A0A3Q0KN00_SCHMA Loading...

Bestrophin homolog

Forms chloride channels.

AlphaFold DB (A0A5K4ENN3), UniProt , Accession A0A3Q0KN00, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 583 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
1M51.9Low77Confident114 Ų11469 Ų6956%0.56243%0.426SS*.  0116.90-75.4-167.9175.700108.5V3 W97M1-V3 VanDerWaalsContact C-N 3.26Å; M1-V3 PolarHBondContact O-N 3.2Å; M1-W97 HydrophobicContact CE-CH2 3.39Å; M1-W97 HydrophobicContact CE-CZ2 3.68Å; M1-W97 HydrophobicContact CE-CZ3 4.28Å; M1-W97 HydrophobicContact CG-CZ2 4.34Å
2T67.3Low77.2Confident38 Ų3875.8 Ų75.823%0.23347%0.467CS..  trans-44.3-47.5165.337.80000112.6S4 D357 D358 D359 E361T2-S4 PolarHBondContact O-N 3.14Å; T2-D357 WeakPolarHBondContact CB-O 3Å; T2-D357 PolarHBondContact OG1-O 2.85Å; T2-D358 WeakPolarHBondContact OG1-CA 3.41Å; T2-D359 WeakPolarHBondContact CG2-O 3.48Å; T2-E361 HydrophobicContact CG2-CG 3.2Å; T2-E361 WeakPolarHBondContact CG2-OE1 3.47Å
3V76.6Confident77.3Confident6 Ų680.7 Ų80.74%0.03648%0.478CS..SBendtrans-92.774.2-179.8-168.10000109.8M1 Y5 R23 R25 D357 D358M1-V3 VanDerWaalsContact C-N 3.26Å; M1-V3 PolarHBondContact O-N 3.2Å; V3-Y5 VanDerWaalsContact O-CD1 3.3Å; V3-Y5 WeakPolarHBondContact O-CD1 3.45Å; V3-Y5 PolarHBondContact O-N 3.29Å; V3-R23 VanDerWaalsContact CG1-CZ 3.42Å; V3-R25 HydrophobicContact CG2-CG 4.39Å; V3-D357 HydrophobicContact CG2-CB 4.25Å; V3-D357 WeakPolarHBondContact CG2-O 3.36Å; V3-D358 WeakPolarHBondContact CB-OD1 3.37Å; V3-D358 VanDerWaalsContact CG2-OD1 3.23Å; V3-D358 WeakPolarHBondContact CG2-OD1 3.34Å
4S79.2Confident77.4Confident82 Ų8292.4 Ų92.457%0.57351%0.512SS*.  trans-67.2125.4174.4-174.10000111.2T2 R23T2-S4 PolarHBondContact O-N 3.14Å; S4-R23 PolarHBondContact O-NH1 3.35Å; S4-R23 VanDerWaalsContact O-NH1 3.1Å; S4-R23 PolarHBondContact O-NH2 3.47Å
5Y83.9Confident77.4Confident90 Ų9088.8 Ų88.835%0.35351%0.505SS..  trans-128.96.8169.459.5-92.9000112.3V3 S7 L8 I9 L20V3-Y5 VanDerWaalsContact O-CD1 3.3Å; V3-Y5 WeakPolarHBondContact O-CD1 3.45Å; V3-Y5 PolarHBondContact O-N 3.29Å; Y5-S7 VanDerWaalsContact C-N 3.3Å; Y5-S7 PolarHBondContact O-N 3.03Å; Y5-L8 WeakPolarHBondContact O-CB 3.07Å; Y5-L8 PolarHBondContact O-N 3.15Å; Y5-I9 HydrophobicContact CD2-CD1 3.88Å; Y5-I9 HydrophobicContact CD2-CG1 4.16Å; Y5-I9 HydrophobicContact CD2-CG2 4.38Å; Y5-I9 HydrophobicContact CE2-CD1 3.74Å; Y5-I9 PolarHBondContact O-N 3.1Å; Y5-L20 HydrophobicContact CD2-CD1 4.38Å; Y5-L20 HydrophobicContact CD2-CD2 4.12Å; Y5-L20 HydrophobicContact CG-CD2 4.12Å
6G81.8Confident77.5Confident39 Ų3984.2 Ų84.240%0.40248%0.48SS..Hα-helixtrans-58.1-39.1-175.500000113.4L8 I9 A10G6-L8 VanDerWaalsContact C-N 3.27Å; G6-L8 PolarHBondContact O-N 3.31Å; G6-I9 WeakPolarHBondContact O-CG1 3.41Å; G6-I9 PolarHBondContact O-N 3.38Å; G6-A10 PolarHBondContact O-N 2.94Å
7S83.1Confident77.7Confident105 Ų10588.2 Ų88.273%0.73449%0.491SS*.Hα-helixtrans-66-28176.257.20000113.4Y5Y5-S7 VanDerWaalsContact C-N 3.3Å; Y5-S7 PolarHBondContact O-N 3.03Å
8L77.2Confident78Confident71 Ų7190.5 Ų90.537%0.37250%0.495SS..Hα-helixtrans-75.3-30.7-179.7-171.967.5000112Y5 G6 L20Y5-L8 WeakPolarHBondContact O-CB 3.07Å; Y5-L8 PolarHBondContact O-N 3.15Å; G6-L8 VanDerWaalsContact C-N 3.27Å; G6-L8 PolarHBondContact O-N 3.31Å; L8-L20 HydrophobicContact CD2-CD2 3.81Å
9I82.7Confident78.2Confident57 Ų5794.4 Ų94.429%0.29250%0.502SS..Hα-helixtrans-102.72.5179.761.4164.9000113.4Y5 G6 T11 F17 L20Y5-I9 HydrophobicContact CD2-CD1 3.88Å; Y5-I9 HydrophobicContact CD2-CG1 4.16Å; Y5-I9 HydrophobicContact CD2-CG2 4.38Å; Y5-I9 HydrophobicContact CE2-CD1 3.74Å; Y5-I9 PolarHBondContact O-N 3.1Å; G6-I9 WeakPolarHBondContact O-CG1 3.41Å; G6-I9 PolarHBondContact O-N 3.38Å; I9-T11 PolarHBondContact O-N 3.23Å; I9-T11 VanDerWaalsContact O-N 3.13Å; I9-F17 HydrophobicContact CG2-CD1 4.16Å; I9-F17 HydrophobicContact CG2-CE1 4.05Å; I9-L20 HydrophobicContact CG2-CD1 3.91Å; I9-L20 HydrophobicContact CG2-CG 4.47Å
10A81.9Confident78.6Confident80 Ų8091.9 Ų91.966%0.66149%0.488SS*.SBendtrans-59.1-27.2-178.200000112.8G6G6-A10 PolarHBondContact O-N 2.94Å
11T81.4Confident79Confident77 Ų7791.8 Ų91.847%0.47249%0.487SS..SBendtrans-117127172.859.30000110I9 K13 S16I9-T11 PolarHBondContact O-N 3.23Å; I9-T11 VanDerWaalsContact O-N 3.13Å; T11-K13 PolarHBondContact O-N 3.02Å; T11-K13 WeakPolarHBondContact OG1-CE 3.31Å; T11-S16 PolarHBondContact O-OG 2.79Å
12V78.9Confident80.5Confident151 Ų15193.9 Ų93.992%0.91549%0.493SS*.  trans-72.590.6174.5-175.50000109.1
13K79.5Confident81.4Confident139 Ų13996.4 Ų96.460%0.60450%0.499SS*.  trans-101152.3169.7-61.9-176.5179.9-174.30110.4T11 G15 S16T11-K13 PolarHBondContact O-N 3.02Å; T11-K13 WeakPolarHBondContact OG1-CE 3.31Å; K13-G15 PolarHBondContact O-N 2.87Å; K13-S16 WeakPolarHBondContact CA-OG 3.45Å; K13-S16 WeakPolarHBondContact CB-OG 3.18Å; K13-S16 PolarHBondContact N-OG 3.44Å; K13-S16 WeakPolarHBondContact O-CB 3.33Å; K13-S16 PolarHBondContact O-N 3.01Å; K13-S16 VanDerWaalsContact O-N 3.08Å; K13-S16 PolarHBondContact O-OG 3.4Å
14Y78.7Confident82Confident244 Ų244103 Ų10396%0.95752%0.523SS*.THydrogen-bonded Turntrans-52.2126.7168.6-71.5-76.2000109.9
15G77.6Confident82.4Confident39 Ų39106.3 Ų106.340%0.40252%0.523SS..THydrogen-bonded Turntrans79.59.4179.700000116.4K13 F17 F18 R19K13-G15 PolarHBondContact O-N 2.87Å; G15-F17 VanDerWaalsContact C-N 3.33Å; G15-F17 PolarHBondContact O-N 3.04Å; G15-F18 WeakPolarHBondContact O-CB 3.47Å; G15-F18 PolarHBondContact O-N 3.24Å; G15-R19 PolarHBondContact O-N 3Å
16S78Confident82.4Confident15 Ų15103.2 Ų103.211%0.10552%0.519CS..Hα-helixtrans-57.5-43.7178.7-57.50000112.5T11 K13T11-S16 PolarHBondContact O-OG 2.79Å; K13-S16 WeakPolarHBondContact CA-OG 3.45Å; K13-S16 WeakPolarHBondContact CB-OG 3.18Å; K13-S16 PolarHBondContact N-OG 3.44Å; K13-S16 WeakPolarHBondContact O-CB 3.33Å; K13-S16 PolarHBondContact O-N 3.01Å; K13-S16 VanDerWaalsContact O-N 3.08Å; K13-S16 PolarHBondContact O-OG 3.4Å
17F81.4Confident82.9Confident152 Ų152102 Ų10267%0.66750%0.504SS*.Hα-helixtrans-74-30173.1-75.7-11000113.6I9 G15 R19 L20 L21I9-F17 HydrophobicContact CG2-CD1 4.16Å; I9-F17 HydrophobicContact CG2-CE1 4.05Å; G15-F17 VanDerWaalsContact C-N 3.33Å; G15-F17 PolarHBondContact O-N 3.04Å; F17-R19 PolarHBondContact O-N 2.79Å; F17-L20 HydrophobicContact CD1-CD1 3.64Å; F17-L20 HydrophobicContact CE1-CD1 4.17Å; F17-L20 WeakPolarHBondContact O-CB 3.23Å; F17-L20 PolarHBondContact O-N 3.49Å; F17-L21 PolarHBondContact O-N 3.28Å
18F83.4Confident83.2Confident130 Ų13099.8 Ų99.857%0.5748%0.484SS*.Hα-helixtrans-62.7-34.9175.5-166.9-105.2000111.6G15 L20 L21 F22G15-F18 WeakPolarHBondContact O-CB 3.47Å; G15-F18 PolarHBondContact O-N 3.24Å; F18-L20 VanDerWaalsContact C-N 3.3Å; F18-L20 PolarHBondContact O-N 2.78Å; F18-L21 HydrophobicContact CD2-CD1 4.07Å; F18-L21 HydrophobicContact CE2-CD1 4.49Å; F18-L21 WeakPolarHBondContact O-CB 3.45Å; F18-L21 PolarHBondContact O-N 3.38Å; F18-F22 AromaticContact CD1-CE2 3.8Å; F18-F22 HydrophobicContact CD1-CE2 3.8Å; F18-F22 AromaticContact CE1-CE2 3.42Å; F18-F22 HydrophobicContact CE1-CE2 3.42Å; F18-F22 VanDerWaalsContact CE1-CE2 3.42Å; F18-F22 AromaticContact CE1-CZ 3.9Å; F18-F22 HydrophobicContact CE1-CZ 3.9Å; F18-F22 AromaticContact CZ-CE2 3.96Å; F18-F22 HydrophobicContact CZ-CE2 3.96Å; F18-F22 HydrophobicContact CZ-CZ 4.09Å; F18-F22 WeakPolarHBondContact O-CD2 3.43Å
19R81.4Confident83.8Confident164 Ų164100.5 Ų100.562%0.61948%0.482SS*.Hα-helixtrans-64.4-32.5172.5-70.1-179.9-177.9173.4-0.2113.1G15 F17 L21 F22G15-R19 PolarHBondContact O-N 3Å; F17-R19 PolarHBondContact O-N 2.79Å; R19-L21 VanDerWaalsContact C-N 3.25Å; R19-L21 PolarHBondContact O-N 3.22Å; R19-F22 PolarHBondContact O-N 3.21Å
20L85.4Confident84.3Confident44 Ų44101.6 Ų101.623%0.2349%0.485CS..Hα-helixtrans-65.2-31.9176.2-65.5174.2000111.8Y5 L8 I9 F17 F18 F22 R23Y5-L20 HydrophobicContact CD2-CD1 4.38Å; Y5-L20 HydrophobicContact CD2-CD2 4.12Å; Y5-L20 HydrophobicContact CG-CD2 4.12Å; L8-L20 HydrophobicContact CD2-CD2 3.81Å; I9-L20 HydrophobicContact CG2-CD1 3.91Å; I9-L20 HydrophobicContact CG2-CG 4.47Å; F17-L20 HydrophobicContact CD1-CD1 3.64Å; F17-L20 HydrophobicContact CE1-CD1 4.17Å; F17-L20 WeakPolarHBondContact O-CB 3.23Å; F17-L20 PolarHBondContact O-N 3.49Å; F18-L20 VanDerWaalsContact C-N 3.3Å; F18-L20 PolarHBondContact O-N 2.78Å; L20-F22 PolarHBondContact O-N 3.23Å; L20-F22 VanDerWaalsContact O-N 3.14Å; L20-R23 WeakPolarHBondContact O-CB 3.16Å; L20-R23 PolarHBondContact O-N 3.09Å; L20-R23 VanDerWaalsContact O-N 3.09Å
21L86.8Confident84.8Confident90 Ų90100.4 Ų100.447%0.47147%0.467SS..THydrogen-bonded Turntrans-65.4-12.5177.5-62.7178000113.8F17 F18 R19 Y29F17-L21 PolarHBondContact O-N 3.28Å; F18-L21 HydrophobicContact CD2-CD1 4.07Å; F18-L21 HydrophobicContact CE2-CD1 4.49Å; F18-L21 WeakPolarHBondContact O-CB 3.45Å; F18-L21 PolarHBondContact O-N 3.38Å; R19-L21 VanDerWaalsContact C-N 3.25Å; R19-L21 PolarHBondContact O-N 3.22Å; L21-Y29 WeakPolarHBondContact O-CE2 3.23Å; L21-Y29 PolarHBondContact O-OH 2.93Å
22F85.1Confident85.4Confident158 Ų15896.9 Ų96.969%0.69345%0.445SS*.THydrogen-bonded Turntrans-99.4-2.5174.8-67.7-72.5000113.7F18 R19 L20F18-F22 AromaticContact CD1-CE2 3.8Å; F18-F22 HydrophobicContact CD1-CE2 3.8Å; F18-F22 AromaticContact CE1-CE2 3.42Å; F18-F22 HydrophobicContact CE1-CE2 3.42Å; F18-F22 VanDerWaalsContact CE1-CE2 3.42Å; F18-F22 AromaticContact CE1-CZ 3.9Å; F18-F22 HydrophobicContact CE1-CZ 3.9Å; F18-F22 AromaticContact CZ-CE2 3.96Å; F18-F22 HydrophobicContact CZ-CE2 3.96Å; F18-F22 HydrophobicContact CZ-CZ 4.09Å; F18-F22 WeakPolarHBondContact O-CD2 3.43Å; R19-F22 PolarHBondContact O-N 3.21Å; L20-F22 PolarHBondContact O-N 3.23Å; L20-F22 VanDerWaalsContact O-N 3.14Å
23R86.3Confident86.2Confident91 Ų9196 Ų9634%0.34343%0.426SS..  trans-76.5135.3176.5-170169.1-177.21520.9109.2V3 S4 L20 S27V3-R23 VanDerWaalsContact CG1-CZ 3.42Å; S4-R23 PolarHBondContact O-NH1 3.35Å; S4-R23 VanDerWaalsContact O-NH1 3.1Å; S4-R23 PolarHBondContact O-NH2 3.47Å; L20-R23 WeakPolarHBondContact O-CB 3.16Å; L20-R23 PolarHBondContact O-N 3.09Å; L20-R23 VanDerWaalsContact O-N 3.09Å; R23-S27 WeakPolarHBondContact O-CB 3.37Å; R23-S27 PolarHBondContact O-OG 2.98Å
24W88.7Confident86.9Confident144 Ų14492.2 Ų92.255%0.54542%0.415SS..  trans-96.4-42.9179.7-177.7-104.8000114.1S27 K30 W33W24-S27 WeakPolarHBondContact O-CB 3.48Å; W24-S27 PolarHBondContact O-N 3.02Å; W24-S27 PolarHBondContact O-OG 3.39Å; W24-K30 HydrophobicContact CD2-CB 4.42Å; W24-K30 HydrophobicContact CZ2-CB 4.1Å; W24-K30 HydrophobicContact CZ2-CG 4.23Å; W24-W33 AromaticContact CH2-CD1 3.94Å; W24-W33 HydrophobicContact CH2-CG 4.44Å
25R86.6Confident87.6Confident152 Ų15282.1 Ų82.157%0.57439%0.385SS*.THydrogen-bonded Turntrans-70.7128.9179.8-169.9-180178.3105.72.4110.4V3 S27 D357V3-R25 HydrophobicContact CG2-CG 4.39Å; R25-S27 PolarHBondContact O-N 3.39Å; R25-D357 HydrophobicContact CG-CB 4.29Å; R25-D357 WeakPolarHBondContact CG-OD2 3.43Å
26G84.7Confident88.4Confident26 Ų2681.9 Ų81.927%0.26837%0.374SS..THydrogen-bonded Turntrans63.622.9-172.200000113.7D357 D358G26-D357 PolarHBondContact N-OD2 2.88Å; G26-D358 WeakPolarHBondContact CA-OD2 3.35Å
27S91.2Very high89.3Confident12 Ų1286.2 Ų86.28%0.08440%0.396CS..  trans-93.5154.8-174.576.90000113.2R23 W24 R25 Y29 K30 L31R23-S27 WeakPolarHBondContact O-CB 3.37Å; R23-S27 PolarHBondContact O-OG 2.98Å; W24-S27 WeakPolarHBondContact O-CB 3.48Å; W24-S27 PolarHBondContact O-N 3.02Å; W24-S27 PolarHBondContact O-OG 3.39Å; R25-S27 PolarHBondContact O-N 3.39Å; S27-Y29 PolarHBondContact O-N 3.42Å; S27-Y29 PolarHBondContact OG-N 3.02Å; S27-K30 PolarHBondContact O-N 3.37Å; S27-K30 PolarHBondContact OG-N 2.98Å; S27-L31 PolarHBondContact O-N 3.16Å
28L90.1Very high90Very high59 Ų5982.6 Ų82.631%0.30939%0.386SS..Hα-helixtrans-52.8-40.8170.2-168.865.5000112L31 V32 I337L28-L31 PolarHBondContact O-N 3.41Å; L28-V32 HydrophobicContact CD1-CG2 4.2Å; L28-V32 HydrophobicContact CG-CG2 4.28Å; L28-V32 WeakPolarHBondContact O-CB 3.49Å; L28-V32 VanDerWaalsContact O-CG2 3.29Å; L28-V32 WeakPolarHBondContact O-CG2 3.48Å; L28-V32 PolarHBondContact O-N 3.35Å; L28-I337 HydrophobicContact CD2-CG2 3.74Å; L28-I337 HydrophobicContact CG-CG2 4.47Å
29Y90.9Very high90.6Very high86 Ų8677 Ų7734%0.33736%0.361SS..Hα-helixtrans-66.6-40.9-176.8-47.8-74.1000111.8L21 S27 L31 V32 W33L21-Y29 WeakPolarHBondContact O-CE2 3.23Å; L21-Y29 PolarHBondContact O-OH 2.93Å; S27-Y29 PolarHBondContact O-N 3.42Å; S27-Y29 PolarHBondContact OG-N 3.02Å; Y29-L31 PolarHBondContact O-N 3.31Å; Y29-V32 PolarHBondContact O-N 2.83Å; Y29-W33 WeakPolarHBondContact O-CB 3.49Å; Y29-W33 VanDerWaalsContact O-CD1 3.3Å; Y29-W33 PolarHBondContact O-N 3.36Å
30K93Very high91.2Very high81 Ų8171.5 Ų71.535%0.35235%0.347SS..Hα-helixtrans-60-34.7177.1-174.9178.5170-174.70111.7W24 S27 W33 D357W24-K30 HydrophobicContact CD2-CB 4.42Å; W24-K30 HydrophobicContact CZ2-CB 4.1Å; W24-K30 HydrophobicContact CZ2-CG 4.23Å; S27-K30 PolarHBondContact O-N 3.37Å; S27-K30 PolarHBondContact OG-N 2.98Å; K30-W33 PolarHBondContact O-NE1 2.94Å; K30-D357 WeakPolarHBondContact CD-OD2 3.36Å; K30-D357 IonicContact NZ-OD1 2.7Å; K30-D357 PolarHBondContact NZ-OD1 3.5Å; K30-D357 IonicContact NZ-OD2 3.98Å; K30-D357 PolarHBondContact NZ-OD2 3.47Å
31L91.6Very high91.7Very high54 Ų5475.7 Ų75.728%0.28336%0.364SS..Hα-helixtrans-79.7-36.1179.4-67.8165.4000113.3S27 L28 Y29 K344S27-L31 PolarHBondContact O-N 3.16Å; L28-L31 PolarHBondContact O-N 3.41Å; Y29-L31 PolarHBondContact O-N 3.31Å; L31-K344 HydrophobicContact CB-CB 3.99Å; L31-K344 HydrophobicContact CB-CD 4.37Å; L31-K344 HydrophobicContact CB-CG 4.2Å; L31-K344 HydrophobicContact CD1-CB 4.35Å
32V94.5Very high92.1Very high3 Ų376.5 Ų76.52%0.01836%0.364CS..Hα-helixtrans-94.6-26.7-169.3176.50000113.4L28 Y29 G35 L36 F336 I337 G341 K344L28-V32 HydrophobicContact CD1-CG2 4.2Å; L28-V32 HydrophobicContact CG-CG2 4.28Å; L28-V32 WeakPolarHBondContact O-CB 3.49Å; L28-V32 VanDerWaalsContact O-CG2 3.29Å; L28-V32 WeakPolarHBondContact O-CG2 3.48Å; L28-V32 PolarHBondContact O-N 3.35Å; Y29-V32 PolarHBondContact O-N 2.83Å; V32-G35 PolarHBondContact O-N 3.34Å; V32-L36 HydrophobicContact CG1-CB 4.28Å; V32-L36 PolarHBondContact O-N 3.36Å; V32-F336 HydrophobicContact CG1-CD1 3.92Å; V32-F336 HydrophobicContact CG1-CE1 3.74Å; V32-I337 HydrophobicContact CG1-CG1 4.44Å; V32-G341 VanDerWaalsContact CG2-CA 3.46Å; V32-K344 HydrophobicContact CG2-CG 4.36Å
33W94.4Very high92.5Very high134 Ų13469.6 Ų69.651%0.50833%0.333SS..Hα-helixtrans-55.8-38.6-171.179.5-89.8000115.4W24 Y29 K30 L36 L37W24-W33 AromaticContact CH2-CD1 3.94Å; W24-W33 HydrophobicContact CH2-CG 4.44Å; Y29-W33 WeakPolarHBondContact O-CB 3.49Å; Y29-W33 VanDerWaalsContact O-CD1 3.3Å; Y29-W33 PolarHBondContact O-N 3.36Å; K30-W33 PolarHBondContact O-NE1 2.94Å; W33-L36 PolarHBondContact O-N 2.83Å; W33-L37 HydrophobicContact CZ3-CD1 4.26Å; W33-L37 WeakPolarHBondContact O-CB 3.45Å; W33-L37 PolarHBondContact O-N 3.25Å
34P94.7Very high92.7Very high59 Ų5967.3 Ų67.338%0.38333%0.334SS..Hα-helixtrans-67.5-43.9-179.6-15.130.2000110.8L37 V38P34-L37 PolarHBondContact O-N 3.17Å; P34-V38 WeakPolarHBondContact O-CG2 3.32Å; P34-V38 PolarHBondContact O-N 3.18Å; P34-V38 VanDerWaalsContact O-N 3.13Å
35G94Very high92.9Very high31 Ų3162.4 Ų62.432%0.3232%0.324SS..Hα-helixtrans-65.1-39.1176.800000112.2V32 V38 Y39V32-G35 PolarHBondContact O-N 3.34Å; G35-V38 PolarHBondContact O-N 2.98Å; G35-Y39 WeakPolarHBondContact O-CB 3.4Å; G35-Y39 PolarHBondContact O-N 2.92Å
36L95.2Very high93.2Very high35 Ų3556.4 Ų56.418%0.18330%0.304CS..Hα-helixtrans-64.5-40.5176.5179.563.7000111.6V32 W33 Y39 C40 I333 F336 I337V32-L36 HydrophobicContact CG1-CB 4.28Å; V32-L36 PolarHBondContact O-N 3.36Å; W33-L36 PolarHBondContact O-N 2.83Å; L36-Y39 PolarHBondContact O-N 3.1Å; L36-C40 WeakPolarHBondContact O-CB 3.39Å; L36-C40 PolarHBondContact O-N 3.23Å; L36-C40 PolarHBondContact O-SG 3.33Å; L36-I333 HydrophobicContact CD1-CG2 3.94Å; L36-I333 HydrophobicContact CD2-CG2 4.33Å; L36-F336 HydrophobicContact CB-CD1 4.03Å; L36-F336 HydrophobicContact CB-CE1 3.82Å; L36-F336 HydrophobicContact CD1-CB 4.34Å; L36-F336 HydrophobicContact CD1-CD1 3.64Å; L36-F336 HydrophobicContact CD1-CE1 4.22Å; L36-F336 HydrophobicContact CD1-CG 4.11Å; L36-F336 HydrophobicContact CG-CD1 4.42Å; L36-I337 HydrophobicContact CD2-CD1 4.36Å; L36-I337 HydrophobicContact CD2-CG1 4.3Å
37L96.1Very high93.4Very high105 Ų10555.9 Ų55.955%0.5530%0.297SS..Hα-helixtrans-61.2-47.5176.5-168.9164.1000110.7W33 P34 Y39 C40 F41W33-L37 HydrophobicContact CZ3-CD1 4.26Å; W33-L37 WeakPolarHBondContact O-CB 3.45Å; W33-L37 PolarHBondContact O-N 3.25Å; P34-L37 PolarHBondContact O-N 3.17Å; L37-Y39 VanDerWaalsContact C-N 3.34Å; L37-Y39 PolarHBondContact O-N 3.37Å; L37-C40 PolarHBondContact O-N 3.39Å; L37-F41 WeakPolarHBondContact O-CB 3.36Å; L37-F41 PolarHBondContact O-N 2.96Å
38V96.2Very high93.3Very high77 Ų7760.4 Ų60.447%0.46732%0.319SS..Hα-helixtrans-60-44.6176.31740000111.2P34 G35 F41 F42P34-V38 WeakPolarHBondContact O-CG2 3.32Å; P34-V38 PolarHBondContact O-N 3.18Å; P34-V38 VanDerWaalsContact O-N 3.13Å; G35-V38 PolarHBondContact O-N 2.98Å; V38-F41 WeakPolarHBondContact O-CB 3.48Å; V38-F41 PolarHBondContact O-N 3Å; V38-F42 HydrophobicContact CG1-CD2 3.78Å; V38-F42 HydrophobicContact CG1-CE2 3.64Å; V38-F42 VanDerWaalsContact O-CD2 3.27Å; V38-F42 WeakPolarHBondContact O-CD2 3.3Å; V38-F42 PolarHBondContact O-N 2.98Å; V38-F42 VanDerWaalsContact O-N 3.08Å
39Y95.8Very high93.3Very high11 Ų1160.4 Ų60.44%0.04333%0.328CS..Hα-helixtrans-59.5-49.5176.3178.8-92.6000112G35 L36 L37 F41 F42 Y43 F264 T267 I268 T332 F336G35-Y39 WeakPolarHBondContact O-CB 3.4Å; G35-Y39 PolarHBondContact O-N 2.92Å; L36-Y39 PolarHBondContact O-N 3.1Å; L37-Y39 VanDerWaalsContact C-N 3.34Å; L37-Y39 PolarHBondContact O-N 3.37Å; Y39-F41 VanDerWaalsContact C-N 3.29Å; Y39-F41 PolarHBondContact O-N 2.98Å; Y39-F42 PolarHBondContact O-N 3.09Å; Y39-Y43 WeakPolarHBondContact O-CB 3.35Å; Y39-Y43 PolarHBondContact O-N 3.34Å; Y39-F264 HydrophobicContact CD2-CB 4.27Å; Y39-F264 HydrophobicContact CE2-CB 4.06Å; Y39-F264 HydrophobicContact CE2-CD1 4.15Å; Y39-F264 HydrophobicContact CE2-CG 4.48Å; Y39-T267 PolarHBondContact OH-OG1 2.9Å; Y39-I268 HydrophobicContact CD2-CD1 4.22Å; Y39-I268 HydrophobicContact CD2-CG1 4.07Å; Y39-I268 HydrophobicContact CE2-CD1 4.21Å; Y39-I268 HydrophobicContact CE2-CG1 3.6Å; Y39-T332 HydrophobicContact CE1-CG2 4.32Å; Y39-T332 WeakPolarHBondContact OH-CG2 3.35Å; Y39-F336 HydrophobicContact CD1-CD2 4.28Å; Y39-F336 AromaticContact CD2-CD2 3.86Å; Y39-F336 HydrophobicContact CD2-CD2 3.86Å; Y39-F336 AromaticContact CD2-CE2 3.91Å; Y39-F336 HydrophobicContact CD2-CE2 3.91Å; Y39-F336 HydrophobicContact CE2-CD2 4.34Å; Y39-F336 AromaticContact CG-CD2 3.82Å; Y39-F336 HydrophobicContact CG-CD2 3.82Å; Y39-F336 AromaticContact CG-CE2 3.9Å; Y39-F336 HydrophobicContact CG-CE2 3.9Å
40C94.2Very high93Very high49 Ų4956.5 Ų56.533%0.33131%0.313SS..Hα-helixtrans-60.9-38.1177.7-730000112L36 L37 A44L36-C40 WeakPolarHBondContact O-CB 3.39Å; L36-C40 PolarHBondContact O-N 3.23Å; L36-C40 PolarHBondContact O-SG 3.33Å; L37-C40 PolarHBondContact O-N 3.39Å; C40-A44 WeakPolarHBondContact O-CB 3.47Å; C40-A44 PolarHBondContact O-N 3.38Å
41F94.8Very high92.6Very high132 Ų13257 Ų5758%0.57932%0.316SS*.Hα-helixtrans-60.9-51.1175.3173.1-96.1000111.7L37 V38 Y39 A44 A45L37-F41 WeakPolarHBondContact O-CB 3.36Å; L37-F41 PolarHBondContact O-N 2.96Å; V38-F41 WeakPolarHBondContact O-CB 3.48Å; V38-F41 PolarHBondContact O-N 3Å; Y39-F41 VanDerWaalsContact C-N 3.29Å; Y39-F41 PolarHBondContact O-N 2.98Å; F41-A44 PolarHBondContact O-N 3.24Å; F41-A45 WeakPolarHBondContact O-CB 3.33Å; F41-A45 PolarHBondContact O-N 2.66Å
42F95Very high92.3Very high108 Ų10858.4 Ų58.447%0.47433%0.331SS..Hα-helixtrans-66.7-39.4178.6-77.6-67.2000112.6V38 Y39 A44 A45 V46 I268V38-F42 HydrophobicContact CG1-CD2 3.78Å; V38-F42 HydrophobicContact CG1-CE2 3.64Å; V38-F42 VanDerWaalsContact O-CD2 3.27Å; V38-F42 WeakPolarHBondContact O-CD2 3.3Å; V38-F42 PolarHBondContact O-N 2.98Å; V38-F42 VanDerWaalsContact O-N 3.08Å; Y39-F42 PolarHBondContact O-N 3.09Å; F42-A44 PolarHBondContact O-N 2.91Å; F42-A45 PolarHBondContact O-N 2.65Å; F42-V46 WeakPolarHBondContact O-CG2 3.35Å; F42-V46 PolarHBondContact O-N 3.21Å; F42-I268 HydrophobicContact CB-CD1 3.91Å
43Y93.8Very high91.7Very high13 Ų1360.4 Ų60.45%0.05134%0.341CS..Hα-helixtrans-59.4-47.4174.6-176.1-84.2000111.3Y39 V46 A47 H271 Q272 F273 P329Y39-Y43 WeakPolarHBondContact O-CB 3.35Å; Y39-Y43 PolarHBondContact O-N 3.34Å; Y43-V46 PolarHBondContact O-N 3.49Å; Y43-A47 WeakPolarHBondContact O-CB 3.43Å; Y43-A47 PolarHBondContact O-N 3.07Å; Y43-H271 PolarHBondContact OH-O 3.34Å; Y43-Q272 PolarHBondContact O-NE2 3.08Å; Y43-Q272 VanDerWaalsContact O-NE2 3.15Å; Y43-F273 WeakPolarHBondContact OH-CD2 3.26Å; Y43-F273 WeakPolarHBondContact OH-CE2 3.43Å; Y43-P329 HydrophobicContact CD1-CG 3.96Å; Y43-P329 HydrophobicContact CD2-CG 4.18Å; Y43-P329 HydrophobicContact CE1-CB 4.34Å; Y43-P329 VanDerWaalsContact CE1-CD 3.46Å; Y43-P329 HydrophobicContact CE1-CG 3.54Å; Y43-P329 HydrophobicContact CE2-CB 4.18Å; Y43-P329 HydrophobicContact CE2-CG 3.77Å; Y43-P329 HydrophobicContact CG-CG 4.27Å; Y43-P329 VanDerWaalsContact CZ-CG 3.43Å
44A91.9Very high90.9Very high43 Ų4356.9 Ų56.936%0.35534%0.335SS..Hα-helixtrans-64.9-40.1177.400000111.9C40 F41 F42 V46 A47 I48C40-A44 WeakPolarHBondContact O-CB 3.47Å; C40-A44 PolarHBondContact O-N 3.38Å; F41-A44 PolarHBondContact O-N 3.24Å; F42-A44 PolarHBondContact O-N 2.91Å; A44-V46 PolarHBondContact O-N 2.87Å; A44-A47 PolarHBondContact O-N 2.96Å; A44-I48 WeakPolarHBondContact O-CB 3.45Å; A44-I48 WeakPolarHBondContact O-CD1 3.32Å; A44-I48 WeakPolarHBondContact O-CG1 3.24Å; A44-I48 PolarHBondContact O-N 2.69Å
45A92.9Very high90Very high40 Ų4060.3 Ų60.333%0.33135%0.35SS..Hα-helixtrans-60.3-44.3176.700000111.8F41 F42 A49F41-A45 WeakPolarHBondContact O-CB 3.33Å; F41-A45 PolarHBondContact O-N 2.66Å; F42-A45 PolarHBondContact O-N 2.65Å; A45-A49 VanDerWaalsContact O-CB 3.29Å; A45-A49 WeakPolarHBondContact O-CB 3.4Å; A45-A49 PolarHBondContact O-N 2.96Å
46V92.2Very high89.3Confident26 Ų2664.8 Ų64.816%0.15836%0.361CS..Hα-helixtrans-66.7-41.6176173.40000111.4F42 Y43 A44 A49 Y50 F66 I268 F269 Q272F42-V46 WeakPolarHBondContact O-CG2 3.35Å; F42-V46 PolarHBondContact O-N 3.21Å; Y43-V46 PolarHBondContact O-N 3.49Å; A44-V46 PolarHBondContact O-N 2.87Å; V46-A49 PolarHBondContact O-N 2.91Å; V46-Y50 PolarHBondContact O-N 3.29Å; V46-F66 HydrophobicContact CG1-CE2 3.9Å; V46-F66 HydrophobicContact CG1-CZ 3.83Å; V46-I268 HydrophobicContact CB-CG2 4.24Å; V46-I268 HydrophobicContact CG2-CG2 3.77Å; V46-F269 HydrophobicContact CG1-CD1 4.21Å; V46-F269 HydrophobicContact CG1-CE1 4.26Å; V46-F269 HydrophobicContact CG2-CE1 4.29Å; V46-Q272 HydrophobicContact CG1-CG 4.05Å
47A89.6Confident88.5Confident15 Ų1568.5 Ų68.512%0.12439%0.387CS..Hα-helixtrans-61.9-46.3176.700000111.9Y43 A44 Y50 H51Y43-A47 WeakPolarHBondContact O-CB 3.43Å; Y43-A47 PolarHBondContact O-N 3.07Å; A44-A47 PolarHBondContact O-N 2.96Å; A47-Y50 PolarHBondContact O-N 3.43Å; A47-H51 PolarHBondContact O-CD2 3.46Å; A47-H51 PolarHBondContact O-N 3.32Å
48I89.1Confident87.7Confident107 Ų10770.8 Ų70.855%0.54940%0.395SS..Hα-helixtrans-63.3-42.8176.6-68.3164.6000110.2A44 Y50 H51 S52A44-I48 WeakPolarHBondContact O-CB 3.45Å; A44-I48 WeakPolarHBondContact O-CD1 3.32Å; A44-I48 WeakPolarHBondContact O-CG1 3.24Å; A44-I48 PolarHBondContact O-N 2.69Å; I48-Y50 VanDerWaalsContact C-N 3.33Å; I48-Y50 PolarHBondContact O-N 3.49Å; I48-H51 PolarHBondContact O-N 3.22Å; I48-S52 VanDerWaalsContact O-CB 3.26Å; I48-S52 WeakPolarHBondContact O-CB 3.32Å; I48-S52 PolarHBondContact O-N 3.09Å; I48-S52 PolarHBondContact O-OG 2.81Å
49A88.8Confident87.1Confident60 Ų6072.3 Ų72.350%0.49639%0.393SS..Hα-helixtrans-59.6-43.6177.200000111.6A45 V46 I53A45-A49 VanDerWaalsContact O-CB 3.29Å; A45-A49 WeakPolarHBondContact O-CB 3.4Å; A45-A49 PolarHBondContact O-N 2.96Å; V46-A49 PolarHBondContact O-N 2.91Å; A49-I53 WeakPolarHBondContact O-CG1 3.46Å
50Y86Confident86.3Confident3 Ų375.6 Ų75.61%0.01241%0.405CS..Hα-helixtrans-64.6-47.4175.6169.8-105.2000112.5V46 A47 I48 S52 I53 R63 F66 D275V46-Y50 PolarHBondContact O-N 3.29Å; A47-Y50 PolarHBondContact O-N 3.43Å; I48-Y50 VanDerWaalsContact C-N 3.33Å; I48-Y50 PolarHBondContact O-N 3.49Å; Y50-S52 VanDerWaalsContact C-N 3.28Å; Y50-S52 PolarHBondContact O-N 3.27Å; Y50-I53 WeakPolarHBondContact O-CB 3.39Å; Y50-I53 PolarHBondContact O-N 2.97Å; Y50-R63 PolarHBondContact OH-NH2 3.28Å; Y50-F66 HydrophobicContact CD1-CE1 4.41Å; Y50-F66 AromaticContact CD2-CD1 3.22Å; Y50-F66 HydrophobicContact CD2-CD1 3.22Å; Y50-F66 AromaticContact CD2-CE1 3.45Å; Y50-F66 HydrophobicContact CD2-CE1 3.45Å; Y50-F66 VanDerWaalsContact CD2-CE1 3.45Å; Y50-F66 HydrophobicContact CD2-CG 4Å; Y50-F66 HydrophobicContact CD2-CZ 4.39Å; Y50-F66 AromaticContact CE2-CD1 3.73Å; Y50-F66 HydrophobicContact CE2-CD1 3.73Å; Y50-F66 HydrophobicContact CE2-CE1 4.16Å; Y50-F66 AromaticContact CG-CD1 3.9Å; Y50-F66 HydrophobicContact CG-CD1 3.9Å; Y50-F66 AromaticContact CG-CE1 3.6Å; Y50-F66 HydrophobicContact CG-CE1 3.6Å; Y50-F66 HydrophobicContact CG-CZ 4.3Å; Y50-D275 PolarHBondContact OH-OD2 3.4Å
51H83.5Confident85.8Confident92 Ų9279.1 Ų79.143%0.42642%0.421SS..Hα-helixtrans-70.6-22.1-179.6-75.2-61.9000113.7A47 I48 I53A47-H51 PolarHBondContact O-CD2 3.46Å; A47-H51 PolarHBondContact O-N 3.32Å; I48-H51 PolarHBondContact O-N 3.22Å; H51-I53 PolarHBondContact O-N 2.91Å
52S85.8Confident85.3Confident84 Ų8475.2 Ų75.259%0.58741%0.413SS*.THydrogen-bonded Turntrans-74.3-13.7174.8-59.50000113I48 Y50 P54I48-S52 VanDerWaalsContact O-CB 3.26Å; I48-S52 WeakPolarHBondContact O-CB 3.32Å; I48-S52 PolarHBondContact O-N 3.09Å; I48-S52 PolarHBondContact O-OG 2.81Å; Y50-S52 VanDerWaalsContact C-N 3.28Å; Y50-S52 PolarHBondContact O-N 3.27Å; S52-P54 VanDerWaalsContact O-CD 3.29Å; S52-P54 WeakPolarHBondContact O-CD 3.35Å
53I82.2Confident84.8Confident44 Ų4471 Ų7123%0.22639%0.394CS..SBendtrans-74115.8177-60.5171.2000109.2A49 Y50 H51 Y59 R63A49-I53 WeakPolarHBondContact O-CG1 3.46Å; Y50-I53 WeakPolarHBondContact O-CB 3.39Å; Y50-I53 PolarHBondContact O-N 2.97Å; H51-I53 PolarHBondContact O-N 2.91Å; I53-Y59 HydrophobicContact CG2-CG 4.26Å; I53-R63 HydrophobicContact CB-CG 4.37Å; I53-R63 HydrophobicContact CG2-CG 3.73Å; I53-R63 PolarHBondContact O-NH1 3.18Å
54P77.8Confident84.4Confident60 Ų6072.9 Ų72.939%0.3941%0.405SS..  trans-61.6142.9-177.8-19.831.5000112.1S52 K56 Y59S52-P54 VanDerWaalsContact O-CD 3.29Å; S52-P54 WeakPolarHBondContact O-CD 3.35Å; P54-K56 HydrophobicContact CB-CD 4.42Å; P54-K56 HydrophobicContact CB-CG 4.15Å; P54-K56 PolarHBondContact O-N 3.49Å; P54-Y59 HydrophobicContact CB-CD2 4.32Å; P54-Y59 HydrophobicContact CG-CD2 4.31Å; P54-Y59 HydrophobicContact CG-CE2 4.26Å
55D75.1Confident84.2Confident132 Ų13275.9 Ų75.971%0.70641%0.414SS*.  trans-78.752.9176.6-15917.8000111.9
56K80.3Confident84.1Confident124 Ų12475.5 Ų75.554%0.53941%0.405SS..SBendtrans-101.3149.2176-65.6-176.2-178.6179.50109.7P54 E58 Y59 R60P54-K56 HydrophobicContact CB-CD 4.42Å; P54-K56 HydrophobicContact CB-CG 4.15Å; P54-K56 PolarHBondContact O-N 3.49Å; K56-E58 PolarHBondContact O-N 3.1Å; K56-Y59 HydrophobicContact CB-CD2 4.21Å; K56-Y59 PolarHBondContact O-N 3.17Å; K56-R60 PolarHBondContact O-N 2.98Å
57P76.5Confident83.8Confident114 Ų11476.2 Ų76.274%0.7441%0.41SS*.G310 helixtrans-57.5-28.3-178.722.8-33.8000113.2Y59 R60P57-Y59 PolarHBondContact O-N 3.23Å; P57-R60 WeakPolarHBondContact O-CB 3.48Å; P57-R60 PolarHBondContact O-N 3.04Å
58E81Confident83.8Confident153 Ų15381 Ų8172%0.71543%0.429SS*.G310 helixtrans-63.1-35.8177.8-64.5174.7-175.500113.3K56K56-E58 PolarHBondContact O-N 3.1Å
59Y82.5Confident83.9Confident109 Ų10979.6 Ų79.643%0.42742%0.422SS..G310 helixtrans-96.52.3-178.1-59.3-71.9000113.6I53 P54 K56 P57 N61 A62 R63I53-Y59 HydrophobicContact CG2-CG 4.26Å; P54-Y59 HydrophobicContact CB-CD2 4.32Å; P54-Y59 HydrophobicContact CG-CD2 4.31Å; P54-Y59 HydrophobicContact CG-CE2 4.26Å; K56-Y59 HydrophobicContact CB-CD2 4.21Å; K56-Y59 PolarHBondContact O-N 3.17Å; P57-Y59 PolarHBondContact O-N 3.23Å; Y59-N61 VanDerWaalsContact C-N 3.26Å; Y59-N61 PolarHBondContact O-N 3.2Å; Y59-A62 PolarHBondContact O-N 2.95Å; Y59-A62 VanDerWaalsContact O-N 3.09Å; Y59-R63 PolarHBondContact O-N 3.41Å; Y59-R63 VanDerWaalsContact O-N 3.08Å
60R79.5Confident84Confident79 Ų7976.9 Ų76.930%0.29840%0.399SS..Hα-helixtrans-58.6-37.8-177.8-171178.1178.51608.8112.6K56 P57 R63 L64 I279 H282K56-R60 PolarHBondContact O-N 2.98Å; P57-R60 WeakPolarHBondContact O-CB 3.48Å; P57-R60 PolarHBondContact O-N 3.04Å; R60-R63 PolarHBondContact O-N 2.9Å; R60-L64 HydrophobicContact CG-CD1 4.45Å; R60-L64 WeakPolarHBondContact O-CB 3.43Å; R60-L64 WeakPolarHBondContact O-CG 3.2Å; R60-L64 PolarHBondContact O-N 3.29Å; R60-I279 HydrophobicContact CG-CG2 4.43Å; R60-H282 PolarHBondContact NH2-CD2 3.45Å
61N83.6Confident84.2Confident124 Ų12483.8 Ų83.866%0.66343%0.426SS*.Hα-helixtrans-65.5-39.7177.4-68.6-16.6000112.1Y59 L64 L65Y59-N61 VanDerWaalsContact C-N 3.26Å; Y59-N61 PolarHBondContact O-N 3.2Å; N61-L64 PolarHBondContact O-N 2.79Å; N61-L65 PolarHBondContact O-N 2.84Å
62A85.1Confident84.5Confident49 Ų4983.7 Ų83.741%0.40543%0.428SS..Hα-helixtrans-67.4-41.4177.800000111.5Y59 L65 F66Y59-A62 PolarHBondContact O-N 2.95Å; Y59-A62 VanDerWaalsContact O-N 3.09Å; A62-L65 PolarHBondContact O-N 3.05Å; A62-F66 PolarHBondContact O-N 3.22Å
63R84.7Confident84.8Confident20 Ų2080.2 Ų80.28%0.07540%0.404CS..Hα-helixtrans-61.2-46.1173.4-66.3-177.869.1118.7-3.2111.1Y50 I53 Y59 R60 L65 F66 V67 D275Y50-R63 PolarHBondContact OH-NH2 3.28Å; I53-R63 HydrophobicContact CB-CG 4.37Å; I53-R63 HydrophobicContact CG2-CG 3.73Å; I53-R63 PolarHBondContact O-NH1 3.18Å; Y59-R63 PolarHBondContact O-N 3.41Å; Y59-R63 VanDerWaalsContact O-N 3.08Å; R60-R63 PolarHBondContact O-N 2.9Å; R63-L65 PolarHBondContact O-N 3.22Å; R63-F66 WeakPolarHBondContact O-CB 3.43Å; R63-F66 PolarHBondContact O-N 3.39Å; R63-V67 VanDerWaalsContact O-CG2 3.27Å; R63-V67 WeakPolarHBondContact O-CG2 3.31Å; R63-V67 PolarHBondContact O-N 2.97Å; R63-D275 IonicContact NH2-OD2 3.16Å; R63-D275 PolarHBondContact NH2-OD2 2.96Å; R63-D275 VanDerWaalsContact NH2-OD2 3.16Å
64L84.4Confident85.2Confident53 Ų5378.8 Ų78.828%0.27740%0.401SS..Hα-helixtrans-57.2-45.6175.9-85.5169.1000112.9R60 N61 F66 V67 Q68 I279R60-L64 HydrophobicContact CG-CD1 4.45Å; R60-L64 WeakPolarHBondContact O-CB 3.43Å; R60-L64 WeakPolarHBondContact O-CG 3.2Å; R60-L64 PolarHBondContact O-N 3.29Å; N61-L64 PolarHBondContact O-N 2.79Å; L64-F66 VanDerWaalsContact C-N 3.33Å; L64-F66 PolarHBondContact O-N 3.28Å; L64-V67 PolarHBondContact O-N 3.43Å; L64-Q68 PolarHBondContact O-N 3.28Å; L64-I279 HydrophobicContact CD1-CG2 4.08Å; L64-I279 HydrophobicContact CD2-CB 4.26Å; L64-I279 HydrophobicContact CD2-CG2 3.33Å; L64-I279 HydrophobicContact CG-CG2 3.57Å
65L87.7Confident85.7Confident106 Ų10683.7 Ų83.756%0.55541%0.411SS*.Hα-helixtrans-59.5-45.1176.6-171.994.5000111N61 A62 R63 Q68 I69N61-L65 PolarHBondContact O-N 2.84Å; A62-L65 PolarHBondContact O-N 3.05Å; R63-L65 PolarHBondContact O-N 3.22Å; L65-Q68 WeakPolarHBondContact O-CB 3.47Å; L65-Q68 PolarHBondContact O-N 2.94Å; L65-I69 HydrophobicContact CD2-CD1 4.14Å; L65-I69 HydrophobicContact CG-CD1 4.21Å; L65-I69 WeakPolarHBondContact O-CG1 3.49Å; L65-I69 PolarHBondContact O-N 3.19Å
66F90.1Very high86.4Confident31 Ų3180.8 Ų80.814%0.13640%0.398CS..Hα-helixtrans-61.4-45.8177.5-177.7-97.9000112V46 Y50 A62 R63 L64 Q68 I69 C70 F269 Q272 I274V46-F66 HydrophobicContact CG1-CE2 3.9Å; V46-F66 HydrophobicContact CG1-CZ 3.83Å; Y50-F66 HydrophobicContact CD1-CE1 4.41Å; Y50-F66 AromaticContact CD2-CD1 3.22Å; Y50-F66 HydrophobicContact CD2-CD1 3.22Å; Y50-F66 AromaticContact CD2-CE1 3.45Å; Y50-F66 HydrophobicContact CD2-CE1 3.45Å; Y50-F66 VanDerWaalsContact CD2-CE1 3.45Å; Y50-F66 HydrophobicContact CD2-CG 4Å; Y50-F66 HydrophobicContact CD2-CZ 4.39Å; Y50-F66 AromaticContact CE2-CD1 3.73Å; Y50-F66 HydrophobicContact CE2-CD1 3.73Å; Y50-F66 HydrophobicContact CE2-CE1 4.16Å; Y50-F66 AromaticContact CG-CD1 3.9Å; Y50-F66 HydrophobicContact CG-CD1 3.9Å; Y50-F66 AromaticContact CG-CE1 3.6Å; Y50-F66 HydrophobicContact CG-CE1 3.6Å; Y50-F66 HydrophobicContact CG-CZ 4.3Å; A62-F66 PolarHBondContact O-N 3.22Å; R63-F66 WeakPolarHBondContact O-CB 3.43Å; R63-F66 PolarHBondContact O-N 3.39Å; L64-F66 VanDerWaalsContact C-N 3.33Å; L64-F66 PolarHBondContact O-N 3.28Å; F66-Q68 VanDerWaalsContact C-N 3.26Å; F66-Q68 PolarHBondContact O-N 3.16Å; F66-I69 PolarHBondContact O-N 3.33Å; F66-I69 VanDerWaalsContact O-N 3.12Å; F66-C70 WeakPolarHBondContact CE1-SG 3.44Å; F66-C70 PolarHBondContact O-N 2.85Å; F66-C70 PolarHBondContact O-SG 3.47Å; F66-F269 HydrophobicContact CE2-CD1 4.41Å; F66-Q272 HydrophobicContact CE1-CB 4.41Å; F66-Q272 HydrophobicContact CZ-CB 4.37Å; F66-Q272 HydrophobicContact CZ-CG 4.12Å; F66-I274 HydrophobicContact CE1-CG1 4.45Å
