G4V8P1_SCHMA Loading...

Tektin

Microtubule inner protein (MIP) part of the dynein-decorated doublet microtubules (DMTs) in cilia and flagellar axoneme. Forms filamentous polymers in the walls of ciliary and flagellar microtubules.

AlphaFold DB , UniProt , Accession G4V8P1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 402 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
1M40.8Very low58Low243 Ų243150.5 Ų150.5100%1.19778%0.775SS**  0133.20-73.8-165.1-161.600108.7
2A49.9Very low60.1Low91 Ų91143.9 Ų143.975%0.75275%0.747SS**  trans51.787.4166.100000115.7L4A2-L4 PolarHBondContact O-N 3.29Å
3G46.6Very low61.8Low72 Ų72144.2 Ų144.274%0.74274%0.742SS**  trans-49.9114.5157.200000107.4V5G3-V5 PolarHBondContact O-N 3.02Å
4L52.2Low63.7Low171 Ų171145.2 Ų145.290%0.89574%0.742SS**  trans-60.688.1170.3-87142.6000105.4A2 R6A2-L4 PolarHBondContact O-N 3.29Å; L4-R6 PolarHBondContact O-N 3.33Å
5V53Low65.2Low118 Ų118141.7 Ų141.772%0.71572%0.721SS**  trans-52.796.3161.6176.10000102.4G3 Q7G3-V5 PolarHBondContact O-N 3.02Å; V5-Q7 PolarHBondContact O-N 2.83Å
6R49.2Very low66.6Low237 Ų237142.3 Ų142.389%0.89471%0.712SS**  trans-56.696.8177.5-171-179.5-174.4-171.11.6103.2L4 P8L4-R6 PolarHBondContact O-N 3.33Å; R6-P8 WeakPolarHBondContact O-CD 3.29Å
7Q52.4Low67.9Low151 Ų151136.8 Ų136.871%0.70669%0.687SS**  trans-57.8121.6-172.1-77.7-155.73.400104.8V5 Q9V5-Q7 PolarHBondContact O-N 2.83Å; Q7-Q9 PolarHBondContact O-N 3.16Å; Q7-Q9 VanDerWaalsContact O-N 3.15Å
8P65.2Low69Low93 Ų93138.2 Ų138.260%0.60468%0.684SS**  trans-54.9130.3-176.819.4-29.3000106.6R6 R10R6-P8 WeakPolarHBondContact O-CD 3.29Å; P8-R10 VanDerWaalsContact O-CG 3.31Å; P8-R10 WeakPolarHBondContact O-CG 3.34Å; P8-R10 PolarHBondContact O-N 2.91Å
9Q73Confident70Confident150 Ų150133.7 Ų133.770%0.70167%0.668SS**  trans-47.9112.9178-175.4173.73.100107.9Q7 F11Q7-Q9 PolarHBondContact O-N 3.16Å; Q7-Q9 VanDerWaalsContact O-N 3.15Å; Q9-F11 HydrophobicContact CB-CE2 4.31Å; Q9-F11 HydrophobicContact CB-CZ 4.27Å; Q9-F11 VanDerWaalsContact CD-CZ 3.48Å; Q9-F11 HydrophobicContact CG-CE1 3.97Å; Q9-F11 HydrophobicContact CG-CE2 4.14Å; Q9-F11 HydrophobicContact CG-CZ 3.72Å
10R75.1Confident71Confident210 Ų210128.6 Ų128.679%0.79264%0.643SS**  trans-92.3112.6-179.3-66.6-166.3179.2-162.4-0.4107P8P8-R10 VanDerWaalsContact O-CG 3.31Å; P8-R10 WeakPolarHBondContact O-CG 3.34Å; P8-R10 PolarHBondContact O-N 2.91Å
11F80.9Confident72Confident120 Ų120126 Ų12653%0.52663%0.631SS.*  trans-80.2141.8175.3-61.1-79.8000109.5Q9 E15Q9-F11 HydrophobicContact CB-CE2 4.31Å; Q9-F11 HydrophobicContact CB-CZ 4.27Å; Q9-F11 VanDerWaalsContact CD-CZ 3.48Å; Q9-F11 HydrophobicContact CG-CE1 3.97Å; Q9-F11 HydrophobicContact CG-CE2 4.14Å; Q9-F11 HydrophobicContact CG-CZ 3.72Å; F11-E15 WeakPolarHBondContact CA-OE2 3.49Å; F11-E15 HydrophobicContact CB-CB 3.94Å; F11-E15 HydrophobicContact CD1-CB 4.17Å
12T82.8Confident74.3Confident71 Ų71118.8 Ų118.844%0.43660%0.597SS.*  trans-64.7158169.168.50000109.4E14 E15 W16T12-E14 PolarHBondContact O-N 3.28Å; T12-E14 VanDerWaalsContact O-N 3.16Å; T12-E15 PolarHBondContact N-OE2 3.42Å; T12-E15 PolarHBondContact O-N 3.38Å; T12-E15 VanDerWaalsContact O-N 3.09Å; T12-E15 WeakPolarHBondContact OG1-CG 3.4Å; T12-E15 PolarHBondContact OG1-N 3.47Å; T12-E15 VanDerWaalsContact OG1-N 3.1Å; T12-W16 PolarHBondContact O-N 3.31Å
13H82.9Confident76.3Confident147 Ų147120.8 Ų120.868%0.68159%0.589SS**Hα-helixtrans-56.6-31.3174.5-175.566.5000111.5T17H13-T17 VanDerWaalsContact O-CB 3.24Å; H13-T17 WeakPolarHBondContact O-CB 3.49Å; H13-T17 PolarHBondContact O-N 2.77Å; H13-T17 PolarHBondContact O-OG1 2.65Å
14E87.4Confident78.4Confident159 Ų159124.4 Ų124.474%0.74358%0.581SS**Hα-helixtrans-67-45.5174.3-65.3172.5173.100112.3T12 T17 Y18T12-E14 PolarHBondContact O-N 3.28Å; T12-E14 VanDerWaalsContact O-N 3.16Å; E14-T17 PolarHBondContact O-N 3.4Å; E14-Y18 VanDerWaalsContact O-CB 3.3Å; E14-Y18 WeakPolarHBondContact O-CB 3.33Å; E14-Y18 PolarHBondContact O-N 2.78Å
15E86.1Confident80.3Confident93 Ų93125.4 Ų125.444%0.43557%0.573SS.*Hα-helixtrans-64.4-41175.9-74173.2147.700112.2F11 T12 Y18 S19F11-E15 WeakPolarHBondContact CA-OE2 3.49Å; F11-E15 HydrophobicContact CB-CB 3.94Å; F11-E15 HydrophobicContact CD1-CB 4.17Å; T12-E15 PolarHBondContact N-OE2 3.42Å; T12-E15 PolarHBondContact O-N 3.38Å; T12-E15 VanDerWaalsContact O-N 3.09Å; T12-E15 WeakPolarHBondContact OG1-CG 3.4Å; T12-E15 PolarHBondContact OG1-N 3.47Å; T12-E15 VanDerWaalsContact OG1-N 3.1Å; E15-Y18 PolarHBondContact O-N 2.99Å; E15-S19 WeakPolarHBondContact O-CB 3.39Å; E15-S19 PolarHBondContact O-N 2.88Å
16W87.8Confident82Confident151 Ų151123.3 Ų123.357%0.57256%0.564SS**Hα-helixtrans-61.7-44.6173.7-179.389.9000111.3T12 S19 N20T12-W16 PolarHBondContact O-N 3.31Å; W16-S19 PolarHBondContact O-N 3.35Å; W16-N20 VanDerWaalsContact CD2-ND2 3.29Å; W16-N20 VanDerWaalsContact CH2-ND2 3.29Å; W16-N20 WeakPolarHBondContact CH2-ND2 3.43Å; W16-N20 WeakPolarHBondContact CZ2-ND2 3.3Å; W16-N20 WeakPolarHBondContact O-CB 3.39Å; W16-N20 PolarHBondContact O-N 2.93Å; W16-N20 PolarHBondContact O-ND2 3.38Å
17T88.5Confident84Confident48 Ų48115 Ų11529%0.29455%0.546SS..Hα-helixtrans-65.3-42.2177.3-60.70000111.3H13 E14 N21H13-T17 VanDerWaalsContact O-CB 3.24Å; H13-T17 WeakPolarHBondContact O-CB 3.49Å; H13-T17 PolarHBondContact O-N 2.77Å; H13-T17 PolarHBondContact O-OG1 2.65Å; E14-T17 PolarHBondContact O-N 3.4Å; T17-N21 WeakPolarHBondContact CG2-ND2 3.45Å; T17-N21 WeakPolarHBondContact O-CB 3.22Å; T17-N21 PolarHBondContact O-N 3.02Å; T17-N21 PolarHBondContact O-ND2 3.36Å
18Y87.5Confident85.9Confident162 Ų162112.3 Ų112.364%0.63553%0.533SS*.Hα-helixtrans-63.7-47.9176.4-178.1-100.8000111.4E14 E15 N20 N21 L22E14-Y18 VanDerWaalsContact O-CB 3.3Å; E14-Y18 WeakPolarHBondContact O-CB 3.33Å; E14-Y18 PolarHBondContact O-N 2.78Å; E15-Y18 PolarHBondContact O-N 2.99Å; Y18-N20 PolarHBondContact O-N 3.38Å; Y18-N21 PolarHBondContact O-N 2.91Å; Y18-L22 HydrophobicContact CD1-CD1 4.13Å; Y18-L22 HydrophobicContact CE1-CD1 3.37Å; Y18-L22 HydrophobicContact CE2-CD1 4.44Å; Y18-L22 WeakPolarHBondContact O-CB 3.42Å; Y18-L22 PolarHBondContact O-N 3.15Å
19S88.8Confident87.2Confident54 Ų54114.4 Ų114.438%0.37853%0.533SS..Hα-helixtrans-60.4-44.8178.7-172.60000112.5E15 W16 L22 K23E15-S19 WeakPolarHBondContact O-CB 3.39Å; E15-S19 PolarHBondContact O-N 2.88Å; W16-S19 PolarHBondContact O-N 3.35Å; S19-L22 PolarHBondContact O-N 3.45Å; S19-K23 WeakPolarHBondContact O-CG 3.37Å; S19-K23 PolarHBondContact O-N 3.42Å
20N89.8Confident88.2Confident30 Ų30113.2 Ų113.216%0.1653%0.527CS..Hα-helixtrans-64.1-45.4176.2-74.4-23.8000111.6W16 Y18 L22 K23 Y24W16-N20 VanDerWaalsContact CD2-ND2 3.29Å; W16-N20 VanDerWaalsContact CH2-ND2 3.29Å; W16-N20 WeakPolarHBondContact CH2-ND2 3.43Å; W16-N20 WeakPolarHBondContact CZ2-ND2 3.3Å; W16-N20 WeakPolarHBondContact O-CB 3.39Å; W16-N20 PolarHBondContact O-N 2.93Å; W16-N20 PolarHBondContact O-ND2 3.38Å; Y18-N20 PolarHBondContact O-N 3.38Å; N20-L22 VanDerWaalsContact C-N 3.28Å; N20-L22 PolarHBondContact O-N 3.38Å; N20-K23 PolarHBondContact O-N 3.34Å; N20-Y24 HydrophobicContact CB-CE2 3.91Å; N20-Y24 WeakPolarHBondContact O-CD2 3.47Å; N20-Y24 PolarHBondContact O-N 3.06Å
21N91.6Very high89.1Confident74 Ų74111.1 Ų111.140%0.39652%0.519SS..Hα-helixtrans-59.8-38175.2-82.2-55000112.5T17 Y18 Y24 R25T17-N21 WeakPolarHBondContact CG2-ND2 3.45Å; T17-N21 WeakPolarHBondContact O-CB 3.22Å; T17-N21 PolarHBondContact O-N 3.02Å; T17-N21 PolarHBondContact O-ND2 3.36Å; Y18-N21 PolarHBondContact O-N 2.91Å; N21-Y24 PolarHBondContact O-N 2.85Å; N21-R25 WeakPolarHBondContact O-CB 3.36Å; N21-R25 VanDerWaalsContact O-CG 3.26Å; N21-R25 WeakPolarHBondContact O-CG 3.44Å; N21-R25 PolarHBondContact O-N 3.07Å
22L90.3Very high89.7Confident92 Ų92111.6 Ų111.648%0.48252%0.523SS..Hα-helixtrans-66.7-42.2177.1-138.5151.3000111.3Y18 S19 N20 R25 S26Y18-L22 HydrophobicContact CD1-CD1 4.13Å; Y18-L22 HydrophobicContact CE1-CD1 3.37Å; Y18-L22 HydrophobicContact CE2-CD1 4.44Å; Y18-L22 WeakPolarHBondContact O-CB 3.42Å; Y18-L22 PolarHBondContact O-N 3.15Å; S19-L22 PolarHBondContact O-N 3.45Å; N20-L22 VanDerWaalsContact C-N 3.28Å; N20-L22 PolarHBondContact O-N 3.38Å; L22-R25 PolarHBondContact O-N 2.81Å; L22-S26 WeakPolarHBondContact O-CB 3.45Å; L22-S26 PolarHBondContact O-N 3.16Å
23K90.6Very high90.2Very high134 Ų134112.7 Ų112.758%0.58353%0.525SS*.Hα-helixtrans-64.3-43.8173.2-72.4177.5-178.2176.30112.3S19 N20 S26 A27S19-K23 WeakPolarHBondContact O-CG 3.37Å; S19-K23 PolarHBondContact O-N 3.42Å; N20-K23 PolarHBondContact O-N 3.34Å; K23-S26 PolarHBondContact O-N 3.28Å; K23-A27 WeakPolarHBondContact O-CB 3.12Å; K23-A27 PolarHBondContact O-N 3.17Å
24Y91.8Very high90.8Very high147 Ų147108.2 Ų108.258%0.57651%0.51SS*.Hα-helixtrans-60.1-48.6175.5-60.9-32.7000111N20 N21 S26 A27 E28N20-Y24 HydrophobicContact CB-CE2 3.91Å; N20-Y24 WeakPolarHBondContact O-CD2 3.47Å; N20-Y24 PolarHBondContact O-N 3.06Å; N21-Y24 PolarHBondContact O-N 2.85Å; Y24-S26 VanDerWaalsContact C-N 3.33Å; Y24-S26 PolarHBondContact O-N 3.2Å; Y24-A27 PolarHBondContact O-N 3.19Å; Y24-E28 WeakPolarHBondContact O-CB 3.16Å; Y24-E28 PolarHBondContact O-N 3.44Å
25R91.3Very high91.1Very high193 Ų193105 Ų10573%0.72850%0.495SS*.Hα-helixtrans-60.7-40.4176.4-74.1176.9-179.3-173.80.8112.6N21 L22 K29N21-R25 WeakPolarHBondContact O-CB 3.36Å; N21-R25 VanDerWaalsContact O-CG 3.26Å; N21-R25 WeakPolarHBondContact O-CG 3.44Å; N21-R25 PolarHBondContact O-N 3.07Å; L22-R25 PolarHBondContact O-N 2.81Å; R25-K29 VanDerWaalsContact O-CB 3.28Å; R25-K29 WeakPolarHBondContact O-CB 3.25Å; R25-K29 PolarHBondContact O-N 3.11Å
26S90.3Very high91.6Very high74 Ų74102.4 Ų102.452%0.51749%0.494SS..Hα-helixtrans-66.9-42.8177-168.70000112.1L22 K23 Y24 E30L22-S26 WeakPolarHBondContact O-CB 3.45Å; L22-S26 PolarHBondContact O-N 3.16Å; K23-S26 PolarHBondContact O-N 3.28Å; Y24-S26 VanDerWaalsContact C-N 3.33Å; Y24-S26 PolarHBondContact O-N 3.2Å; S26-E30 PolarHBondContact O-N 2.9Å
27A90.6Very high91.9Very high62 Ų6299.9 Ų99.951%0.51249%0.491SS..Hα-helixtrans-68.2-40.7178.100000112K23 Y24 E30 R31K23-A27 WeakPolarHBondContact O-CB 3.12Å; K23-A27 PolarHBondContact O-N 3.17Å; Y24-A27 PolarHBondContact O-N 3.19Å; A27-E30 PolarHBondContact O-N 3.36Å; A27-R31 VanDerWaalsContact O-CB 3.3Å; A27-R31 WeakPolarHBondContact O-CB 3.34Å; A27-R31 PolarHBondContact O-N 3.39Å
28E92.4Very high92.2Very high94 Ų94102.3 Ų102.344%0.43950%0.499SS..Hα-helixtrans-63-45.5174.8-161.278.3-123.200110.7Y24 E30 R31 E32Y24-E28 WeakPolarHBondContact O-CB 3.16Å; Y24-E28 PolarHBondContact O-N 3.44Å; E28-E30 PolarHBondContact O-N 3.47Å; E28-R31 WeakPolarHBondContact O-CB 3.26Å; E28-R31 PolarHBondContact O-N 2.93Å; E28-R31 IonicContact OE1-NH1 3.45Å; E28-R31 PolarHBondContact OE1-NH1 3.14Å; E28-E32 WeakPolarHBondContact O-CG 3.46Å; E28-E32 PolarHBondContact O-N 3.44Å
29K92.7Very high92.6Very high138 Ų13899 Ų9960%0.649%0.492SS*.Hα-helixtrans-59.8-44.5176.4-175179179.7-176.80112.1R25 R31 E32 I33R25-K29 VanDerWaalsContact O-CB 3.28Å; R25-K29 WeakPolarHBondContact O-CB 3.25Å; R25-K29 PolarHBondContact O-N 3.11Å; K29-R31 VanDerWaalsContact C-N 3.34Å; K29-E32 PolarHBondContact O-N 2.85Å; K29-I33 HydrophobicContact CG-CD1 4.13Å; K29-I33 VanDerWaalsContact O-CG1 3.28Å; K29-I33 WeakPolarHBondContact O-CG1 3.47Å; K29-I33 PolarHBondContact O-N 3.05Å
30E93.5Very high92.9Very high124 Ų124101.6 Ų101.658%0.57950%0.498SS*.Hα-helixtrans-65.5-39177.1-164.464.7-156.400111.5S26 A27 E28 I33 S34S26-E30 PolarHBondContact O-N 2.9Å; A27-E30 PolarHBondContact O-N 3.36Å; E28-E30 PolarHBondContact O-N 3.47Å; E30-I33 PolarHBondContact O-N 3.43Å; E30-S34 WeakPolarHBondContact O-CB 3.29Å; E30-S34 PolarHBondContact O-N 2.97Å
31R93.6Very high93.2Very high166 Ų166102.9 Ų102.963%0.62651%0.509SS*.Hα-helixtrans-63-43.8174.6-177.2-173.8176.1-157.32.1111.7A27 E28 K29 S34 Q35A27-R31 VanDerWaalsContact O-CB 3.3Å; A27-R31 WeakPolarHBondContact O-CB 3.34Å; A27-R31 PolarHBondContact O-N 3.39Å; E28-R31 WeakPolarHBondContact O-CB 3.26Å; E28-R31 PolarHBondContact O-N 2.93Å; E28-R31 IonicContact OE1-NH1 3.45Å; E28-R31 PolarHBondContact OE1-NH1 3.14Å; K29-R31 VanDerWaalsContact C-N 3.34Å; R31-S34 PolarHBondContact O-N 3.41Å; R31-Q35 WeakPolarHBondContact O-CB 3.42Å; R31-Q35 PolarHBondContact O-N 3.1Å
32E93.7Very high93.5Very high131 Ų131104.3 Ų104.361%0.61252%0.517SS*.Hα-helixtrans-61.9-44.3175.6-75.7177.5175.800111.7E28 K29 Q35 G36E28-E32 WeakPolarHBondContact O-CG 3.46Å; E28-E32 PolarHBondContact O-N 3.44Å; K29-E32 PolarHBondContact O-N 2.85Å; E32-Q35 PolarHBondContact O-N 3.09Å; E32-G36 PolarHBondContact O-N 3.41Å
33I93.7Very high93.7Very high93 Ų93106.6 Ų106.648%0.47752%0.519SS..Hα-helixtrans-61.9-47.5175.4-68.2166.3000110.5K29 E30 Q35 G36 L37K29-I33 HydrophobicContact CG-CD1 4.13Å; K29-I33 VanDerWaalsContact O-CG1 3.28Å; K29-I33 WeakPolarHBondContact O-CG1 3.47Å; K29-I33 PolarHBondContact O-N 3.05Å; E30-I33 PolarHBondContact O-N 3.43Å; I33-Q35 VanDerWaalsContact C-N 3.34Å; I33-Q35 PolarHBondContact O-N 3.02Å; I33-G36 PolarHBondContact O-N 2.8Å; I33-L37 PolarHBondContact O-N 2.98Å
34S94.7Very high94Very high53 Ų53104.7 Ų104.737%0.37152%0.515SS..Hα-helixtrans-62.4-39.9178.3-177.20000112E30 R31 L37 Q38E30-S34 WeakPolarHBondContact O-CB 3.29Å; E30-S34 PolarHBondContact O-N 2.97Å; R31-S34 PolarHBondContact O-N 3.41Å; S34-L37 PolarHBondContact O-N 2.79Å; S34-Q38 WeakPolarHBondContact O-CB 3.27Å; S34-Q38 WeakPolarHBondContact O-CG 3.35Å; S34-Q38 PolarHBondContact O-N 3.21Å
35Q94.8Very high94.3Very high91 Ų91103 Ų10343%0.42551%0.514SS..Hα-helixtrans-67-40.1176.7-169.966.959.900111R31 E32 I33 Q38 N39R31-Q35 WeakPolarHBondContact O-CB 3.42Å; R31-Q35 PolarHBondContact O-N 3.1Å; E32-Q35 PolarHBondContact O-N 3.09Å; I33-Q35 VanDerWaalsContact C-N 3.34Å; I33-Q35 PolarHBondContact O-N 3.02Å; Q35-Q38 PolarHBondContact O-N 3.42Å; Q35-N39 PolarHBondContact NE2-OD1 3.47Å; Q35-N39 PolarHBondContact O-N 2.7Å; Q35-N39 PolarHBondContact O-ND2 2.78Å; Q35-N39 PolarHBondContact O-OD1 3.47Å
36G94.9Very high94.5Very high39 Ų3998.8 Ų98.840%0.40250%0.503SS..Hα-helixtrans-59.5-46.1172.500000112.3E32 I33 N39 E40E32-G36 PolarHBondContact O-N 3.41Å; I33-G36 PolarHBondContact O-N 2.8Å; G36-N39 PolarHBondContact O-N 2.88Å; G36-E40 PolarHBondContact O-N 3.35Å
37L95Very high94.8Very high98 Ų9899.5 Ų99.551%0.51350%0.498SS..Hα-helixtrans-65.1-42.1177.4-178.962.6000112.2I33 S34 N39 E40 C41I33-L37 PolarHBondContact O-N 2.98Å; S34-L37 PolarHBondContact O-N 2.79Å; L37-N39 PolarHBondContact O-N 3.45Å; L37-E40 PolarHBondContact O-N 3.26Å; L37-C41 WeakPolarHBondContact O-CB 3.1Å; L37-C41 PolarHBondContact O-N 2.93Å; L37-C41 PolarHBondContact O-SG 3.17Å; L37-C41 VanDerWaalsContact O-SG 3.32Å
38Q95.5Very high95.1Very high99 Ų9998.9 Ų98.946%0.46349%0.488SS..Hα-helixtrans-58.7-47.3174.8-77.9175.70.100111.3S34 Q35 E40 C41 D42S34-Q38 WeakPolarHBondContact O-CB 3.27Å; S34-Q38 WeakPolarHBondContact O-CG 3.35Å; S34-Q38 PolarHBondContact O-N 3.21Å; Q35-Q38 PolarHBondContact O-N 3.42Å; Q38-E40 VanDerWaalsContact C-N 3.28Å; Q38-E40 PolarHBondContact O-N 3.28Å; Q38-C41 PolarHBondContact O-N 3.04Å; Q38-D42 PolarHBondContact O-N 3.03Å
