y259-K263 HydrophobicContact CE1-CD 4.1Å; Y259-K263 WeakPolarHBondContact O-CB 3.34Å; Y259-K263 PolarHBondContact O-N 2.84Å; S260-K263 PolarHBondContact O-N 3.48Å; A261-K263 PolarHBondContact O-N 3.44Å
264F35.6Very low38.9Very low192 Ų19295.8 Ų95.884%0.84249%0.486SS*.Hα-helixtrans-79.5-35.4174.7-134.1-87.4000112.6S260 A261S260-F264 WeakPolarHBondContact O-CB 3.29Å; S260-F264 PolarHBondContact O-N 2.91Å; A261-F264 PolarHBondContact O-N 2.9Å
265Y31.9Very low38.3Very low212 Ų21294.5 Ų94.583%0.83150%0.498SS*.Hα-helixtrans-75.7-32.8179.4-123-90.8000112.4A261 S267A261-Y265 WeakPolarHBondContact O-CB 3.27Å; A261-Y265 PolarHBondContact O-N 3.44Å; Y265-S267 PolarHBondContact O-N 3.4Å
266L32.6Very low37.6Very low50 Ų5099 Ų9926%0.26251%0.51SS..SBendtrans-91.777.9172.1-70.4166000109.1W262 E268 L271W262-L266 VanDerWaalsContact CD1-CD1 3.41Å; W262-L266 HydrophobicContact CG-CD1 4.3Å; W262-L266 WeakPolarHBondContact O-CB 3.36Å; W262-L266 PolarHBondContact O-N 3.33Å; L266-E268 PolarHBondContact O-N 3.45Å; L266-L271 HydrophobicContact CB-CD1 3.81Å; L266-L271 HydrophobicContact CD1-CD1 3.96Å; L266-L271 HydrophobicContact CD1-CG 4.38Å; L266-L271 HydrophobicContact CD2-CD1 4.49Å; L266-L271 HydrophobicContact CD2-CG 4.35Å; L266-L271 HydrophobicContact CG-CD1 4.32Å
267S39.3Very low36.9Very low65 Ų65101.1 Ų101.146%0.45553%0.534SS..  trans-49.9134.715958.40000108.4Y265 S269 S270Y265-S267 PolarHBondContact O-N 3.4Å; S267-S269 PolarHBondContact O-N 3.18Å; S267-S269 PolarHBondContact OG-OG 3.17Å; S267-S270 PolarHBondContact O-N 3.43Å; S267-S270 PolarHBondContact O-OG 2.85Å
268E40.3Very low36.4Very low117 Ų117106 Ų10655%0.54756%0.555SS.*Hα-helixtrans-48.3-22-177.9-74.7178.5153.700113.2L266 S270L266-E268 PolarHBondContact O-N 3.45Å; E268-S270 PolarHBondContact O-N 2.96Å
269S39.1Very low36.4Very low86 Ų86107.6 Ų107.660%0.60156%0.558SS**Hα-helixtrans-65.3-27.8173.249.10000115.8S267S267-S269 PolarHBondContact O-N 3.18Å; S267-S269 PolarHBondContact OG-OG 3.17Å
270S37.3Very low36Very low37 Ų37107.4 Ų107.426%0.25957%0.565SS.*Hα-helixtrans-90.8-29.8-176.457.60000113.4S267 E268 H273S267-S270 PolarHBondContact O-N 3.43Å; S267-S270 PolarHBondContact O-OG 2.85Å; E268-S270 PolarHBondContact O-N 2.96Å; S270-H273 PolarHBondContact O-N 2.91Å
271L36.5Very low35.8Very low70 Ų70107.1 Ų107.137%0.36656%0.562SS.*Hα-helixtrans-70.7-36.2179.2-106.2151.5000112.9L266 H273 L274L266-L271 HydrophobicContact CB-CD1 3.81Å; L266-L271 HydrophobicContact CD1-CD1 3.96Å; L266-L271 HydrophobicContact CD1-CG 4.38Å; L266-L271 HydrophobicContact CD2-CD1 4.49Å; L266-L271 HydrophobicContact CD2-CG 4.35Å; L266-L271 HydrophobicContact CG-CD1 4.32Å; L271-H273 PolarHBondContact O-N 2.89Å; L271-L274 PolarHBondContact O-N 3.19Å
272M35.1Very low35.7Very low171 Ų171109.9 Ų109.984%0.84257%0.567SS**Hα-helixtrans-65.3-21.3176.4-72.7-77-9700113.2
273H36.9Very low35.4Very low175 Ų175107.9 Ų107.981%0.8157%0.568SS**Hα-helixtrans-91.9-13.9178.7-84.9-19.7000114.7S270 L271S270-H273 PolarHBondContact O-N 2.91Å; L271-H273 PolarHBondContact O-N 2.89Å
274L33Very low35.3Very low109 Ų109106.3 Ų106.357%0.57156%0.563SS**Hα-helixtrans-103.2-1.6-171.1-93.9154.8000113.8L271 Y276L271-L274 PolarHBondContact O-N 3.19Å; L274-Y276 HydrophobicContact CB-CD2 4.08Å; L274-Y276 HydrophobicContact CD2-CE2 4.37Å; L274-Y276 WeakPolarHBondContact O-CD2 3.25Å; L274-Y276 PolarHBondContact O-N 2.79Å
275G29.8Very low35.3Very low76 Ų76101.3 Ų101.378%0.78454%0.541SS*.  trans61.210.2172.700000114.8A277G275-A277 PolarHBondContact O-N 2.96Å
276Y30.1Very low35.5Very low174 Ų17495.6 Ų95.668%0.68252%0.524SS*.  trans-76.5112.1176.4-85-89.4000108.4L274 E278L274-Y276 HydrophobicContact CB-CD2 4.08Å; L274-Y276 HydrophobicContact CD2-CE2 4.37Å; L274-Y276 WeakPolarHBondContact O-CD2 3.25Å; L274-Y276 PolarHBondContact O-N 2.79Å; Y276-E278 PolarHBondContact O-N 3.39Å
277A30.5Very low35.7Very low88 Ų8896.9 Ų96.973%0.72753%0.534SS*.  trans-50.3129.1167.900000109G275 I279G275-A277 PolarHBondContact O-N 2.96Å; A277-I279 PolarHBondContact O-N 3.27Å
278E35.1Very low35.8Very low183 Ų18396 Ų9686%0.85553%0.526SS*.  trans-42111172.8-70.1178147.200109.4Y276 S280Y276-E278 PolarHBondContact O-N 3.39Å; E278-S280 VanDerWaalsContact C-N 3.3Å; E278-S280 PolarHBondContact O-N 2.79Å
279I38.1Very low35.8Very low98 Ų9893.4 Ų93.450%0.50352%0.515SS..  trans-64.8103166.5-62.6173.4000104.6W262 A277 S281 V283 I284W262-I279 HydrophobicContact CH2-CD1 4.41Å; A277-I279 PolarHBondContact O-N 3.27Å; I279-S281 PolarHBondContact O-N 3.29Å; I279-V283 HydrophobicContact CG2-CB 3.94Å; I279-V283 HydrophobicContact CG2-CG1 4.09Å; I279-I284 HydrophobicContact CG2-CD1 4.45Å; I279-I284 HydrophobicContact CG2-CG1 4.18Å
280S35.1Very low35.7Very low53 Ų5396 Ų9637%0.37152%0.516SS..  trans-54137.9-176.671.90000109.5E278 H282 V283E278-S280 VanDerWaalsContact C-N 3.3Å; E278-S280 PolarHBondContact O-N 2.79Å; S280-H282 PolarHBondContact O-N 3.47Å; S280-V283 WeakPolarHBondContact O-CB 3.44Å; S280-V283 PolarHBondContact O-N 3.1Å
281S37.1Very low35.7Very low41 Ų4197.7 Ų97.729%0.28753%0.527SS..Hα-helixtrans-50.4-24.8177.2510000113I279 F285I279-S281 PolarHBondContact O-N 3.29Å; S281-F285 VanDerWaalsContact O-CB 3.23Å; S281-F285 WeakPolarHBondContact O-CB 3.38Å; S281-F285 PolarHBondContact O-N 3.41Å
282H34.7Very low36Very low107 Ų10796 Ų9650%0.49552%0.518SS..Hα-helixtrans-65.4-34174.5-55.2-62.3000113.6S280 L286S280-H282 PolarHBondContact O-N 3.47Å; H282-L286 VanDerWaalsContact O-CB 3.3Å; H282-L286 WeakPolarHBondContact O-CB 3.36Å; H282-L286 WeakPolarHBondContact O-CD1 3.48Å; H282-L286 VanDerWaalsContact O-CG 3.3Å; H282-L286 WeakPolarHBondContact O-CG 3.36Å; H282-L286 PolarHBondContact O-N 2.91Å
283V33.1Very low36Very low76 Ų7692.4 Ų92.446%0.46150%0.502SS..Hα-helixtrans-67.7-48.4177.3175.70000109.5I279 S280 F285 L286 T287I279-V283 HydrophobicContact CG2-CB 3.94Å; I279-V283 HydrophobicContact CG2-CG1 4.09Å; S280-V283 WeakPolarHBondContact O-CB 3.44Å; S280-V283 PolarHBondContact O-N 3.1Å; V283-F285 VanDerWaalsContact C-N 3.32Å; V283-F285 PolarHBondContact O-N 3.29Å; V283-L286 WeakPolarHBondContact O-CB 3.38Å; V283-L286 PolarHBondContact O-N 2.64Å; V283-T287 PolarHBondContact O-N 3.47Å; V283-T287 PolarHBondContact O-OG1 2.89Å
284I39Very low36.1Very low53 Ų5391.3 Ų91.327%0.27249%0.492SS..Hα-helixtrans-62.4-41.5177-60.4167.9000110.7Y259 W262 I279 T287 V288Y259-I284 HydrophobicContact CD2-CD1 4.43Å; Y259-I284 HydrophobicContact CE2-CD1 4.28Å; W262-I284 HydrophobicContact CH2-CD1 4.27Å; W262-I284 HydrophobicContact CZ3-CD1 3.61Å; I279-I284 HydrophobicContact CG2-CD1 4.45Å; I279-I284 HydrophobicContact CG2-CG1 4.18Å; I284-T287 PolarHBondContact O-N 3.21Å; I284-V288 WeakPolarHBondContact O-CG2 3.26Å; I284-V288 PolarHBondContact O-N 3.13Å
285F36.8Very low36.5Very low87 Ų8789.1 Ų89.138%0.38248%0.482SS..Hα-helixtrans-61.7-43.1175-179.6-103.6000112.4S281 V283 V288 I289S281-F285 VanDerWaalsContact O-CB 3.23Å; S281-F285 WeakPolarHBondContact O-CB 3.38Å; S281-F285 PolarHBondContact O-N 3.41Å; V283-F285 VanDerWaalsContact C-N 3.32Å; V283-F285 PolarHBondContact O-N 3.29Å; F285-V288 PolarHBondContact O-N 3.32Å; F285-I289 HydrophobicContact CD1-CD1 3.76Å; F285-I289 HydrophobicContact CE1-CD1 3.25Å; F285-I289 HydrophobicContact CE1-CG1 4.43Å; F285-I289 HydrophobicContact CE2-CD1 4.11Å; F285-I289 HydrophobicContact CG-CD1 4.38Å; F285-I289 HydrophobicContact CZ-CD1 3.46Å; F285-I289 VanDerWaalsContact CZ-CD1 3.46Å; F285-I289 HydrophobicContact CZ-CG1 4.45Å; F285-I289 WeakPolarHBondContact O-CG1 3.06Å; F285-I289 PolarHBondContact O-N 3.42Å