67V87.6Confident86.8Confident42 Ų4275 Ų7526%0.25537%0.374SS..Hα-helixtrans-56.8-42.5174.8177.90000111.2R63 L64 C70 Y71 I274R63-V67 VanDerWaalsContact O-CG2 3.27Å; R63-V67 WeakPolarHBondContact O-CG2 3.31Å; R63-V67 PolarHBondContact O-N 2.97Å; L64-V67 PolarHBondContact O-N 3.43Å; V67-C70 PolarHBondContact O-N 3.46Å; V67-Y71 WeakPolarHBondContact O-CB 3.46Å; V67-Y71 PolarHBondContact O-N 3.13Å; V67-I274 HydrophobicContact CB-CD1 4.5Å; V67-I274 HydrophobicContact CB-CG2 4.24Å; V67-I274 HydrophobicContact CG1-CD1 4.34Å; V67-I274 HydrophobicContact CG1-CG2 4.09Å; V67-I274 HydrophobicContact CG2-CG2 3.36Å
68Q88.5Confident87.1Confident115 Ų11576.3 Ų76.354%0.53737%0.374SS..Hα-helixtrans-63.9-42.2177.5-173.1177.2-2.100112L64 L65 F66 Y71 I72L64-Q68 PolarHBondContact O-N 3.28Å; L65-Q68 WeakPolarHBondContact O-CB 3.47Å; L65-Q68 PolarHBondContact O-N 2.94Å; F66-Q68 VanDerWaalsContact C-N 3.26Å; F66-Q68 PolarHBondContact O-N 3.16Å; Q68-Y71 PolarHBondContact O-N 3.29Å; Q68-I72 HydrophobicContact CG-CD1 4.06Å; Q68-I72 VanDerWaalsContact O-CG1 3.31Å; Q68-I72 WeakPolarHBondContact O-CG1 3.29Å; Q68-I72 PolarHBondContact O-N 3.34Å
69I90.9Very high87.3Confident77 Ų7772.7 Ų72.740%0.39537%0.371SS..Hα-helixtrans-60.9-48.2175.9-69.1165.8000110.5L65 F66 Y71 I72 A73 F269L65-I69 HydrophobicContact CD2-CD1 4.14Å; L65-I69 HydrophobicContact CG-CD1 4.21Å; L65-I69 WeakPolarHBondContact O-CG1 3.49Å; L65-I69 PolarHBondContact O-N 3.19Å; F66-I69 PolarHBondContact O-N 3.33Å; F66-I69 VanDerWaalsContact O-N 3.12Å; I69-Y71 VanDerWaalsContact C-N 3.33Å; I69-Y71 PolarHBondContact O-N 3Å; I69-I72 PolarHBondContact O-N 2.93Å; I69-A73 VanDerWaalsContact O-CB 3.26Å; I69-A73 WeakPolarHBondContact O-CB 3.46Å; I69-A73 PolarHBondContact O-N 2.91Å; I69-F269 HydrophobicContact CG2-CB 4.47Å; I69-F269 HydrophobicContact CG2-CD1 4.46Å
70C91.3Very high87.4Confident3 Ų370.4 Ų70.42%0.0237%0.368CS..Hα-helixtrans-61.5-40.7177.7-64.80000112.1F66 V67 A73 G74 F269 G270 I274F66-C70 WeakPolarHBondContact CE1-SG 3.44Å; F66-C70 PolarHBondContact O-N 2.85Å; F66-C70 PolarHBondContact O-SG 3.47Å; V67-C70 PolarHBondContact O-N 3.46Å; C70-A73 PolarHBondContact O-N 3.14Å; C70-G74 PolarHBondContact O-N 2.93Å; C70-F269 WeakPolarHBondContact CB-O 3.18Å; C70-F269 PolarHBondContact SG-O 3.33Å; C70-G270 WeakPolarHBondContact O-CA 3.5Å; C70-I274 HydrophobicContact CB-CD1 3.2Å; C70-I274 HydrophobicContact CB-CG1 4.4Å
71Y89.2Confident87.8Confident148 Ų14870.8 Ų70.858%0.5838%0.381SS*.Hα-helixtrans-62.7-45.1176.7179.5-98000111.9V67 Q68 I69 G74 R75V67-Y71 WeakPolarHBondContact O-CB 3.46Å; V67-Y71 PolarHBondContact O-N 3.13Å; Q68-Y71 PolarHBondContact O-N 3.29Å; I69-Y71 VanDerWaalsContact C-N 3.33Å; I69-Y71 PolarHBondContact O-N 3Å; Y71-G74 PolarHBondContact O-N 3.15Å; Y71-R75 HydrophobicContact CE1-CG 4.3Å; Y71-R75 PolarHBondContact O-N 3.25Å; Y71-R75 VanDerWaalsContact O-N 3.09Å
72I90.7Very high88.1Confident91 Ų9165 Ų6547%0.46735%0.349SS..Hα-helixtrans-63.6-46.7176.6-66.9166.8000110.1Q68 I69 G74 R75 V76Q68-I72 HydrophobicContact CG-CD1 4.06Å; Q68-I72 VanDerWaalsContact O-CG1 3.31Å; Q68-I72 WeakPolarHBondContact O-CG1 3.29Å; Q68-I72 PolarHBondContact O-N 3.34Å; I69-I72 PolarHBondContact O-N 2.93Å; I72-G74 PolarHBondContact O-N 2.99Å; I72-R75 PolarHBondContact O-N 3.1Å; I72-R75 VanDerWaalsContact O-N 3.13Å; I72-V76 WeakPolarHBondContact O-CG2 3.37Å; I72-V76 PolarHBondContact O-N 3.09Å
73A92.7Very high88.4Confident10 Ų1065.3 Ų65.38%0.08335%0.349CS..Hα-helixtrans-58.4-45.1177.700000111.9I69 C70 R75 V76 T77 V266 F269I69-A73 VanDerWaalsContact O-CB 3.26Å; I69-A73 WeakPolarHBondContact O-CB 3.46Å; I69-A73 PolarHBondContact O-N 2.91Å; C70-A73 PolarHBondContact O-N 3.14Å; A73-R75 VanDerWaalsContact C-N 3.29Å; A73-R75 PolarHBondContact O-N 3.31Å; A73-V76 PolarHBondContact O-N 3.4Å; A73-V76 VanDerWaalsContact O-N 3.16Å; A73-T77 WeakPolarHBondContact O-CG2 3.49Å; A73-T77 PolarHBondContact O-N 3.06Å; A73-T77 PolarHBondContact O-OG1 3.41Å; A73-V266 HydrophobicContact CB-CG1 3.6Å; A73-V266 WeakPolarHBondContact O-CG1 3.4Å; A73-F269 HydrophobicContact CB-CB 4.01Å
74G89.2Confident88.8Confident15 Ų1570.5 Ų70.516%0.15537%0.372CS..Hα-helixtrans-64.5-29.3176.400000113.7C70 Y71 I72 T77 N78C70-G74 PolarHBondContact O-N 2.93Å; Y71-G74 PolarHBondContact O-N 3.15Å; I72-G74 PolarHBondContact O-N 2.99Å; G74-T77 PolarHBondContact O-OG1 2.93Å; G74-N78 PolarHBondContact O-ND2 2.89Å
75R89.5Confident89Confident162 Ų16270.2 Ų70.261%0.61137%0.373SS*.Hα-helixtrans-72.3-39171.5-74.5-165.865.5154.5-0.3112.5Y71 I72 A73Y71-R75 HydrophobicContact CE1-CG 4.3Å; Y71-R75 PolarHBondContact O-N 3.25Å; Y71-R75 VanDerWaalsContact O-N 3.09Å; I72-R75 PolarHBondContact O-N 3.1Å; I72-R75 VanDerWaalsContact O-N 3.13Å; A73-R75 VanDerWaalsContact C-N 3.29Å; A73-R75 PolarHBondContact O-N 3.31Å
76V89.7Confident89.4Confident71 Ų7165.2 Ų65.243%0.4335%0.346SS..Hα-helixtrans-66.6-42.5178.8172.40000110.9I72 A73 N78 A79 V266I72-V76 WeakPolarHBondContact O-CG2 3.37Å; I72-V76 PolarHBondContact O-N 3.09Å; A73-V76 PolarHBondContact O-N 3.4Å; A73-V76 VanDerWaalsContact O-N 3.16Å; V76-N78 VanDerWaalsContact C-N 3.31Å; V76-N78 PolarHBondContact O-N 2.94Å; V76-A79 WeakPolarHBondContact O-CB 3.48Å; V76-A79 PolarHBondContact O-N 2.93Å; V76-V266 HydrophobicContact CB-CG1 4.33Å; V76-V266 HydrophobicContact CG1-CG1 4.39Å
77T88.2Confident89.6Confident4 Ų465.5 Ų65.53%0.02535%0.354CS..Hα-helixtrans-61.1-39.218052.80000112.4A73 G74 A79 V80 Y263 V266 T267A73-T77 WeakPolarHBondContact O-CG2 3.49Å; A73-T77 PolarHBondContact O-N 3.06Å; A73-T77 PolarHBondContact O-OG1 3.41Å; G74-T77 PolarHBondContact O-OG1 2.93Å; T77-A79 PolarHBondContact O-N 2.69Å; T77-V80 PolarHBondContact O-N 3.02Å; T77-Y263 HydrophobicContact CG2-CE2 4.42Å; T77-Y263 WeakPolarHBondContact O-CE2 3.36Å; T77-V266 HydrophobicContact CG2-CB 4.05Å; T77-V266 HydrophobicContact CG2-CG1 3.72Å; T77-T267 HydrophobicContact CG2-CG2 3.56Å
78N83.6Confident89.9Confident140 Ų14068.7 Ų68.775%0.74937%0.365SS*.THydrogen-bonded Turntrans-69.2-16.4177.4-71.1-33.5000114G74 V76G74-N78 PolarHBondContact O-ND2 2.89Å; V76-N78 VanDerWaalsContact C-N 3.31Å; V76-N78 PolarHBondContact O-N 2.94Å
79A85.1Confident90.2Very high78 Ų7863.8 Ų63.865%0.64534%0.342SS*.THydrogen-bonded Turntrans-89.2-18.9-178.600000113.6V76 T77 P81V76-A79 WeakPolarHBondContact O-CB 3.48Å; V76-A79 PolarHBondContact O-N 2.93Å; T77-A79 PolarHBondContact O-N 2.69Å; A79-P81 WeakPolarHBondContact O-CD 3.41Å
80V83.5Confident90.5Very high60 Ų6060.6 Ų60.636%0.36433%0.326SS..  trans-86.9116-173.2-177.30000110.9T77 L82 Y263T77-V80 PolarHBondContact O-N 3.02Å; V80-L82 HydrophobicContact CG1-CD2 4.04Å; V80-L82 HydrophobicContact CG1-CG 3.96Å; V80-L82 PolarHBondContact O-N 3.3Å; V80-Y263 HydrophobicContact CB-CD2 4.31Å
81P87.7Confident90.7Very high87 Ų8765.9 Ų65.957%0.56535%0.354SS*.  trans-82.361.7-179.935.6-36.6000111.7A79 S83 F84A79-P81 WeakPolarHBondContact O-CD 3.41Å; P81-S83 PolarHBondContact O-N 3.15Å; P81-S83 VanDerWaalsContact O-N 3.14Å; P81-F84 HydrophobicContact CB-CB 4.49Å; P81-F84 PolarHBondContact O-N 2.81Å; P81-F84 VanDerWaalsContact O-N 3.11Å
82L90Very high91Very high2 Ų262 Ų621%0.0134%0.343CS..Hα-helixtrans-52.8-38.3-178.3-82.9-174.9000113.1V80 F84 V85 L86 A259 V260 Y263 Y339V80-L82 HydrophobicContact CG1-CD2 4.04Å; V80-L82 HydrophobicContact CG1-CG 3.96Å; V80-L82 PolarHBondContact O-N 3.3Å; L82-F84 VanDerWaalsContact C-N 3.26Å; L82-F84 PolarHBondContact O-N 3.34Å; L82-V85 PolarHBondContact O-N 3.13Å; L82-L86 WeakPolarHBondContact O-CB 3.42Å; L82-L86 PolarHBondContact O-N 2.99Å; L82-A259 HydrophobicContact CD2-CB 4.19Å; L82-V260 HydrophobicContact CD2-CG2 4.12Å; L82-Y263 HydrophobicContact CD1-CD1 3.29Å; L82-Y263 HydrophobicContact CD1-CD2 3.59Å; L82-Y263 HydrophobicContact CD1-CE1 3.75Å; L82-Y263 HydrophobicContact CD1-CE2 4.01Å; L82-Y263 HydrophobicContact CD1-CG 3.2Å; L82-Y263 HydrophobicContact CG-CD2 4.07Å; L82-Y263 HydrophobicContact CG-CG 4.03Å; L82-Y339 HydrophobicContact CB-CD1 4.11Å; L82-Y339 HydrophobicContact CB-CE1 3.93Å; L82-Y339 HydrophobicContact CD1-CD1 4.39Å; L82-Y339 HydrophobicContact CD1-CD2 4.22Å; L82-Y339 HydrophobicContact CD1-CG 4.14Å
83S92.7Very high91.2Very high56 Ų5657.8 Ų57.839%0.39232%0.321SS..Hα-helixtrans-58.5-38.5-178-50.10000112.6P81 A87 Y339 W342P81-S83 PolarHBondContact O-N 3.15Å; P81-S83 VanDerWaalsContact O-N 3.14Å; S83-A87 VanDerWaalsContact O-CB 3.28Å; S83-A87 WeakPolarHBondContact O-CB 3.4Å; S83-A87 PolarHBondContact O-N 3.48Å; S83-Y339 WeakPolarHBondContact OG-CE1 3.5Å; S83-Y339 PolarHBondContact OG-OH 2.91Å; S83-Y339 VanDerWaalsContact OG-OH 3.06Å; S83-W342 WeakPolarHBondContact O-CH2 3.21Å; S83-W342 WeakPolarHBondContact O-CZ3 3.49Å
84F91.7Very high91.4Very high130 Ų13059.9 Ų59.957%0.5733%0.333SS*.Hα-helixtrans-68.3-51.3180-177.3-90.2000110.2P81 L82 L86 A87 F88P81-F84 HydrophobicContact CB-CB 4.49Å; P81-F84 PolarHBondContact O-N 2.81Å; P81-F84 VanDerWaalsContact O-N 3.11Å; L82-F84 VanDerWaalsContact C-N 3.26Å; L82-F84 PolarHBondContact O-N 3.34Å; F84-L86 PolarHBondContact O-N 3.19Å; F84-A87 PolarHBondContact O-N 3.41Å; F84-F88 AromaticContact CD1-CD2 3.82Å; F84-F88 HydrophobicContact CD1-CD2 3.82Å; F84-F88 AromaticContact CD1-CE2 3.71Å; F84-F88 HydrophobicContact CD1-CE2 3.71Å; F84-F88 HydrophobicContact CD2-CD2 4.39Å; F84-F88 AromaticContact CD2-CE2 3.57Å; F84-F88 HydrophobicContact CD2-CE2 3.57Å; F84-F88 HydrophobicContact CD2-CZ 4.45Å; F84-F88 AromaticContact CE1-CD2 3.65Å; F84-F88 HydrophobicContact CE1-CD2 3.65Å; F84-F88 AromaticContact CE1-CE2 3.35Å; F84-F88 HydrophobicContact CE1-CE2 3.35Å; F84-F88 HydrophobicContact CE1-CZ 4.28Å; F84-F88 HydrophobicContact CE2-CD2 4.27Å; F84-F88 AromaticContact CE2-CE2 3.22Å; F84-F88 HydrophobicContact CE2-CE2 3.22Å; F84-F88 AromaticContact CE2-CZ 3.78Å; F84-F88 HydrophobicContact CE2-CZ 3.78Å; F84-F88 HydrophobicContact CG-CD2 4.19Å; F84-F88 AromaticContact CG-CE2 3.81Å; F84-F88 HydrophobicContact CG-CE2 3.81Å; F84-F88 AromaticContact CZ-CD2 3.9Å; F84-F88 HydrophobicContact CZ-CD2 3.9Å; F84-F88 AromaticContact CZ-CE2 3.1Å; F84-F88 HydrophobicContact CZ-CE2 3.1Å; F84-F88 AromaticContact CZ-CZ 3.67Å; F84-F88 HydrophobicContact CZ-CZ 3.67Å; F84-F88 WeakPolarHBondContact O-CD2 3.4Å; F84-F88 PolarHBondContact O-N 2.95Å
85V90.5Very high91.7Very high47 Ų4761.8 Ų61.829%0.28534%0.344SS..Hα-helixtrans-59.4-46.2-178.6178.30000111.3L82 Y89 V256L82-V85 PolarHBondContact O-N 3.13Å; V85-Y89 WeakPolarHBondContact O-CB 3.4Å; V85-Y89 PolarHBondContact O-N 3.28Å; V85-V256 HydrophobicContact CG1-CG1 4.43Å; V85-V256 HydrophobicContact CG1-CG2 3.95Å
86L94.4Very high92Very high0 Ų056 Ų560%032%0.322CS..Hα-helixtrans-64.6-39.4177.7-81.4163.1000112.4L82 F84 F88 Y89 V90 V256 V260 Y339 W342 L343L82-L86 WeakPolarHBondContact O-CB 3.42Å; L82-L86 PolarHBondContact O-N 2.99Å; F84-L86 PolarHBondContact O-N 3.19Å; L86-F88 PolarHBondContact O-N 3.41Å; L86-Y89 PolarHBondContact O-N 2.84Å; L86-V90 VanDerWaalsContact O-CB 3.31Å; L86-V90 WeakPolarHBondContact O-CB 3.41Å; L86-V90 WeakPolarHBondContact O-CG2 3.42Å; L86-V90 PolarHBondContact O-N 3.34Å; L86-V256 HydrophobicContact CD2-CG1 3.95Å; L86-V260 HydrophobicContact CD1-CG2 3.93Å; L86-V260 HydrophobicContact CD2-CG2 4.03Å; L86-V260 HydrophobicContact CG-CG2 4.12Å; L86-Y339 HydrophobicContact CD1-CD1 3.66Å; L86-Y339 HydrophobicContact CD1-CG 4.34Å; L86-W342 HydrophobicContact CB-CD2 3.97Å; L86-W342 HydrophobicContact CB-CE3 3.54Å; L86-W342 HydrophobicContact CB-CH2 4.39Å; L86-W342 HydrophobicContact CB-CZ3 3.79Å; L86-W342 HydrophobicContact CD1-CE3 4.01Å; L86-W342 HydrophobicContact CG-CE3 4.36Å; L86-L343 HydrophobicContact CD2-CB 3.96Å; L86-L343 HydrophobicContact CD2-CD1 4.23Å
87A95.2Very high92.3Very high37 Ų3754 Ų5431%0.30631%0.307SS..Hα-helixtrans-59.1-49.1179.200000112.6S83 F84 N91 W342S83-A87 VanDerWaalsContact O-CB 3.28Å; S83-A87 WeakPolarHBondContact O-CB 3.4Å; S83-A87 PolarHBondContact O-N 3.48Å; F84-A87 PolarHBondContact O-N 3.41Å; A87-N91 WeakPolarHBondContact O-CB 3.42Å; A87-N91 PolarHBondContact O-N 3.39Å; A87-W342 HydrophobicContact CB-CH2 3.68Å; A87-W342 HydrophobicContact CB-CZ2 3.92Å
88F93.9Very high92.6Very high109 Ų10957.7 Ų57.748%0.47833%0.326SS..Hα-helixtrans-64.8-42.5179.3-74.3-76000112.1F84 L86 L92F84-F88 AromaticContact CD1-CD2 3.82Å; F84-F88 HydrophobicContact CD1-CD2 3.82Å; F84-F88 AromaticContact CD1-CE2 3.71Å; F84-F88 HydrophobicContact CD1-CE2 3.71Å; F84-F88 HydrophobicContact CD2-CD2 4.39Å; F84-F88 AromaticContact CD2-CE2 3.57Å; F84-F88 HydrophobicContact CD2-CE2 3.57Å; F84-F88 HydrophobicContact CD2-CZ 4.45Å; F84-F88 AromaticContact CE1-CD2 3.65Å; F84-F88 HydrophobicContact CE1-CD2 3.65Å; F84-F88 AromaticContact CE1-CE2 3.35Å; F84-F88 HydrophobicContact CE1-CE2 3.35Å; F84-F88 HydrophobicContact CE1-CZ 4.28Å; F84-F88 HydrophobicContact CE2-CD2 4.27Å; F84-F88 AromaticContact CE2-CE2 3.22Å; F84-F88 HydrophobicContact CE2-CE2 3.22Å; F84-F88 AromaticContact CE2-CZ 3.78Å; F84-F88 HydrophobicContact CE2-CZ 3.78Å; F84-F88 HydrophobicContact CG-CD2 4.19Å; F84-F88 AromaticContact CG-CE2 3.81Å; F84-F88 HydrophobicContact CG-CE2 3.81Å; F84-F88 AromaticContact CZ-CD2 3.9Å; F84-F88 HydrophobicContact CZ-CD2 3.9Å; F84-F88 AromaticContact CZ-CE2 3.1Å; F84-F88 HydrophobicContact CZ-CE2 3.1Å; F84-F88 AromaticContact CZ-CZ 3.67Å; F84-F88 HydrophobicContact CZ-CZ 3.67Å; F84-F88 WeakPolarHBondContact O-CD2 3.4Å; F84-F88 PolarHBondContact O-N 2.95Å; L86-F88 PolarHBondContact O-N 3.41Å; F88-L92 PolarHBondContact O-N 2.62Å
89Y95.5Very high93.2Very high12 Ų1255 Ų555%0.04731%0.309CS..Hα-helixtrans-64.9-51-179.9177-112.6000111.8V85 L86 N91 L92 V93 V248 Y252 N253 V256 L343 A346V85-Y89 WeakPolarHBondContact O-CB 3.4Å; V85-Y89 PolarHBondContact O-N 3.28Å; L86-Y89 PolarHBondContact O-N 2.84Å; Y89-N91 VanDerWaalsContact C-N 3.3Å; Y89-N91 PolarHBondContact O-N 3.21Å; Y89-L92 WeakPolarHBondContact O-CB 3.38Å; Y89-L92 PolarHBondContact O-N 3.04Å; Y89-V93 HydrophobicContact CD2-CG2 4.42Å; Y89-V93 HydrophobicContact CE1-CG2 4.3Å; Y89-V93 HydrophobicContact CE2-CG2 3.96Å; Y89-V93 WeakPolarHBondContact O-CG2 3.3Å; Y89-V93 PolarHBondContact O-N 2.94Å; Y89-V248 HydrophobicContact CE2-CG1 4.25Å; Y89-Y252 HydrophobicContact CD2-CD1 4.27Å; Y89-Y252 HydrophobicContact CD2-CD2 4.48Å; Y89-Y252 HydrophobicContact CD2-CE1 4.18Å; Y89-Y252 HydrophobicContact CD2-CE2 4.39Å; Y89-Y252 HydrophobicContact CD2-CG 4.42Å; Y89-N253 VanDerWaalsContact CE2-OD1 3.27Å; Y89-N253 WeakPolarHBondContact CE2-OD1 3.45Å; Y89-N253 PolarHBondContact OH-OD1 3.34Å; Y89-V256 HydrophobicContact CD1-CB 4.26Å; Y89-V256 HydrophobicContact CD1-CG1 3.73Å; Y89-V256 HydrophobicContact CD1-CG2 4.3Å; Y89-V256 HydrophobicContact CD2-CG2 3.93Å; Y89-V256 HydrophobicContact CE1-CG1 4.31Å; Y89-V256 HydrophobicContact CG-CB 4.21Å; Y89-V256 HydrophobicContact CG-CG1 3.99Å; Y89-V256 HydrophobicContact CG-CG2 3.74Å; Y89-L343 HydrophobicContact CE1-CD1 4.23Å; Y89-A346 HydrophobicContact CD1-CB 3.71Å; Y89-A346 HydrophobicContact CE1-CB 3.31Å
90V95.9Very high93.6Very high11 Ų1151.6 Ų51.67%0.06728%0.28CS..Hα-helixtrans-62.3-40.9180175.30000110.4L86 L92 V93 V94 W342 A346L86-V90 VanDerWaalsContact O-CB 3.31Å; L86-V90 WeakPolarHBondContact O-CB 3.41Å; L86-V90 WeakPolarHBondContact O-CG2 3.42Å; L86-V90 PolarHBondContact O-N 3.34Å; V90-L92 VanDerWaalsContact C-N 3.35Å; V90-L92 PolarHBondContact O-N 3.23Å; V90-V93 PolarHBondContact O-N 3.35Å; V90-V94 HydrophobicContact CG1-CG2 4Å; V90-V94 WeakPolarHBondContact O-CB 3.36Å; V90-V94 VanDerWaalsContact O-CG2 3.26Å; V90-V94 WeakPolarHBondContact O-CG2 3.24Å; V90-V94 PolarHBondContact O-N 3.05Å; V90-W342 HydrophobicContact CG2-CD2 4.48Å; V90-W342 HydrophobicContact CG2-CG 4.14Å; V90-W342 WeakPolarHBondContact CG2-O 3.42Å; V90-A346 HydrophobicContact CG2-CB 3.86Å
91N96.1Very high94.2Very high114 Ų11452.9 Ų52.961%0.6128%0.281SS*.Hα-helixtrans-62-41176.5-17459.7000112.5A87 Y89 S95A87-N91 WeakPolarHBondContact O-CB 3.42Å; A87-N91 PolarHBondContact O-N 3.39Å; Y89-N91 VanDerWaalsContact C-N 3.3Å; Y89-N91 PolarHBondContact O-N 3.21Å; N91-S95 VanDerWaalsContact O-CB 3.27Å; N91-S95 WeakPolarHBondContact O-CB 3.34Å; N91-S95 PolarHBondContact O-N 2.77Å
92L95.3Very high94.5Very high66 Ų6654.4 Ų54.435%0.34628%0.283SS..Hα-helixtrans-59.4-47.5174.1175.668000111.1F88 Y89 V90 S95 R96 V248 Y252F88-L92 PolarHBondContact O-N 2.62Å; Y89-L92 WeakPolarHBondContact O-CB 3.38Å; Y89-L92 PolarHBondContact O-N 3.04Å; V90-L92 VanDerWaalsContact C-N 3.35Å; V90-L92 PolarHBondContact O-N 3.23Å; L92-S95 PolarHBondContact O-N 3.28Å; L92-R96 WeakPolarHBondContact O-CG 3.33Å; L92-R96 PolarHBondContact O-N 2.95Å; L92-V248 HydrophobicContact CD2-CG1 4.08Å; L92-Y252 HydrophobicContact CD2-CD1 3.85Å; L92-Y252 HydrophobicContact CD2-CE1 3.58Å
93V96Very high94.7Very high2 Ų255 Ų551%0.01229%0.288CS..Hα-helixtrans-66.5-46.8-178.3177.60000111.3Y89 V90 S95 R96 W97 V248 A346 L349 V350Y89-V93 HydrophobicContact CD2-CG2 4.42Å; Y89-V93 HydrophobicContact CE1-CG2 4.3Å; Y89-V93 HydrophobicContact CE2-CG2 3.96Å; Y89-V93 WeakPolarHBondContact O-CG2 3.3Å; Y89-V93 PolarHBondContact O-N 2.94Å; V90-V93 PolarHBondContact O-N 3.35Å; V93-S95 VanDerWaalsContact C-N 3.29Å; V93-S95 PolarHBondContact O-N 2.9Å; V93-R96 PolarHBondContact O-N 3.47Å; V93-W97 WeakPolarHBondContact O-CB 3.21Å; V93-W97 PolarHBondContact O-N 3.43Å; V93-V248 HydrophobicContact CG2-CG2 4.49Å; V93-A346 HydrophobicContact CB-CB 4.32Å; V93-A346 WeakPolarHBondContact CG1-O 3.29Å; V93-A346 HydrophobicContact CG2-CB 4.19Å; V93-L349 HydrophobicContact CG1-CB 3.73Å; V93-V350 HydrophobicContact CG1-CB 4.31Å; V93-V350 HydrophobicContact CG2-CG2 4.46Å
94V95.4Very high94.8Very high54 Ų5453.8 Ų53.833%0.32728%0.277SS..Hα-helixtrans-60.7-40178.1171.70000111.2V90 W97 L98 L349V90-V94 HydrophobicContact CG1-CG2 4Å; V90-V94 WeakPolarHBondContact O-CB 3.36Å; V90-V94 VanDerWaalsContact O-CG2 3.26Å; V90-V94 WeakPolarHBondContact O-CG2 3.24Å; V90-V94 PolarHBondContact O-N 3.05Å; V94-W97 PolarHBondContact O-N 3.27Å; V94-L98 WeakPolarHBondContact O-CB 3.33Å; V94-L98 PolarHBondContact O-N 3.48Å; V94-L349 HydrophobicContact CG2-CD1 3.77Å
95S96.3Very high94.8Very high55 Ų5547.7 Ų47.739%0.38525%0.25SC..Hα-helixtrans-63.1-46.6176.4-175.30000111.7N91 L92 V93 L98 Q99N91-S95 VanDerWaalsContact O-CB 3.27Å; N91-S95 WeakPolarHBondContact O-CB 3.34Å; N91-S95 PolarHBondContact O-N 2.77Å; L92-S95 PolarHBondContact O-N 3.28Å; V93-S95 VanDerWaalsContact C-N 3.29Å; V93-S95 PolarHBondContact O-N 2.9Å; S95-L98 PolarHBondContact O-N 3.34Å; S95-Q99 WeakPolarHBondContact O-CG 3.19Å; S95-Q99 PolarHBondContact O-N 2.99Å
96R95.6Very high94.9Very high42 Ų4248.1 Ų48.116%0.15825%0.253CS..Hα-helixtrans-62.6-42.3175.2-74.5176.458.594.4-0.4112.2L92 V93 L98 Q99 Q100 Y243 V246L92-R96 WeakPolarHBondContact O-CG 3.33Å; L92-R96 PolarHBondContact O-N 2.95Å; V93-R96 PolarHBondContact O-N 3.47Å; R96-L98 VanDerWaalsContact C-N 3.34Å; R96-L98 PolarHBondContact O-N 3.45Å; R96-Q99 PolarHBondContact O-N 2.89Å; R96-Q100 WeakPolarHBondContact O-CG 3.46Å; R96-Q100 PolarHBondContact O-N 3.1Å; R96-Q100 PolarHBondContact O-NE2 2.94Å; R96-Y243 HydrophobicContact CG-CE1 4.45Å; R96-Y243 PolarHBondContact NH2-O 3.49Å; R96-V246 PolarHBondContact NH1-O 3.01Å; R96-V246 PolarHBondContact NH2-O 2.94Å
97W95.2Very high95Very high28 Ų2848.1 Ų48.111%0.10625%0.253CS..Hα-helixtrans-58.1-46.5175.9171.190.8000111.2M1 V93 V94 Q99 Q100 F101 L349 F360M1-W97 HydrophobicContact CE-CH2 3.39Å; M1-W97 HydrophobicContact CE-CZ2 3.68Å; M1-W97 HydrophobicContact CE-CZ3 4.28Å; M1-W97 HydrophobicContact CG-CZ2 4.34Å; V93-W97 WeakPolarHBondContact O-CB 3.21Å; V93-W97 PolarHBondContact O-N 3.43Å; V94-W97 PolarHBondContact O-N 3.27Å; W97-Q99 PolarHBondContact O-N 2.87Å; W97-Q100 PolarHBondContact O-N 3.11Å; W97-F101 PolarHBondContact O-N 3.25Å; W97-L349 HydrophobicContact CB-CB 4.3Å; W97-L349 HydrophobicContact CD2-CD2 4.25Å; W97-L349 HydrophobicContact CG-CB 4.31Å; W97-L349 HydrophobicContact CG-CD2 4Å; W97-F360 AromaticContact CD1-CZ 3.97Å; W97-F360 AromaticContact CE2-CE1 3.71Å; W97-F360 AromaticContact CE2-CZ 3.95Å; W97-F360 AromaticContact CZ2-CE1 3.84Å; W97-F360 HydrophobicContact CZ2-CE1 3.84Å; W97-F360 HydrophobicContact CZ2-CZ 4.44Å; W97-F360 AromaticContact NE1-CE1 3.44Å; W97-F360 AromaticContact NE1-CZ 3.57Å
98L95Very high95Very high82 Ų8248 Ų4843%0.42925%0.247SC..Hα-helixtrans-65.3-40.7179.3-177.163.3000111.7V94 S95 R96 F101 L102V94-L98 WeakPolarHBondContact O-CB 3.33Å; V94-L98 PolarHBondContact O-N 3.48Å; S95-L98 PolarHBondContact O-N 3.34Å; R96-L98 VanDerWaalsContact C-N 3.34Å; R96-L98 PolarHBondContact O-N 3.45Å; L98-F101 WeakPolarHBondContact O-CB 3.41Å; L98-F101 PolarHBondContact O-N 2.93Å; L98-L102 HydrophobicContact CG-CD1 4.18Å; L98-L102 VanDerWaalsContact O-CG 3.29Å; L98-L102 WeakPolarHBondContact O-CG 3.18Å; L98-L102 PolarHBondContact O-N 3.22Å
99Q95.7Very high95.1Very high83 Ų8344.8 Ų44.839%0.38824%0.241SC..Hα-helixtrans-63-41.8176.5-72.4175.1-21.600112.1S95 R96 W97 L102 C103 Y243S95-Q99 WeakPolarHBondContact O-CG 3.19Å; S95-Q99 PolarHBondContact O-N 2.99Å; R96-Q99 PolarHBondContact O-N 2.89Å; W97-Q99 PolarHBondContact O-N 2.87Å; Q99-L102 PolarHBondContact O-N 3.07Å; Q99-C103 PolarHBondContact O-N 3.1Å; Q99-C103 VanDerWaalsContact O-N 3.14Å; Q99-C103 PolarHBondContact O-SG 2.85Å; Q99-Y243 HydrophobicContact CB-CE2 4.36Å; Q99-Y243 VanDerWaalsContact CB-OH 3.31Å; Q99-Y243 WeakPolarHBondContact CB-OH 3.3Å; Q99-Y243 PolarHBondContact OE1-OH 3.37Å
100Q95.2Very high95.1Very high7 Ų744.3 Ų44.33%0.03324%0.239CC..Hα-helixtrans-62-44.2173.7-72.5175.590.200111.3R96 W97 L102 C103 L104 L240 Y243 F360R96-Q100 WeakPolarHBondContact O-CG 3.46Å; R96-Q100 PolarHBondContact O-N 3.1Å; R96-Q100 PolarHBondContact O-NE2 2.94Å; W97-Q100 PolarHBondContact O-N 3.11Å; Q100-L102 VanDerWaalsContact C-N 3.33Å; Q100-L102 PolarHBondContact O-N 2.86Å; Q100-C103 PolarHBondContact O-N 2.99Å; Q100-L104 PolarHBondContact O-N 2.88Å; Q100-L240 HydrophobicContact CB-CD2 4.2Å; Q100-L240 WeakPolarHBondContact O-CD2 3.16Å; Q100-Y243 HydrophobicContact CG-CD1 4.09Å; Q100-Y243 HydrophobicContact CG-CD2 3.57Å; Q100-Y243 HydrophobicContact CG-CE2 4.2Å; Q100-Y243 HydrophobicContact CG-CG 3.52Å; Q100-F360 HydrophobicContact CB-CE2 4.11Å
101F94.2Very high95.1Very high87 Ų8743.8 Ų43.838%0.38224%0.236SC..Hα-helixtrans-57.3-45.8176.2179.6-105000112.2W97 L98 C103 L104 F360W97-F101 PolarHBondContact O-N 3.25Å; L98-F101 WeakPolarHBondContact O-CB 3.41Å; L98-F101 PolarHBondContact O-N 2.93Å; F101-C103 PolarHBondContact O-N 3.13Å; F101-L104 HydrophobicContact CD2-CD1 3.83Å; F101-L104 HydrophobicContact CE2-CD1 4.23Å; F101-L104 WeakPolarHBondContact O-CB 3.49Å; F101-L104 WeakPolarHBondContact O-CG 3.42Å; F101-L104 PolarHBondContact O-N 3.5Å; F101-L104 VanDerWaalsContact O-N 3.15Å; F101-F360 HydrophobicContact CB-CE1 3.93Å; F101-F360 HydrophobicContact CB-CE2 4.36Å; F101-F360 HydrophobicContact CB-CZ 3.56Å; F101-F360 HydrophobicContact CD2-CD1 4.1Å; F101-F360 AromaticContact CD2-CE1 3.65Å; F101-F360 HydrophobicContact CD2-CE1 3.65Å; F101-F360 HydrophobicContact CD2-CZ 4.09Å; F101-F360 HydrophobicContact CG-CE1 4.22Å; F101-F360 HydrophobicContact CG-CZ 4.32Å
102L94.3Very high95Very high118 Ų11842.8 Ų42.862%0.61823%0.23SC*.Hα-helixtrans-68.3-18178.9-67.2170.9000113.3L98 Q99 Q100L98-L102 HydrophobicContact CG-CD1 4.18Å; L98-L102 VanDerWaalsContact O-CG 3.29Å; L98-L102 WeakPolarHBondContact O-CG 3.18Å; L98-L102 PolarHBondContact O-N 3.22Å; Q99-L102 PolarHBondContact O-N 3.07Å; Q100-L102 VanDerWaalsContact C-N 3.33Å; Q100-L102 PolarHBondContact O-N 2.86Å
103C94.6Very high95Very high16 Ų1641.5 Ų41.511%0.10822%0.223CC..THydrogen-bonded Turntrans-89.9-3.3175-65.70000113.3Q99 Q100 F101 P105 K236 K239 L240Q99-C103 PolarHBondContact O-N 3.1Å; Q99-C103 VanDerWaalsContact O-N 3.14Å; Q99-C103 PolarHBondContact O-SG 2.85Å; Q100-C103 PolarHBondContact O-N 2.99Å; F101-C103 PolarHBondContact O-N 3.13Å; C103-P105 WeakPolarHBondContact O-CD 3.23Å; C103-P105 VanDerWaalsContact O-N 3.13Å; C103-K236 WeakPolarHBondContact O-CB 3.21Å; C103-K239 HydrophobicContact CB-CB 4.47Å; C103-L240 HydrophobicContact CB-CD2 3.7Å; C103-L240 HydrophobicContact CB-CG 4.02Å
104L94.8Very high94.9Very high30 Ų3041.4 Ų41.416%0.15722%0.223CC..  trans-63.5113.4175.4-71.2173.2000109.8Q100 F101 F156 L240 F353 F360 L365Q100-L104 PolarHBondContact O-N 2.88Å; F101-L104 HydrophobicContact CD2-CD1 3.83Å; F101-L104 HydrophobicContact CE2-CD1 4.23Å; F101-L104 WeakPolarHBondContact O-CB 3.49Å; F101-L104 WeakPolarHBondContact O-CG 3.42Å; F101-L104 PolarHBondContact O-N 3.5Å; F101-L104 VanDerWaalsContact O-N 3.15Å; L104-F156 HydrophobicContact CD2-CE1 4.31Å; L104-F156 HydrophobicContact CD2-CZ 4.39Å; L104-L240 HydrophobicContact CD2-CD1 4.13Å; L104-F353 HydrophobicContact CD2-CE1 3.99Å; L104-F353 HydrophobicContact CD2-CZ 4.06Å; L104-F360 HydrophobicContact CD1-CB 4.41Å; L104-F360 HydrophobicContact CD1-CD1 4.46Å; L104-F360 HydrophobicContact CD1-CD2 4.05Å; L104-F360 HydrophobicContact CD1-CE2 4.45Å; L104-F360 HydrophobicContact CD1-CG 4.06Å; L104-F360 HydrophobicContact CD2-CD2 4.4Å; L104-L365 HydrophobicContact CB-CD2 4.15Å; L104-L365 HydrophobicContact CD1-CD2 4.45Å; L104-L365 HydrophobicContact CD2-CD2 4.25Å
105P91.1Very high94.7Very high1 Ų140.4 Ų40.41%0.00622%0.218CC..  trans-86.1147.8-169.834.3-33.1000111.9C103 F233 K236 L237 N369C103-P105 WeakPolarHBondContact O-CD 3.23Å; C103-P105 VanDerWaalsContact O-N 3.13Å; P105-F233 HydrophobicContact CB-CD2 3.72Å; P105-F233 HydrophobicContact CB-CE2 3.55Å; P105-F233 HydrophobicContact CB-CG 4.29Å; P105-F233 HydrophobicContact CB-CZ 3.99Å; P105-F233 HydrophobicContact CG-CE2 4.11Å; P105-F233 HydrophobicContact CG-CZ 4.04Å; P105-K236 HydrophobicContact CB-CB 4Å; P105-K236 HydrophobicContact CB-CD 4.3Å; P105-L237 HydrophobicContact CG-CD2 3.43Å; P105-L237 VanDerWaalsContact CG-CD2 3.43Å; P105-L237 HydrophobicContact CG-CG 3.86Å; P105-N369 PolarHBondContact O-ND2 3.29Å; P105-N369 VanDerWaalsContact O-ND2 3.15Å
106T94.2Very high94.4Very high56 Ų5641.3 Ų41.334%0.34423%0.229SC..  trans-121.9139.4170.961.30000109.2D108T106-D108 PolarHBondContact O-N 3.15Å; T106-D108 PolarHBondContact OG1-OD2 3.18Å
107P95.6Very high94.3Very high0 Ų042.6 Ų42.60%023%0.234CC..SBendtrans-78-0.7-178.934.5-38.1000112.8A109 I110 C111 I148 F233 N369P107-A109 PolarHBondContact O-N 3.03Å; P107-I110 PolarHBondContact O-N 3.15Å; P107-I110 VanDerWaalsContact O-N 3.16Å; P107-C111 PolarHBondContact O-N 3.04Å; P107-C111 PolarHBondContact O-SG 2.98Å; P107-I148 HydrophobicContact CB-CG2 3.84Å; P107-F233 HydrophobicContact CB-CE2 4.39Å; P107-N369 HydrophobicContact CG-CB 3.86Å
108D95.5Very high94.2Very high34 Ų3441.3 Ų41.318%0.18223%0.229CC..Hα-helixtrans-52.6-49-169.3-57-18.7000112.8T106 C111 L112 R368 T372 F376T106-D108 PolarHBondContact O-N 3.15Å; T106-D108 PolarHBondContact OG1-OD2 3.18Å; D108-C111 PolarHBondContact O-N 3.18Å; D108-L112 VanDerWaalsContact O-CB 3.25Å; D108-L112 WeakPolarHBondContact O-CB 3.27Å; D108-L112 PolarHBondContact O-N 3.24Å; D108-R368 VanDerWaalsContact CG-NH2 3.29Å; D108-R368 IonicContact OD1-CZ 2.62Å; D108-R368 IonicContact OD1-NH1 3.71Å; D108-R368 IonicContact OD1-NH2 3.48Å; D108-R368 PolarHBondContact OD1-NH2 2.94Å; D108-R368 IonicContact OD2-CZ 2.95Å; D108-R368 IonicContact OD2-NH1 3.42Å; D108-R368 PolarHBondContact OD2-NH1 3.38Å; D108-R368 VanDerWaalsContact OD2-NH1 3.15Å; D108-R368 IonicContact OD2-NH2 2.94Å; D108-R368 PolarHBondContact OD2-NH2 2.94Å; D108-T372 WeakPolarHBondContact OD1-CG2 3.2Å; D108-F376 HydrophobicContact CB-CE2 4.24Å
109A95Very high93.8Very high42 Ų4238.9 Ų38.935%0.34722%0.224SC..Hα-helixtrans-64.4-43.8-178.800000112P107 L113 Q229P107-A109 PolarHBondContact O-N 3.03Å; A109-L113 WeakPolarHBondContact O-CG 3.29Å; A109-L113 PolarHBondContact O-N 2.97Å; A109-L113 VanDerWaalsContact O-N 3.1Å; A109-Q229 VanDerWaalsContact CB-OE1 3.26Å
110I96.5Very high93.3Very high2 Ų239.8 Ų39.81%0.0123%0.228CC..Hα-helixtrans-65-46.1178.6-55.7161.3000110.1P107 L112 L113 L114 I148 L226 Q229 V230 F233P107-I110 PolarHBondContact O-N 3.15Å; P107-I110 VanDerWaalsContact O-N 3.16Å; I110-L112 PolarHBondContact O-N 2.87Å; I110-L113 PolarHBondContact O-N 3.22Å; I110-L114 WeakPolarHBondContact O-CB 3.49Å; I110-L114 PolarHBondContact O-N 3.39Å; I110-I148 HydrophobicContact CB-CD1 3.96Å; I110-I148 HydrophobicContact CD1-CD1 3.88Å; I110-I148 HydrophobicContact CD1-CG1 4.28Å; I110-I148 HydrophobicContact CD1-CG2 4.02Å; I110-I148 HydrophobicContact CG2-CD1 3.4Å; I110-L226 HydrophobicContact CG2-CD2 4.49Å; I110-Q229 HydrophobicContact CG1-CB 3.7Å; I110-V230 HydrophobicContact CD1-CG2 4.11Å; I110-V230 HydrophobicContact CG1-CG2 4.39Å; I110-V230 HydrophobicContact CG2-CG2 3.99Å; I110-F233 HydrophobicContact CD1-CB 3.74Å; I110-F233 HydrophobicContact CD1-CD2 4.03Å; I110-F233 HydrophobicContact CD1-CG 3.98Å
111C96Very high92.7Very high0 Ų041 Ų410%024%0.235CC..Hα-helixtrans-67.7-36.4-177.4-63.50000112.4P107 D108 L114 S115 S373 F376 V377P107-C111 PolarHBondContact O-N 3.04Å; P107-C111 PolarHBondContact O-SG 2.98Å; D108-C111 PolarHBondContact O-N 3.18Å; C111-L114 PolarHBondContact O-N 2.98Å; C111-S115 PolarHBondContact O-N 3.4Å; C111-S373 VanDerWaalsContact SG-CB 3.51Å; C111-F376 HydrophobicContact CB-CB 3.88Å; C111-F376 HydrophobicContact CB-CD2 4.08Å; C111-F376 HydrophobicContact CB-CG 4.39Å; C111-V377 HydrophobicContact CB-CG1 3.94Å
112L93.8Very high91.9Very high94 Ų9439.7 Ų39.749%0.49224%0.235SC..Hα-helixtrans-62.5-49.4173.6-176.769.5000110.9D108 I110 L114 S115 A116 F376D108-L112 VanDerWaalsContact O-CB 3.25Å; D108-L112 WeakPolarHBondContact O-CB 3.27Å; D108-L112 PolarHBondContact O-N 3.24Å; I110-L112 PolarHBondContact O-N 2.87Å; L112-L114 VanDerWaalsContact C-N 3.29Å; L112-L114 PolarHBondContact O-N 3.3Å; L112-S115 PolarHBondContact O-N 2.98Å; L112-S115 PolarHBondContact O-OG 2.94Å; L112-A116 PolarHBondContact O-N 3.42Å; L112-F376 HydrophobicContact CD1-CD1 4.38Å; L112-F376 HydrophobicContact CD1-CE1 4.28Å
113L94.9Very high91.2Very high39 Ų3940.1 Ų40.120%0.20424%0.238CC..Hα-helixtrans-63.6-38.1176.3-66.8-178000111.8A109 I110 S115 A116 Y117 L226 Q229A109-L113 WeakPolarHBondContact O-CG 3.29Å; A109-L113 PolarHBondContact O-N 2.97Å; A109-L113 VanDerWaalsContact O-N 3.1Å; I110-L113 PolarHBondContact O-N 3.22Å; L113-S115 VanDerWaalsContact C-N 3.31Å; L113-S115 PolarHBondContact O-N 3.44Å; L113-A116 PolarHBondContact O-N 3.38Å; L113-A116 VanDerWaalsContact O-N 3.12Å; L113-Y117 HydrophobicContact CB-CD2 4.07Å; L113-Y117 HydrophobicContact CB-CE2 4Å; L113-Y117 HydrophobicContact CD1-CE2 4.39Å; L113-Y117 HydrophobicContact CD2-CE2 3.71Å; L113-Y117 HydrophobicContact CG-CE2 4.24Å; L113-Y117 WeakPolarHBondContact O-CB 3.27Å; L113-Y117 WeakPolarHBondContact O-CD2 3.48Å; L113-Y117 PolarHBondContact O-N 3.34Å; L113-L226 HydrophobicContact CB-CD2 3.67Å; L113-L226 HydrophobicContact CB-CG 4.45Å; L113-Q229 HydrophobicContact CD1-CG 3.69Å
114L94.6Very high90.3Very high0 Ų041.6 Ų41.60%025%0.248CC..Hα-helixtrans-63.5-38.3178.6-169.764000111.6I110 C111 L112 A116 L118 R141 I144 L226 V377I110-L114 WeakPolarHBondContact O-CB 3.49Å; I110-L114 PolarHBondContact O-N 3.39Å; C111-L114 PolarHBondContact O-N 2.98Å; L112-L114 VanDerWaalsContact C-N 3.29Å; L112-L114 PolarHBondContact O-N 3.3Å; L114-A116 VanDerWaalsContact C-N 3.31Å; L114-A116 PolarHBondContact O-N 3.34Å; L114-L118 HydrophobicContact CD1-CB 3.99Å; L114-L118 HydrophobicContact CD1-CD1 3.87Å; L114-L118 VanDerWaalsContact O-CB 3.32Å; L114-L118 WeakPolarHBondContact O-CB 3.46Å; L114-L118 PolarHBondContact O-N 2.6Å; L114-L118 VanDerWaalsContact O-N 3.13Å; L114-R141 HydrophobicContact CD2-CB 3.97Å; L114-R141 HydrophobicContact CD2-CG 4.44Å; L114-R141 WeakPolarHBondContact CD2-O 3.07Å; L114-R141 HydrophobicContact CG-CB 4.06Å; L114-R141 HydrophobicContact CG-CG 3.99Å; L114-I144 HydrophobicContact CD1-CD1 3.89Å; L114-I144 HydrophobicContact CD1-CG2 4.39Å; L114-I144 HydrophobicContact CD2-CB 3.85Å; L114-I144 HydrophobicContact CD2-CG2 3.7Å; L114-L226 HydrophobicContact CB-CD2 4.19Å; L114-L226 HydrophobicContact CD1-CD1 4.4Å; L114-L226 HydrophobicContact CD1-CD2 4.38Å; L114-V377 HydrophobicContact CD2-CG1 3.95Å