39N95.1Very high95.3Very high92 Ų9297 Ų9749%0.49249%0.488SS..Hα-helixtrans-61.5-36.8177-65.2-14.3000112Q35 G36 L37 R43Q35-N39 PolarHBondContact NE2-OD1 3.47Å; Q35-N39 PolarHBondContact O-N 2.7Å; Q35-N39 PolarHBondContact O-ND2 2.78Å; Q35-N39 PolarHBondContact O-OD1 3.47Å; G36-N39 PolarHBondContact O-N 2.88Å; L37-N39 PolarHBondContact O-N 3.45Å; N39-R43 WeakPolarHBondContact O-CB 3.33Å; N39-R43 PolarHBondContact O-N 3.43Å; N39-R43 VanDerWaalsContact O-N 3.08Å
40E95.7Very high95.4Very high109 Ų10996.3 Ų96.351%0.50949%0.485SS..Hα-helixtrans-68.2-43175.1-175.2173.7-168.400112.1G36 L37 Q38 R43 L44G36-E40 PolarHBondContact O-N 3.35Å; L37-E40 PolarHBondContact O-N 3.26Å; Q38-E40 VanDerWaalsContact C-N 3.28Å; Q38-E40 PolarHBondContact O-N 3.28Å; E40-R43 PolarHBondContact O-N 3.27Å; E40-L44 WeakPolarHBondContact O-CB 3.43Å; E40-L44 PolarHBondContact O-N 3.22Å
41C96.1Very high95.6Very high58 Ų5897 Ų9739%0.39248%0.483SS..Hα-helixtrans-61.6-46.8175-72.30000111.6L37 Q38 R43 L44 I45L37-C41 WeakPolarHBondContact O-CB 3.1Å; L37-C41 PolarHBondContact O-N 2.93Å; L37-C41 PolarHBondContact O-SG 3.17Å; L37-C41 VanDerWaalsContact O-SG 3.32Å; Q38-C41 PolarHBondContact O-N 3.04Å; C41-R43 VanDerWaalsContact C-N 3.34Å; C41-R43 PolarHBondContact O-N 3.06Å; C41-L44 PolarHBondContact O-N 2.99Å; C41-L44 VanDerWaalsContact O-N 3.17Å; C41-I45 VanDerWaalsContact O-CG1 3.26Å; C41-I45 WeakPolarHBondContact O-CG1 2.87Å; C41-I45 PolarHBondContact O-N 3.27Å
42D96.5Very high95.7Very high103 Ų10392.9 Ų92.955%0.55148%0.476SS*.Hα-helixtrans-60.6-44.8178.3-72.3-17.4000111Q38 L44 I45 E46Q38-D42 PolarHBondContact O-N 3.03Å; D42-L44 PolarHBondContact O-N 2.92Å; D42-I45 PolarHBondContact O-N 2.78Å; D42-E46 PolarHBondContact O-N 2.96Å
43R95.4Very high95.8Very high141 Ų14191.4 Ų91.453%0.53247%0.469SS..Hα-helixtrans-60.1-45.8174-176.1-176.465.8163.6-0.2111.5N39 E40 C41 I45 E46 E47N39-R43 WeakPolarHBondContact O-CB 3.33Å; N39-R43 PolarHBondContact O-N 3.43Å; N39-R43 VanDerWaalsContact O-N 3.08Å; E40-R43 PolarHBondContact O-N 3.27Å; C41-R43 VanDerWaalsContact C-N 3.34Å; C41-R43 PolarHBondContact O-N 3.06Å; R43-I45 PolarHBondContact O-N 2.95Å; R43-E46 PolarHBondContact O-N 3.36Å; R43-E47 WeakPolarHBondContact CD-OE1 3.37Å; R43-E47 HydrophobicContact CG-CG 4.26Å; R43-E47 WeakPolarHBondContact CG-OE1 3.36Å; R43-E47 IonicContact NE-OE1 3.36Å; R43-E47 WeakPolarHBondContact O-CB 3.47Å; R43-E47 VanDerWaalsContact O-CG 3.32Å; R43-E47 WeakPolarHBondContact O-CG 3.39Å; R43-E47 PolarHBondContact O-N 2.87Å
44L96.8Very high95.9Very high94 Ų9494.8 Ų94.849%0.49248%0.481SS..Hα-helixtrans-64.6-39.4-179.8-177.762.9000111.7E40 C41 D42 T48E40-L44 WeakPolarHBondContact O-CB 3.43Å; E40-L44 PolarHBondContact O-N 3.22Å; C41-L44 PolarHBondContact O-N 2.99Å; C41-L44 VanDerWaalsContact O-N 3.17Å; D42-L44 PolarHBondContact O-N 2.92Å; L44-T48 HydrophobicContact CD1-CG2 3.9Å; L44-T48 HydrophobicContact CG-CG2 4.21Å; L44-T48 VanDerWaalsContact O-CB 3.26Å; L44-T48 WeakPolarHBondContact O-CB 3.38Å; L44-T48 WeakPolarHBondContact O-CG2 3.29Å; L44-T48 PolarHBondContact O-N 3.35Å; L44-T48 PolarHBondContact O-OG1 2.86Å
45I97.1Very high96Very high110 Ų11096 Ų9656%0.56449%0.486SS*.Hα-helixtrans-61.1-47.1174.7-70.5164.6000110C41 D42 R43 T48 A49C41-I45 VanDerWaalsContact O-CG1 3.26Å; C41-I45 WeakPolarHBondContact O-CG1 2.87Å; C41-I45 PolarHBondContact O-N 3.27Å; D42-I45 PolarHBondContact O-N 2.78Å; R43-I45 PolarHBondContact O-N 2.95Å; I45-T48 WeakPolarHBondContact CA-OG1 3.29Å; I45-T48 PolarHBondContact O-OG1 2.96Å; I45-A49 VanDerWaalsContact O-CB 3.23Å; I45-A49 WeakPolarHBondContact O-CB 3.49Å; I45-A49 PolarHBondContact O-N 3.23Å
46E96.3Very high96Very high105 Ų10595.2 Ų95.249%0.49148%0.484SS..Hα-helixtrans-65.7-45.4179.4-168.9-174.6166.500112.2D42 R43 A49 K50D42-E46 PolarHBondContact O-N 2.96Å; R43-E46 PolarHBondContact O-N 3.36Å; E46-A49 PolarHBondContact O-N 3.47Å; E46-K50 HydrophobicContact CG-CD 4.25Å; E46-K50 WeakPolarHBondContact O-CB 3.32Å; E46-K50 WeakPolarHBondContact O-CG 3.45Å; E46-K50 PolarHBondContact O-N 3.01Å; E46-K50 VanDerWaalsContact OE1-CE 3.27Å; E46-K50 WeakPolarHBondContact OE1-CE 3.3Å; E46-K50 IonicContact OE1-NZ 3.84Å; E46-K50 PolarHBondContact OE1-NZ 3.34Å
47E96.9Very high96Very high89 Ų8998.8 Ų98.842%0.41649%0.488SS..Hα-helixtrans-63.2-43.3178.3-75.9179-172.700111.9R43 R51R43-E47 WeakPolarHBondContact CD-OE1 3.37Å; R43-E47 HydrophobicContact CG-CG 4.26Å; R43-E47 WeakPolarHBondContact CG-OE1 3.36Å; R43-E47 IonicContact NE-OE1 3.36Å; R43-E47 WeakPolarHBondContact O-CB 3.47Å; R43-E47 VanDerWaalsContact O-CG 3.32Å; R43-E47 WeakPolarHBondContact O-CG 3.39Å; R43-E47 PolarHBondContact O-N 2.87Å; E47-R51 VanDerWaalsContact O-CB 3.26Å; E47-R51 WeakPolarHBondContact O-CB 3.5Å; E47-R51 PolarHBondContact O-N 3.07Å
48T96.7Very high96.1Very high49 Ų4997.7 Ų97.730%0.30148%0.483SS..Hα-helixtrans-66.8-42.1176.954.30000111.2L44 I45 R51 T52L44-T48 HydrophobicContact CD1-CG2 3.9Å; L44-T48 HydrophobicContact CG-CG2 4.21Å; L44-T48 VanDerWaalsContact O-CB 3.26Å; L44-T48 WeakPolarHBondContact O-CB 3.38Å; L44-T48 WeakPolarHBondContact O-CG2 3.29Å; L44-T48 PolarHBondContact O-N 3.35Å; L44-T48 PolarHBondContact O-OG1 2.86Å; I45-T48 WeakPolarHBondContact CA-OG1 3.29Å; I45-T48 PolarHBondContact O-OG1 2.96Å; T48-R51 PolarHBondContact O-N 2.84Å; T48-T52 WeakPolarHBondContact O-CB 3.37Å; T48-T52 PolarHBondContact O-N 3.05Å; T48-T52 PolarHBondContact O-OG1 3.48Å
49A95.9Very high96.2Very high54 Ų5495.9 Ų95.945%0.44648%0.479SS..Hα-helixtrans-60.3-49.5175.700000111.9I45 E46 R51 T52 E53I45-A49 VanDerWaalsContact O-CB 3.23Å; I45-A49 WeakPolarHBondContact O-CB 3.49Å; I45-A49 PolarHBondContact O-N 3.23Å; E46-A49 PolarHBondContact O-N 3.47Å; A49-R51 VanDerWaalsContact C-N 3.35Å; A49-R51 PolarHBondContact O-N 2.94Å; A49-T52 PolarHBondContact O-N 3.44Å; A49-E53 WeakPolarHBondContact O-CB 3.26Å; A49-E53 PolarHBondContact O-N 2.94Å
50K96.7Very high96.3Very high124 Ų12495.8 Ų95.854%0.53948%0.475SS..Hα-helixtrans-60.7-42.4177.3-76.6174.1172169.80112.3E46 K54E46-K50 HydrophobicContact CG-CD 4.25Å; E46-K50 WeakPolarHBondContact O-CB 3.32Å; E46-K50 WeakPolarHBondContact O-CG 3.45Å; E46-K50 PolarHBondContact O-N 3.01Å; E46-K50 VanDerWaalsContact OE1-CE 3.27Å; E46-K50 WeakPolarHBondContact OE1-CE 3.3Å; E46-K50 IonicContact OE1-NZ 3.84Å; E46-K50 PolarHBondContact OE1-NZ 3.34Å; K50-K54 WeakPolarHBondContact O-CB 3.23Å; K50-K54 PolarHBondContact O-N 3.38Å
51R97.1Very high96.3Very high139 Ų13996.7 Ų96.753%0.52548%0.478SS..Hα-helixtrans-64.4-45.3177.3179.3168.752.2-133.2-6.6111E47 T48 A49 K54 T55E47-R51 VanDerWaalsContact O-CB 3.26Å; E47-R51 WeakPolarHBondContact O-CB 3.5Å; E47-R51 PolarHBondContact O-N 3.07Å; T48-R51 PolarHBondContact O-N 2.84Å; A49-R51 VanDerWaalsContact C-N 3.35Å; A49-R51 PolarHBondContact O-N 2.94Å; R51-K54 PolarHBondContact O-N 2.93Å; R51-T55 WeakPolarHBondContact O-CB 3.45Å; R51-T55 PolarHBondContact O-N 2.81Å; R51-T55 PolarHBondContact O-OG1 3.39Å; R51-T55 VanDerWaalsContact O-OG1 3.1Å
52T95.1Very high96.4Very high79 Ų7999.3 Ų99.349%0.48548%0.482SS..Hα-helixtrans-61.5-48.1176.9-61.10000111.3T48 A49 K54 T55 L56T48-T52 WeakPolarHBondContact O-CB 3.37Å; T48-T52 PolarHBondContact O-N 3.05Å; T48-T52 PolarHBondContact O-OG1 3.48Å; A49-T52 PolarHBondContact O-N 3.44Å; T52-K54 VanDerWaalsContact C-N 3.35Å; T52-K54 PolarHBondContact O-N 3.22Å; T52-T55 PolarHBondContact O-N 3.19Å; T52-L56 HydrophobicContact CG2-CD1 4.1Å; T52-L56 HydrophobicContact CG2-CG 4.41Å; T52-L56 WeakPolarHBondContact O-CG 3.32Å; T52-L56 PolarHBondContact O-N 2.95Å
53E95.7Very high96.4Very high101 Ų10197.3 Ų97.347%0.47247%0.469SS..Hα-helixtrans-59-45.4177.3-173.4-170.7173.400111.7A49 T55 L56 K57A49-E53 WeakPolarHBondContact O-CB 3.26Å; A49-E53 PolarHBondContact O-N 2.94Å; E53-T55 PolarHBondContact O-N 3.04Å; E53-L56 PolarHBondContact O-N 3.19Å; E53-K57 HydrophobicContact CG-CD 4.49Å; E53-K57 WeakPolarHBondContact O-CG 3.4Å; E53-K57 PolarHBondContact O-N 3.01Å; E53-K57 VanDerWaalsContact OE1-CE 3.28Å; E53-K57 WeakPolarHBondContact OE1-CE 3.45Å; E53-K57 IonicContact OE1-NZ 2.61Å; E53-K57 PolarHBondContact OE1-NZ 3.25Å
54K97.1Very high96.5Very high164 Ų16495 Ų9571%0.71347%0.467SS*.Hα-helixtrans-61.5-44.1177.1-177.8-179.5176.6-177.70111.6K50 R51 T52 D58K50-K54 WeakPolarHBondContact O-CB 3.23Å; K50-K54 PolarHBondContact O-N 3.38Å; R51-K54 PolarHBondContact O-N 2.93Å; T52-K54 VanDerWaalsContact C-N 3.35Å; T52-K54 PolarHBondContact O-N 3.22Å; K54-D58 WeakPolarHBondContact O-CB 3.38Å; K54-D58 PolarHBondContact O-N 2.92Å
55T95.9Very high96.5Very high79 Ų7996.1 Ų96.149%0.48547%0.47SS..Hα-helixtrans-64.4-42.7178.1-670000111.4R51 T52 E53 D58 V59R51-T55 WeakPolarHBondContact O-CB 3.45Å; R51-T55 PolarHBondContact O-N 2.81Å; R51-T55 PolarHBondContact O-OG1 3.39Å; R51-T55 VanDerWaalsContact O-OG1 3.1Å; T52-T55 PolarHBondContact O-N 3.19Å; E53-T55 PolarHBondContact O-N 3.04Å; T55-D58 PolarHBondContact O-N 3.48Å; T55-V59 HydrophobicContact CG2-CG2 4.44Å; T55-V59 WeakPolarHBondContact O-CG2 3.4Å; T55-V59 PolarHBondContact O-N 3.48Å
56L94.7Very high96.5Very high73 Ų7394.4 Ų94.438%0.38246%0.456SS..Hα-helixtrans-58.6-50.8176.1-72.2172.8000111.1T52 E53 D58 V59 E60 P193T52-L56 HydrophobicContact CG2-CD1 4.1Å; T52-L56 HydrophobicContact CG2-CG 4.41Å; T52-L56 WeakPolarHBondContact O-CG 3.32Å; T52-L56 PolarHBondContact O-N 2.95Å; E53-L56 PolarHBondContact O-N 3.19Å; L56-D58 VanDerWaalsContact C-N 3.32Å; L56-D58 PolarHBondContact O-N 3.36Å; L56-V59 PolarHBondContact O-N 3.21Å; L56-V59 VanDerWaalsContact O-N 3.15Å; L56-E60 WeakPolarHBondContact O-CG 3.46Å; L56-E60 PolarHBondContact O-N 3.37Å; L56-P193 HydrophobicContact CD1-CG 4.11Å
57K95.6Very high96.6Very high114 Ų11490 Ų9050%0.49644%0.436SS..Hα-helixtrans-60.9-38177.9-70.9179.9-175.1171.60113.3E53 K61E53-K57 HydrophobicContact CG-CD 4.49Å; E53-K57 WeakPolarHBondContact O-CG 3.4Å; E53-K57 PolarHBondContact O-N 3.01Å; E53-K57 VanDerWaalsContact OE1-CE 3.28Å; E53-K57 WeakPolarHBondContact OE1-CE 3.45Å; E53-K57 IonicContact OE1-NZ 2.61Å; E53-K57 PolarHBondContact OE1-NZ 3.25Å; K57-K61 WeakPolarHBondContact O-CB 3.43Å; K57-K61 PolarHBondContact O-N 2.91Å; K57-K61 VanDerWaalsContact O-N 3.08Å
58D97.3Very high96.6Very high76 Ų7688.5 Ų88.541%0.40644%0.439SS..Hα-helixtrans-65.2-41.4176.4-17860.4000111.7K54 T55 L56 K62K54-D58 WeakPolarHBondContact O-CB 3.38Å; K54-D58 PolarHBondContact O-N 2.92Å; T55-D58 PolarHBondContact O-N 3.48Å; L56-D58 VanDerWaalsContact C-N 3.32Å; L56-D58 PolarHBondContact O-N 3.36Å; D58-K62 WeakPolarHBondContact O-CG 3.28Å; D58-K62 PolarHBondContact O-N 2.99Å; D58-K62 VanDerWaalsContact O-N 3.13Å; D58-K62 IonicContact OD1-NZ 3.4Å; D58-K62 WeakPolarHBondContact OD2-CE 3.44Å; D58-K62 IonicContact OD2-NZ 2.64Å; D58-K62 PolarHBondContact OD2-NZ 3.28Å
59V96.2Very high96.6Very high60 Ų6088.9 Ų88.936%0.36444%0.439SS..Hα-helixtrans-70-44.2178.1171.70000111.4T55 L56 K61 K62 F63T55-V59 HydrophobicContact CG2-CG2 4.44Å; T55-V59 WeakPolarHBondContact O-CG2 3.4Å; T55-V59 PolarHBondContact O-N 3.48Å; L56-V59 PolarHBondContact O-N 3.21Å; L56-V59 VanDerWaalsContact O-N 3.15Å; V59-K61 VanDerWaalsContact C-N 3.3Å; V59-K61 PolarHBondContact O-N 3.27Å; V59-K62 WeakPolarHBondContact O-CA 3.37Å; V59-K62 WeakPolarHBondContact O-CB 3.23Å; V59-K62 PolarHBondContact O-N 2.94Å; V59-F63 HydrophobicContact CG1-CD2 3.72Å; V59-F63 HydrophobicContact CG1-CE2 3.53Å; V59-F63 WeakPolarHBondContact O-CD2 3.47Å; V59-F63 PolarHBondContact O-N 2.85Å
60E96.7Very high96.7Very high91 Ų9186.3 Ų86.343%0.42542%0.418SS..Hα-helixtrans-54.3-47173.4-73.6171.3-178.300111.2L56 K62 F63 D64 L189L56-E60 WeakPolarHBondContact O-CG 3.46Å; L56-E60 PolarHBondContact O-N 3.37Å; E60-K62 VanDerWaalsContact C-N 3.29Å; E60-K62 PolarHBondContact O-N 3.25Å; E60-F63 WeakPolarHBondContact O-CB 3.31Å; E60-F63 PolarHBondContact O-N 3.47Å; E60-F63 VanDerWaalsContact O-N 3.12Å; E60-D64 PolarHBondContact O-N 3.29Å; E60-L189 HydrophobicContact CB-CD1 3.96Å; E60-L189 HydrophobicContact CG-CD1 3.95Å
61K97.1Very high96.8Very high128 Ų12884.5 Ų84.556%0.55741%0.41SS*.Hα-helixtrans-61.2-36.4176.5-174.3179.1-179.7-178.50112.7K57 V59 D64 Q65K57-K61 WeakPolarHBondContact O-CB 3.43Å; K57-K61 PolarHBondContact O-N 2.91Å; K57-K61 VanDerWaalsContact O-N 3.08Å; V59-K61 VanDerWaalsContact C-N 3.3Å; V59-K61 PolarHBondContact O-N 3.27Å; K61-D64 PolarHBondContact O-N 2.93Å; K61-Q65 VanDerWaalsContact O-CG 3.3Å; K61-Q65 WeakPolarHBondContact O-CG 3.31Å; K61-Q65 PolarHBondContact O-N 3.04Å; K61-Q65 VanDerWaalsContact O-N 3.1Å
62K97.2Very high96.8Very high113 Ų11383.7 Ų83.749%0.49141%0.408SS..Hα-helixtrans-69.5-36.9175.8-74.5167.5176.1163.10111.7D58 V59 E60 Q65 R66D58-K62 WeakPolarHBondContact O-CG 3.28Å; D58-K62 PolarHBondContact O-N 2.99Å; D58-K62 VanDerWaalsContact O-N 3.13Å; D58-K62 IonicContact OD1-NZ 3.4Å; D58-K62 WeakPolarHBondContact OD2-CE 3.44Å; D58-K62 IonicContact OD2-NZ 2.64Å; D58-K62 PolarHBondContact OD2-NZ 3.28Å; V59-K62 WeakPolarHBondContact O-CA 3.37Å; V59-K62 WeakPolarHBondContact O-CB 3.23Å; V59-K62 PolarHBondContact O-N 2.94Å; E60-K62 VanDerWaalsContact C-N 3.29Å; E60-K62 PolarHBondContact O-N 3.25Å; K62-Q65 PolarHBondContact O-N 3.32Å; K62-R66 WeakPolarHBondContact O-CB 3.42Å; K62-R66 PolarHBondContact O-N 2.97Å
63F96.8Very high96.9Very high61 Ų6181.2 Ų81.227%0.26839%0.39SS..Hα-helixtrans-61.9-47.9171-85.6-70.8000111.4V59 E60 Q65 R66 I67 D185 A188 L189V59-F63 HydrophobicContact CG1-CD2 3.72Å; V59-F63 HydrophobicContact CG1-CE2 3.53Å; V59-F63 WeakPolarHBondContact O-CD2 3.47Å; V59-F63 PolarHBondContact O-N 2.85Å; E60-F63 WeakPolarHBondContact O-CB 3.31Å; E60-F63 PolarHBondContact O-N 3.47Å; E60-F63 VanDerWaalsContact O-N 3.12Å; F63-Q65 VanDerWaalsContact C-N 3.29Å; F63-Q65 PolarHBondContact O-N 3.32Å; F63-R66 PolarHBondContact O-N 3Å; F63-R66 VanDerWaalsContact O-N 3.08Å; F63-I67 WeakPolarHBondContact O-CB 3.37Å; F63-I67 VanDerWaalsContact O-CG1 3.3Å; F63-I67 WeakPolarHBondContact O-CG1 3.29Å; F63-I67 PolarHBondContact O-N 3.25Å; F63-D185 HydrophobicContact CD1-CB 4.27Å; F63-A188 HydrophobicContact CE1-CB 4.05Å; F63-A188 HydrophobicContact CZ-CB 4.16Å; F63-L189 HydrophobicContact CB-CB 4.32Å; F63-L189 HydrophobicContact CB-CD1 3.94Å; F63-L189 HydrophobicContact CB-CD2 4.36Å; F63-L189 HydrophobicContact CB-CG 4.44Å
64D97.7Very high97Very high93 Ų9378.3 Ų78.350%0.49738%0.375SS..Hα-helixtrans-55-46176.2-78-34.8000111.9E60 K61 I67 A68 L189E60-D64 PolarHBondContact O-N 3.29Å; K61-D64 PolarHBondContact O-N 2.93Å; D64-I67 PolarHBondContact O-N 2.95Å; D64-A68 WeakPolarHBondContact O-CB 3.38Å; D64-A68 PolarHBondContact O-N 3.04Å; D64-L189 VanDerWaalsContact OD1-CD2 3.31Å; D64-L189 WeakPolarHBondContact OD1-CD2 3.42Å
65Q97.2Very high97Very high117 Ų11773.3 Ų73.355%0.54736%0.361SS..Hα-helixtrans-61.9-43.3176.4-72.6173.9-2.600112.1K61 K62 F63 N69K61-Q65 VanDerWaalsContact O-CG 3.3Å; K61-Q65 WeakPolarHBondContact O-CG 3.31Å; K61-Q65 PolarHBondContact O-N 3.04Å; K61-Q65 VanDerWaalsContact O-N 3.1Å; K62-Q65 PolarHBondContact O-N 3.32Å; F63-Q65 VanDerWaalsContact C-N 3.29Å; F63-Q65 PolarHBondContact O-N 3.32Å; Q65-N69 WeakPolarHBondContact O-CB 3.3Å; Q65-N69 PolarHBondContact O-N 2.89Å
66R96.6Very high97.1Very high74 Ų7472.8 Ų72.828%0.27935%0.353SS..Hα-helixtrans-65.9-46.3178.6-178.457.7178.3169.71.1111.4K62 F63 A68 N69 V70 D185K62-R66 WeakPolarHBondContact O-CB 3.42Å; K62-R66 PolarHBondContact O-N 2.97Å; F63-R66 PolarHBondContact O-N 3Å; F63-R66 VanDerWaalsContact O-N 3.08Å; R66-A68 VanDerWaalsContact C-N 3.34Å; R66-A68 PolarHBondContact O-N 3.29Å; R66-N69 PolarHBondContact O-N 3.38Å; R66-V70 HydrophobicContact CG-CG2 4.38Å; R66-V70 WeakPolarHBondContact O-CG2 3.38Å; R66-V70 PolarHBondContact O-N 2.85Å; R66-D185 WeakPolarHBondContact CG-OD2 3.46Å