286L36.3Very low36.9Very low92 Ų9291.2 Ų91.248%0.48247%0.468SS..Hα-helixtrans-63.6-41.7173.1-81.6161.1000111H282 V283 V288 I289 F290H282-L286 VanDerWaalsContact O-CB 3.3Å; H282-L286 WeakPolarHBondContact O-CB 3.36Å; H282-L286 WeakPolarHBondContact O-CD1 3.48Å; H282-L286 VanDerWaalsContact O-CG 3.3Å; H282-L286 WeakPolarHBondContact O-CG 3.36Å; H282-L286 PolarHBondContact O-N 2.91Å; V283-L286 WeakPolarHBondContact O-CB 3.38Å; V283-L286 PolarHBondContact O-N 2.64Å; L286-V288 PolarHBondContact O-N 3.14Å; L286-I289 PolarHBondContact O-N 3.43Å; L286-F290 HydrophobicContact CD2-CE2 4.43Å; L286-F290 WeakPolarHBondContact O-CB 3.07Å; L286-F290 VanDerWaalsContact O-CD2 3.27Å; L286-F290 WeakPolarHBondContact O-CD2 3.45Å; L286-F290 PolarHBondContact O-N 2.87Å
287T37.4Very low37.2Very low76 Ų7689.8 Ų89.847%0.46647%0.467SS..Hα-helixtrans-63.1-41.4176.7-18.70000111.7V283 I284 F290 C291V283-T287 PolarHBondContact O-N 3.47Å; V283-T287 PolarHBondContact O-OG1 2.89Å; I284-T287 PolarHBondContact O-N 3.21Å; T287-F290 PolarHBondContact O-N 3.41Å; T287-C291 WeakPolarHBondContact O-CB 3.2Å; T287-C291 PolarHBondContact O-N 2.85Å; T287-C291 PolarHBondContact O-SG 3.48Å
288V40.1Very low37.7Very low48 Ų4889.6 Ų89.629%0.29145%0.454SS..Hα-helixtrans-65.1-44.7176.4173.10000110.9L255 I284 F285 L286 C291 I292L255-V288 HydrophobicContact CD1-CG2 4.16Å; I284-V288 WeakPolarHBondContact O-CG2 3.26Å; I284-V288 PolarHBondContact O-N 3.13Å; F285-V288 PolarHBondContact O-N 3.32Å; L286-V288 PolarHBondContact O-N 3.14Å; V288-C291 PolarHBondContact O-N 2.88Å; V288-I292 HydrophobicContact CG1-CD1 3.77Å; V288-I292 HydrophobicContact CG1-CG1 4.39Å; V288-I292 WeakPolarHBondContact O-CB 3.46Å; V288-I292 WeakPolarHBondContact O-CG1 3.44Å; V288-I292 PolarHBondContact O-N 2.87Å
289I39.6Very low37.9Very low62 Ų6284.3 Ų84.332%0.31843%0.431SS..Hα-helixtrans-62-43.7174.8-72.5176.7000111.1F285 L286 I292 L293F285-I289 HydrophobicContact CD1-CD1 3.76Å; F285-I289 HydrophobicContact CE1-CD1 3.25Å; F285-I289 HydrophobicContact CE1-CG1 4.43Å; F285-I289 HydrophobicContact CE2-CD1 4.11Å; F285-I289 HydrophobicContact CG-CD1 4.38Å; F285-I289 HydrophobicContact CZ-CD1 3.46Å; F285-I289 VanDerWaalsContact CZ-CD1 3.46Å; F285-I289 HydrophobicContact CZ-CG1 4.45Å; F285-I289 WeakPolarHBondContact O-CG1 3.06Å; F285-I289 PolarHBondContact O-N 3.42Å; L286-I289 PolarHBondContact O-N 3.43Å; I289-I292 PolarHBondContact O-N 3.29Å; I289-L293 HydrophobicContact CG2-CD1 3.62Å; I289-L293 HydrophobicContact CG2-CG 4.17Å; I289-L293 VanDerWaalsContact O-CB 3.31Å; I289-L293 WeakPolarHBondContact O-CB 3.32Å; I289-L293 VanDerWaalsContact O-CG 3.26Å; I289-L293 WeakPolarHBondContact O-CG 3.31Å; I289-L293 PolarHBondContact O-N 3.21Å
290F37.1Very low37.9Very low139 Ų13983.5 Ų83.561%0.6143%0.427SS*.Hα-helixtrans-63.6-40.2176.4-94.3-73.9000111.8L286 T287 L293 Y294L286-F290 HydrophobicContact CD2-CE2 4.43Å; L286-F290 WeakPolarHBondContact O-CB 3.07Å; L286-F290 VanDerWaalsContact O-CD2 3.27Å; L286-F290 WeakPolarHBondContact O-CD2 3.45Å; L286-F290 PolarHBondContact O-N 2.87Å; T287-F290 PolarHBondContact O-N 3.41Å; F290-L293 PolarHBondContact O-N 2.86Å; F290-Y294 WeakPolarHBondContact O-CB 3.31Å; F290-Y294 PolarHBondContact O-N 3.44Å
291C38.4Very low37.8Very low74 Ų7483.9 Ų83.950%0.543%0.429SS..Hα-helixtrans-65.1-41.8174.1-72.10000111.8T287 V288 Y294 V295T287-C291 WeakPolarHBondContact O-CB 3.2Å; T287-C291 PolarHBondContact O-N 2.85Å; T287-C291 PolarHBondContact O-SG 3.48Å; V288-C291 PolarHBondContact O-N 2.88Å; C291-Y294 PolarHBondContact O-N 2.77Å; C291-V295 WeakPolarHBondContact O-CB 3.44Å; C291-V295 WeakPolarHBondContact O-CG2 3.19Å; C291-V295 PolarHBondContact O-N 3.5Å
292I41.9Very low38Very low34 Ų3485.3 Ų85.317%0.17444%0.438CS..Hα-helixtrans-64.9-46176.4-68.1169.2000110.5L178 M248 V288 I289 V295 Y296L178-I292 HydrophobicContact CD2-CG2 4.16Å; M248-I292 HydrophobicContact CE-CB 4.48Å; M248-I292 HydrophobicContact CE-CD1 4.46Å; M248-I292 HydrophobicContact CE-CG1 3.92Å; M248-I292 HydrophobicContact CE-CG2 4.03Å; V288-I292 HydrophobicContact CG1-CD1 3.77Å; V288-I292 HydrophobicContact CG1-CG1 4.39Å; V288-I292 WeakPolarHBondContact O-CB 3.46Å; V288-I292 WeakPolarHBondContact O-CG1 3.44Å; V288-I292 PolarHBondContact O-N 2.87Å; I289-I292 PolarHBondContact O-N 3.29Å; I292-V295 PolarHBondContact O-N 3.31Å; I292-Y296 WeakPolarHBondContact O-CB 3.4Å; I292-Y296 PolarHBondContact O-N 2.8Å
293L37Very low37.9Very low95 Ų9582.4 Ų82.450%0.49743%0.427SS..Hα-helixtrans-63.9-40.6176.5-73.8170.5000111.5I289 F290 Y296 E297I289-L293 HydrophobicContact CG2-CD1 3.62Å; I289-L293 HydrophobicContact CG2-CG 4.17Å; I289-L293 VanDerWaalsContact O-CB 3.31Å; I289-L293 WeakPolarHBondContact O-CB 3.32Å; I289-L293 VanDerWaalsContact O-CG 3.26Å; I289-L293 WeakPolarHBondContact O-CG 3.31Å; I289-L293 PolarHBondContact O-N 3.21Å; F290-L293 PolarHBondContact O-N 2.86Å; L293-Y296 CarbonylContact O-C 3.59Å; L293-Y296 WeakPolarHBondContact O-CB 3.36Å; L293-Y296 PolarHBondContact O-N 3.39Å; L293-E297 VanDerWaalsContact O-CB 3.27Å; L293-E297 WeakPolarHBondContact O-CB 3.27Å; L293-E297 PolarHBondContact O-N 2.8Å
294Y37.8Very low37.8Very low153 Ų15383.8 Ų83.860%0.643%0.428SS*.Hα-helixtrans-65.8-40.1176.7-177.3-98.8000112.2F290 C291 Y296 N298F290-Y294 WeakPolarHBondContact O-CB 3.31Å; F290-Y294 PolarHBondContact O-N 3.44Å; C291-Y294 PolarHBondContact O-N 2.77Å; Y294-Y296 VanDerWaalsContact C-N 3.34Å; Y294-N298 VanDerWaalsContact CE1-ND2 3.28Å; Y294-N298 WeakPolarHBondContact CE1-ND2 3.43Å; Y294-N298 WeakPolarHBondContact CE2-ND2 3.3Å; Y294-N298 WeakPolarHBondContact O-CB 3.39Å; Y294-N298 PolarHBondContact O-N 3.12Å; Y294-N298 VanDerWaalsContact O-N 3.12Å; Y294-N298 PolarHBondContact O-ND2 3.49Å
295V40.6Very low37.7Very low62 Ų6287.6 Ų87.638%0.37645%0.448SS..Hα-helixtrans-65.1-41.7172.1170.50000109.9C291 I292 L299C291-V295 WeakPolarHBondContact O-CB 3.44Å; C291-V295 WeakPolarHBondContact O-CG2 3.19Å; C291-V295 PolarHBondContact O-N 3.5Å; I292-V295 PolarHBondContact O-N 3.31Å; V295-L299 HydrophobicContact CG1-CD1 3.47Å; V295-L299 VanDerWaalsContact CG1-CD1 3.47Å; V295-L299 VanDerWaalsContact O-CB 3.29Å; V295-L299 WeakPolarHBondContact O-CB 3.21Å; V295-L299 WeakPolarHBondContact O-CD1 3.4Å; V295-L299 PolarHBondContact O-N 3.49Å
296Y39.6Very low37.6Very low121 Ų12189.2 Ų89.248%0.47546%0.457SS..Hα-helixtrans-64.6-45.7178.5-150.9-91.1000112.2I292 L293 Y294 N298 L299 L300I292-Y296 WeakPolarHBondContact O-CB 3.4Å; I292-Y296 PolarHBondContact O-N 2.8Å; L293-Y296 CarbonylContact O-C 3.59Å; L293-Y296 WeakPolarHBondContact O-CB 3.36Å; L293-Y296 PolarHBondContact O-N 3.39Å; Y294-Y296 VanDerWaalsContact C-N 3.34Å; Y296-N298 VanDerWaalsContact C-N 3.32Å; Y296-N298 PolarHBondContact O-N 2.9Å; Y296-L299 PolarHBondContact O-N 2.86Å; Y296-L300 HydrophobicContact CE1-CD1 4.01Å; Y296-L300 VanDerWaalsContact O-CB 3.23Å; Y296-L300 WeakPolarHBondContact O-CB 3.34Å; Y296-L300 PolarHBondContact O-N 3.19Å