115S91.7Very high89.5Confident33 Ų3348.4 Ų48.423%0.23128%0.276CS..Hα-helixtrans-65.5-32.5173.3700000113.5C111 L112 L113 F376C111-S115 PolarHBondContact O-N 3.4Å; L112-S115 PolarHBondContact O-N 2.98Å; L112-S115 PolarHBondContact O-OG 2.94Å; L113-S115 VanDerWaalsContact C-N 3.31Å; L113-S115 PolarHBondContact O-N 3.44Å; S115-F376 VanDerWaalsContact CB-O 3.26Å; S115-F376 WeakPolarHBondContact CB-O 3.49Å
116A90Very high88.9Confident74 Ų7454 Ų5461%0.61231%0.306SS*.Hα-helixtrans-84-36-177.800000112.9L112 L113 L114L112-A116 PolarHBondContact O-N 3.42Å; L113-A116 PolarHBondContact O-N 3.38Å; L113-A116 VanDerWaalsContact O-N 3.12Å; L114-A116 VanDerWaalsContact C-N 3.31Å; L114-A116 PolarHBondContact O-N 3.34Å
117Y92.6Very high87.8Confident68 Ų6859.1 Ų59.127%0.26733%0.325SS..Hα-helixtrans-101.8-22.2-169.2-60.8-24.9000114.7L113 H222 A225 L226L113-Y117 HydrophobicContact CB-CD2 4.07Å; L113-Y117 HydrophobicContact CB-CE2 4Å; L113-Y117 HydrophobicContact CD1-CE2 4.39Å; L113-Y117 HydrophobicContact CD2-CE2 3.71Å; L113-Y117 HydrophobicContact CG-CE2 4.24Å; L113-Y117 WeakPolarHBondContact O-CB 3.27Å; L113-Y117 WeakPolarHBondContact O-CD2 3.48Å; L113-Y117 PolarHBondContact O-N 3.34Å; Y117-H222 HydrophobicContact CD1-CB 4.24Å; Y117-H222 AromaticContact CD1-CD2 3.73Å; Y117-H222 AromaticContact CD1-CG 3.73Å; Y117-H222 AromaticContact CD1-ND1 4Å; Y117-H222 HydrophobicContact CD2-CB 3.68Å; Y117-H222 AromaticContact CE1-CD2 3.58Å; Y117-H222 AromaticContact CE1-NE2 3.89Å; Y117-H222 HydrophobicContact CE2-CB 4.2Å; Y117-H222 HydrophobicContact CG-CB 3.69Å; Y117-H222 AromaticContact CG-CG 3.72Å; Y117-H222 AromaticContact CZ-CD2 3.78Å; Y117-A225 HydrophobicContact CE2-CB 4.04Å; Y117-L226 HydrophobicContact CD2-CD1 4.33Å; Y117-L226 HydrophobicContact CD2-CG 4.14Å
118L91.9Very high86.7Confident2 Ų267 Ų671%0.0136%0.36CS..  trans-104.9101.7-178.4-163.7145.3000110.2L114 A137 F140 R141 I144 A211 M216 I217L114-L118 HydrophobicContact CD1-CB 3.99Å; L114-L118 HydrophobicContact CD1-CD1 3.87Å; L114-L118 VanDerWaalsContact O-CB 3.32Å; L114-L118 WeakPolarHBondContact O-CB 3.46Å; L114-L118 PolarHBondContact O-N 2.6Å; L114-L118 VanDerWaalsContact O-N 3.13Å; L118-A137 HydrophobicContact CD2-CB 4.07Å; L118-A137 WeakPolarHBondContact CD2-O 3.46Å; L118-F140 HydrophobicContact CD1-CB 4.09Å; L118-F140 HydrophobicContact CD2-CB 3.83Å; L118-R141 HydrophobicContact CB-CG 4.13Å; L118-R141 HydrophobicContact CD2-CG 3.42Å; L118-R141 VanDerWaalsContact CD2-CG 3.42Å; L118-R141 HydrophobicContact CG-CG 4.25Å; L118-R141 PolarHBondContact O-NH1 3.28Å; L118-I144 HydrophobicContact CD1-CD1 4.22Å; L118-A211 HydrophobicContact CD1-CB 3.63Å; L118-M216 HydrophobicContact CD2-CE 4.03Å; L118-I217 HydrophobicContact CB-CG1 4.33Å; L118-I217 HydrophobicContact CD1-CD1 4.16Å; L118-I217 HydrophobicContact CD1-CG1 4.1Å; L118-I217 HydrophobicContact CG-CG1 4.22Å
119G87.5Confident85.5Confident30 Ų3068.5 Ų68.531%0.30937%0.366SS..  trans-121.6-166.2-179.100000112.8M216G119-M216 PolarHBondContact N-O 2.88Å; G119-M216 WeakPolarHBondContact O-CB 3.34Å
120E84.3Confident84.3Confident103 Ų10371.5 Ų71.548%0.48138%0.375SS..  trans-67147.7173-65.3-179.2179.600111.5P122 E134E120-P122 WeakPolarHBondContact O-CD 3.27Å; E120-E134 HydrophobicContact CG-CB 4.4Å; E120-E134 WeakPolarHBondContact OE1-CB 3.36Å; E120-E134 PolarHBondContact OE1-N 3.44Å
121N82.6Confident83.1Confident33 Ų3379 Ų7918%0.17641%0.41CS..  trans-65.4119.9171.4173.98.3000108.9N123 M216N121-N123 PolarHBondContact ND2-O 3.21Å; N121-N123 PolarHBondContact O-N 3.02Å; N121-N123 PolarHBondContact OD1-N 2.78Å; N121-N123 PolarHBondContact OD1-O 3.01Å; N121-M216 HydrophobicContact CB-CG 4.38Å
122P77.7Confident82.3Confident59 Ų5983.1 Ų83.138%0.38343%0.432SS..SBendtrans-68.9-18.4-177.628.1-35.4000113.9E120 P124 N215E120-P122 WeakPolarHBondContact O-CD 3.27Å; P122-P124 WeakPolarHBondContact O-CD 3.44Å; P122-N215 WeakPolarHBondContact CD-O 3.33Å
123N80Confident81.7Confident126 Ų12679.2 Ų79.267%0.67441%0.414SS*.SBendtrans-122.377.7179-68-36.1000109.4N121 K125N121-N123 PolarHBondContact ND2-O 3.21Å; N121-N123 PolarHBondContact O-N 3.02Å; N121-N123 PolarHBondContact OD1-N 2.78Å; N121-N123 PolarHBondContact OD1-O 3.01Å; N123-K125 PolarHBondContact O-N 3.08Å
124P76.1Confident81.2Confident48 Ų4881.3 Ų81.331%0.31242%0.423SS..  trans-64.5131.7175.225.3-30000109.3P122 E129 L130P122-P124 WeakPolarHBondContact O-CD 3.44Å; P124-E129 HydrophobicContact CB-CB 3.88Å; P124-L130 HydrophobicContact CB-CB 4.18Å; P124-L130 HydrophobicContact CG-CB 4.12Å; P124-L130 HydrophobicContact CG-CD1 3.78Å
125K76.9Confident80.8Confident173 Ų17387 Ų8775%0.75245%0.45SS*.SBendtrans-75.4-33.4-179.1-66.4177.7-177.6171.90111.6N123 E129N123-K125 PolarHBondContact O-N 3.08Å; K125-E129 PolarHBondContact N-OE2 2.82Å
126D79.1Confident80.7Confident118 Ų11890.9 Ų90.963%0.63146%0.46SS*.SBendtrans-134.1156.5-175.6-63.1-39.6000111.7K128 E129 L130D126-K128 PolarHBondContact O-N 3.05Å; D126-K128 VanDerWaalsContact O-N 3.14Å; D126-E129 WeakPolarHBondContact O-CB 3.45Å; D126-E129 PolarHBondContact O-N 3.07Å; D126-L130 PolarHBondContact O-N 3.44Å
127H71.3Confident80.8Confident163 Ų16387.4 Ų87.476%0.75543%0.43SS*.Hα-helixtrans-55.6-31.5176.4-89.9-71.7000113.8L130 E131H127-L130 WeakPolarHBondContact O-CB 3.35Å; H127-L130 PolarHBondContact O-N 3.47Å; H127-E131 PolarHBondContact O-N 2.9Å; H127-E131 VanDerWaalsContact O-N 3.15Å
128K72.4Confident80.8Confident166 Ų16685 Ų8572%0.72242%0.422SS*.Hα-helixtrans-69-32.8174.9-77.9-174.4175.1-179.20113.2D126 L130 N132D126-K128 PolarHBondContact O-N 3.05Å; D126-K128 VanDerWaalsContact O-N 3.14Å; K128-L130 VanDerWaalsContact C-N 3.29Å; K128-N132 WeakPolarHBondContact O-CB 3.32Å; K128-N132 PolarHBondContact O-N 2.81Å
129E70.7Confident80.8Confident66 Ų6688.6 Ų88.631%0.30844%0.444SS..Hα-helixtrans-70.4-31.1174.1-101.6-174.4171.800111.3P124 K125 D126 G133P124-E129 HydrophobicContact CB-CB 3.88Å; K125-E129 PolarHBondContact N-OE2 2.82Å; D126-E129 WeakPolarHBondContact O-CB 3.45Å; D126-E129 PolarHBondContact O-N 3.07Å; E129-G133 VanDerWaalsContact O-CA 3.23Å; E129-G133 WeakPolarHBondContact O-CA 3.42Å; E129-G133 PolarHBondContact O-N 3.09Å
130L70.1Confident81.2Confident104 Ų10488 Ų8855%0.54543%0.433SS..Hα-helixtrans-67.8-43.3174.4-175.471.6000111.5P124 D126 H127 K128P124-L130 HydrophobicContact CB-CB 4.18Å; P124-L130 HydrophobicContact CG-CB 4.12Å; P124-L130 HydrophobicContact CG-CD1 3.78Å; D126-L130 PolarHBondContact O-N 3.44Å; H127-L130 WeakPolarHBondContact O-CB 3.35Å; H127-L130 PolarHBondContact O-N 3.47Å; K128-L130 VanDerWaalsContact C-N 3.29Å
131E70.8Confident81.7Confident161 Ų16183.3 Ų83.375%0.75241%0.411SS*.Hα-helixtrans-73.4-36.1179-73.5-177.716400113.2H127H127-E131 PolarHBondContact O-N 2.9Å; H127-E131 VanDerWaalsContact O-N 3.15Å
132N80.2Confident82.3Confident85 Ų8586.4 Ų86.446%0.45542%0.42SS..SBendtrans-102.911.7-175.8-65.20.7000113.6K128 E135 R136K128-N132 WeakPolarHBondContact O-CB 3.32Å; K128-N132 PolarHBondContact O-N 2.81Å; N132-E135 PolarHBondContact O-N 3.06Å; N132-R136 WeakPolarHBondContact O-CB 3.39Å; N132-R136 PolarHBondContact O-N 2.74Å
133G80.7Confident83.2Confident12 Ų1285 Ų8512%0.12441%0.41CS..Hα-helixtrans-60.6-47.1-176.100000112.6E129 R136 A137E129-G133 VanDerWaalsContact O-CA 3.23Å; E129-G133 WeakPolarHBondContact O-CA 3.42Å; E129-G133 PolarHBondContact O-N 3.09Å; G133-R136 PolarHBondContact O-N 3.33Å; G133-A137 PolarHBondContact O-N 2.83Å
134E83.4Confident84Confident83 Ų8379 Ų7939%0.38838%0.378SS..Hα-helixtrans-63.7-45.5178.8-156.3-173.1153.400111.6E120 R136 A137 L138 S382E120-E134 HydrophobicContact CG-CB 4.4Å; E120-E134 WeakPolarHBondContact OE1-CB 3.36Å; E120-E134 PolarHBondContact OE1-N 3.44Å; E134-R136 VanDerWaalsContact C-N 3.3Å; E134-R136 PolarHBondContact O-N 2.99Å; E134-A137 PolarHBondContact O-N 3.32Å; E134-L138 WeakPolarHBondContact O-CB 3.31Å; E134-L138 PolarHBondContact O-N 3.24Å; E134-S382 PolarHBondContact OE1-OG 2.93Å
135E86.5Confident85Confident121 Ų12176.7 Ų76.757%0.56536%0.363SS*.Hα-helixtrans-60.6-42.9179.9-173-178.4-172.900110.5N132 L138 V139N132-E135 PolarHBondContact O-N 3.06Å; E135-L138 WeakPolarHBondContact O-CB 3.47Å; E135-L138 PolarHBondContact O-N 3.29Å; E135-V139 VanDerWaalsContact O-CG2 3.32Å; E135-V139 WeakPolarHBondContact O-CG2 3.5Å; E135-V139 PolarHBondContact O-N 3.43Å
136R90.6Very high85.9Confident114 Ų11470.3 Ų70.343%0.4333%0.334SS..Hα-helixtrans-62.8-45.2176.2-168.9173.2-177105.4-2.3111.4N132 G133 E134 L138 V139 F140 E214 M216N132-R136 WeakPolarHBondContact O-CB 3.39Å; N132-R136 PolarHBondContact O-N 2.74Å; G133-R136 PolarHBondContact O-N 3.33Å; E134-R136 VanDerWaalsContact C-N 3.3Å; E134-R136 PolarHBondContact O-N 2.99Å; R136-L138 VanDerWaalsContact C-N 3.32Å; R136-L138 PolarHBondContact O-N 2.96Å; R136-V139 PolarHBondContact O-N 3.47Å; R136-F140 HydrophobicContact CG-CD2 4.35Å; R136-F140 HydrophobicContact CG-CE2 4.34Å; R136-F140 WeakPolarHBondContact O-CD2 3.47Å; R136-F140 PolarHBondContact O-N 3.35Å; R136-F140 VanDerWaalsContact O-N 3.09Å; R136-E214 IonicContact CZ-OE2 3.28Å; R136-E214 VanDerWaalsContact CZ-OE2 3.28Å; R136-E214 IonicContact NE-OE2 2.88Å; R136-E214 PolarHBondContact NE-OE2 3.15Å; R136-E214 VanDerWaalsContact NH2-CD 3.31Å; R136-E214 IonicContact NH2-OE1 3.01Å; R136-E214 PolarHBondContact NH2-OE1 3.01Å; R136-E214 IonicContact NH2-OE2 2.87Å; R136-E214 PolarHBondContact NH2-OE2 3.34Å; R136-M216 HydrophobicContact CG-CE 4.43Å
137A91.5Very high86.8Confident0 Ų066 Ų660%031%0.309CS..Hα-helixtrans-58.9-44.7174.400000112.1L118 G133 E134 V139 F140 R141 M216L118-A137 HydrophobicContact CD2-CB 4.07Å; L118-A137 WeakPolarHBondContact CD2-O 3.46Å; G133-A137 PolarHBondContact O-N 2.83Å; E134-A137 PolarHBondContact O-N 3.32Å; A137-V139 PolarHBondContact O-N 3.23Å; A137-F140 WeakPolarHBondContact O-CB 3.3Å; A137-F140 PolarHBondContact O-N 3.11Å; A137-R141 WeakPolarHBondContact O-CG 3.5Å; A137-R141 PolarHBondContact O-N 3.06Å; A137-M216 HydrophobicContact CB-CE 3.61Å
138L92.1Very high88.1Confident19 Ų1958.2 Ų58.210%0.09927%0.273CS..Hα-helixtrans-61-43178-176.461.4000112.3E134 E135 R136 F140 R141 R142 D378E134-L138 WeakPolarHBondContact O-CB 3.31Å; E134-L138 PolarHBondContact O-N 3.24Å; E135-L138 WeakPolarHBondContact O-CB 3.47Å; E135-L138 PolarHBondContact O-N 3.29Å; R136-L138 VanDerWaalsContact C-N 3.32Å; R136-L138 PolarHBondContact O-N 2.96Å; L138-F140 PolarHBondContact O-N 3.26Å; L138-R141 PolarHBondContact O-N 3.29Å; L138-R142 HydrophobicContact CD1-CG 4.26Å; L138-R142 WeakPolarHBondContact O-CB 3.31Å; L138-R142 WeakPolarHBondContact O-CG 3.43Å; L138-R142 PolarHBondContact O-N 3Å; L138-D378 HydrophobicContact CD1-CB 3.79Å; L138-D378 WeakPolarHBondContact CD1-OD1 3.46Å
139V93.3Very high89.2Confident76 Ų7650.3 Ų50.346%0.46124%0.239SC..Hα-helixtrans-61.8-43.1176171.30000111.2E135 R136 A137 T143E135-V139 VanDerWaalsContact O-CG2 3.32Å; E135-V139 WeakPolarHBondContact O-CG2 3.5Å; E135-V139 PolarHBondContact O-N 3.43Å; R136-V139 PolarHBondContact O-N 3.47Å; A137-V139 PolarHBondContact O-N 3.23Å; V139-T143 VanDerWaalsContact O-CB 3.24Å; V139-T143 WeakPolarHBondContact O-CB 3.18Å; V139-T143 PolarHBondContact O-N 3.39Å; V139-T143 PolarHBondContact O-OG1 3.37Å
140F95Very high90.4Very high17 Ų1747.1 Ų47.18%0.07522%0.224CC..Hα-helixtrans-59.3-49.9174.2-94-91.9000111.3L118 R136 A137 L138 T143 I144 L207 K210 A211 M216L118-F140 HydrophobicContact CD1-CB 4.09Å; L118-F140 HydrophobicContact CD2-CB 3.83Å; R136-F140 HydrophobicContact CG-CD2 4.35Å; R136-F140 HydrophobicContact CG-CE2 4.34Å; R136-F140 WeakPolarHBondContact O-CD2 3.47Å; R136-F140 PolarHBondContact O-N 3.35Å; R136-F140 VanDerWaalsContact O-N 3.09Å; A137-F140 WeakPolarHBondContact O-CB 3.3Å; A137-F140 PolarHBondContact O-N 3.11Å; L138-F140 PolarHBondContact O-N 3.26Å; F140-T143 PolarHBondContact O-N 3.21Å; F140-I144 WeakPolarHBondContact O-CB 3.38Å; F140-I144 WeakPolarHBondContact O-CD1 3.22Å; F140-I144 VanDerWaalsContact O-CG1 3.29Å; F140-I144 WeakPolarHBondContact O-CG1 3.21Å; F140-I144 PolarHBondContact O-N 3.12Å; F140-L207 HydrophobicContact CD1-CB 4.41Å; F140-L207 HydrophobicContact CD1-CD2 4.48Å; F140-L207 HydrophobicContact CE1-CB 4.44Å; F140-L207 HydrophobicContact CE1-CD2 4.06Å; F140-L207 WeakPolarHBondContact CE1-O 3.37Å; F140-K210 HydrophobicContact CE1-CB 4.38Å; F140-K210 HydrophobicContact CE1-CG 4.42Å; F140-K210 HydrophobicContact CZ-CD 4.27Å; F140-K210 HydrophobicContact CZ-CG 4.24Å; F140-A211 HydrophobicContact CD1-CB 3.85Å; F140-A211 HydrophobicContact CE1-CB 3.88Å; F140-M216 HydrophobicContact CB-CE 4.47Å; F140-M216 HydrophobicContact CD2-CE 3.89Å; F140-M216 HydrophobicContact CD2-SD 4.01Å; F140-M216 HydrophobicContact CE2-CE 4.46Å; F140-M216 HydrophobicContact CE2-SD 3.99Å; F140-M216 HydrophobicContact CG-CE 4.36Å
141R95.2Very high91.6Very high5 Ų542.2 Ų42.22%0.01920%0.198CC..Hα-helixtrans-65.4-44.5-176.6-54.7-175.4-73.9-95.3-1.1112.5L114 L118 A137 L138 T143 S145 V377 I381L114-R141 HydrophobicContact CD2-CB 3.97Å; L114-R141 HydrophobicContact CD2-CG 4.44Å; L114-R141 WeakPolarHBondContact CD2-O 3.07Å; L114-R141 HydrophobicContact CG-CB 4.06Å; L114-R141 HydrophobicContact CG-CG 3.99Å; L118-R141 HydrophobicContact CB-CG 4.13Å; L118-R141 HydrophobicContact CD2-CG 3.42Å; L118-R141 VanDerWaalsContact CD2-CG 3.42Å; L118-R141 HydrophobicContact CG-CG 4.25Å; L118-R141 PolarHBondContact O-NH1 3.28Å; A137-R141 WeakPolarHBondContact O-CG 3.5Å; A137-R141 PolarHBondContact O-N 3.06Å; L138-R141 PolarHBondContact O-N 3.29Å; R141-T143 VanDerWaalsContact C-N 3.35Å; R141-T143 PolarHBondContact O-N 2.85Å; R141-S145 VanDerWaalsContact O-CB 3.27Å; R141-S145 WeakPolarHBondContact O-CB 3.16Å; R141-S145 PolarHBondContact O-N 2.84Å; R141-V377 HydrophobicContact CB-CB 3.69Å; R141-V377 HydrophobicContact CB-CG1 4.17Å; R141-V377 HydrophobicContact CB-CG2 4.47Å; R141-V377 PolarHBondContact NE-O 2.91Å; R141-I381 VanDerWaalsContact CZ-CD1 3.5Å
142R95.3Very high92.8Very high99 Ų9934.5 Ų34.537%0.37416%0.163SC..Hα-helixtrans-61.7-41.5176.3-75.9-179.5172.9149.5-9.3111.7L138 R146 L374 V377 D378L138-R142 HydrophobicContact CD1-CG 4.26Å; L138-R142 WeakPolarHBondContact O-CB 3.31Å; L138-R142 WeakPolarHBondContact O-CG 3.43Å; L138-R142 PolarHBondContact O-N 3Å; R142-R146 VanDerWaalsContact O-CB 3.29Å; R142-R146 WeakPolarHBondContact O-CB 3.31Å; R142-R146 PolarHBondContact O-N 2.95Å; R142-L374 HydrophobicContact CG-CD2 4.36Å; R142-V377 HydrophobicContact CG-CG2 4.24Å; R142-D378 HydrophobicContact CG-CB 4.47Å; R142-D378 VanDerWaalsContact CZ-CG 3.45Å; R142-D378 IonicContact CZ-OD1 2.83Å; R142-D378 IonicContact CZ-OD2 3.43Å; R142-D378 VanDerWaalsContact NE-CG 3.29Å; R142-D378 IonicContact NE-OD1 3.68Å; R142-D378 IonicContact NE-OD2 2.85Å; R142-D378 PolarHBondContact NE-OD2 3.15Å; R142-D378 IonicContact NH2-OD1 3.57Å; R142-D378 PolarHBondContact NH2-OD1 3.5Å; R142-D378 IonicContact NH2-OD2 3.18Å; R142-D378 PolarHBondContact NH2-OD2 3.06Å
143T96.4Very high93.5Very high28 Ų2830.5 Ų30.517%0.17214%0.141CC..Hα-helixtrans-68.6-44.8-179.3-56.30000112V139 F140 R141 R146 Y147 L207V139-T143 VanDerWaalsContact O-CB 3.24Å; V139-T143 WeakPolarHBondContact O-CB 3.18Å; V139-T143 PolarHBondContact O-N 3.39Å; V139-T143 PolarHBondContact O-OG1 3.37Å; F140-T143 PolarHBondContact O-N 3.21Å; R141-T143 VanDerWaalsContact C-N 3.35Å; R141-T143 PolarHBondContact O-N 2.85Å; T143-R146 PolarHBondContact O-N 2.88Å; T143-Y147 HydrophobicContact CG2-CD2 4.33Å; T143-Y147 HydrophobicContact CG2-CE1 4.08Å; T143-Y147 HydrophobicContact CG2-CE2 3.81Å; T143-Y147 PolarHBondContact O-N 3.35Å; T143-L207 HydrophobicContact CG2-CD1 3.48Å; T143-L207 VanDerWaalsContact CG2-CD1 3.48Å
144I97Very high94.1Very high0 Ų030.4 Ų30.40%014%0.138CC..Hα-helixtrans-61.5-46.5176.2-69163000110.3L114 L118 F140 R146 Y147 I148 A204 L207 I208L114-I144 HydrophobicContact CD1-CD1 3.89Å; L114-I144 HydrophobicContact CD1-CG2 4.39Å; L114-I144 HydrophobicContact CD2-CB 3.85Å; L114-I144 HydrophobicContact CD2-CG2 3.7Å; L118-I144 HydrophobicContact CD1-CD1 4.22Å; F140-I144 WeakPolarHBondContact O-CB 3.38Å; F140-I144 WeakPolarHBondContact O-CD1 3.22Å; F140-I144 VanDerWaalsContact O-CG1 3.29Å; F140-I144 WeakPolarHBondContact O-CG1 3.21Å; F140-I144 PolarHBondContact O-N 3.12Å; I144-R146 VanDerWaalsContact C-N 3.33Å; I144-R146 PolarHBondContact O-N 3.09Å; I144-Y147 PolarHBondContact O-N 2.97Å; I144-I148 HydrophobicContact CG2-CD1 4.03Å; I144-I148 WeakPolarHBondContact O-CD1 3.02Å; I144-I148 WeakPolarHBondContact O-CG1 3.5Å; I144-I148 PolarHBondContact O-N 3.3Å; I144-I148 VanDerWaalsContact O-N 3.11Å; I144-A204 HydrophobicContact CG2-CB 4.33Å; I144-L207 HydrophobicContact CD1-CB 4.11Å; I144-L207 HydrophobicContact CG1-CB 3.78Å; I144-L207 HydrophobicContact CG1-CD1 4.06Å; I144-I208 HydrophobicContact CD1-CG1 3.86Å; I144-I208 HydrophobicContact CG1-CG1 4.49Å; I144-I208 HydrophobicContact CG2-CD1 4.45Å; I144-I208 HydrophobicContact CG2-CG1 4.46Å
145S96.6Very high94.6Very high0 Ų026.4 Ų26.40%012%0.119CC..Hα-helixtrans-57.1-45.61751720000112.1R141 Y147 I148 N149 S373R141-S145 VanDerWaalsContact O-CB 3.27Å; R141-S145 WeakPolarHBondContact O-CB 3.16Å; R141-S145 PolarHBondContact O-N 2.84Å; S145-Y147 PolarHBondContact O-N 3.23Å; S145-I148 PolarHBondContact O-N 2.88Å; S145-N149 PolarHBondContact O-N 3.03Å; S145-N149 VanDerWaalsContact O-N 3.09Å; S145-N149 PolarHBondContact O-ND2 3.43Å; S145-S373 WeakPolarHBondContact OG-CB 3.46Å; S145-S373 PolarHBondContact OG-OG 3.28Å
146R96.8Very high95Very high39 Ų3920.7 Ų20.715%0.1479%0.092CC..Hα-helixtrans-62.1-41.8177.5-175.1174.856.175.7-1.9112R142 T143 I144 I148 N149 L150 L178 E183R142-R146 VanDerWaalsContact O-CB 3.29Å; R142-R146 WeakPolarHBondContact O-CB 3.31Å; R142-R146 PolarHBondContact O-N 2.95Å; T143-R146 PolarHBondContact O-N 2.88Å; I144-R146 VanDerWaalsContact C-N 3.33Å; I144-R146 PolarHBondContact O-N 3.09Å; R146-I148 VanDerWaalsContact C-N 3.35Å; R146-I148 PolarHBondContact O-N 3.28Å; R146-N149 PolarHBondContact O-N 3.45Å; R146-L150 VanDerWaalsContact O-CB 3.27Å; R146-L150 WeakPolarHBondContact O-CB 3.32Å; R146-L150 PolarHBondContact O-N 3.5Å; R146-L178 WeakPolarHBondContact CD-O 3.49Å; R146-L178 VanDerWaalsContact CG-O 3.23Å; R146-L178 WeakPolarHBondContact CG-O 3.32Å; R146-L178 PolarHBondContact NH1-O 3.25Å; R146-L178 VanDerWaalsContact NH1-O 3.07Å; R146-E183 IonicContact CZ-OE1 3.81Å; R146-E183 IonicContact CZ-OE2 2.78Å; R146-E183 VanDerWaalsContact NH1-CD 3.31Å; R146-E183 IonicContact NH1-OE1 3.17Å; R146-E183 PolarHBondContact NH1-OE1 3.48Å; R146-E183 IonicContact NH1-OE2 3.74Å; R146-E183 PolarHBondContact NH1-OE2 2.9Å; R146-E183 IonicContact NH2-OE1 3.1Å; R146-E183 PolarHBondContact NH2-OE1 2.85Å; R146-E183 IonicContact NH2-OE2 3.56Å
147Y97.6Very high95.1Very high27 Ų2716.4 Ų16.411%0.1068%0.079CC..Hα-helixtrans-62.8-38.5176.4-71.8-13000113.5T143 I144 S145 L150 A151 E183 P200 W203 A204 L207T143-Y147 HydrophobicContact CG2-CD2 4.33Å; T143-Y147 HydrophobicContact CG2-CE1 4.08Å; T143-Y147 HydrophobicContact CG2-CE2 3.81Å; T143-Y147 PolarHBondContact O-N 3.35Å; I144-Y147 PolarHBondContact O-N 2.97Å; S145-Y147 PolarHBondContact O-N 3.23Å; Y147-L150 PolarHBondContact O-N 3.03Å; Y147-A151 PolarHBondContact O-N 2.75Å; Y147-E183 HydrophobicContact CE1-CG 4.35Å; Y147-E183 PolarHBondContact OH-OE1 3.23Å; Y147-P200 WeakPolarHBondContact CB-O 3.27Å; Y147-P200 VanDerWaalsContact O-CB 3.27Å; Y147-P200 WeakPolarHBondContact O-CB 3.32Å; Y147-W203 HydrophobicContact CD1-CE3 4.23Å; Y147-W203 HydrophobicContact CD2-CB 3.59Å; Y147-W203 AromaticContact CE1-CE3 3.88Å; Y147-W203 HydrophobicContact CE1-CE3 3.88Å; Y147-W203 HydrophobicContact CE1-CZ3 4.45Å; Y147-W203 HydrophobicContact CE2-CB 3.43Å; Y147-W203 VanDerWaalsContact CE2-CB 3.43Å; Y147-W203 HydrophobicContact CE2-CE3 4.34Å; Y147-W203 HydrophobicContact CE2-CG 4.41Å; Y147-W203 HydrophobicContact CG-CB 4.4Å; Y147-W203 AromaticContact CZ-CE3 3.94Å; Y147-A204 HydrophobicContact CD2-CB 4.35Å; Y147-L207 HydrophobicContact CD2-CD1 3.91Å; Y147-L207 HydrophobicContact CE2-CD1 3.41Å; Y147-L207 VanDerWaalsContact CE2-CD1 3.41Å; Y147-L207 HydrophobicContact CE2-CG 4.24Å
148I97.6Very high95Very high0 Ų019.3 Ų19.30%010%0.1CC..Hα-helixtrans-63.4-45.5175.3-64157.9000110.3P107 I110 I144 S145 R146 A151 S152 L201 F233P107-I148 HydrophobicContact CB-CG2 3.84Å; I110-I148 HydrophobicContact CB-CD1 3.96Å; I110-I148 HydrophobicContact CD1-CD1 3.88Å; I110-I148 HydrophobicContact CD1-CG1 4.28Å; I110-I148 HydrophobicContact CD1-CG2 4.02Å; I110-I148 HydrophobicContact CG2-CD1 3.4Å; I144-I148 HydrophobicContact CG2-CD1 4.03Å; I144-I148 WeakPolarHBondContact O-CD1 3.02Å; I144-I148 WeakPolarHBondContact O-CG1 3.5Å; I144-I148 PolarHBondContact O-N 3.3Å; I144-I148 VanDerWaalsContact O-N 3.11Å; S145-I148 PolarHBondContact O-N 2.88Å; R146-I148 VanDerWaalsContact C-N 3.35Å; R146-I148 PolarHBondContact O-N 3.28Å; I148-A151 PolarHBondContact O-N 2.91Å; I148-S152 PolarHBondContact O-N 3.43Å; I148-L201 HydrophobicContact CG1-CD2 4.4Å; I148-F233 HydrophobicContact CG2-CD1 3.98Å; I148-F233 HydrophobicContact CG2-CD2 4.11Å; I148-F233 HydrophobicContact CG2-CE1 3.61Å; I148-F233 HydrophobicContact CG2-CE2 3.75Å; I148-F233 HydrophobicContact CG2-CG 4.23Å; I148-F233 HydrophobicContact CG2-CZ 3.51Å
149N96.6Very high95Very high0 Ų019 Ų190%010%0.098CC..Hα-helixtrans-67.5-37.1176.7-71.1-64.6000112.4S145 R146 S152 A153 L178 L370 S373S145-N149 PolarHBondContact O-N 3.03Å; S145-N149 VanDerWaalsContact O-N 3.09Å; S145-N149 PolarHBondContact O-ND2 3.43Å; R146-N149 PolarHBondContact O-N 3.45Å; N149-S152 WeakPolarHBondContact O-CB 3.35Å; N149-S152 PolarHBondContact O-N 2.96Å; N149-A153 WeakPolarHBondContact O-CB 3.46Å; N149-A153 PolarHBondContact O-N 3.44Å; N149-L178 HydrophobicContact CB-CD2 4.12Å; N149-L370 HydrophobicContact CB-CD1 4.4Å; N149-S373 PolarHBondContact ND2-OG 3.47Å
150L95.7Very high95Very high0 Ų015.7 Ų15.70%08%0.079CC..Hα-helixtrans-62.4-43.4175.8179.361.2000111.1R146 Y147 S152 A153 L154 L173 L178 M179 P200R146-L150 VanDerWaalsContact O-CB 3.27Å; R146-L150 WeakPolarHBondContact O-CB 3.32Å; R146-L150 PolarHBondContact O-N 3.5Å; Y147-L150 PolarHBondContact O-N 3.03Å; L150-S152 VanDerWaalsContact C-N 3.31Å; L150-S152 PolarHBondContact O-N 3.18Å; L150-A153 PolarHBondContact O-N 3.23Å; L150-L154 HydrophobicContact CD1-CD1 4.33Å; L150-L154 HydrophobicContact CD1-CG 4.29Å; L150-L154 HydrophobicContact CG-CD1 4.13Å; L150-L154 WeakPolarHBondContact O-CG 3.48Å; L150-L154 PolarHBondContact O-N 3.35Å; L150-L173 HydrophobicContact CD1-CD1 4.26Å; L150-L178 HydrophobicContact CD1-CB 4.29Å; L150-M179 HydrophobicContact CD1-CB 4.03Å; L150-M179 HydrophobicContact CD1-CG 4.48Å; L150-M179 HydrophobicContact CD1-SD 4.45Å; L150-M179 HydrophobicContact CD2-CB 4.26Å; L150-M179 HydrophobicContact CD2-CE 4.41Å; L150-M179 HydrophobicContact CD2-CG 4.09Å; L150-M179 HydrophobicContact CD2-SD 4.48Å; L150-P200 HydrophobicContact CB-CB 4.33Å; L150-P200 HydrophobicContact CB-CG 4.36Å; L150-P200 HydrophobicContact CD2-CB 4.16Å; L150-P200 HydrophobicContact CD2-CG 3.8Å; L150-P200 HydrophobicContact CG-CB 4.3Å; L150-P200 HydrophobicContact CG-CG 3.84Å
151A95.9Very high94.8Very high0 Ų019 Ų190%010%0.096CC..Hα-helixtrans-58.9-43.4173.800000112Y147 I148 C155 F197 P200 L201 L237Y147-A151 PolarHBondContact O-N 2.75Å; I148-A151 PolarHBondContact O-N 2.91Å; A151-C155 WeakPolarHBondContact O-CB 3.4Å; A151-C155 PolarHBondContact O-N 2.84Å; A151-F197 WeakPolarHBondContact CA-O 3.41Å; A151-F197 VanDerWaalsContact CB-O 3.24Å; A151-F197 WeakPolarHBondContact CB-O 3.04Å; A151-P200 HydrophobicContact CB-CB 4.22Å; A151-L201 HydrophobicContact CB-CD1 4.12Å; A151-L201 HydrophobicContact CB-CD2 3.53Å; A151-L201 HydrophobicContact CB-CG 3.56Å; A151-L237 HydrophobicContact CB-CD1 4.27Å
152S95.3Very high94.5Very high0 Ų019.7 Ų19.70%010%0.104CC..Hα-helixtrans-62.6-44175.1-163.60000111.8I148 N149 L150 C155 F156I148-S152 PolarHBondContact O-N 3.43Å; N149-S152 WeakPolarHBondContact O-CB 3.35Å; N149-S152 PolarHBondContact O-N 2.96Å; L150-S152 VanDerWaalsContact C-N 3.31Å; L150-S152 PolarHBondContact O-N 3.18Å; S152-C155 PolarHBondContact O-N 2.63Å; S152-F156 WeakPolarHBondContact O-CB 3.48Å; S152-F156 WeakPolarHBondContact O-CD2 3.21Å; S152-F156 WeakPolarHBondContact O-CG 3.07Å; S152-F156 PolarHBondContact O-N 2.93Å; S152-F156 WeakPolarHBondContact OG-CD2 3.43Å; S152-F156 WeakPolarHBondContact OG-CE2 3.26Å; S152-F156 WeakPolarHBondContact OG-CZ 3.29Å
153A94.4Very high94.3Very high0 Ų015 Ų150%09%0.086CC..Hα-helixtrans-62-46.5178.800000111.7N149 L150 C155 F156 C157 L173 L178 L366N149-A153 WeakPolarHBondContact O-CB 3.46Å; N149-A153 PolarHBondContact O-N 3.44Å; L150-A153 PolarHBondContact O-N 3.23Å; A153-C155 PolarHBondContact O-N 3.42Å; A153-F156 PolarHBondContact O-N 2.91Å; A153-C157 PolarHBondContact O-N 3.49Å; A153-C157 PolarHBondContact O-SG 3.12Å; A153-L173 HydrophobicContact CB-CD2 4.26Å; A153-L178 HydrophobicContact CB-CD1 4.25Å; A153-L366 HydrophobicContact CB-CD1 4.35Å; A153-L366 HydrophobicContact CB-CD2 3.75Å
154L93.6Very high94.1Very high10 Ų1020.1 Ų20.15%0.05211%0.107CC..Hα-helixtrans-62.2-43.3177.7-71169000112.2L150 C157 S158 L170 L173 Y187 F197 P200L150-L154 HydrophobicContact CD1-CD1 4.33Å; L150-L154 HydrophobicContact CD1-CG 4.29Å; L150-L154 HydrophobicContact CG-CD1 4.13Å; L150-L154 WeakPolarHBondContact O-CG 3.48Å; L150-L154 PolarHBondContact O-N 3.35Å; L154-C157 PolarHBondContact O-N 3.38Å; L154-S158 PolarHBondContact O-N 3.49Å; L154-S158 PolarHBondContact O-OG 2.84Å; L154-L170 HydrophobicContact CD2-CD2 3.69Å; L154-L173 HydrophobicContact CD2-CD1 3.62Å; L154-L173 HydrophobicContact CG-CD1 4.29Å; L154-Y187 HydrophobicContact CD1-CE2 3.92Å; L154-F197 HydrophobicContact CB-CB 3.91Å; L154-P200 HydrophobicContact CD1-CG 3.83Å
155C94.3Very high93.8Very high0 Ų026.4 Ų26.40%014%0.136CC..Hα-helixtrans-60.1-49.8174.2177.30000110.7A151 S152 A153 C157 S158 I159 F197 L237 C241A151-C155 WeakPolarHBondContact O-CB 3.4Å; A151-C155 PolarHBondContact O-N 2.84Å; S152-C155 PolarHBondContact O-N 2.63Å; A153-C155 PolarHBondContact O-N 3.42Å; C155-C157 VanDerWaalsContact C-N 3.34Å; C155-C157 PolarHBondContact O-N 3.21Å; C155-S158 WeakPolarHBondContact O-CA 3.38Å; C155-S158 VanDerWaalsContact O-CB 3.29Å; C155-S158 WeakPolarHBondContact O-CB 3.42Å; C155-S158 PolarHBondContact O-N 3.19Å; C155-I159 PolarHBondContact O-N 2.87Å; C155-I159 VanDerWaalsContact O-N 3.14Å; C155-F197 HydrophobicContact CB-CB 3.99Å; C155-F197 HydrophobicContact CB-CD2 4.11Å; C155-F197 HydrophobicContact CB-CG 3.97Å; C155-L237 HydrophobicContact CB-CD1 4.45Å; C155-L237 HydrophobicContact CB-CD2 3.88Å; C155-C241 PolarHBondContact SG-SG 3.28Å
156F94.3Very high93.4Very high0 Ų030 Ų300%015%0.149CC..Hα-helixtrans-63.7-33.8179-66.1-31000113.8L104 S152 A153 S158 I159 S160 M163 L240 V362 L365L104-F156 HydrophobicContact CD2-CE1 4.31Å; L104-F156 HydrophobicContact CD2-CZ 4.39Å; S152-F156 WeakPolarHBondContact O-CB 3.48Å; S152-F156 WeakPolarHBondContact O-CD2 3.21Å; S152-F156 WeakPolarHBondContact O-CG 3.07Å; S152-F156 PolarHBondContact O-N 2.93Å; S152-F156 WeakPolarHBondContact OG-CD2 3.43Å; S152-F156 WeakPolarHBondContact OG-CE2 3.26Å; S152-F156 WeakPolarHBondContact OG-CZ 3.29Å; A153-F156 PolarHBondContact O-N 2.91Å; F156-S158 PolarHBondContact O-N 3.43Å; F156-I159 HydrophobicContact CD1-CD1 3.95Å; F156-I159 HydrophobicContact CD1-CG1 4.3Å; F156-I159 HydrophobicContact CE1-CD1 4.41Å; F156-I159 PolarHBondContact O-N 3.41Å; F156-S160 WeakPolarHBondContact O-CA 3.41Å; F156-S160 VanDerWaalsContact O-CB 3.31Å; F156-S160 WeakPolarHBondContact O-CB 3.16Å; F156-S160 PolarHBondContact O-N 3.17Å; F156-M163 HydrophobicContact CB-CB 4.22Å; F156-M163 HydrophobicContact CB-CE 3.74Å; F156-M163 HydrophobicContact CB-CG 3.85Å; F156-M163 HydrophobicContact CD2-CE 3.99Å; F156-M163 HydrophobicContact CG-CE 4.3Å; F156-M163 WeakPolarHBondContact O-CB 3.2Å; F156-L240 HydrophobicContact CE1-CD1 4.06Å; F156-V362 HydrophobicContact CB-CG1 3.64Å; F156-V362 HydrophobicContact CD1-CG1 3.46Å; F156-V362 VanDerWaalsContact CD1-CG1 3.46Å; F156-V362 HydrophobicContact CD2-CG1 3.12Å; F156-V362 HydrophobicContact CE1-CG1 3.78Å; F156-V362 HydrophobicContact CE2-CG1 3.44Å; F156-V362 VanDerWaalsContact CE2-CG1 3.44Å; F156-V362 HydrophobicContact CG-CG1 3.12Å; F156-V362 HydrophobicContact CZ-CG1 3.76Å; F156-L365 HydrophobicContact CZ-CD2 4.34Å
157C92.1Very high93.1Very high24 Ų2428.5 Ų28.516%0.16214%0.144CC..Hα-helixtrans-63.9-25.5172.4-68.30000112.5A153 L154 C155 M163A153-C157 PolarHBondContact O-N 3.49Å; A153-C157 PolarHBondContact O-SG 3.12Å; L154-C157 PolarHBondContact O-N 3.38Å; C155-C157 VanDerWaalsContact C-N 3.34Å; C155-C157 PolarHBondContact O-N 3.21Å; C157-M163 HydrophobicContact CB-CG 4.4Å; C157-M163 VanDerWaalsContact SG-CG 3.59Å
158S89.9Confident92.6Very high61 Ų6131.5 Ų31.543%0.42717%0.167SC..Hα-helixtrans-82.2-39.6179.1-51.80000112L154 C155 F156 S195L154-S158 PolarHBondContact O-N 3.49Å; L154-S158 PolarHBondContact O-OG 2.84Å; C155-S158 WeakPolarHBondContact O-CA 3.38Å; C155-S158 VanDerWaalsContact O-CB 3.29Å; C155-S158 WeakPolarHBondContact O-CB 3.42Å; C155-S158 PolarHBondContact O-N 3.19Å; F156-S158 PolarHBondContact O-N 3.43Å; S158-S195 PolarHBondContact OG-OG 3.44Å
159I92.2Very high92.2Very high12 Ų1235 Ų356%0.06219%0.188CC..Hα-helixtrans-100.4-26.2-172.767.9177.7000114.5C155 F156 L240 D244 F353C155-I159 PolarHBondContact O-N 2.87Å; C155-I159 VanDerWaalsContact O-N 3.14Å; F156-I159 HydrophobicContact CD1-CD1 3.95Å; F156-I159 HydrophobicContact CD1-CG1 4.3Å; F156-I159 HydrophobicContact CE1-CD1 4.41Å; F156-I159 PolarHBondContact O-N 3.41Å; I159-L240 HydrophobicContact CD1-CB 3.98Å; I159-L240 HydrophobicContact CD1-CD1 4.43Å; I159-D244 HydrophobicContact CB-CB 4.35Å; I159-D244 HydrophobicContact CG2-CB 3.86Å; I159-F353 HydrophobicContact CD1-CD1 4.11Å; I159-F353 HydrophobicContact CD1-CD2 4.26Å; I159-F353 HydrophobicContact CD1-CE1 3.8Å; I159-F353 HydrophobicContact CD1-CE2 3.97Å; I159-F353 HydrophobicContact CD1-CG 4.33Å; I159-F353 HydrophobicContact CD1-CZ 3.73Å; I159-F353 HydrophobicContact CG1-CD1 4.26Å; I159-F353 HydrophobicContact CG1-CE1 4.43Å; I159-F353 HydrophobicContact CG1-CG 4.35Å; I159-F353 WeakPolarHBondContact O-CB 3.24Å
160S93.3Very high91.8Very high8 Ų838 Ų386%0.05620%0.204CC..  trans-107.6128-173.91790000112.8F156 G162 M163 K164 F353F156-S160 WeakPolarHBondContact O-CA 3.41Å; F156-S160 VanDerWaalsContact O-CB 3.31Å; F156-S160 WeakPolarHBondContact O-CB 3.16Å; F156-S160 PolarHBondContact O-N 3.17Å; S160-G162 PolarHBondContact OG-N 3.36Å; S160-M163 PolarHBondContact O-N 2.91Å; S160-M163 PolarHBondContact OG-N 3.36Å; S160-K164 WeakPolarHBondContact O-CB 3.4Å; S160-K164 PolarHBondContact O-N 3.21Å; S160-F353 WeakPolarHBondContact CA-O 3.4Å; S160-F353 PolarHBondContact OG-O 3.14Å
161I90.7Very high91.6Very high87 Ų8742.4 Ų42.445%0.44623%0.227SC..Hα-helixtrans-65.3-44176.7-55.1177.9000110.1M163 K164 Q165 F353 L355I161-M163 VanDerWaalsContact C-N 3.33Å; I161-M163 PolarHBondContact O-N 3.11Å; I161-K164 PolarHBondContact O-N 3Å; I161-Q165 WeakPolarHBondContact O-CG 3.37Å; I161-Q165 PolarHBondContact O-N 3.4Å; I161-F353 PolarHBondContact N-O 3.26Å; I161-F353 VanDerWaalsContact N-O 3.14Å; I161-L355 HydrophobicContact CB-CG 4.37Å; I161-L355 HydrophobicContact CG2-CD1 3.92Å; I161-L355 HydrophobicContact CG2-CG 4.17Å
162G89Confident91.4Very high18 Ų1843 Ų4319%0.18623%0.232CC..Hα-helixtrans-62.5-38.4178.300000113S160 Q165 R166S160-G162 PolarHBondContact OG-N 3.36Å; G162-Q165 PolarHBondContact O-N 3.22Å; G162-R166 PolarHBondContact O-N 3.43Å
163M91.4Very high91.2Very high0 Ų043.2 Ų43.20%023%0.233CC..Hα-helixtrans-67.5-43.6175.4-168.965.475.900111.3F156 C157 S160 I161 Q165 R166 F167 V362 V363 L366F156-M163 HydrophobicContact CB-CB 4.22Å; F156-M163 HydrophobicContact CB-CE 3.74Å; F156-M163 HydrophobicContact CB-CG 3.85Å; F156-M163 HydrophobicContact CD2-CE 3.99Å; F156-M163 HydrophobicContact CG-CE 4.3Å; F156-M163 WeakPolarHBondContact O-CB 3.2Å; C157-M163 HydrophobicContact CB-CG 4.4Å; C157-M163 VanDerWaalsContact SG-CG 3.59Å; S160-M163 PolarHBondContact O-N 2.91Å; S160-M163 PolarHBondContact OG-N 3.36Å; I161-M163 VanDerWaalsContact C-N 3.33Å; I161-M163 PolarHBondContact O-N 3.11Å; M163-Q165 VanDerWaalsContact C-N 3.3Å; M163-Q165 PolarHBondContact O-N 3.17Å; M163-R166 PolarHBondContact O-N 2.87Å; M163-R166 VanDerWaalsContact O-N 3.1Å; M163-F167 HydrophobicContact CG-CD2 4.21Å; M163-F167 PolarHBondContact O-N 3.04Å; M163-F167 HydrophobicContact SD-CD2 3.41Å; M163-F167 WeakPolarHBondContact SD-CD2 3.5Å; M163-F167 HydrophobicContact SD-CE2 3.55Å; M163-F167 VanDerWaalsContact SD-CE2 3.55Å; M163-V362 HydrophobicContact CE-CB 4.45Å; M163-V362 HydrophobicContact CE-CG1 3.76Å; M163-V363 HydrophobicContact CE-CG2 3.86Å; M163-V363 HydrophobicContact SD-CG2 3.91Å; M163-L366 HydrophobicContact CE-CB 4.12Å; M163-L366 HydrophobicContact CE-CD2 3.68Å; M163-L366 HydrophobicContact SD-CD2 4.17Å