67I97.9Very high97.2Very high11 Ų1169.3 Ų69.36%0.05634%0.335CS..Hα-helixtrans-59.6-45.5177.6-68.7163.8000110.2F63 D64 N69 V70 K71 Q182 D185 E186 L189F63-I67 WeakPolarHBondContact O-CB 3.37Å; F63-I67 VanDerWaalsContact O-CG1 3.3Å; F63-I67 WeakPolarHBondContact O-CG1 3.29Å; F63-I67 PolarHBondContact O-N 3.25Å; D64-I67 PolarHBondContact O-N 2.95Å; I67-N69 VanDerWaalsContact C-N 3.34Å; I67-N69 PolarHBondContact O-N 3.46Å; I67-V70 PolarHBondContact O-N 3.46Å; I67-K71 HydrophobicContact CG2-CD 3.97Å; I67-K71 HydrophobicContact CG2-CG 4.46Å; I67-K71 WeakPolarHBondContact O-CB 3.49Å; I67-K71 VanDerWaalsContact O-CG 3.31Å; I67-K71 WeakPolarHBondContact O-CG 3.43Å; I67-K71 PolarHBondContact O-N 3.32Å; I67-Q182 HydrophobicContact CG2-CG 4.45Å; I67-D185 HydrophobicContact CD1-CB 4.1Å; I67-D185 HydrophobicContact CG1-CB 3.6Å; I67-E186 HydrophobicContact CD1-CG 3.94Å; I67-E186 HydrophobicContact CG1-CG 4.33Å; I67-E186 HydrophobicContact CG2-CG 4.09Å; I67-L189 HydrophobicContact CD1-CB 4.39Å; I67-L189 HydrophobicContact CD1-CD2 3.73Å
68A97.7Very high97.3Very high59 Ų5966.9 Ų66.949%0.48833%0.327SS..Hα-helixtrans-60.1-43.5176.500000111.9D64 R66 K71 Y72D64-A68 WeakPolarHBondContact O-CB 3.38Å; D64-A68 PolarHBondContact O-N 3.04Å; R66-A68 VanDerWaalsContact C-N 3.34Å; R66-A68 PolarHBondContact O-N 3.29Å; A68-K71 PolarHBondContact O-N 3.43Å; A68-Y72 PolarHBondContact O-N 3.42Å
69N96.8Very high97.3Very high57 Ų5769.4 Ų69.431%0.30534%0.335SS..Hα-helixtrans-65.8-44.4178.2-164.311.4000111.9Q65 R66 I67 K71 Y72 W73Q65-N69 WeakPolarHBondContact O-CB 3.3Å; Q65-N69 PolarHBondContact O-N 2.89Å; R66-N69 PolarHBondContact O-N 3.38Å; I67-N69 VanDerWaalsContact C-N 3.34Å; I67-N69 PolarHBondContact O-N 3.46Å; N69-K71 PolarHBondContact O-N 2.86Å; N69-Y72 PolarHBondContact O-N 3.4Å; N69-W73 VanDerWaalsContact O-CD1 3.3Å; N69-W73 PolarHBondContact O-N 3.45Å; N69-W73 PolarHBondContact OD1-NE1 3.19Å; N69-W73 VanDerWaalsContact OD1-NE1 3.16Å
70V97.8Very high97.3Very high0 Ų068 Ų680%032%0.324CS..Hα-helixtrans-61.9-43.3175.9172.80000110.8R66 I67 Y72 W73 K74 K178 Q182 W217R66-V70 HydrophobicContact CG-CG2 4.38Å; R66-V70 WeakPolarHBondContact O-CG2 3.38Å; R66-V70 PolarHBondContact O-N 2.85Å; I67-V70 PolarHBondContact O-N 3.46Å; V70-Y72 PolarHBondContact O-N 2.77Å; V70-W73 PolarHBondContact O-N 2.94Å; V70-K74 WeakPolarHBondContact O-CB 3.44Å; V70-K74 PolarHBondContact O-N 3.28Å; V70-K178 HydrophobicContact CG1-CB 4.15Å; V70-K178 VanDerWaalsContact CG1-O 3.25Å; V70-K178 WeakPolarHBondContact CG1-O 3.31Å; V70-Q182 HydrophobicContact CG1-CB 3.97Å; V70-W217 HydrophobicContact CG2-CH2 4.36Å; V70-W217 HydrophobicContact CG2-CZ2 4.02Å
71K97.8Very high97.4Very high86 Ų8664.6 Ų64.637%0.37431%0.309SS..Hα-helixtrans-58.9-46.5175.8-78.9175.1178.31700112I67 A68 N69 K74 S75 Q182 E186I67-K71 HydrophobicContact CG2-CD 3.97Å; I67-K71 HydrophobicContact CG2-CG 4.46Å; I67-K71 WeakPolarHBondContact O-CB 3.49Å; I67-K71 VanDerWaalsContact O-CG 3.31Å; I67-K71 WeakPolarHBondContact O-CG 3.43Å; I67-K71 PolarHBondContact O-N 3.32Å; A68-K71 PolarHBondContact O-N 3.43Å; N69-K71 PolarHBondContact O-N 2.86Å; K71-K74 PolarHBondContact O-N 3.04Å; K71-S75 PolarHBondContact O-N 2.88Å; K71-S75 PolarHBondContact O-OG 3.49Å; K71-Q182 HydrophobicContact CG-CG 4.18Å; K71-E186 WeakPolarHBondContact CE-OE1 3.06Å; K71-E186 IonicContact NZ-OE1 2.68Å; K71-E186 PolarHBondContact NZ-OE1 3.46Å
72Y97.5Very high97.4Very high121 Ų12163.4 Ų63.448%0.47531%0.305SS..Hα-helixtrans-59.2-54.5177.1171.7-96.8000111.8A68 N69 V70 K74 S75 E76A68-Y72 PolarHBondContact O-N 3.42Å; N69-Y72 PolarHBondContact O-N 3.4Å; V70-Y72 PolarHBondContact O-N 2.77Å; Y72-K74 VanDerWaalsContact C-N 3.27Å; Y72-K74 PolarHBondContact O-N 3.32Å; Y72-S75 PolarHBondContact O-N 3.39Å; Y72-S75 VanDerWaalsContact O-N 3.11Å; Y72-S75 PolarHBondContact O-OG 3.14Å; Y72-E76 HydrophobicContact CE1-CG 4.04Å; Y72-E76 HydrophobicContact CE2-CG 4.15Å; Y72-E76 PolarHBondContact O-N 3.31Å
73W97.3Very high97.5Very high28 Ų2860.7 Ų60.711%0.10630%0.296CS..Hα-helixtrans-66.2-31.4-179.3-76.4100.2000112.6N69 V70 E76 V77 K178 W217 Q218 T222 I225N69-W73 VanDerWaalsContact O-CD1 3.3Å; N69-W73 PolarHBondContact O-N 3.45Å; N69-W73 PolarHBondContact OD1-NE1 3.19Å; N69-W73 VanDerWaalsContact OD1-NE1 3.16Å; V70-W73 PolarHBondContact O-N 2.94Å; W73-E76 PolarHBondContact O-N 3.34Å; W73-V77 WeakPolarHBondContact O-CB 3.45Å; W73-V77 VanDerWaalsContact O-CG2 3.23Å; W73-V77 WeakPolarHBondContact O-CG2 3.49Å; W73-V77 PolarHBondContact O-N 3.06Å; W73-K178 HydrophobicContact CB-CD 4.32Å; W73-W217 HydrophobicContact CB-CH2 3.74Å; W73-W217 HydrophobicContact CB-CZ2 4.23Å; W73-W217 AromaticContact CD1-CH2 3.29Å; W73-W217 AromaticContact CD1-CZ3 3.38Å; W73-W217 AromaticContact CG-CH2 3.66Å; W73-W217 HydrophobicContact CG-CH2 3.66Å; W73-W217 AromaticContact CG-CZ3 4Å; W73-W217 HydrophobicContact CG-CZ3 4Å; W73-W217 AromaticContact NE1-CZ3 3.83Å; W73-Q218 HydrophobicContact CH2-CG 4.06Å; W73-Q218 HydrophobicContact CZ2-CG 3.46Å; W73-Q218 VanDerWaalsContact CZ2-CG 3.46Å; W73-T222 WeakPolarHBondContact CH2-OG1 3.43Å; W73-I225 HydrophobicContact CE3-CD1 4.07Å; W73-I225 HydrophobicContact CZ3-CD1 3.91Å
74K97.3Very high97.5Very high39 Ų3957.8 Ų57.817%0.1728%0.283CS..Hα-helixtrans-64.2-42.3172.8-169.2-172.272.4174.60111.3V70 K71 Y72 N78 K178 L179V70-K74 WeakPolarHBondContact O-CB 3.44Å; V70-K74 PolarHBondContact O-N 3.28Å; K71-K74 PolarHBondContact O-N 3.04Å; Y72-K74 VanDerWaalsContact C-N 3.27Å; Y72-K74 PolarHBondContact O-N 3.32Å; K74-N78 VanDerWaalsContact O-CB 3.3Å; K74-N78 WeakPolarHBondContact O-CB 3.3Å; K74-N78 VanDerWaalsContact O-CG 3.28Å; K74-N78 PolarHBondContact O-N 3.49Å; K74-N78 PolarHBondContact O-ND2 2.89Å; K74-K178 HydrophobicContact CB-CB 4.1Å; K74-K178 HydrophobicContact CB-CD 4.13Å; K74-K178 HydrophobicContact CG-CB 4.15Å; K74-L179 HydrophobicContact CD-CB 4.17Å; K74-L179 HydrophobicContact CD-CD1 4.26Å
75S97.6Very high97.6Very high59 Ų5954.8 Ų54.841%0.41327%0.268SS..Hα-helixtrans-65.4-39.9176.856.90000112.2K71 Y72 N78 K79K71-S75 PolarHBondContact O-N 2.88Å; K71-S75 PolarHBondContact O-OG 3.49Å; Y72-S75 PolarHBondContact O-N 3.39Å; Y72-S75 VanDerWaalsContact O-N 3.11Å; Y72-S75 PolarHBondContact O-OG 3.14Å; S75-N78 PolarHBondContact O-N 2.94Å; S75-K79 WeakPolarHBondContact O-CB 3.38Å; S75-K79 PolarHBondContact O-N 3.05Å
76E97.5Very high97.6Very high68 Ų6852.5 Ų52.532%0.31826%0.259SS..Hα-helixtrans-64.2-46.1176.9-66.9-58.198.400111.8Y72 W73 N78 K79 K80 I225Y72-E76 HydrophobicContact CE1-CG 4.04Å; Y72-E76 HydrophobicContact CE2-CG 4.15Å; Y72-E76 PolarHBondContact O-N 3.31Å; W73-E76 PolarHBondContact O-N 3.34Å; E76-N78 PolarHBondContact O-N 3.39Å; E76-K79 PolarHBondContact O-N 3.42Å; E76-K80 PolarHBondContact O-N 3.42Å; E76-I225 HydrophobicContact CB-CD1 3.83Å
77V97.2Very high97.7Very high0 Ų049.3 Ų49.30%025%0.248CC..Hα-helixtrans-62.1-42.5175.6172.40000111W73 K80 L81 M171 D174 I225W73-V77 WeakPolarHBondContact O-CB 3.45Å; W73-V77 VanDerWaalsContact O-CG2 3.23Å; W73-V77 WeakPolarHBondContact O-CG2 3.49Å; W73-V77 PolarHBondContact O-N 3.06Å; V77-K80 PolarHBondContact O-N 2.83Å; V77-L81 WeakPolarHBondContact O-CB 3.49Å; V77-L81 PolarHBondContact O-N 3.29Å; V77-M171 HydrophobicContact CG1-CB 4.13Å; V77-M171 HydrophobicContact CG1-CG 4.45Å; V77-D174 HydrophobicContact CG1-CB 4.41Å; V77-D174 WeakPolarHBondContact CG2-OD2 3.49Å; V77-I225 HydrophobicContact CG2-CD1 4.18Å; V77-I225 HydrophobicContact CG2-CG1 4.19Å
78N97.8Very high97.7Very high63 Ų6349.3 Ų49.334%0.33725%0.248SC..Hα-helixtrans-65.6-41.1178.4-80.8-23.9000112.9K74 S75 E76 L81 Q82 S175K74-N78 VanDerWaalsContact O-CB 3.3Å; K74-N78 WeakPolarHBondContact O-CB 3.3Å; K74-N78 VanDerWaalsContact O-CG 3.28Å; K74-N78 PolarHBondContact O-N 3.49Å; K74-N78 PolarHBondContact O-ND2 2.89Å; S75-N78 PolarHBondContact O-N 2.94Å; E76-N78 PolarHBondContact O-N 3.39Å; N78-L81 WeakPolarHBondContact O-CB 3.29Å; N78-L81 PolarHBondContact O-N 3.13Å; N78-Q82 PolarHBondContact O-N 3.3Å; N78-S175 WeakPolarHBondContact OD1-CB 3.34Å; N78-S175 PolarHBondContact OD1-OG 3.08Å
79K97.5Very high97.7Very high130 Ų13052.5 Ų52.557%0.56525%0.253SS*.Hα-helixtrans-59.9-49.9174.8180-178.8172.7-1740110.1S75 E76 L81 Q82 D83S75-K79 WeakPolarHBondContact O-CB 3.38Å; S75-K79 PolarHBondContact O-N 3.05Å; E76-K79 PolarHBondContact O-N 3.42Å; K79-L81 VanDerWaalsContact C-N 3.31Å; K79-L81 PolarHBondContact O-N 3.4Å; K79-Q82 WeakPolarHBondContact O-CB 3.22Å; K79-Q82 PolarHBondContact O-N 3.31Å; K79-Q82 VanDerWaalsContact O-N 3.14Å; K79-D83 PolarHBondContact O-N 2.99Å
80K96.6Very high97.8Very high29 Ų2952.8 Ų52.813%0.12625%0.254CS..Hα-helixtrans-64.1-37.4179.3-167.951.850.4-1690112.8E76 V77 Q82 D83 I84 M171 I225 D229 L232E76-K80 PolarHBondContact O-N 3.42Å; V77-K80 PolarHBondContact O-N 2.83Å; K80-Q82 VanDerWaalsContact C-N 3.32Å; K80-Q82 PolarHBondContact O-N 3.42Å; K80-D83 IonicContact NZ-OD2 3.95Å; K80-D83 PolarHBondContact NZ-OD2 3.14Å; K80-D83 PolarHBondContact O-N 3.34Å; K80-I84 VanDerWaalsContact O-CG2 3.31Å; K80-I84 WeakPolarHBondContact O-CG2 3.46Å; K80-I84 PolarHBondContact O-N 3.02Å; K80-I84 VanDerWaalsContact O-N 3.07Å; K80-M171 HydrophobicContact CB-SD 4.34Å; K80-M171 HydrophobicContact CG-CE 3.74Å; K80-M171 HydrophobicContact CG-SD 4.13Å; K80-I225 HydrophobicContact CG-CG2 4.26Å; K80-D229 VanDerWaalsContact CD-OD1 3.3Å; K80-D229 WeakPolarHBondContact CD-OD1 3.38Å; K80-D229 WeakPolarHBondContact CE-OD1 3.36Å; K80-D229 IonicContact NZ-OD1 3.6Å; K80-D229 PolarHBondContact NZ-OD1 2.83Å; K80-L232 HydrophobicContact CD-CD1 3.66Å
81L97.9Very high97.8Very high21 Ų2152.8 Ų52.811%0.1125%0.254CS..Hα-helixtrans-60.4-40.7173.8171.561.7000111.7V77 N78 K79 I84 T85 I168 M171 K172V77-L81 WeakPolarHBondContact O-CB 3.49Å; V77-L81 PolarHBondContact O-N 3.29Å; N78-L81 WeakPolarHBondContact O-CB 3.29Å; N78-L81 PolarHBondContact O-N 3.13Å; K79-L81 VanDerWaalsContact C-N 3.31Å; K79-L81 PolarHBondContact O-N 3.4Å; L81-I84 WeakPolarHBondContact O-CG2 3.45Å; L81-T85 WeakPolarHBondContact O-CB 3.46Å; L81-T85 PolarHBondContact O-N 3.15Å; L81-T85 PolarHBondContact O-OG1 3.41Å; L81-I168 HydrophobicContact CD1-CB 4.31Å; L81-I168 HydrophobicContact CD1-CG1 4.42Å; L81-I168 HydrophobicContact CD1-CG2 3.92Å; L81-M171 HydrophobicContact CB-CB 4.17Å; L81-M171 HydrophobicContact CB-SD 4.22Å; L81-M171 HydrophobicContact CD1-CB 4.06Å; L81-K172 HydrophobicContact CD1-CG 3.82Å; L81-K172 HydrophobicContact CD2-CG 3.7Å; L81-K172 HydrophobicContact CG-CG 4.42Å
82Q98.2Very high97.9Very high103 Ų10351.1 Ų51.148%0.48125%0.249SC..Hα-helixtrans-65.6-51.2175.7-170.263.146.300110.6N78 K79 K80 I84 T85 D86N78-Q82 PolarHBondContact O-N 3.3Å; K79-Q82 WeakPolarHBondContact O-CB 3.22Å; K79-Q82 PolarHBondContact O-N 3.31Å; K79-Q82 VanDerWaalsContact O-N 3.14Å; K80-Q82 VanDerWaalsContact C-N 3.32Å; K80-Q82 PolarHBondContact O-N 3.42Å; Q82-I84 VanDerWaalsContact C-N 3.3Å; Q82-I84 PolarHBondContact O-N 3.2Å; Q82-T85 WeakPolarHBondContact O-CB 3.4Å; Q82-T85 PolarHBondContact O-N 2.91Å; Q82-D86 PolarHBondContact NE2-OD1 3.13Å; Q82-D86 PolarHBondContact NE2-OD2 2.91Å; Q82-D86 PolarHBondContact O-N 3.16Å
83D98.3Very high97.9Very high55 Ų5551.7 Ų51.729%0.29426%0.256SS..Hα-helixtrans-51-49.6179.8-62.8-16.7000111.5K79 K80 E87 L232K79-D83 PolarHBondContact O-N 2.99Å; K80-D83 IonicContact NZ-OD2 3.95Å; K80-D83 PolarHBondContact NZ-OD2 3.14Å; K80-D83 PolarHBondContact O-N 3.34Å; D83-E87 WeakPolarHBondContact O-CB 3.4Å; D83-E87 PolarHBondContact O-N 2.88Å; D83-L232 HydrophobicContact CB-CD1 3.71Å; D83-L232 HydrophobicContact CB-CD2 4.36Å
84I97.9Very high97.9Very high0 Ų052.2 Ų52.20%026%0.259CS..Hα-helixtrans-72.5-28-179-166.4170.5000112.8K80 L81 Q82 T88 N164 A167 I168 M171 Q231 L232K80-I84 VanDerWaalsContact O-CG2 3.31Å; K80-I84 WeakPolarHBondContact O-CG2 3.46Å; K80-I84 PolarHBondContact O-N 3.02Å; K80-I84 VanDerWaalsContact O-N 3.07Å; L81-I84 WeakPolarHBondContact O-CG2 3.45Å; Q82-I84 VanDerWaalsContact C-N 3.3Å; Q82-I84 PolarHBondContact O-N 3.2Å; I84-T88 VanDerWaalsContact O-CB 3.3Å; I84-T88 WeakPolarHBondContact O-CB 3.13Å; I84-T88 PolarHBondContact O-N 2.89Å; I84-T88 PolarHBondContact O-OG1 3.39Å; I84-N164 HydrophobicContact CD1-CB 4.42Å; I84-N164 HydrophobicContact CG1-CB 4.31Å; I84-A167 HydrophobicContact CD1-CB 3.5Å; I84-I168 HydrophobicContact CG1-CG1 4.34Å; I84-I168 HydrophobicContact CG2-CG1 3.66Å; I84-M171 HydrophobicContact CG2-SD 4.19Å; I84-Q231 HydrophobicContact CD1-CB 3.68Å; I84-Q231 HydrophobicContact CD1-CG 4.29Å; I84-L232 HydrophobicContact CB-CD2 4.15Å; I84-L232 HydrophobicContact CB-CG 4.21Å; I84-L232 HydrophobicContact CG1-CD2 4.45Å; I84-L232 HydrophobicContact CG1-CG 4.47Å
85T98.4Very high97.9Very high30 Ų3051.9 Ų51.918%0.18426%0.257CS..Hα-helixtrans-67.4-49.6174.4-60.20000109.8L81 Q82 E87 T88 E89L81-T85 WeakPolarHBondContact O-CB 3.46Å; L81-T85 PolarHBondContact O-N 3.15Å; L81-T85 PolarHBondContact O-OG1 3.41Å; Q82-T85 WeakPolarHBondContact O-CB 3.4Å; Q82-T85 PolarHBondContact O-N 2.91Å; T85-E87 PolarHBondContact O-N 3.11Å; T85-T88 WeakPolarHBondContact O-CB 3.42Å; T85-T88 PolarHBondContact O-N 3.41Å; T85-T88 VanDerWaalsContact O-N 3.12Å; T85-E89 PolarHBondContact O-N 3.44Å; T85-E89 VanDerWaalsContact O-N 3.14Å
86D98.4Very high97.9Very high69 Ų6952.4 Ų52.437%0.36926%0.255SS..Hα-helixtrans-61-47.1179.3-63.2-14.8000111.1Q82 T88 E89 I90Q82-D86 PolarHBondContact NE2-OD1 3.13Å; Q82-D86 PolarHBondContact NE2-OD2 2.91Å; Q82-D86 PolarHBondContact O-N 3.16Å; D86-T88 VanDerWaalsContact C-N 3.26Å; D86-T88 PolarHBondContact O-N 2.98Å; D86-E89 PolarHBondContact O-N 3.05Å; D86-I90 WeakPolarHBondContact O-CG1 3.49Å; D86-I90 PolarHBondContact O-N 2.96Å; D86-I90 VanDerWaalsContact O-N 3.13Å
87E98Very high97.9Very high7 Ų752.7 Ų52.73%0.03325%0.253CS..Hα-helixtrans-64.5-30.3177.2176.256.3-153.900112.6D83 T85 I90 L91 L232 S235 H236 R239D83-E87 WeakPolarHBondContact O-CB 3.4Å; D83-E87 PolarHBondContact O-N 2.88Å; T85-E87 PolarHBondContact O-N 3.11Å; E87-I90 PolarHBondContact O-N 3.47Å; E87-L91 WeakPolarHBondContact O-CB 3.42Å; E87-L91 PolarHBondContact O-N 3.07Å; E87-L232 HydrophobicContact CB-CD2 3.48Å; E87-L232 VanDerWaalsContact CB-CD2 3.48Å; E87-L232 HydrophobicContact CG-CD2 3.77Å; E87-S235 WeakPolarHBondContact CG-OG 3.49Å; E87-S235 VanDerWaalsContact OE1-CB 3.25Å; E87-S235 WeakPolarHBondContact OE1-CB 3.21Å; E87-S235 PolarHBondContact OE1-OG 3.27Å; E87-H236 IonicContact OE1-ND1 2.71Å; E87-H236 IonicContact OE2-CE1 3.91Å; E87-H236 PolarHBondContact OE2-CE1 2.95Å; E87-H236 IonicContact OE2-ND1 2.56Å; E87-H236 PolarHBondContact OE2-ND1 2.88Å; E87-R239 IonicContact OE1-CZ 3.78Å; E87-R239 IonicContact OE1-NE 2.71Å; E87-R239 PolarHBondContact OE1-NE 3.21Å; E87-R239 IonicContact OE1-NH2 3.87Å; E87-R239 IonicContact OE2-CZ 3.3Å; E87-R239 IonicContact OE2-NE 2.72Å; E87-R239 PolarHBondContact OE2-NE 3.31Å; E87-R239 IonicContact OE2-NH2 2.93Å; E87-R239 PolarHBondContact OE2-NH2 3.34Å