297E36.5Very low37.3Very low143 Ų14389.7 Ų89.767%0.66846%0.459SS*.Hα-helixtrans-68.9-29.7-178.5-164.3172.3-162.700112.2L293 P301L293-E297 VanDerWaalsContact O-CB 3.27Å; L293-E297 WeakPolarHBondContact O-CB 3.27Å; L293-E297 PolarHBondContact O-N 2.8Å; E297-P301 WeakPolarHBondContact O-CD 3.31Å; E297-P301 WeakPolarHBondContact O-CG 3.28Å
298N41.5Very low37.1Very low85 Ų8594.3 Ų94.346%0.45547%0.473SS..Hα-helixtrans-87.6-26.9174.3-70.1-51.6000113.9Y294 Y296 S302Y294-N298 VanDerWaalsContact CE1-ND2 3.28Å; Y294-N298 WeakPolarHBondContact CE1-ND2 3.43Å; Y294-N298 WeakPolarHBondContact CE2-ND2 3.3Å; Y294-N298 WeakPolarHBondContact O-CB 3.39Å; Y294-N298 PolarHBondContact O-N 3.12Å; Y294-N298 VanDerWaalsContact O-N 3.12Å; Y294-N298 PolarHBondContact O-ND2 3.49Å; Y296-N298 VanDerWaalsContact C-N 3.32Å; Y296-N298 PolarHBondContact O-N 2.9Å; N298-S302 PolarHBondContact O-OG 2.8Å
299L37.6Very low36.5Very low72 Ų7295.6 Ų95.638%0.37749%0.485SS..Hα-helixtrans-82.9-29.5174.9-101111.6000113.4V295 Y296 S302 L303V295-L299 HydrophobicContact CG1-CD1 3.47Å; V295-L299 VanDerWaalsContact CG1-CD1 3.47Å; V295-L299 VanDerWaalsContact O-CB 3.29Å; V295-L299 WeakPolarHBondContact O-CB 3.21Å; V295-L299 WeakPolarHBondContact O-CD1 3.4Å; V295-L299 PolarHBondContact O-N 3.49Å; Y296-L299 PolarHBondContact O-N 2.86Å; L299-S302 PolarHBondContact O-N 2.82Å; L299-L303 HydrophobicContact CB-CD1 4.48Å; L299-L303 HydrophobicContact CD2-CD1 4.46Å; L299-L303 WeakPolarHBondContact O-CB 3.04Å; L299-L303 PolarHBondContact O-N 2.85Å
300L37.8Very low36Very low80 Ų8099.7 Ų99.742%0.41950%0.504SS..Hα-helixtrans-60.5-41.4-176.9-160.976.6000113.2Y296 L303 Q304Y296-L300 HydrophobicContact CE1-CD1 4.01Å; Y296-L300 VanDerWaalsContact O-CB 3.23Å; Y296-L300 WeakPolarHBondContact O-CB 3.34Å; Y296-L300 PolarHBondContact O-N 3.19Å; L300-L303 PolarHBondContact O-N 3.46Å; L300-Q304 WeakPolarHBondContact O-CB 3.23Å; L300-Q304 WeakPolarHBondContact O-CG 3.37Å; L300-Q304 PolarHBondContact O-N 3Å
301P33.8Very low35.5Very low62 Ų6299.7 Ų99.740%0.40351%0.511SS..Hα-helixtrans-68.5-35.6175.6-18.532.3000112.3E297 Q304 L305E297-P301 WeakPolarHBondContact O-CD 3.31Å; E297-P301 WeakPolarHBondContact O-CG 3.28Å; P301-Q304 PolarHBondContact O-N 3.24Å; P301-L305 WeakPolarHBondContact O-CB 3.29Å; P301-L305 PolarHBondContact O-N 2.93Å
302S40.7Very low35Very low70 Ų70107.4 Ų107.449%0.4953%0.529SS..Hα-helixtrans-66.7-40.4175.8-45.70000111.6N298 L299 L305 E306N298-S302 PolarHBondContact O-OG 2.8Å; L299-S302 PolarHBondContact O-N 2.82Å; S302-L305 PolarHBondContact O-N 2.91Å; S302-E306 PolarHBondContact O-N 3.36Å; S302-E306 VanDerWaalsContact O-N 3.09Å
303L32.8Very low34.4Very low47 Ų47113.5 Ų113.525%0.24656%0.56CS.*Hα-helixtrans-65.2-41.7172-87.2156.1000111.5L299 L300 E306 L307L299-L303 HydrophobicContact CB-CD1 4.48Å; L299-L303 HydrophobicContact CD2-CD1 4.46Å; L299-L303 WeakPolarHBondContact O-CB 3.04Å; L299-L303 PolarHBondContact O-N 2.85Å; L300-L303 PolarHBondContact O-N 3.46Å; L303-E306 PolarHBondContact O-N 3.47Å; L303-L307 HydrophobicContact CB-CD1 4.35Å; L303-L307 WeakPolarHBondContact O-CB 3.49Å; L303-L307 VanDerWaalsContact O-CD1 3.27Å; L303-L307 WeakPolarHBondContact O-CD1 3.5Å; L303-L307 VanDerWaalsContact O-CG 3.3Å; L303-L307 WeakPolarHBondContact O-CG 3.49Å; L303-L307 PolarHBondContact O-N 3Å
304Q31.7Very low34.3Very low105 Ų105113.1 Ų113.149%0.49156%0.562SS.*Hα-helixtrans-63.6-41.7175.4-81.6-178.5-2200112.1L300 P301 E306 L307 F308L300-Q304 WeakPolarHBondContact O-CB 3.23Å; L300-Q304 WeakPolarHBondContact O-CG 3.37Å; L300-Q304 PolarHBondContact O-N 3Å; P301-Q304 PolarHBondContact O-N 3.24Å; Q304-E306 PolarHBondContact O-N 2.83Å; Q304-L307 PolarHBondContact O-N 3.41Å; Q304-F308 HydrophobicContact CB-CD2 4.44Å; Q304-F308 WeakPolarHBondContact O-CB 3.22Å; Q304-F308 VanDerWaalsContact O-CD2 3.27Å; Q304-F308 WeakPolarHBondContact O-CD2 3.49Å; Q304-F308 PolarHBondContact O-N 2.78Å
305L36.3Very low34.2Very low133 Ų133113.4 Ų113.470%0.69657%0.572SS**Hα-helixtrans-64.8-36.5176.2-106134.8000112.4P301 S302 S309P301-L305 WeakPolarHBondContact O-CB 3.29Å; P301-L305 PolarHBondContact O-N 2.93Å; S302-L305 PolarHBondContact O-N 2.91Å; L305-S309 WeakPolarHBondContact O-CB 3.18Å; L305-S309 PolarHBondContact O-N 2.94Å; L305-S309 VanDerWaalsContact O-N 3.16Å; L305-S309 PolarHBondContact O-OG 3.28Å
306E34.9Very low34.4Very low120 Ų120113.4 Ų113.456%0.56157%0.57SS**Hα-helixtrans-76-33.4172.2-79-171.7155.500113.3S302 L303 Q304 F308 S309S302-E306 PolarHBondContact O-N 3.36Å; S302-E306 VanDerWaalsContact O-N 3.09Å; L303-E306 PolarHBondContact O-N 3.47Å; Q304-E306 PolarHBondContact O-N 2.83Å; E306-F308 VanDerWaalsContact C-N 3.34Å; E306-S309 WeakPolarHBondContact CA-OG 3.27Å; E306-S309 PolarHBondContact O-OG 3.22Å
307L30.9Very low35Very low102 Ų102110 Ų11053%0.53456%0.562SS.*Hα-helixtrans-71.1-27.7177.7-87.8152.4000112.9L237 L303 Q304L237-L307 HydrophobicContact CD1-CD2 4.41Å; L237-L307 HydrophobicContact CD1-CG 4.44Å; L303-L307 HydrophobicContact CB-CD1 4.35Å; L303-L307 WeakPolarHBondContact O-CB 3.49Å; L303-L307 VanDerWaalsContact O-CD1 3.27Å; L303-L307 WeakPolarHBondContact O-CD1 3.5Å; L303-L307 VanDerWaalsContact O-CG 3.3Å; L303-L307 WeakPolarHBondContact O-CG 3.49Å; L303-L307 PolarHBondContact O-N 3Å; Q304-L307 PolarHBondContact O-N 3.41Å
308F32.3Very low35.8Very low173 Ų173108.1 Ų108.176%0.75957%0.565SS**SBendtrans-112.14.9-177.3-70.7-75.9000114.2Q304 E306Q304-F308 HydrophobicContact CB-CD2 4.44Å; Q304-F308 WeakPolarHBondContact O-CB 3.22Å; Q304-F308 VanDerWaalsContact O-CD2 3.27Å; Q304-F308 WeakPolarHBondContact O-CD2 3.49Å; Q304-F308 PolarHBondContact O-N 2.78Å; E306-F308 VanDerWaalsContact C-N 3.34Å
309S27.4Very low36.8Very low76 Ų76107.5 Ų107.553%0.53156%0.562SS.*SBendtrans-92.48175.551.50000115L305 E306L305-S309 WeakPolarHBondContact O-CB 3.18Å; L305-S309 PolarHBondContact O-N 2.94Å; L305-S309 VanDerWaalsContact O-N 3.16Å; L305-S309 PolarHBondContact O-OG 3.28Å; E306-S309 WeakPolarHBondContact CA-OG 3.27Å; E306-S309 PolarHBondContact O-OG 3.22Å
310M28.9Very low38.1Very low148 Ų148106.4 Ų106.473%0.72956%0.56SS**SBendtrans-110.3104.9175.7-73.9-74.7173.700110.7
311D28Very low39.5Very low139 Ų139102.6 Ų102.674%0.74354%0.54SS*.  trans46.4119.5152-58.8-30.8000119.1I313D311-I313 PolarHBondContact O-N 2.7Å
312R26.8Very low41Very low236 Ų236100.6 Ų100.689%0.89153%0.528SS*.  trans-14.5100.8161.2-65.1176.8-179.9176.80.4111.9T314R312-T314 PolarHBondContact O-N 2.82Å
313I30.1Very low42.2Very low162 Ų162100.1 Ų100.183%0.83152%0.519SS*.  trans-62.490.3168.7-60.9172.6000106.3D311 I315D311-I313 PolarHBondContact O-N 2.7Å; I313-I315 PolarHBondContact O-N 2.7Å
314T34.1Very low44Very low86 Ų8698.6 Ų98.653%0.52851%0.513SS..  trans-75.1110.6169.139.80000105.5R312 L316R312-T314 PolarHBondContact O-N 2.82Å; T314-L316 VanDerWaalsContact C-N 3.34Å; T314-L316 PolarHBondContact O-N 2.81Å
315I35.6Very low45.8Very low159 Ų15999 Ų9982%0.81552%0.522SS*.  trans-61102.7167.8-62.8169.8000105.4I313 P317I313-I315 PolarHBondContact O-N 2.7Å; I315-P317 WeakPolarHBondContact O-CD 3.46Å