164K90.8Very high91.2Very high137 Ų13744.5 Ų44.560%0.59624%0.241SC*.Hα-helixtrans-63.9-33.1177.8-168.1173.2-174.91750113S160 I161 F167 P168S160-K164 WeakPolarHBondContact O-CB 3.4Å; S160-K164 PolarHBondContact O-N 3.21Å; I161-K164 PolarHBondContact O-N 3Å; K164-F167 CarbonylContact O-C 3.45Å; K164-P168 VanDerWaalsContact O-CA 3.32Å; K164-P168 WeakPolarHBondContact O-CA 3.38Å
165Q91.4Very high91.1Very high131 Ų13150 Ų5061%0.61227%0.269SS*.Hα-helixtrans-68.1-37.1172.5-74.5-178.1-0.300112.3I161 G162 M163I161-Q165 WeakPolarHBondContact O-CG 3.37Å; I161-Q165 PolarHBondContact O-N 3.4Å; G162-Q165 PolarHBondContact O-N 3.22Å; M163-Q165 VanDerWaalsContact C-N 3.3Å; M163-Q165 PolarHBondContact O-N 3.17Å
166R88.5Confident90.8Very high76 Ų7651.7 Ų51.729%0.28728%0.28SS..Hα-helixtrans-77.5-34.5179-167.9165.1-171.4178.7-5.3112.9G162 M163 E367 L492G162-R166 PolarHBondContact O-N 3.43Å; M163-R166 PolarHBondContact O-N 2.87Å; M163-R166 VanDerWaalsContact O-N 3.1Å; R166-E367 IonicContact CZ-OE1 3.15Å; R166-E367 IonicContact NH1-OE1 2.94Å; R166-E367 PolarHBondContact NH1-OE1 3.22Å; R166-E367 IonicContact NH2-OE1 2.71Å; R166-E367 PolarHBondContact NH2-OE1 3.21Å; R166-L492 VanDerWaalsContact NE-CD2 3.35Å; R166-L492 PolarHBondContact NE-O 3.23Å; R166-L492 PolarHBondContact NH2-O 2.92Å
167F90.1Very high90.6Very high7 Ų754.1 Ų54.13%0.03131%0.305CS..  trans-128.579.6178.7-57.4-74000110.9M163 K164 T169 L173 C176 L492M163-F167 HydrophobicContact CG-CD2 4.21Å; M163-F167 PolarHBondContact O-N 3.04Å; M163-F167 HydrophobicContact SD-CD2 3.41Å; M163-F167 WeakPolarHBondContact SD-CD2 3.5Å; M163-F167 HydrophobicContact SD-CE2 3.55Å; M163-F167 VanDerWaalsContact SD-CE2 3.55Å; K164-F167 CarbonylContact O-C 3.45Å; F167-T169 VanDerWaalsContact C-N 3.28Å; F167-T169 PolarHBondContact O-N 3.03Å; F167-L173 HydrophobicContact CB-CD2 4.18Å; F167-L173 HydrophobicContact CD1-CD2 3.9Å; F167-L173 HydrophobicContact CD2-CD2 4.34Å; F167-L173 HydrophobicContact CE1-CD2 4.21Å; F167-L173 HydrophobicContact CG-CD2 3.9Å; F167-L173 HydrophobicContact CZ-CD2 4.48Å; F167-C176 HydrophobicContact CE1-CB 3.92Å; F167-L492 HydrophobicContact CE1-CD2 4.07Å; F167-L492 HydrophobicContact CE1-CG 4.3Å; F167-L492 HydrophobicContact CE2-CD2 3.75Å; F167-L492 HydrophobicContact CZ-CD1 4.1Å; F167-L492 HydrophobicContact CZ-CD2 3.17Å; F167-L492 HydrophobicContact CZ-CG 3.71Å
168P87.2Confident90.6Very high90 Ų9053 Ų5358%0.58430%0.298SS*.  trans-69.2-28.4-177.3-19.733000113.3K164K164-P168 VanDerWaalsContact O-CA 3.32Å; K164-P168 WeakPolarHBondContact O-CA 3.38Å
169T88.5Confident90.7Very high73 Ų7350.3 Ų50.345%0.44828%0.278SS..SBendtrans-130155.5-172.457.10000111F167 D171 S172F167-T169 VanDerWaalsContact C-N 3.28Å; F167-T169 PolarHBondContact O-N 3.03Å; T169-D171 PolarHBondContact O-N 3.35Å; T169-S172 WeakPolarHBondContact O-CB 3.38Å; T169-S172 PolarHBondContact O-N 2.85Å; T169-S172 PolarHBondContact O-OG 3.19Å; T169-S172 PolarHBondContact OG1-N 3.1Å; T169-S172 PolarHBondContact OG1-OG 3.17Å
170L89.2Confident90.9Very high65 Ų6552.3 Ų52.334%0.3429%0.291SS..Hα-helixtrans-60.3-33.6173.5-67.6173.3000111.8L154 S172 L173 V174 L184 Y187L154-L170 HydrophobicContact CD2-CD2 3.69Å; L170-S172 PolarHBondContact O-N 2.68Å; L170-L173 HydrophobicContact CD2-CD1 4.21Å; L170-L173 WeakPolarHBondContact O-CB 3.46Å; L170-L173 PolarHBondContact O-N 2.94Å; L170-V174 PolarHBondContact O-N 3.43Å; L170-L184 HydrophobicContact CB-CD1 3.59Å; L170-L184 HydrophobicContact CD1-CD1 4.1Å; L170-L184 HydrophobicContact CG-CD1 4.44Å; L170-Y187 HydrophobicContact CD1-CD1 4.01Å; L170-Y187 HydrophobicContact CD1-CE1 4.14Å; L170-Y187 HydrophobicContact CD2-CE1 4.24Å
171D91.6Very high90.9Very high91 Ų9159.4 Ų59.449%0.48732%0.324SS..Hα-helixtrans-58.1-32.3174.1-60-51.3000112.4T169 L173 V174 I175 L184T169-D171 PolarHBondContact O-N 3.35Å; D171-L173 PolarHBondContact O-N 3.03Å; D171-V174 WeakPolarHBondContact O-CB 3.27Å; D171-V174 PolarHBondContact O-N 3.22Å; D171-V174 VanDerWaalsContact O-N 3.08Å; D171-I175 WeakPolarHBondContact O-CG1 3.34Å; D171-I175 PolarHBondContact O-N 3.43Å; D171-L184 VanDerWaalsContact OD1-CD2 3.3Å; D171-L184 WeakPolarHBondContact OD1-CD2 3.31Å
172S92Very high91Very high14 Ų1462.5 Ų62.510%0.09834%0.336CS..Hα-helixtrans-63.5-32175.8-47.70000111.9T169 L170 V174 C176T169-S172 WeakPolarHBondContact O-CB 3.38Å; T169-S172 PolarHBondContact O-N 2.85Å; T169-S172 PolarHBondContact O-OG 3.19Å; T169-S172 PolarHBondContact OG1-N 3.1Å; T169-S172 PolarHBondContact OG1-OG 3.17Å; L170-S172 PolarHBondContact O-N 2.68Å; S172-V174 VanDerWaalsContact C-N 3.35Å; S172-C176 WeakPolarHBondContact O-CB 3.47Å; S172-C176 PolarHBondContact O-N 3.19Å; S172-C176 VanDerWaalsContact O-N 3.15Å
173L91.9Very high91.2Very high3 Ų362.3 Ų62.32%0.01633%0.33CS..Hα-helixtrans-72.8-29.9174.6-60.5175.4000111.8L150 A153 L154 F167 L170 D171 G177 L178 M179L150-L173 HydrophobicContact CD1-CD1 4.26Å; A153-L173 HydrophobicContact CB-CD2 4.26Å; L154-L173 HydrophobicContact CD2-CD1 3.62Å; L154-L173 HydrophobicContact CG-CD1 4.29Å; F167-L173 HydrophobicContact CB-CD2 4.18Å; F167-L173 HydrophobicContact CD1-CD2 3.9Å; F167-L173 HydrophobicContact CD2-CD2 4.34Å; F167-L173 HydrophobicContact CE1-CD2 4.21Å; F167-L173 HydrophobicContact CG-CD2 3.9Å; F167-L173 HydrophobicContact CZ-CD2 4.48Å; L170-L173 HydrophobicContact CD2-CD1 4.21Å; L170-L173 WeakPolarHBondContact O-CB 3.46Å; L170-L173 PolarHBondContact O-N 2.94Å; D171-L173 PolarHBondContact O-N 3.03Å; L173-G177 PolarHBondContact O-N 3.39Å; L173-L178 HydrophobicContact CD2-CD1 4.22Å; L173-L178 PolarHBondContact O-N 3.49Å; L173-M179 HydrophobicContact CB-CB 4.35Å; L173-M179 PolarHBondContact O-N 3.27Å
174V92.9Very high91.3Very high27 Ų2763.6 Ų63.616%0.16434%0.337CS..Hα-helixtrans-71.1-49173.8178.40000111.2L170 D171 S172 C176 G177 M179 E181 L184L170-V174 PolarHBondContact O-N 3.43Å; D171-V174 WeakPolarHBondContact O-CB 3.27Å; D171-V174 PolarHBondContact O-N 3.22Å; D171-V174 VanDerWaalsContact O-N 3.08Å; S172-V174 VanDerWaalsContact C-N 3.35Å; V174-C176 PolarHBondContact O-N 3.44Å; V174-G177 PolarHBondContact O-N 3.03Å; V174-M179 WeakPolarHBondContact CA-O 3.43Å; V174-M179 HydrophobicContact CG2-CB 3.98Å; V174-M179 HydrophobicContact CG2-CG 4.24Å; V174-E181 HydrophobicContact CG1-CG 3.89Å; V174-L184 HydrophobicContact CG2-CB 3.92Å; V174-L184 HydrophobicContact CG2-CD2 3.81Å; V174-L184 HydrophobicContact CG2-CG 4.33Å
175I91.2Very high91.3Very high126 Ų12663.1 Ų63.165%0.64634%0.337SS*.Hα-helixtrans-57-36.1177.2-66.9165.1000111D171 G177D171-I175 WeakPolarHBondContact O-CG1 3.34Å; D171-I175 PolarHBondContact O-N 3.43Å; I175-G177 VanDerWaalsContact C-N 3.26Å; I175-G177 PolarHBondContact O-N 3.1Å
176C88.7Confident91.3Very high35 Ų3561.2 Ų61.224%0.23633%0.33CS..THydrogen-bonded Turntrans-72.6-14.2177.1-177.60000114.2F167 S172 V174 L178 L492F167-C176 HydrophobicContact CE1-CB 3.92Å; S172-C176 WeakPolarHBondContact O-CB 3.47Å; S172-C176 PolarHBondContact O-N 3.19Å; S172-C176 VanDerWaalsContact O-N 3.15Å; V174-C176 PolarHBondContact O-N 3.44Å; C176-L178 VanDerWaalsContact C-N 3.33Å; C176-L492 WeakPolarHBondContact SG-CD1 3.43Å; C176-L492 WeakPolarHBondContact SG-CG 3.41Å
177G89.8Confident91.4Very high51 Ų5158.8 Ų58.853%0.52632%0.321SS..THydrogen-bonded Turntrans78.111.9-176.800000114.8L173 V174 I175L173-G177 PolarHBondContact O-N 3.39Å; V174-G177 PolarHBondContact O-N 3.03Å; I175-G177 VanDerWaalsContact C-N 3.26Å; I175-G177 PolarHBondContact O-N 3.1Å
178L91.7Very high91.2Very high1 Ų161.8 Ų61.81%0.00534%0.343CS..SBendtrans-76.8-29.8171.6-82.1162.1000111.5R146 N149 L150 A153 L173 C176 L366 L370R146-L178 WeakPolarHBondContact CD-O 3.49Å; R146-L178 VanDerWaalsContact CG-O 3.23Å; R146-L178 WeakPolarHBondContact CG-O 3.32Å; R146-L178 PolarHBondContact NH1-O 3.25Å; R146-L178 VanDerWaalsContact NH1-O 3.07Å; N149-L178 HydrophobicContact CB-CD2 4.12Å; L150-L178 HydrophobicContact CD1-CB 4.29Å; A153-L178 HydrophobicContact CB-CD1 4.25Å; L173-L178 HydrophobicContact CD2-CD1 4.22Å; L173-L178 PolarHBondContact O-N 3.49Å; C176-L178 VanDerWaalsContact C-N 3.33Å; L178-L366 HydrophobicContact CD1-CD2 4.45Å; L178-L370 HydrophobicContact CD2-CD1 4.15Å
179M93.7Very high91.2Very high4 Ų463.4 Ų63.42%0.0235%0.347CS..SBendtrans-128.1145.4-179.6-164.9169.7-155.600110.2L150 L173 V174 E183 L184 Y187 W203L150-M179 HydrophobicContact CD1-CB 4.03Å; L150-M179 HydrophobicContact CD1-CG 4.48Å; L150-M179 HydrophobicContact CD1-SD 4.45Å; L150-M179 HydrophobicContact CD2-CB 4.26Å; L150-M179 HydrophobicContact CD2-CE 4.41Å; L150-M179 HydrophobicContact CD2-CG 4.09Å; L150-M179 HydrophobicContact CD2-SD 4.48Å; L173-M179 HydrophobicContact CB-CB 4.35Å; L173-M179 PolarHBondContact O-N 3.27Å; V174-M179 WeakPolarHBondContact CA-O 3.43Å; V174-M179 HydrophobicContact CG2-CB 3.98Å; V174-M179 HydrophobicContact CG2-CG 4.24Å; M179-E183 HydrophobicContact CE-CB 4.08Å; M179-E183 WeakPolarHBondContact CE-O 3.46Å; M179-E183 HydrophobicContact CG-CB 3.85Å; M179-L184 HydrophobicContact SD-CB 4.25Å; M179-L184 HydrophobicContact SD-CD1 4.19Å; M179-Y187 HydrophobicContact CE-CD1 4.35Å; M179-Y187 HydrophobicContact CE-CD2 4.04Å; M179-Y187 HydrophobicContact CE-CG 3.69Å; M179-W203 HydrophobicContact CE-CH2 4.4Å
180T94.5Very high91Very high54 Ų5463 Ų6333%0.33134%0.341SS..  trans-90.9160.6171.867.90000110.9Q182 E183 L184T180-Q182 VanDerWaalsContact C-N 3.26Å; T180-Q182 PolarHBondContact O-N 3.16Å; T180-E183 WeakPolarHBondContact CG2-OE1 3.24Å; T180-E183 PolarHBondContact N-OE2 3.43Å; T180-E183 PolarHBondContact O-N 2.9Å; T180-E183 WeakPolarHBondContact OG1-CB 3.43Å; T180-E183 WeakPolarHBondContact OG1-CG 3.32Å; T180-E183 PolarHBondContact OG1-N 3.32Å; T180-E183 PolarHBondContact OG1-OE1 3.4Å; T180-E183 PolarHBondContact OG1-OE2 3.31Å; T180-L184 PolarHBondContact O-N 3.03Å
181E93.4Very high89.8Confident158 Ų15867.8 Ų67.874%0.73836%0.362SS*.Hα-helixtrans-59.2-38.7176.4-66.6179.9175.100112.1V174 L184 E185V174-E181 HydrophobicContact CG1-CG 3.89Å; E181-L184 WeakPolarHBondContact O-CB 3.14Å; E181-L184 PolarHBondContact O-N 2.67Å; E181-E185 PolarHBondContact O-N 3.36Å
182Q93.6Very high88.4Confident151 Ų15172.4 Ų72.471%0.70638%0.381SS*.Hα-helixtrans-66.3-41177.2-66.2176.3-7.500111.9T180 L184 E185 I186T180-Q182 VanDerWaalsContact C-N 3.26Å; T180-Q182 PolarHBondContact O-N 3.16Å; Q182-L184 VanDerWaalsContact C-N 3.31Å; Q182-E185 PolarHBondContact O-N 3.41Å; Q182-I186 WeakPolarHBondContact O-CG1 3.37Å; Q182-I186 PolarHBondContact O-N 3.05Å; Q182-I186 VanDerWaalsContact O-N 3.09Å
183E94.2Very high86.6Confident14 Ų1475.9 Ų75.97%0.06541%0.405CS..Hα-helixtrans-65.3-38.4175-73.5154.1-154.200111.4R146 Y147 M179 T180 E185 I186 Y187 W203R146-E183 IonicContact CZ-OE1 3.81Å; R146-E183 IonicContact CZ-OE2 2.78Å; R146-E183 VanDerWaalsContact NH1-CD 3.31Å; R146-E183 IonicContact NH1-OE1 3.17Å; R146-E183 PolarHBondContact NH1-OE1 3.48Å; R146-E183 IonicContact NH1-OE2 3.74Å; R146-E183 PolarHBondContact NH1-OE2 2.9Å; R146-E183 IonicContact NH2-OE1 3.1Å; R146-E183 PolarHBondContact NH2-OE1 2.85Å; R146-E183 IonicContact NH2-OE2 3.56Å; Y147-E183 HydrophobicContact CE1-CG 4.35Å; Y147-E183 PolarHBondContact OH-OE1 3.23Å; M179-E183 HydrophobicContact CE-CB 4.08Å; M179-E183 WeakPolarHBondContact CE-O 3.46Å; M179-E183 HydrophobicContact CG-CB 3.85Å; T180-E183 WeakPolarHBondContact CG2-OE1 3.24Å; T180-E183 PolarHBondContact N-OE2 3.43Å; T180-E183 PolarHBondContact O-N 2.9Å; T180-E183 WeakPolarHBondContact OG1-CB 3.43Å; T180-E183 WeakPolarHBondContact OG1-CG 3.32Å; T180-E183 PolarHBondContact OG1-N 3.32Å; T180-E183 PolarHBondContact OG1-OE1 3.4Å; T180-E183 PolarHBondContact OG1-OE2 3.31Å; E183-E185 VanDerWaalsContact C-N 3.34Å; E183-I186 PolarHBondContact O-N 3.3Å; E183-Y187 VanDerWaalsContact O-CB 3.23Å; E183-Y187 WeakPolarHBondContact O-CB 3.47Å; E183-Y187 PolarHBondContact O-N 3.42Å; E183-W203 HydrophobicContact CB-CH2 4.14Å; E183-W203 HydrophobicContact CB-CZ3 3.95Å; E183-W203 HydrophobicContact CG-CH2 4.43Å; E183-W203 HydrophobicContact CG-CZ3 3.93Å
184L92Very high85Confident27 Ų2777 Ų7714%0.14141%0.412CS..Hα-helixtrans-61-44.8175.817864.4000110.7L170 D171 V174 M179 T180 E181 Q182 I186 Y187 S188L170-L184 HydrophobicContact CB-CD1 3.59Å; L170-L184 HydrophobicContact CD1-CD1 4.1Å; L170-L184 HydrophobicContact CG-CD1 4.44Å; D171-L184 VanDerWaalsContact OD1-CD2 3.3Å; D171-L184 WeakPolarHBondContact OD1-CD2 3.31Å; V174-L184 HydrophobicContact CG2-CB 3.92Å; V174-L184 HydrophobicContact CG2-CD2 3.81Å; V174-L184 HydrophobicContact CG2-CG 4.33Å; M179-L184 HydrophobicContact SD-CB 4.25Å; M179-L184 HydrophobicContact SD-CD1 4.19Å; T180-L184 PolarHBondContact O-N 3.03Å; E181-L184 WeakPolarHBondContact O-CB 3.14Å; E181-L184 PolarHBondContact O-N 2.67Å; Q182-L184 VanDerWaalsContact C-N 3.31Å; L184-I186 PolarHBondContact O-N 3.45Å; L184-Y187 PolarHBondContact O-N 3.49Å; L184-S188 VanDerWaalsContact O-CB 3.31Å; L184-S188 WeakPolarHBondContact O-CB 3.42Å; L184-S188 PolarHBondContact O-N 2.83Å; L184-S188 PolarHBondContact O-OG 3.14Å
185E91.8Very high83.8Confident127 Ų12777.1 Ų77.159%0.59341%0.414SS*.Hα-helixtrans-57.7-50.5175.7-173.4-177.2178.800111E181 Q182 E183 Y187 S188 N189E181-E185 PolarHBondContact O-N 3.36Å; Q182-E185 PolarHBondContact O-N 3.41Å; E183-E185 VanDerWaalsContact C-N 3.34Å; E185-Y187 VanDerWaalsContact C-N 3.29Å; E185-Y187 PolarHBondContact O-N 3.15Å; E185-S188 PolarHBondContact O-N 2.82Å; E185-S188 PolarHBondContact O-OG 2.9Å; E185-N189 PolarHBondContact O-N 3.47Å; E185-N189 VanDerWaalsContact O-N 3.16Å; E185-N189 PolarHBondContact O-ND2 3.31Å
186I91.1Very high83.5Confident92 Ų9272 Ų7247%0.47239%0.388SS..Hα-helixtrans-60.1-41.8177.8-63.1165.5000110.9Q182 E183 L184 N189 W203Q182-I186 WeakPolarHBondContact O-CG1 3.37Å; Q182-I186 PolarHBondContact O-N 3.05Å; Q182-I186 VanDerWaalsContact O-N 3.09Å; E183-I186 PolarHBondContact O-N 3.3Å; L184-I186 PolarHBondContact O-N 3.45Å; I186-N189 PolarHBondContact O-N 3.28Å; I186-W203 HydrophobicContact CB-CZ2 4.41Å; I186-W203 HydrophobicContact CG2-CZ2 3.85Å
187Y90Very high83.6Confident24 Ų2470.5 Ų70.59%0.09438%0.377CS..Hα-helixtrans-69.1-39-179-166.8-91.4000112.4L154 L170 M179 E183 L184 E185 N189 L190 N196 V199 W203L154-Y187 HydrophobicContact CD1-CE2 3.92Å; L170-Y187 HydrophobicContact CD1-CD1 4.01Å; L170-Y187 HydrophobicContact CD1-CE1 4.14Å; L170-Y187 HydrophobicContact CD2-CE1 4.24Å; M179-Y187 HydrophobicContact CE-CD1 4.35Å; M179-Y187 HydrophobicContact CE-CD2 4.04Å; M179-Y187 HydrophobicContact CE-CG 3.69Å; E183-Y187 VanDerWaalsContact O-CB 3.23Å; E183-Y187 WeakPolarHBondContact O-CB 3.47Å; E183-Y187 PolarHBondContact O-N 3.42Å; L184-Y187 PolarHBondContact O-N 3.49Å; E185-Y187 VanDerWaalsContact C-N 3.29Å; E185-Y187 PolarHBondContact O-N 3.15Å; Y187-N189 VanDerWaalsContact C-N 3.27Å; Y187-N189 PolarHBondContact O-N 2.9Å; Y187-L190 HydrophobicContact CD2-CD1 4.2Å; Y187-L190 VanDerWaalsContact O-CB 3.31Å; Y187-L190 WeakPolarHBondContact O-CB 3.46Å; Y187-L190 PolarHBondContact O-N 2.89Å; Y187-L190 VanDerWaalsContact O-N 3.17Å; Y187-N196 HydrophobicContact CE2-CB 4.17Å; Y187-N196 WeakPolarHBondContact CE2-O 3.34Å; Y187-N196 VanDerWaalsContact OH-C 3.24Å; Y187-N196 WeakPolarHBondContact OH-CB 3.49Å; Y187-N196 PolarHBondContact OH-O 2.82Å; Y187-N196 VanDerWaalsContact OH-O 3.1Å; Y187-V199 HydrophobicContact CD2-CB 4.36Å; Y187-V199 HydrophobicContact CD2-CG1 4.12Å; Y187-V199 HydrophobicContact CE2-CB 4.06Å; Y187-V199 HydrophobicContact CE2-CG1 4.33Å; Y187-W203 HydrophobicContact CD2-CH2 4.33Å
188S86.9Confident83.8Confident70 Ų7069.4 Ų69.449%0.4936%0.358SS..Hα-helixtrans-67.8-26.4178.369.40000113.1L184 E185 L190L184-S188 VanDerWaalsContact O-CB 3.31Å; L184-S188 WeakPolarHBondContact O-CB 3.42Å; L184-S188 PolarHBondContact O-N 2.83Å; L184-S188 PolarHBondContact O-OG 3.14Å; E185-S188 PolarHBondContact O-N 2.82Å; E185-S188 PolarHBondContact O-OG 2.9Å; S188-L190 PolarHBondContact O-N 3.11Å
189N87.1Confident83.9Confident125 Ų12570.1 Ų70.167%0.66836%0.363SS*.THydrogen-bonded Turntrans-76.1-6175.2-71.9-39.5000113.3E185 I186 Y187E185-N189 PolarHBondContact O-N 3.47Å; E185-N189 VanDerWaalsContact O-N 3.16Å; E185-N189 PolarHBondContact O-ND2 3.31Å; I186-N189 PolarHBondContact O-N 3.28Å; Y187-N189 VanDerWaalsContact C-N 3.27Å; Y187-N189 PolarHBondContact O-N 2.9Å
190L83.6Confident84Confident63 Ų6369.9 Ų69.933%0.3336%0.362SS..SBendtrans-82.7146176.1-58171.4000110.1Y187 S188 E192 V199Y187-L190 HydrophobicContact CD2-CD1 4.2Å; Y187-L190 VanDerWaalsContact O-CB 3.31Å; Y187-L190 WeakPolarHBondContact O-CB 3.46Å; Y187-L190 PolarHBondContact O-N 2.89Å; Y187-L190 VanDerWaalsContact O-N 3.17Å; S188-L190 PolarHBondContact O-N 3.11Å; L190-E192 PolarHBondContact O-N 2.92Å; L190-V199 HydrophobicContact CD1-CB 4.37Å; L190-V199 HydrophobicContact CD1-CG1 3.85Å; L190-V199 HydrophobicContact CD1-CG2 3.81Å
191E64.2Low84.1Confident166 Ų16667.6 Ų67.678%0.77635%0.347SS*.  trans-52.5124.2177.9-109.4173.6166.300111.7S193 N196E191-S193 PolarHBondContact O-N 3.45Å; E191-S193 VanDerWaalsContact O-N 3.1Å; E191-N196 PolarHBondContact O-ND2 3.16Å
192E61.1Low84.2Confident189 Ų18962.8 Ų62.888%0.88333%0.328SS*.THydrogen-bonded Turntrans-66.6-7.1-174.7-81.9-178154.900114.6L190 T194L190-E192 PolarHBondContact O-N 2.92Å; E192-T194 PolarHBondContact O-N 3.5Å; E192-T194 VanDerWaalsContact O-N 3.1Å
193S56Low84.4Confident87 Ų8757.8 Ų57.861%0.60830%0.303SS*.THydrogen-bonded Turntrans-69.6-13.8-165.157.90000115.4E191E191-S193 PolarHBondContact O-N 3.45Å; E191-S193 VanDerWaalsContact O-N 3.1Å
194T58.3Low84.6Confident26 Ų2657.1 Ų57.116%0.1630%0.3CS..SBendtrans-142.4147.3-179.549.60000112.4E192 N196 L526E192-T194 PolarHBondContact O-N 3.5Å; E192-T194 VanDerWaalsContact O-N 3.1Å; T194-N196 PolarHBondContact O-N 3.13Å; T194-N196 PolarHBondContact O-ND2 2.8Å; T194-N196 PolarHBondContact O-OD1 3.1Å; T194-N196 VanDerWaalsContact O-OD1 3.07Å; T194-N196 PolarHBondContact OG1-OD1 3.49Å; T194-L526 HydrophobicContact CG2-CD2 4.22Å; T194-L526 HydrophobicContact CG2-CG 4.28Å
195S66.3Low84.8Confident30 Ų3056.3 Ų56.321%0.2130%0.296CS..  trans-59.699.2168.2175.90000109.3S158 F197S158-S195 PolarHBondContact OG-OG 3.44Å; S195-F197 WeakPolarHBondContact O-CD1 2.95Å; S195-F197 PolarHBondContact O-N 3.19Å
196N85.4Confident85.1Confident19 Ų1952.9 Ų52.910%0.10229%0.286CS..  trans-85.145.3-173.2-68.2-28.9000110.9Y187 E191 T194 F198 V199Y187-N196 HydrophobicContact CE2-CB 4.17Å; Y187-N196 WeakPolarHBondContact CE2-O 3.34Å; Y187-N196 VanDerWaalsContact OH-C 3.24Å; Y187-N196 WeakPolarHBondContact OH-CB 3.49Å; Y187-N196 PolarHBondContact OH-O 2.82Å; Y187-N196 VanDerWaalsContact OH-O 3.1Å; E191-N196 PolarHBondContact O-ND2 3.16Å; T194-N196 PolarHBondContact O-N 3.13Å; T194-N196 PolarHBondContact O-ND2 2.8Å; T194-N196 PolarHBondContact O-OD1 3.1Å; T194-N196 VanDerWaalsContact O-OD1 3.07Å; T194-N196 PolarHBondContact OG1-OD1 3.49Å; N196-F198 PolarHBondContact O-N 3.49Å; N196-F198 VanDerWaalsContact O-N 3.15Å; N196-V199 HydrophobicContact CB-CG2 3.81Å; N196-V199 WeakPolarHBondContact O-CB 3.12Å; N196-V199 PolarHBondContact O-N 3.46Å
197F91.7Very high85.3Confident2 Ų250.1 Ų50.11%0.00927%0.272CS..THydrogen-bonded Turntrans-63.2-19.9-177.971.2-94.8000113A151 L154 C155 S195 P200 W234 L237 Y238 C241A151-F197 WeakPolarHBondContact CA-O 3.41Å; A151-F197 VanDerWaalsContact CB-O 3.24Å; A151-F197 WeakPolarHBondContact CB-O 3.04Å; L154-F197 HydrophobicContact CB-CB 3.91Å; C155-F197 HydrophobicContact CB-CB 3.99Å; C155-F197 HydrophobicContact CB-CD2 4.11Å; C155-F197 HydrophobicContact CB-CG 3.97Å; S195-F197 WeakPolarHBondContact O-CD1 2.95Å; S195-F197 PolarHBondContact O-N 3.19Å; F197-P200 WeakPolarHBondContact O-CD 3.47Å; F197-W234 AromaticContact CE2-CD1 3.99Å; F197-L237 HydrophobicContact CD2-CB 4.28Å; F197-L237 HydrophobicContact CD2-CD1 4.23Å; F197-L237 HydrophobicContact CE2-CB 3.82Å; F197-L237 HydrophobicContact CE2-CD1 4.48Å; F197-Y238 HydrophobicContact CZ-CD2 4.39Å; F197-C241 HydrophobicContact CE1-CB 4.46Å; F197-C241 VanDerWaalsContact CE1-SG 3.57Å
198F92.1Very high85.7Confident29 Ų2949 Ų4913%0.12727%0.267CS..THydrogen-bonded Turntrans-78.8-16.1179.363.1-92.8000113.4N196 L201 V202 L526 I530N196-F198 PolarHBondContact O-N 3.49Å; N196-F198 VanDerWaalsContact O-N 3.15Å; F198-L201 WeakPolarHBondContact O-CB 3.48Å; F198-L201 PolarHBondContact O-N 3.16Å; F198-V202 HydrophobicContact CD2-CG2 4.35Å; F198-V202 PolarHBondContact O-N 3.14Å; F198-V202 VanDerWaalsContact O-N 3.15Å; F198-L526 HydrophobicContact CD1-CD2 4.49Å; F198-L526 HydrophobicContact CE1-CD2 3.76Å; F198-I530 HydrophobicContact CD1-CD1 4.23Å; F198-I530 HydrophobicContact CE1-CD1 4.32Å; F198-I530 HydrophobicContact CE2-CG1 4.39Å; F198-I530 HydrophobicContact CG-CD1 4.49Å; F198-I530 HydrophobicContact CZ-CG1 4.39Å
199V94.3Very high86.1Confident15 Ų1546.8 Ų46.89%0.09125%0.251CS..Hα-helixtrans-59.6-46.8-175.7166.90000112.7Y187 L190 N196 L201 V202 W203Y187-V199 HydrophobicContact CD2-CB 4.36Å; Y187-V199 HydrophobicContact CD2-CG1 4.12Å; Y187-V199 HydrophobicContact CE2-CB 4.06Å; Y187-V199 HydrophobicContact CE2-CG1 4.33Å; L190-V199 HydrophobicContact CD1-CB 4.37Å; L190-V199 HydrophobicContact CD1-CG1 3.85Å; L190-V199 HydrophobicContact CD1-CG2 3.81Å; N196-V199 HydrophobicContact CB-CG2 3.81Å; N196-V199 WeakPolarHBondContact O-CB 3.12Å; N196-V199 PolarHBondContact O-N 3.46Å; V199-L201 PolarHBondContact O-N 3.15Å; V199-V202 WeakPolarHBondContact O-CB 3.12Å; V199-V202 PolarHBondContact O-N 2.95Å; V199-W203 HydrophobicContact CG1-CD2 4.13Å; V199-W203 VanDerWaalsContact CG1-CE2 3.43Å; V199-W203 HydrophobicContact CG1-CH2 4.12Å; V199-W203 HydrophobicContact CG1-CZ2 3.44Å; V199-W203 VanDerWaalsContact CG1-CZ2 3.44Å; V199-W203 PolarHBondContact O-N 3.33Å
200P96Very high86.5Confident0 Ų045.6 Ų45.60%024%0.24CC..Hα-helixtrans-59.7-30174.1-24.634.6000113.5Y147 L150 A151 L154 F197 W203 A204Y147-P200 WeakPolarHBondContact CB-O 3.27Å; Y147-P200 VanDerWaalsContact O-CB 3.27Å; Y147-P200 WeakPolarHBondContact O-CB 3.32Å; L150-P200 HydrophobicContact CB-CB 4.33Å; L150-P200 HydrophobicContact CB-CG 4.36Å; L150-P200 HydrophobicContact CD2-CB 4.16Å; L150-P200 HydrophobicContact CD2-CG 3.8Å; L150-P200 HydrophobicContact CG-CB 4.3Å; L150-P200 HydrophobicContact CG-CG 3.84Å; A151-P200 HydrophobicContact CB-CB 4.22Å; L154-P200 HydrophobicContact CD1-CG 3.83Å; F197-P200 WeakPolarHBondContact O-CD 3.47Å; P200-W203 HydrophobicContact CB-CE3 4.36Å; P200-W203 WeakPolarHBondContact O-CB 3.32Å; P200-W203 PolarHBondContact O-N 2.88Å; P200-A204 WeakPolarHBondContact O-CB 3.24Å; P200-A204 PolarHBondContact O-N 3.2Å
201L96.9Very high87Confident6 Ų642.6 Ų42.63%0.03122%0.224CC..Hα-helixtrans-69.5-35.8175.8-56.5179.5000111.5I148 A151 F198 V199 W203 A204 I205 V230 F233 W234 L237I148-L201 HydrophobicContact CG1-CD2 4.4Å; A151-L201 HydrophobicContact CB-CD1 4.12Å; A151-L201 HydrophobicContact CB-CD2 3.53Å; A151-L201 HydrophobicContact CB-CG 3.56Å; F198-L201 WeakPolarHBondContact O-CB 3.48Å; F198-L201 PolarHBondContact O-N 3.16Å; V199-L201 PolarHBondContact O-N 3.15Å; L201-W203 VanDerWaalsContact C-N 3.34Å; L201-A204 WeakPolarHBondContact O-CB 3.46Å; L201-A204 PolarHBondContact O-N 2.89Å; L201-I205 WeakPolarHBondContact O-CG1 3.49Å; L201-I205 PolarHBondContact O-N 3.39Å; L201-V230 HydrophobicContact CB-CG1 4.18Å; L201-V230 HydrophobicContact CD2-CG1 4.28Å; L201-F233 HydrophobicContact CD1-CD1 4.47Å; L201-F233 HydrophobicContact CD2-CD1 4.21Å; L201-F233 HydrophobicContact CD2-CE1 4.48Å; L201-W234 HydrophobicContact CD1-CB 3.55Å; L201-W234 HydrophobicContact CD1-CG 4.1Å; L201-L237 HydrophobicContact CD1-CD1 4.48Å
202V95.8Very high88.5Confident56 Ų5637.3 Ų37.334%0.33920%0.199SC..Hα-helixtrans-64.3-41.2171.8178.60000110.6F198 V199 A204 I205 S206F198-V202 HydrophobicContact CD2-CG2 4.35Å; F198-V202 PolarHBondContact O-N 3.14Å; F198-V202 VanDerWaalsContact O-N 3.15Å; V199-V202 WeakPolarHBondContact O-CB 3.12Å; V199-V202 PolarHBondContact O-N 2.95Å; V202-A204 VanDerWaalsContact C-N 3.34Å; V202-I205 PolarHBondContact O-N 3.44Å; V202-S206 WeakPolarHBondContact O-CB 3.25Å; V202-S206 PolarHBondContact O-N 3.01Å; V202-S206 PolarHBondContact O-OG 3.1Å
203W97.3Very high90Very high47 Ų4733.9 Ų33.918%0.17818%0.183CC..Hα-helixtrans-63.3-40.4173.9-59.4-18.5000111.8Y147 M179 E183 I186 Y187 V199 P200 L201 S206 L207Y147-W203 HydrophobicContact CD1-CE3 4.23Å; Y147-W203 HydrophobicContact CD2-CB 3.59Å; Y147-W203 AromaticContact CE1-CE3 3.88Å; Y147-W203 HydrophobicContact CE1-CE3 3.88Å; Y147-W203 HydrophobicContact CE1-CZ3 4.45Å; Y147-W203 HydrophobicContact CE2-CB 3.43Å; Y147-W203 VanDerWaalsContact CE2-CB 3.43Å; Y147-W203 HydrophobicContact CE2-CE3 4.34Å; Y147-W203 HydrophobicContact CE2-CG 4.41Å; Y147-W203 HydrophobicContact CG-CB 4.4Å; Y147-W203 AromaticContact CZ-CE3 3.94Å; M179-W203 HydrophobicContact CE-CH2 4.4Å; E183-W203 HydrophobicContact CB-CH2 4.14Å; E183-W203 HydrophobicContact CB-CZ3 3.95Å; E183-W203 HydrophobicContact CG-CH2 4.43Å; E183-W203 HydrophobicContact CG-CZ3 3.93Å; I186-W203 HydrophobicContact CB-CZ2 4.41Å; I186-W203 HydrophobicContact CG2-CZ2 3.85Å; Y187-W203 HydrophobicContact CD2-CH2 4.33Å; V199-W203 HydrophobicContact CG1-CD2 4.13Å; V199-W203 VanDerWaalsContact CG1-CE2 3.43Å; V199-W203 HydrophobicContact CG1-CH2 4.12Å; V199-W203 HydrophobicContact CG1-CZ2 3.44Å; V199-W203 VanDerWaalsContact CG1-CZ2 3.44Å; V199-W203 PolarHBondContact O-N 3.33Å; P200-W203 HydrophobicContact CB-CE3 4.36Å; P200-W203 WeakPolarHBondContact O-CB 3.32Å; P200-W203 PolarHBondContact O-N 2.88Å; L201-W203 VanDerWaalsContact C-N 3.34Å; W203-S206 PolarHBondContact O-N 3.38Å; W203-L207 WeakPolarHBondContact O-CG 3.48Å; W203-L207 PolarHBondContact O-N 2.96Å
204A97.6Very high91.6Very high0 Ų031.9 Ų31.90%016%0.164CC..Hα-helixtrans-61.1-48.1176.300000111.6I144 Y147 P200 L201 V202 S206 L207 I208I144-A204 HydrophobicContact CG2-CB 4.33Å; Y147-A204 HydrophobicContact CD2-CB 4.35Å; P200-A204 WeakPolarHBondContact O-CB 3.24Å; P200-A204 PolarHBondContact O-N 3.2Å; L201-A204 WeakPolarHBondContact O-CB 3.46Å; L201-A204 PolarHBondContact O-N 2.89Å; V202-A204 VanDerWaalsContact C-N 3.34Å; A204-S206 VanDerWaalsContact C-N 3.31Å; A204-S206 PolarHBondContact O-N 2.89Å; A204-L207 PolarHBondContact O-N 3Å; A204-I208 VanDerWaalsContact O-CG1 3.3Å; A204-I208 WeakPolarHBondContact O-CG1 3.44Å; A204-I208 PolarHBondContact O-N 3.44Å
205I97.6Very high93.1Very high9 Ų934.5 Ų34.55%0.04618%0.177CC..Hα-helixtrans-61.4-42.2176-65.2167.6000110.7L201 V202 L207 I208 T209 V227 V230 L537L201-I205 WeakPolarHBondContact O-CG1 3.49Å; L201-I205 PolarHBondContact O-N 3.39Å; V202-I205 PolarHBondContact O-N 3.44Å; I205-L207 VanDerWaalsContact C-N 3.31Å; I205-L207 PolarHBondContact O-N 2.91Å; I205-I208 WeakPolarHBondContact O-CB 3.45Å; I205-I208 PolarHBondContact O-N 3.35Å; I205-I208 VanDerWaalsContact O-N 3.16Å; I205-T209 PolarHBondContact O-N 3.32Å; I205-T209 PolarHBondContact O-OG1 3.13Å; I205-V227 HydrophobicContact CD1-CG1 4.41Å; I205-V227 HydrophobicContact CG2-CG1 4.47Å; I205-V227 HydrophobicContact CG2-CG2 4.01Å; I205-V230 HydrophobicContact CD1-CG1 4.06Å; I205-V230 HydrophobicContact CG1-CB 4.34Å; I205-V230 HydrophobicContact CG1-CG1 3.87Å; I205-L537 HydrophobicContact CB-CD2 4.47Å; I205-L537 HydrophobicContact CG2-CD2 3.62Å
206S97.4Very high94.2Very high56 Ų5633.4 Ų33.439%0.39217%0.169SC..Hα-helixtrans-61.8-38.8177.8-57.50000112.1V202 W203 A204 K210V202-S206 WeakPolarHBondContact O-CB 3.25Å; V202-S206 PolarHBondContact O-N 3.01Å; V202-S206 PolarHBondContact O-OG 3.1Å; W203-S206 PolarHBondContact O-N 3.38Å; A204-S206 VanDerWaalsContact C-N 3.31Å; A204-S206 PolarHBondContact O-N 2.89Å; S206-K210 WeakPolarHBondContact O-CB 3.35Å; S206-K210 PolarHBondContact O-N 3.35Å
207L96.5Very high94.5Very high33 Ų3332.5 Ų32.517%0.17316%0.164CC..Hα-helixtrans-68.5-37.7173.7-75.2-178.5000112.6F140 T143 I144 Y147 W203 A204 I205 K210 A211F140-L207 HydrophobicContact CD1-CB 4.41Å; F140-L207 HydrophobicContact CD1-CD2 4.48Å; F140-L207 HydrophobicContact CE1-CB 4.44Å; F140-L207 HydrophobicContact CE1-CD2 4.06Å; F140-L207 WeakPolarHBondContact CE1-O 3.37Å; T143-L207 HydrophobicContact CG2-CD1 3.48Å; T143-L207 VanDerWaalsContact CG2-CD1 3.48Å; I144-L207 HydrophobicContact CD1-CB 4.11Å; I144-L207 HydrophobicContact CG1-CB 3.78Å; I144-L207 HydrophobicContact CG1-CD1 4.06Å; Y147-L207 HydrophobicContact CD2-CD1 3.91Å; Y147-L207 HydrophobicContact CE2-CD1 3.41Å; Y147-L207 VanDerWaalsContact CE2-CD1 3.41Å; Y147-L207 HydrophobicContact CE2-CG 4.24Å; W203-L207 WeakPolarHBondContact O-CG 3.48Å; W203-L207 PolarHBondContact O-N 2.96Å; A204-L207 PolarHBondContact O-N 3Å; I205-L207 VanDerWaalsContact C-N 3.31Å; I205-L207 PolarHBondContact O-N 2.91Å; L207-K210 PolarHBondContact O-N 3.18Å; L207-A211 WeakPolarHBondContact O-CB 3.41Å; L207-A211 PolarHBondContact O-N 3.14Å
208I96.9Very high94.2Very high0 Ų041.2 Ų41.20%020%0.197CC..Hα-helixtrans-61.9-46.5174.6-67.3161000110I144 A204 I205 K210 A211 H212 I217 V223 L226 V227 V230I144-I208 HydrophobicContact CD1-CG1 3.86Å; I144-I208 HydrophobicContact CG1-CG1 4.49Å; I144-I208 HydrophobicContact CG2-CD1 4.45Å; I144-I208 HydrophobicContact CG2-CG1 4.46Å; A204-I208 VanDerWaalsContact O-CG1 3.3Å; A204-I208 WeakPolarHBondContact O-CG1 3.44Å; A204-I208 PolarHBondContact O-N 3.44Å; I205-I208 WeakPolarHBondContact O-CB 3.45Å; I205-I208 PolarHBondContact O-N 3.35Å; I205-I208 VanDerWaalsContact O-N 3.16Å; I208-K210 VanDerWaalsContact C-N 3.34Å; I208-K210 PolarHBondContact O-N 3Å; I208-A211 PolarHBondContact O-N 3.22Å; I208-H212 PolarHBondContact O-N 3.37Å; I208-H212 VanDerWaalsContact O-N 3.13Å; I208-I217 HydrophobicContact CG2-CD1 3.86Å; I208-V223 HydrophobicContact CG2-CG1 4.08Å; I208-L226 HydrophobicContact CD1-CB 4.12Å; I208-L226 HydrophobicContact CG2-CB 4.17Å; I208-L226 HydrophobicContact CG2-CD1 4.11Å; I208-V227 HydrophobicContact CG2-CG2 4.45Å; I208-V230 HydrophobicContact CD1-CG2 4.13Å
209T96Very high94.2Very high24 Ų2443.4 Ų43.415%0.14721%0.208CC..Hα-helixtrans-61.7-43.1176.4-52.70000111.4I205 A211 H212 E213I205-T209 PolarHBondContact O-N 3.32Å; I205-T209 PolarHBondContact O-OG1 3.13Å; T209-A211 PolarHBondContact O-N 2.89Å; T209-H212 WeakPolarHBondContact O-CB 3.37Å; T209-H212 PolarHBondContact O-N 2.73Å; T209-E213 WeakPolarHBondContact O-CG 3.27Å; T209-E213 PolarHBondContact O-N 3.44Å
210K95.7Very high94.2Very high101 Ų10147.2 Ų47.244%0.43922%0.224SC..Hα-helixtrans-62.8-40.3176.5-174.2176.9178.3-178.40112.5F140 S206 L207 I208 H212 E213 E214F140-K210 HydrophobicContact CE1-CB 4.38Å; F140-K210 HydrophobicContact CE1-CG 4.42Å; F140-K210 HydrophobicContact CZ-CD 4.27Å; F140-K210 HydrophobicContact CZ-CG 4.24Å; S206-K210 WeakPolarHBondContact O-CB 3.35Å; S206-K210 PolarHBondContact O-N 3.35Å; L207-K210 PolarHBondContact O-N 3.18Å; I208-K210 VanDerWaalsContact C-N 3.34Å; I208-K210 PolarHBondContact O-N 3Å; K210-H212 PolarHBondContact O-N 3.17Å; K210-E213 WeakPolarHBondContact O-CB 3.4Å; K210-E213 PolarHBondContact O-N 2.99Å; K210-E213 VanDerWaalsContact O-N 3.17Å; K210-E214 WeakPolarHBondContact CE-OE1 3.45Å; K210-E214 WeakPolarHBondContact O-CG 3.42Å; K210-E214 PolarHBondContact O-N 2.9Å
211A94.3Very high94.1Very high0 Ų054.9 Ų54.90%025%0.253CS..Hα-helixtrans-63.1-32.8176.100000112.3L118 F140 L207 I208 T209 N215 M216 I217L118-A211 HydrophobicContact CD1-CB 3.63Å; F140-A211 HydrophobicContact CD1-CB 3.85Å; F140-A211 HydrophobicContact CE1-CB 3.88Å; L207-A211 WeakPolarHBondContact O-CB 3.41Å; L207-A211 PolarHBondContact O-N 3.14Å; I208-A211 PolarHBondContact O-N 3.22Å; T209-A211 PolarHBondContact O-N 2.89Å; A211-N215 PolarHBondContact O-N 3.34Å; A211-M216 HydrophobicContact CB-CB 4.46Å; A211-M216 WeakPolarHBondContact O-CB 3.3Å; A211-M216 PolarHBondContact O-N 3.42Å; A211-I217 HydrophobicContact CB-CD1 3.92Å; A211-I217 HydrophobicContact CB-CG1 4.03Å; A211-I217 PolarHBondContact O-N 3.2Å
212H94.8Very high94Very high54 Ų5455.6 Ų55.625%0.2526%0.257CS..Hα-helixtrans-70.6-41.3171.9177.9-102.6000112.3I208 T209 K210 E214 N215 I217 V223I208-H212 PolarHBondContact O-N 3.37Å; I208-H212 VanDerWaalsContact O-N 3.13Å; T209-H212 WeakPolarHBondContact O-CB 3.37Å; T209-H212 PolarHBondContact O-N 2.73Å; K210-H212 PolarHBondContact O-N 3.17Å; H212-E214 PolarHBondContact O-N 3.08Å; H212-N215 WeakPolarHBondContact O-CA 3.49Å; H212-N215 PolarHBondContact O-N 3.34Å; H212-I217 HydrophobicContact CB-CB 4.24Å; H212-I217 PolarHBondContact CD2-O 3.15Å; H212-I217 VanDerWaalsContact CD2-O 3.29Å; H212-V223 HydrophobicContact CB-CG2 3.6Å