88T98.4Very high97.8Very high11 Ų1152.7 Ų52.77%0.06725%0.253CS..Hα-helixtrans-67.6-37.6175.2-61.40000111.8I84 T85 D86 L91 D92 L161 N164 R165 I168I84-T88 VanDerWaalsContact O-CB 3.3Å; I84-T88 WeakPolarHBondContact O-CB 3.13Å; I84-T88 PolarHBondContact O-N 2.89Å; I84-T88 PolarHBondContact O-OG1 3.39Å; T85-T88 WeakPolarHBondContact O-CB 3.42Å; T85-T88 PolarHBondContact O-N 3.41Å; T85-T88 VanDerWaalsContact O-N 3.12Å; D86-T88 VanDerWaalsContact C-N 3.26Å; D86-T88 PolarHBondContact O-N 2.98Å; T88-L91 PolarHBondContact O-N 3.24Å; T88-D92 WeakPolarHBondContact O-CB 3.46Å; T88-D92 PolarHBondContact O-N 2.7Å; T88-L161 HydrophobicContact CG2-CD2 3.87Å; T88-L161 WeakPolarHBondContact O-CD2 3.31Å; T88-N164 HydrophobicContact CG2-CB 4.25Å; T88-N164 WeakPolarHBondContact OG1-CB 3.5Å; T88-N164 PolarHBondContact OG1-ND2 3.21Å; T88-R165 HydrophobicContact CG2-CG 4.43Å; T88-I168 HydrophobicContact CG2-CD1 4.32Å; T88-I168 WeakPolarHBondContact OG1-CD1 3.02Å
89E98.5Very high97.8Very high126 Ų12656.6 Ų56.659%0.58926%0.263SS*.Hα-helixtrans-65-45.6175.3-67178.1-177.500110.5T85 D86 L91 D92 E93T85-E89 PolarHBondContact O-N 3.44Å; T85-E89 VanDerWaalsContact O-N 3.14Å; D86-E89 PolarHBondContact O-N 3.05Å; E89-L91 PolarHBondContact O-N 2.87Å; E89-D92 WeakPolarHBondContact O-CB 3.48Å; E89-D92 PolarHBondContact O-N 3.39Å; E89-D92 VanDerWaalsContact O-N 3.16Å; E89-E93 PolarHBondContact O-N 2.97Å; E89-E93 VanDerWaalsContact O-N 3.17Å
90I98.3Very high97.7Very high64 Ų6456.2 Ų56.233%0.32826%0.261SS..Hα-helixtrans-61.6-44.3176.3-58.5168.1000111.1D86 E87 D92 E93 Y94D86-I90 WeakPolarHBondContact O-CG1 3.49Å; D86-I90 PolarHBondContact O-N 2.96Å; D86-I90 VanDerWaalsContact O-N 3.13Å; E87-I90 PolarHBondContact O-N 3.47Å; I90-D92 VanDerWaalsContact C-N 3.27Å; I90-D92 PolarHBondContact O-N 3.12Å; I90-E93 WeakPolarHBondContact O-CB 3.45Å; I90-E93 PolarHBondContact O-N 3.23Å; I90-Y94 HydrophobicContact CG2-CD2 4.3Å; I90-Y94 HydrophobicContact CG2-CE2 4.22Å; I90-Y94 WeakPolarHBondContact O-CD2 3.37Å; I90-Y94 PolarHBondContact O-N 2.98Å
91L98.4Very high97.7Very high0 Ų054.9 Ų54.90%026%0.255CS..Hα-helixtrans-64.3-32.9177.4-176.765.6000112.1E87 T88 E89 E93 Y94 F95 Q160 L161 S235 L238 R239E87-L91 WeakPolarHBondContact O-CB 3.42Å; E87-L91 PolarHBondContact O-N 3.07Å; T88-L91 PolarHBondContact O-N 3.24Å; E89-L91 PolarHBondContact O-N 2.87Å; L91-E93 VanDerWaalsContact C-N 3.35Å; L91-Y94 WeakPolarHBondContact O-CB 3.47Å; L91-Y94 PolarHBondContact O-N 3.27Å; L91-F95 WeakPolarHBondContact O-CB 3.39Å; L91-F95 PolarHBondContact O-N 3Å; L91-Q160 HydrophobicContact CD2-CB 3.91Å; L91-Q160 HydrophobicContact CD2-CG 3.72Å; L91-L161 HydrophobicContact CB-CD2 4.02Å; L91-L161 HydrophobicContact CD2-CD2 3.9Å; L91-L161 HydrophobicContact CD2-CG 3.82Å; L91-L161 HydrophobicContact CG-CD2 3.96Å; L91-L161 HydrophobicContact CG-CG 4.05Å; L91-S235 WeakPolarHBondContact CD2-OG 3.35Å; L91-L238 HydrophobicContact CD1-CD2 4.34Å; L91-R239 HydrophobicContact CD1-CG 3.89Å
92D98.3Very high97.6Very high50 Ų5055 Ų5527%0.26726%0.256SS..Hα-helixtrans-65.4-38.7176.7-158.284.5000111.1T88 E89 I90 Y94 F95 I96 L161 R165T88-D92 WeakPolarHBondContact O-CB 3.46Å; T88-D92 PolarHBondContact O-N 2.7Å; E89-D92 WeakPolarHBondContact O-CB 3.48Å; E89-D92 PolarHBondContact O-N 3.39Å; E89-D92 VanDerWaalsContact O-N 3.16Å; I90-D92 VanDerWaalsContact C-N 3.27Å; I90-D92 PolarHBondContact O-N 3.12Å; D92-Y94 PolarHBondContact O-N 3.4Å; D92-F95 WeakPolarHBondContact O-CB 3.48Å; D92-F95 PolarHBondContact O-N 3.02Å; D92-I96 WeakPolarHBondContact O-CG1 3.48Å; D92-I96 PolarHBondContact O-N 2.82Å; D92-L161 HydrophobicContact CB-CD2 4.14Å; D92-R165 IonicContact OD1-NH2 3.82Å; D92-R165 PolarHBondContact OD1-NH2 2.82Å; D92-R165 VanDerWaalsContact OD1-NH2 3.12Å
93E97.9Very high97.5Very high133 Ų13357 Ų5762%0.62127%0.265SS*.Hα-helixtrans-60.4-43.9171.9-64.2-179.317400112.1E89 I90 L91 F95 I96 R97E89-E93 PolarHBondContact O-N 2.97Å; E89-E93 VanDerWaalsContact O-N 3.17Å; I90-E93 WeakPolarHBondContact O-CB 3.45Å; I90-E93 PolarHBondContact O-N 3.23Å; L91-E93 VanDerWaalsContact C-N 3.35Å; E93-F95 VanDerWaalsContact C-N 3.34Å; E93-I96 PolarHBondContact O-N 3.5Å; E93-R97 WeakPolarHBondContact O-CB 3.31Å; E93-R97 PolarHBondContact O-N 2.92Å
94Y97.5Very high97.3Very high40 Ų4055.6 Ų55.616%0.15726%0.261CS..Hα-helixtrans-63.5-39.9175.4-88.3-113.8000112I90 L91 D92 R97 L98 R239 V242 D243I90-Y94 HydrophobicContact CG2-CD2 4.3Å; I90-Y94 HydrophobicContact CG2-CE2 4.22Å; I90-Y94 WeakPolarHBondContact O-CD2 3.37Å; I90-Y94 PolarHBondContact O-N 2.98Å; L91-Y94 WeakPolarHBondContact O-CB 3.47Å; L91-Y94 PolarHBondContact O-N 3.27Å; D92-Y94 PolarHBondContact O-N 3.4Å; Y94-R97 PolarHBondContact O-N 3.23Å; Y94-L98 WeakPolarHBondContact O-CG 3.38Å; Y94-L98 PolarHBondContact O-N 2.9Å; Y94-R239 HydrophobicContact CD1-CB 3.94Å; Y94-R239 HydrophobicContact CD1-CG 3.88Å; Y94-R239 HydrophobicContact CD2-CG 4.18Å; Y94-R239 HydrophobicContact CE1-CB 3.78Å; Y94-R239 HydrophobicContact CE1-CG 4.12Å; Y94-R239 WeakPolarHBondContact CE1-O 3.38Å; Y94-R239 HydrophobicContact CE2-CG 4.4Å; Y94-R239 HydrophobicContact CG-CB 4.46Å; Y94-R239 HydrophobicContact CG-CG 3.92Å; Y94-V242 HydrophobicContact CD1-CB 3.9Å; Y94-V242 HydrophobicContact CD1-CG1 3.57Å; Y94-V242 HydrophobicContact CE1-CG1 4.33Å; Y94-V242 HydrophobicContact CG-CG1 4.47Å; Y94-D243 VanDerWaalsContact CE1-CG 3.47Å; Y94-D243 WeakPolarHBondContact CE1-OD2 3.13Å; Y94-D243 VanDerWaalsContact CZ-OD2 3.32Å; Y94-D243 PolarHBondContact OH-OD2 3.44Å
95F98.2Very high97.2Very high32 Ų3255.6 Ų55.614%0.1426%0.261CS..Hα-helixtrans-62.2-43174.6174.5-106.4000111.8L91 D92 E93 R99 V154 A157 K158 L161L91-F95 WeakPolarHBondContact O-CB 3.39Å; L91-F95 PolarHBondContact O-N 3Å; D92-F95 WeakPolarHBondContact O-CB 3.48Å; D92-F95 PolarHBondContact O-N 3.02Å; E93-F95 VanDerWaalsContact C-N 3.34Å; F95-R99 HydrophobicContact CE2-CG 4.45Å; F95-R99 HydrophobicContact CZ-CG 4.36Å; F95-R99 WeakPolarHBondContact O-CG 3.28Å; F95-R99 PolarHBondContact O-N 3.39Å; F95-R99 VanDerWaalsContact O-N 3.15Å; F95-V154 HydrophobicContact CD2-CG1 4.46Å; F95-V154 HydrophobicContact CE2-CG1 3.71Å; F95-V154 HydrophobicContact CZ-CG1 4.44Å; F95-A157 HydrophobicContact CB-CB 4.4Å; F95-A157 HydrophobicContact CD2-CB 3.94Å; F95-K158 HydrophobicContact CD2-CB 4.48Å; F95-K158 HydrophobicContact CE2-CB 3.8Å; F95-K158 HydrophobicContact CE2-CG 4.49Å; F95-K158 HydrophobicContact CZ-CB 4.34Å; F95-L161 HydrophobicContact CB-CD1 3.82Å; F95-L161 HydrophobicContact CD1-CD1 4.13Å; F95-L161 HydrophobicContact CD2-CD1 4.43Å; F95-L161 HydrophobicContact CG-CD1 3.88Å
96I97.4Very high97.1Very high70 Ų7058.9 Ų58.936%0.35927%0.274SS..Hα-helixtrans-62.9-45.2174.6-68165.5000110.5D92 E93 R99 K100D92-I96 WeakPolarHBondContact O-CG1 3.48Å; D92-I96 PolarHBondContact O-N 2.82Å; E93-I96 PolarHBondContact O-N 3.5Å; I96-R99 PolarHBondContact O-N 3.36Å; I96-K100 HydrophobicContact CG2-CD 4.2Å; I96-K100 WeakPolarHBondContact O-CG 3.21Å; I96-K100 PolarHBondContact O-N 2.94Å
97R96.2Very high97Very high73 Ų7359.8 Ų59.828%0.27528%0.276SS..Hα-helixtrans-60.9-46.2178.5-170.2-179.8176.1-155.4-2.6111.7E93 Y94 R99 K100 T101 D243 I246 F402E93-R97 WeakPolarHBondContact O-CB 3.31Å; E93-R97 PolarHBondContact O-N 2.92Å; Y94-R97 PolarHBondContact O-N 3.23Å; R97-R99 VanDerWaalsContact C-N 3.32Å; R97-R99 PolarHBondContact O-N 3.49Å; R97-K100 PolarHBondContact O-N 3.44Å; R97-T101 PolarHBondContact O-N 2.95Å; R97-T101 PolarHBondContact O-OG1 3.13Å; R97-D243 IonicContact CZ-OD1 2.61Å; R97-D243 IonicContact NH1-OD1 2.6Å; R97-D243 PolarHBondContact NH1-OD1 3.06Å; R97-I246 HydrophobicContact CG-CD1 3.99Å; R97-F402 PolarHBondContact NE-O 2.86Å; R97-F402 PolarHBondContact NH2-O 2.69Å
98L96.5Very high96.9Very high0 Ų059.5 Ų59.50%028%0.275CS..Hα-helixtrans-54.5-46.6174.4-82.7170.5000112.6Y94 T101 L102 L150 T153 V154 A157 V242 I246Y94-L98 WeakPolarHBondContact O-CG 3.38Å; Y94-L98 PolarHBondContact O-N 2.9Å; L98-T101 PolarHBondContact O-N 3.06Å; L98-L102 PolarHBondContact O-N 3Å; L98-L150 HydrophobicContact CD2-CD2 4.03Å; L98-T153 HydrophobicContact CD1-CG2 3.9Å; L98-T153 HydrophobicContact CD2-CG2 4Å; L98-V154 HydrophobicContact CB-CG2 3.8Å; L98-V154 HydrophobicContact CD1-CG2 4.44Å; L98-A157 HydrophobicContact CD1-CB 4.03Å; L98-V242 HydrophobicContact CD1-CG1 3.95Å; L98-V242 HydrophobicContact CD1-CG2 3.7Å; L98-V242 HydrophobicContact CD2-CG1 3.7Å; L98-V242 HydrophobicContact CD2-CG2 4.33Å; L98-V242 HydrophobicContact CG-CG1 3.57Å; L98-V242 HydrophobicContact CG-CG2 4.23Å; L98-I246 HydrophobicContact CD2-CD1 4.19Å; L98-I246 HydrophobicContact CD2-CG1 4.11Å; L98-I246 HydrophobicContact CG-CD1 4.47Å
99R97.5Very high96.8Very high145 Ų14559.5 Ų59.555%0.54728%0.275SS..Hα-helixtrans-63.9-41.9179.9-73-175.665.6-141.5-4.9112F95 I96 R97 L102 E103 V154F95-R99 HydrophobicContact CE2-CG 4.45Å; F95-R99 HydrophobicContact CZ-CG 4.36Å; F95-R99 WeakPolarHBondContact O-CG 3.28Å; F95-R99 PolarHBondContact O-N 3.39Å; F95-R99 VanDerWaalsContact O-N 3.15Å; I96-R99 PolarHBondContact O-N 3.36Å; R97-R99 VanDerWaalsContact C-N 3.32Å; R97-R99 PolarHBondContact O-N 3.49Å; R99-L102 PolarHBondContact O-N 3.36Å; R99-E103 WeakPolarHBondContact O-CB 3.31Å; R99-E103 PolarHBondContact O-N 2.92Å; R99-V154 HydrophobicContact CG-CG1 4.11Å; R99-V154 HydrophobicContact CG-CG2 4.16Å
100K95.8Very high96.7Very high123 Ų12358.4 Ų58.454%0.53527%0.27SS..Hα-helixtrans-63.3-43.2174.8-71.5177.8178.2179.10111.6I96 R97 L102 E103 A104I96-K100 HydrophobicContact CG2-CD 4.2Å; I96-K100 WeakPolarHBondContact O-CG 3.21Å; I96-K100 PolarHBondContact O-N 2.94Å; R97-K100 PolarHBondContact O-N 3.44Å; K100-L102 VanDerWaalsContact C-N 3.31Å; K100-L102 PolarHBondContact O-N 3.37Å; K100-E103 PolarHBondContact O-N 3.39Å; K100-A104 WeakPolarHBondContact O-CB 3.41Å; K100-A104 PolarHBondContact O-N 2.92Å
101T95.2Very high96.7Very high0 Ų056.6 Ų56.60%026%0.259CS..Hα-helixtrans-60.9-41.9175.6-57.30000111.2R97 L98 A104 T105 L150 I246 F402R97-T101 PolarHBondContact O-N 2.95Å; R97-T101 PolarHBondContact O-OG1 3.13Å; L98-T101 PolarHBondContact O-N 3.06Å; T101-A104 PolarHBondContact O-N 3.5Å; T101-T105 WeakPolarHBondContact O-CG2 3.37Å; T101-T105 PolarHBondContact O-N 2.93Å; T101-L150 HydrophobicContact CG2-CD1 3.96Å; T101-L150 HydrophobicContact CG2-CD2 4.08Å; T101-I246 HydrophobicContact CG2-CG2 4.45Å; T101-F402 HydrophobicContact CG2-CD2 4.11Å
102L96.9Very high96.6Very high25 Ų2556.6 Ų56.613%0.13126%0.259CS..Hα-helixtrans-62.4-50.2175.617761.9000111.7L98 R99 K100 A104 T105 Q147 L150 Q151L98-L102 PolarHBondContact O-N 3Å; R99-L102 PolarHBondContact O-N 3.36Å; K100-L102 VanDerWaalsContact C-N 3.31Å; K100-L102 PolarHBondContact O-N 3.37Å; L102-A104 VanDerWaalsContact C-N 3.25Å; L102-A104 PolarHBondContact O-N 3.46Å; L102-T105 WeakPolarHBondContact O-CB 3.31Å; L102-T105 PolarHBondContact O-N 3.11Å; L102-T105 PolarHBondContact O-OG1 3.27Å; L102-Q147 HydrophobicContact CD1-CB 4Å; L102-Q147 HydrophobicContact CD1-CG 3.93Å; L102-L150 HydrophobicContact CB-CB 4.24Å; L102-L150 HydrophobicContact CB-CD1 4.24Å; L102-L150 HydrophobicContact CD1-CB 3.98Å; L102-L150 HydrophobicContact CD1-CD1 4.3Å; L102-Q151 HydrophobicContact CD2-CB 4.46Å; L102-Q151 VanDerWaalsContact CD2-OE1 3.25Å
103E96Very high96.6Very high144 Ų14457.5 Ų57.567%0.67326%0.262SS*.Hα-helixtrans-57.5-39.6178-176.6174.6-16800112R99 K100 T105 E106R99-E103 WeakPolarHBondContact O-CB 3.31Å; R99-E103 PolarHBondContact O-N 2.92Å; K100-E103 PolarHBondContact O-N 3.39Å; E103-T105 PolarHBondContact O-N 3.36Å; E103-T105 VanDerWaalsContact O-N 3.16Å; E103-E106 WeakPolarHBondContact O-CB 3.06Å; E103-E106 WeakPolarHBondContact O-CG 3.38Å; E103-E106 PolarHBondContact O-N 3.39Å; E103-E106 VanDerWaalsContact O-N 3.13Å
104A94.6Very high96.6Very high25 Ų2554.7 Ų54.721%0.20725%0.249CC..THydrogen-bonded Turntrans-66.8-13.6178.200000115.3K100 T101 L102 E106 P108 F399 F402K100-A104 WeakPolarHBondContact O-CB 3.41Å; K100-A104 PolarHBondContact O-N 2.92Å; T101-A104 PolarHBondContact O-N 3.5Å; L102-A104 VanDerWaalsContact C-N 3.25Å; L102-A104 PolarHBondContact O-N 3.46Å; A104-E106 VanDerWaalsContact C-N 3.33Å; A104-P108 VanDerWaalsContact O-CD 3.3Å; A104-P108 WeakPolarHBondContact O-CD 3.41Å; A104-F399 HydrophobicContact CB-CE2 4.43Å; A104-F402 HydrophobicContact CB-CD2 4.41Å; A104-F402 HydrophobicContact CB-CE1 3.96Å; A104-F402 HydrophobicContact CB-CE2 3.26Å; A104-F402 HydrophobicContact CB-CZ 3Å
105T95.9Very high96.6Very high0 Ų052.8 Ų52.80%024%0.241CC..THydrogen-bonded Turntrans-79.4-16174.367.40000113.4T101 L102 E103 L109 Q147 L150 I253 F399T101-T105 WeakPolarHBondContact O-CG2 3.37Å; T101-T105 PolarHBondContact O-N 2.93Å; L102-T105 WeakPolarHBondContact O-CB 3.31Å; L102-T105 PolarHBondContact O-N 3.11Å; L102-T105 PolarHBondContact O-OG1 3.27Å; E103-T105 PolarHBondContact O-N 3.36Å; E103-T105 VanDerWaalsContact O-N 3.16Å; T105-L109 WeakPolarHBondContact O-CB 3.48Å; T105-L109 PolarHBondContact O-N 3.06Å; T105-Q147 WeakPolarHBondContact OG1-CG 3.42Å; T105-Q147 PolarHBondContact OG1-NE2 3.48Å; T105-L150 HydrophobicContact CG2-CD1 4.04Å; T105-I253 HydrophobicContact CG2-CD1 3.67Å; T105-F399 HydrophobicContact CG2-CE2 4.49Å
106E95.9Very high96.6Very high99 Ų9952.7 Ų52.746%0.46324%0.242SC..Hα-helixtrans-67.4-41.4-175.3-66.6-63.2161.400112.7E103 A104 L109 H110 Q147E103-E106 WeakPolarHBondContact O-CB 3.06Å; E103-E106 WeakPolarHBondContact O-CG 3.38Å; E103-E106 PolarHBondContact O-N 3.39Å; E103-E106 VanDerWaalsContact O-N 3.13Å; A104-E106 VanDerWaalsContact C-N 3.33Å; E106-L109 PolarHBondContact O-N 3.01Å; E106-H110 WeakPolarHBondContact O-CB 3.23Å; E106-H110 PolarHBondContact O-N 3.45Å; E106-Q147 VanDerWaalsContact CD-NE2 3.33Å; E106-Q147 PolarHBondContact OE1-NE2 3.26Å
107E94.6Very high96.6Very high88 Ų8854.7 Ų54.741%0.41125%0.253SS..Hα-helixtrans-64.6-52.5-179.3173.8-173.692.500112L109 H110 F111E107-L109 VanDerWaalsContact C-N 3.26Å; E107-L109 PolarHBondContact O-N 3.12Å; E107-H110 PolarHBondContact O-N 3.23Å; E107-F111 HydrophobicContact CG-CD2 3.97Å; E107-F111 HydrophobicContact CG-CE1 4.15Å; E107-F111 HydrophobicContact CG-CE2 3.35Å; E107-F111 HydrophobicContact CG-CZ 3.45Å; E107-F111 VanDerWaalsContact CG-CZ 3.45Å; E107-F111 WeakPolarHBondContact O-CG 3.29Å; E107-F111 PolarHBondContact O-N 2.98Å
108P96.1Very high96.6Very high1 Ų152.3 Ų52.31%0.00625%0.247CC..Hα-helixtrans-55.9-39.4173.7-26.934.5000113.3A104 F111 A112 I143 I257 I397 F399A104-P108 VanDerWaalsContact O-CD 3.3Å; A104-P108 WeakPolarHBondContact O-CD 3.41Å; P108-F111 PolarHBondContact O-N 3.23Å; P108-A112 WeakPolarHBondContact O-CB 3.49Å; P108-A112 PolarHBondContact O-N 3.12Å; P108-I143 HydrophobicContact CB-CD1 3.8Å; P108-I257 HydrophobicContact CB-CD1 4.36Å; P108-I397 HydrophobicContact CG-CG2 4.3Å; P108-F399 HydrophobicContact CG-CB 4.41Å; P108-F399 HydrophobicContact CG-CD2 3.97Å; P108-F399 HydrophobicContact CG-CG 4.45Å
109L97.5Very high96.6Very high11 Ų1152.6 Ų52.66%0.05825%0.249CC..Hα-helixtrans-62.3-47.9177.3178.259.7000111.3T105 E106 E107 F111 A112 Q113 I140 I143 K144T105-L109 WeakPolarHBondContact O-CB 3.48Å; T105-L109 PolarHBondContact O-N 3.06Å; E106-L109 PolarHBondContact O-N 3.01Å; E107-L109 VanDerWaalsContact C-N 3.26Å; E107-L109 PolarHBondContact O-N 3.12Å; L109-F111 VanDerWaalsContact C-N 3.34Å; L109-F111 PolarHBondContact O-N 3.37Å; L109-A112 PolarHBondContact O-N 2.65Å; L109-Q113 HydrophobicContact CD1-CG 4.47Å; L109-Q113 VanDerWaalsContact O-CG 3.32Å; L109-Q113 WeakPolarHBondContact O-CG 3.31Å; L109-Q113 PolarHBondContact O-N 2.93Å; L109-I140 HydrophobicContact CD1-CB 4.32Å; L109-I140 HydrophobicContact CD1-CG1 4.28Å; L109-I140 HydrophobicContact CD1-CG2 3.9Å; L109-I143 HydrophobicContact CB-CG2 3.8Å; L109-I143 HydrophobicContact CD1-CB 4.44Å; L109-I143 HydrophobicContact CD1-CG2 4.38Å; L109-I143 HydrophobicContact CG-CG2 4.5Å; L109-K144 HydrophobicContact CD1-CG 4.15Å; L109-K144 HydrophobicContact CD2-CG 4.45Å