316L44.2Very low47.2Very low63 Ų6394.7 Ų94.733%0.3350%0.5SS..  trans-65.3126177.4-75.9100.1000108.3T314 L328 V338 L340T314-L316 VanDerWaalsContact C-N 3.34Å; T314-L316 PolarHBondContact O-N 2.81Å; L316-L328 HydrophobicContact CD2-CB 4.43Å; L316-V338 HydrophobicContact CD2-CG1 3.96Å; L316-L340 HydrophobicContact CD2-CD1 3.59Å; L316-L340 HydrophobicContact CD2-CD2 4.28Å; L316-L340 HydrophobicContact CD2-CG 3.87Å; L316-L340 HydrophobicContact CG-CD1 3.75Å
317P52.7Low48.7Very low48 Ų4890.5 Ų90.531%0.31248%0.483SS..  trans-63.4151.9172.525.5-31.1000110.2I315 D319 L349I315-P317 WeakPolarHBondContact O-CD 3.46Å; P317-D319 PolarHBondContact O-N 2.95Å; P317-L349 HydrophobicContact CB-CD1 4.45Å; P317-L349 HydrophobicContact CG-CD1 3.2Å
318S53.7Low50.1Low104 Ų10485.6 Ų85.673%0.72746%0.457SS*.SBendtrans-66.911.2177.753.40000114.3
319D61.8Low51.4Low72 Ų7283 Ų8339%0.38545%0.446SS..PPolyproline II helixtrans-71.5150.5-173.3-71.1-23.2000111.2P317 L328P317-D319 PolarHBondContact O-N 2.95Å; D319-L328 HydrophobicContact CB-CD1 3.91Å; D319-L328 WeakPolarHBondContact O-CD1 3.39Å; D319-L328 VanDerWaalsContact O-CG 3.23Å; D319-L328 WeakPolarHBondContact O-CG 3.3Å; D319-L328 PolarHBondContact O-N 2.66Å
320S66.6Low52.7Low49 Ų4983.4 Ų83.434%0.34344%0.44SS..BIsolated β-bridgetrans-83.7141.6173.464.60000110.7S322 T325 L326 R367S320-S322 PolarHBondContact O-N 3.04Å; S320-T325 WeakPolarHBondContact CB-O 3.38Å; S320-L326 CarbonylContact C-O 3.55Å; S320-L326 WeakPolarHBondContact CA-O 3.23Å; S320-R367 PolarHBondContact O-NH2 2.87Å; S320-R367 PolarHBondContact OG-NH2 2.88Å
321C66Low54Low1 Ų179.6 Ų79.61%0.00743%0.426CS..PPolyproline II helixtrans-58.5132.9168.3174.20000110L323 C324 T325 L326 L328 H351C321-L323 PolarHBondContact O-N 3.23Å; C321-L323 PolarHBondContact SG-N 3.26Å; C321-C324 VanDerWaalsContact CB-SG 3.54Å; C321-C324 VanDerWaalsContact SG-SG 3.68Å; C321-T325 WeakPolarHBondContact O-CA 3.09Å; C321-T325 PolarHBondContact O-N 3.31Å; C321-L326 PolarHBondContact N-O 3.34Å; C321-L328 HydrophobicContact CB-CD2 3.9Å; C321-H351 WeakPolarHBondContact CB-ND1 3.33Å; C321-H351 PolarHBondContact SG-ND1 3.45Å
322S65.9Low55.4Low20 Ų2073.4 Ų73.414%0.1439%0.393CS..THydrogen-bonded Turntrans-62.9-26.5179.352.20000114.2S320S320-S322 PolarHBondContact O-N 3.04Å
323L65.7Low56.9Low59 Ų5968.5 Ų68.531%0.30938%0.383SS..THydrogen-bonded Turntrans-92.9-53.9-177-164.882000112.6C321 C354 L366C321-L323 PolarHBondContact O-N 3.23Å; C321-L323 PolarHBondContact SG-N 3.26Å; L323-C354 HydrophobicContact CB-CB 3.81Å; L323-C354 HydrophobicContact CD2-CB 3.52Å; L323-C354 WeakPolarHBondContact CD2-O 3.27Å; L323-C354 HydrophobicContact CG-CB 4.3Å; L323-L366 HydrophobicContact CD1-CD1 3.75Å
324C70.9Confident57.8Low16 Ų1665.7 Ų65.711%0.10837%0.369CS..THydrogen-bonded Turntrans-94.8-3.7-174.870.60000113.8C321 L326 H351C321-C324 VanDerWaalsContact CB-SG 3.54Å; C321-C324 VanDerWaalsContact SG-SG 3.68Å; C324-L326 PolarHBondContact O-N 3.35Å; C324-H351 PolarHBondContact SG-CE1 2.79Å; C324-H351 PolarHBondContact SG-ND1 3.27Å
325T69.1Low58.6Low112 Ų11264.8 Ų64.869%0.68736%0.364SS*.  trans59.3-1.7-176.667.50000115.6S320 C321S320-T325 WeakPolarHBondContact CB-O 3.38Å; C321-T325 WeakPolarHBondContact O-CA 3.09Å; C321-T325 PolarHBondContact O-N 3.31Å
326L66.6Low58.9Low43 Ų4361.9 Ų61.923%0.22536%0.358CS..SBendtrans-72.9148.9174.9-66.4177.5000110.6S320 C321 C324 L328 P331 I333S320-L326 CarbonylContact C-O 3.55Å; S320-L326 WeakPolarHBondContact CA-O 3.23Å; C321-L326 PolarHBondContact N-O 3.34Å; C324-L326 PolarHBondContact O-N 3.35Å; L326-L328 PolarHBondContact O-N 3.03Å; L326-P331 WeakPolarHBondContact CD1-O 3.35Å; L326-I333 HydrophobicContact CD1-CD1 4.37Å; L326-I333 HydrophobicContact CD1-CG1 3.63Å; L326-I333 HydrophobicContact CG-CG1 4.47Å
327P64.9Low58.8Low32 Ų3263.6 Ų63.621%0.20837%0.367CS..BIsolated β-bridgetrans-56.1139.4171.8-13.524.2000110.8F329 Q330 H351P327-F329 HydrophobicContact CB-CD1 3.43Å; P327-F329 VanDerWaalsContact CB-CD1 3.43Å; P327-F329 HydrophobicContact CB-CD2 4.26Å; P327-F329 HydrophobicContact CB-CE1 3.09Å; P327-F329 HydrophobicContact CB-CE2 3.97Å; P327-F329 HydrophobicContact CB-CG 4.02Å; P327-F329 HydrophobicContact CB-CZ 3.38Å; P327-F329 HydrophobicContact CG-CE1 3.87Å; P327-F329 HydrophobicContact CG-CE2 4.23Å; P327-F329 HydrophobicContact CG-CZ 3.65Å; P327-F329 PolarHBondContact O-N 2.73Å; P327-F329 VanDerWaalsContact O-N 3.07Å; P327-Q330 HydrophobicContact CB-CG 4.48Å; P327-Q330 HydrophobicContact CG-CG 4.22Å; P327-Q330 WeakPolarHBondContact O-CB 3.38Å; P327-Q330 PolarHBondContact O-N 3.35Å; P327-H351 PolarHBondContact O-NE2 3.33Å
328L59.9Low58.3Low0 Ų064.4 Ų64.40%037%0.371CS..THydrogen-bonded Turntrans-61.9-20.6-178.6-68.7160.4000113.2L316 D319 C321 L326 L340 L349L316-L328 HydrophobicContact CD2-CB 4.43Å; D319-L328 HydrophobicContact CB-CD1 3.91Å; D319-L328 WeakPolarHBondContact O-CD1 3.39Å; D319-L328 VanDerWaalsContact O-CG 3.23Å; D319-L328 WeakPolarHBondContact O-CG 3.3Å; D319-L328 PolarHBondContact O-N 2.66Å; C321-L328 HydrophobicContact CB-CD2 3.9Å; L326-L328 PolarHBondContact O-N 3.03Å; L328-L340 HydrophobicContact CB-CD2 4.29Å; L328-L340 HydrophobicContact CD1-CD2 4.22Å; L328-L340 HydrophobicContact CD2-CD2 3.85Å; L328-L340 HydrophobicContact CG-CD2 4.34Å; L328-L349 HydrophobicContact CD1-CB 3.33Å; L328-L349 HydrophobicContact CD1-CD1 3.93Å; L328-L349 HydrophobicContact CD1-CG 4.27Å; L328-L349 HydrophobicContact CD2-CB 4.32Å; L328-L349 HydrophobicContact CG-CB 4.46Å
329F59.6Low58Low119 Ų11962.7 Ų62.752%0.52236%0.356SS..THydrogen-bonded Turntrans-79.9-12.6172.867-101.2000114.2P327P327-F329 HydrophobicContact CB-CD1 3.43Å; P327-F329 VanDerWaalsContact CB-CD1 3.43Å; P327-F329 HydrophobicContact CB-CD2 4.26Å; P327-F329 HydrophobicContact CB-CE1 3.09Å; P327-F329 HydrophobicContact CB-CE2 3.97Å; P327-F329 HydrophobicContact CB-CG 4.02Å; P327-F329 HydrophobicContact CB-CZ 3.38Å; P327-F329 HydrophobicContact CG-CE1 3.87Å; P327-F329 HydrophobicContact CG-CE2 4.23Å; P327-F329 HydrophobicContact CG-CZ 3.65Å; P327-F329 PolarHBondContact O-N 2.73Å; P327-F329 VanDerWaalsContact O-N 3.07Å
330Q56.1Low57.1Low84 Ų8461.1 Ų61.139%0.39335%0.348SS..SBendtrans-93.1146.1170.8-75.5-173.3-17.400109.7P327 H351P327-Q330 HydrophobicContact CB-CG 4.48Å; P327-Q330 HydrophobicContact CG-CG 4.22Å; P327-Q330 WeakPolarHBondContact O-CB 3.38Å; P327-Q330 PolarHBondContact O-N 3.35Å; Q330-H351 PolarHBondContact O-NE2 3.26Å
331P55.7Low56.1Low68 Ų6860.4 Ų60.444%0.44234%0.34SS..PPolyproline II helixtrans-59.9146.1172.826.1-33.4000110.2L326L326-P331 WeakPolarHBondContact CD1-O 3.35Å
332S57.5Low55.1Low8 Ų867.6 Ų67.66%0.05637%0.372CS..PPolyproline II helixtrans-59156.5172.171.80000110.8L334 T335 S353S332-L334 PolarHBondContact O-N 2.95Å; S332-L334 PolarHBondContact OG-N 3.43Å; S332-T335 PolarHBondContact OG-N 3.21Å; S332-T335 PolarHBondContact OG-O 2.84Å; S332-S353 WeakPolarHBondContact CB-OG 3.38Å; S332-S353 PolarHBondContact OG-OG 3.4Å
333I57.5Low54.3Low134 Ų13467 Ų6769%0.68737%0.367SS*.SBendtrans-55.3-22.3172.3-67.3173.7000111.7L326L326-I333 HydrophobicContact CD1-CD1 4.37Å; L326-I333 HydrophobicContact CD1-CG1 3.63Å; L326-I333 HydrophobicContact CG-CG1 4.47Å
334L50.7Low53.4Low102 Ų10265.3 Ų65.353%0.53436%0.364SS..SBendtrans-100.8-30.6-166-70.6134000113.7S332 I357S332-L334 PolarHBondContact O-N 2.95Å; S332-L334 PolarHBondContact OG-N 3.43Å; L334-I357 HydrophobicContact CD1-CD1 3.49Å; L334-I357 VanDerWaalsContact CD1-CD1 3.49Å; L334-I357 HydrophobicContact CD2-CD1 3.91Å; L334-I357 HydrophobicContact CG-CD1 4.15Å