213E93Very high94.1Very high118 Ų11853.5 Ų53.555%0.55124%0.244SC*.Hα-helixtrans-60.3-34.5173.3-68.6173.6-179.300112.2T209 K210 N215T209-E213 WeakPolarHBondContact O-CG 3.27Å; T209-E213 PolarHBondContact O-N 3.44Å; K210-E213 WeakPolarHBondContact O-CB 3.4Å; K210-E213 PolarHBondContact O-N 2.99Å; K210-E213 VanDerWaalsContact O-N 3.17Å; E213-N215 PolarHBondContact O-N 3.2Å
214E90.3Very high94Very high44 Ų4455.7 Ų55.721%0.20626%0.259CS..THydrogen-bonded Turntrans-80.36174-65.7-174.6-16400113.4R136 K210 H212 M216R136-E214 IonicContact CZ-OE2 3.28Å; R136-E214 VanDerWaalsContact CZ-OE2 3.28Å; R136-E214 IonicContact NE-OE2 2.88Å; R136-E214 PolarHBondContact NE-OE2 3.15Å; R136-E214 VanDerWaalsContact NH2-CD 3.31Å; R136-E214 IonicContact NH2-OE1 3.01Å; R136-E214 PolarHBondContact NH2-OE1 3.01Å; R136-E214 IonicContact NH2-OE2 2.87Å; R136-E214 PolarHBondContact NH2-OE2 3.34Å; K210-E214 WeakPolarHBondContact CE-OE1 3.45Å; K210-E214 WeakPolarHBondContact O-CG 3.42Å; K210-E214 PolarHBondContact O-N 2.9Å; H212-E214 PolarHBondContact O-N 3.08Å; E214-M216 HydrophobicContact CB-CG 4.19Å; E214-M216 HydrophobicContact CB-SD 4.12Å; E214-M216 PolarHBondContact O-N 3.34Å
215N89.6Confident93.9Very high81 Ų8157.4 Ų57.443%0.43327%0.273SS..THydrogen-bonded Turntrans57.119.7-177.4-55.8-78.1000115.4P122 A211 H212 E213P122-N215 WeakPolarHBondContact CD-O 3.33Å; A211-N215 PolarHBondContact O-N 3.34Å; H212-N215 WeakPolarHBondContact O-CA 3.49Å; H212-N215 PolarHBondContact O-N 3.34Å; E213-N215 PolarHBondContact O-N 3.2Å
216M89.1Confident93.9Very high8 Ų857 Ų574%0.03927%0.271CS..SBendtrans-77.9-28.8174.1-60.6170.269.300111.6L118 G119 N121 R136 A137 F140 A211 E214L118-M216 HydrophobicContact CD2-CE 4.03Å; G119-M216 PolarHBondContact N-O 2.88Å; G119-M216 WeakPolarHBondContact O-CB 3.34Å; N121-M216 HydrophobicContact CB-CG 4.38Å; R136-M216 HydrophobicContact CG-CE 4.43Å; A137-M216 HydrophobicContact CB-CE 3.61Å; F140-M216 HydrophobicContact CB-CE 4.47Å; F140-M216 HydrophobicContact CD2-CE 3.89Å; F140-M216 HydrophobicContact CD2-SD 4.01Å; F140-M216 HydrophobicContact CE2-CE 4.46Å; F140-M216 HydrophobicContact CE2-SD 3.99Å; F140-M216 HydrophobicContact CG-CE 4.36Å; A211-M216 HydrophobicContact CB-CB 4.46Å; A211-M216 WeakPolarHBondContact O-CB 3.3Å; A211-M216 PolarHBondContact O-N 3.42Å; E214-M216 HydrophobicContact CB-CG 4.19Å; E214-M216 HydrophobicContact CB-SD 4.12Å; E214-M216 PolarHBondContact O-N 3.34Å
217I91.6Very high93.9Very high0 Ų055.6 Ų55.60%026%0.26CS..SBendtrans-102.3117.2165-55.2175.6000107.2L118 I208 A211 H212 H222 V223 L226L118-I217 HydrophobicContact CB-CG1 4.33Å; L118-I217 HydrophobicContact CD1-CD1 4.16Å; L118-I217 HydrophobicContact CD1-CG1 4.1Å; L118-I217 HydrophobicContact CG-CG1 4.22Å; I208-I217 HydrophobicContact CG2-CD1 3.86Å; A211-I217 HydrophobicContact CB-CD1 3.92Å; A211-I217 HydrophobicContact CB-CG1 4.03Å; A211-I217 PolarHBondContact O-N 3.2Å; H212-I217 HydrophobicContact CB-CB 4.24Å; H212-I217 PolarHBondContact CD2-O 3.15Å; H212-I217 VanDerWaalsContact CD2-O 3.29Å; I217-H222 HydrophobicContact CG2-CB 3.74Å; I217-V223 HydrophobicContact CB-CG2 4.45Å; I217-V223 HydrophobicContact CD1-CG2 4.41Å; I217-V223 HydrophobicContact CG2-CG2 3.85Å; I217-L226 HydrophobicContact CD1-CD1 4Å
218R86.4Confident93.9Very high184 Ų18455.8 Ų55.869%0.69427%0.27SS*.  trans-75.1-38.2-169.3-72.3178.6158.4-172.1-5.5115.3
219E91.7Very high93.9Very high76 Ų7658.2 Ų58.236%0.35528%0.282SS..  trans-122.5137.9-168.7-58.5179.3-150.400110.4R221 H222E219-R221 HydrophobicContact CB-CG 4Å; E219-R221 PolarHBondContact O-N 3.38Å; E219-R221 IonicContact OE1-CZ 3.35Å; E219-R221 IonicContact OE1-NH2 2.68Å; E219-R221 PolarHBondContact OE1-NH2 3.36Å; E219-R221 WeakPolarHBondContact OE2-CD 3.45Å; E219-R221 WeakPolarHBondContact OE2-CG 3.39Å; E219-R221 IonicContact OE2-CZ 3.2Å; E219-R221 IonicContact OE2-NE 2.73Å; E219-R221 PolarHBondContact OE2-NE 2.71Å; E219-R221 IonicContact OE2-NH1 3.85Å; E219-R221 IonicContact OE2-NH2 2.65Å; E219-R221 PolarHBondContact OE2-NH2 3.42Å; E219-R221 VanDerWaalsContact OE2-NH2 3.1Å; E219-H222 WeakPolarHBondContact O-CB 3.42Å; E219-H222 PolarHBondContact O-N 2.83Å; E219-H222 IonicContact OE1-CE1 3.67Å; E219-H222 IonicContact OE2-CE1 3.33Å; E219-H222 IonicContact OE2-NE2 2.66Å
220E93.3Very high94Very high94 Ų9457.1 Ų57.144%0.43928%0.275SS..Hα-helixtrans-58.4-34.1177.3-170.1171.4-171.600111.5H222 V223 D224E220-H222 PolarHBondContact O-N 3Å; E220-V223 WeakPolarHBondContact O-CA 3.19Å; E220-V223 VanDerWaalsContact O-CB 3.31Å; E220-V223 WeakPolarHBondContact O-CB 3.39Å; E220-V223 PolarHBondContact O-N 2.64Å; E220-D224 PolarHBondContact O-N 3.34Å
221R94.9Very high94.1Very high161 Ų16154.4 Ų54.461%0.60827%0.267SS*.Hα-helixtrans-59-31.2175.480.5177-168.4-157.3-17.9113.3E219 A225E219-R221 HydrophobicContact CB-CG 4Å; E219-R221 PolarHBondContact O-N 3.38Å; E219-R221 IonicContact OE1-CZ 3.35Å; E219-R221 IonicContact OE1-NH2 2.68Å; E219-R221 PolarHBondContact OE1-NH2 3.36Å; E219-R221 WeakPolarHBondContact OE2-CD 3.45Å; E219-R221 WeakPolarHBondContact OE2-CG 3.39Å; E219-R221 IonicContact OE2-CZ 3.2Å; E219-R221 IonicContact OE2-NE 2.73Å; E219-R221 PolarHBondContact OE2-NE 2.71Å; E219-R221 IonicContact OE2-NH1 3.85Å; E219-R221 IonicContact OE2-NH2 2.65Å; E219-R221 PolarHBondContact OE2-NH2 3.42Å; E219-R221 VanDerWaalsContact OE2-NH2 3.1Å; R221-A225 WeakPolarHBondContact O-CB 3.36Å; R221-A225 PolarHBondContact O-N 2.85Å
222H95.1Very high94.1Very high22 Ų2257.8 Ų57.810%0.10228%0.282CS..Hα-helixtrans-75.1-33.7179-61154.4000110.8Y117 I217 E219 E220 L226Y117-H222 HydrophobicContact CD1-CB 4.24Å; Y117-H222 AromaticContact CD1-CD2 3.73Å; Y117-H222 AromaticContact CD1-CG 3.73Å; Y117-H222 AromaticContact CD1-ND1 4Å; Y117-H222 HydrophobicContact CD2-CB 3.68Å; Y117-H222 AromaticContact CE1-CD2 3.58Å; Y117-H222 AromaticContact CE1-NE2 3.89Å; Y117-H222 HydrophobicContact CE2-CB 4.2Å; Y117-H222 HydrophobicContact CG-CB 3.69Å; Y117-H222 AromaticContact CG-CG 3.72Å; Y117-H222 AromaticContact CZ-CD2 3.78Å; I217-H222 HydrophobicContact CG2-CB 3.74Å; E219-H222 WeakPolarHBondContact O-CB 3.42Å; E219-H222 PolarHBondContact O-N 2.83Å; E219-H222 IonicContact OE1-CE1 3.67Å; E219-H222 IonicContact OE2-CE1 3.33Å; E219-H222 IonicContact OE2-NE2 2.66Å; E220-H222 PolarHBondContact O-N 3Å; H222-L226 WeakPolarHBondContact O-CB 3.48Å; H222-L226 WeakPolarHBondContact O-CG 3.44Å; H222-L226 PolarHBondContact O-N 3.48Å
223V96.5Very high94.2Very high11 Ų1155.5 Ų55.57%0.06727%0.272CS..Hα-helixtrans-62.6-49.6171.41790000109.6I208 H212 I217 E220 A225 L226 V227I208-V223 HydrophobicContact CG2-CG1 4.08Å; H212-V223 HydrophobicContact CB-CG2 3.6Å; I217-V223 HydrophobicContact CB-CG2 4.45Å; I217-V223 HydrophobicContact CD1-CG2 4.41Å; I217-V223 HydrophobicContact CG2-CG2 3.85Å; E220-V223 WeakPolarHBondContact O-CA 3.19Å; E220-V223 VanDerWaalsContact O-CB 3.31Å; E220-V223 WeakPolarHBondContact O-CB 3.39Å; E220-V223 PolarHBondContact O-N 2.64Å; V223-A225 VanDerWaalsContact C-N 3.33Å; V223-A225 PolarHBondContact O-N 2.79Å; V223-L226 PolarHBondContact O-N 2.88Å; V223-V227 HydrophobicContact CG1-CG2 4.21Å; V223-V227 WeakPolarHBondContact O-CB 3.35Å; V223-V227 VanDerWaalsContact O-CG2 3.31Å; V223-V227 WeakPolarHBondContact O-CG2 3.47Å; V223-V227 PolarHBondContact O-N 3.17Å
224D95.9Very high94.4Very high94 Ų9452.1 Ų52.150%0.50325%0.254SS..Hα-helixtrans-59.8-42.2178.5-75-19.5000112.3E220 G228E220-D224 PolarHBondContact O-N 3.34Å; D224-G228 PolarHBondContact O-N 3.02Å
225A96.4Very high94.6Very high36 Ų3654 Ų5430%0.29826%0.263SS..Hα-helixtrans-62.4-43.8176.500000112.4Y117 R221 V223 Q229Y117-A225 HydrophobicContact CE2-CB 4.04Å; R221-A225 WeakPolarHBondContact O-CB 3.36Å; R221-A225 PolarHBondContact O-N 2.85Å; V223-A225 VanDerWaalsContact C-N 3.33Å; V223-A225 PolarHBondContact O-N 2.79Å; A225-Q229 PolarHBondContact O-N 3.15Å; A225-Q229 VanDerWaalsContact O-N 3.17Å
226L97Very high94.9Very high0 Ų053.2 Ų53.20%026%0.256CS..Hα-helixtrans-65.9-48.1177.2-77.9166.8000111.8I110 L113 L114 Y117 I208 I217 H222 V223 G228 Q229 V230I110-L226 HydrophobicContact CG2-CD2 4.49Å; L113-L226 HydrophobicContact CB-CD2 3.67Å; L113-L226 HydrophobicContact CB-CG 4.45Å; L114-L226 HydrophobicContact CB-CD2 4.19Å; L114-L226 HydrophobicContact CD1-CD1 4.4Å; L114-L226 HydrophobicContact CD1-CD2 4.38Å; Y117-L226 HydrophobicContact CD2-CD1 4.33Å; Y117-L226 HydrophobicContact CD2-CG 4.14Å; I208-L226 HydrophobicContact CD1-CB 4.12Å; I208-L226 HydrophobicContact CG2-CB 4.17Å; I208-L226 HydrophobicContact CG2-CD1 4.11Å; I217-L226 HydrophobicContact CD1-CD1 4Å; H222-L226 WeakPolarHBondContact O-CB 3.48Å; H222-L226 WeakPolarHBondContact O-CG 3.44Å; H222-L226 PolarHBondContact O-N 3.48Å; V223-L226 PolarHBondContact O-N 2.88Å; L226-G228 VanDerWaalsContact C-N 3.3Å; L226-G228 PolarHBondContact O-N 3.45Å; L226-Q229 PolarHBondContact O-N 3.28Å; L226-V230 WeakPolarHBondContact O-CG2 3.4Å; L226-V230 PolarHBondContact O-N 3.39Å
227V97.1Very high95.2Very high26 Ų2652.9 Ų52.916%0.15825%0.254CS..Hα-helixtrans-61.5-42178.9173.40000110.4I205 I208 V223 Q229 V230 V231I205-V227 HydrophobicContact CD1-CG1 4.41Å; I205-V227 HydrophobicContact CG2-CG1 4.47Å; I205-V227 HydrophobicContact CG2-CG2 4.01Å; I208-V227 HydrophobicContact CG2-CG2 4.45Å; V223-V227 HydrophobicContact CG1-CG2 4.21Å; V223-V227 WeakPolarHBondContact O-CB 3.35Å; V223-V227 VanDerWaalsContact O-CG2 3.31Å; V223-V227 WeakPolarHBondContact O-CG2 3.47Å; V223-V227 PolarHBondContact O-N 3.17Å; V227-Q229 VanDerWaalsContact C-N 3.34Å; V227-Q229 PolarHBondContact O-N 3.33Å; V227-V230 PolarHBondContact O-N 3.37Å; V227-V231 HydrophobicContact CG1-CG2 4.34Å; V227-V231 WeakPolarHBondContact O-CG2 3.49Å; V227-V231 PolarHBondContact O-N 3.28Å
228G97Very high95.4Very high38 Ų3855 Ų5539%0.39226%0.262SS..Hα-helixtrans-57.1-44.6175.400000112.7D224 L226 V231 E232D224-G228 PolarHBondContact O-N 3.02Å; L226-G228 VanDerWaalsContact C-N 3.3Å; L226-G228 PolarHBondContact O-N 3.45Å; G228-V231 PolarHBondContact O-N 2.96Å; G228-E232 PolarHBondContact O-N 3.32Å
229Q97Very high95.8Very high51 Ų5151 Ų5124%0.23825%0.25CS..Hα-helixtrans-68.9-35.3177.3-73.1-62-60.400113.2A109 I110 L113 A225 L226 V227 E232 F233A109-Q229 VanDerWaalsContact CB-OE1 3.26Å; I110-Q229 HydrophobicContact CG1-CB 3.7Å; L113-Q229 HydrophobicContact CD1-CG 3.69Å; A225-Q229 PolarHBondContact O-N 3.15Å; A225-Q229 VanDerWaalsContact O-N 3.17Å; L226-Q229 PolarHBondContact O-N 3.28Å; V227-Q229 VanDerWaalsContact C-N 3.34Å; V227-Q229 PolarHBondContact O-N 3.33Å; Q229-E232 PolarHBondContact NE2-OE2 3.14Å; Q229-E232 PolarHBondContact O-N 3.35Å; Q229-F233 WeakPolarHBondContact O-CB 3.09Å; Q229-F233 PolarHBondContact O-N 3.06Å
230V97.6Very high95.9Very high1 Ų147.4 Ų47.41%0.00623%0.233CC..Hα-helixtrans-65.6-40173.6175.10000111.2I110 L201 I205 I208 L226 V227 F233 W234I110-V230 HydrophobicContact CD1-CG2 4.11Å; I110-V230 HydrophobicContact CG1-CG2 4.39Å; I110-V230 HydrophobicContact CG2-CG2 3.99Å; L201-V230 HydrophobicContact CB-CG1 4.18Å; L201-V230 HydrophobicContact CD2-CG1 4.28Å; I205-V230 HydrophobicContact CD1-CG1 4.06Å; I205-V230 HydrophobicContact CG1-CB 4.34Å; I205-V230 HydrophobicContact CG1-CG1 3.87Å; I208-V230 HydrophobicContact CD1-CG2 4.13Å; L226-V230 WeakPolarHBondContact O-CG2 3.4Å; L226-V230 PolarHBondContact O-N 3.39Å; V227-V230 PolarHBondContact O-N 3.37Å; V230-F233 WeakPolarHBondContact O-CB 3.44Å; V230-F233 PolarHBondContact O-N 2.99Å; V230-W234 PolarHBondContact O-N 3.21Å
231V96.9Very high95.9Very high43 Ų4343.4 Ų43.426%0.26122%0.215SC..Hα-helixtrans-66.1-43175.8173.10000111V227 G228 F233 W234 E235V227-V231 HydrophobicContact CG1-CG2 4.34Å; V227-V231 WeakPolarHBondContact O-CG2 3.49Å; V227-V231 PolarHBondContact O-N 3.28Å; G228-V231 PolarHBondContact O-N 2.96Å; V231-F233 VanDerWaalsContact C-N 3.28Å; V231-F233 PolarHBondContact O-N 2.98Å; V231-W234 WeakPolarHBondContact O-CB 3.05Å; V231-W234 PolarHBondContact O-N 2.76Å; V231-W234 VanDerWaalsContact O-N 3.15Å; V231-E235 WeakPolarHBondContact O-CG 3.41Å; V231-E235 PolarHBondContact O-N 2.69Å
232E96.1Very high95.8Very high71 Ų7137.6 Ų37.633%0.33220%0.195SC..Hα-helixtrans-60.1-39.4175.1-167.1-167.3145.700111.8G228 Q229 E235 K236G228-E232 PolarHBondContact O-N 3.32Å; Q229-E232 PolarHBondContact NE2-OE2 3.14Å; Q229-E232 PolarHBondContact O-N 3.35Å; E232-E235 PolarHBondContact O-N 3Å; E232-K236 WeakPolarHBondContact O-CG 3.5Å; E232-K236 PolarHBondContact O-N 2.76Å; E232-K236 VanDerWaalsContact O-N 3.13Å; E232-K236 WeakPolarHBondContact OE1-CE 3.37Å; E232-K236 IonicContact OE1-NZ 3.65Å; E232-K236 PolarHBondContact OE1-NZ 2.7Å
233F96.7Very high95.7Very high6 Ų638.7 Ų38.73%0.02620%0.199CC..Hα-helixtrans-64.5-42.6174.8-173.5-84.4000111.9P105 P107 I110 I148 L201 Q229 V230 V231 K236 L237P105-F233 HydrophobicContact CB-CD2 3.72Å; P105-F233 HydrophobicContact CB-CE2 3.55Å; P105-F233 HydrophobicContact CB-CG 4.29Å; P105-F233 HydrophobicContact CB-CZ 3.99Å; P105-F233 HydrophobicContact CG-CE2 4.11Å; P105-F233 HydrophobicContact CG-CZ 4.04Å; P107-F233 HydrophobicContact CB-CE2 4.39Å; I110-F233 HydrophobicContact CD1-CB 3.74Å; I110-F233 HydrophobicContact CD1-CD2 4.03Å; I110-F233 HydrophobicContact CD1-CG 3.98Å; I148-F233 HydrophobicContact CG2-CD1 3.98Å; I148-F233 HydrophobicContact CG2-CD2 4.11Å; I148-F233 HydrophobicContact CG2-CE1 3.61Å; I148-F233 HydrophobicContact CG2-CE2 3.75Å; I148-F233 HydrophobicContact CG2-CG 4.23Å; I148-F233 HydrophobicContact CG2-CZ 3.51Å; L201-F233 HydrophobicContact CD1-CD1 4.47Å; L201-F233 HydrophobicContact CD2-CD1 4.21Å; L201-F233 HydrophobicContact CD2-CE1 4.48Å; Q229-F233 WeakPolarHBondContact O-CB 3.09Å; Q229-F233 PolarHBondContact O-N 3.06Å; V230-F233 WeakPolarHBondContact O-CB 3.44Å; V230-F233 PolarHBondContact O-N 2.99Å; V231-F233 VanDerWaalsContact C-N 3.28Å; V231-F233 PolarHBondContact O-N 2.98Å; F233-K236 PolarHBondContact O-N 3.17Å; F233-L237 HydrophobicContact CD1-CD1 3.92Å; F233-L237 HydrophobicContact CD1-CG 4.37Å; F233-L237 HydrophobicContact CE1-CD1 3.54Å; F233-L237 HydrophobicContact CE1-CG 4.12Å; F233-L237 HydrophobicContact CZ-CD1 4.5Å; F233-L237 PolarHBondContact O-N 3.07Å; F233-L237 VanDerWaalsContact O-N 3.14Å
234W95.6Very high95.5Very high47 Ų4741.3 Ų41.318%0.17821%0.212CC..Hα-helixtrans-59.5-46.5172.9171.373.1000111.7F197 L201 V230 V231 K236 L237 Y238 I530F197-W234 AromaticContact CE2-CD1 3.99Å; L201-W234 HydrophobicContact CD1-CB 3.55Å; L201-W234 HydrophobicContact CD1-CG 4.1Å; V230-W234 PolarHBondContact O-N 3.21Å; V231-W234 WeakPolarHBondContact O-CB 3.05Å; V231-W234 PolarHBondContact O-N 2.76Å; V231-W234 VanDerWaalsContact O-N 3.15Å; W234-K236 VanDerWaalsContact C-N 3.27Å; W234-K236 PolarHBondContact O-N 3.28Å; W234-L237 PolarHBondContact O-N 2.53Å; W234-L237 VanDerWaalsContact O-N 3.16Å; W234-Y238 HydrophobicContact CZ2-CD2 4.17Å; W234-Y238 HydrophobicContact CZ2-CG 4.19Å; W234-Y238 WeakPolarHBondContact O-CB 3.39Å; W234-Y238 PolarHBondContact O-N 3.17Å; W234-I530 HydrophobicContact CH2-CG2 4.43Å; W234-I530 HydrophobicContact CZ2-CD1 4.09Å; W234-I530 HydrophobicContact CZ2-CG2 4.16Å
235E95.7Very high95.2Very high84 Ų8441.2 Ų41.239%0.39321%0.205SC..Hα-helixtrans-59.6-38.9-179.7-73.6-176.8-177.900112.1V231 E232 Y238 K239V231-E235 WeakPolarHBondContact O-CG 3.41Å; V231-E235 PolarHBondContact O-N 2.69Å; E232-E235 PolarHBondContact O-N 3Å; E235-Y238 PolarHBondContact O-N 2.79Å; E235-K239 WeakPolarHBondContact O-CB 3.48Å; E235-K239 VanDerWaalsContact O-CG 3.27Å; E235-K239 WeakPolarHBondContact O-CG 3.39Å; E235-K239 PolarHBondContact O-N 3.43Å
236K96.3Very high95.1Very high65 Ų6543.2 Ų43.228%0.28321%0.214SC..Hα-helixtrans-62.5-48.8174.7-76.8174.3-171.9162.80111.4C103 P105 E232 F233 W234 Y238 K239 L240C103-K236 WeakPolarHBondContact O-CB 3.21Å; P105-K236 HydrophobicContact CB-CB 4Å; P105-K236 HydrophobicContact CB-CD 4.3Å; E232-K236 WeakPolarHBondContact O-CG 3.5Å; E232-K236 PolarHBondContact O-N 2.76Å; E232-K236 VanDerWaalsContact O-N 3.13Å; E232-K236 WeakPolarHBondContact OE1-CE 3.37Å; E232-K236 IonicContact OE1-NZ 3.65Å; E232-K236 PolarHBondContact OE1-NZ 2.7Å; F233-K236 PolarHBondContact O-N 3.17Å; W234-K236 VanDerWaalsContact C-N 3.27Å; W234-K236 PolarHBondContact O-N 3.28Å; K236-Y238 PolarHBondContact O-N 3.24Å; K236-K239 PolarHBondContact O-N 2.94Å; K236-L240 WeakPolarHBondContact O-CG 3.18Å; K236-L240 PolarHBondContact O-N 3.47Å
237L95.7Very high94.7Very high0 Ų047.4 Ų47.40%024%0.236CC..Hα-helixtrans-60.9-44175-71.8177.8000112.2P105 A151 C155 F197 L201 F233 W234 K239 L240 C241P105-L237 HydrophobicContact CG-CD2 3.43Å; P105-L237 VanDerWaalsContact CG-CD2 3.43Å; P105-L237 HydrophobicContact CG-CG 3.86Å; A151-L237 HydrophobicContact CB-CD1 4.27Å; C155-L237 HydrophobicContact CB-CD1 4.45Å; C155-L237 HydrophobicContact CB-CD2 3.88Å; F197-L237 HydrophobicContact CD2-CB 4.28Å; F197-L237 HydrophobicContact CD2-CD1 4.23Å; F197-L237 HydrophobicContact CE2-CB 3.82Å; F197-L237 HydrophobicContact CE2-CD1 4.48Å; L201-L237 HydrophobicContact CD1-CD1 4.48Å; F233-L237 HydrophobicContact CD1-CD1 3.92Å; F233-L237 HydrophobicContact CD1-CG 4.37Å; F233-L237 HydrophobicContact CE1-CD1 3.54Å; F233-L237 HydrophobicContact CE1-CG 4.12Å; F233-L237 HydrophobicContact CZ-CD1 4.5Å; F233-L237 PolarHBondContact O-N 3.07Å; F233-L237 VanDerWaalsContact O-N 3.14Å; W234-L237 PolarHBondContact O-N 2.53Å; W234-L237 VanDerWaalsContact O-N 3.16Å; L237-K239 PolarHBondContact O-N 3.22Å; L237-L240 WeakPolarHBondContact O-CB 3.31Å; L237-L240 PolarHBondContact O-N 3.44Å; L237-C241 PolarHBondContact O-N 3.32Å; L237-C241 VanDerWaalsContact O-N 3.1Å; L237-C241 PolarHBondContact O-SG 2.89Å
238Y94.4Very high94.5Very high45 Ų4546.4 Ų46.418%0.17623%0.23CC..Hα-helixtrans-63-42.7179.3-179.1-99.9000111.6F197 W234 E235 K236 L240 C241 M242F197-Y238 HydrophobicContact CZ-CD2 4.39Å; W234-Y238 HydrophobicContact CZ2-CD2 4.17Å; W234-Y238 HydrophobicContact CZ2-CG 4.19Å; W234-Y238 WeakPolarHBondContact O-CB 3.39Å; W234-Y238 PolarHBondContact O-N 3.17Å; E235-Y238 PolarHBondContact O-N 2.79Å; K236-Y238 PolarHBondContact O-N 3.24Å; Y238-L240 VanDerWaalsContact C-N 3.27Å; Y238-L240 PolarHBondContact O-N 3.32Å; Y238-C241 WeakPolarHBondContact O-CB 3.45Å; Y238-C241 PolarHBondContact O-N 3.47Å; Y238-C241 VanDerWaalsContact O-N 3.13Å; Y238-M242 HydrophobicContact CD1-CG 3.86Å; Y238-M242 HydrophobicContact CD2-CE 4.3Å; Y238-M242 HydrophobicContact CE1-CE 4.22Å; Y238-M242 HydrophobicContact CE1-CG 3.45Å; Y238-M242 VanDerWaalsContact CE1-CG 3.45Å; Y238-M242 HydrophobicContact CE1-SD 3.81Å; Y238-M242 HydrophobicContact CE2-CE 3.58Å; Y238-M242 HydrophobicContact CE2-CG 4.43Å; Y238-M242 HydrophobicContact CE2-SD 4.23Å; Y238-M242 HydrophobicContact CG-CG 4.5Å; Y238-M242 VanDerWaalsContact CZ-SD 3.54Å; Y238-M242 WeakPolarHBondContact O-CG 3.45Å; Y238-M242 PolarHBondContact O-N 3.03Å; Y238-M242 PolarHBondContact OH-SD 3.4Å; Y238-M242 VanDerWaalsContact OH-SD 3.33Å
239K94.3Very high94.3Very high101 Ų10148.5 Ų48.544%0.43924%0.236SC..Hα-helixtrans-56.6-41.7174-78.9170.7-176.1166.20111.6C103 E235 K236 L237 M242 Y243C103-K239 HydrophobicContact CB-CB 4.47Å; E235-K239 WeakPolarHBondContact O-CB 3.48Å; E235-K239 VanDerWaalsContact O-CG 3.27Å; E235-K239 WeakPolarHBondContact O-CG 3.39Å; E235-K239 PolarHBondContact O-N 3.43Å; K236-K239 PolarHBondContact O-N 2.94Å; L237-K239 PolarHBondContact O-N 3.22Å; K239-M242 WeakPolarHBondContact O-CB 3.45Å; K239-M242 PolarHBondContact O-N 2.82Å; K239-Y243 WeakPolarHBondContact O-CD2 3.04Å; K239-Y243 PolarHBondContact O-N 3.35Å
240L95Very high94.1Very high0 Ų051.8 Ų51.80%026%0.255CS..Hα-helixtrans-61-46.4175.1-64.6177.5000111.9Q100 C103 L104 F156 I159 K236 L237 Y238 M242 Y243 D244 F353Q100-L240 HydrophobicContact CB-CD2 4.2Å; Q100-L240 WeakPolarHBondContact O-CD2 3.16Å; C103-L240 HydrophobicContact CB-CD2 3.7Å; C103-L240 HydrophobicContact CB-CG 4.02Å; L104-L240 HydrophobicContact CD2-CD1 4.13Å; F156-L240 HydrophobicContact CE1-CD1 4.06Å; I159-L240 HydrophobicContact CD1-CB 3.98Å; I159-L240 HydrophobicContact CD1-CD1 4.43Å; K236-L240 WeakPolarHBondContact O-CG 3.18Å; K236-L240 PolarHBondContact O-N 3.47Å; L237-L240 WeakPolarHBondContact O-CB 3.31Å; L237-L240 PolarHBondContact O-N 3.44Å; Y238-L240 VanDerWaalsContact C-N 3.27Å; Y238-L240 PolarHBondContact O-N 3.32Å; L240-M242 VanDerWaalsContact C-N 3.26Å; L240-M242 PolarHBondContact O-N 3Å; L240-Y243 PolarHBondContact O-N 3.21Å; L240-Y243 VanDerWaalsContact O-N 3.15Å; L240-D244 PolarHBondContact O-N 3.22Å; L240-D244 VanDerWaalsContact O-N 3.08Å; L240-F353 HydrophobicContact CD1-CZ 4.27Å; L240-F353 HydrophobicContact CD2-CE2 4.24Å; L240-F353 HydrophobicContact CD2-CZ 3.9Å
241C92.9Very high94Very high9 Ų956.1 Ų56.16%0.06128%0.281CS..Hα-helixtrans-60.1-35.9174.4-64.50000112.5C155 F197 L237 Y238 D244 W245C155-C241 PolarHBondContact SG-SG 3.28Å; F197-C241 HydrophobicContact CE1-CB 4.46Å; F197-C241 VanDerWaalsContact CE1-SG 3.57Å; L237-C241 PolarHBondContact O-N 3.32Å; L237-C241 VanDerWaalsContact O-N 3.1Å; L237-C241 PolarHBondContact O-SG 2.89Å; Y238-C241 WeakPolarHBondContact O-CB 3.45Å; Y238-C241 PolarHBondContact O-N 3.47Å; Y238-C241 VanDerWaalsContact O-N 3.13Å; C241-D244 PolarHBondContact O-N 3.39Å; C241-W245 WeakPolarHBondContact O-CB 3.48Å; C241-W245 PolarHBondContact O-N 3.42Å
242M92.8Very high93.8Very high39 Ų3957.6 Ų57.619%0.19228%0.283CS..Hα-helixtrans-68.7-35.7176.3-68-62.2100.200112.5Y238 K239 L240 W245 V246Y238-M242 HydrophobicContact CD1-CG 3.86Å; Y238-M242 HydrophobicContact CD2-CE 4.3Å; Y238-M242 HydrophobicContact CE1-CE 4.22Å; Y238-M242 HydrophobicContact CE1-CG 3.45Å; Y238-M242 VanDerWaalsContact CE1-CG 3.45Å; Y238-M242 HydrophobicContact CE1-SD 3.81Å; Y238-M242 HydrophobicContact CE2-CE 3.58Å; Y238-M242 HydrophobicContact CE2-CG 4.43Å; Y238-M242 HydrophobicContact CE2-SD 4.23Å; Y238-M242 HydrophobicContact CG-CG 4.5Å; Y238-M242 VanDerWaalsContact CZ-SD 3.54Å; Y238-M242 WeakPolarHBondContact O-CG 3.45Å; Y238-M242 PolarHBondContact O-N 3.03Å; Y238-M242 PolarHBondContact OH-SD 3.4Å; Y238-M242 VanDerWaalsContact OH-SD 3.33Å; K239-M242 WeakPolarHBondContact O-CB 3.45Å; K239-M242 PolarHBondContact O-N 2.82Å; L240-M242 VanDerWaalsContact C-N 3.26Å; L240-M242 PolarHBondContact O-N 3Å; M242-W245 HydrophobicContact CE-CE3 3.97Å; M242-W245 HydrophobicContact SD-CE3 3.84Å; M242-W245 HydrophobicContact SD-CZ3 4.22Å; M242-V246 WeakPolarHBondContact O-CB 3.27Å; M242-V246 PolarHBondContact O-N 3.48Å
243Y93.7Very high93.7Very high46 Ų4656.2 Ų56.218%0.1828%0.278CS..Hα-helixtrans-68.4-37.5174.8-79.4-69000112.5R96 Q99 Q100 K239 L240 V246R96-Y243 HydrophobicContact CG-CE1 4.45Å; R96-Y243 PolarHBondContact NH2-O 3.49Å; Q99-Y243 HydrophobicContact CB-CE2 4.36Å; Q99-Y243 VanDerWaalsContact CB-OH 3.31Å; Q99-Y243 WeakPolarHBondContact CB-OH 3.3Å; Q99-Y243 PolarHBondContact OE1-OH 3.37Å; Q100-Y243 HydrophobicContact CG-CD1 4.09Å; Q100-Y243 HydrophobicContact CG-CD2 3.57Å; Q100-Y243 HydrophobicContact CG-CE2 4.2Å; Q100-Y243 HydrophobicContact CG-CG 3.52Å; K239-Y243 WeakPolarHBondContact O-CD2 3.04Å; K239-Y243 PolarHBondContact O-N 3.35Å; L240-Y243 PolarHBondContact O-N 3.21Å; L240-Y243 VanDerWaalsContact O-N 3.15Å; Y243-V246 CarbonylContact O-C 3.38Å
244D91.8Very high93.7Very high65 Ų6561.1 Ų61.135%0.34830%0.301SS..Hα-helixtrans-67.3-42.3174.9-179.268000111.8I159 L240 C241 N247I159-D244 HydrophobicContact CB-CB 4.35Å; I159-D244 HydrophobicContact CG2-CB 3.86Å; L240-D244 PolarHBondContact O-N 3.22Å; L240-D244 VanDerWaalsContact O-N 3.08Å; C241-D244 PolarHBondContact O-N 3.39Å; D244-N247 PolarHBondContact O-ND2 3.2Å
245W90.1Very high93.6Very high93 Ų9362.7 Ų62.735%0.35232%0.315SS..Hα-helixtrans-70.6-47.2177.9-179.844.8000112.3C241 M242 N247 L521 P523C241-W245 WeakPolarHBondContact O-CB 3.48Å; C241-W245 PolarHBondContact O-N 3.42Å; M242-W245 HydrophobicContact CE-CE3 3.97Å; M242-W245 HydrophobicContact SD-CE3 3.84Å; M242-W245 HydrophobicContact SD-CZ3 4.22Å; W245-N247 PolarHBondContact O-N 3.32Å; W245-L521 WeakPolarHBondContact CZ2-O 3.36Å; W245-L521 PolarHBondContact NE1-O 3.17Å; W245-L521 VanDerWaalsContact NE1-O 3.11Å; W245-P523 HydrophobicContact CH2-CB 3.77Å; W245-P523 HydrophobicContact CH2-CG 3.45Å; W245-P523 VanDerWaalsContact CH2-CG 3.45Å; W245-P523 HydrophobicContact CZ2-CG 4.22Å; W245-P523 HydrophobicContact CZ3-CB 3.85Å; W245-P523 HydrophobicContact CZ3-CG 4.07Å
246V92.6Very high93.6Very high78 Ų7858.7 Ų58.747%0.47330%0.296SS..SBendtrans-100.580.3-179.5-170.50000109.9R96 M242 Y243R96-V246 PolarHBondContact NH1-O 3.01Å; R96-V246 PolarHBondContact NH2-O 2.94Å; M242-V246 WeakPolarHBondContact O-CB 3.27Å; M242-V246 PolarHBondContact O-N 3.48Å; Y243-V246 CarbonylContact O-C 3.38Å
247N89.6Confident93.5Very high87 Ų8756.8 Ų56.847%0.46529%0.293SS..PPolyproline II helixtrans-67.6167.1173.5-72.1-56.6000112.6D244 W245D244-N247 PolarHBondContact O-ND2 3.2Å; W245-N247 PolarHBondContact O-N 3.32Å
248V92.1Very high93.4Very high6 Ų661.8 Ų61.84%0.03632%0.319CS..SBendtrans-56.3131.1168.4-179.30000108.1Y89 L92 V93 L250 Y252 N253 V350Y89-V248 HydrophobicContact CE2-CG1 4.25Å; L92-V248 HydrophobicContact CD2-CG1 4.08Å; V93-V248 HydrophobicContact CG2-CG2 4.49Å; V248-L250 PolarHBondContact O-N 3.35Å; V248-Y252 HydrophobicContact CG1-CD1 4.12Å; V248-N253 VanDerWaalsContact CG1-OD1 3.28Å; V248-N253 WeakPolarHBondContact CG1-OD1 3.48Å; V248-V350 HydrophobicContact CG2-CG2 4.18Å
249P93.2Very high93.4Very high81 Ų8161 Ų6153%0.52632%0.322SS..PPolyproline II helixtrans-49.7128.2-176.4-30.335.4000111.6V251 Y252 N253P249-V251 HydrophobicContact CB-CG1 4.21Å; P249-V251 PolarHBondContact O-N 3.25Å; P249-V251 VanDerWaalsContact O-N 3.14Å; P249-Y252 WeakPolarHBondContact O-CA 3.35Å; P249-Y252 WeakPolarHBondContact O-CB 3.29Å; P249-Y252 PolarHBondContact O-N 2.88Å; P249-N253 PolarHBondContact O-N 3.06Å
250L93Very high93.4Very high120 Ų12056.2 Ų56.263%0.62830%0.301SS*.Hα-helixtrans-53-41.3-175.2176.161.8000112V248 Y252 N253 Q254V248-L250 PolarHBondContact O-N 3.35Å; L250-Y252 PolarHBondContact O-N 3.14Å; L250-N253 PolarHBondContact O-N 3.04Å; L250-Q254 HydrophobicContact CD1-CG 4.17Å; L250-Q254 HydrophobicContact CG-CG 4.23Å; L250-Q254 WeakPolarHBondContact O-CB 3.37Å; L250-Q254 VanDerWaalsContact O-CG 3.3Å; L250-Q254 WeakPolarHBondContact O-CG 3.48Å; L250-Q254 PolarHBondContact O-N 2.91Å
251V95.4Very high93.4Very high92 Ų9262 Ų6256%0.55832%0.324SS*.Hα-helixtrans-57.3-35.517766.70000112.2P249 Q254 V255P249-V251 HydrophobicContact CB-CG1 4.21Å; P249-V251 PolarHBondContact O-N 3.25Å; P249-V251 VanDerWaalsContact O-N 3.14Å; V251-Q254 PolarHBondContact O-N 2.68Å; V251-V255 HydrophobicContact CG2-CG2 4.33Å; V251-V255 WeakPolarHBondContact O-CB 3.28Å; V251-V255 VanDerWaalsContact O-CG2 3.22Å; V251-V255 WeakPolarHBondContact O-CG2 3.46Å; V251-V255 PolarHBondContact O-N 2.82Å
252Y93.4Very high93.4Very high75 Ų7565.9 Ų65.929%0.29434%0.343SS..Hα-helixtrans-70.9-44.6-179.9-164.3-168.2000110.8Y89 L92 V248 P249 L250 Q254 V255 V256Y89-Y252 HydrophobicContact CD2-CD1 4.27Å; Y89-Y252 HydrophobicContact CD2-CD2 4.48Å; Y89-Y252 HydrophobicContact CD2-CE1 4.18Å; Y89-Y252 HydrophobicContact CD2-CE2 4.39Å; Y89-Y252 HydrophobicContact CD2-CG 4.42Å; L92-Y252 HydrophobicContact CD2-CD1 3.85Å; L92-Y252 HydrophobicContact CD2-CE1 3.58Å; V248-Y252 HydrophobicContact CG1-CD1 4.12Å; P249-Y252 WeakPolarHBondContact O-CA 3.35Å; P249-Y252 WeakPolarHBondContact O-CB 3.29Å; P249-Y252 PolarHBondContact O-N 2.88Å; L250-Y252 PolarHBondContact O-N 3.14Å; Y252-Q254 VanDerWaalsContact C-N 3.29Å; Y252-Q254 PolarHBondContact O-N 3.2Å; Y252-V255 PolarHBondContact O-N 3.3Å; Y252-V256 HydrophobicContact CD2-CG2 3.88Å; Y252-V256 HydrophobicContact CE2-CG2 3.79Å; Y252-V256 WeakPolarHBondContact O-CG2 3.44Å; Y252-V256 PolarHBondContact O-N 3.26Å; Y252-V256 VanDerWaalsContact O-N 3.12Å
253N93.8Very high93.5Very high41 Ų4165.3 Ų65.322%0.21934%0.339CS..Hα-helixtrans-57.9-44.8173.3-64.4-4.1000110.8Y89 V248 P249 L250 V256 A257Y89-N253 VanDerWaalsContact CE2-OD1 3.27Å; Y89-N253 WeakPolarHBondContact CE2-OD1 3.45Å; Y89-N253 PolarHBondContact OH-OD1 3.34Å; V248-N253 VanDerWaalsContact CG1-OD1 3.28Å; V248-N253 WeakPolarHBondContact CG1-OD1 3.48Å; P249-N253 PolarHBondContact O-N 3.06Å; L250-N253 PolarHBondContact O-N 3.04Å; N253-V256 PolarHBondContact O-N 2.78Å; N253-A257 VanDerWaalsContact O-CB 3.27Å; N253-A257 WeakPolarHBondContact O-CB 3.22Å; N253-A257 PolarHBondContact O-N 3.41Å
254Q95.3Very high93.6Very high109 Ų10963.4 Ų63.451%0.50933%0.332SS..Hα-helixtrans-62.3-47.2178.7-73.8174.9-16.100112.2L250 V251 Y252 V256 A257 L258L250-Q254 HydrophobicContact CD1-CG 4.17Å; L250-Q254 HydrophobicContact CG-CG 4.23Å; L250-Q254 WeakPolarHBondContact O-CB 3.37Å; L250-Q254 VanDerWaalsContact O-CG 3.3Å; L250-Q254 WeakPolarHBondContact O-CG 3.48Å; L250-Q254 PolarHBondContact O-N 2.91Å; V251-Q254 PolarHBondContact O-N 2.68Å; Y252-Q254 VanDerWaalsContact C-N 3.29Å; Y252-Q254 PolarHBondContact O-N 3.2Å; Q254-V256 VanDerWaalsContact C-N 3.35Å; Q254-V256 PolarHBondContact O-N 3.4Å; Q254-A257 PolarHBondContact O-N 3.49Å; Q254-L258 WeakPolarHBondContact O-CB 3.45Å; Q254-L258 PolarHBondContact O-N 3.27Å
255V94.9Very high93.7Very high80 Ų8062.7 Ų62.749%0.48534%0.335SS..Hα-helixtrans-60.9-44.6-179.5166.70000111.1V251 Y252 A259V251-V255 HydrophobicContact CG2-CG2 4.33Å; V251-V255 WeakPolarHBondContact O-CB 3.28Å; V251-V255 VanDerWaalsContact O-CG2 3.22Å; V251-V255 WeakPolarHBondContact O-CG2 3.46Å; V251-V255 PolarHBondContact O-N 2.82Å; Y252-V255 PolarHBondContact O-N 3.3Å; V255-A259 VanDerWaalsContact O-CB 3.29Å; V255-A259 WeakPolarHBondContact O-CB 3.34Å; V255-A259 PolarHBondContact O-N 3.28Å
256V95Very high93.9Very high0 Ų060 Ų600%033%0.328CS..Hα-helixtrans-69.6-45.8-178.7-179.20000110.9V85 L86 Y89 Y252 N253 Q254 L258 A259 V260 L343V85-V256 HydrophobicContact CG1-CG1 4.43Å; V85-V256 HydrophobicContact CG1-CG2 3.95Å; L86-V256 HydrophobicContact CD2-CG1 3.95Å; Y89-V256 HydrophobicContact CD1-CB 4.26Å; Y89-V256 HydrophobicContact CD1-CG1 3.73Å; Y89-V256 HydrophobicContact CD1-CG2 4.3Å; Y89-V256 HydrophobicContact CD2-CG2 3.93Å; Y89-V256 HydrophobicContact CE1-CG1 4.31Å; Y89-V256 HydrophobicContact CG-CB 4.21Å; Y89-V256 HydrophobicContact CG-CG1 3.99Å; Y89-V256 HydrophobicContact CG-CG2 3.74Å; Y252-V256 HydrophobicContact CD2-CG2 3.88Å; Y252-V256 HydrophobicContact CE2-CG2 3.79Å; Y252-V256 WeakPolarHBondContact O-CG2 3.44Å; Y252-V256 PolarHBondContact O-N 3.26Å; Y252-V256 VanDerWaalsContact O-N 3.12Å; N253-V256 PolarHBondContact O-N 2.78Å; Q254-V256 VanDerWaalsContact C-N 3.35Å; Q254-V256 PolarHBondContact O-N 3.4Å; V256-L258 PolarHBondContact O-N 2.92Å; V256-A259 PolarHBondContact O-N 3.08Å; V256-V260 WeakPolarHBondContact O-CG2 3.42Å; V256-V260 PolarHBondContact O-N 2.93Å; V256-V260 VanDerWaalsContact O-N 3.11Å; V256-L343 HydrophobicContact CG1-CD1 3.99Å
257A94.3Very high94Very high25 Ų2556.2 Ų56.221%0.20731%0.306CS..Hα-helixtrans-60.7-46.8176.800000111.4N253 Q254 A259 V260 Y261N253-A257 VanDerWaalsContact O-CB 3.27Å; N253-A257 WeakPolarHBondContact O-CB 3.22Å; N253-A257 PolarHBondContact O-N 3.41Å; Q254-A257 PolarHBondContact O-N 3.49Å; A257-A259 PolarHBondContact O-N 3.3Å; A257-V260 PolarHBondContact O-N 2.72Å; A257-Y261 HydrophobicContact CB-CE2 4.3Å; A257-Y261 WeakPolarHBondContact O-CB 3.45Å; A257-Y261 WeakPolarHBondContact O-CD2 3.23Å; A257-Y261 VanDerWaalsContact O-CG 3.23Å; A257-Y261 PolarHBondContact O-N 3.37Å
258L94Very high94.2Very high106 Ų10653.1 Ų53.156%0.55529%0.289SS*.Hα-helixtrans-59.9-45.2177.3-17187.5000111.2Q254 V256 V260 Y261 I262Q254-L258 WeakPolarHBondContact O-CB 3.45Å; Q254-L258 PolarHBondContact O-N 3.27Å; V256-L258 PolarHBondContact O-N 2.92Å; L258-V260 PolarHBondContact O-N 3.09Å; L258-Y261 PolarHBondContact O-N 3.5Å; L258-I262 HydrophobicContact CD1-CD1 4.05Å; L258-I262 HydrophobicContact CD1-CG1 4.41Å; L258-I262 HydrophobicContact CD2-CD1 3.81Å; L258-I262 HydrophobicContact CG-CD1 3.57Å; L258-I262 HydrophobicContact CG-CG1 4.12Å; L258-I262 VanDerWaalsContact O-CB 3.31Å; L258-I262 WeakPolarHBondContact O-CB 3.22Å; L258-I262 VanDerWaalsContact O-CG1 3.28Å; L258-I262 WeakPolarHBondContact O-CG1 3.3Å; L258-I262 PolarHBondContact O-N 3.34Å
259A94.1Very high94.2Very high28 Ų2856.8 Ų56.823%0.23130%0.304CS..Hα-helixtrans-59-46.1179.300000111.8L82 V255 V256 A257 Y263L82-A259 HydrophobicContact CD2-CB 4.19Å; V255-A259 VanDerWaalsContact O-CB 3.29Å; V255-A259 WeakPolarHBondContact O-CB 3.34Å; V255-A259 PolarHBondContact O-N 3.28Å; V256-A259 PolarHBondContact O-N 3.08Å; A257-A259 PolarHBondContact O-N 3.3Å; A259-Y263 VanDerWaalsContact O-CB 3.3Å; A259-Y263 WeakPolarHBondContact O-CB 3.44Å; A259-Y263 PolarHBondContact O-N 3.19Å