110H96.9Very high96.6Very high104 Ų10452.1 Ų52.148%0.48125%0.252SS..Hα-helixtrans-60.8-44.1179.5-178.460.1000111.5E106 E107 Q113 Q114E106-H110 WeakPolarHBondContact O-CB 3.23Å; E106-H110 PolarHBondContact O-N 3.45Å; E107-H110 PolarHBondContact O-N 3.23Å; H110-Q113 WeakPolarHBondContact O-CB 3.47Å; H110-Q113 PolarHBondContact O-N 3.35Å; H110-Q114 WeakPolarHBondContact O-CB 3.37Å; H110-Q114 PolarHBondContact O-N 3.31Å
111F97.1Very high96.5Very high26 Ų2648.7 Ų48.711%0.11425%0.252CS..Hα-helixtrans-67.4-40.4178.7-64.6-16.6000112.6E107 P108 L109 Q113 Q114 C115 I393 S396 I397E107-F111 HydrophobicContact CG-CD2 3.97Å; E107-F111 HydrophobicContact CG-CE1 4.15Å; E107-F111 HydrophobicContact CG-CE2 3.35Å; E107-F111 HydrophobicContact CG-CZ 3.45Å; E107-F111 VanDerWaalsContact CG-CZ 3.45Å; E107-F111 WeakPolarHBondContact O-CG 3.29Å; E107-F111 PolarHBondContact O-N 2.98Å; P108-F111 PolarHBondContact O-N 3.23Å; L109-F111 VanDerWaalsContact C-N 3.34Å; L109-F111 PolarHBondContact O-N 3.37Å; F111-Q113 VanDerWaalsContact C-N 3.29Å; F111-Q113 PolarHBondContact O-N 3.43Å; F111-Q114 PolarHBondContact O-N 2.93Å; F111-C115 WeakPolarHBondContact O-CB 3.44Å; F111-C115 PolarHBondContact O-N 2.91Å; F111-C115 PolarHBondContact O-SG 3.25Å; F111-I393 HydrophobicContact CB-CD1 4.18Å; F111-I393 HydrophobicContact CB-CG1 4.4Å; F111-I393 HydrophobicContact CD1-CB 4.5Å; F111-I393 HydrophobicContact CD1-CD1 4.4Å; F111-I393 HydrophobicContact CG-CD1 4.47Å; F111-S396 VanDerWaalsContact CE2-OG 3.22Å; F111-S396 WeakPolarHBondContact CE2-OG 3.3Å; F111-S396 WeakPolarHBondContact CZ-OG 3.13Å; F111-I397 HydrophobicContact CD2-CD1 4.19Å; F111-I397 HydrophobicContact CD2-CG1 3.48Å; F111-I397 VanDerWaalsContact CD2-CG1 3.48Å; F111-I397 HydrophobicContact CE2-CG1 3.97Å
112A97.5Very high96.6Very high0 Ų049.2 Ų49.20%025%0.254CS..Hα-helixtrans-60.3-40.8174.800000111.6P108 L109 C115 L116 L136 E139 I140P108-A112 WeakPolarHBondContact O-CB 3.49Å; P108-A112 PolarHBondContact O-N 3.12Å; L109-A112 PolarHBondContact O-N 2.65Å; A112-C115 PolarHBondContact O-N 3.49Å; A112-L116 PolarHBondContact O-N 3.2Å; A112-L136 HydrophobicContact CB-CD2 4.48Å; A112-E139 HydrophobicContact CB-CB 4.41Å; A112-E139 HydrophobicContact CB-CG 4.09Å; A112-I140 HydrophobicContact CB-CD1 4.37Å; A112-I140 HydrophobicContact CB-CG1 3.68Å
113Q98.2Very high96.5Very high69 Ų6951.6 Ų51.632%0.32227%0.27SS..Hα-helixtrans-65.3-45.2174.5-71171.4-8.300112.4L109 H110 F111 C115 L116 L117 I140L109-Q113 HydrophobicContact CD1-CG 4.47Å; L109-Q113 VanDerWaalsContact O-CG 3.32Å; L109-Q113 WeakPolarHBondContact O-CG 3.31Å; L109-Q113 PolarHBondContact O-N 2.93Å; H110-Q113 WeakPolarHBondContact O-CB 3.47Å; H110-Q113 PolarHBondContact O-N 3.35Å; F111-Q113 VanDerWaalsContact C-N 3.29Å; F111-Q113 PolarHBondContact O-N 3.43Å; Q113-C115 VanDerWaalsContact C-N 3.31Å; Q113-C115 PolarHBondContact O-N 3.39Å; Q113-L116 PolarHBondContact O-N 2.86Å; Q113-L117 WeakPolarHBondContact O-CG 3.48Å; Q113-L117 PolarHBondContact O-N 2.72Å; Q113-I140 HydrophobicContact CB-CD1 4.44Å; Q113-I140 HydrophobicContact CG-CD1 3.7Å; Q113-I140 HydrophobicContact CG-CG1 4.14Å
114Q97.7Very high96.3Very high74 Ų7447.6 Ų47.635%0.34627%0.267SS..Hα-helixtrans-64.1-36.6178.6-1731765.800111.9H110 F111 L117 S118 I393H110-Q114 WeakPolarHBondContact O-CB 3.37Å; H110-Q114 PolarHBondContact O-N 3.31Å; F111-Q114 PolarHBondContact O-N 2.93Å; Q114-L117 PolarHBondContact O-N 3.31Å; Q114-S118 WeakPolarHBondContact O-CB 3.34Å; Q114-S118 PolarHBondContact O-N 2.79Å; Q114-S118 PolarHBondContact O-OG 3.5Å; Q114-I393 HydrophobicContact CB-CD1 3.85Å; Q114-I393 HydrophobicContact CG-CD1 3.86Å
115C97.8Very high96.3Very high0 Ų052.6 Ų52.60%029%0.289CS..Hα-helixtrans-61.4-45.7172.5-750000112F111 A112 Q113 S118 R119 L136 C390F111-C115 WeakPolarHBondContact O-CB 3.44Å; F111-C115 PolarHBondContact O-N 2.91Å; F111-C115 PolarHBondContact O-SG 3.25Å; A112-C115 PolarHBondContact O-N 3.49Å; Q113-C115 VanDerWaalsContact C-N 3.31Å; Q113-C115 PolarHBondContact O-N 3.39Å; C115-S118 PolarHBondContact O-N 2.62Å; C115-R119 VanDerWaalsContact O-CG 3.28Å; C115-R119 WeakPolarHBondContact O-CG 3.43Å; C115-R119 PolarHBondContact O-N 3.36Å; C115-L136 HydrophobicContact CB-CD1 3.81Å; C115-L136 HydrophobicContact CB-CD2 3.5Å; C115-L136 VanDerWaalsContact CB-CD2 3.5Å; C115-L136 HydrophobicContact CB-CG 4.34Å; C115-C390 HydrophobicContact CB-CB 4.25Å
116L96.8Very high96.3Very high30 Ų3053 Ų5316%0.15729%0.291CS..Hα-helixtrans-60.8-48.4176-75.8179.6000111.6A112 Q113 S118 R119 E120 Q133 L136 I137 I140A112-L116 PolarHBondContact O-N 3.2Å; Q113-L116 PolarHBondContact O-N 2.86Å; L116-S118 VanDerWaalsContact C-N 3.31Å; L116-S118 PolarHBondContact O-N 3.28Å; L116-R119 PolarHBondContact O-N 2.9Å; L116-R119 VanDerWaalsContact O-N 3.1Å; L116-E120 PolarHBondContact O-N 3.26Å; L116-E120 VanDerWaalsContact O-N 3.11Å; L116-Q133 HydrophobicContact CD2-CG 3.9Å; L116-L136 HydrophobicContact CD1-CB 4.45Å; L116-L136 HydrophobicContact CD2-CB 3.53Å; L116-L136 HydrophobicContact CD2-CD1 3.89Å; L116-L136 HydrophobicContact CD2-CG 4.35Å; L116-L136 HydrophobicContact CG-CB 3.82Å; L116-L136 HydrophobicContact CG-CD1 4.31Å; L116-I137 HydrophobicContact CD1-CG1 3.85Å; L116-I137 HydrophobicContact CD2-CG1 4.17Å; L116-I140 HydrophobicContact CD1-CD1 3.39Å; L116-I140 HydrophobicContact CG-CD1 4.37Å
117L97.2Very high96.3Very high111 Ų11152.7 Ų52.758%0.58129%0.292SS*.Hα-helixtrans-58.6-42.3177.3-74.3165.1000112.1Q113 Q114 R119 E120Q113-L117 WeakPolarHBondContact O-CG 3.48Å; Q113-L117 PolarHBondContact O-N 2.72Å; Q114-L117 PolarHBondContact O-N 3.31Å; L117-R119 VanDerWaalsContact C-N 3.27Å; L117-R119 PolarHBondContact O-N 3.05Å; L117-E120 WeakPolarHBondContact O-CB 3.38Å; L117-E120 PolarHBondContact O-N 3.35Å
118S97Very high96.2Very high23 Ų2351 Ų5116%0.16129%0.288CS..Hα-helixtrans-62.8-37.9177.7-56.20000111.2Q114 C115 L116 E120 G121 I385Q114-S118 WeakPolarHBondContact O-CB 3.34Å; Q114-S118 PolarHBondContact O-N 2.79Å; Q114-S118 PolarHBondContact O-OG 3.5Å; C115-S118 PolarHBondContact O-N 2.62Å; L116-S118 VanDerWaalsContact C-N 3.31Å; L116-S118 PolarHBondContact O-N 3.28Å; S118-E120 VanDerWaalsContact C-N 3.32Å; S118-E120 PolarHBondContact O-N 3.38Å; S118-G121 PolarHBondContact O-N 2.88Å; S118-G121 VanDerWaalsContact O-N 3.1Å; S118-I385 WeakPolarHBondContact O-CG2 3.28Å
119R97.3Very high96Very high7 Ų758.5 Ų58.53%0.02632%0.322CS..Hα-helixtrans-72.2-21.5178.5-70.7174.759.9105.15.3114C115 L116 L117 G121 R122 L127 D130 A132 I385 D386C115-R119 VanDerWaalsContact O-CG 3.28Å; C115-R119 WeakPolarHBondContact O-CG 3.43Å; C115-R119 PolarHBondContact O-N 3.36Å; L116-R119 PolarHBondContact O-N 2.9Å; L116-R119 VanDerWaalsContact O-N 3.1Å; L117-R119 VanDerWaalsContact C-N 3.27Å; L117-R119 PolarHBondContact O-N 3.05Å; R119-G121 PolarHBondContact O-N 3.49Å; R119-R122 VanDerWaalsContact NH2-NH1 3.2Å; R119-R122 WeakPolarHBondContact O-CG 3.46Å; R119-R122 PolarHBondContact O-N 2.91Å; R119-L127 WeakPolarHBondContact O-CD1 3.17Å; R119-D130 IonicContact CZ-OD1 3.65Å; R119-D130 IonicContact CZ-OD2 3.99Å; R119-D130 IonicContact NH2-OD1 3.58Å; R119-D130 PolarHBondContact NH2-OD1 3.35Å; R119-D130 IonicContact NH2-OD2 3.62Å; R119-D130 PolarHBondContact NH2-OD2 2.61Å; R119-A132 VanDerWaalsContact NH1-CB 3.32Å; R119-I385 HydrophobicContact CG-CG2 3.97Å; R119-D386 IonicContact CZ-OD1 2.66Å; R119-D386 IonicContact NH1-OD1 3.42Å; R119-D386 PolarHBondContact NH1-OD1 3.03Å; R119-D386 IonicContact NH1-OD2 3.38Å; R119-D386 PolarHBondContact NH1-OD2 3.46Å
120E96.1Very high95.9Very high134 Ų13458.8 Ų58.863%0.62632%0.324SS*.Hα-helixtrans-64.9-21.2168.5-65.7179.7171.900112.2L116 L117 S118 R122L116-E120 PolarHBondContact O-N 3.26Å; L116-E120 VanDerWaalsContact O-N 3.11Å; L117-E120 WeakPolarHBondContact O-CB 3.38Å; L117-E120 PolarHBondContact O-N 3.35Å; S118-E120 VanDerWaalsContact C-N 3.32Å; S118-E120 PolarHBondContact O-N 3.38Å; E120-R122 PolarHBondContact O-N 3.22Å
121G94.5Very high95.9Very high52 Ų5257.5 Ų57.554%0.53632%0.321SS..THydrogen-bonded Turntrans-75.90.6176.100000115.3S118 R119S118-G121 PolarHBondContact O-N 2.88Å; S118-G121 VanDerWaalsContact O-N 3.1Å; R119-G121 PolarHBondContact O-N 3.49Å
122R96.1Very high95.9Very high11 Ų1156.3 Ų56.34%0.04232%0.316CS..  trans-72.4153.1176-67.5178.4-177-168-5111.8R119 E120 D126 L127 D130 I385 D386R119-R122 VanDerWaalsContact NH2-NH1 3.2Å; R119-R122 WeakPolarHBondContact O-CG 3.46Å; R119-R122 PolarHBondContact O-N 2.91Å; E120-R122 PolarHBondContact O-N 3.22Å; R122-D126 WeakPolarHBondContact CD-O 3.45Å; R122-D126 PolarHBondContact NH1-O 3.11Å; R122-L127 HydrophobicContact CB-CB 4.19Å; R122-L127 HydrophobicContact CB-CD1 4.14Å; R122-D130 IonicContact NH1-OD2 3.02Å; R122-I385 HydrophobicContact CB-CD1 4.47Å; R122-I385 HydrophobicContact CG-CD1 3.63Å; R122-D386 IonicContact CZ-OD1 2.7Å; R122-D386 IonicContact CZ-OD2 3.03Å; R122-D386 IonicContact NH2-OD1 3.65Å; R122-D386 PolarHBondContact NH2-OD1 3.32Å; R122-D386 IonicContact NH2-OD2 3.74Å; R122-D386 PolarHBondContact NH2-OD2 3.03Å
123T94.8Very high95.9Very high75 Ų7558.1 Ų58.146%0.4632%0.324SS..  trans-118.6151.2-174.755.30000112.2D126 I378T123-D126 PolarHBondContact O-N 2.85Å; T123-I378 WeakPolarHBondContact O-CG2 3.35Å
124G93.4Very high95.9Very high59 Ų5960 Ų6061%0.60833%0.334SS*.G310 helixtrans63.6-142175.400000112.8D126 L127G124-D126 PolarHBondContact O-N 3.46Å; G124-L127 PolarHBondContact O-N 2.82Å
125I94.1Very high95.9Very high131 Ų13158.8 Ų58.867%0.67233%0.328SS*.G310 helixtrans-68-15.3-176.4-162.263000113.4L127I125-L127 VanDerWaalsContact C-N 3.31Å
126D95.8Very high95.9Very high7 Ų758.8 Ų58.84%0.03733%0.328CS..G310 helixtrans-80-13.7-179-76.414.4000113.3R122 T123 G124 V128 I378 K379 T382R122-D126 WeakPolarHBondContact CD-O 3.45Å; R122-D126 PolarHBondContact NH1-O 3.11Å; T123-D126 PolarHBondContact O-N 2.85Å; G124-D126 PolarHBondContact O-N 3.46Å; D126-V128 PolarHBondContact O-N 3.02Å; D126-I378 HydrophobicContact CB-CG2 4.08Å; D126-K379 VanDerWaalsContact OD1-CE 3.31Å; D126-K379 WeakPolarHBondContact OD1-CE 3.35Å; D126-K379 IonicContact OD1-NZ 3.81Å; D126-K379 PolarHBondContact OD1-NZ 2.9Å; D126-K379 WeakPolarHBondContact OD2-CD 3.49Å; D126-K379 IonicContact OD2-NZ 3.29Å; D126-K379 PolarHBondContact OD2-NZ 3.42Å; D126-T382 HydrophobicContact CB-CG2 4.31Å; D126-T382 WeakPolarHBondContact CB-OG1 3.33Å; D126-T382 VanDerWaalsContact OD2-CB 3.31Å; D126-T382 WeakPolarHBondContact OD2-CB 3.44Å; D126-T382 PolarHBondContact OD2-OG1 3.03Å
127L95.4Very high96Very high94 Ų9460.7 Ų60.749%0.49234%0.338SS..SBendtrans-7568.2167.1-172.463.5000109.6R119 R122 G124 I125R119-L127 WeakPolarHBondContact O-CD1 3.17Å; R122-L127 HydrophobicContact CB-CB 4.19Å; R122-L127 HydrophobicContact CB-CD1 4.14Å; G124-L127 PolarHBondContact O-N 2.82Å; I125-L127 VanDerWaalsContact C-N 3.31Å
128V92.8Very high96.1Very high53 Ų5359.7 Ų59.732%0.32133%0.329SS..  trans-113.7144-171.9640000111.6D126 D130 Q133D126-V128 PolarHBondContact O-N 3.02Å; V128-D130 HydrophobicContact CG1-CB 4.13Å; V128-D130 PolarHBondContact O-N 3.39Å; V128-Q133 PolarHBondContact O-OE1 3.1Å
129H92.5Very high96.1Very high157 Ų15758.6 Ų58.673%0.72732%0.321SS*.  trans-78.495.8167.6-70.351.8000108.8
130D95.7Very high96.2Very high18 Ų1859.2 Ų59.210%0.09633%0.325CS..  trans-113.7178-178.463.225000112.2R119 R122 V128 A132 Q133 M134 R267R119-D130 IonicContact CZ-OD1 3.65Å; R119-D130 IonicContact CZ-OD2 3.99Å; R119-D130 IonicContact NH2-OD1 3.58Å; R119-D130 PolarHBondContact NH2-OD1 3.35Å; R119-D130 IonicContact NH2-OD2 3.62Å; R119-D130 PolarHBondContact NH2-OD2 2.61Å; R122-D130 IonicContact NH1-OD2 3.02Å; V128-D130 HydrophobicContact CG1-CB 4.13Å; V128-D130 PolarHBondContact O-N 3.39Å; D130-A132 PolarHBondContact O-N 3.39Å; D130-A132 WeakPolarHBondContact OD1-CB 3.5Å; D130-A132 PolarHBondContact OD1-N 3Å; D130-Q133 PolarHBondContact O-N 3.05Å; D130-Q133 PolarHBondContact OD1-N 2.72Å; D130-M134 WeakPolarHBondContact O-CG 3.44Å; D130-M134 PolarHBondContact O-N 3.46Å; D130-R267 WeakPolarHBondContact OD2-CD 3.48Å; D130-R267 WeakPolarHBondContact OD2-CG 3.35Å; D130-R267 IonicContact OD2-CZ 2.73Å; D130-R267 IonicContact OD2-NE 3.39Å; D130-R267 PolarHBondContact OD2-NE 2.78Å
131D96.8Very high96.3Very high76 Ų7658.8 Ų58.841%0.40632%0.323SS..Hα-helixtrans-53.3-36.1177.7-67.7-13.8000112.5M134 E135 A263 K266D131-M134 HydrophobicContact CB-CE 4.46Å; D131-M134 PolarHBondContact O-N 2.6Å; D131-M134 VanDerWaalsContact OD1-CE 3.29Å; D131-M134 WeakPolarHBondContact OD1-CE 3.38Å; D131-E135 WeakPolarHBondContact O-CG 3.45Å; D131-E135 PolarHBondContact O-N 3.26Å; D131-A263 HydrophobicContact CB-CB 4.49Å; D131-K266 IonicContact OD2-NZ 2.79Å; D131-K266 PolarHBondContact OD2-NZ 3.06Å
132A97.3Very high96.5Very high1 Ų158.2 Ų58.21%0.00831%0.309CS..Hα-helixtrans-71.9-39.7-178.300000111.9R119 D130 L136 A263 L264 R267R119-A132 VanDerWaalsContact NH1-CB 3.32Å; D130-A132 PolarHBondContact O-N 3.39Å; D130-A132 WeakPolarHBondContact OD1-CB 3.5Å; D130-A132 PolarHBondContact OD1-N 3Å; A132-L136 WeakPolarHBondContact O-CB 3.34Å; A132-L136 VanDerWaalsContact O-CG 3.31Å; A132-L136 WeakPolarHBondContact O-CG 3.31Å; A132-L136 PolarHBondContact O-N 3.1Å; A132-A263 HydrophobicContact CB-CB 4.35Å; A132-L264 HydrophobicContact CB-CD2 3.89Å; A132-L264 HydrophobicContact CB-CG 4.19Å; A132-R267 HydrophobicContact CB-CB 4.29Å
133Q96.9Very high96.6Very high39 Ų3957.8 Ų57.818%0.18231%0.308CS..Hα-helixtrans-64.8-41.4172.6-176.3172.2-17.800111.6L116 V128 D130 L136 I137L116-Q133 HydrophobicContact CD2-CG 3.9Å; V128-Q133 PolarHBondContact O-OE1 3.1Å; D130-Q133 PolarHBondContact O-N 3.05Å; D130-Q133 PolarHBondContact OD1-N 2.72Å; Q133-L136 PolarHBondContact O-N 3.38Å; Q133-I137 HydrophobicContact CG-CD1 4.13Å; Q133-I137 WeakPolarHBondContact O-CG1 3.16Å; Q133-I137 PolarHBondContact O-N 3.33Å
134M98.1Very high96.8Very high109 Ų10959.1 Ų59.154%0.53731%0.307SS..Hα-helixtrans-62-46.4177.1-69.1-170.3-67.500112.2D130 D131 L136 I137 K138D130-M134 WeakPolarHBondContact O-CG 3.44Å; D130-M134 PolarHBondContact O-N 3.46Å; D131-M134 HydrophobicContact CB-CE 4.46Å; D131-M134 PolarHBondContact O-N 2.6Å; D131-M134 VanDerWaalsContact OD1-CE 3.29Å; D131-M134 WeakPolarHBondContact OD1-CE 3.38Å; M134-L136 VanDerWaalsContact C-N 3.34Å; M134-L136 PolarHBondContact O-N 3.37Å; M134-I137 PolarHBondContact O-N 3.11Å; M134-K138 WeakPolarHBondContact O-CB 3.41Å; M134-K138 PolarHBondContact O-N 2.87Å
135E98.4Very high97Very high47 Ų4757.9 Ų57.922%0.2229%0.294CS..Hα-helixtrans-67.9-32.6178.6-70.3-63.4153.800112.6D131 K138 E139 Q256 T260 A263D131-E135 WeakPolarHBondContact O-CG 3.45Å; D131-E135 PolarHBondContact O-N 3.26Å; E135-K138 PolarHBondContact O-N 3Å; E135-K138 IonicContact OE1-NZ 3.27Å; E135-K138 IonicContact OE2-NZ 3.29Å; E135-E139 WeakPolarHBondContact O-CB 3.44Å; E135-E139 PolarHBondContact O-N 3.34Å; E135-Q256 PolarHBondContact O-NE2 3.2Å; E135-Q256 PolarHBondContact OE2-NE2 3.05Å; E135-T260 HydrophobicContact CB-CG2 4.33Å; E135-T260 PolarHBondContact O-OG1 2.86Å; E135-A263 HydrophobicContact CB-CB 4.14Å; E135-A263 HydrophobicContact CG-CB 3.87Å