335T49.4Very low52.3Low68 Ų6872 Ų7242%0.41739%0.394SS..  trans-161.2155.717751.40000112.5S332 D337 S353S332-T335 PolarHBondContact OG-N 3.21Å; S332-T335 PolarHBondContact OG-O 2.84Å; T335-D337 PolarHBondContact O-N 2.97Å; T335-S353 VanDerWaalsContact OG1-CB 3.28Å; T335-S353 WeakPolarHBondContact OG1-CB 3.32Å
336S42.6Very low51.6Low98 Ų9867.2 Ų67.269%0.68537%0.365SS*.SBendtrans-70.42.3-177.750.80000115.9V338S336-V338 PolarHBondContact O-N 3.38Å
337D41.7Very low51.3Low98 Ų9874.2 Ų74.252%0.52440%0.396SS..  trans-98.9106.2-165-62.2-12.7000109.7T335 T339T335-D337 PolarHBondContact O-N 2.97Å; D337-T339 PolarHBondContact O-N 2.79Å
338V43Very low51.2Low65 Ų6575 Ų7539%0.39440%0.397SS..  trans-86.888.4173.9-177.20000107.6L316 S336L316-V338 HydrophobicContact CD2-CG1 3.96Å; S336-V338 PolarHBondContact O-N 3.38Å
339T46Very low51.3Low68 Ų6876 Ų7642%0.41740%0.403SS..  trans-123.7133163.646.20000107.7D337 M352D337-T339 PolarHBondContact O-N 2.79Å; T339-M352 VanDerWaalsContact O-CB 3.24Å; T339-M352 WeakPolarHBondContact O-CB 3.19Å; T339-M352 PolarHBondContact O-N 3.34Å; T339-M352 WeakPolarHBondContact OG1-CB 3.32Å; T339-M352 PolarHBondContact OG1-SD 3.47Å
340L43.6Very low51.6Low40 Ų4070.6 Ų70.621%0.20938%0.379CS..EExtended strand (participates in β ladder)trans-89.4127.9178.6-77.2169.3000108.6L316 L328 L349L316-L340 HydrophobicContact CD2-CD1 3.59Å; L316-L340 HydrophobicContact CD2-CD2 4.28Å; L316-L340 HydrophobicContact CD2-CG 3.87Å; L316-L340 HydrophobicContact CG-CD1 3.75Å; L328-L340 HydrophobicContact CB-CD2 4.29Å; L328-L340 HydrophobicContact CD1-CD2 4.22Å; L328-L340 HydrophobicContact CD2-CD2 3.85Å; L328-L340 HydrophobicContact CG-CD2 4.34Å; L340-L349 HydrophobicContact CD2-CB 4.47Å; L340-L349 HydrophobicContact CD2-CD2 4.39Å
341N44.9Very low52.1Low34 Ų3466.7 Ų66.718%0.18236%0.36CS..EExtended strand (participates in β ladder)trans-102.8126.6165.4-146.68.2000108.6S343 M352 A355N341-S343 PolarHBondContact O-N 3.21Å; N341-M352 HydrophobicContact CB-CE 3.96Å; N341-A355 HydrophobicContact CB-CB 4.14Å
342F46.5Very low52.5Low152 Ų15266 Ų6667%0.66735%0.352SS*.EExtended strand (participates in β ladder)trans-78.9111.1168.7-69.8-86.4000106.8G344 L349F342-G344 PolarHBondContact O-N 2.93Å; F342-L349 HydrophobicContact CD1-CD2 4.22Å; F342-L349 HydrophobicContact CE1-CD2 4.05Å
343S48Very low53Low7 Ų766 Ų665%0.04935%0.352CS..  trans-63.5124.9172.347.10000109.6N341 E345 C346 H348N341-S343 PolarHBondContact O-N 3.21Å; S343-E345 PolarHBondContact O-N 2.82Å; S343-C346 PolarHBondContact OG-O 3.48Å; S343-C346 PolarHBondContact OG-SG 3.49Å; S343-H348 PolarHBondContact OG-O 3.31Å
344G46.4Very low53.4Low24 Ų2459.6 Ų59.625%0.24732%0.319CS..SBendtrans-54.5137.8171.100000110.3F342 C346F342-G344 PolarHBondContact O-N 2.93Å; G344-C346 VanDerWaalsContact C-N 3.29Å; G344-C346 PolarHBondContact O-N 3.24Å; G344-C346 VanDerWaalsContact O-N 3.1Å
345E49.7Very low54Low157 Ų15754.8 Ų54.873%0.73429%0.294SS*.SBendtrans72.6-32.6-178.6-55.2-168.7168.200118.1S343 S372S343-E345 PolarHBondContact O-N 2.82Å; E345-S372 WeakPolarHBondContact OE2-CB 3.39Å; E345-S372 PolarHBondContact OE2-OG 2.91Å
346C53.8Low54.9Low10 Ų1057.1 Ų57.17%0.06830%0.3CS..SBendtrans-116.1120.9174.363.20000111.2S343 G344 H348 C365 C368S343-C346 PolarHBondContact OG-O 3.48Å; S343-C346 PolarHBondContact OG-SG 3.49Å; G344-C346 VanDerWaalsContact C-N 3.29Å; G344-C346 PolarHBondContact O-N 3.24Å; G344-C346 VanDerWaalsContact O-N 3.1Å; C346-H348 PolarHBondContact O-N 2.89Å; C346-C365 VanDerWaalsContact SG-CB 3.55Å; C346-C368 WeakPolarHBondContact CB-SG 3.47Å
347Q59.7Low55.9Low190 Ų19054.9 Ų54.989%0.88828%0.28SS*.  trans-71.327-177.1-64.4-178.3-13.900113.9
348H63.9Low57Low50 Ų5050.6 Ų50.623%0.23126%0.258CS..  trans-85.3133.6-178.8-65.6120.1000111.2S343 C346 C365 R367 C368S343-H348 PolarHBondContact OG-O 3.31Å; C346-H348 PolarHBondContact O-N 2.89Å; H348-C365 PolarHBondContact ND1-SG 2.85Å; H348-R367 WeakPolarHBondContact CD2-CD 3.42Å; H348-C368 PolarHBondContact ND1-SG 3.31Å
349L60.9Low58Low21 Ų2151.3 Ų51.311%0.1126%0.257CS..EExtended strand (participates in β ladder)trans-94.4138.1-173.8-63.1167.2000111.6P317 L328 L340 F342P317-L349 HydrophobicContact CB-CD1 4.45Å; P317-L349 HydrophobicContact CG-CD1 3.2Å; L328-L349 HydrophobicContact CD1-CB 3.33Å; L328-L349 HydrophobicContact CD1-CD1 3.93Å; L328-L349 HydrophobicContact CD1-CG 4.27Å; L328-L349 HydrophobicContact CD2-CB 4.32Å; L328-L349 HydrophobicContact CG-CB 4.46Å; L340-L349 HydrophobicContact CD2-CB 4.47Å; L340-L349 HydrophobicContact CD2-CD2 4.39Å; F342-L349 HydrophobicContact CD1-CD2 4.22Å; F342-L349 HydrophobicContact CE1-CD2 4.05Å
350M66.1Low58.7Low4 Ų452.5 Ų52.52%0.0227%0.268CS..EExtended strand (participates in β ladder)trans-145.1154178.652.2-175.979.300111.4A355 F373M350-A355 HydrophobicContact CG-CB 3.96Å; M350-A355 HydrophobicContact SD-CB 3.66Å; M350-F373 HydrophobicContact CE-CE1 3.97Å; M350-F373 HydrophobicContact CE-CZ 3.5Å; M350-F373 HydrophobicContact SD-CE1 3.94Å; M350-F373 HydrophobicContact SD-CZ 4Å
351H67.3Low59.5Low2 Ų255.3 Ų55.31%0.00928%0.282CS..EExtended strand (participates in β ladder)trans-62.1144.1168.5-59107.5000109.8C321 C324 P327 Q330 S353 C354 A355C321-H351 WeakPolarHBondContact CB-ND1 3.33Å; C321-H351 PolarHBondContact SG-ND1 3.45Å; C324-H351 PolarHBondContact SG-CE1 2.79Å; C324-H351 PolarHBondContact SG-ND1 3.27Å; P327-H351 PolarHBondContact O-NE2 3.33Å; Q330-H351 PolarHBondContact O-NE2 3.26Å; H351-S353 VanDerWaalsContact C-N 3.29Å; H351-S353 PolarHBondContact O-N 2.8Å; H351-C354 HydrophobicContact CB-CB 4.11Å; H351-C354 CarbonylContact O-C 3.58Å; H351-C354 WeakPolarHBondContact O-CA 3.45Å; H351-C354 VanDerWaalsContact O-CB 3.3Å; H351-C354 WeakPolarHBondContact O-CB 3.48Å; H351-C354 PolarHBondContact O-N 2.8Å; H351-A355 PolarHBondContact O-N 3.25Å
352M64.5Low60.2Low53 Ų5359 Ų5926%0.26131%0.311SS..Hα-helixtrans-60-37.5179.9-173.2157.4-76.100113.4T339 N341 C354 A355 Q356T339-M352 VanDerWaalsContact O-CB 3.24Å; T339-M352 WeakPolarHBondContact O-CB 3.19Å; T339-M352 PolarHBondContact O-N 3.34Å; T339-M352 WeakPolarHBondContact OG1-CB 3.32Å; T339-M352 PolarHBondContact OG1-SD 3.47Å; N341-M352 HydrophobicContact CB-CE 3.96Å; M352-C354 VanDerWaalsContact C-N 3.3Å; M352-C354 PolarHBondContact O-N 3.22Å; M352-A355 WeakPolarHBondContact O-CB 3.26Å; M352-A355 PolarHBondContact O-N 3.27Å; M352-Q356 VanDerWaalsContact O-CG 3.32Å; M352-Q356 WeakPolarHBondContact O-CG 3.48Å; M352-Q356 PolarHBondContact O-N 2.92Å
353S66.6Low60.6Low9 Ų956 Ų566%0.06330%0.298CS..Hα-helixtrans-62.2-38.3172.8550000112.4S332 T335 H351 I357S332-S353 WeakPolarHBondContact CB-OG 3.38Å; S332-S353 PolarHBondContact OG-OG 3.4Å; T335-S353 VanDerWaalsContact OG1-CB 3.28Å; T335-S353 WeakPolarHBondContact OG1-CB 3.32Å; H351-S353 VanDerWaalsContact C-N 3.29Å; H351-S353 PolarHBondContact O-N 2.8Å; S353-I357 WeakPolarHBondContact O-CD1 3.38Å; S353-I357 VanDerWaalsContact O-CG1 3.31Å; S353-I357 WeakPolarHBondContact O-CG1 3.08Å; S353-I357 PolarHBondContact O-N 3.06Å