260V94.9Very high94Very high1 Ų153.7 Ų53.71%0.00629%0.287CS..Hα-helixtrans-66.1-44.7178.1176.10000111.3L82 L86 V256 A257 L258 Y263 F264 L343L82-V260 HydrophobicContact CD2-CG2 4.12Å; L86-V260 HydrophobicContact CD1-CG2 3.93Å; L86-V260 HydrophobicContact CD2-CG2 4.03Å; L86-V260 HydrophobicContact CG-CG2 4.12Å; V256-V260 WeakPolarHBondContact O-CG2 3.42Å; V256-V260 PolarHBondContact O-N 2.93Å; V256-V260 VanDerWaalsContact O-N 3.11Å; A257-V260 PolarHBondContact O-N 2.72Å; L258-V260 PolarHBondContact O-N 3.09Å; V260-Y263 WeakPolarHBondContact O-CB 3.39Å; V260-Y263 PolarHBondContact O-N 3.4Å; V260-F264 HydrophobicContact CG1-CD2 3.77Å; V260-F264 HydrophobicContact CG1-CE2 3.61Å; V260-F264 WeakPolarHBondContact O-CD2 3.14Å; V260-F264 PolarHBondContact O-N 3.38Å; V260-L343 HydrophobicContact CB-CD2 4.02Å; V260-L343 HydrophobicContact CG1-CD2 4.01Å; V260-L343 HydrophobicContact CG2-CD2 4.21Å
261Y94.5Very high93.8Very high121 Ų12150.5 Ų50.548%0.47527%0.269SS..Hα-helixtrans-70.7-40.2-178.3-64.8-17.8000113A257 L258 Y263 F264 A265 L343A257-Y261 HydrophobicContact CB-CE2 4.3Å; A257-Y261 WeakPolarHBondContact O-CB 3.45Å; A257-Y261 WeakPolarHBondContact O-CD2 3.23Å; A257-Y261 VanDerWaalsContact O-CG 3.23Å; A257-Y261 PolarHBondContact O-N 3.37Å; L258-Y261 PolarHBondContact O-N 3.5Å; Y261-Y263 VanDerWaalsContact C-N 3.34Å; Y261-F264 PolarHBondContact O-N 2.83Å; Y261-A265 VanDerWaalsContact O-CB 3.32Å; Y261-A265 WeakPolarHBondContact O-CB 3.46Å; Y261-A265 PolarHBondContact O-N 3.5Å; Y261-L343 HydrophobicContact CE1-CD2 4.11Å
262I93.9Very high93.5Very high91 Ų9146.9 Ų46.947%0.46725%0.246SC..Hα-helixtrans-62.5-44.9173.5-71.3177.2000109.8L258 F264 A265 V266L258-I262 HydrophobicContact CD1-CD1 4.05Å; L258-I262 HydrophobicContact CD1-CG1 4.41Å; L258-I262 HydrophobicContact CD2-CD1 3.81Å; L258-I262 HydrophobicContact CG-CD1 3.57Å; L258-I262 HydrophobicContact CG-CG1 4.12Å; L258-I262 VanDerWaalsContact O-CB 3.31Å; L258-I262 WeakPolarHBondContact O-CB 3.22Å; L258-I262 VanDerWaalsContact O-CG1 3.28Å; L258-I262 WeakPolarHBondContact O-CG1 3.3Å; L258-I262 PolarHBondContact O-N 3.34Å; I262-F264 VanDerWaalsContact C-N 3.31Å; I262-F264 PolarHBondContact O-N 3.44Å; I262-A265 PolarHBondContact O-N 3.5Å; I262-V266 HydrophobicContact CG2-CG2 4.3Å; I262-V266 VanDerWaalsContact O-CG2 3.32Å; I262-V266 WeakPolarHBondContact O-CG2 3.45Å; I262-V266 PolarHBondContact O-N 3.03Å
263Y94.5Very high92.9Very high26 Ų2647.2 Ų47.210%0.10225%0.249CC..Hα-helixtrans-54.2-50.9175.8173.1-93000110.9T77 V80 L82 A259 V260 Y261 A265 V266 T267 Y339T77-Y263 HydrophobicContact CG2-CE2 4.42Å; T77-Y263 WeakPolarHBondContact O-CE2 3.36Å; V80-Y263 HydrophobicContact CB-CD2 4.31Å; L82-Y263 HydrophobicContact CD1-CD1 3.29Å; L82-Y263 HydrophobicContact CD1-CD2 3.59Å; L82-Y263 HydrophobicContact CD1-CE1 3.75Å; L82-Y263 HydrophobicContact CD1-CE2 4.01Å; L82-Y263 HydrophobicContact CD1-CG 3.2Å; L82-Y263 HydrophobicContact CG-CD2 4.07Å; L82-Y263 HydrophobicContact CG-CG 4.03Å; A259-Y263 VanDerWaalsContact O-CB 3.3Å; A259-Y263 WeakPolarHBondContact O-CB 3.44Å; A259-Y263 PolarHBondContact O-N 3.19Å; V260-Y263 WeakPolarHBondContact O-CB 3.39Å; V260-Y263 PolarHBondContact O-N 3.4Å; Y261-Y263 VanDerWaalsContact C-N 3.34Å; Y263-A265 PolarHBondContact O-N 3.24Å; Y263-V266 PolarHBondContact O-N 3.45Å; Y263-T267 HydrophobicContact CD1-CG2 4.08Å; Y263-T267 HydrophobicContact CE1-CG2 3.74Å; Y263-T267 HydrophobicContact CE2-CG2 4.45Å; Y263-T267 WeakPolarHBondContact O-CG2 3.36Å; Y263-T267 PolarHBondContact O-N 3.45Å; Y263-Y339 HydrophobicContact CE1-CD2 4.34Å
264F94.9Very high92.1Very high7 Ų747.4 Ų47.43%0.03125%0.25CC..Hα-helixtrans-67.4-36.2179.3-73.9-55.2000113.4Y39 V260 Y261 I262 V266 T267 I268 F336 Y339 N340Y39-F264 HydrophobicContact CD2-CB 4.27Å; Y39-F264 HydrophobicContact CE2-CB 4.06Å; Y39-F264 HydrophobicContact CE2-CD1 4.15Å; Y39-F264 HydrophobicContact CE2-CG 4.48Å; V260-F264 HydrophobicContact CG1-CD2 3.77Å; V260-F264 HydrophobicContact CG1-CE2 3.61Å; V260-F264 WeakPolarHBondContact O-CD2 3.14Å; V260-F264 PolarHBondContact O-N 3.38Å; Y261-F264 PolarHBondContact O-N 2.83Å; I262-F264 VanDerWaalsContact C-N 3.31Å; I262-F264 PolarHBondContact O-N 3.44Å; F264-V266 VanDerWaalsContact C-N 3.28Å; F264-V266 PolarHBondContact O-N 2.85Å; F264-T267 WeakPolarHBondContact CA-OG1 3.26Å; F264-T267 PolarHBondContact O-N 3.46Å; F264-T267 PolarHBondContact O-OG1 2.97Å; F264-I268 PolarHBondContact O-N 2.98Å; F264-I268 VanDerWaalsContact O-N 3.13Å; F264-F336 HydrophobicContact CB-CD2 4.49Å; F264-F336 HydrophobicContact CB-CE2 4.48Å; F264-F336 AromaticContact CD1-CD2 3.62Å; F264-F336 HydrophobicContact CD1-CD2 3.62Å; F264-F336 HydrophobicContact CD1-CE2 4.37Å; F264-F336 AromaticContact CD2-CD2 3.85Å; F264-F336 HydrophobicContact CD2-CD2 3.85Å; F264-F336 AromaticContact CD2-CE2 3.95Å; F264-F336 HydrophobicContact CD2-CE2 3.95Å; F264-F336 HydrophobicContact CE1-CB 3.89Å; F264-F336 AromaticContact CE1-CD2 3.72Å; F264-F336 HydrophobicContact CE1-CD2 3.72Å; F264-F336 HydrophobicContact CE1-CG 4.22Å; F264-F336 AromaticContact CE2-CD2 3.93Å; F264-F336 HydrophobicContact CE2-CD2 3.93Å; F264-F336 HydrophobicContact CE2-CE2 4.29Å; F264-F336 AromaticContact CG-CD2 3.72Å; F264-F336 HydrophobicContact CG-CD2 3.72Å; F264-F336 HydrophobicContact CG-CE2 4.01Å; F264-F336 VanDerWaalsContact CZ-CA 3.41Å; F264-F336 HydrophobicContact CZ-CB 4.13Å; F264-F336 AromaticContact CZ-CD2 3.89Å; F264-F336 HydrophobicContact CZ-CD2 3.89Å; F264-F336 HydrophobicContact CZ-CG 4.26Å; F264-Y339 HydrophobicContact CZ-CD2 4.28Å; F264-N340 HydrophobicContact CE2-CB 4.14Å
265A94.5Very high90.7Very high50 Ų5046 Ų4641%0.41325%0.246SC..Hα-helixtrans-58.6-40.5173.100000111.9Y261 I262 Y263Y261-A265 VanDerWaalsContact O-CB 3.32Å; Y261-A265 WeakPolarHBondContact O-CB 3.46Å; Y261-A265 PolarHBondContact O-N 3.5Å; I262-A265 PolarHBondContact O-N 3.5Å; Y263-A265 PolarHBondContact O-N 3.24Å
266V94.4Very high88.8Confident35 Ų3546 Ų4621%0.21225%0.253CS..Hα-helixtrans-72.6-38.3176.5-178.80000111.2A73 V76 T77 I262 Y263 F264 I268 F269 G270A73-V266 HydrophobicContact CB-CG1 3.6Å; A73-V266 WeakPolarHBondContact O-CG1 3.4Å; V76-V266 HydrophobicContact CB-CG1 4.33Å; V76-V266 HydrophobicContact CG1-CG1 4.39Å; T77-V266 HydrophobicContact CG2-CB 4.05Å; T77-V266 HydrophobicContact CG2-CG1 3.72Å; I262-V266 HydrophobicContact CG2-CG2 4.3Å; I262-V266 VanDerWaalsContact O-CG2 3.32Å; I262-V266 WeakPolarHBondContact O-CG2 3.45Å; I262-V266 PolarHBondContact O-N 3.03Å; Y263-V266 PolarHBondContact O-N 3.45Å; F264-V266 VanDerWaalsContact C-N 3.28Å; F264-V266 PolarHBondContact O-N 2.85Å; V266-I268 PolarHBondContact O-N 3.46Å; V266-F269 PolarHBondContact O-N 2.93Å; V266-G270 PolarHBondContact O-N 3.04Å
267T93.6Very high86.6Confident0 Ų050.8 Ų50.80%029%0.285CS..Hα-helixtrans-61.9-28176.964.50000113.4Y39 T77 Y263 F264 F269 G270 H271Y39-T267 PolarHBondContact OH-OG1 2.9Å; T77-T267 HydrophobicContact CG2-CG2 3.56Å; Y263-T267 HydrophobicContact CD1-CG2 4.08Å; Y263-T267 HydrophobicContact CE1-CG2 3.74Å; Y263-T267 HydrophobicContact CE2-CG2 4.45Å; Y263-T267 WeakPolarHBondContact O-CG2 3.36Å; Y263-T267 PolarHBondContact O-N 3.45Å; F264-T267 WeakPolarHBondContact CA-OG1 3.26Å; F264-T267 PolarHBondContact O-N 3.46Å; F264-T267 PolarHBondContact O-OG1 2.97Å; T267-F269 PolarHBondContact O-N 2.85Å; T267-G270 PolarHBondContact O-N 3.38Å; T267-H271 WeakPolarHBondContact O-CB 3.49Å; T267-H271 PolarHBondContact O-N 3.17Å
268I93.9Very high84.5Confident22 Ų2253.4 Ų53.411%0.11330%0.301CS..Hα-helixtrans-55.4-35174.6-74.2164.5000110.8Y39 F42 V46 F264 V266 Q272Y39-I268 HydrophobicContact CD2-CD1 4.22Å; Y39-I268 HydrophobicContact CD2-CG1 4.07Å; Y39-I268 HydrophobicContact CE2-CD1 4.21Å; Y39-I268 HydrophobicContact CE2-CG1 3.6Å; F42-I268 HydrophobicContact CB-CD1 3.91Å; V46-I268 HydrophobicContact CB-CG2 4.24Å; V46-I268 HydrophobicContact CG2-CG2 3.77Å; F264-I268 PolarHBondContact O-N 2.98Å; F264-I268 VanDerWaalsContact O-N 3.13Å; V266-I268 PolarHBondContact O-N 3.46Å; I268-Q272 WeakPolarHBondContact O-CG 3.08Å; I268-Q272 PolarHBondContact O-NE2 3.46Å
269F92.7Very high82.4Confident83 Ų8349.3 Ų49.336%0.36428%0.28SS..Hα-helixtrans-92.1-45.5174.3-60.1-82.4000111.7V46 F66 I69 C70 A73 V266 T267 H271 Q272V46-F269 HydrophobicContact CG1-CD1 4.21Å; V46-F269 HydrophobicContact CG1-CE1 4.26Å; V46-F269 HydrophobicContact CG2-CE1 4.29Å; F66-F269 HydrophobicContact CE2-CD1 4.41Å; I69-F269 HydrophobicContact CG2-CB 4.47Å; I69-F269 HydrophobicContact CG2-CD1 4.46Å; C70-F269 WeakPolarHBondContact CB-O 3.18Å; C70-F269 PolarHBondContact SG-O 3.33Å; A73-F269 HydrophobicContact CB-CB 4.01Å; V266-F269 PolarHBondContact O-N 2.93Å; T267-F269 PolarHBondContact O-N 2.85Å; F269-H271 VanDerWaalsContact C-N 3.27Å; F269-H271 PolarHBondContact O-N 3.12Å; F269-Q272 WeakPolarHBondContact O-CG 3.27Å; F269-Q272 PolarHBondContact O-N 2.94Å
270G88.5Confident80.1Confident16 Ų1654 Ų5417%0.16530%0.301CS..Hα-helixtrans-63.9-29.4-171.500000114.4C70 V266 T267C70-G270 WeakPolarHBondContact O-CA 3.5Å; V266-G270 PolarHBondContact O-N 3.04Å; T267-G270 PolarHBondContact O-N 3.38Å
271H89.2Confident77.7Confident52 Ų5257.5 Ų57.524%0.24132%0.323CS..THydrogen-bonded Turntrans-107.221.6-177.5-61177.9000112.7Y43 T267 F269 T332Y43-H271 PolarHBondContact OH-O 3.34Å; T267-H271 WeakPolarHBondContact O-CB 3.49Å; T267-H271 PolarHBondContact O-N 3.17Å; F269-H271 VanDerWaalsContact C-N 3.27Å; F269-H271 PolarHBondContact O-N 3.12Å; H271-T332 HydrophobicContact CB-CG2 4.41Å; H271-T332 VanDerWaalsContact ND1-CG2 3.32Å; H271-T332 WeakPolarHBondContact ND1-CG2 2.94Å; H271-T332 PolarHBondContact ND1-OG1 3.27Å
272Q89.4Confident75.4Confident16 Ų1656.9 Ų56.98%0.07533%0.325CS..  trans-68.5140171-70.6-68.8-23.800110.6Y43 V46 F66 I268 F269 I274Y43-Q272 PolarHBondContact O-NE2 3.08Å; Y43-Q272 VanDerWaalsContact O-NE2 3.15Å; V46-Q272 HydrophobicContact CG1-CG 4.05Å; F66-Q272 HydrophobicContact CE1-CB 4.41Å; F66-Q272 HydrophobicContact CZ-CB 4.37Å; F66-Q272 HydrophobicContact CZ-CG 4.12Å; I268-Q272 WeakPolarHBondContact O-CG 3.08Å; I268-Q272 PolarHBondContact O-NE2 3.46Å; F269-Q272 WeakPolarHBondContact O-CG 3.27Å; F269-Q272 PolarHBondContact O-N 2.94Å; Q272-I274 HydrophobicContact CB-CG1 4.49Å; Q272-I274 PolarHBondContact O-N 3.32Å; Q272-I274 VanDerWaalsContact O-N 3.17Å
273F81.6Confident72.8Confident83 Ų8359.2 Ų59.236%0.36434%0.335SS..  trans-80.499.2175.8-68-91.1000109.7Y43 N327 P329Y43-F273 WeakPolarHBondContact OH-CD2 3.26Å; Y43-F273 WeakPolarHBondContact OH-CE2 3.43Å; F273-N327 HydrophobicContact CB-CB 3.71Å; F273-N327 VanDerWaalsContact CB-ND2 3.3Å; F273-N327 WeakPolarHBondContact CB-ND2 3.48Å; F273-N327 HydrophobicContact CD1-CB 4.46Å; F273-N327 HydrophobicContact CD2-CB 3.4Å; F273-N327 VanDerWaalsContact CD2-O 3.25Å; F273-N327 WeakPolarHBondContact CD2-O 3.34Å; F273-N327 HydrophobicContact CE2-CB 4.04Å; F273-N327 WeakPolarHBondContact CE2-O 3.5Å; F273-N327 HydrophobicContact CG-CB 3.62Å; F273-P329 HydrophobicContact CE2-CB 3.88Å; F273-P329 HydrophobicContact CZ-CB 4.41Å
274I76Confident70.2Confident45 Ų4561.9 Ų61.923%0.23136%0.357CS..  trans-94.7140.2-178.5-61.4162.5000109.9F66 V67 C70 Q272 A276F66-I274 HydrophobicContact CE1-CG1 4.45Å; V67-I274 HydrophobicContact CB-CD1 4.5Å; V67-I274 HydrophobicContact CB-CG2 4.24Å; V67-I274 HydrophobicContact CG1-CD1 4.34Å; V67-I274 HydrophobicContact CG1-CG2 4.09Å; V67-I274 HydrophobicContact CG2-CG2 3.36Å; C70-I274 HydrophobicContact CB-CD1 3.2Å; C70-I274 HydrophobicContact CB-CG1 4.4Å; Q272-I274 HydrophobicContact CB-CG1 4.49Å; Q272-I274 PolarHBondContact O-N 3.32Å; Q272-I274 VanDerWaalsContact O-N 3.17Å; I274-A276 PolarHBondContact O-N 2.9Å
275D65.9Low67.7Low80 Ų8065.8 Ų65.843%0.42838%0.382SS..  trans-69.593.1170.2-53.1-56.3000110.1Y50 R63Y50-D275 PolarHBondContact OH-OD2 3.4Å; R63-D275 IonicContact NH2-OD2 3.16Å; R63-D275 PolarHBondContact NH2-OD2 2.96Å; R63-D275 VanDerWaalsContact NH2-OD2 3.16Å
276A54.8Low64.9Low78 Ų7873.9 Ų73.965%0.64540%0.402SS*.THydrogen-bonded Turntrans-105.2125.916500000107.9I274I274-A276 PolarHBondContact O-N 2.9Å
277P49.9Very low62.4Low102 Ų10277.4 Ų77.466%0.66242%0.423SS*.THydrogen-bonded Turncis-144.383.32338.1-13.4000113.9
278S49.7Very low59.7Low79 Ų7984.3 Ų84.355%0.55246%0.46SS*.SBendtrans-94.3-10.7160.858.90000112.3
279I49.7Very low56.9Low21 Ų2188 Ų8811%0.10849%0.488CS..SBendtrans-104.6-16.7-166.9-34.1-177.8000113.1R60 L64R60-I279 HydrophobicContact CG-CG2 4.43Å; L64-I279 HydrophobicContact CD1-CG2 4.08Å; L64-I279 HydrophobicContact CD2-CB 4.26Å; L64-I279 HydrophobicContact CD2-CG2 3.33Å; L64-I279 HydrophobicContact CG-CG2 3.57Å
280L45.8Very low54.1Low126 Ų12688.3 Ų88.366%0.6650%0.501SS*.G310 helixtrans-77.9-26.4-177.3-92.8153.2000117.6H282L280-H282 VanDerWaalsContact C-N 3.28Å; L280-H282 PolarHBondContact O-N 3.46Å
281P45.5Very low51.8Low75 Ų7595.5 Ų95.549%0.48754%0.535SS..G310 helixtrans-78.9-4.7-177.328.4-31.1000114.8S284 T285P281-S284 PolarHBondContact O-OG 3.48Å; P281-T285 PolarHBondContact O-OG1 3.2Å; P281-T285 VanDerWaalsContact O-OG1 3.1Å
282H44.4Very low48.9Very low108 Ų108100.5 Ų100.550%0.556%0.563SS.*G310 helixtrans-98.4-8.3-179-74.8-79.7000115.1R60 L280 T285R60-H282 PolarHBondContact NH2-CD2 3.45Å; L280-H282 VanDerWaalsContact C-N 3.28Å; L280-H282 PolarHBondContact O-N 3.46Å; H282-T285 WeakPolarHBondContact CA-OG1 3.42Å
283M39.8Very low46.1Very low140 Ų140105.4 Ų105.469%0.6959%0.594SS**THydrogen-bonded Turntrans-79.7-28.8174.3-142.1164.6-140.300111.4
284S41.3Very low43.7Very low81 Ų81106.7 Ų106.757%0.56661%0.613SS**SBendtrans-78.2-20.4174.736.30000113.9P281P281-S284 PolarHBondContact O-OG 3.48Å
285T42.2Very low41.7Very low90 Ų90111.4 Ų111.455%0.55264%0.644SS**SBendtrans-84.7-13.9179.68.40000114.3P281 H282P281-T285 PolarHBondContact O-OG1 3.2Å; P281-T285 VanDerWaalsContact O-OG1 3.1Å; H282-T285 WeakPolarHBondContact CA-OG1 3.42Å
286R34.9Very low40.1Very low220 Ų220113.6 Ų113.683%0.8366%0.656SS**SBendtrans-91.3-7.1-178.6-128.9-179.4-167.6-174.53114.8
287V42.8Very low39Very low108 Ų108115.4 Ų115.466%0.65565%0.654SS**SBendtrans-96.1-13.9-178.1-178.90000112.9
288N36Very low38Very low146 Ų146116.9 Ų116.978%0.78166%0.657SS**SBendtrans-105.717.8-174.8-72-4.1000115.3
289S34.8Very low37.3Very low99 Ų99120.7 Ų120.769%0.69267%0.671SS**SBendtrans-111.321.2178.729.20000114.5
290S34.9Very low36.3Very low90 Ų90127.3 Ų127.363%0.62971%0.707SS**SBendtrans-146.980.3167.659.60000110.3
291N38.7Very low35.5Very low166 Ų166130.6 Ų130.689%0.88872%0.716SS**  trans173.5124.5133.7-81.9-19.6000110.4
292L29.1Very low34.6Very low157 Ų157132.1 Ų132.182%0.82273%0.728SS**  trans-68.9159.6175.5-112.176.1000111.9
293T31.2Very low34.1Very low120 Ų120132.3 Ų132.374%0.73674%0.742SS**  trans81117.7146.853.40000121.1
294S30.8Very low33.5Very low109 Ų109130.7 Ų130.776%0.76274%0.744SS**  trans54.8122.3148.9730000119
295V34.1Very low32.9Very low144 Ų144134.5 Ų134.587%0.87376%0.757SS**  -174.2143.8105.6152.40000109.2
296N31.4Very low32.2Very low127 Ų127138.3 Ų138.368%0.67977%0.772SS**  trans-83.1162-173.7-169.919000112.8
297N32.1Very low32.1Very low115 Ų115135.6 Ų135.662%0.61577%0.774SS**  trans81.6114.6155.5-71.9-20.6000121.7
298N29.3Very low31.4Very low133 Ų133137.6 Ų137.671%0.71178%0.781SS**  48.5115.2128.7-56.8-10.1000118.3
299N35.3Very low31.1Very low160 Ų160136.1 Ų136.186%0.85678%0.78SS**  -169.2141.7115.6-86.5-25.9000112.2F301N299-F301 PolarHBondContact O-N 3.1Å
300N28Very low30.8Very low160 Ų160135.2 Ų135.286%0.85678%0.778SS**  trans-57.4124.1177.5-59.2-38.4000111.6
301F29.5Very low30.4Very low195 Ų195138 Ų13886%0.85579%0.786SS**  trans-146.8121148.8-158.3-101.5000110.9N299 S303N299-F301 PolarHBondContact O-N 3.1Å; F301-S303 PolarHBondContact O-N 3.13Å
302S25.3Very low29.9Very low107 Ų107137 Ų13775%0.74878%0.781SS**  trans-47.9118176.1-40.10000112.8
303S34Very low29.9Very low112 Ų112135.3 Ų135.378%0.78378%0.777SS**  trans-134.595.5154.362.20000108.4F301F301-S303 PolarHBondContact O-N 3.13Å
304S27.3Very low29.8Very low105 Ų105136.1 Ų136.173%0.73478%0.777SS**  trans-56.6158160.143.30000110.5
305I28.3Very low29.7Very low162 Ų162137.2 Ų137.283%0.83178%0.779SS**  trans89.974.5171.1-43.5168000114.4
306L27.4Very low29.6Very low169 Ų169136.8 Ų136.889%0.88578%0.777SS**  -152.677.3129.7-157.872.7000109.7
307N32.9Very low29.4Very low163 Ų163137.9 Ų137.987%0.87278%0.782SS**  trans-80.8118160.6-86.4-8.7000108.2
308N29Very low29.3Very low150 Ų150136 Ų13680%0.80279%0.79SS**  trans-49.7151.7164.9-140.69000111.2
309P29.6Very low29.3Very low116 Ų116136 Ų13675%0.75379%0.789SS**  -137.3148.112634-20.1000114.8
310A29.2Very low28.8Very low79 Ų79134.1 Ų134.165%0.65379%0.788SS**  trans80.895.8147.800000118.8D312A310-D312 PolarHBondContact O-N 3.08Å
311N26.3Very low28.7Very low149 Ų149134.5 Ų134.580%0.79778%0.782SS**  -33.2119.1127.3-92-12.8000111.4
312D28.6Very low28.7Very low144 Ų144130.1 Ų130.177%0.7777%0.774SS**  trans-13390.1148.8-94.8-31.8000108.1A310A310-D312 PolarHBondContact O-N 3.08Å
313T28.1Very low29.2Very low122 Ų122136.9 Ų136.975%0.74878%0.783SS**  trans-86.295.416136.40000106.7
314N29.6Very low29.7Very low138 Ų138137.1 Ų137.174%0.73878%0.779SS**  trans-137.3102.3163-84.5-38000110.3T316N314-T316 PolarHBondContact O-N 3.3Å
315V29.3Very low30.5Very low132 Ų132139 Ų13980%0.878%0.78SS**  trans-48.7116.3163.4174.60000109.2
316T31.7Very low31.8Very low134 Ų134135.8 Ų135.882%0.82277%0.77SS**  trans-127.7126.5157.547.10000109.4N314N314-T316 PolarHBondContact O-N 3.3Å
317N27.3Very low33.8Very low150 Ų150130.9 Ų130.980%0.80275%0.745SS**  trans-67.1140.2-173.2-66.6-38.4000111.9I319N317-I319 PolarHBondContact O-N 2.91Å
318G28.7Very low36.2Very low75 Ų75127.7 Ų127.777%0.77373%0.726SS**  trans8.299.2155.300000118.8
319I29.2Very low39Very low134 Ų134121 Ų12169%0.68769%0.692SS**  -143111.7124.4-58.4-174.8000106.3N317 F321N317-I319 PolarHBondContact O-N 2.91Å; I319-F321 VanDerWaalsContact C-N 3.31Å; I319-F321 HydrophobicContact CB-CD2 4.25Å; I319-F321 HydrophobicContact CB-CE2 4.07Å; I319-F321 HydrophobicContact CG2-CD2 3.8Å; I319-F321 HydrophobicContact CG2-CE2 3.56Å; I319-F321 HydrophobicContact CG2-CZ 4.17Å; I319-F321 PolarHBondContact O-N 3.33Å
320S26.3Very low41.8Very low120 Ų120119.6 Ų119.684%0.83968%0.68SS**  trans-68.184.6172.547.50000110.1
321F25.6Very low44.7Very low168 Ų168123.8 Ų123.874%0.73768%0.684SS**  trans-73.9121.7161.3-78.5-81.3000107.9I319 R323I319-F321 VanDerWaalsContact C-N 3.31Å; I319-F321 HydrophobicContact CB-CD2 4.25Å; I319-F321 HydrophobicContact CB-CE2 4.07Å; I319-F321 HydrophobicContact CG2-CD2 3.8Å; I319-F321 HydrophobicContact CG2-CE2 3.56Å; I319-F321 HydrophobicContact CG2-CZ 4.17Å; I319-F321 PolarHBondContact O-N 3.33Å; F321-R323 PolarHBondContact O-N 3.38Å; F321-R323 VanDerWaalsContact O-N 3.12Å
322P30.2Very low47.7Very low104 Ų104117.3 Ų117.368%0.67565%0.65SS**  trans-61.5122.4173.829-32.1000106.3V324P322-V324 HydrophobicContact CB-CG2 3.91Å; P322-V324 PolarHBondContact O-N 3.13Å
323R35.7Very low50.8Low249 Ų249112.1 Ų112.194%0.9462%0.622SS**  trans-72.555.4179.8-153.7-179.7-166.6160.32.4109.8F321F321-R323 PolarHBondContact O-N 3.38Å; F321-R323 VanDerWaalsContact O-N 3.12Å
324V43.1Very low53.9Low116 Ų116109.6 Ų109.670%0.70360%0.604SS**  trans-112.461179.5-166.30000106P322P322-V324 HydrophobicContact CB-CG2 3.91Å; P322-V324 PolarHBondContact O-N 3.13Å
325L43.9Very low56.9Low144 Ų144104.8 Ų104.875%0.75458%0.581SS**  trans-68134.1153.4-85.997.1000105.8N327L325-N327 PolarHBondContact O-N 3.34Å
326P55.4Low60Low95 Ų9599 Ų9962%0.61755%0.545SS*.  trans-69.1112.8-177.331.8-32.8000106.7I328P326-I328 HydrophobicContact CB-CD1 3.99Å; P326-I328 HydrophobicContact CB-CG1 3.88Å; P326-I328 HydrophobicContact CG-CD1 3.87Å; P326-I328 HydrophobicContact CG-CG1 4.22Å; P326-I328 PolarHBondContact O-N 2.9Å
327N71.1Confident63.1Low67 Ų6794.1 Ų94.136%0.35851%0.513SS..  trans-62.464.3172.2-86.1-17.1000110.1F273 L325 P329F273-N327 HydrophobicContact CB-CB 3.71Å; F273-N327 VanDerWaalsContact CB-ND2 3.3Å; F273-N327 WeakPolarHBondContact CB-ND2 3.48Å; F273-N327 HydrophobicContact CD1-CB 4.46Å; F273-N327 HydrophobicContact CD2-CB 3.4Å; F273-N327 VanDerWaalsContact CD2-O 3.25Å; F273-N327 WeakPolarHBondContact CD2-O 3.34Å; F273-N327 HydrophobicContact CE2-CB 4.04Å; F273-N327 WeakPolarHBondContact CE2-O 3.5Å; F273-N327 HydrophobicContact CG-CB 3.62Å; L325-N327 PolarHBondContact O-N 3.34Å; N327-P329 WeakPolarHBondContact O-CD 3.27Å
328I82.4Confident66.2Low95 Ų9593.3 Ų93.349%0.48750%0.503SS..  trans-83.1119.7-178.1-61.6169.8000107.9P326 V330 I333P326-I328 HydrophobicContact CB-CD1 3.99Å; P326-I328 HydrophobicContact CB-CG1 3.88Å; P326-I328 HydrophobicContact CG-CD1 3.87Å; P326-I328 HydrophobicContact CG-CG1 4.22Å; P326-I328 PolarHBondContact O-N 2.9Å; I328-V330 HydrophobicContact CG2-CG2 4.14Å; I328-V330 PolarHBondContact O-N 3.02Å; I328-I333 HydrophobicContact CG2-CD1 3.78Å
329P87.5Confident69.3Low11 Ų1192.2 Ų92.27%0.07148%0.476CS..  trans-81.169.6-176.536.8-40.6000110.6Y43 F273 N327 F331 T332 I333Y43-P329 HydrophobicContact CD1-CG 3.96Å; Y43-P329 HydrophobicContact CD2-CG 4.18Å; Y43-P329 HydrophobicContact CE1-CB 4.34Å; Y43-P329 VanDerWaalsContact CE1-CD 3.46Å; Y43-P329 HydrophobicContact CE1-CG 3.54Å; Y43-P329 HydrophobicContact CE2-CB 4.18Å; Y43-P329 HydrophobicContact CE2-CG 3.77Å; Y43-P329 HydrophobicContact CG-CG 4.27Å; Y43-P329 VanDerWaalsContact CZ-CG 3.43Å; F273-P329 HydrophobicContact CE2-CB 3.88Å; F273-P329 HydrophobicContact CZ-CB 4.41Å; N327-P329 WeakPolarHBondContact O-CD 3.27Å; P329-F331 VanDerWaalsContact C-N 3.32Å; P329-F331 PolarHBondContact O-N 3.18Å; P329-T332 WeakPolarHBondContact O-CA 3.47Å; P329-T332 WeakPolarHBondContact O-CB 3.45Å; P329-T332 PolarHBondContact O-N 2.99Å; P329-I333 HydrophobicContact CG-CG1 4.47Å; P329-I333 PolarHBondContact O-N 3.31Å
330V89.7Confident72.5Confident85 Ų8586.2 Ų86.252%0.51545%0.445SS..Hα-helixtrans-51.5-47.4-173.1178.20000112.4I328 T332 I333 L334I328-V330 HydrophobicContact CG2-CG2 4.14Å; I328-V330 PolarHBondContact O-N 3.02Å; V330-T332 VanDerWaalsContact C-N 3.29Å; V330-T332 PolarHBondContact O-N 3.23Å; V330-I333 PolarHBondContact O-N 3.26Å; V330-L334 HydrophobicContact CG1-CD1 4.39Å; V330-L334 WeakPolarHBondContact O-CG 3.44Å; V330-L334 PolarHBondContact O-N 3.35Å
331F88.1Confident75.7Confident168 Ų16880.6 Ų80.674%0.73741%0.406SS*.Hα-helixtrans-65.8-32.2178.5-70-69.7000113P329 L334 S335P329-F331 VanDerWaalsContact C-N 3.32Å; P329-F331 PolarHBondContact O-N 3.18Å; F331-L334 HydrophobicContact CD1-CD1 4.48Å; F331-L334 PolarHBondContact O-N 3.35Å; F331-S335 PolarHBondContact O-N 3.01Å; F331-S335 PolarHBondContact O-OG 2.96Å; F331-S335 VanDerWaalsContact O-OG 3.06Å
332T91Very high79Confident12 Ų1276.6 Ų76.67%0.07439%0.386CS..Hα-helixtrans-72.5-37.6176.5-51.50000111.1Y39 H271 P329 V330 L334 S335 F336Y39-T332 HydrophobicContact CE1-CG2 4.32Å; Y39-T332 WeakPolarHBondContact OH-CG2 3.35Å; H271-T332 HydrophobicContact CB-CG2 4.41Å; H271-T332 VanDerWaalsContact ND1-CG2 3.32Å; H271-T332 WeakPolarHBondContact ND1-CG2 2.94Å; H271-T332 PolarHBondContact ND1-OG1 3.27Å; P329-T332 WeakPolarHBondContact O-CA 3.47Å; P329-T332 WeakPolarHBondContact O-CB 3.45Å; P329-T332 PolarHBondContact O-N 2.99Å; V330-T332 VanDerWaalsContact C-N 3.29Å; V330-T332 PolarHBondContact O-N 3.23Å; T332-L334 VanDerWaalsContact C-N 3.33Å; T332-S335 PolarHBondContact O-N 3.37Å; T332-F336 WeakPolarHBondContact O-CB 3.27Å; T332-F336 PolarHBondContact O-N 3.49Å
333I93.6Very high82.1Confident35 Ų3572.1 Ų72.118%0.17936%0.356CS..Hα-helixtrans-61.9-42.9172.2-68.9167.3000110.3L36 I328 P329 V330 F336 I337L36-I333 HydrophobicContact CD1-CG2 3.94Å; L36-I333 HydrophobicContact CD2-CG2 4.33Å; I328-I333 HydrophobicContact CG2-CD1 3.78Å; P329-I333 HydrophobicContact CG-CG1 4.47Å; P329-I333 PolarHBondContact O-N 3.31Å; V330-I333 PolarHBondContact O-N 3.26Å; I333-F336 WeakPolarHBondContact O-CB 3.42Å; I333-F336 PolarHBondContact O-N 3.14Å; I333-I337 HydrophobicContact CG2-CD1 4.15Å; I333-I337 WeakPolarHBondContact O-CG1 3.43Å; I333-I337 PolarHBondContact O-N 2.87Å
334L93Very high84.9Confident70 Ų7062.1 Ų62.137%0.36632%0.319SS..Hα-helixtrans-63.4-45.3174.4-72.7173.1000111.9V330 F331 T332 F336 I337 F338V330-L334 HydrophobicContact CG1-CD1 4.39Å; V330-L334 WeakPolarHBondContact O-CG 3.44Å; V330-L334 PolarHBondContact O-N 3.35Å; F331-L334 HydrophobicContact CD1-CD1 4.48Å; F331-L334 PolarHBondContact O-N 3.35Å; T332-L334 VanDerWaalsContact C-N 3.33Å; L334-F336 PolarHBondContact O-N 2.93Å; L334-I337 PolarHBondContact O-N 2.82Å; L334-I337 VanDerWaalsContact O-N 3.17Å; L334-F338 HydrophobicContact CB-CE2 4.35Å; L334-F338 VanDerWaalsContact O-CD2 3.28Å; L334-F338 WeakPolarHBondContact O-CD2 3.29Å; L334-F338 WeakPolarHBondContact O-CG 3.44Å; L334-F338 PolarHBondContact O-N 3.32Å
335S92.5Very high87.3Confident37 Ų3759 Ų5926%0.25930%0.301SS..Hα-helixtrans-59-36.9173.2-63.60000112F331 T332 F338 Y339F331-S335 PolarHBondContact O-N 3.01Å; F331-S335 PolarHBondContact O-OG 2.96Å; F331-S335 VanDerWaalsContact O-OG 3.06Å; T332-S335 PolarHBondContact O-N 3.37Å; S335-F338 PolarHBondContact O-N 3.34Å; S335-Y339 VanDerWaalsContact O-CD2 3.31Å; S335-Y339 WeakPolarHBondContact O-CD2 3.33Å; S335-Y339 PolarHBondContact O-N 3.44Å
336F94.8Very high89.7Confident11 Ų1152.2 Ų52.25%0.04827%0.265CS..Hα-helixtrans-60.4-52172.5-171-84.4000111.5V32 L36 Y39 F264 T332 I333 L334 F338 N340V32-F336 HydrophobicContact CG1-CD1 3.92Å; V32-F336 HydrophobicContact CG1-CE1 3.74Å; L36-F336 HydrophobicContact CB-CD1 4.03Å; L36-F336 HydrophobicContact CB-CE1 3.82Å; L36-F336 HydrophobicContact CD1-CB 4.34Å; L36-F336 HydrophobicContact CD1-CD1 3.64Å; L36-F336 HydrophobicContact CD1-CE1 4.22Å; L36-F336 HydrophobicContact CD1-CG 4.11Å; L36-F336 HydrophobicContact CG-CD1 4.42Å; Y39-F336 HydrophobicContact CD1-CD2 4.28Å; Y39-F336 AromaticContact CD2-CD2 3.86Å; Y39-F336 HydrophobicContact CD2-CD2 3.86Å; Y39-F336 AromaticContact CD2-CE2 3.91Å; Y39-F336 HydrophobicContact CD2-CE2 3.91Å; Y39-F336 HydrophobicContact CE2-CD2 4.34Å; Y39-F336 AromaticContact CG-CD2 3.82Å; Y39-F336 HydrophobicContact CG-CD2 3.82Å; Y39-F336 AromaticContact CG-CE2 3.9Å; Y39-F336 HydrophobicContact CG-CE2 3.9Å; F264-F336 HydrophobicContact CB-CD2 4.49Å; F264-F336 HydrophobicContact CB-CE2 4.48Å; F264-F336 AromaticContact CD1-CD2 3.62Å; F264-F336 HydrophobicContact CD1-CD2 3.62Å; F264-F336 HydrophobicContact CD1-CE2 4.37Å; F264-F336 AromaticContact CD2-CD2 3.85Å; F264-F336 HydrophobicContact CD2-CD2 3.85Å; F264-F336 AromaticContact CD2-CE2 3.95Å; F264-F336 HydrophobicContact CD2-CE2 3.95Å; F264-F336 HydrophobicContact CE1-CB 3.89Å; F264-F336 AromaticContact CE1-CD2 3.72Å; F264-F336 HydrophobicContact CE1-CD2 3.72Å; F264-F336 HydrophobicContact CE1-CG 4.22Å; F264-F336 AromaticContact CE2-CD2 3.93Å; F264-F336 HydrophobicContact CE2-CD2 3.93Å; F264-F336 HydrophobicContact CE2-CE2 4.29Å; F264-F336 AromaticContact CG-CD2 3.72Å; F264-F336 HydrophobicContact CG-CD2 3.72Å; F264-F336 HydrophobicContact CG-CE2 4.01Å; F264-F336 VanDerWaalsContact CZ-CA 3.41Å; F264-F336 HydrophobicContact CZ-CB 4.13Å; F264-F336 AromaticContact CZ-CD2 3.89Å; F264-F336 HydrophobicContact CZ-CD2 3.89Å; F264-F336 HydrophobicContact CZ-CG 4.26Å; T332-F336 WeakPolarHBondContact O-CB 3.27Å; T332-F336 PolarHBondContact O-N 3.49Å; I333-F336 WeakPolarHBondContact O-CB 3.42Å; I333-F336 PolarHBondContact O-N 3.14Å; L334-F336 PolarHBondContact O-N 2.93Å; F336-F338 VanDerWaalsContact C-N 3.26Å; F336-F338 PolarHBondContact O-N 2.98Å; F336-N340 HydrophobicContact CD1-CB 4.11Å; F336-N340 HydrophobicContact CE1-CB 3.86Å; F336-N340 HydrophobicContact CE2-CB 4.35Å; F336-N340 HydrophobicContact CG-CB 4.48Å; F336-N340 HydrophobicContact CZ-CB 3.98Å; F336-N340 WeakPolarHBondContact O-CB 3.14Å; F336-N340 PolarHBondContact O-N 3.42Å
337I95Very high91.5Very high30 Ų3052.1 Ų52.115%0.15426%0.256CS..Hα-helixtrans-57.7-41.4178.3-66.3165.6000111L28 V32 L36 I333 L334 G341L28-I337 HydrophobicContact CD2-CG2 3.74Å; L28-I337 HydrophobicContact CG-CG2 4.47Å; V32-I337 HydrophobicContact CG1-CG1 4.44Å; L36-I337 HydrophobicContact CD2-CD1 4.36Å; L36-I337 HydrophobicContact CD2-CG1 4.3Å; I333-I337 HydrophobicContact CG2-CD1 4.15Å; I333-I337 WeakPolarHBondContact O-CG1 3.43Å; I333-I337 PolarHBondContact O-N 2.87Å; L334-I337 PolarHBondContact O-N 2.82Å; L334-I337 VanDerWaalsContact O-N 3.17Å; I337-G341 WeakPolarHBondContact O-CA 3.45Å; I337-G341 PolarHBondContact O-N 3Å
338F93.4Very high92.5Very high133 Ų13349.6 Ų49.658%0.58324%0.244SC*.Hα-helixtrans-70.2-55.4179.5-64-38.6000113.3L334 S335 F336 W342L334-F338 HydrophobicContact CB-CE2 4.35Å; L334-F338 VanDerWaalsContact O-CD2 3.28Å; L334-F338 WeakPolarHBondContact O-CD2 3.29Å; L334-F338 WeakPolarHBondContact O-CG 3.44Å; L334-F338 PolarHBondContact O-N 3.32Å; S335-F338 PolarHBondContact O-N 3.34Å; F336-F338 VanDerWaalsContact C-N 3.26Å; F336-F338 PolarHBondContact O-N 2.98Å; F338-W342 WeakPolarHBondContact O-CB 3.32Å; F338-W342 PolarHBondContact O-N 3.43Å
339Y94.3Very high93Very high53 Ų5346.1 Ų46.121%0.20823%0.226CC..Hα-helixtrans-75.4-43.6-175-66.4-63.9000113L82 S83 L86 Y263 F264 S335 G341 W342 L343L82-Y339 HydrophobicContact CB-CD1 4.11Å; L82-Y339 HydrophobicContact CB-CE1 3.93Å; L82-Y339 HydrophobicContact CD1-CD1 4.39Å; L82-Y339 HydrophobicContact CD1-CD2 4.22Å; L82-Y339 HydrophobicContact CD1-CG 4.14Å; S83-Y339 WeakPolarHBondContact OG-CE1 3.5Å; S83-Y339 PolarHBondContact OG-OH 2.91Å; S83-Y339 VanDerWaalsContact OG-OH 3.06Å; L86-Y339 HydrophobicContact CD1-CD1 3.66Å; L86-Y339 HydrophobicContact CD1-CG 4.34Å; Y263-Y339 HydrophobicContact CE1-CD2 4.34Å; F264-Y339 HydrophobicContact CZ-CD2 4.28Å; S335-Y339 VanDerWaalsContact O-CD2 3.31Å; S335-Y339 WeakPolarHBondContact O-CD2 3.33Å; S335-Y339 PolarHBondContact O-N 3.44Å; Y339-G341 VanDerWaalsContact C-N 3.31Å; Y339-W342 PolarHBondContact O-N 3.11Å; Y339-L343 PolarHBondContact O-N 3.04Å
340N94.9Very high93.3Very high8 Ų847.5 Ų47.54%0.04323%0.234CC..Hα-helixtrans-69.4-35.1175.9-172.267.7000110.7F264 F336 L343 K344F264-N340 HydrophobicContact CE2-CB 4.14Å; F336-N340 HydrophobicContact CD1-CB 4.11Å; F336-N340 HydrophobicContact CE1-CB 3.86Å; F336-N340 HydrophobicContact CE2-CB 4.35Å; F336-N340 HydrophobicContact CG-CB 4.48Å; F336-N340 HydrophobicContact CZ-CB 3.98Å; F336-N340 WeakPolarHBondContact O-CB 3.14Å; F336-N340 PolarHBondContact O-N 3.42Å; N340-L343 PolarHBondContact O-N 3.04Å; N340-K344 WeakPolarHBondContact O-CB 3.22Å; N340-K344 VanDerWaalsContact O-CG 3.26Å; N340-K344 WeakPolarHBondContact O-CG 3.31Å; N340-K344 PolarHBondContact O-N 3.42Å
341G94.9Very high93.3Very high1 Ų146.3 Ų46.31%0.0123%0.23CC..Hα-helixtrans-62.5-43.3172.500000112.8V32 I337 Y339 L343 K344 V345V32-G341 VanDerWaalsContact CG2-CA 3.46Å; I337-G341 WeakPolarHBondContact O-CA 3.45Å; I337-G341 PolarHBondContact O-N 3Å; Y339-G341 VanDerWaalsContact C-N 3.31Å; G341-L343 PolarHBondContact O-N 3.37Å; G341-K344 WeakPolarHBondContact O-CB 3.28Å; G341-K344 PolarHBondContact O-N 2.88Å; G341-K344 VanDerWaalsContact O-N 3.14Å; G341-V345 WeakPolarHBondContact O-CG2 3.15Å; G341-V345 PolarHBondContact O-N 2.81Å
342W94.5Very high93.5Very high85 Ų8538.3 Ų38.332%0.32220%0.195SC..Hα-helixtrans-65.5-38.5176.8-160.315.5000112.5S83 L86 A87 V90 F338 Y339 K344 V345 A346S83-W342 WeakPolarHBondContact O-CH2 3.21Å; S83-W342 WeakPolarHBondContact O-CZ3 3.49Å; L86-W342 HydrophobicContact CB-CD2 3.97Å; L86-W342 HydrophobicContact CB-CE3 3.54Å; L86-W342 HydrophobicContact CB-CH2 4.39Å; L86-W342 HydrophobicContact CB-CZ3 3.79Å; L86-W342 HydrophobicContact CD1-CE3 4.01Å; L86-W342 HydrophobicContact CG-CE3 4.36Å; A87-W342 HydrophobicContact CB-CH2 3.68Å; A87-W342 HydrophobicContact CB-CZ2 3.92Å; V90-W342 HydrophobicContact CG2-CD2 4.48Å; V90-W342 HydrophobicContact CG2-CG 4.14Å; V90-W342 WeakPolarHBondContact CG2-O 3.42Å; F338-W342 WeakPolarHBondContact O-CB 3.32Å; F338-W342 PolarHBondContact O-N 3.43Å; Y339-W342 PolarHBondContact O-N 3.11Å; W342-K344 VanDerWaalsContact C-N 3.35Å; W342-V345 PolarHBondContact O-N 3.13Å; W342-A346 PolarHBondContact O-N 2.9Å