136L98Very high97.2Very high0 Ų052 Ų520%027%0.265CS..Hα-helixtrans-64.7-43.7172.3-80.5168.2000112.6A112 C115 L116 A132 Q133 M134 K138 E139 I140 T260A112-L136 HydrophobicContact CB-CD2 4.48Å; C115-L136 HydrophobicContact CB-CD1 3.81Å; C115-L136 HydrophobicContact CB-CD2 3.5Å; C115-L136 VanDerWaalsContact CB-CD2 3.5Å; C115-L136 HydrophobicContact CB-CG 4.34Å; L116-L136 HydrophobicContact CD1-CB 4.45Å; L116-L136 HydrophobicContact CD2-CB 3.53Å; L116-L136 HydrophobicContact CD2-CD1 3.89Å; L116-L136 HydrophobicContact CD2-CG 4.35Å; L116-L136 HydrophobicContact CG-CB 3.82Å; L116-L136 HydrophobicContact CG-CD1 4.31Å; A132-L136 WeakPolarHBondContact O-CB 3.34Å; A132-L136 VanDerWaalsContact O-CG 3.31Å; A132-L136 WeakPolarHBondContact O-CG 3.31Å; A132-L136 PolarHBondContact O-N 3.1Å; Q133-L136 PolarHBondContact O-N 3.38Å; M134-L136 VanDerWaalsContact C-N 3.34Å; M134-L136 PolarHBondContact O-N 3.37Å; L136-K138 VanDerWaalsContact C-N 3.35Å; L136-E139 PolarHBondContact O-N 2.87Å; L136-I140 WeakPolarHBondContact O-CG1 3.28Å; L136-I140 PolarHBondContact O-N 3.23Å; L136-I140 VanDerWaalsContact O-N 3.14Å; L136-T260 HydrophobicContact CD2-CG2 3.61Å; L136-T260 HydrophobicContact CG-CG2 3.74Å
137I98.3Very high97.3Very high70 Ų7053 Ų5336%0.35927%0.27SS..Hα-helixtrans-61.9-47.2175.5-68.9166.2000109.8L116 Q133 M134 E139 I140 E141L116-I137 HydrophobicContact CD1-CG1 3.85Å; L116-I137 HydrophobicContact CD2-CG1 4.17Å; Q133-I137 HydrophobicContact CG-CD1 4.13Å; Q133-I137 WeakPolarHBondContact O-CG1 3.16Å; Q133-I137 PolarHBondContact O-N 3.33Å; M134-I137 PolarHBondContact O-N 3.11Å; I137-E139 VanDerWaalsContact C-N 3.29Å; I137-E139 PolarHBondContact O-N 3.46Å; I137-I140 WeakPolarHBondContact O-CB 3.42Å; I137-I140 PolarHBondContact O-N 3.46Å; I137-I140 VanDerWaalsContact O-N 3.16Å; I137-E141 WeakPolarHBondContact O-CG 3.32Å; I137-E141 PolarHBondContact O-N 3.41Å
138K98.5Very high97.4Very high90 Ų9051.7 Ų51.739%0.39127%0.266SS..Hα-helixtrans-61.7-36.3177.7-174-179.5171-161.50112.5M134 E135 L136 E141 V142 Q256M134-K138 WeakPolarHBondContact O-CB 3.41Å; M134-K138 PolarHBondContact O-N 2.87Å; E135-K138 PolarHBondContact O-N 3Å; E135-K138 IonicContact OE1-NZ 3.27Å; E135-K138 IonicContact OE2-NZ 3.29Å; L136-K138 VanDerWaalsContact C-N 3.35Å; K138-E141 PolarHBondContact O-N 3.2Å; K138-V142 HydrophobicContact CG-CG2 4.45Å; K138-V142 WeakPolarHBondContact O-CB 3.31Å; K138-V142 VanDerWaalsContact O-CG2 3.29Å; K138-V142 WeakPolarHBondContact O-CG2 3.47Å; K138-V142 PolarHBondContact O-N 3.46Å; K138-Q256 VanDerWaalsContact CE-OE1 3.24Å
139E98.3Very high97.7Very high0 Ų053 Ų530%027%0.27CS..Hα-helixtrans-60.5-45.8173-174.1170.5140.800112.2A112 E135 L136 I137 E141 V142 I143 Q256 T260 R394A112-E139 HydrophobicContact CB-CB 4.41Å; A112-E139 HydrophobicContact CB-CG 4.09Å; E135-E139 WeakPolarHBondContact O-CB 3.44Å; E135-E139 PolarHBondContact O-N 3.34Å; L136-E139 PolarHBondContact O-N 2.87Å; I137-E139 VanDerWaalsContact C-N 3.29Å; I137-E139 PolarHBondContact O-N 3.46Å; E139-E141 VanDerWaalsContact C-N 3.32Å; E139-E141 PolarHBondContact O-N 2.98Å; E139-V142 PolarHBondContact O-N 3.31Å; E139-I143 HydrophobicContact CG-CD1 3.7Å; E139-I143 HydrophobicContact CG-CG1 4.47Å; E139-I143 WeakPolarHBondContact O-CB 3.49Å; E139-I143 WeakPolarHBondContact O-CD1 3.39Å; E139-I143 VanDerWaalsContact O-CG1 3.23Å; E139-I143 WeakPolarHBondContact O-CG1 3.43Å; E139-I143 PolarHBondContact O-N 3.11Å; E139-Q256 VanDerWaalsContact CA-CG 3.47Å; E139-Q256 HydrophobicContact CB-CG 3.82Å; E139-Q256 HydrophobicContact CG-CG 4.14Å; E139-T260 WeakPolarHBondContact OE2-CB 3.42Å; E139-T260 WeakPolarHBondContact OE2-CG2 3.34Å; E139-T260 PolarHBondContact OE2-OG1 3.17Å; E139-R394 IonicContact OE1-CZ 2.72Å; E139-R394 IonicContact OE1-NH1 3.8Å; E139-R394 PolarHBondContact OE1-NH1 2.96Å; E139-R394 IonicContact OE1-NH2 3.06Å; E139-R394 PolarHBondContact OE1-NH2 3.12Å; E139-R394 IonicContact OE2-CZ 2.86Å; E139-R394 IonicContact OE2-NH1 3.38Å; E139-R394 PolarHBondContact OE2-NH1 3.09Å; E139-R394 IonicContact OE2-NH2 2.62Å; E139-R394 PolarHBondContact OE2-NH2 3.1Å
140I98.6Very high98Very high20 Ų2045.5 Ų45.510%0.10324%0.235CC..Hα-helixtrans-60.4-43.3174.6-67.7169.6000111.1L109 A112 Q113 L116 L136 I137 I143 K144L109-I140 HydrophobicContact CD1-CB 4.32Å; L109-I140 HydrophobicContact CD1-CG1 4.28Å; L109-I140 HydrophobicContact CD1-CG2 3.9Å; A112-I140 HydrophobicContact CB-CD1 4.37Å; A112-I140 HydrophobicContact CB-CG1 3.68Å; Q113-I140 HydrophobicContact CB-CD1 4.44Å; Q113-I140 HydrophobicContact CG-CD1 3.7Å; Q113-I140 HydrophobicContact CG-CG1 4.14Å; L116-I140 HydrophobicContact CD1-CD1 3.39Å; L116-I140 HydrophobicContact CG-CD1 4.37Å; L136-I140 WeakPolarHBondContact O-CG1 3.28Å; L136-I140 PolarHBondContact O-N 3.23Å; L136-I140 VanDerWaalsContact O-N 3.14Å; I137-I140 WeakPolarHBondContact O-CB 3.42Å; I137-I140 PolarHBondContact O-N 3.46Å; I137-I140 VanDerWaalsContact O-N 3.16Å; I140-I143 PolarHBondContact O-N 2.93Å; I140-K144 HydrophobicContact CG2-CD 3.92Å; I140-K144 HydrophobicContact CG2-CG 4.41Å; I140-K144 WeakPolarHBondContact O-CB 3.46Å; I140-K144 VanDerWaalsContact O-CG 3.31Å; I140-K144 WeakPolarHBondContact O-CG 3.49Å; I140-K144 PolarHBondContact O-N 2.63Å
141E98.6Very high98.1Very high125 Ų12548.7 Ų48.758%0.58425%0.25SC*.Hα-helixtrans-63.3-46.3178.6-70.9177.4174.300112.2I137 K138 E139 K144 G145I137-E141 WeakPolarHBondContact O-CG 3.32Å; I137-E141 PolarHBondContact O-N 3.41Å; K138-E141 PolarHBondContact O-N 3.2Å; E139-E141 VanDerWaalsContact C-N 3.32Å; E139-E141 PolarHBondContact O-N 2.98Å; E141-K144 PolarHBondContact O-N 3.45Å; E141-G145 PolarHBondContact O-N 3.1Å
142V98.4Very high98.2Very high41 Ų4153.4 Ų53.425%0.24826%0.262CS..Hα-helixtrans-61.3-46.3177.4168.50000110.7K138 E139 G145 A146 D252 Q256K138-V142 HydrophobicContact CG-CG2 4.45Å; K138-V142 WeakPolarHBondContact O-CB 3.31Å; K138-V142 VanDerWaalsContact O-CG2 3.29Å; K138-V142 WeakPolarHBondContact O-CG2 3.47Å; K138-V142 PolarHBondContact O-N 3.46Å; E139-V142 PolarHBondContact O-N 3.31Å; V142-G145 PolarHBondContact O-N 3.3Å; V142-A146 WeakPolarHBondContact O-CB 3.34Å; V142-A146 PolarHBondContact O-N 3.47Å; V142-D252 HydrophobicContact CG1-CB 4.26Å; V142-Q256 HydrophobicContact CB-CB 4.45Å; V142-Q256 HydrophobicContact CB-CG 4.17Å; V142-Q256 HydrophobicContact CG1-CB 4.21Å; V142-Q256 HydrophobicContact CG1-CG 4.48Å; V142-Q256 HydrophobicContact CG2-CB 4.47Å; V142-Q256 HydrophobicContact CG2-CG 4.06Å
143I98Very high98.2Very high1 Ų153.5 Ų53.51%0.00526%0.262CS..Hα-helixtrans-67-43.3-179.2-63.4163.1000111.1P108 L109 E139 I140 G145 A146 Q147 I253P108-I143 HydrophobicContact CB-CD1 3.8Å; L109-I143 HydrophobicContact CB-CG2 3.8Å; L109-I143 HydrophobicContact CD1-CB 4.44Å; L109-I143 HydrophobicContact CD1-CG2 4.38Å; L109-I143 HydrophobicContact CG-CG2 4.5Å; E139-I143 HydrophobicContact CG-CD1 3.7Å; E139-I143 HydrophobicContact CG-CG1 4.47Å; E139-I143 WeakPolarHBondContact O-CB 3.49Å; E139-I143 WeakPolarHBondContact O-CD1 3.39Å; E139-I143 VanDerWaalsContact O-CG1 3.23Å; E139-I143 WeakPolarHBondContact O-CG1 3.43Å; E139-I143 PolarHBondContact O-N 3.11Å; I140-I143 PolarHBondContact O-N 2.93Å; I143-G145 VanDerWaalsContact C-N 3.32Å; I143-G145 PolarHBondContact O-N 3.39Å; I143-A146 WeakPolarHBondContact O-CB 3.22Å; I143-A146 PolarHBondContact O-N 2.85Å; I143-Q147 HydrophobicContact CG2-CG 4.44Å; I143-Q147 WeakPolarHBondContact O-CG 3.44Å; I143-Q147 PolarHBondContact O-N 3.49Å; I143-I253 HydrophobicContact CG1-CD1 4.39Å; I143-I253 HydrophobicContact CG1-CG1 4.13Å; I143-I253 HydrophobicContact CG1-CG2 4.44Å
144K98.6Very high98.3Very high103 Ų10352 Ų5245%0.44826%0.256SS..Hα-helixtrans-63.4-38.1175.4-76.2-180174.8178.70112.6L109 I140 E141 Q147 T148L109-K144 HydrophobicContact CD1-CG 4.15Å; L109-K144 HydrophobicContact CD2-CG 4.45Å; I140-K144 HydrophobicContact CG2-CD 3.92Å; I140-K144 HydrophobicContact CG2-CG 4.41Å; I140-K144 WeakPolarHBondContact O-CB 3.46Å; I140-K144 VanDerWaalsContact O-CG 3.31Å; I140-K144 WeakPolarHBondContact O-CG 3.49Å; I140-K144 PolarHBondContact O-N 2.63Å; E141-K144 PolarHBondContact O-N 3.45Å; K144-Q147 PolarHBondContact O-N 2.96Å; K144-T148 PolarHBondContact O-N 3.28Å; K144-T148 PolarHBondContact O-OG1 2.89Å
145G98.4Very high98.3Very high33 Ų3351 Ų5134%0.3425%0.25SC..Hα-helixtrans-60.3-47172.800000111.5E141 V142 I143 T148 I149E141-G145 PolarHBondContact O-N 3.1Å; V142-G145 PolarHBondContact O-N 3.3Å; I143-G145 VanDerWaalsContact C-N 3.32Å; I143-G145 PolarHBondContact O-N 3.39Å; G145-T148 WeakPolarHBondContact O-CB 3.4Å; G145-T148 PolarHBondContact O-N 2.87Å; G145-I149 WeakPolarHBondContact O-CG1 3.49Å; G145-I149 PolarHBondContact O-N 3.3Å; G145-I149 VanDerWaalsContact O-N 3.09Å
146A97.6Very high98.3Very high8 Ų853.8 Ų53.87%0.06626%0.263CS..Hα-helixtrans-60.7-47175.300000112.6V142 I143 T148 I149 L150 V249 I253V142-A146 WeakPolarHBondContact O-CB 3.34Å; V142-A146 PolarHBondContact O-N 3.47Å; I143-A146 WeakPolarHBondContact O-CB 3.22Å; I143-A146 PolarHBondContact O-N 2.85Å; A146-T148 VanDerWaalsContact C-N 3.27Å; A146-T148 PolarHBondContact O-N 3.25Å; A146-I149 PolarHBondContact O-N 2.93Å; A146-L150 WeakPolarHBondContact O-CB 3.33Å; A146-L150 WeakPolarHBondContact O-CG 3.39Å; A146-L150 PolarHBondContact O-N 3.06Å; A146-V249 HydrophobicContact CB-CB 4.33Å; A146-V249 HydrophobicContact CB-CG1 3.65Å; A146-V249 HydrophobicContact CB-CG2 3.89Å; A146-I253 HydrophobicContact CB-CD1 4.03Å; A146-I253 HydrophobicContact CB-CG1 4.36Å
147Q98.3Very high98.3Very high29 Ų2953.8 Ų53.814%0.13626%0.263CS..Hα-helixtrans-55.7-42.6174.7-77-177.8-26.100112L102 T105 E106 I143 K144 L150 Q151L102-Q147 HydrophobicContact CD1-CB 4Å; L102-Q147 HydrophobicContact CD1-CG 3.93Å; T105-Q147 WeakPolarHBondContact OG1-CG 3.42Å; T105-Q147 PolarHBondContact OG1-NE2 3.48Å; E106-Q147 VanDerWaalsContact CD-NE2 3.33Å; E106-Q147 PolarHBondContact OE1-NE2 3.26Å; I143-Q147 HydrophobicContact CG2-CG 4.44Å; I143-Q147 WeakPolarHBondContact O-CG 3.44Å; I143-Q147 PolarHBondContact O-N 3.49Å; K144-Q147 PolarHBondContact O-N 2.96Å; Q147-L150 PolarHBondContact O-N 2.97Å; Q147-Q151 VanDerWaalsContact O-CB 3.27Å; Q147-Q151 WeakPolarHBondContact O-CB 3.35Å; Q147-Q151 PolarHBondContact O-N 3.4Å
148T98.5Very high98.3Very high65 Ų6555.8 Ų55.840%0.39927%0.269SS..Hα-helixtrans-63.4-43.4178.5-59.60000111.8K144 G145 A146 R152K144-T148 PolarHBondContact O-N 3.28Å; K144-T148 PolarHBondContact O-OG1 2.89Å; G145-T148 WeakPolarHBondContact O-CB 3.4Å; G145-T148 PolarHBondContact O-N 2.87Å; A146-T148 VanDerWaalsContact C-N 3.27Å; A146-T148 PolarHBondContact O-N 3.25Å; T148-R152 VanDerWaalsContact O-CG 3.3Å; T148-R152 WeakPolarHBondContact O-CG 3.22Å; T148-R152 PolarHBondContact O-N 3.22Å; T148-R152 VanDerWaalsContact O-N 3.16Å
149I98.1Very high98.3Very high81 Ų8155.5 Ų55.542%0.41527%0.269SS..Hα-helixtrans-64.9-50.6177.8-65.7167000109.6G145 A146 Q151 R152 T153 I245G145-I149 WeakPolarHBondContact O-CG1 3.49Å; G145-I149 PolarHBondContact O-N 3.3Å; G145-I149 VanDerWaalsContact O-N 3.09Å; A146-I149 PolarHBondContact O-N 2.93Å; I149-Q151 PolarHBondContact O-N 2.86Å; I149-R152 PolarHBondContact O-N 2.88Å; I149-T153 PolarHBondContact O-N 2.82Å; I149-T153 PolarHBondContact O-OG1 2.68Å; I149-I245 HydrophobicContact CG2-CD1 4Å; I149-I245 HydrophobicContact CG2-CG1 4.22Å; I149-I245 HydrophobicContact CG2-CG2 3.74Å
150L98.1Very high98.4Very high0 Ų056.3 Ų56.30%027%0.273CS..Hα-helixtrans-57.7-46.2178.6-73.1172.1000112.1L98 T101 L102 T105 A146 Q147 R152 T153 V154 I245 V249L98-L150 HydrophobicContact CD2-CD2 4.03Å; T101-L150 HydrophobicContact CG2-CD1 3.96Å; T101-L150 HydrophobicContact CG2-CD2 4.08Å; L102-L150 HydrophobicContact CB-CB 4.24Å; L102-L150 HydrophobicContact CB-CD1 4.24Å; L102-L150 HydrophobicContact CD1-CB 3.98Å; L102-L150 HydrophobicContact CD1-CD1 4.3Å; T105-L150 HydrophobicContact CG2-CD1 4.04Å; A146-L150 WeakPolarHBondContact O-CB 3.33Å; A146-L150 WeakPolarHBondContact O-CG 3.39Å; A146-L150 PolarHBondContact O-N 3.06Å; Q147-L150 PolarHBondContact O-N 2.97Å; L150-R152 VanDerWaalsContact C-N 3.33Å; L150-R152 PolarHBondContact O-N 2.96Å; L150-T153 PolarHBondContact O-N 3.46Å; L150-T153 VanDerWaalsContact O-N 3.17Å; L150-V154 VanDerWaalsContact O-CG2 3.3Å; L150-V154 WeakPolarHBondContact O-CG2 3.39Å; L150-V154 PolarHBondContact O-N 3.18Å; L150-I245 HydrophobicContact CD2-CG2 3.91Å; L150-V249 HydrophobicContact CD1-CG1 4.03Å; L150-V249 HydrophobicContact CD2-CG2 4.5Å; L150-V249 HydrophobicContact CG-CG2 4.26Å
151Q98.4Very high98.4Very high85 Ų8555.5 Ų55.540%0.39727%0.269SS..Hα-helixtrans-61.1-42179.3-176.462.452.800111.8L102 Q147 I149 T153 V154 E155L102-Q151 HydrophobicContact CD2-CB 4.46Å; L102-Q151 VanDerWaalsContact CD2-OE1 3.25Å; Q147-Q151 VanDerWaalsContact O-CB 3.27Å; Q147-Q151 WeakPolarHBondContact O-CB 3.35Å; Q147-Q151 PolarHBondContact O-N 3.4Å; I149-Q151 PolarHBondContact O-N 2.86Å; Q151-T153 VanDerWaalsContact C-N 3.33Å; Q151-T153 PolarHBondContact O-N 3.44Å; Q151-V154 PolarHBondContact O-N 3.5Å; Q151-E155 PolarHBondContact NE2-OE1 2.99Å; Q151-E155 PolarHBondContact O-N 3.27Å; Q151-E155 VanDerWaalsContact O-N 3.12Å
152R98.5Very high98.4Very high174 Ų17455.3 Ų55.366%0.65726%0.262SS*.Hα-helixtrans-62.2-43.1175.5-72.9172.9-178.5179.92.3111.2T148 I149 L150 E155 Q156T148-R152 VanDerWaalsContact O-CG 3.3Å; T148-R152 WeakPolarHBondContact O-CG 3.22Å; T148-R152 PolarHBondContact O-N 3.22Å; T148-R152 VanDerWaalsContact O-N 3.16Å; I149-R152 PolarHBondContact O-N 2.88Å; L150-R152 VanDerWaalsContact C-N 3.33Å; L150-R152 PolarHBondContact O-N 2.96Å; R152-E155 PolarHBondContact O-N 3.14Å; R152-Q156 WeakPolarHBondContact O-CG 3.31Å; R152-Q156 PolarHBondContact O-N 2.83Å
153T98.1Very high98.4Very high3 Ų355.6 Ų55.62%0.01826%0.262CS..Hα-helixtrans-68.4-35.2179-51.40000112.5L98 I149 L150 Q151 Q156 A157 V242 I245L98-T153 HydrophobicContact CD1-CG2 3.9Å; L98-T153 HydrophobicContact CD2-CG2 4Å; I149-T153 PolarHBondContact O-N 2.82Å; I149-T153 PolarHBondContact O-OG1 2.68Å; L150-T153 PolarHBondContact O-N 3.46Å; L150-T153 VanDerWaalsContact O-N 3.17Å; Q151-T153 VanDerWaalsContact C-N 3.33Å; Q151-T153 PolarHBondContact O-N 3.44Å; T153-Q156 PolarHBondContact O-N 3.31Å; T153-A157 WeakPolarHBondContact O-CB 3.43Å; T153-A157 PolarHBondContact O-N 3.18Å; T153-V242 HydrophobicContact CG2-CG2 3.59Å; T153-I245 HydrophobicContact CG2-CD1 4.03Å; T153-I245 WeakPolarHBondContact OG1-CD1 3.43Å
154V98.5Very high98.4Very high8 Ų855.5 Ų55.55%0.04826%0.262CS..Hα-helixtrans-58.8-46.3171.3166.40000110.7F95 L98 R99 L150 Q151 A157 K158F95-V154 HydrophobicContact CD2-CG1 4.46Å; F95-V154 HydrophobicContact CE2-CG1 3.71Å; F95-V154 HydrophobicContact CZ-CG1 4.44Å; L98-V154 HydrophobicContact CB-CG2 3.8Å; L98-V154 HydrophobicContact CD1-CG2 4.44Å; R99-V154 HydrophobicContact CG-CG1 4.11Å; R99-V154 HydrophobicContact CG-CG2 4.16Å; L150-V154 VanDerWaalsContact O-CG2 3.3Å; L150-V154 WeakPolarHBondContact O-CG2 3.39Å; L150-V154 PolarHBondContact O-N 3.18Å; Q151-V154 PolarHBondContact O-N 3.5Å; V154-A157 PolarHBondContact O-N 3.24Å; V154-K158 VanDerWaalsContact O-CB 3.32Å; V154-K158 WeakPolarHBondContact O-CB 3.45Å; V154-K158 PolarHBondContact O-N 3.2Å