354C65.6Low61.2Low0 Ų058.1 Ų58.10%031%0.311CS..Hα-helixtrans-69.1-38.5173.6-66.60000111.7L323 H351 M352 I357 S358L323-C354 HydrophobicContact CB-CB 3.81Å; L323-C354 HydrophobicContact CD2-CB 3.52Å; L323-C354 WeakPolarHBondContact CD2-O 3.27Å; L323-C354 HydrophobicContact CG-CB 4.3Å; H351-C354 HydrophobicContact CB-CB 4.11Å; H351-C354 CarbonylContact O-C 3.58Å; H351-C354 WeakPolarHBondContact O-CA 3.45Å; H351-C354 VanDerWaalsContact O-CB 3.3Å; H351-C354 WeakPolarHBondContact O-CB 3.48Å; H351-C354 PolarHBondContact O-N 2.8Å; M352-C354 VanDerWaalsContact C-N 3.3Å; M352-C354 PolarHBondContact O-N 3.22Å; C354-I357 PolarHBondContact O-N 2.99Å; C354-S358 WeakPolarHBondContact O-CB 3.45Å; C354-S358 PolarHBondContact O-N 2.73Å
355A64.6Low61.7Low0 Ų057 Ų570%030%0.3CS..Hα-helixtrans-62.5-47.5174.900000111.3N341 M350 H351 M352 I357 S358 E359N341-A355 HydrophobicContact CB-CB 4.14Å; M350-A355 HydrophobicContact CG-CB 3.96Å; M350-A355 HydrophobicContact SD-CB 3.66Å; H351-A355 PolarHBondContact O-N 3.25Å; M352-A355 WeakPolarHBondContact O-CB 3.26Å; M352-A355 PolarHBondContact O-N 3.27Å; A355-I357 VanDerWaalsContact C-N 3.3Å; A355-I357 PolarHBondContact O-N 2.81Å; A355-S358 WeakPolarHBondContact O-CB 3.3Å; A355-S358 PolarHBondContact O-N 3.35Å; A355-S358 VanDerWaalsContact O-N 3.11Å; A355-E359 WeakPolarHBondContact O-CG 3.37Å; A355-E359 PolarHBondContact O-N 3.3Å
356Q66.9Low62.1Low117 Ų11754.2 Ų54.255%0.54729%0.29SS..Hα-helixtrans-59.9-38.1177.9-74.3173.3-12.800112.7M352 S360M352-Q356 VanDerWaalsContact O-CG 3.32Å; M352-Q356 WeakPolarHBondContact O-CG 3.48Å; M352-Q356 PolarHBondContact O-N 2.92Å; Q356-S360 WeakPolarHBondContact O-CB 3.47Å; Q356-S360 PolarHBondContact O-N 3.4Å
357I65.3Low62.4Low52 Ų5259.1 Ų59.127%0.26731%0.307SS..Hα-helixtrans-70-42.6175.2-68.2164.7000110.6L334 S353 C354 A355 E359 S360 I361L334-I357 HydrophobicContact CD1-CD1 3.49Å; L334-I357 VanDerWaalsContact CD1-CD1 3.49Å; L334-I357 HydrophobicContact CD2-CD1 3.91Å; L334-I357 HydrophobicContact CG-CD1 4.15Å; S353-I357 WeakPolarHBondContact O-CD1 3.38Å; S353-I357 VanDerWaalsContact O-CG1 3.31Å; S353-I357 WeakPolarHBondContact O-CG1 3.08Å; S353-I357 PolarHBondContact O-N 3.06Å; C354-I357 PolarHBondContact O-N 2.99Å; A355-I357 VanDerWaalsContact C-N 3.3Å; A355-I357 PolarHBondContact O-N 2.81Å; I357-E359 VanDerWaalsContact C-N 3.28Å; I357-E359 PolarHBondContact O-N 2.91Å; I357-S360 WeakPolarHBondContact CA-OG 3.3Å; I357-S360 PolarHBondContact O-N 3.35Å; I357-S360 VanDerWaalsContact O-N 3.15Å; I357-S360 PolarHBondContact O-OG 2.87Å; I357-I361 HydrophobicContact CG2-CD1 3.66Å; I357-I361 WeakPolarHBondContact O-CG1 3.5Å; I357-I361 PolarHBondContact O-N 3.24Å; I357-I361 VanDerWaalsContact O-N 3.11Å
358S64.4Low62.4Low8 Ų852.4 Ų52.46%0.05628%0.28CS..Hα-helixtrans-58.8-41.9175.2-161.70000111.5C354 A355 I361 S362 F363C354-S358 WeakPolarHBondContact O-CB 3.45Å; C354-S358 PolarHBondContact O-N 2.73Å; A355-S358 WeakPolarHBondContact O-CB 3.3Å; A355-S358 PolarHBondContact O-N 3.35Å; A355-S358 VanDerWaalsContact O-N 3.11Å; S358-I361 PolarHBondContact O-N 3.05Å; S358-S362 PolarHBondContact O-N 3.06Å; S358-S362 VanDerWaalsContact O-N 3.15Å; S358-F363 PolarHBondContact O-N 2.89Å; S358-F363 PolarHBondContact OG-O 3.35Å
359E63Low62.1Low79 Ų7954.5 Ų54.537%0.36930%0.3SS..Hα-helixtrans-62.1-44.9174-74.7172.7-174.300111.2A355 I357 I361 S362A355-E359 WeakPolarHBondContact O-CG 3.37Å; A355-E359 PolarHBondContact O-N 3.3Å; I357-E359 VanDerWaalsContact C-N 3.28Å; I357-E359 PolarHBondContact O-N 2.91Å; E359-I361 PolarHBondContact O-N 2.99Å; E359-S362 PolarHBondContact O-N 3.35Å
360S60.6Low61.8Low94 Ų9454.8 Ų54.866%0.65731%0.306SS*.Hα-helixtrans-65.5-22.718072.50000114.4Q356 I357Q356-S360 WeakPolarHBondContact O-CB 3.47Å; Q356-S360 PolarHBondContact O-N 3.4Å; I357-S360 WeakPolarHBondContact CA-OG 3.3Å; I357-S360 PolarHBondContact O-N 3.35Å; I357-S360 VanDerWaalsContact O-N 3.15Å; I357-S360 PolarHBondContact O-OG 2.87Å
361I61.2Low61Low98 Ų9863.5 Ų63.550%0.50335%0.346SS..THydrogen-bonded Turntrans-106.13-177.5-55168.2000111.1I357 S358 E359 F363I357-I361 HydrophobicContact CG2-CD1 3.66Å; I357-I361 WeakPolarHBondContact O-CG1 3.5Å; I357-I361 PolarHBondContact O-N 3.24Å; I357-I361 VanDerWaalsContact O-N 3.11Å; S358-I361 PolarHBondContact O-N 3.05Å; E359-I361 PolarHBondContact O-N 2.99Å; I361-F363 HydrophobicContact CB-CB 4.46Å; I361-F363 HydrophobicContact CG2-CD2 4.05Å; I361-F363 PolarHBondContact O-N 3.26Å
362S58.8Low59.9Low113 Ų11365.1 Ų65.179%0.7936%0.358SS*.THydrogen-bonded Turntrans4939.4-172.954.60000112.2S358 E359S358-S362 PolarHBondContact O-N 3.06Å; S358-S362 VanDerWaalsContact O-N 3.15Å; E359-S362 PolarHBondContact O-N 3.35Å
363F56.5Low58.7Low89 Ų8965.2 Ų65.239%0.3936%0.357SS..  trans-84.5126.5-171.7-149-86.2000109.9S358 I361 L366S358-F363 PolarHBondContact O-N 2.89Å; S358-F363 PolarHBondContact OG-O 3.35Å; I361-F363 HydrophobicContact CB-CB 4.46Å; I361-F363 HydrophobicContact CG2-CD2 4.05Å; I361-F363 PolarHBondContact O-N 3.26Å; F363-L366 HydrophobicContact CD1-CD2 4.32Å; F363-L366 HydrophobicContact CD1-CG 4.1Å; F363-L366 HydrophobicContact CE1-CD1 4.37Å; F363-L366 HydrophobicContact CE1-CD2 3.49Å; F363-L366 VanDerWaalsContact CE1-CD2 3.49Å; F363-L366 HydrophobicContact CE1-CG 3.77Å; F363-L366 HydrophobicContact CZ-CD2 4.3Å
364P59.1Low57.3Low50 Ų5070.6 Ų70.633%0.32538%0.384SS..  trans-64.3155.3178.627.5-34.7000110.3L366P364-L366 PolarHBondContact O-N 3.31Å
365C57Low55.8Low2 Ų273.5 Ų73.51%0.01440%0.404CS..  trans-57.5114.7179179.30000110.7C346 H348 R367 C368 S369 A370 F373C346-C365 VanDerWaalsContact SG-CB 3.55Å; H348-C365 PolarHBondContact ND1-SG 2.85Å; C365-R367 PolarHBondContact O-N 3.15Å; C365-C368 PolarHBondContact O-N 3.09Å; C365-C368 VanDerWaalsContact O-N 3.1Å; C365-S369 WeakPolarHBondContact O-CA 3.3Å; C365-S369 PolarHBondContact O-N 2.81Å; C365-A370 PolarHBondContact N-O 3.41Å; C365-A370 VanDerWaalsContact N-O 3.15Å; C365-F373 HydrophobicContact CB-CE2 4.28Å
366L58.6Low54.4Low98 Ų9878.5 Ų78.551%0.51343%0.434SS..THydrogen-bonded Turntrans-57.4-16.8-176.7-81.4161.9000114.7L323 F363 P364L323-L366 HydrophobicContact CD1-CD1 3.75Å; F363-L366 HydrophobicContact CD1-CD2 4.32Å; F363-L366 HydrophobicContact CD1-CG 4.1Å; F363-L366 HydrophobicContact CE1-CD1 4.37Å; F363-L366 HydrophobicContact CE1-CD2 3.49Å; F363-L366 VanDerWaalsContact CE1-CD2 3.49Å; F363-L366 HydrophobicContact CE1-CG 3.77Å; F363-L366 HydrophobicContact CZ-CD2 4.3Å; P364-L366 PolarHBondContact O-N 3.31Å
367R59.7Low52.6Low113 Ų11381.4 Ų81.443%0.42645%0.448SS..THydrogen-bonded Turntrans-93.9-28.8178.2-77.3-170176.1-176.55.4114.6S320 H348 C365S320-R367 PolarHBondContact O-NH2 2.87Å; S320-R367 PolarHBondContact OG-NH2 2.88Å; H348-R367 WeakPolarHBondContact CD2-CD 3.42Å; C365-R367 PolarHBondContact O-N 3.15Å
368C60.2Low50.9Low48 Ų4885 Ų8532%0.32447%0.467SS..THydrogen-bonded Turntrans-1365.3-175.260.50000115C346 H348 C365 A370C346-C368 WeakPolarHBondContact CB-SG 3.47Å; H348-C368 PolarHBondContact ND1-SG 3.31Å; C365-C368 PolarHBondContact O-N 3.09Å; C365-C368 VanDerWaalsContact O-N 3.1Å; C368-A370 PolarHBondContact O-N 2.94Å
369S57.5Low49.1Very low95 Ų9589.6 Ų89.666%0.66450%0.495SS*.  trans53.323.2179.548.10000114.5C365C365-S369 WeakPolarHBondContact O-CA 3.3Å; C365-S369 PolarHBondContact O-N 2.81Å