343L95.6Very high93.7Very high9 Ų938 Ų385%0.04719%0.193CC..Hα-helixtrans-60.4-44.4169.6179.961.3000111.4L86 Y89 V256 V260 Y261 Y339 N340 G341 V345 A346 E347L86-L343 HydrophobicContact CD2-CB 3.96Å; L86-L343 HydrophobicContact CD2-CD1 4.23Å; Y89-L343 HydrophobicContact CE1-CD1 4.23Å; V256-L343 HydrophobicContact CG1-CD1 3.99Å; V260-L343 HydrophobicContact CB-CD2 4.02Å; V260-L343 HydrophobicContact CG1-CD2 4.01Å; V260-L343 HydrophobicContact CG2-CD2 4.21Å; Y261-L343 HydrophobicContact CE1-CD2 4.11Å; Y339-L343 PolarHBondContact O-N 3.04Å; N340-L343 PolarHBondContact O-N 3.04Å; G341-L343 PolarHBondContact O-N 3.37Å; L343-V345 VanDerWaalsContact C-N 3.3Å; L343-V345 PolarHBondContact O-N 2.92Å; L343-A346 WeakPolarHBondContact O-CB 3.5Å; L343-A346 PolarHBondContact O-N 3.33Å; L343-A346 VanDerWaalsContact O-N 3.09Å; L343-E347 PolarHBondContact O-N 3.23Å
344K94.6Very high93.5Very high39 Ų3937 Ų3717%0.1719%0.191CC..Hα-helixtrans-63.8-32.4178.4-76.7-70.7175.1-162.70113.3L31 V32 N340 G341 W342 A346 E347 S348L31-K344 HydrophobicContact CB-CB 3.99Å; L31-K344 HydrophobicContact CB-CD 4.37Å; L31-K344 HydrophobicContact CB-CG 4.2Å; L31-K344 HydrophobicContact CD1-CB 4.35Å; V32-K344 HydrophobicContact CG2-CG 4.36Å; N340-K344 WeakPolarHBondContact O-CB 3.22Å; N340-K344 VanDerWaalsContact O-CG 3.26Å; N340-K344 WeakPolarHBondContact O-CG 3.31Å; N340-K344 PolarHBondContact O-N 3.42Å; G341-K344 WeakPolarHBondContact O-CB 3.28Å; G341-K344 PolarHBondContact O-N 2.88Å; G341-K344 VanDerWaalsContact O-N 3.14Å; W342-K344 VanDerWaalsContact C-N 3.35Å; K344-A346 VanDerWaalsContact C-N 3.33Å; K344-E347 WeakPolarHBondContact CD-OE2 3.41Å; K344-E347 WeakPolarHBondContact CE-OE2 3.14Å; K344-E347 IonicContact NZ-OE1 2.79Å; K344-E347 PolarHBondContact NZ-OE1 3.4Å; K344-E347 IonicContact NZ-OE2 2.72Å; K344-E347 PolarHBondContact NZ-OE2 3.25Å; K344-E347 PolarHBondContact O-N 3.38Å; K344-S348 PolarHBondContact O-N 3.49Å; K344-S348 PolarHBondContact O-OG 2.99Å
345V93.5Very high93.4Very high52 Ų5238.7 Ų38.732%0.31520%0.2SC..Hα-helixtrans-60.9-43.5170.9173.60000110.8G341 W342 L343 S348 L349G341-V345 WeakPolarHBondContact O-CG2 3.15Å; G341-V345 PolarHBondContact O-N 2.81Å; W342-V345 PolarHBondContact O-N 3.13Å; L343-V345 VanDerWaalsContact C-N 3.3Å; L343-V345 PolarHBondContact O-N 2.92Å; V345-S348 PolarHBondContact O-OG 2.81Å; V345-S348 VanDerWaalsContact O-OG 3.08Å; V345-L349 HydrophobicContact CG1-CD1 3.89Å; V345-L349 WeakPolarHBondContact O-CB 3.31Å; V345-L349 WeakPolarHBondContact O-CD1 3.3Å; V345-L349 WeakPolarHBondContact O-CG 3.45Å; V345-L349 PolarHBondContact O-N 3.05Å
346A94.6Very high93.3Very high0 Ų040.9 Ų40.90%021%0.209CC..Hα-helixtrans-67.9-39.5175.200000111.8Y89 V90 V93 W342 L343 K344 S348 L349 V350Y89-A346 HydrophobicContact CD1-CB 3.71Å; Y89-A346 HydrophobicContact CE1-CB 3.31Å; V90-A346 HydrophobicContact CG2-CB 3.86Å; V93-A346 HydrophobicContact CB-CB 4.32Å; V93-A346 WeakPolarHBondContact CG1-O 3.29Å; V93-A346 HydrophobicContact CG2-CB 4.19Å; W342-A346 PolarHBondContact O-N 2.9Å; L343-A346 WeakPolarHBondContact O-CB 3.5Å; L343-A346 PolarHBondContact O-N 3.33Å; L343-A346 VanDerWaalsContact O-N 3.09Å; K344-A346 VanDerWaalsContact C-N 3.33Å; A346-S348 PolarHBondContact O-N 3.32Å; A346-L349 PolarHBondContact O-N 3.19Å; A346-V350 PolarHBondContact O-N 2.9Å
347E93.3Very high93Very high93 Ų9341.8 Ų41.844%0.43521%0.214SC..Hα-helixtrans-59.6-45.2177.5-165.6178.814500112.1L343 K344 L349 V350L343-E347 PolarHBondContact O-N 3.23Å; K344-E347 WeakPolarHBondContact CD-OE2 3.41Å; K344-E347 WeakPolarHBondContact CE-OE2 3.14Å; K344-E347 IonicContact NZ-OE1 2.79Å; K344-E347 PolarHBondContact NZ-OE1 3.4Å; K344-E347 IonicContact NZ-OE2 2.72Å; K344-E347 PolarHBondContact NZ-OE2 3.25Å; K344-E347 PolarHBondContact O-N 3.38Å; E347-L349 PolarHBondContact O-N 3.19Å; E347-V350 WeakPolarHBondContact O-CG1 3.2Å; E347-V350 PolarHBondContact O-N 3.06Å
348S91.8Very high92.6Very high14 Ų1442.1 Ų42.110%0.09822%0.216CC..Hα-helixtrans-70.6-17.917965.30000113.9K344 V345 A346K344-S348 PolarHBondContact O-N 3.49Å; K344-S348 PolarHBondContact O-OG 2.99Å; V345-S348 PolarHBondContact O-OG 2.81Å; V345-S348 VanDerWaalsContact O-OG 3.08Å; A346-S348 PolarHBondContact O-N 3.32Å
349L93.3Very high92.6Very high22 Ų2236 Ų3612%0.11519%0.19CC..Hα-helixtrans-103.4-10.3-178.4-63177.5000112.9V93 V94 W97 V345 A346 E347 S351V93-L349 HydrophobicContact CG1-CB 3.73Å; V94-L349 HydrophobicContact CG2-CD1 3.77Å; W97-L349 HydrophobicContact CB-CB 4.3Å; W97-L349 HydrophobicContact CD2-CD2 4.25Å; W97-L349 HydrophobicContact CG-CB 4.31Å; W97-L349 HydrophobicContact CG-CD2 4Å; V345-L349 HydrophobicContact CG1-CD1 3.89Å; V345-L349 WeakPolarHBondContact O-CB 3.31Å; V345-L349 WeakPolarHBondContact O-CD1 3.3Å; V345-L349 WeakPolarHBondContact O-CG 3.45Å; V345-L349 PolarHBondContact O-N 3.05Å; A346-L349 PolarHBondContact O-N 3.19Å; E347-L349 PolarHBondContact O-N 3.19Å; L349-S351 VanDerWaalsContact C-N 3.29Å; L349-S351 PolarHBondContact O-N 3.25Å
350V92.6Very high92.6Very high40 Ų4034.5 Ų34.524%0.24218%0.184CC..Hα-helixtrans-68-32.1-177.488.50000111.7V93 V248 A346 E347V93-V350 HydrophobicContact CG1-CB 4.31Å; V93-V350 HydrophobicContact CG2-CG2 4.46Å; V248-V350 HydrophobicContact CG2-CG2 4.18Å; A346-V350 PolarHBondContact O-N 2.9Å; E347-V350 WeakPolarHBondContact O-CG1 3.2Å; E347-V350 PolarHBondContact O-N 3.06Å
351S90.1Very high92.4Very high60 Ų6039.3 Ų39.342%0.4221%0.207SC..  trans-130.579.5179.2-1690000110.6L349 F353 G354L349-S351 VanDerWaalsContact C-N 3.29Å; L349-S351 PolarHBondContact O-N 3.25Å; S351-F353 PolarHBondContact O-N 3.09Å; S351-G354 PolarHBondContact O-N 3.42Å
352P93Very high92.3Very high1 Ų139.4 Ų39.41%0.00621%0.207CC..THydrogen-bonded Turntrans-72.73.1-173.430.2-35.8000115D359 F360P352-D359 WeakPolarHBondContact CA-OD1 3.36Å; P352-D359 WeakPolarHBondContact O-CB 3.45Å; P352-F360 HydrophobicContact CB-CD2 3.79Å; P352-F360 HydrophobicContact CB-CE1 4.3Å; P352-F360 HydrophobicContact CB-CE2 3.52Å; P352-F360 HydrophobicContact CB-CG 4.29Å; P352-F360 HydrophobicContact CB-CZ 3.78Å; P352-F360 HydrophobicContact CG-CD2 4.16Å; P352-F360 HydrophobicContact CG-CE2 3.66Å; P352-F360 HydrophobicContact CG-CZ 4.2Å; P352-F360 PolarHBondContact O-N 2.88Å
353F93.7Very high92.1Very high5 Ų536.6 Ų36.62%0.02220%0.199CC..THydrogen-bonded Turntrans-105.914-179.6-69.8-72.5000112.6L104 I159 S160 I161 L240 S351 F360 V362L104-F353 HydrophobicContact CD2-CE1 3.99Å; L104-F353 HydrophobicContact CD2-CZ 4.06Å; I159-F353 HydrophobicContact CD1-CD1 4.11Å; I159-F353 HydrophobicContact CD1-CD2 4.26Å; I159-F353 HydrophobicContact CD1-CE1 3.8Å; I159-F353 HydrophobicContact CD1-CE2 3.97Å; I159-F353 HydrophobicContact CD1-CG 4.33Å; I159-F353 HydrophobicContact CD1-CZ 3.73Å; I159-F353 HydrophobicContact CG1-CD1 4.26Å; I159-F353 HydrophobicContact CG1-CE1 4.43Å; I159-F353 HydrophobicContact CG1-CG 4.35Å; I159-F353 WeakPolarHBondContact O-CB 3.24Å; S160-F353 WeakPolarHBondContact CA-O 3.4Å; S160-F353 PolarHBondContact OG-O 3.14Å; I161-F353 PolarHBondContact N-O 3.26Å; I161-F353 VanDerWaalsContact N-O 3.14Å; L240-F353 HydrophobicContact CD1-CZ 4.27Å; L240-F353 HydrophobicContact CD2-CE2 4.24Å; L240-F353 HydrophobicContact CD2-CZ 3.9Å; S351-F353 PolarHBondContact O-N 3.09Å; F353-F360 HydrophobicContact CD1-CD2 4.4Å; F353-F360 AromaticContact CE1-CD2 3.95Å; F353-F360 HydrophobicContact CE1-CD2 3.95Å; F353-F360 HydrophobicContact CE2-CD2 4.39Å; F353-F360 AromaticContact CZ-CD2 3.93Å; F353-F360 HydrophobicContact CZ-CD2 3.93Å; F353-F360 HydrophobicContact CZ-CE2 4.37Å; F353-V362 HydrophobicContact CD1-CG2 3.61Å; F353-V362 HydrophobicContact CE1-CG2 3.72Å
354G90.8Very high92Very high15 Ų1539 Ų3916%0.15522%0.215CC..SBendtrans-79-138.6178.600000113.7S351 D359S351-G354 PolarHBondContact O-N 3.42Å; G354-D359 WeakPolarHBondContact CA-OD2 3.35Å; G354-D359 PolarHBondContact N-OD2 3.38Å
355L90.2Very high92Very high105 Ų10538.8 Ų38.855%0.5522%0.215SC..SBendtrans-132.313.3-177.8-63.7173.9000112.1I161 D359I161-L355 HydrophobicContact CB-CG 4.37Å; I161-L355 HydrophobicContact CG2-CD1 3.92Å; I161-L355 HydrophobicContact CG2-CG 4.17Å; L355-D359 PolarHBondContact N-OD2 3.01Å
356D89.9Confident92Very high83 Ų8336.5 Ų36.544%0.44420%0.201SC..SBendtrans-68.1157.7177.5-76.9-26.7000110.9D358 D359D356-D358 PolarHBondContact O-N 3.3Å; D356-D359 WeakPolarHBondContact CB-OD2 3.31Å; D356-D359 PolarHBondContact N-OD2 3.4Å; D356-D359 PolarHBondContact O-N 3.32Å
357D88.5Confident92Very high29 Ų2939.3 Ų39.316%0.15522%0.215CC..THydrogen-bonded Turntrans-57.5-28.2-177.6-77.6-13.6000112.3T2 V3 R25 G26 K30T2-D357 WeakPolarHBondContact CB-O 3Å; T2-D357 PolarHBondContact OG1-O 2.85Å; V3-D357 HydrophobicContact CG2-CB 4.25Å; V3-D357 WeakPolarHBondContact CG2-O 3.36Å; R25-D357 HydrophobicContact CG-CB 4.29Å; R25-D357 WeakPolarHBondContact CG-OD2 3.43Å; G26-D357 PolarHBondContact N-OD2 2.88Å; K30-D357 WeakPolarHBondContact CD-OD2 3.36Å; K30-D357 IonicContact NZ-OD1 2.7Å; K30-D357 PolarHBondContact NZ-OD1 3.5Å; K30-D357 IonicContact NZ-OD2 3.98Å; K30-D357 PolarHBondContact NZ-OD2 3.47Å
358D87.3Confident92.1Very high37 Ų3739.7 Ų39.720%0.19821%0.212CC..THydrogen-bonded Turntrans-103.82.3-174.8-81.2-49.7000115.1T2 V3 G26 D356T2-D358 WeakPolarHBondContact OG1-CA 3.41Å; V3-D358 WeakPolarHBondContact CB-OD1 3.37Å; V3-D358 VanDerWaalsContact CG2-OD1 3.23Å; V3-D358 WeakPolarHBondContact CG2-OD1 3.34Å; G26-D358 WeakPolarHBondContact CA-OD2 3.35Å; D356-D358 PolarHBondContact O-N 3.3Å
359D93.3Very high92.2Very high6 Ų639 Ų393%0.03221%0.207CC..SBendtrans-67167.3178.9-77.4-17.7000112.8T2 P352 G354 L355 D356 E361T2-D359 WeakPolarHBondContact CG2-O 3.48Å; P352-D359 WeakPolarHBondContact CA-OD1 3.36Å; P352-D359 WeakPolarHBondContact O-CB 3.45Å; G354-D359 WeakPolarHBondContact CA-OD2 3.35Å; G354-D359 PolarHBondContact N-OD2 3.38Å; L355-D359 PolarHBondContact N-OD2 3.01Å; D356-D359 WeakPolarHBondContact CB-OD2 3.31Å; D356-D359 PolarHBondContact N-OD2 3.4Å; D356-D359 PolarHBondContact O-N 3.32Å; D359-E361 PolarHBondContact O-N 3.36Å
360F93.5Very high92.3Very high21 Ų2139.2 Ų39.29%0.09221%0.209CC..  trans-71.4130.2179.4-59.9-30.6000111.9W97 Q100 F101 L104 P352 F353 V362W97-F360 AromaticContact CD1-CZ 3.97Å; W97-F360 AromaticContact CE2-CE1 3.71Å; W97-F360 AromaticContact CE2-CZ 3.95Å; W97-F360 AromaticContact CZ2-CE1 3.84Å; W97-F360 HydrophobicContact CZ2-CE1 3.84Å; W97-F360 HydrophobicContact CZ2-CZ 4.44Å; W97-F360 AromaticContact NE1-CE1 3.44Å; W97-F360 AromaticContact NE1-CZ 3.57Å; Q100-F360 HydrophobicContact CB-CE2 4.11Å; F101-F360 HydrophobicContact CB-CE1 3.93Å; F101-F360 HydrophobicContact CB-CE2 4.36Å; F101-F360 HydrophobicContact CB-CZ 3.56Å; F101-F360 HydrophobicContact CD2-CD1 4.1Å; F101-F360 AromaticContact CD2-CE1 3.65Å; F101-F360 HydrophobicContact CD2-CE1 3.65Å; F101-F360 HydrophobicContact CD2-CZ 4.09Å; F101-F360 HydrophobicContact CG-CE1 4.22Å; F101-F360 HydrophobicContact CG-CZ 4.32Å; L104-F360 HydrophobicContact CD1-CB 4.41Å; L104-F360 HydrophobicContact CD1-CD1 4.46Å; L104-F360 HydrophobicContact CD1-CD2 4.05Å; L104-F360 HydrophobicContact CD1-CE2 4.45Å; L104-F360 HydrophobicContact CD1-CG 4.06Å; L104-F360 HydrophobicContact CD2-CD2 4.4Å; P352-F360 HydrophobicContact CB-CD2 3.79Å; P352-F360 HydrophobicContact CB-CE1 4.3Å; P352-F360 HydrophobicContact CB-CE2 3.52Å; P352-F360 HydrophobicContact CB-CG 4.29Å; P352-F360 HydrophobicContact CB-CZ 3.78Å; P352-F360 HydrophobicContact CG-CD2 4.16Å; P352-F360 HydrophobicContact CG-CE2 3.66Å; P352-F360 HydrophobicContact CG-CZ 4.2Å; P352-F360 PolarHBondContact O-N 2.88Å; F353-F360 HydrophobicContact CD1-CD2 4.4Å; F353-F360 AromaticContact CE1-CD2 3.95Å; F353-F360 HydrophobicContact CE1-CD2 3.95Å; F353-F360 HydrophobicContact CE2-CD2 4.39Å; F353-F360 AromaticContact CZ-CD2 3.93Å; F353-F360 HydrophobicContact CZ-CD2 3.93Å; F353-F360 HydrophobicContact CZ-CE2 4.37Å; F360-V362 HydrophobicContact CB-CG2 4.11Å; F360-V362 PolarHBondContact O-N 2.87Å
361E90.9Very high92.4Very high109 Ų10941.5 Ų41.551%0.50922%0.219SC..  trans-77.768.8173.4-61.7-170.914500111.3T2 D359 V363 P364 L365T2-E361 HydrophobicContact CG2-CG 3.2Å; T2-E361 WeakPolarHBondContact CG2-OE1 3.47Å; D359-E361 PolarHBondContact O-N 3.36Å; E361-V363 VanDerWaalsContact C-N 3.27Å; E361-V363 PolarHBondContact O-N 3.38Å; E361-P364 HydrophobicContact CB-CB 4.22Å; E361-P364 HydrophobicContact CB-CG 3.9Å; E361-P364 WeakPolarHBondContact O-CD 3.34Å; E361-L365 WeakPolarHBondContact O-CB 3.32Å; E361-L365 PolarHBondContact O-N 3.29Å
362V92.6Very high92.6Very high3 Ų340.1 Ų40.12%0.01821%0.208CC..Hα-helixtrans-63.8-35.3-176.3-173.70000112.3F156 M163 F353 F360 L365 L366F156-V362 HydrophobicContact CB-CG1 3.64Å; F156-V362 HydrophobicContact CD1-CG1 3.46Å; F156-V362 VanDerWaalsContact CD1-CG1 3.46Å; F156-V362 HydrophobicContact CD2-CG1 3.12Å; F156-V362 HydrophobicContact CE1-CG1 3.78Å; F156-V362 HydrophobicContact CE2-CG1 3.44Å; F156-V362 VanDerWaalsContact CE2-CG1 3.44Å; F156-V362 HydrophobicContact CG-CG1 3.12Å; F156-V362 HydrophobicContact CZ-CG1 3.76Å; M163-V362 HydrophobicContact CE-CB 4.45Å; M163-V362 HydrophobicContact CE-CG1 3.76Å; F353-V362 HydrophobicContact CD1-CG2 3.61Å; F353-V362 HydrophobicContact CE1-CG2 3.72Å; F360-V362 HydrophobicContact CB-CG2 4.11Å; F360-V362 PolarHBondContact O-N 2.87Å; V362-L365 WeakPolarHBondContact O-CB 3.39Å; V362-L365 PolarHBondContact O-N 3.17Å; V362-L366 WeakPolarHBondContact O-CB 3.17Å; V362-L366 PolarHBondContact O-N 3.31Å
363V92Very high92.6Very high25 Ų2540 Ų4015%0.15221%0.208CC..Hα-helixtrans-67.9-54.4-179167.90000111.2M163 E361 L365 L366 E367M163-V363 HydrophobicContact CE-CG2 3.86Å; M163-V363 HydrophobicContact SD-CG2 3.91Å; E361-V363 VanDerWaalsContact C-N 3.27Å; E361-V363 PolarHBondContact O-N 3.38Å; V363-L365 PolarHBondContact O-N 3.03Å; V363-L366 PolarHBondContact O-N 3.13Å; V363-L366 VanDerWaalsContact O-N 3.16Å; V363-E367 PolarHBondContact O-N 2.94Å
364P92.7Very high92.6Very high59 Ų5941.4 Ų41.438%0.38322%0.215SC..Hα-helixtrans-57.2-34.3169.4-29.736.9000114.2E361 E367 R368E361-P364 HydrophobicContact CB-CB 4.22Å; E361-P364 HydrophobicContact CB-CG 3.9Å; E361-P364 WeakPolarHBondContact O-CD 3.34Å; P364-E367 PolarHBondContact O-N 3.35Å; P364-R368 VanDerWaalsContact O-CB 3.3Å; P364-R368 WeakPolarHBondContact O-CB 3.45Å; P364-R368 PolarHBondContact O-N 3.47Å
365L94.2Very high92.6Very high35 Ų3545.7 Ų45.718%0.18323%0.228CC..Hα-helixtrans-62.5-45.9174.6178.166.3000111.3L104 F156 E361 V362 V363 R368 N369L104-L365 HydrophobicContact CB-CD2 4.15Å; L104-L365 HydrophobicContact CD1-CD2 4.45Å; L104-L365 HydrophobicContact CD2-CD2 4.25Å; F156-L365 HydrophobicContact CZ-CD2 4.34Å; E361-L365 WeakPolarHBondContact O-CB 3.32Å; E361-L365 PolarHBondContact O-N 3.29Å; V362-L365 WeakPolarHBondContact O-CB 3.39Å; V362-L365 PolarHBondContact O-N 3.17Å; V363-L365 PolarHBondContact O-N 3.03Å; L365-R368 PolarHBondContact O-N 3.2Å; L365-N369 VanDerWaalsContact O-CB 3.32Å; L365-N369 WeakPolarHBondContact O-CB 3.26Å; L365-N369 PolarHBondContact O-N 3.14Å; L365-N369 PolarHBondContact O-OD1 2.91Å
366L94Very high92.7Very high4 Ų443 Ų432%0.02121%0.211CC..Hα-helixtrans-63.6-42.7177.9-176.664.8000111.4A153 M163 L178 V362 V363 N369 L370A153-L366 HydrophobicContact CB-CD1 4.35Å; A153-L366 HydrophobicContact CB-CD2 3.75Å; M163-L366 HydrophobicContact CE-CB 4.12Å; M163-L366 HydrophobicContact CE-CD2 3.68Å; M163-L366 HydrophobicContact SD-CD2 4.17Å; L178-L366 HydrophobicContact CD1-CD2 4.45Å; V362-L366 WeakPolarHBondContact O-CB 3.17Å; V362-L366 PolarHBondContact O-N 3.31Å; V363-L366 PolarHBondContact O-N 3.13Å; V363-L366 VanDerWaalsContact O-N 3.16Å; L366-N369 PolarHBondContact O-N 2.93Å; L366-L370 WeakPolarHBondContact O-CB 3.19Å; L366-L370 PolarHBondContact O-N 3.41Å
367E93.7Very high92.8Very high60 Ų6039 Ų3928%0.2819%0.19SC..Hα-helixtrans-61.9-43.6175-71.1177.6171.700111.7R166 V363 P364 N369 L370 N371 L492R166-E367 IonicContact CZ-OE1 3.15Å; R166-E367 IonicContact NH1-OE1 2.94Å; R166-E367 PolarHBondContact NH1-OE1 3.22Å; R166-E367 IonicContact NH2-OE1 2.71Å; R166-E367 PolarHBondContact NH2-OE1 3.21Å; V363-E367 PolarHBondContact O-N 2.94Å; P364-E367 PolarHBondContact O-N 3.35Å; E367-N369 VanDerWaalsContact C-N 3.33Å; E367-N369 PolarHBondContact O-N 3.37Å; E367-L370 PolarHBondContact O-N 2.92Å; E367-N371 WeakPolarHBondContact O-CB 3.38Å; E367-N371 PolarHBondContact O-N 3.42Å; E367-N371 PolarHBondContact O-ND2 3.13Å; E367-L492 HydrophobicContact CG-CD2 4.5Å
368R95.4Very high92.9Very high100 Ų10039 Ų3938%0.37719%0.19SC..Hα-helixtrans-61-43.8174.2176.8-95.8156.5164.2-2.8111.1D108 P364 L365 T372D108-R368 VanDerWaalsContact CG-NH2 3.29Å; D108-R368 IonicContact OD1-CZ 2.62Å; D108-R368 IonicContact OD1-NH1 3.71Å; D108-R368 IonicContact OD1-NH2 3.48Å; D108-R368 PolarHBondContact OD1-NH2 2.94Å; D108-R368 IonicContact OD2-CZ 2.95Å; D108-R368 IonicContact OD2-NH1 3.42Å; D108-R368 PolarHBondContact OD2-NH1 3.38Å; D108-R368 VanDerWaalsContact OD2-NH1 3.15Å; D108-R368 IonicContact OD2-NH2 2.94Å; D108-R368 PolarHBondContact OD2-NH2 2.94Å; P364-R368 VanDerWaalsContact O-CB 3.3Å; P364-R368 WeakPolarHBondContact O-CB 3.45Å; P364-R368 PolarHBondContact O-N 3.47Å; L365-R368 PolarHBondContact O-N 3.2Å; R368-T372 PolarHBondContact NE-OG1 3.35Å; R368-T372 VanDerWaalsContact NE-OG1 3.17Å; R368-T372 VanDerWaalsContact O-CB 3.24Å; R368-T372 WeakPolarHBondContact O-CB 3.28Å; R368-T372 PolarHBondContact O-N 3.32Å; R368-T372 PolarHBondContact O-OG1 2.71Å
369N95.7Very high92.7Very high0 Ų040 Ų400%020%0.197CC..Hα-helixtrans-64.3-45.7-180-76.3-6.5000110.8P105 P107 L365 L366 E367 T372 S373P105-N369 PolarHBondContact O-ND2 3.29Å; P105-N369 VanDerWaalsContact O-ND2 3.15Å; P107-N369 HydrophobicContact CG-CB 3.86Å; L365-N369 VanDerWaalsContact O-CB 3.32Å; L365-N369 WeakPolarHBondContact O-CB 3.26Å; L365-N369 PolarHBondContact O-N 3.14Å; L365-N369 PolarHBondContact O-OD1 2.91Å; L366-N369 PolarHBondContact O-N 2.93Å; E367-N369 VanDerWaalsContact C-N 3.33Å; E367-N369 PolarHBondContact O-N 3.37Å; N369-T372 PolarHBondContact O-N 2.68Å; N369-S373 WeakPolarHBondContact O-CB 3.41Å; N369-S373 PolarHBondContact O-N 3.31Å; N369-S373 PolarHBondContact O-OG 3.23Å
370L94.3Very high92.1Very high27 Ų2741.4 Ų41.414%0.14121%0.207CC..Hα-helixtrans-59.3-52.2176.9-174.464.1000111.1N149 L178 L366 E367 T372 S373 L374N149-L370 HydrophobicContact CB-CD1 4.4Å; L178-L370 HydrophobicContact CD2-CD1 4.15Å; L366-L370 WeakPolarHBondContact O-CB 3.19Å; L366-L370 PolarHBondContact O-N 3.41Å; E367-L370 PolarHBondContact O-N 2.92Å; L370-T372 PolarHBondContact O-N 2.97Å; L370-S373 WeakPolarHBondContact CA-OG 3.48Å; L370-S373 PolarHBondContact O-N 2.91Å; L370-S373 PolarHBondContact O-OG 3.11Å; L370-L374 HydrophobicContact CD1-CD1 4.31Å; L370-L374 HydrophobicContact CG-CD1 4.28Å; L370-L374 WeakPolarHBondContact O-CG 3.48Å; L370-L374 PolarHBondContact O-N 3.05Å
371N93.9Very high91.5Very high88 Ų8843 Ų4347%0.47122%0.216SC..Hα-helixtrans-60.9-46179.4-72.8-31.1000112.7E367 Y375E367-N371 WeakPolarHBondContact O-CB 3.38Å; E367-N371 PolarHBondContact O-N 3.42Å; E367-N371 PolarHBondContact O-ND2 3.13Å; N371-Y375 WeakPolarHBondContact O-CB 3.47Å; N371-Y375 PolarHBondContact O-N 3.33Å
372T94.3Very high90.8Very high30 Ų3040 Ų4018%0.18421%0.208CC..Hα-helixtrans-65.8-41.8-179.7-530000111D108 R368 N369 L370 Y375 F376D108-T372 WeakPolarHBondContact OD1-CG2 3.2Å; R368-T372 PolarHBondContact NE-OG1 3.35Å; R368-T372 VanDerWaalsContact NE-OG1 3.17Å; R368-T372 VanDerWaalsContact O-CB 3.24Å; R368-T372 WeakPolarHBondContact O-CB 3.28Å; R368-T372 PolarHBondContact O-N 3.32Å; R368-T372 PolarHBondContact O-OG1 2.71Å; N369-T372 PolarHBondContact O-N 2.68Å; L370-T372 PolarHBondContact O-N 2.97Å; T372-Y375 PolarHBondContact O-N 2.97Å; T372-F376 HydrophobicContact CG2-CD2 3.84Å; T372-F376 HydrophobicContact CG2-CE2 3.39Å; T372-F376 HydrophobicContact CG2-CZ 4.22Å; T372-F376 VanDerWaalsContact O-CD2 3.24Å; T372-F376 WeakPolarHBondContact O-CD2 3.42Å; T372-F376 PolarHBondContact O-N 2.85Å; T372-F376 VanDerWaalsContact O-N 3.11Å
373S95Very high90.1Very high0 Ų042.8 Ų42.80%022%0.223CC..Hα-helixtrans-65-42-179.370.40000111.9C111 S145 N149 N369 L370 F376 V377C111-S373 VanDerWaalsContact SG-CB 3.51Å; S145-S373 WeakPolarHBondContact OG-CB 3.46Å; S145-S373 PolarHBondContact OG-OG 3.28Å; N149-S373 PolarHBondContact ND2-OG 3.47Å; N369-S373 WeakPolarHBondContact O-CB 3.41Å; N369-S373 PolarHBondContact O-N 3.31Å; N369-S373 PolarHBondContact O-OG 3.23Å; L370-S373 WeakPolarHBondContact CA-OG 3.48Å; L370-S373 PolarHBondContact O-N 2.91Å; L370-S373 PolarHBondContact O-OG 3.11Å; S373-F376 PolarHBondContact O-N 3.44Å; S373-V377 WeakPolarHBondContact O-CG1 3.43Å; S373-V377 WeakPolarHBondContact O-CG2 3.46Å; S373-V377 PolarHBondContact O-N 2.83Å
374L92.4Very high89.1Confident33 Ų3346.3 Ų46.317%0.17325%0.246CC..Hα-helixtrans-65.1-43.9174.5-70.7175.1000111.1R142 L370 F376 V377 D378 F488R142-L374 HydrophobicContact CG-CD2 4.36Å; L370-L374 HydrophobicContact CD1-CD1 4.31Å; L370-L374 HydrophobicContact CG-CD1 4.28Å; L370-L374 WeakPolarHBondContact O-CG 3.48Å; L370-L374 PolarHBondContact O-N 3.05Å; L374-F376 VanDerWaalsContact C-N 3.33Å; L374-F376 PolarHBondContact O-N 3.43Å; L374-V377 PolarHBondContact O-N 3.34Å; L374-D378 WeakPolarHBondContact O-CB 3.44Å; L374-D378 PolarHBondContact O-N 3.02Å; L374-F488 HydrophobicContact CD1-CE2 4.46Å
375Y92Very high88.3Confident106 Ų10650.4 Ų50.442%0.41627%0.265SS..Iπ-helixtrans-54.6-47176.8178.4-99.9000112.6N371 T372 T379 C380 L386N371-Y375 WeakPolarHBondContact O-CB 3.47Å; N371-Y375 PolarHBondContact O-N 3.33Å; T372-Y375 PolarHBondContact O-N 2.97Å; Y375-T379 HydrophobicContact CD2-CG2 4.03Å; Y375-T379 HydrophobicContact CE2-CG2 4.06Å; Y375-T379 PolarHBondContact O-N 3.36Å; Y375-C380 VanDerWaalsContact CD1-SG 3.57Å; Y375-C380 WeakPolarHBondContact CE1-SG 3.29Å; Y375-C380 VanDerWaalsContact CZ-SG 3.51Å; Y375-C380 PolarHBondContact O-N 2.68Å; Y375-C380 PolarHBondContact O-SG 3.32Å; Y375-L386 HydrophobicContact CE2-CD2 4.06Å; Y375-L386 WeakPolarHBondContact OH-CD2 3.44Å
376F91.9Very high87.5Confident48 Ų4852 Ų5221%0.21127%0.273CS..Iπ-helixtrans-64.4-42.1179.1-75.4-53.1000113.6D108 C111 L112 S115 T372 S373 L374D108-F376 HydrophobicContact CB-CE2 4.24Å; C111-F376 HydrophobicContact CB-CB 3.88Å; C111-F376 HydrophobicContact CB-CD2 4.08Å; C111-F376 HydrophobicContact CB-CG 4.39Å; L112-F376 HydrophobicContact CD1-CD1 4.38Å; L112-F376 HydrophobicContact CD1-CE1 4.28Å; S115-F376 VanDerWaalsContact CB-O 3.26Å; S115-F376 WeakPolarHBondContact CB-O 3.49Å; T372-F376 HydrophobicContact CG2-CD2 3.84Å; T372-F376 HydrophobicContact CG2-CE2 3.39Å; T372-F376 HydrophobicContact CG2-CZ 4.22Å; T372-F376 VanDerWaalsContact O-CD2 3.24Å; T372-F376 WeakPolarHBondContact O-CD2 3.42Å; T372-F376 PolarHBondContact O-N 2.85Å; T372-F376 VanDerWaalsContact O-N 3.11Å; S373-F376 PolarHBondContact O-N 3.44Å; L374-F376 VanDerWaalsContact C-N 3.33Å; L374-F376 PolarHBondContact O-N 3.43Å
377V91.4Very high86.7Confident0 Ų057.5 Ų57.50%030%0.301CS..Iπ-helixtrans-88.4-9.9-170.2-610000114.7C111 L114 R141 R142 S373 L374C111-V377 HydrophobicContact CB-CG1 3.94Å; L114-V377 HydrophobicContact CD2-CG1 3.95Å; R141-V377 HydrophobicContact CB-CB 3.69Å; R141-V377 HydrophobicContact CB-CG1 4.17Å; R141-V377 HydrophobicContact CB-CG2 4.47Å; R141-V377 PolarHBondContact NE-O 2.91Å; R142-V377 HydrophobicContact CG-CG2 4.24Å; S373-V377 WeakPolarHBondContact O-CG1 3.43Å; S373-V377 WeakPolarHBondContact O-CG2 3.46Å; S373-V377 PolarHBondContact O-N 2.83Å; L374-V377 PolarHBondContact O-N 3.34Å
378D90.3Very high86.1Confident28 Ų2859.9 Ų59.915%0.1532%0.322CS..Iπ-helixtrans-133.9-74.2-169.8177.520.6000110.4L138 R142 L374 C380 I381 S382L138-D378 HydrophobicContact CD1-CB 3.79Å; L138-D378 WeakPolarHBondContact CD1-OD1 3.46Å; R142-D378 HydrophobicContact CG-CB 4.47Å; R142-D378 VanDerWaalsContact CZ-CG 3.45Å; R142-D378 IonicContact CZ-OD1 2.83Å; R142-D378 IonicContact CZ-OD2 3.43Å; R142-D378 VanDerWaalsContact NE-CG 3.29Å; R142-D378 IonicContact NE-OD1 3.68Å; R142-D378 IonicContact NE-OD2 2.85Å; R142-D378 PolarHBondContact NE-OD2 3.15Å; R142-D378 IonicContact NH2-OD1 3.57Å; R142-D378 PolarHBondContact NH2-OD1 3.5Å; R142-D378 IonicContact NH2-OD2 3.18Å; R142-D378 PolarHBondContact NH2-OD2 3.06Å; L374-D378 WeakPolarHBondContact O-CB 3.44Å; L374-D378 PolarHBondContact O-N 3.02Å; D378-C380 PolarHBondContact O-N 3.05Å; D378-I381 PolarHBondContact O-N 2.97Å; D378-S382 PolarHBondContact O-N 3.23Å
379T82.7Confident85.4Confident57 Ų5763.3 Ų63.335%0.3534%0.342SS..Iπ-helixtrans-60.1-42-172.7-46.20000113.1Y375 I381 D383 L386Y375-T379 HydrophobicContact CD2-CG2 4.03Å; Y375-T379 HydrophobicContact CE2-CG2 4.06Å; Y375-T379 PolarHBondContact O-N 3.36Å; T379-I381 PolarHBondContact O-N 3.5Å; T379-D383 PolarHBondContact O-N 2.79Å; T379-L386 HydrophobicContact CG2-CD1 4.31Å
380C80.7Confident84.8Confident36 Ų3671.5 Ų71.524%0.24339%0.385CS..Hα-helixtrans-63.6-22.3178.5-77.40000114.1Y375 D378Y375-C380 VanDerWaalsContact CD1-SG 3.57Å; Y375-C380 WeakPolarHBondContact CE1-SG 3.29Å; Y375-C380 VanDerWaalsContact CZ-SG 3.51Å; Y375-C380 PolarHBondContact O-N 2.68Å; Y375-C380 PolarHBondContact O-SG 3.32Å; D378-C380 PolarHBondContact O-N 3.05Å
381I81.3Confident84.4Confident54 Ų5476 Ų7628%0.27741%0.413SS..Hα-helixtrans-103.3-45.3-171.9-57.5169.1000109.9R141 D378 T379 D383R141-I381 VanDerWaalsContact CZ-CD1 3.5Å; D378-I381 PolarHBondContact O-N 2.97Å; T379-I381 PolarHBondContact O-N 3.5Å; I381-D383 PolarHBondContact O-N 3.08Å
382S76.8Confident83.8Confident48 Ų4881.5 Ų81.534%0.33643%0.433SS..Hα-helixtrans-80.7-11.2-172.4-65.10000114.3E134 D378 P384E134-S382 PolarHBondContact OE1-OG 2.93Å; D378-S382 PolarHBondContact O-N 3.23Å; S382-P384 WeakPolarHBondContact O-CD 3.15Å
383D78.1Confident83.1Confident61 Ų6184.6 Ų84.633%0.32646%0.456SS..  trans-114.3100.9173.5-171.6-6.7000111.1T379 I381 N385 L386T379-D383 PolarHBondContact O-N 2.79Å; I381-D383 PolarHBondContact O-N 3.08Å; D383-N385 PolarHBondContact O-N 3.33Å; D383-N385 VanDerWaalsContact O-N 3.09Å; D383-N385 WeakPolarHBondContact OD1-CB 3.07Å; D383-N385 PolarHBondContact OD1-N 3.19Å; D383-N385 PolarHBondContact OD1-ND2 2.87Å; D383-L386 HydrophobicContact CB-CD1 3.46Å; D383-L386 VanDerWaalsContact CB-CD1 3.46Å; D383-L386 VanDerWaalsContact CG-CD1 3.5Å; D383-L386 PolarHBondContact O-N 3.25Å; D383-L386 VanDerWaalsContact O-N 3.11Å; D383-L386 VanDerWaalsContact OD2-CD1 3.27Å; D383-L386 WeakPolarHBondContact OD2-CD1 3.5Å
384P70Confident82.4Confident99 Ų9988.5 Ų88.564%0.64350%0.496SS*.G310 helixtrans-58.8-23.7-179.9-22.732.1000113.6S382 L386 I387S382-P384 WeakPolarHBondContact O-CD 3.15Å; P384-L386 PolarHBondContact O-N 3.13Å; P384-I387 PolarHBondContact O-N 2.98Å
385N75.8Confident81.4Confident145 Ų14592 Ų9278%0.77552%0.522SS*.G310 helixtrans-74.7-13.5-178.2-54.1-66.7000112.8D383 I387D383-N385 PolarHBondContact O-N 3.33Å; D383-N385 VanDerWaalsContact O-N 3.09Å; D383-N385 WeakPolarHBondContact OD1-CB 3.07Å; D383-N385 PolarHBondContact OD1-N 3.19Å; D383-N385 PolarHBondContact OD1-ND2 2.87Å; N385-I387 VanDerWaalsContact C-N 3.32Å
386L77Confident80.3Confident67 Ų6795.8 Ų95.835%0.35154%0.541SS..G310 helixtrans-78.4-14.7175.7-90110.3000113.5Y375 T379 D383 P384 P388Y375-L386 HydrophobicContact CE2-CD2 4.06Å; Y375-L386 WeakPolarHBondContact OH-CD2 3.44Å; T379-L386 HydrophobicContact CG2-CD1 4.31Å; D383-L386 HydrophobicContact CB-CD1 3.46Å; D383-L386 VanDerWaalsContact CB-CD1 3.46Å; D383-L386 VanDerWaalsContact CG-CD1 3.5Å; D383-L386 PolarHBondContact O-N 3.25Å; D383-L386 VanDerWaalsContact O-N 3.11Å; D383-L386 VanDerWaalsContact OD2-CD1 3.27Å; D383-L386 WeakPolarHBondContact OD2-CD1 3.5Å; P384-L386 PolarHBondContact O-N 3.13Å; L386-P388 WeakPolarHBondContact O-CD 3.32Å
387I77.4Confident79Confident121 Ų12199.3 Ų99.362%0.62157%0.566SS**SBendtrans-90.7113.1175.2-57.3177.4000108.2P384 N385P384-I387 PolarHBondContact O-N 2.98Å; N385-I387 VanDerWaalsContact C-N 3.32Å
388P80.9Confident77.6Confident110 Ų110106.1 Ų106.171%0.71460%0.602SS**  trans-62.2143.8178.2-19.231.8000111.1L386L386-P388 WeakPolarHBondContact O-CD 3.32Å
389E81.3Confident76.2Confident172 Ų172111 Ų11180%0.80463%0.627SS**  trans-57.7143.7173.1-169.5179.3175.900110.6V391E389-V391 PolarHBondContact O-N 3.23Å
390L84Confident74.8Confident171 Ų171116.9 Ų116.990%0.89565%0.65SS**  trans-68.6102.6177-75.990.7000110.1
391V85.1Confident73.5Confident122 Ų122119.7 Ų119.774%0.73967%0.667SS**  trans-105.5140.8176.5-177.20000110.4E389 S393E389-V391 PolarHBondContact O-N 3.23Å; V391-S393 PolarHBondContact O-N 2.81Å
392K81.9Confident71.8Confident203 Ų203124.6 Ų124.688%0.88369%0.694SS**  trans-59.7127.7171.8-73-176.1179.4179.90109.9
393S80.2Confident70.5Confident95 Ų95128.8 Ų128.866%0.66471%0.712SS**  trans-59.3139177.4-177.10000111.3V391 C395V391-S393 PolarHBondContact O-N 2.81Å; S393-C395 PolarHBondContact O-N 2.87Å; S393-C395 PolarHBondContact OG-N 3.35Å
394G79.4Confident68.6Low82 Ų82133.7 Ų133.785%0.84574%0.738SS**SBendtrans-73.2-11.3172.500000113.8K396G394-K396 PolarHBondContact O-N 3.33Å
395C70.5Confident67.2Low106 Ų106136.3 Ų136.372%0.71675%0.747SS**  trans-76.3101.6171.4-79.10000109.4S393S393-C395 PolarHBondContact O-N 2.87Å; S393-C395 PolarHBondContact OG-N 3.35Å
396K70.8Confident65.5Low187 Ų187138 Ų13881%0.81375%0.75SS**  trans-75.9125.1156.7-75.4-177.3175.1-176.50107.7G394 D398G394-K396 PolarHBondContact O-N 3.33Å; K396-D398 PolarHBondContact O-N 3.4Å
397V64.3Low63.7Low121 Ų121140.4 Ų140.473%0.73377%0.767SS**  trans-81.8109.7161.7179.40000104.3I399V397-I399 VanDerWaalsContact C-N 3.27Å; V397-I399 HydrophobicContact CG1-CG1 4.17Å; V397-I399 PolarHBondContact O-N 3.09Å
398D61.3Low61.8Low143 Ų143142.5 Ų142.577%0.76578%0.78SS**  trans-67.197.6168.9-63.9-35.5000105.8K396 E400K396-D398 PolarHBondContact O-N 3.4Å; D398-E400 VanDerWaalsContact C-N 3.34Å; D398-E400 PolarHBondContact O-N 3.25Å; D398-E400 VanDerWaalsContact O-N 3.13Å
399I62Low59.4Low132 Ų132140 Ų14068%0.67777%0.774SS**  trans-76.498.1170.1-56.9174.8000104V397 T401V397-I399 VanDerWaalsContact C-N 3.27Å; V397-I399 HydrophobicContact CG1-CG1 4.17Å; V397-I399 PolarHBondContact O-N 3.09Å; I399-T401 HydrophobicContact CG2-CG2 3.9Å; I399-T401 PolarHBondContact O-N 3.06Å
400E52.8Low57.3Low179 Ų179139 Ų13984%0.83678%0.78SS**  trans-63.690.8160.6-72.8178.417100106.4D398 D402D398-E400 VanDerWaalsContact C-N 3.34Å; D398-E400 PolarHBondContact O-N 3.25Å; D398-E400 VanDerWaalsContact O-N 3.13Å; E400-D402 PolarHBondContact O-N 2.85Å
401T53.3Low54.7Low96 Ų96135.2 Ų135.259%0.58977%0.773SS**  trans-73.7106.3159.542.10000106.1I399 D403I399-T401 HydrophobicContact CG2-CG2 3.9Å; I399-T401 PolarHBondContact O-N 3.06Å; T401-D403 PolarHBondContact O-N 2.87Å
402D44.6Very low52.3Low157 Ų157135.9 Ų135.984%0.8478%0.777SS**  trans-59.979.6157.2-82.6-31.3000107.4E400E400-D402 PolarHBondContact O-N 2.85Å
403D50Low49.8Very low136 Ų136130.9 Ų130.973%0.72777%0.768SS**  trans-91.2105163-77.2-33.4000107T401 D405T401-D403 PolarHBondContact O-N 2.87Å; D403-D405 PolarHBondContact O-N 3.31Å
404D39Very low47.6Very low164 Ų164133.6 Ų133.688%0.87778%0.775SS**  trans-48103164.2-74.6-50.7000110.3
405D39.1Very low45.2Very low153 Ų153134.9 Ų134.982%0.81877%0.771SS**  trans-149.297.6151.1-136.5-3.9000112.6D403D403-D405 PolarHBondContact O-N 3.31Å
406H41.7Very low43.3Very low181 Ų181137.4 Ų137.484%0.83878%0.777SS**  trans-117.5117.4159-90-1.6000102.9
407T38Very low41.3Very low117 Ų117139.2 Ų139.272%0.71878%0.781SS**  cis-175.6143.338.541.40000107.1
408D37.3Very low39.6Very low166 Ų166144.5 Ų144.589%0.88879%0.789SS**  -180148.996.5-135-15.4000112.2
409G31.6Very low38Very low57 Ų57143 Ų14359%0.58879%0.79SS**  trans-76.7162.6-156.600000118.1
410T35.6Very low36.5Very low152 Ų152148 Ų14893%0.93380%0.8SS**  -174.7144.6112.820.20000111
411A31.3Very low35.4Very low91 Ų91146.9 Ų146.975%0.75280%0.799SS**  trans-69.8150.4-168.600000114.7
412V34.2Very low34.4Very low135 Ų135149.7 Ų149.782%0.81881%0.811SS**  165.8129.9113.61610000110.5
413S29.6Very low33.9Very low98 Ų98148.4 Ų148.469%0.68580%0.802SS**  trans61.9100.8155.4-1620000119.2
414D33Very low33Very low152 Ų152148.2 Ų148.281%0.81381%0.808SS**  -164.1113.5115.7-96.9-13.7000111.1D416D414-D416 PolarHBondContact O-N 2.99Å
415S29.4Very low32.6Very low110 Ų110143.9 Ų143.977%0.76980%0.803SS**  trans-7997.9167.858.90000108.6
416D30.7Very low32.3Very low158 Ų158141.4 Ų141.485%0.84580%0.797SS**  trans-166.827.2159-99.7-15.4000114.1D414D414-D416 PolarHBondContact O-N 2.99Å
417Y29Very low31.6Very low225 Ų225145.1 Ų145.188%0.88280%0.804SS**  trans-10786.3170.9-101.1-96.2000109.6
418Y28Very low31.4Very low232 Ų232148 Ų14891%0.9181%0.809SS**SBendtrans16861.4149.3-89.5-65.5000108.1
419S27.3Very low31Very low112 Ų112150.3 Ų150.378%0.78381%0.805SS**  trans-163.393168.3-85.90000111.2
420R30.7Very low30.9Very low237 Ų237157.4 Ų157.489%0.89482%0.82SS**  trans169.880.3135.4-92173.3-151.3-1508.6110.7