155E98.4Very high98.4Very high87 Ų8757.1 Ų57.141%0.40727%0.265SS..Hα-helixtrans-66.7-37.4177.5-65.9-52.4136.300112.3Q151 R152 K158 E159Q151-E155 PolarHBondContact NE2-OE1 2.99Å; Q151-E155 PolarHBondContact O-N 3.27Å; Q151-E155 VanDerWaalsContact O-N 3.12Å; R152-E155 PolarHBondContact O-N 3.14Å; E155-K158 PolarHBondContact O-N 3Å; E155-K158 IonicContact OE2-NZ 3.28Å; E155-E159 WeakPolarHBondContact O-CB 3.42Å; E155-E159 PolarHBondContact O-N 2.99Å
156Q98.5Very high98.4Very high107 Ų10761.4 Ų61.450%0.528%0.275SS..Hα-helixtrans-61.8-46.5173.6-71.7173.2-39.600111.9R152 T153 E159 Q160 L238R152-Q156 WeakPolarHBondContact O-CG 3.31Å; R152-Q156 PolarHBondContact O-N 2.83Å; T153-Q156 PolarHBondContact O-N 3.31Å; Q156-E159 PolarHBondContact O-N 3.48Å; Q156-Q160 PolarHBondContact O-N 3.44Å; Q156-L238 HydrophobicContact CB-CD1 4.26Å
157A98.5Very high98.4Very high0 Ų061.1 Ų61.10%027%0.272CS..Hα-helixtrans-64.1-41.2177.600000112.1F95 L98 T153 V154 E159 Q160 L161 L238F95-A157 HydrophobicContact CB-CB 4.4Å; F95-A157 HydrophobicContact CD2-CB 3.94Å; L98-A157 HydrophobicContact CD1-CB 4.03Å; T153-A157 WeakPolarHBondContact O-CB 3.43Å; T153-A157 PolarHBondContact O-N 3.18Å; V154-A157 PolarHBondContact O-N 3.24Å; A157-E159 PolarHBondContact O-N 3.01Å; A157-Q160 PolarHBondContact O-N 2.72Å; A157-L161 WeakPolarHBondContact O-CB 3.29Å; A157-L161 WeakPolarHBondContact O-CG 3.32Å; A157-L161 PolarHBondContact O-N 3.3Å; A157-L238 HydrophobicContact CB-CD2 4.15Å
158K98.4Very high98.4Very high112 Ų11260.6 Ų60.649%0.48727%0.27SS..Hα-helixtrans-60.7-43.6174.7-175.5-179.4173.8-170.70112.3F95 V154 E155 R162F95-K158 HydrophobicContact CD2-CB 4.48Å; F95-K158 HydrophobicContact CE2-CB 3.8Å; F95-K158 HydrophobicContact CE2-CG 4.49Å; F95-K158 HydrophobicContact CZ-CB 4.34Å; V154-K158 VanDerWaalsContact O-CB 3.32Å; V154-K158 WeakPolarHBondContact O-CB 3.45Å; V154-K158 PolarHBondContact O-N 3.2Å; E155-K158 PolarHBondContact O-N 3Å; E155-K158 IonicContact OE2-NZ 3.28Å; K158-R162 PolarHBondContact O-N 2.97Å
159E98.4Very high98.4Very high83 Ų8364.8 Ų64.839%0.38828%0.279SS..Hα-helixtrans-68.1-41.6177.7178.456.2-16600111.7E155 Q156 A157 L161 R162 L163E155-E159 WeakPolarHBondContact O-CB 3.42Å; E155-E159 PolarHBondContact O-N 2.99Å; Q156-E159 PolarHBondContact O-N 3.48Å; A157-E159 PolarHBondContact O-N 3.01Å; E159-L161 PolarHBondContact O-N 2.88Å; E159-R162 WeakPolarHBondContact O-CB 3.49Å; E159-R162 PolarHBondContact O-N 3.43Å; E159-R162 VanDerWaalsContact O-N 3.13Å; E159-R162 IonicContact OE1-CZ 3.54Å; E159-R162 IonicContact OE1-NE 3.76Å; E159-R162 PolarHBondContact OE1-NE 3.28Å; E159-R162 IonicContact OE1-NH2 2.97Å; E159-R162 PolarHBondContact OE1-NH2 2.97Å; E159-R162 IonicContact OE2-CZ 2.65Å; E159-R162 IonicContact OE2-NE 3.8Å; E159-R162 PolarHBondContact OE2-NE 3.18Å; E159-R162 IonicContact OE2-NH2 2.84Å; E159-L163 HydrophobicContact CG-CD1 4.45Å; E159-L163 WeakPolarHBondContact O-CG 3.36Å; E159-L163 PolarHBondContact O-N 2.99Å
160Q98.6Very high98.3Very high17 Ų1764.1 Ų64.18%0.07928%0.277CS..Hα-helixtrans-63.2-41.4175.7-170.957.550.300111.6L91 Q156 A157 R162 L163 N164 Q231 L238L91-Q160 HydrophobicContact CD2-CB 3.91Å; L91-Q160 HydrophobicContact CD2-CG 3.72Å; Q156-Q160 PolarHBondContact O-N 3.44Å; A157-Q160 PolarHBondContact O-N 2.72Å; Q160-R162 VanDerWaalsContact C-N 3.3Å; Q160-R162 PolarHBondContact O-N 2.95Å; Q160-L163 PolarHBondContact O-N 3.38Å; Q160-L163 VanDerWaalsContact O-N 3.17Å; Q160-N164 PolarHBondContact NE2-OD1 3.2Å; Q160-N164 PolarHBondContact O-N 3.46Å; Q160-N164 PolarHBondContact O-OD1 3.04Å; Q160-N164 VanDerWaalsContact O-OD1 3.12Å; Q160-Q231 PolarHBondContact NE2-O 3.17Å; Q160-L238 HydrophobicContact CB-CD2 3.75Å; Q160-L238 HydrophobicContact CG-CD2 4.19Å
161L98.7Very high98.2Very high3 Ų364.2 Ų64.22%0.01628%0.277CS..Hα-helixtrans-58.4-40.6172-77.4169.8000112.2T88 L91 D92 F95 A157 E159 N164 R165T88-L161 HydrophobicContact CG2-CD2 3.87Å; T88-L161 WeakPolarHBondContact O-CD2 3.31Å; L91-L161 HydrophobicContact CB-CD2 4.02Å; L91-L161 HydrophobicContact CD2-CD2 3.9Å; L91-L161 HydrophobicContact CD2-CG 3.82Å; L91-L161 HydrophobicContact CG-CD2 3.96Å; L91-L161 HydrophobicContact CG-CG 4.05Å; D92-L161 HydrophobicContact CB-CD2 4.14Å; F95-L161 HydrophobicContact CB-CD1 3.82Å; F95-L161 HydrophobicContact CD1-CD1 4.13Å; F95-L161 HydrophobicContact CD2-CD1 4.43Å; F95-L161 HydrophobicContact CG-CD1 3.88Å; A157-L161 WeakPolarHBondContact O-CB 3.29Å; A157-L161 WeakPolarHBondContact O-CG 3.32Å; A157-L161 PolarHBondContact O-N 3.3Å; E159-L161 PolarHBondContact O-N 2.88Å; L161-N164 PolarHBondContact O-N 3.17Å; L161-R165 WeakPolarHBondContact O-CB 3.38Å; L161-R165 WeakPolarHBondContact O-CG 3.34Å; L161-R165 PolarHBondContact O-N 3.39Å
162R98.6Very high98.2Very high121 Ų12165.9 Ų65.946%0.45728%0.283SS..Hα-helixtrans-63.4-42.7176.2-168.1-165.368.674.70.7111.5K158 E159 Q160 K166K158-R162 PolarHBondContact O-N 2.97Å; E159-R162 WeakPolarHBondContact O-CB 3.49Å; E159-R162 PolarHBondContact O-N 3.43Å; E159-R162 VanDerWaalsContact O-N 3.13Å; E159-R162 IonicContact OE1-CZ 3.54Å; E159-R162 IonicContact OE1-NE 3.76Å; E159-R162 PolarHBondContact OE1-NE 3.28Å; E159-R162 IonicContact OE1-NH2 2.97Å; E159-R162 PolarHBondContact OE1-NH2 2.97Å; E159-R162 IonicContact OE2-CZ 2.65Å; E159-R162 IonicContact OE2-NE 3.8Å; E159-R162 PolarHBondContact OE2-NE 3.18Å; E159-R162 IonicContact OE2-NH2 2.84Å; Q160-R162 VanDerWaalsContact C-N 3.3Å; Q160-R162 PolarHBondContact O-N 2.95Å; R162-K166 PolarHBondContact O-N 2.89Å
163L98.5Very high98.1Very high47 Ų4763.3 Ų63.325%0.24628%0.277CS..Hα-helixtrans-66.9-42.6177.5-67.9173.5000112.1E159 Q160 R165 K166 A167E159-L163 HydrophobicContact CG-CD1 4.45Å; E159-L163 WeakPolarHBondContact O-CG 3.36Å; E159-L163 PolarHBondContact O-N 2.99Å; Q160-L163 PolarHBondContact O-N 3.38Å; Q160-L163 VanDerWaalsContact O-N 3.17Å; L163-R165 PolarHBondContact O-N 2.96Å; L163-K166 WeakPolarHBondContact O-CB 3.5Å; L163-K166 PolarHBondContact O-N 3.36Å; L163-A167 PolarHBondContact O-N 3.06Å
164N98.6Very high98Very high0 Ų063.5 Ų63.50%028%0.278CS..Hα-helixtrans-60-47.7174.9-68.110.7000111I84 T88 Q160 L161 K166 A167 I168I84-N164 HydrophobicContact CD1-CB 4.42Å; I84-N164 HydrophobicContact CG1-CB 4.31Å; T88-N164 HydrophobicContact CG2-CB 4.25Å; T88-N164 WeakPolarHBondContact OG1-CB 3.5Å; T88-N164 PolarHBondContact OG1-ND2 3.21Å; Q160-N164 PolarHBondContact NE2-OD1 3.2Å; Q160-N164 PolarHBondContact O-N 3.46Å; Q160-N164 PolarHBondContact O-OD1 3.04Å; Q160-N164 VanDerWaalsContact O-OD1 3.12Å; L161-N164 PolarHBondContact O-N 3.17Å; N164-K166 VanDerWaalsContact C-N 3.28Å; N164-K166 PolarHBondContact O-N 3.48Å; N164-A167 WeakPolarHBondContact O-CB 3.37Å; N164-A167 PolarHBondContact O-N 3.25Å; N164-A167 VanDerWaalsContact O-N 3.07Å; N164-I168 WeakPolarHBondContact O-CG1 3.29Å; N164-I168 PolarHBondContact O-N 2.75Å
165R98.4Very high97.9Very high137 Ų13763.8 Ų63.852%0.51728%0.28SS..Hα-helixtrans-59.3-37.8177.2-71.9169.4-175163.15.8112.3T88 D92 L161 L163 Y169T88-R165 HydrophobicContact CG2-CG 4.43Å; D92-R165 IonicContact OD1-NH2 3.82Å; D92-R165 PolarHBondContact OD1-NH2 2.82Å; D92-R165 VanDerWaalsContact OD1-NH2 3.12Å; L161-R165 WeakPolarHBondContact O-CB 3.38Å; L161-R165 WeakPolarHBondContact O-CG 3.34Å; L161-R165 PolarHBondContact O-N 3.39Å; L163-R165 PolarHBondContact O-N 2.96Å; R165-Y169 WeakPolarHBondContact O-CB 3.46Å; R165-Y169 PolarHBondContact O-N 3.44Å
166K98.2Very high97.8Very high123 Ų12363 Ų6354%0.53529%0.285SS..Hα-helixtrans-64.3-44.4173.6-176.5-176.6177.3-174.60111.6R162 L163 N164 Y169 N170R162-K166 PolarHBondContact O-N 2.89Å; L163-K166 WeakPolarHBondContact O-CB 3.5Å; L163-K166 PolarHBondContact O-N 3.36Å; N164-K166 VanDerWaalsContact C-N 3.28Å; N164-K166 PolarHBondContact O-N 3.48Å; K166-Y169 PolarHBondContact O-N 3.04Å; K166-N170 PolarHBondContact O-N 3.48Å; K166-N170 VanDerWaalsContact O-N 3.07Å
167A97.8Very high97.7Very high1 Ų162.1 Ų62.11%0.00828%0.283CS..Hα-helixtrans-63.9-44.7177.300000111.6I84 L163 N164 Y169 N170 M171 Q231I84-A167 HydrophobicContact CD1-CB 3.5Å; L163-A167 PolarHBondContact O-N 3.06Å; N164-A167 WeakPolarHBondContact O-CB 3.37Å; N164-A167 PolarHBondContact O-N 3.25Å; N164-A167 VanDerWaalsContact O-N 3.07Å; A167-Y169 VanDerWaalsContact C-N 3.34Å; A167-Y169 PolarHBondContact O-N 3.34Å; A167-N170 PolarHBondContact O-N 3.05Å; A167-M171 WeakPolarHBondContact O-CG 3.3Å; A167-M171 PolarHBondContact O-N 3.14Å; A167-Q231 HydrophobicContact CB-CG 4.02Å
168I98.2Very high97.6Very high18 Ų1862.3 Ų62.39%0.09228%0.284CS..Hα-helixtrans-54-49.3172.5-72.5165000111L81 I84 T88 N164 N170 M171 K172L81-I168 HydrophobicContact CD1-CB 4.31Å; L81-I168 HydrophobicContact CD1-CG1 4.42Å; L81-I168 HydrophobicContact CD1-CG2 3.92Å; I84-I168 HydrophobicContact CG1-CG1 4.34Å; I84-I168 HydrophobicContact CG2-CG1 3.66Å; T88-I168 HydrophobicContact CG2-CD1 4.32Å; T88-I168 WeakPolarHBondContact OG1-CD1 3.02Å; N164-I168 WeakPolarHBondContact O-CG1 3.29Å; N164-I168 PolarHBondContact O-N 2.75Å; I168-N170 PolarHBondContact O-N 3.18Å; I168-M171 PolarHBondContact O-N 3.33Å; I168-K172 HydrophobicContact CG2-CD 4.01Å; I168-K172 HydrophobicContact CG2-CG 4.45Å; I168-K172 WeakPolarHBondContact O-CB 3.49Å; I168-K172 WeakPolarHBondContact O-CG 3.42Å; I168-K172 PolarHBondContact O-N 3.29Å
169Y97.8Very high97.6Very high153 Ų15360.1 Ų60.160%0.628%0.277SS*.Hα-helixtrans-59.3-47.6179.4173.7-95000112R165 K166 A167 M171 K172 K173R165-Y169 WeakPolarHBondContact O-CB 3.46Å; R165-Y169 PolarHBondContact O-N 3.44Å; K166-Y169 PolarHBondContact O-N 3.04Å; A167-Y169 VanDerWaalsContact C-N 3.34Å; A167-Y169 PolarHBondContact O-N 3.34Å; Y169-M171 PolarHBondContact O-N 3.38Å; Y169-K172 PolarHBondContact O-N 3.03Å; Y169-K173 PolarHBondContact O-N 3.34Å
170N96.4Very high97.6Very high68 Ų6861.3 Ų61.336%0.36428%0.283SS..Hα-helixtrans-63-42.1179.9-72.9-13.1000112K166 A167 I168 K173 D174K166-N170 PolarHBondContact O-N 3.48Å; K166-N170 VanDerWaalsContact O-N 3.07Å; A167-N170 PolarHBondContact O-N 3.05Å; I168-N170 PolarHBondContact O-N 3.18Å; N170-K173 PolarHBondContact O-N 3.3Å; N170-D174 WeakPolarHBondContact O-CB 3.38Å; N170-D174 PolarHBondContact O-N 3.49Å
171M96.8Very high97.5Very high1 Ų162 Ų621%0.00529%0.291CS..Hα-helixtrans-69.5-36.8177.2-71.7178.4-16800113V77 K80 L81 I84 A167 I168 Y169 K173 D174 S175 S224V77-M171 HydrophobicContact CG1-CB 4.13Å; V77-M171 HydrophobicContact CG1-CG 4.45Å; K80-M171 HydrophobicContact CB-SD 4.34Å; K80-M171 HydrophobicContact CG-CE 3.74Å; K80-M171 HydrophobicContact CG-SD 4.13Å; L81-M171 HydrophobicContact CB-CB 4.17Å; L81-M171 HydrophobicContact CB-SD 4.22Å; L81-M171 HydrophobicContact CD1-CB 4.06Å; I84-M171 HydrophobicContact CG2-SD 4.19Å; A167-M171 WeakPolarHBondContact O-CG 3.3Å; A167-M171 PolarHBondContact O-N 3.14Å; I168-M171 PolarHBondContact O-N 3.33Å; Y169-M171 PolarHBondContact O-N 3.38Å; M171-K173 VanDerWaalsContact C-N 3.31Å; M171-K173 PolarHBondContact O-N 3.46Å; M171-D174 PolarHBondContact O-N 2.98Å; M171-S175 VanDerWaalsContact O-CB 3.31Å; M171-S175 WeakPolarHBondContact O-CB 3.29Å; M171-S175 PolarHBondContact O-N 3.01Å; M171-S224 WeakPolarHBondContact CE-O 3.45Å
172K97.5Very high97.4Very high120 Ų12062.5 Ų62.552%0.52229%0.294SS..Hα-helixtrans-59.9-44.6172.8-80.1179.8178.3-179.40111L81 I168 Y169 S176L81-K172 HydrophobicContact CD1-CG 3.82Å; L81-K172 HydrophobicContact CD2-CG 3.7Å; L81-K172 HydrophobicContact CG-CG 4.42Å; I168-K172 HydrophobicContact CG2-CD 4.01Å; I168-K172 HydrophobicContact CG2-CG 4.45Å; I168-K172 WeakPolarHBondContact O-CB 3.49Å; I168-K172 WeakPolarHBondContact O-CG 3.42Å; I168-K172 PolarHBondContact O-N 3.29Å; Y169-K172 PolarHBondContact O-N 3.03Å; K172-S176 WeakPolarHBondContact O-CB 3.47Å; K172-S176 PolarHBondContact O-N 3.02Å
173K96.6Very high97.4Very high121 Ų12161.1 Ų61.153%0.52629%0.292SS..Hα-helixtrans-61.2-49.9175.2-175.9179176.8-174.60110.9Y169 N170 M171 S175 S176 D177Y169-K173 PolarHBondContact O-N 3.34Å; N170-K173 PolarHBondContact O-N 3.3Å; M171-K173 VanDerWaalsContact C-N 3.31Å; M171-K173 PolarHBondContact O-N 3.46Å; K173-S175 VanDerWaalsContact C-N 3.35Å; K173-S175 PolarHBondContact O-N 2.89Å; K173-S176 WeakPolarHBondContact O-CB 3.38Å; K173-S176 PolarHBondContact O-N 3.05Å; K173-S176 VanDerWaalsContact O-N 3.14Å; K173-D177 PolarHBondContact O-N 3.3Å
174D95.7Very high97.3Very high6 Ų663.5 Ų63.53%0.03231%0.305CS..Hα-helixtrans-60.4-42.6-179.4-173.930.9000112.8V77 N170 M171 D177 K178 F220V77-D174 HydrophobicContact CG1-CB 4.41Å; V77-D174 WeakPolarHBondContact CG2-OD2 3.49Å; N170-D174 WeakPolarHBondContact O-CB 3.38Å; N170-D174 PolarHBondContact O-N 3.49Å; M171-D174 PolarHBondContact O-N 2.98Å; D174-D177 PolarHBondContact O-N 3.44Å; D174-K178 WeakPolarHBondContact O-CB 3.44Å; D174-K178 VanDerWaalsContact O-CG 3.3Å; D174-K178 WeakPolarHBondContact O-CG 3.46Å; D174-K178 PolarHBondContact O-N 3.21Å; D174-K178 IonicContact OD1-NZ 3.88Å; D174-K178 PolarHBondContact OD1-NZ 3.23Å; D174-K178 IonicContact OD2-NZ 2.82Å; D174-K178 PolarHBondContact OD2-NZ 2.74Å; D174-F220 HydrophobicContact CB-CE1 4.14Å; D174-F220 WeakPolarHBondContact OD1-CE1 3.23Å
175S96.5Very high97.3Very high14 Ų1465.1 Ų65.110%0.09831%0.313CS..Hα-helixtrans-63.5-41.5174.2-178.60000112.4N78 M171 K173 K178 L179N78-S175 WeakPolarHBondContact OD1-CB 3.34Å; N78-S175 PolarHBondContact OD1-OG 3.08Å; M171-S175 VanDerWaalsContact O-CB 3.31Å; M171-S175 WeakPolarHBondContact O-CB 3.29Å; M171-S175 PolarHBondContact O-N 3.01Å; K173-S175 VanDerWaalsContact C-N 3.35Å; K173-S175 PolarHBondContact O-N 2.89Å; S175-K178 PolarHBondContact O-N 3.47Å; S175-L179 WeakPolarHBondContact O-CB 3.34Å; S175-L179 PolarHBondContact O-N 3.03Å
176S97.4Very high97.3Very high72 Ų7261.6 Ų61.650%0.50330%0.303SS..Hα-helixtrans-63.8-45.4176.3-174.80000112K172 K173 K178 L179 Q180K172-S176 WeakPolarHBondContact O-CB 3.47Å; K172-S176 PolarHBondContact O-N 3.02Å; K173-S176 WeakPolarHBondContact O-CB 3.38Å; K173-S176 PolarHBondContact O-N 3.05Å; K173-S176 VanDerWaalsContact O-N 3.14Å; S176-K178 VanDerWaalsContact C-N 3.33Å; S176-K178 PolarHBondContact O-N 3.47Å; S176-L179 PolarHBondContact O-N 3.16Å; S176-Q180 PolarHBondContact O-N 2.95Å
177D96.6Very high97.1Very high87 Ų8762.9 Ų62.947%0.46531%0.305SS..Hα-helixtrans-63.2-41.4178.6-69.8-17.4000110.4K173 D174 Q180 A181K173-D177 PolarHBondContact O-N 3.3Å; D174-D177 PolarHBondContact O-N 3.44Å; D177-Q180 PolarHBondContact O-N 3.2Å; D177-A181 WeakPolarHBondContact O-CB 3.44Å; D177-A181 PolarHBondContact O-N 2.9Å