370A54.8Low47.4Very low27 Ų2794 Ų9422%0.22352%0.521CS..  trans-72.3131.5176.600000109.7C365 C368C365-A370 PolarHBondContact N-O 3.41Å; C365-A370 VanDerWaalsContact N-O 3.15Å; C368-A370 PolarHBondContact O-N 2.94Å
371E50.1Low45.7Very low186 Ų18696.3 Ų96.387%0.86953%0.526SS*.  trans-88.87.1-171.7-71.5-174.5157.300114.5
372S43.4Very low44Very low37 Ų3798.5 Ų98.526%0.25954%0.539SS..  trans-126.5104.2-167.734.60000112.2E345E345-S372 WeakPolarHBondContact OE2-CB 3.39Å; E345-S372 PolarHBondContact OE2-OG 2.91Å
373F38.4Very low42.3Very low54 Ų5498.2 Ų98.224%0.23754%0.537CS..  trans-104.2110.4163-88.5-104.4000108.9M350 C365M350-F373 HydrophobicContact CE-CE1 3.97Å; M350-F373 HydrophobicContact CE-CZ 3.5Å; M350-F373 HydrophobicContact SD-CE1 3.94Å; M350-F373 HydrophobicContact SD-CZ 4Å; C365-F373 HydrophobicContact CB-CE2 4.28Å
374I37.9Very low40.8Very low122 Ų12299.4 Ų99.463%0.62655%0.551SS**  trans-105.8111.7165.3-59.2172.9000106.6V376I374-V376 PolarHBondContact O-N 3.48Å
375C34.5Very low39.2Very low62 Ų62103.5 Ų103.542%0.41957%0.569SS.*  trans-73.8112.6176.7-162.20000108.7Q377C375-Q377 PolarHBondContact O-N 2.83Å
376V35.9Very low37.8Very low104 Ų104113.5 Ų113.563%0.6361%0.613SS**  trans-74.485.1168.6-178.90000107.3I374 D378I374-V376 PolarHBondContact O-N 3.48Å; V376-D378 VanDerWaalsContact C-N 3.28Å; V376-D378 HydrophobicContact CG1-CB 4.26Å; V376-D378 WeakPolarHBondContact CG1-OD2 3.19Å; V376-D378 PolarHBondContact O-N 3.11Å; V376-D378 VanDerWaalsContact O-N 3.13Å
377Q28.9Very low36.1Very low179 Ų179115.5 Ų115.584%0.83662%0.624SS**  trans-74.684.4162-87.8-176.2-22.400108.5C375 T379C375-Q377 PolarHBondContact O-N 2.83Å; Q377-T379 PolarHBondContact O-N 2.92Å
378D28.7Very low34.5Very low128 Ų128118 Ų11868%0.68464%0.64SS**  trans-86.198.6168.2-89.7-26.3000111V376V376-D378 VanDerWaalsContact C-N 3.28Å; V376-D378 HydrophobicContact CG1-CB 4.26Å; V376-D378 WeakPolarHBondContact CG1-OD2 3.19Å; V376-D378 PolarHBondContact O-N 3.11Å; V376-D378 VanDerWaalsContact O-N 3.13Å
379T27.6Very low32.9Very low104 Ų104122.3 Ų122.364%0.63866%0.659SS**  trans77.664.213664.60000119.2Q377Q377-T379 PolarHBondContact O-N 2.92Å
380N26.7Very low31.5Very low171 Ų171125 Ų12591%0.91466%0.661SS**  trans-89.491.8134.5-91.4-15.9000108N382N380-N382 VanDerWaalsContact C-N 3.29Å; N380-N382 PolarHBondContact O-N 2.81Å
381N24.7Very low30.1Very low142 Ų142129.6 Ų129.676%0.75969%0.692SS**  trans-56.798.3160.1-87-20.5000107.8
382N25.3Very low29Very low145 Ų145125.8 Ų125.878%0.77569%0.685SS**  trans-179.2105.2131.1-86.2-23.7000109.9N380N380-N382 VanDerWaalsContact C-N 3.29Å; N380-N382 PolarHBondContact O-N 2.81Å
383S23.7Very low28.3Very low106 Ų106135.2 Ų135.274%0.74172%0.717SS**  trans73.7142.2137.570.50000119
384V25.3Very low27.8Very low114 Ų114136.1 Ų136.169%0.69174%0.735SS**  trans88.383.5160.3-165.80000113
385I25Very low27.3Very low137 Ų137137.4 Ų137.470%0.70374%0.743SS**  67.5101.195.6-62155.5000110.3
386F27.2Very low27.2Very low212 Ų212139.2 Ų139.293%0.9376%0.756SS**  trans-155.180.8133.4-103.9-75.5000107.5
387N23.8Very low26.8Very low139 Ų139143 Ų14374%0.74377%0.767SS**  trans-54.9158.5152.3-95.9-12.5000109
388E26Very low26.9Very low167 Ų167140.6 Ų140.678%0.7876%0.764SS**  trans76.3102.5164.5-69.1175.5-176.300114.3
389L26Very low26.9Very low138 Ų138138.8 Ų138.872%0.72376%0.761SS**  169.1136.499.2-91.2142.6000113.4
390H28.8Very low27.1Very low150 Ų150140.3 Ų140.369%0.69477%0.766SS**  trans85.762.6156.1-59.6-54.2000119.3S392H390-S392 PolarHBondContact O-N 3.27Å
391S25.4Very low27.2Very low125 Ų125138 Ų13887%0.87476%0.758SS**  trans-62.3108.5135.147.30000109.7
392S26.6Very low27.4Very low105 Ų105135.5 Ų135.573%0.73475%0.752SS**  trans-126.16416252.10000108.8H390 A394H390-S392 PolarHBondContact O-N 3.27Å; S392-A394 PolarHBondContact O-N 3.25Å
393Y28.4Very low27.6Very low235 Ų235135.9 Ų135.992%0.92275%0.753SS**  trans-84.7100.1162.6-113.5-89.4000107.9
394A26.8Very low28.1Very low74 Ų74135.3 Ų135.361%0.61275%0.749SS**  trans-72.3141.5164.200000109.6S392S392-A394 PolarHBondContact O-N 3.25Å
395N29Very low28.3Very low149 Ų149136.2 Ų136.280%0.79775%0.75SS**  trans103.9114.4153.7-57-20.7000118.7
396S30.5Very low28.6Very low99 Ų99136.8 Ų136.869%0.69275%0.75SS**  trans81.792.4134.562.40000119
397E27.7Very low28.8Very low185 Ų185134 Ų13486%0.86474%0.739SS**  78.5138.9118.6-70.4-176.9163.200120.6
398V30.8Very low29Very low128 Ų128131.7 Ų131.778%0.77673%0.734SS**  trans93.371.6159.6-156.30000117.4
399S28.9Very low29.2Very low89 Ų89129.1 Ų129.162%0.62274%0.735SS**  42.7120.2118.665.70000121.3
400N31.5Very low29.4Very low137 Ų137128 Ų12873%0.73374%0.739SS**  136.399128.8-74.3-14.8000111.3
401T29Very low29.2Very low122 Ų122125.8 Ų125.875%0.74874%0.74SS**  55.9126.299.359.40000112.4
402S30.7Very low29.3Very low90 Ų90125.1 Ų125.163%0.62974%0.735SS**  cis173.3149.515.939.30000107.4
403N29.5Very low29.4Very low152 Ų152124.6 Ų124.681%0.81373%0.731SS**  trans67.5140.8146.5-62.8-4.7000116.8
404S33Very low29.3Very low94 Ų94120.3 Ų120.366%0.65772%0.723SS**  cis176.9147.317.928.70000109.7
405L30.4Very low29.3Very low133 Ų133127 Ų12770%0.69673%0.734SS**  trans69115.4135.2-59.8163.9000118.3
406E31.3Very low29.3Very low150 Ų150127.9 Ų127.970%0.70174%0.738SS**  95.5144.498-79.8177.2172.200109.7
407E30.5Very low29.2Very low152 Ų152130.4 Ų130.471%0.7174%0.744SS**  cis-167.81475.5-125.7173.7175.500108.5
408S28.3Very low29.4Very low92 Ų92131 Ų13164%0.64374%0.744SS**  trans32.6125.214264.40000121.6
409S29.3Very low29.1Very low112 Ų112132.3 Ų132.378%0.78375%0.747SS**  119.6147.2108.770.60000108.5
410S31Very low29.1Very low116 Ų116134 Ų13481%0.81175%0.753SS**  cis-164170.913.941.80000108.5
411S25.5Very low28.8Very low102 Ų102134 Ų13471%0.71375%0.753SS**  trans-65.6166.3-169.448.80000119.7
412S27.2Very low28.8Very low112 Ų112135.8 Ų135.878%0.78376%0.757SS**  trans83139.1152.581.90000115.3
413S27Very low28.6Very low93 Ų93135.9 Ų135.965%0.6576%0.758SS**  cis-175.4172.84.549.80000108
414I27.7Very low28.5Very low145 Ų145133.5 Ų133.574%0.74475%0.748SS**  trans88.5108.5154.4-60.6157.3000117.3
415Y25.9Very low28.3Very low215 Ų215140.1 Ų140.184%0.84376%0.761SS**  trans38.2120.3144.4-74.4-96000119.8
416D30Very low28Very low167 Ų167141.3 Ų141.389%0.89377%0.767SS**  trans-150.9125.4139.2-105.9-24.5000111.4
417D27Very low27.8Very low152 Ų152140.3 Ų140.381%0.81377%0.767SS**  trans-47.4131.1165.2-80.5-44.9000111.4
418K32.5Very low27.8Very low197 Ų197139.2 Ų139.286%0.85778%0.776SS**  trans-150.5123.7142.8-73.1-153.7177.3179.80112
419D25.5Very low27.7Very low156 Ų156142.5 Ų142.583%0.83479%0.786SS**  trans-40.3134163.7-54-67.5000113.4
420V28.8Very low27.6Very low124 Ų124144.8 Ų144.875%0.75278%0.784SS**  trans-133.696155.4-176.80000108.5L422V420-L422 HydrophobicContact CG1-CD1 4.43Å; V420-L422 PolarHBondContact O-N 3.39Å
421D24.9Very low27.6Very low137 Ų137149.7 Ų149.773%0.73379%0.791SS**  trans-51.5113.5162.7-93.3-42.8000110.4S423D421-S423 VanDerWaalsContact C-N 3.31Å; D421-S423 PolarHBondContact O-N 3.28Å
422L29.1Very low27.7Very low160 Ų160151.8 Ų151.884%0.83880%0.795SS**  trans-98.851.5168.6-134.484.6000110.7V420 V424V420-L422 HydrophobicContact CG1-CD1 4.43Å; V420-L422 PolarHBondContact O-N 3.39Å; L422-V424 VanDerWaalsContact C-N 3.28Å