421L30.4Very low30.6Very low156 Ų156157.3 Ų157.382%0.81781%0.813SS**  trans-111.682.9147.7-99.3137.5000106.8I423L421-I423 HydrophobicContact CD2-CD1 4.15Å; L421-I423 HydrophobicContact CD2-CG1 4.18Å; L421-I423 PolarHBondContact O-N 3.16Å
422N32.5Very low30.5Very low155 Ų155158 Ų15883%0.82981%0.811SS**  trans-87.792.1162.7-93.8-13.2000107.3P424N422-P424 WeakPolarHBondContact O-CD 3.28Å
423I34.4Very low30.4Very low130 Ų130157.5 Ų157.567%0.66781%0.809SS**  trans-85.1110.6159.2-61.1172.1000105.9L421 G425L421-I423 HydrophobicContact CD2-CD1 4.15Å; L421-I423 HydrophobicContact CD2-CG1 4.18Å; L421-I423 PolarHBondContact O-N 3.16Å; I423-G425 PolarHBondContact O-N 3.03Å; I423-G425 VanDerWaalsContact O-N 3.13Å
424P30.6Very low30.4Very low131 Ų131162.7 Ų162.785%0.85182%0.819SS**SBendtrans-79.398.617730.6-28.2000108.3N422N422-P424 WeakPolarHBondContact O-CD 3.28Å
425G30.2Very low30.3Very low74 Ų74161 Ų16176%0.76382%0.82SS**  trans164.225.5174.700000119.4I423I423-G425 PolarHBondContact O-N 3.03Å; I423-G425 VanDerWaalsContact O-N 3.13Å
426S32.1Very low30.3Very low100 Ų100165.6 Ų165.670%0.69983%0.826SS**  trans-131.195.3166.955.50000110.3Q428S426-Q428 VanDerWaalsContact C-N 3.28Å; S426-Q428 PolarHBondContact O-N 3.37Å
427R28.5Very low30.3Very low259 Ų259162 Ų16298%0.97783%0.827SS**  trans-65.788.8166.4-83.1179.9169.1178-2.8108.7
428Q34Very low30.3Very low178 Ų178155.4 Ų155.483%0.83283%0.826SS**  trans-84.9121.1158.8-85.8-175.2-23.600109.5S426 K430S426-Q428 VanDerWaalsContact C-N 3.28Å; S426-Q428 PolarHBondContact O-N 3.37Å; Q428-K430 PolarHBondContact O-N 3.43Å
429R26.9Very low30.5Very low214 Ų214148 Ų14881%0.80882%0.821SS**  trans-55.5114.4172.2-77176.1177.5170.5-1.7109.5I431R429-I431 PolarHBondContact O-N 3.36Å
430K30.7Very low30.8Very low206 Ų206148.7 Ų148.790%0.89683%0.825SS**  trans-74.9107.6162.9-86.4-177.9176.31780109Q428 S432Q428-K430 PolarHBondContact O-N 3.43Å; K430-S432 PolarHBondContact O-N 3Å
431I28.3Very low30.7Very low151 Ų151148.9 Ų148.977%0.77483%0.826SS**  trans-74.7111.1156.8-67.4172.6000106.1R429 T433R429-I431 PolarHBondContact O-N 3.36Å; I431-T433 HydrophobicContact CG2-CG2 4.44Å; I431-T433 PolarHBondContact O-N 3.47Å
432S29.8Very low30.7Very low104 Ų104153.5 Ų153.573%0.72783%0.833SS**  trans-82.7106.4174.9178.90000109.1K430K430-S432 PolarHBondContact O-N 3Å
433T31.3Very low30.6Very low125 Ų125149.5 Ų149.577%0.76783%0.828SS**  trans-98.6102.1159.850.60000108.3I431 S435I431-T433 HydrophobicContact CG2-CG2 4.44Å; I431-T433 PolarHBondContact O-N 3.47Å; T433-S435 PolarHBondContact O-N 3.28Å
434K29.8Very low30.3Very low207 Ų207147.9 Ų147.990%0.983%0.829SS**  trans-65.5111.7166.4-98.2176.3172.2173.70108.7
435S32.1Very low30.4Very low118 Ų118150.2 Ų150.283%0.82583%0.825SS**  trans-105132.9158.3-176.50000109.4T433T433-S435 PolarHBondContact O-N 3.28Å
436K29.9Very low30.5Very low205 Ų205154.2 Ų154.289%0.89183%0.828SS**  trans-71.9124.1-176.9-72.4170.2169.9173.50110.2
437G30.3Very low30.2Very low84 Ų84154.6 Ų154.687%0.86683%0.831SS**  trans-100.5106.1155.800000109.1
438G28.9Very low30.8Very low85 Ų85147.1 Ų147.188%0.87682%0.816SS**  trans-87.1133.6163.800000109.2
439G32.5Very low30.6Very low77 Ų77145.7 Ų145.779%0.79481%0.814SS**  trans-177.971.2-17800000113.1
440S32.7Very low30.9Very low126 Ų126139.4 Ų139.488%0.88180%0.803SS**  trans52.9121.1152.4-147.50000121.7
441R29.7Very low30.9Very low242 Ų242139.3 Ų139.391%0.91380%0.799SS**  trans-72.1153.6168.5-69.4170.3168.5172.3-5.7112.1
442R29.7Very low31.1Very low253 Ų253138.9 Ų138.996%0.95580%0.798SS**  trans-115.6145.6141.8-141.7173.5-175.3-175.81.2108.2
443G29.6Very low31.2Very low71 Ų71141.4 Ų141.473%0.73280%0.798SS**  trans-62.8178.2-156.200000116.6
444S29.3Very low31.2Very low96 Ų96140.2 Ų140.267%0.67179%0.787SS**  cis-175.5171.221.335.40000108.4
445F31.8Very low31.4Very low179 Ų179141 Ų14179%0.78579%0.786SS**  trans110.495.9162.4-63.1-77.1000117.4
446L32.2Very low31Very low158 Ų158142.4 Ų142.483%0.82778%0.784SS**  trans78.3101.6130.8-60.8166.4000119.5
447S25.9Very low31.1Very low108 Ų108137.6 Ų137.676%0.75578%0.776SS**  trans-81.2-173.6150.2-103.40000110.6
448P40.6Very low31Very low103 Ų103139.6 Ų139.667%0.66977%0.771SS**  cis-143.1175.5-26.533.1-12.7000114.8
449N31.5Very low31.2Very low148 Ų148140.3 Ų140.379%0.79176%0.761SS**  trans148.4136.9142.2-84.6-2.1000108.7
450S31.7Very low31Very low82 Ų82145.1 Ų145.157%0.57376%0.762SS**  cis178.31557.852.50000111.5
451Y31.4Very low30.9Very low204 Ų204145.8 Ų145.880%0.876%0.761SS**  trans89.7130.4149.1-59.8-60.7000124.1
452D32.6Very low30.6Very low141 Ų141143.6 Ų143.675%0.75476%0.758SS**  trans72.8121.7157.5-54.8-16.7000120.8
453E31.3Very low30.6Very low157 Ų157140.3 Ų140.373%0.73475%0.754SS**  cis117.5123.120.3-93-135.7151.800111.6
454N31Very low30.5Very low100 Ų100141.9 Ų141.954%0.53575%0.754SS.*  trans71.5134.7148.7-50.8-22.9000118.9
455Y34Very low30.5Very low225 Ų225143.4 Ų143.488%0.88276%0.761SS**  cis-145.2147.535-92.3-90.6000114.3
456L24.3Very low30.3Very low147 Ų147142.6 Ų142.677%0.7776%0.762SS**  trans-101.5149.8170.7-162.794.6000109.3
457S31.5Very low30Very low104 Ų104142.5 Ų142.573%0.72776%0.762SS**  trans166.194.9143.4-73.40000109.7
458T29.5Very low30.2Very low125 Ų125145.1 Ų145.177%0.76777%0.768SS**  88.8147.791.6480000115.8
459P32.8Very low29.6Very low101 Ų101148.8 Ų148.866%0.65678%0.776SS**  trans-112.9176-147.340.4-28.2000113.6
460H28.3Very low29.7Very low177 Ų177147 Ų14782%0.81977%0.77SS**  trans158.3121.2141.3-81.5-63.4000108.9
461T29.2Very low29.6Very low140 Ų140148.8 Ų148.886%0.85978%0.78SS**  176.8134.5118.3-62.70000108.9
462F23.8Very low29.5Very low197 Ų197149.5 Ų149.586%0.86478%0.782SS**  trans-96.1118.9-173.9-176.5-87.6000107.3
463E30.6Very low29.4Very low184 Ų184147.2 Ų147.286%0.8677%0.774SS**  trans-168.1125.6156.9-112.6167.3-159.700112.8
464S26.9Very low29.3Very low104 Ų104148.7 Ų148.773%0.72778%0.781SS**  trans59.3114.2155.9-154.30000121.6
465P28.8Very low29Very low127 Ų127151.5 Ų151.583%0.82580%0.795SS**  trans-10687.716536.2-22.1000110.4
466M28Very low28.7Very low162 Ų162145.8 Ų145.880%0.79879%0.786SS**  trans-145.7116.8154-76.8-126.78500106
467D27Very low29Very low156 Ų156144.6 Ų144.683%0.83479%0.787SS**  trans131.972.3171-65.7-12.4000110.5
468N29.8Very low28.9Very low164 Ų164146.2 Ų146.288%0.87779%0.793SS**  trans-145.173.5156-98.6-26.2000107.7T470N468-T470 PolarHBondContact O-N 3.06Å; N468-T470 VanDerWaalsContact O-N 3.09Å
469E28Very low28.8Very low179 Ų179151.6 Ų151.684%0.83680%0.799SS**  trans-63.6104157.5-74.1-161.8152.300107.8
470T32.4Very low28.6Very low111 Ų111154.4 Ų154.468%0.68180%0.803SS**PPolyproline II helixtrans-51.2132.5161.126.30000109.3N468 W472N468-T470 PolarHBondContact O-N 3.06Å; N468-T470 VanDerWaalsContact O-N 3.09Å; T470-W472 PolarHBondContact O-N 3.06Å; T470-W472 VanDerWaalsContact O-N 3.13Å
471P30.5Very low28.4Very low120 Ų120157.9 Ų157.978%0.77981%0.809SS**PPolyproline II helixtrans-62.8122.4177.225.2-30.5000108.2
472W28.8Very low28.2Very low219 Ų219161.4 Ų161.483%0.8381%0.807SS**PPolyproline II helixtrans-48136.7166.1-69.887.5000108.3T470 E474T470-W472 PolarHBondContact O-N 3.06Å; T470-W472 VanDerWaalsContact O-N 3.13Å; W472-E474 PolarHBondContact O-N 3.09Å
473P31.8Very low28.3Very low93 Ų93156.7 Ų156.760%0.60480%0.796SS**PPolyproline II helixtrans-56.4123.1171.124.5-29.5000107L475P473-L475 PolarHBondContact O-N 3.37Å
474E28.6Very low28.1Very low187 Ų187153.2 Ų153.287%0.87479%0.792SS**  trans-45.1112.2176.1-73.4179.6151.200108.4W472W472-E474 PolarHBondContact O-N 3.09Å
475L25.5Very low28Very low159 Ų159155.8 Ų155.883%0.83279%0.792SS**PPolyproline II helixtrans-54.3130.6161.3-74.5163.4000105.4P473P473-L475 PolarHBondContact O-N 3.37Å
476P26.7Very low27.9Very low106 Ų106156 Ų15669%0.68879%0.791SS**PPolyproline II helixtrans-54144.5179.424.3-32000108T478P476-T478 PolarHBondContact O-N 3.44Å
477P30.6Very low27.7Very low121 Ų121153 Ų15379%0.78679%0.793SS**PPolyproline II helixtrans-51.8126.8179.524.3-32.4000106.4R479P477-R479 PolarHBondContact O-N 3.18Å
478T30.2Very low27.8Very low138 Ų138151.7 Ų151.785%0.84778%0.779SS**  trans-33.9104178.619.70000108.2P476 Q480P476-T478 PolarHBondContact O-N 3.44Å; T478-Q480 PolarHBondContact O-N 2.98Å
479R27.5Very low27.7Very low239 Ų239152.8 Ų152.890%0.90278%0.783SS**  trans-60.7101.8174.5-164.8177.9-171.3-171.92.2103.1P477 R481P477-R479 PolarHBondContact O-N 3.18Å; R479-R481 PolarHBondContact O-N 2.73Å
480Q28Very low27.7Very low159 Ų159146.3 Ų146.374%0.74377%0.765SS**  trans-39.2120.8159.2-83.1-179.6-29.400104.4T478 R482T478-Q480 PolarHBondContact O-N 2.98Å; Q480-R482 PolarHBondContact O-N 2.95Å
481R24.5Very low28Very low251 Ų251144.8 Ų144.895%0.94776%0.759SS**  trans-58.886.8169.6-85.8-175.3168.8-171.7-3.1105.8R479R479-R481 PolarHBondContact O-N 2.73Å
482R24.4Very low28.4Very low213 Ų213140 Ų14080%0.80473%0.726SS**  trans-67.1121157-74.7-172178.6-170.5-0.9103.8Q480 S484Q480-R482 PolarHBondContact O-N 2.95Å; R482-S484 PolarHBondContact O-N 2.96Å
483P25.7Very low28.7Very low98 Ų98137 Ų13764%0.63672%0.722SS**  trans-57.4126.9166.826.1-29.2000106H485P483-H485 VanDerWaalsContact C-N 3.33Å; P483-H485 PolarHBondContact O-N 3.21Å
484S26.4Very low28.8Very low111 Ų111136.9 Ų136.978%0.77672%0.719SS**  trans-61.699.4170.843.80000107.6R482 T486R482-S484 PolarHBondContact O-N 2.96Å; S484-T486 PolarHBondContact O-N 2.66Å
485H24.8Very low28.8Very low158 Ų158132.3 Ų132.373%0.73171%0.713SS**  trans-71101.1166.2-85.8-94.3000108.7P483P483-H485 VanDerWaalsContact C-N 3.33Å; P483-H485 PolarHBondContact O-N 3.21Å
486T26.3Very low28.8Very low132 Ų132128.1 Ų128.181%0.8171%0.709SS**  trans178.6111158.926.90000105.5S484S484-T486 PolarHBondContact O-N 2.66Å
487A25Very low28.9Very low100 Ų100127.7 Ų127.783%0.82671%0.714SS**SBendcis-141.5117.33.700000109.6
488F28.4Very low28.6Very low127 Ų127128.4 Ų128.456%0.55772%0.716SS**  trans-155.4108.5149.3-168.7-104.3000105.5L374 G490L374-F488 HydrophobicContact CD1-CE2 4.46Å; F488-G490 VanDerWaalsContact C-N 3.27Å; F488-G490 PolarHBondContact O-N 2.86Å; F488-G490 VanDerWaalsContact O-N 3.07Å
489I28Very low28.6Very low187 Ų187131.6 Ų131.696%0.95972%0.718SS**  trans-79.488.3171.5-65.5174.1000105.3
490G27.5Very low28.4Very low43 Ų43129.8 Ų129.844%0.44372%0.72SS.*  trans-175.161-179.900000108.5F488 L492F488-G490 VanDerWaalsContact C-N 3.27Å; F488-G490 PolarHBondContact O-N 2.86Å; F488-G490 VanDerWaalsContact O-N 3.07Å; G490-L492 PolarHBondContact O-N 2.9Å
491S38Very low28.5Very low80 Ų80125.6 Ų125.656%0.55972%0.72SS**  trans-61.3133163.8-171.70000107.1E493S491-E493 PolarHBondContact O-N 3.38Å
492L39.1Very low28.4Very low19 Ų19121.3 Ų121.310%0.09972%0.716CS.*  trans-73.538.8-179.6-159.5121.8000110.4R166 F167 C176 E367 G490R166-L492 VanDerWaalsContact NE-CD2 3.35Å; R166-L492 PolarHBondContact NE-O 3.23Å; R166-L492 PolarHBondContact NH2-O 2.92Å; F167-L492 HydrophobicContact CE1-CD2 4.07Å; F167-L492 HydrophobicContact CE1-CG 4.3Å; F167-L492 HydrophobicContact CE2-CD2 3.75Å; F167-L492 HydrophobicContact CZ-CD1 4.1Å; F167-L492 HydrophobicContact CZ-CD2 3.17Å; F167-L492 HydrophobicContact CZ-CG 3.71Å; C176-L492 WeakPolarHBondContact SG-CD1 3.43Å; C176-L492 WeakPolarHBondContact SG-CG 3.41Å; E367-L492 HydrophobicContact CG-CD2 4.5Å; G490-L492 PolarHBondContact O-N 2.9Å
493E35.7Very low28.6Very low156 Ų156119.8 Ų119.873%0.72972%0.722SS**  trans-97111.2178.9-89.5-178.1139.100108.5S491 A495S491-E493 PolarHBondContact O-N 3.38Å; E493-A495 PolarHBondContact O-N 2.94Å
494V33.8Very low28.6Very low91 Ų91123.7 Ų123.755%0.55273%0.73SS**  trans-69.8100.5164.1177.90000106.7G496V494-G496 PolarHBondContact O-N 3.26Å; V494-G496 VanDerWaalsContact O-N 3.08Å
495A28.8Very low28.5Very low91 Ų91125.6 Ų125.675%0.75273%0.73SS**  trans-63.9109.8172.800000109.1E493 A497E493-A495 PolarHBondContact O-N 2.94Å; A495-A497 PolarHBondContact O-N 3.09Å
496G25.8Very low28.5Very low71 Ų71123.3 Ų123.373%0.73273%0.732SS**  trans-63.899.7171.700000110.6V494 T498V494-G496 PolarHBondContact O-N 3.26Å; V494-G496 VanDerWaalsContact O-N 3.08Å; G496-T498 PolarHBondContact O-N 3.26Å; G496-T498 VanDerWaalsContact O-N 3.13Å
497A28.4Very low28.6Very low97 Ų97123 Ų12380%0.80273%0.732SS**  trans-75.995.6167.400000109.1A495 K499A495-A497 PolarHBondContact O-N 3.09Å; A497-K499 PolarHBondContact O-N 3.08Å
498T24.3Very low28.6Very low136 Ų136123.6 Ų123.683%0.83473%0.731SS**  trans-66.7114.215935.80000108.6G496G496-T498 PolarHBondContact O-N 3.26Å; G496-T498 VanDerWaalsContact O-N 3.13Å
499K30.2Very low28.3Very low205 Ų205125.5 Ų125.589%0.89175%0.746SS**  trans-126.2107155.4-94.2-174.1176.71780108.7A497A497-K499 PolarHBondContact O-N 3.08Å
500E23.8Very low28.4Very low200 Ų200125 Ų12594%0.93574%0.739SS**  trans-54.2134.7162.6-64.4178.3144.900110
501G28.5Very low28.1Very low72 Ų72128 Ų12874%0.74275%0.753SS**  trans176.869.5-179.500000113.2
502N24Very low27.7Very low160 Ų160131.4 Ų131.486%0.85676%0.764SS**  trans4.2115.2158-90.3-30.4000118.2
503L27.2Very low27Very low181 Ų181136 Ų13695%0.94879%0.793SS**  trans-145.9133.3136.5-98165000109.8
504K26.7Very low26.6Very low181 Ų181134.5 Ų134.579%0.78780%0.797SS**  trans-80.4144.6-167.9-82.6170.1168.2173.70113.3
505L23.9Very low26.1Very low150 Ų150137.3 Ų137.379%0.78581%0.809SS**  trans43.6125.3138.6-70.3141.8000117.9
506S24.5Very low26.1Very low111 Ų111142.3 Ų142.378%0.77682%0.816SS**  -168.4158.575.1-58.20000112.3
507P27.9Very low26.2Very low124 Ų124146.7 Ų146.781%0.80582%0.818SS**  trans-95.3146.2-170.836.5-29.8000112.8
508S26.5Very low26.2Very low114 Ų114145.8 Ų145.880%0.79781%0.806SS**  trans-142.4114.8160.260.90000111.6
509L22.4Very low26.7Very low167 Ų167145.2 Ų145.287%0.87480%0.804SS**  trans-44126.8160.5-126.979.1000110.9
510H28.7Very low26.9Very low175 Ų175141.1 Ų141.181%0.8179%0.788SS**  trans-147.6113.3145.4-101-63.5000110.1
511S22.5Very low27.5Very low106 Ų106133.5 Ų133.574%0.74175%0.754SS**  trans-59.6127.8161.751.20000110.8
512L28Very low27.8Very low153 Ų153135.5 Ų135.580%0.80174%0.743SS**  trans-151.9109.7160.4-94.3158.5000109.8
513T26.2Very low28.3Very low115 Ų115129.2 Ų129.271%0.70671%0.712SS**  trans16.9139.8142.947.10000121.2D515T513-D515 PolarHBondContact O-N 3.2Å
514P26.2Very low28.7Very low124 Ų124125.4 Ų125.481%0.80569%0.692SS**SBendtrans-85.395171.434.6-26.1000109.5
515D24.5Very low29.4Very low150 Ų150120.4 Ų120.480%0.80268%0.677SS**  trans-160.684.2161.9-95.4-29.3000108.8T513T513-D515 PolarHBondContact O-N 3.2Å
516Q28.5Very low29.8Very low196 Ų196113.5 Ų113.592%0.91664%0.64SS**  trans-139.787.9156.3-107.2-179.8-10.800107.2S518Q516-S518 PolarHBondContact O-N 3.45Å
517Q26.4Very low30.6Very low163 Ų163112.8 Ų112.876%0.76263%0.627SS**  trans-51.4126.4157.8-78.3172.9-19.800108.2
518S30.1Very low31.2Very low79 Ų79111.4 Ų111.455%0.55262%0.616SS**  trans-48.5144.6165.56.30000109.9Q516 H520Q516-S518 PolarHBondContact O-N 3.45Å; S518-H520 PolarHBondContact O-CD2 3.45Å; S518-H520 PolarHBondContact O-N 2.97Å; S518-H520 PolarHBondContact O-NE2 3.06Å
519P33.4Very low31.8Very low123 Ų123108.6 Ų108.680%0.79960%0.597SS**  trans-66.9101176.128.3-30.8000107.9L521P519-L521 PolarHBondContact O-N 3.38Å
520H34.7Very low32.8Very low119 Ų119101.5 Ų101.555%0.55156%0.56SS**  trans-70124.6178.8-62.5-68.3000109.1S518 H522S518-H520 PolarHBondContact O-CD2 3.45Å; S518-H520 PolarHBondContact O-N 2.97Å; S518-H520 PolarHBondContact O-NE2 3.06Å; H520-H522 PolarHBondContact O-N 3.28Å
521L37.3Very low33.4Very low40 Ų4095.1 Ų95.121%0.20954%0.542CS..  trans-54.8115.4174.7-105.970.8000110.2W245 P519 L526W245-L521 WeakPolarHBondContact CZ2-O 3.36Å; W245-L521 PolarHBondContact NE1-O 3.17Å; W245-L521 VanDerWaalsContact NE1-O 3.11Å; P519-L521 PolarHBondContact O-N 3.38Å; L521-L526 HydrophobicContact CD2-CD1 3.38Å; L521-L526 HydrophobicContact CG-CD1 3.95Å
522H33.7Very low34.4Very low114 Ų11493.1 Ų93.153%0.52853%0.527SS..  trans-81.9133.3169.5-150.3-90.3000109.2H520 D524 T525H520-H522 PolarHBondContact O-N 3.28Å; H522-D524 VanDerWaalsContact C-N 3.26Å; H522-D524 IonicContact CE1-OD2 3.21Å; H522-D524 PolarHBondContact CE1-OD2 3.06Å; H522-D524 IonicContact ND1-OD2 3.14Å; H522-D524 PolarHBondContact ND1-OD2 2.81Å; H522-D524 PolarHBondContact O-N 2.97Å; H522-T525 PolarHBondContact O-OG1 2.93Å
523P35.7Very low34.9Very low29 Ų2988.9 Ų88.919%0.18851%0.51CS..Hα-helixtrans-68-30.4-174.529.2-36.1000111.7W245 T525 L526 I527W245-P523 HydrophobicContact CH2-CB 3.77Å; W245-P523 HydrophobicContact CH2-CG 3.45Å; W245-P523 VanDerWaalsContact CH2-CG 3.45Å; W245-P523 HydrophobicContact CZ2-CG 4.22Å; W245-P523 HydrophobicContact CZ3-CB 3.85Å; W245-P523 HydrophobicContact CZ3-CG 4.07Å; P523-T525 VanDerWaalsContact C-N 3.3Å; P523-T525 PolarHBondContact O-N 3.39Å; P523-L526 PolarHBondContact O-N 3.32Å; P523-I527 HydrophobicContact CB-CD1 4.25Å; P523-I527 WeakPolarHBondContact O-CB 3.36Å; P523-I527 WeakPolarHBondContact O-CG1 3.26Å; P523-I527 PolarHBondContact O-N 3.47Å
524D34.5Very low35.5Very low101 Ų10186.7 Ų86.754%0.5449%0.494SS..Hα-helixtrans-68.1-29.3-173.2-63-23.1000112.8H522 T528H522-D524 VanDerWaalsContact C-N 3.26Å; H522-D524 IonicContact CE1-OD2 3.21Å; H522-D524 PolarHBondContact CE1-OD2 3.06Å; H522-D524 IonicContact ND1-OD2 3.14Å; H522-D524 PolarHBondContact ND1-OD2 2.81Å; H522-D524 PolarHBondContact O-N 2.97Å; D524-T528 WeakPolarHBondContact O-CB 3.47Å; D524-T528 VanDerWaalsContact O-CG2 3.22Å; D524-T528 WeakPolarHBondContact O-CG2 3.38Å; D524-T528 PolarHBondContact O-N 2.97Å; D524-T528 PolarHBondContact O-OG1 3.32Å
525T42Very low36.3Very low75 Ų7587.6 Ų87.646%0.4649%0.487SS..Hα-helixtrans-77.7-35.6177.626.40000113H522 P523 S529H522-T525 PolarHBondContact O-OG1 2.93Å; P523-T525 VanDerWaalsContact C-N 3.3Å; P523-T525 PolarHBondContact O-N 3.39Å; T525-S529 WeakPolarHBondContact O-CB 3.43Å; T525-S529 PolarHBondContact O-N 3.12Å
526L33.2Very low37.3Very low5 Ų589.7 Ų89.73%0.02648%0.484CS..Hα-helixtrans-77.8-44.1178.7-74.3173.6000111.7T194 F198 L521 P523 T528 I530T194-L526 HydrophobicContact CG2-CD2 4.22Å; T194-L526 HydrophobicContact CG2-CG 4.28Å; F198-L526 HydrophobicContact CD1-CD2 4.49Å; F198-L526 HydrophobicContact CE1-CD2 3.76Å; L521-L526 HydrophobicContact CD2-CD1 3.38Å; L521-L526 HydrophobicContact CG-CD1 3.95Å; P523-L526 PolarHBondContact O-N 3.32Å; L526-T528 PolarHBondContact O-N 3.21Å; L526-I530 HydrophobicContact CB-CD1 4.19Å; L526-I530 HydrophobicContact CD2-CD1 4.32Å; L526-I530 WeakPolarHBondContact O-CB 3.43Å; L526-I530 VanDerWaalsContact O-CD1 3.27Å; L526-I530 WeakPolarHBondContact O-CD1 3.46Å; L526-I530 WeakPolarHBondContact O-CG1 3.47Å; L526-I530 PolarHBondContact O-N 3.41Å
527I40.8Very low37.7Very low97 Ų9782.3 Ų82.350%0.49745%0.45SS..Hα-helixtrans-66.4-38.8-177.4-64.4170.4000111.1P523 G531P523-I527 HydrophobicContact CB-CD1 4.25Å; P523-I527 WeakPolarHBondContact O-CB 3.36Å; P523-I527 WeakPolarHBondContact O-CG1 3.26Å; P523-I527 PolarHBondContact O-N 3.47Å; I527-G531 PolarHBondContact O-N 3.43Å
528T41.2Very low38.4Very low94 Ų9476.2 Ų76.258%0.57743%0.432SS*.Hα-helixtrans-74.2-41.4179.954.90000113D524 L526 S532D524-T528 WeakPolarHBondContact O-CB 3.47Å; D524-T528 VanDerWaalsContact O-CG2 3.22Å; D524-T528 WeakPolarHBondContact O-CG2 3.38Å; D524-T528 PolarHBondContact O-N 2.97Å; D524-T528 PolarHBondContact O-OG1 3.32Å; L526-T528 PolarHBondContact O-N 3.21Å; T528-S532 WeakPolarHBondContact O-CB 3.25Å; T528-S532 PolarHBondContact O-N 2.93Å; T528-S532 PolarHBondContact O-OG 2.84Å; T528-S532 VanDerWaalsContact O-OG 3.1Å
529S38.3Very low39.1Very low56 Ų5675 Ų7539%0.39242%0.423SS..Hα-helixtrans-66.7-39.4176.6-177.50000112.2T525 S532 S533T525-S529 WeakPolarHBondContact O-CB 3.43Å; T525-S529 PolarHBondContact O-N 3.12Å; S529-S532 PolarHBondContact O-OG 2.99Å; S529-S533 WeakPolarHBondContact O-CB 3.44Å; S529-S533 PolarHBondContact O-N 3.13Å; S529-S533 VanDerWaalsContact O-N 3.15Å; S529-S533 PolarHBondContact O-OG 3.44Å
530I43.6Very low39.5Very low17 Ų1776 Ų769%0.08742%0.415CS..Hα-helixtrans-78.4-42.4-177.9-64.6168000111.5F198 W234 L526 S532 S533 L534F198-I530 HydrophobicContact CD1-CD1 4.23Å; F198-I530 HydrophobicContact CE1-CD1 4.32Å; F198-I530 HydrophobicContact CE2-CG1 4.39Å; F198-I530 HydrophobicContact CG-CD1 4.49Å; F198-I530 HydrophobicContact CZ-CG1 4.39Å; W234-I530 HydrophobicContact CH2-CG2 4.43Å; W234-I530 HydrophobicContact CZ2-CD1 4.09Å; W234-I530 HydrophobicContact CZ2-CG2 4.16Å; L526-I530 HydrophobicContact CB-CD1 4.19Å; L526-I530 HydrophobicContact CD2-CD1 4.32Å; L526-I530 WeakPolarHBondContact O-CB 3.43Å; L526-I530 VanDerWaalsContact O-CD1 3.27Å; L526-I530 WeakPolarHBondContact O-CD1 3.46Å; L526-I530 WeakPolarHBondContact O-CG1 3.47Å; L526-I530 PolarHBondContact O-N 3.41Å; I530-S532 VanDerWaalsContact C-N 3.29Å; I530-S532 PolarHBondContact O-N 3.31Å; I530-S533 PolarHBondContact O-N 3.43Å; I530-L534 HydrophobicContact CG2-CD1 3.61Å; I530-L534 HydrophobicContact CG2-CG 4.2Å; I530-L534 WeakPolarHBondContact O-CB 3.29Å; I530-L534 PolarHBondContact O-N 2.94Å
531G39.9Very low40Very low42 Ų4272.7 Ų72.743%0.43340%0.401SS..Hα-helixtrans-60.1-39.517600000112.2I527 H535I527-G531 PolarHBondContact O-N 3.43Å; G531-H535 WeakPolarHBondContact O-CB 3.12Å; G531-H535 PolarHBondContact O-N 3.34Å
532S44Very low40.1Very low63 Ų6379.4 Ų79.444%0.44142%0.423SS..Hα-helixtrans-72-37176.7690000113.1T528 S529 I530 R536T528-S532 WeakPolarHBondContact O-CB 3.25Å; T528-S532 PolarHBondContact O-N 2.93Å; T528-S532 PolarHBondContact O-OG 2.84Å; T528-S532 VanDerWaalsContact O-OG 3.1Å; S529-S532 PolarHBondContact O-OG 2.99Å; I530-S532 VanDerWaalsContact C-N 3.29Å; I530-S532 PolarHBondContact O-N 3.31Å; S532-R536 VanDerWaalsContact O-CB 3.24Å; S532-R536 WeakPolarHBondContact O-CB 3.47Å; S532-R536 WeakPolarHBondContact O-CG 3.41Å; S532-R536 PolarHBondContact O-N 3.39Å
533S39.1Very low40.6Very low64 Ų6481.5 Ų81.545%0.44843%0.431SS..Hα-helixtrans-73.1-44179.2-66.60000112.7S529 I530 R536 L537S529-S533 WeakPolarHBondContact O-CB 3.44Å; S529-S533 PolarHBondContact O-N 3.13Å; S529-S533 VanDerWaalsContact O-N 3.15Å; S529-S533 PolarHBondContact O-OG 3.44Å; I530-S533 PolarHBondContact O-N 3.43Å; S533-R536 PolarHBondContact O-N 3.09Å; S533-L537 WeakPolarHBondContact O-CB 3.44Å; S533-L537 PolarHBondContact O-N 3.29Å
534L38.9Very low40.6Very low70 Ų7084.5 Ų84.537%0.36645%0.445SS..Hα-helixtrans-71.1-36.2175.8-71.2173.3000112.1I530 L537 G538I530-L534 HydrophobicContact CG2-CD1 3.61Å; I530-L534 HydrophobicContact CG2-CG 4.2Å; I530-L534 WeakPolarHBondContact O-CB 3.29Å; I530-L534 PolarHBondContact O-N 2.94Å; L534-L537 PolarHBondContact O-N 2.73Å; L534-G538 PolarHBondContact O-N 2.85Å
535H43.6Very low40.6Very low143 Ų14382.3 Ų82.366%0.66244%0.438SS*.Hα-helixtrans-68.2-37.4172.7-171.4-89.1000111.9G531 L537 S539G531-H535 WeakPolarHBondContact O-CB 3.12Å; G531-H535 PolarHBondContact O-N 3.34Å; H535-L537 VanDerWaalsContact C-N 3.35Å; H535-S539 VanDerWaalsContact O-CB 3.3Å; H535-S539 WeakPolarHBondContact O-CB 3.22Å; H535-S539 PolarHBondContact O-N 3.04Å; H535-S539 PolarHBondContact O-OG 3.02Å
536R43.8Very low40.4Very low194 Ų19484 Ų8473%0.73244%0.443SS*.Hα-helixtrans-64.7-36.8170.9-87.1-176175.6-142.71112.4S532 S533 S539 K540S532-R536 VanDerWaalsContact O-CB 3.24Å; S532-R536 WeakPolarHBondContact O-CB 3.47Å; S532-R536 WeakPolarHBondContact O-CG 3.41Å; S532-R536 PolarHBondContact O-N 3.39Å; S533-R536 PolarHBondContact O-N 3.09Å; R536-S539 WeakPolarHBondContact CA-OG 3.45Å; R536-S539 PolarHBondContact O-OG 3.4Å; R536-S539 VanDerWaalsContact O-OG 3.06Å; R536-K540 WeakPolarHBondContact O-CB 3.31Å; R536-K540 PolarHBondContact O-N 3.46Å
537L37.8Very low40.5Very low40 Ų4088.3 Ų88.321%0.20947%0.474CS..Hα-helixtrans-72-46.4177.7-159.671.7000111.5I205 S533 L534 H535 S539 K540 I541I205-L537 HydrophobicContact CB-CD2 4.47Å; I205-L537 HydrophobicContact CG2-CD2 3.62Å; S533-L537 WeakPolarHBondContact O-CB 3.44Å; S533-L537 PolarHBondContact O-N 3.29Å; L534-L537 PolarHBondContact O-N 2.73Å; H535-L537 VanDerWaalsContact C-N 3.35Å; L537-S539 VanDerWaalsContact C-N 3.32Å; L537-S539 PolarHBondContact O-N 3.07Å; L537-K540 WeakPolarHBondContact O-CB 3.44Å; L537-K540 PolarHBondContact O-N 3.5Å; L537-K540 VanDerWaalsContact O-N 3.09Å; L537-I541 HydrophobicContact CG-CD1 4.49Å; L537-I541 WeakPolarHBondContact O-CG1 3.27Å; L537-I541 PolarHBondContact O-N 3.06Å
538G40.2Very low40.2Very low36 Ų3693.9 Ų93.937%0.37149%0.489SS..Hα-helixtrans-62.4-35.3174.700000113.2L534 R542L534-G538 PolarHBondContact O-N 2.85Å; G538-R542 WeakPolarHBondContact O-CB 3.5Å; G538-R542 PolarHBondContact O-N 3.16Å
539S45.4Very low39.8Very low52 Ų5293.2 Ų93.236%0.36449%0.487SS..Hα-helixtrans-74.7-26.3172.653.80000113.5H535 R536 L537 K543H535-S539 VanDerWaalsContact O-CB 3.3Å; H535-S539 WeakPolarHBondContact O-CB 3.22Å; H535-S539 PolarHBondContact O-N 3.04Å; H535-S539 PolarHBondContact O-OG 3.02Å; R536-S539 WeakPolarHBondContact CA-OG 3.45Å; R536-S539 PolarHBondContact O-OG 3.4Å; R536-S539 VanDerWaalsContact O-OG 3.06Å; L537-S539 VanDerWaalsContact C-N 3.32Å; L537-S539 PolarHBondContact O-N 3.07Å; S539-K543 WeakPolarHBondContact O-CB 3.47Å; S539-K543 WeakPolarHBondContact O-CG 3.45Å; S539-K543 PolarHBondContact O-N 3.23Å
540K42.8Very low39.2Very low146 Ų14697.6 Ų97.664%0.63551%0.507SS*.Hα-helixtrans-70-43.6169.1-119.6176.4177.6-175.70111.6R536 L537 K543 L544R536-K540 WeakPolarHBondContact O-CB 3.31Å; R536-K540 PolarHBondContact O-N 3.46Å; L537-K540 WeakPolarHBondContact O-CB 3.44Å; L537-K540 PolarHBondContact O-N 3.5Å; L537-K540 VanDerWaalsContact O-N 3.09Å; K540-K543 PolarHBondContact O-N 3.46Å; K540-L544 WeakPolarHBondContact O-CG 3.3Å; K540-L544 PolarHBondContact O-N 2.93Å
541I44.1Very low38.6Very low48 Ų48102.4 Ų102.425%0.24654%0.537CS..Hα-helixtrans-62.3-45.2175-66.5166.8000110.2L537 K543 L544 S545L537-I541 HydrophobicContact CG-CD1 4.49Å; L537-I541 WeakPolarHBondContact O-CG1 3.27Å; L537-I541 PolarHBondContact O-N 3.06Å; I541-K543 VanDerWaalsContact C-N 3.32Å; I541-K543 PolarHBondContact O-N 2.97Å; I541-L544 PolarHBondContact O-N 3.12Å; I541-L544 VanDerWaalsContact O-N 3.1Å; I541-S545 PolarHBondContact O-N 3.1Å
542R39.9Very low38Very low182 Ų182106.1 Ų106.169%0.68755%0.553SS**Hα-helixtrans-65.9-31.6176-152.6-177.6-75.8-175.1-4112.8G538 S545 L546G538-R542 WeakPolarHBondContact O-CB 3.5Å; G538-R542 PolarHBondContact O-N 3.16Å; R542-S545 PolarHBondContact O-OG 3.42Å; R542-L546 HydrophobicContact CG-CD1 4.02Å; R542-L546 WeakPolarHBondContact O-CB 3.37Å; R542-L546 WeakPolarHBondContact O-CD1 3.47Å; R542-L546 PolarHBondContact O-N 3.29Å; R542-L546 VanDerWaalsContact O-N 3.09Å
543K43.9Very low37.1Very low157 Ų157109.1 Ų109.168%0.68357%0.569SS**Hα-helixtrans-71.9-31.2171.3-85.1-178.2177.6-177.70112.7S539 K540 I541 S547S539-K543 WeakPolarHBondContact O-CB 3.47Å; S539-K543 WeakPolarHBondContact O-CG 3.45Å; S539-K543 PolarHBondContact O-N 3.23Å; K540-K543 PolarHBondContact O-N 3.46Å; I541-K543 VanDerWaalsContact C-N 3.32Å; I541-K543 PolarHBondContact O-N 2.97Å; K543-S547 WeakPolarHBondContact O-CB 3.46Å; K543-S547 PolarHBondContact O-N 2.98Å
544L35Very low36.8Very low92 Ų92113.3 Ų113.348%0.48259%0.585SS.*Hα-helixtrans-73.7-34.2175.4-70.9166.2000111.9K540 I541K540-L544 WeakPolarHBondContact O-CG 3.3Å; K540-L544 PolarHBondContact O-N 2.93Å; I541-L544 PolarHBondContact O-N 3.12Å; I541-L544 VanDerWaalsContact O-N 3.1Å
545S34.7Very low36.2Very low56 Ų56116.9 Ų116.939%0.39260%0.599SS.*Hα-helixtrans-74-34.2173.380.30000113.2I541 R542I541-S545 PolarHBondContact O-N 3.1Å; R542-S545 PolarHBondContact O-OG 3.42Å
546L38Very low35.5Very low109 Ų109119.3 Ų119.357%0.57161%0.611SS**Hα-helixtrans-79.1-21.8172.7-88.8113000114.3R542 R548 S549R542-L546 HydrophobicContact CG-CD1 4.02Å; R542-L546 WeakPolarHBondContact O-CB 3.37Å; R542-L546 WeakPolarHBondContact O-CD1 3.47Å; R542-L546 PolarHBondContact O-N 3.29Å; R542-L546 VanDerWaalsContact O-N 3.09Å; L546-R548 PolarHBondContact O-N 3.3Å; L546-S549 PolarHBondContact O-OG 3.1Å
547S35.5Very low34.7Very low97 Ų97115.7 Ų115.768%0.67861%0.605SS**THydrogen-bonded Turntrans-80.21.6178.7-170.20000113.6K543K543-S547 WeakPolarHBondContact O-CB 3.46Å; K543-S547 PolarHBondContact O-N 2.98Å
548R35.4Very low34.2Very low214 Ų214118.6 Ų118.681%0.80863%0.625SS**THydrogen-bonded Turntrans-1126.9175.1-123.8177.1-178.9-174.30.5114.4L546L546-R548 PolarHBondContact O-N 3.3Å
549S31.5Very low33.7Very low79 Ų79123.9 Ų123.955%0.55265%0.645SS**SBendtrans-105.76.3175.664.70000115.4L546L546-S549 PolarHBondContact O-OG 3.1Å
550N26.9Very low32.9Very low148 Ų148128.6 Ų128.679%0.79167%0.665SS**  trans-115.177176.1-81.8-17.1000111.8
551T30.1Very low32.1Very low119 Ų119129.9 Ų129.973%0.7368%0.679SS**  trans-85.3129.9151.241.30000108.7V553T551-V553 PolarHBondContact O-N 3.31Å; T551-V553 VanDerWaalsContact O-N 3.1Å
552P27.7Very low31.5Very low119 Ų119133.3 Ų133.377%0.77370%0.702SS**  trans-74.9104.5176.130.9-29.6000108.6I554P552-I554 PolarHBondContact O-N 3.42Å
553V26.1Very low30.9Very low127 Ų127133.8 Ų133.877%0.7771%0.712SS**  trans-77.796.7161.41780000106.3T551 H555T551-V553 PolarHBondContact O-N 3.31Å; T551-V553 VanDerWaalsContact O-N 3.1Å; V553-H555 PolarHBondContact O-N 3.39Å
554I31.3Very low30.1Very low152 Ų152131.4 Ų131.478%0.77972%0.716SS**  trans-68.7115.8165-69.1179.1000106.9P552 E556P552-I554 PolarHBondContact O-N 3.42Å; I554-E556 PolarHBondContact O-N 3.48Å
555H27.5Very low30.2Very low145 Ų145132.3 Ų132.367%0.67173%0.727SS**  trans-55.2120163.4-107.4-89.8000109.9V553 L557V553-H555 PolarHBondContact O-N 3.39Å; H555-L557 WeakPolarHBondContact ND1-CG 3.39Å
556E27.6Very low30.1Very low194 Ų194136.5 Ų136.591%0.90775%0.745SS**  trans-112.2108.7145.1-155.6169.9-160.300106.8I554I554-E556 PolarHBondContact O-N 3.48Å
557L27.9Very low29.9Very low117 Ų117141.4 Ų141.461%0.61376%0.756SS**  trans-80.8137.9177.4-92.7146.5000109.6H555H555-L557 WeakPolarHBondContact ND1-CG 3.39Å
558T27Very low29.7Very low102 Ų102141.5 Ų141.563%0.62676%0.756SS**  trans65111.3141.256.50000118.4
559N28.7Very low29.5Very low147 Ų147137.3 Ų137.379%0.78675%0.754SS**  174.2121.599.9-90.4-32.7000111.2
560L29.9Very low29.6Very low151 Ų151138.6 Ų138.679%0.79176%0.764SS**  trans158.892.6130.6-84.8156.8000109.2
561N25.4Very low29.9Very low173 Ų173137.6 Ų137.693%0.92576%0.762SS**  trans-135.2106.2144.2-101.3-8.7000106.4
562T31.6Very low30.1Very low120 Ų120138.2 Ų138.274%0.73677%0.766SS**  trans-100.7137.8168.435.90000109.1
563E28.2Very low30.4Very low191 Ų191137.1 Ų137.189%0.89376%0.761SS**  trans101.689.9161.5-60.9-172156.100118.8
564S26.5Very low30.8Very low108 Ų108135.7 Ų135.776%0.75576%0.756SS**  trans-75163.713162.20000109.8
565P37.6Very low30.8Very low110 Ų110136.7 Ų136.771%0.71476%0.758SS**  -156.9164.46439-17000117.6
566D31.5Very low31.2Very low144 Ų144135.5 Ų135.577%0.7776%0.756SS**  -174.6137.8117.3-107.3-17.9000116.4
567R33.7Very low31.6Very low212 Ų212134.1 Ų134.180%0.875%0.747SS**  trans79.496.2149-73.9-180172.4178-2.2123.1
568S31.2Very low31.9Very low99 Ų99134.8 Ų134.869%0.69275%0.751SS**  46.1130.8103.576.20000118.1
569V32.9Very low32.3Very low126 Ų126136.7 Ų136.776%0.76476%0.757SS**  cis-171.3158.546.9167.60000109.6
570S32.6Very low32.8Very low107 Ų107133.8 Ų133.875%0.74875%0.749SS**  trans84.1133.216069.20000118
571V33.9Very low33.4Very low126 Ų126135.4 Ų135.476%0.76475%0.749SS**  cis-166.6135.612.7119.10000110.2
572V33.8Very low34.3Very low132 Ų132133.9 Ų133.980%0.874%0.741SS**  trans78.3110.6139.4177.60000123
573S33.2Very low34.9Very low97 Ų97136.7 Ų136.768%0.67878%0.777SS**  89.8101.8125.4-175.90000123
574S34.7Very low35.3Very low96 Ų96134 Ų13467%0.67177%0.771SS**  48.2115.1118.8-470000120.1
575Q32.7Very low35.7Very low173 Ų173135.4 Ų135.481%0.80877%0.772SS**  55.3125.890.1-84.1170.5-25.300112.7
576D34.8Very low35.6Very low120 Ų120136.8 Ų136.864%0.64278%0.775SS**  -179.3159.851.7-1330.5000111.3
577K35.1Very low35.9Very low165 Ų165136.4 Ų136.472%0.71778%0.775SS**  trans84.5116.1142.1-74.5178.4-179.4170.50124.3
578L35.8Very low36Very low132 Ų132131.6 Ų131.669%0.69177%0.774SS**  94.2122.1119-106.888.5000122.3
579N35.1Very low36.3Very low141 Ų141133.8 Ų133.875%0.75478%0.779SS**  trans65142.7133.6-79.92.8000119.6
580S39.8Very low36.6Very low87 Ų87134.4 Ų134.461%0.60878%0.78SS**  cis-179.9152.1-0.3510000109.1
581K40.6Very low36.9Very low184 Ų184136.5 Ų136.580%0.878%0.783SS**  trans67.9140.2140-79.4-179.8176.2-173.90118.7
582D44.5Very low37.1Very low142 Ų142137.3 Ų137.376%0.75978%0.784SS**  cis-151.7160.924-86.2-44.4000111.7
583A45.8Very low37.4Very low179 Ų179137.8 Ų137.8100%1.47978%0.783SS**  trans75.20159.700000120.3

Retrieved 583 of 583 residues in 847.4 ms (Link to these results)

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