423S25.5Very low27.6Very low93 Ų93156.1 Ų156.165%0.6580%0.799SS**  trans-95.146.516456.30000110.4D421D421-S423 VanDerWaalsContact C-N 3.31Å; D421-S423 PolarHBondContact O-N 3.28Å
424V28.3Very low27.7Very low101 Ų101156.8 Ų156.861%0.61280%0.804SS**  trans-141.488.7175.9-176.80000107.6L422L422-V424 VanDerWaalsContact C-N 3.28Å
425Y28.6Very low27.5Very low233 Ų233157.4 Ų157.491%0.91481%0.809SS**  trans-176.161143-93.4-68.4000107.2
426L25.1Very low27.6Very low158 Ų158155 Ų15583%0.82781%0.809SS**  trans-88.7155.1162-88.3159.9000108.9
427N26.2Very low27.3Very low130 Ų130151.8 Ų151.870%0.69580%0.8SS**  trans92.580.1169.7-66.1-14.8000117.9
428S29.3Very low27.1Very low129 Ų129155.9 Ų155.990%0.90280%0.803SS**  trans-96.821.6157.2-36.50000113.2Q430S428-Q430 VanDerWaalsContact C-N 3.29Å
429D27.1Very low26.7Very low160 Ų160153.1 Ų153.186%0.85680%0.804SS**  trans-89.813.8173.9-83-21.6000113.3
430Q28.2Very low26.7Very low160 Ų160154.3 Ų154.375%0.74881%0.809SS**  trans-132.380.7175.7-78.5-175.2-15.100110.6S428S428-Q430 VanDerWaalsContact C-N 3.29Å
431F29.7Very low26.5Very low219 Ų219159.9 Ų159.996%0.96182%0.816SS**  trans-15484.7138.8-102.3-71.6000108.3
432N28Very low26.5Very low147 Ų147165.3 Ų165.379%0.78683%0.826SS**  trans-70.1147.9178.9-146.5-7.3000109.9S434N432-S434 PolarHBondContact O-N 2.92Å
433K25.3Very low26.5Very low203 Ų203165.5 Ų165.588%0.88383%0.827SS**  trans-38.3122.2172.2-69.5166.8173.6173.60112.6
434S28.6Very low26.7Very low107 Ų107168.3 Ų168.375%0.74884%0.835SS**  trans-139.1111.815153.20000110.2N432N432-S434 PolarHBondContact O-N 2.92Å
435N24.4Very low26.6Very low158 Ų158166.9 Ų166.985%0.84584%0.841SS**  trans-45.8136.7156.1-68.7-36.5000109.3
436I26.7Very low26.5Very low165 Ų165161.3 Ų161.385%0.84684%0.836SS**  trans-161.1138.2138.5-88.8134.3000109.2
437S24.2Very low26.7Very low99 Ų99159.2 Ų159.269%0.69284%0.835SS**  trans-61.2150.3-168.845.70000119.4
438R22.8Very low26.8Very low237 Ų237158.3 Ų158.389%0.89484%0.838SS**  trans12126.8138.8-72.8177.5173.4152.2-2118
439T25.5Very low27Very low140 Ų140157.3 Ų157.386%0.85983%0.832SS**  -155.7112.8127.824.20000110.6
440L23.9Very low27Very low180 Ų180157.1 Ų157.194%0.94283%0.83SS**  trans-68.7127.8159-85.3148.8000108.3
441R26.1Very low27.1Very low242 Ų242159 Ų15991%0.91384%0.836SS**  trans-113.9124160.2-92.7-175.1-177.2167.71.7109
442R24.2Very low27Very low250 Ų250153.5 Ų153.594%0.94383%0.825SS**  trans-56.5138167.5-76.4172164.2145.4-6109.5
443L29.6Very low27.2Very low164 Ų164153.4 Ų153.486%0.85983%0.829SS**  trans-104.9136.8160.3-92.6158.2000108.4
444D29.2Very low27.3Very low152 Ų152150.6 Ų150.681%0.81382%0.824SS**  trans-48147.2-176.1-55.7-62.8000113
445G25.7Very low27.7Very low71 Ų71153.5 Ų153.573%0.73283%0.831SS**  10174.850.400000108.8
446S26.2Very low28Very low116 Ų116153.4 Ų153.481%0.81183%0.83SS**  trans174.6101.8155.840.60000111.2
447S29.4Very low28.5Very low114 Ų114152.4 Ų152.480%0.79783%0.832SS**  trans177.3105139.5330000110.7
448S28.6Very low28.9Very low111 Ų111154.9 Ų154.978%0.77684%0.837SS**  trans9.9116.3141.755.20000119.1
449S32.9Very low29.2Very low109 Ų109150.3 Ų150.376%0.76283%0.83SS**  160.6105126.947.50000108.5
450L27.5Very low29.6Very low156 Ų156150.7 Ų150.782%0.81783%0.827SS**  5191.3106.8-74.3165.9000113
451F30.5Very low30.1Very low200 Ų200147.6 Ų147.688%0.87782%0.815SS**  169.9123.7113.3-98.8-81.2000110.1
452S27.1Very low30.2Very low103 Ų103143.5 Ų143.572%0.7281%0.811SS**  trans-77139.3175.548.40000112.4
453V32.6Very low30.6Very low145 Ų145137.1 Ų137.188%0.87981%0.805SS**  trans-155.7118.7139.3-179.70000108
454D28.5Very low30.6Very low144 Ų144135.6 Ų135.677%0.7780%0.802SS**  trans-75149.2167.6-69.6-50.7000110.8
455D35.4Very low30.7Very low168 Ų168136.1 Ų136.190%0.89881%0.805SS**  trans-169.9122.2136.3-94.2-25.2000111.2
456D32.1Very low30.9Very low156 Ų156138.2 Ų138.283%0.83481%0.809SS**  trans-66.8139.5171.9-68.2-53.2000112.2
457V36.3Very low31.3Very low144 Ų144136.7 Ų136.787%0.87380%0.803SS**  trans-153133.2140.2-174.80000111.5
458D33.6Very low31.3Very low150 Ų150140.4 Ų140.480%0.80281%0.808SS**  trans-40.8162.8-178.6-69.6-57.6000123.4
459N28.8Very low31.6Very low141 Ų141145 Ų14575%0.75481%0.808SS**  trans-53.1151.2170.8-63.3-63.2000116
460D33.4Very low31.4Very low149 Ų149146.6 Ų146.680%0.79781%0.808SS**  -176.8115.7125.5-93-18.4000110.3
461V33.3Very low31.5Very low114 Ų114148.3 Ų148.369%0.69181%0.805SS**  82.5109.994.2173.10000114.8
462L29.6Very low31.5Very low156 Ų156145.3 Ų145.382%0.81780%0.798SS**  trans55.9117.3145.3-61.9168.6000120.8
463S32.4Very low31.5Very low117 Ų117147.5 Ų147.582%0.81880%0.802SS**  153.3138.196.952.30000112.2
464T28.7Very low31.6Very low131 Ų131145.4 Ų145.480%0.80479%0.791SS**  trans-74.2135.9177.141.90000111.6
465D31.8Very low31.5Very low163 Ų163143.4 Ų143.487%0.87279%0.789SS**  trans-155.5145142.3-98.8-24.9000111.6
466S31Very low31.3Very low116 Ų116146.2 Ų146.281%0.81179%0.788SS**  trans-52.1141.4-177.547.80000116
467A33Very low31.3Very low83 Ų83147.2 Ų147.269%0.68679%0.788SS**  trans-140.311515800000110.9
468E29.8Very low31.2Very low193 Ų193145 Ų14590%0.90278%0.779SS**  trans-56.8136.4161.7-69.8173.8137.300110.3
469W34.4Very low31Very low208 Ų208144.9 Ų144.979%0.78878%0.778SS**  trans-111.295168.5-81.350000108.9Y471W469-Y471 HydrophobicContact CE3-CD2 4.22Å; W469-Y471 AromaticContact CE3-CE2 3.64Å; W469-Y471 HydrophobicContact CE3-CE2 3.64Å; W469-Y471 AromaticContact CZ3-CE2 3.8Å; W469-Y471 HydrophobicContact CZ3-CE2 3.8Å
470N29.5Very low31.3Very low142 Ų142146.6 Ų146.676%0.75979%0.785SS**  trans-94.8109.8169.7-159.46.3000107.5
471Y30.6Very low31.2Very low192 Ų192144.2 Ų144.275%0.75378%0.781SS**  trans-100.1103.7172.8-105.2-86.8000109.3W469W469-Y471 HydrophobicContact CE3-CD2 4.22Å; W469-Y471 AromaticContact CE3-CE2 3.64Å; W469-Y471 HydrophobicContact CE3-CE2 3.64Å; W469-Y471 AromaticContact CZ3-CE2 3.8Å; W469-Y471 HydrophobicContact CZ3-CE2 3.8Å
472N29.3Very low31.1Very low136 Ų136143.8 Ų143.873%0.72778%0.783SS**  trans-126.2141.3161.4-97.1-23.8000108.9
473N28Very low31.2Very low149 Ų149150.1 Ų150.180%0.79780%0.804SS**  trans83.4154.2164.1-85.4-0.5000119.5
474P33.2Very low31.1Very low101 Ų101151.8 Ų151.866%0.65680%0.803SS**  cis-142.2-177.9-49.135.9-16.1000112.7
475S26.7Very low31.3Very low103 Ų103152.8 Ų152.872%0.7280%0.803SS**  trans64.7107.3153.558.30000121.3
476Y31.6Very low31.2Very low227 Ų227152.3 Ų152.389%0.8980%0.799SS**  trans-149.9104.7142.7-103.7-89.5000104.2
477E31.4Very low31.3Very low176 Ų176154.4 Ų154.482%0.82280%0.799SS**  31.8121.688.8-75.5-175.8170.500111.4
478S34.5Very low31.2Very low98 Ų98158.9 Ų158.969%0.68581%0.806SS**  cis-174.9151.427.544.70000108.5
479D29.7Very low31.2Very low148 Ų148156.6 Ų156.679%0.79180%0.799SS**  trans49.1100.5146.3-57.3-24.7000121.1
480I35Very low31Very low176 Ų176152.9 Ų152.990%0.90380%0.8SS**  -138103.7129.4-61.5-175000108.1
481S32.5Very low31.1Very low100 Ų100153.8 Ų153.870%0.69980%0.803SS**  trans-75.8146.5170.550.30000112.6
482S30.5Very low31.2Very low105 Ų105150.6 Ų150.673%0.73481%0.807SS**  trans61.5104.615362.50000119.9
483F31.9Very low31.4Very low288 Ų288151.9 Ų151.9100%1.26382%0.815SS**  -152.30121.6-112.1-77000110.8

Retrieved 483 of 483 residues in 721.3 ms (Link to these results)

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