178K96.8Very high97Very high4 Ų464.6 Ų64.62%0.01732%0.32CS..Hα-helixtrans-64.2-40.2173.2-74.6177.5172.370.50113V70 W73 K74 D174 S175 S176 A181 Q182 W217 S221V70-K178 HydrophobicContact CG1-CB 4.15Å; V70-K178 VanDerWaalsContact CG1-O 3.25Å; V70-K178 WeakPolarHBondContact CG1-O 3.31Å; W73-K178 HydrophobicContact CB-CD 4.32Å; K74-K178 HydrophobicContact CB-CB 4.1Å; K74-K178 HydrophobicContact CB-CD 4.13Å; K74-K178 HydrophobicContact CG-CB 4.15Å; D174-K178 WeakPolarHBondContact O-CB 3.44Å; D174-K178 VanDerWaalsContact O-CG 3.3Å; D174-K178 WeakPolarHBondContact O-CG 3.46Å; D174-K178 PolarHBondContact O-N 3.21Å; D174-K178 IonicContact OD1-NZ 3.88Å; D174-K178 PolarHBondContact OD1-NZ 3.23Å; D174-K178 IonicContact OD2-NZ 2.82Å; D174-K178 PolarHBondContact OD2-NZ 2.74Å; S175-K178 PolarHBondContact O-N 3.47Å; S176-K178 VanDerWaalsContact C-N 3.33Å; S176-K178 PolarHBondContact O-N 3.47Å; K178-A181 PolarHBondContact O-N 2.94Å; K178-Q182 WeakPolarHBondContact O-CB 3.21Å; K178-Q182 PolarHBondContact O-N 2.74Å; K178-W217 HydrophobicContact CG-CZ2 4.48Å; K178-S221 VanDerWaalsContact CE-OG 3.31Å; K178-S221 WeakPolarHBondContact CE-OG 3.32Å; K178-S221 PolarHBondContact NZ-OG 2.9Å
179L97.4Very high96.8Very high67 Ų6766 Ų6635%0.35133%0.327SS..Hα-helixtrans-63-44.3176.3-178.866.7000111K74 S175 S176 Q182 H183K74-L179 HydrophobicContact CD-CB 4.17Å; K74-L179 HydrophobicContact CD-CD1 4.26Å; S175-L179 WeakPolarHBondContact O-CB 3.34Å; S175-L179 PolarHBondContact O-N 3.03Å; S176-L179 PolarHBondContact O-N 3.16Å; L179-Q182 WeakPolarHBondContact O-CB 3.47Å; L179-Q182 PolarHBondContact O-N 3.05Å; L179-H183 WeakPolarHBondContact CD1-NE2 3.34Å; L179-H183 PolarHBondContact O-N 2.62Å
180Q97.8Very high96.6Very high107 Ų10762.3 Ų62.350%0.532%0.323SS..Hα-helixtrans-63.9-44.4176.9-172.364.22200111.4S176 D177 Q182 H183 L184S176-Q180 PolarHBondContact O-N 2.95Å; D177-Q180 PolarHBondContact O-N 3.2Å; Q180-Q182 VanDerWaalsContact C-N 3.33Å; Q180-Q182 PolarHBondContact O-N 3.18Å; Q180-H183 PolarHBondContact O-N 3.38Å; Q180-L184 HydrophobicContact CG-CD1 4.29Å; Q180-L184 WeakPolarHBondContact O-CG 3.44Å; Q180-L184 PolarHBondContact O-N 3.37Å
181A96.8Very high96.4Very high31 Ų3162.2 Ų62.226%0.25632%0.322SS..Hα-helixtrans-59.6-43.5175.400000111.7D177 K178 H183 L184 D185D177-A181 WeakPolarHBondContact O-CB 3.44Å; D177-A181 PolarHBondContact O-N 2.9Å; K178-A181 PolarHBondContact O-N 2.94Å; A181-H183 PolarHBondContact O-N 3.43Å; A181-L184 PolarHBondContact O-N 2.83Å; A181-D185 WeakPolarHBondContact O-CB 3.37Å; A181-D185 PolarHBondContact O-N 2.87Å
182Q97.4Very high96.1Very high15 Ų1568.6 Ų68.67%0.0735%0.35CS..Hα-helixtrans-58.2-48.3175.4-172.9-159.6-4100111.5I67 V70 K71 K178 L179 Q180 L184 D185 E186I67-Q182 HydrophobicContact CG2-CG 4.45Å; V70-Q182 HydrophobicContact CG1-CB 3.97Å; K71-Q182 HydrophobicContact CG-CG 4.18Å; K178-Q182 WeakPolarHBondContact O-CB 3.21Å; K178-Q182 PolarHBondContact O-N 2.74Å; L179-Q182 WeakPolarHBondContact O-CB 3.47Å; L179-Q182 PolarHBondContact O-N 3.05Å; Q180-Q182 VanDerWaalsContact C-N 3.33Å; Q180-Q182 PolarHBondContact O-N 3.18Å; Q182-L184 VanDerWaalsContact C-N 3.34Å; Q182-L184 PolarHBondContact O-N 3.13Å; Q182-D185 PolarHBondContact O-N 3.23Å; Q182-E186 HydrophobicContact CG-CG 4.38Å; Q182-E186 VanDerWaalsContact NE2-CD 3.35Å; Q182-E186 PolarHBondContact NE2-OE1 2.98Å; Q182-E186 PolarHBondContact NE2-OE2 3.07Å; Q182-E186 WeakPolarHBondContact O-CB 3.34Å; Q182-E186 VanDerWaalsContact O-CG 3.28Å; Q182-E186 WeakPolarHBondContact O-CG 3.38Å; Q182-E186 PolarHBondContact O-N 3.16Å
183H98Very high95.7Very high92 Ų9267.7 Ų67.743%0.42636%0.357SS..Hα-helixtrans-64.1-38.8-179.9-67.7168.7000112.5L179 Q180 A181 E186 Y187L179-H183 WeakPolarHBondContact CD1-NE2 3.34Å; L179-H183 PolarHBondContact O-N 2.62Å; Q180-H183 PolarHBondContact O-N 3.38Å; A181-H183 PolarHBondContact O-N 3.43Å; H183-E186 IonicContact CD2-OE2 2.88Å; H183-Y187 VanDerWaalsContact O-CB 3.26Å; H183-Y187 WeakPolarHBondContact O-CB 3.24Å; H183-Y187 PolarHBondContact O-N 2.94Å
184L97.7Very high95.3Very high97 Ų9767.7 Ų67.751%0.50837%0.367SS..Hα-helixtrans-64.8-44.6176.5-71.4172.5000111.4Q180 A181 Q182 Y187 A188Q180-L184 HydrophobicContact CG-CD1 4.29Å; Q180-L184 WeakPolarHBondContact O-CG 3.44Å; Q180-L184 PolarHBondContact O-N 3.37Å; A181-L184 PolarHBondContact O-N 2.83Å; Q182-L184 VanDerWaalsContact C-N 3.34Å; Q182-L184 PolarHBondContact O-N 3.13Å; L184-Y187 PolarHBondContact O-N 2.93Å; L184-A188 VanDerWaalsContact O-CB 3.31Å; L184-A188 WeakPolarHBondContact O-CB 3.45Å; L184-A188 PolarHBondContact O-N 3.42Å
185D97.4Very high94.9Very high34 Ų3470.1 Ų70.118%0.18238%0.38CS..Hα-helixtrans-68-40.8178.5-71.6-17.6000111.5F63 R66 I67 A181 Q182 A188 L189F63-D185 HydrophobicContact CD1-CB 4.27Å; R66-D185 WeakPolarHBondContact CG-OD2 3.46Å; I67-D185 HydrophobicContact CD1-CB 4.1Å; I67-D185 HydrophobicContact CG1-CB 3.6Å; A181-D185 WeakPolarHBondContact O-CB 3.37Å; A181-D185 PolarHBondContact O-N 2.87Å; Q182-D185 PolarHBondContact O-N 3.23Å; D185-A188 PolarHBondContact O-N 2.92Å; D185-L189 VanDerWaalsContact O-CB 3.29Å; D185-L189 WeakPolarHBondContact O-CB 3.4Å; D185-L189 PolarHBondContact O-N 3.28Å
186E97.7Very high94.3Very high63 Ų6379 Ų7929%0.29442%0.42SS..Hα-helixtrans-63.8-40.5175.1-76.1173.2162.600111.7I67 K71 Q182 H183 S190I67-E186 HydrophobicContact CD1-CG 3.94Å; I67-E186 HydrophobicContact CG1-CG 4.33Å; I67-E186 HydrophobicContact CG2-CG 4.09Å; K71-E186 WeakPolarHBondContact CE-OE1 3.06Å; K71-E186 IonicContact NZ-OE1 2.68Å; K71-E186 PolarHBondContact NZ-OE1 3.46Å; Q182-E186 HydrophobicContact CG-CG 4.38Å; Q182-E186 VanDerWaalsContact NE2-CD 3.35Å; Q182-E186 PolarHBondContact NE2-OE1 2.98Å; Q182-E186 PolarHBondContact NE2-OE2 3.07Å; Q182-E186 WeakPolarHBondContact O-CB 3.34Å; Q182-E186 VanDerWaalsContact O-CG 3.28Å; Q182-E186 WeakPolarHBondContact O-CG 3.38Å; Q182-E186 PolarHBondContact O-N 3.16Å; H183-E186 IonicContact CD2-OE2 2.88Å; E186-S190 WeakPolarHBondContact O-CB 3.46Å; E186-S190 PolarHBondContact O-N 3.45Å; E186-S190 VanDerWaalsContact O-N 3.12Å
187Y95.8Very high93.7Very high149 Ų14983.5 Ų83.558%0.58444%0.438SS*.Hα-helixtrans-65.7-47.8174.1177-111.1000111.3H183 L184 L189 S190 L191H183-Y187 VanDerWaalsContact O-CB 3.26Å; H183-Y187 WeakPolarHBondContact O-CB 3.24Å; H183-Y187 PolarHBondContact O-N 2.94Å; L184-Y187 PolarHBondContact O-N 2.93Å; Y187-L189 VanDerWaalsContact C-N 3.29Å; Y187-L189 PolarHBondContact O-N 3Å; Y187-S190 WeakPolarHBondContact O-CB 3.27Å; Y187-S190 PolarHBondContact O-N 3.45Å; Y187-S190 PolarHBondContact O-OG 3.36Å; Y187-L191 HydrophobicContact CE1-CD1 4.36Å; Y187-L191 HydrophobicContact CE1-CD2 4.39Å; Y187-L191 HydrophobicContact CE2-CD2 4.31Å; Y187-L191 PolarHBondContact O-N 3.33Å
188A94Very high93.1Very high38 Ų3883.2 Ų83.231%0.31444%0.436SS..Hα-helixtrans-59.2-40.5178.400000112.2F63 L184 D185 S190 L191F63-A188 HydrophobicContact CE1-CB 4.05Å; F63-A188 HydrophobicContact CZ-CB 4.16Å; L184-A188 VanDerWaalsContact O-CB 3.31Å; L184-A188 WeakPolarHBondContact O-CB 3.45Å; L184-A188 PolarHBondContact O-N 3.42Å; D185-A188 PolarHBondContact O-N 2.92Å; A188-S190 VanDerWaalsContact C-N 3.28Å; A188-S190 PolarHBondContact O-N 3.36Å; A188-L191 PolarHBondContact O-N 3.32Å
189L94.6Very high92.3Very high48 Ų4888.1 Ų88.125%0.25147%0.47SS..Hα-helixtrans-67-27.7175.1-178.760.8000112.9E60 F63 D64 I67 D185 Y187 L191E60-L189 HydrophobicContact CB-CD1 3.96Å; E60-L189 HydrophobicContact CG-CD1 3.95Å; F63-L189 HydrophobicContact CB-CB 4.32Å; F63-L189 HydrophobicContact CB-CD1 3.94Å; F63-L189 HydrophobicContact CB-CD2 4.36Å; F63-L189 HydrophobicContact CB-CG 4.44Å; D64-L189 VanDerWaalsContact OD1-CD2 3.31Å; D64-L189 WeakPolarHBondContact OD1-CD2 3.42Å; I67-L189 HydrophobicContact CD1-CB 4.39Å; I67-L189 HydrophobicContact CD1-CD2 3.73Å; D185-L189 VanDerWaalsContact O-CB 3.29Å; D185-L189 WeakPolarHBondContact O-CB 3.4Å; D185-L189 PolarHBondContact O-N 3.28Å; Y187-L189 VanDerWaalsContact C-N 3.29Å; Y187-L189 PolarHBondContact O-N 3Å; L189-L191 VanDerWaalsContact C-N 3.34Å
190S93.5Very high91.4Very high74 Ų7488.6 Ų88.652%0.51749%0.491SS..Hα-helixtrans-77.6-18.118077.30000114.3E186 Y187 A188E186-S190 WeakPolarHBondContact O-CB 3.46Å; E186-S190 PolarHBondContact O-N 3.45Å; E186-S190 VanDerWaalsContact O-N 3.12Å; Y187-S190 WeakPolarHBondContact O-CB 3.27Å; Y187-S190 PolarHBondContact O-N 3.45Å; Y187-S190 PolarHBondContact O-OG 3.36Å; A188-S190 VanDerWaalsContact C-N 3.28Å; A188-S190 PolarHBondContact O-N 3.36Å
191L93.2Very high90.4Very high66 Ų6687.7 Ų87.735%0.34650%0.497SS..  trans-68.3141.5-179.6-67.1173.4000111.3Y187 A188 L189 D195 L198Y187-L191 HydrophobicContact CE1-CD1 4.36Å; Y187-L191 HydrophobicContact CE1-CD2 4.39Å; Y187-L191 HydrophobicContact CE2-CD2 4.31Å; Y187-L191 PolarHBondContact O-N 3.33Å; A188-L191 PolarHBondContact O-N 3.32Å; L189-L191 VanDerWaalsContact C-N 3.34Å; L191-D195 WeakPolarHBondContact CA-OD2 3.49Å; L191-L198 HydrophobicContact CD1-CD2 4.46Å
192K90Very high89.4Confident135 Ų13592.5 Ų92.559%0.58752%0.523SS*.  trans-113.9150.1177.5-63.8-179.7-177.6176.40110.6T194 D195K192-T194 PolarHBondContact O-N 2.89Å; K192-D195 PolarHBondContact N-OD2 3.45Å; K192-D195 WeakPolarHBondContact O-CB 3.39Å; K192-D195 VanDerWaalsContact O-CG 3.28Å; K192-D195 PolarHBondContact O-N 3.35Å
193P88Confident88.7Confident102 Ų10298 Ų9866%0.66255%0.553SS**THydrogen-bonded Turntrans-57.8-16.5177.9-25.734.6000115.2L56L56-P193 HydrophobicContact CD1-CG 4.11Å
194T88.5Confident87.9Confident120 Ų120100.1 Ų100.174%0.73657%0.572SS**THydrogen-bonded Turntrans-93.60.2-179.953.10000113.9K192 E196K192-T194 PolarHBondContact O-N 2.89Å; T194-E196 PolarHBondContact O-N 3.48Å
195D87.9Confident87.1Confident58 Ų58101 Ų10131%0.3158%0.584SS.*  trans-70.3130-176.9-67.2-15.4000111L191 K192 L197 L198L191-D195 WeakPolarHBondContact CA-OD2 3.49Å; K192-D195 PolarHBondContact N-OD2 3.45Å; K192-D195 WeakPolarHBondContact O-CB 3.39Å; K192-D195 VanDerWaalsContact O-CG 3.28Å; K192-D195 PolarHBondContact O-N 3.35Å; D195-L197 VanDerWaalsContact C-N 3.25Å; D195-L197 PolarHBondContact O-N 3.12Å; D195-L198 HydrophobicContact CB-CD1 4.43Å; D195-L198 HydrophobicContact CB-CD2 4.41Å; D195-L198 HydrophobicContact CB-CG 4.08Å; D195-L198 VanDerWaalsContact O-CG 3.28Å; D195-L198 WeakPolarHBondContact O-CG 3.25Å; D195-L198 PolarHBondContact O-N 3Å
196E84.4Confident86.5Confident199 Ų199108.5 Ų108.593%0.9362%0.615SS**THydrogen-bonded Turntrans-68.4-22.5-173.2-64-178.7173.900113.8T194T194-E196 PolarHBondContact O-N 3.48Å
197L83.6Confident86Confident168 Ų168112.8 Ų112.888%0.8864%0.638SS**THydrogen-bonded Turntrans-92.38.8-174.3-68.9169.6000114D195 S199D195-L197 VanDerWaalsContact C-N 3.25Å; D195-L197 PolarHBondContact O-N 3.12Å; L197-S199 PolarHBondContact O-N 3.26Å
198L84.4Confident85.7Confident81 Ų81112.3 Ų112.342%0.42464%0.641SS.*  trans-63.9131.2178.6-65173.2000110.8L191 D195 G200L191-L198 HydrophobicContact CD1-CD2 4.46Å; D195-L198 HydrophobicContact CB-CD1 4.43Å; D195-L198 HydrophobicContact CB-CD2 4.41Å; D195-L198 HydrophobicContact CB-CG 4.08Å; D195-L198 VanDerWaalsContact O-CG 3.28Å; D195-L198 WeakPolarHBondContact O-CG 3.25Å; D195-L198 PolarHBondContact O-N 3Å; L198-G200 PolarHBondContact O-N 2.94Å
199S80.5Confident85.4Confident106 Ų106116 Ų11674%0.74166%0.662SS**  trans-67.5129178.7750000110.7L197 S201L197-S199 PolarHBondContact O-N 3.26Å; S199-S201 PolarHBondContact O-N 2.97Å
200G77.6Confident85.2Confident77 Ų77120.9 Ų120.979%0.79469%0.688SS**  trans-74.224.5179.700000115.9L198 T202L198-G200 PolarHBondContact O-N 2.94Å; G200-T202 PolarHBondContact O-N 3.33Å
201S76.9Confident85.1Confident88 Ų88120.4 Ų120.462%0.61569%0.685SS**  trans-71.2118.4178-176.40000110.3S199S199-S201 PolarHBondContact O-N 2.97Å
202T76.7Confident85.1Confident132 Ų132125.2 Ų125.281%0.8170%0.704SS**  trans-104.8-0179.354.10000113.5G200G200-T202 PolarHBondContact O-N 3.33Å
203N82Confident85.3Confident130 Ų130121.7 Ų121.770%0.69569%0.693SS**SBendtrans-72.9131.9178.8-72.2-26.3000110.1P205N203-P205 WeakPolarHBondContact O-CD 3.48Å
204V80.8Confident85.6Confident138 Ų138120.5 Ų120.584%0.83669%0.686SS**  trans-66.9112.2169.6-178.20000107.8
205P81.1Confident85.9Confident116 Ų116120.8 Ų120.875%0.75368%0.678SS**PPolyproline II helixtrans-68.3145.3-178.127.8-32.2000110.4N203N203-P205 WeakPolarHBondContact O-CD 3.48Å
206K86.3Confident86.3Confident190 Ų190122.7 Ų122.783%0.82669%0.685SS**PPolyproline II helixtrans-83.5150.1167.4-67.4-178.9-179.6177.80108.7E208K206-E208 PolarHBondContact O-N 2.62Å
207I87Confident86.8Confident153 Ų153115.2 Ų115.279%0.78565%0.649SS**PPolyproline II helixtrans-60.2129.1171.8-61.9173.5000108.1
208E89.5Confident87.3Confident139 Ų139111.2 Ų111.265%0.6563%0.626SS**PPolyproline II helixtrans-63.7129178.7-71.5-61.5150.900110.4K206 N210 S211K206-E208 PolarHBondContact O-N 2.62Å; E208-N210 PolarHBondContact O-N 2.91Å; E208-S211 VanDerWaalsContact O-CB 3.31Å; E208-S211 WeakPolarHBondContact O-CB 3.28Å; E208-S211 PolarHBondContact O-N 3.5Å; E208-S211 PolarHBondContact O-OG 3.02Å
209P87.5Confident87.9Confident115 Ų115111.8 Ų111.875%0.74763%0.632SS**THydrogen-bonded Turntrans-66.6-22.5-174.724.4-32.9000113.7
210N88.9Confident88.6Confident152 Ų152112.5 Ų112.581%0.81362%0.622SS**THydrogen-bonded Turntrans-100.432.7177.3-62.5-27.4000112.2E208E208-N210 PolarHBondContact O-N 2.91Å
211S92.9Very high89.4Confident64 Ų64108.8 Ų108.845%0.44859%0.585SS.*  trans-93.6166.3174.561.60000111.6E208E208-S211 VanDerWaalsContact O-CB 3.31Å; E208-S211 WeakPolarHBondContact O-CB 3.28Å; E208-S211 PolarHBondContact O-N 3.5Å; E208-S211 PolarHBondContact O-OG 3.02Å
212F93.7Very high90.3Very high167 Ų167106.6 Ų106.673%0.73257%0.567SS**  trans-119.8144-178.6-59.5-81.9000110.2E216F212-E216 VanDerWaalsContact CA-OE2 3.31Å; F212-E216 WeakPolarHBondContact CA-OE2 3.4Å; F212-E216 HydrophobicContact CB-CB 4.32Å
213T94.2Very high91.2Very high60 Ų60102.7 Ų102.737%0.36855%0.548SS..  trans-73.4159.9171.384.50000110.9E215 E216 W217T213-E215 VanDerWaalsContact CB-OE2 3.22Å; T213-E215 WeakPolarHBondContact CB-OE2 3.35Å; T213-E215 PolarHBondContact O-N 3.34Å; T213-E215 PolarHBondContact OG1-N 3.34Å; T213-E215 PolarHBondContact OG1-OE2 3.26Å; T213-E216 PolarHBondContact N-OE2 2.91Å; T213-E216 PolarHBondContact O-N 2.99Å; T213-E216 PolarHBondContact OG1-N 3.45Å; T213-W217 WeakPolarHBondContact O-CB 3.42Å; T213-W217 PolarHBondContact O-N 2.85Å
214P93.4Very high91.7Very high78 Ų7897.2 Ų97.251%0.50652%0.521SS..Hα-helixtrans-55.6-35.2173.6-2736.6000113.5Q218P214-Q218 WeakPolarHBondContact O-CB 3.32Å; P214-Q218 PolarHBondContact O-N 2.84Å
215E94.4Very high92.4Very high125 Ų12591.9 Ų91.958%0.58449%0.487SS*.Hα-helixtrans-66.1-48.8176.4-58.673.7-16000110.8T213 W217 Q218 T219T213-E215 VanDerWaalsContact CB-OE2 3.22Å; T213-E215 WeakPolarHBondContact CB-OE2 3.35Å; T213-E215 PolarHBondContact O-N 3.34Å; T213-E215 PolarHBondContact OG1-N 3.34Å; T213-E215 PolarHBondContact OG1-OE2 3.26Å; E215-W217 VanDerWaalsContact C-N 3.32Å; E215-W217 PolarHBondContact O-N 3.47Å; E215-Q218 PolarHBondContact O-N 3.21Å; E215-T219 WeakPolarHBondContact O-CB 3.34Å; E215-T219 PolarHBondContact O-N 3.43Å; E215-T219 PolarHBondContact O-OG1 3.46Å; E215-T219 VanDerWaalsContact O-OG1 3.05Å
216E95.6Very high93.2Very high98 Ų9892.2 Ų92.246%0.45848%0.478SS..Hα-helixtrans-60.3-42.3176.8-68.6172.9149.100111.8F212 T213 T219 F220F212-E216 VanDerWaalsContact CA-OE2 3.31Å; F212-E216 WeakPolarHBondContact CA-OE2 3.4Å; F212-E216 HydrophobicContact CB-CB 4.32Å; T213-E216 PolarHBondContact N-OE2 2.91Å; T213-E216 PolarHBondContact O-N 2.99Å; T213-E216 PolarHBondContact OG1-N 3.45Å; E216-T219 PolarHBondContact O-N 2.88Å; E216-F220 PolarHBondContact O-N 3.2Å
217W95.5Very high93.7Very high42 Ų4286.2 Ų86.216%0.15946%0.455CS..Hα-helixtrans-61.8-42.2175.6172.385.5000112.6V70 W73 K178 T213 E215 S221V70-W217 HydrophobicContact CG2-CH2 4.36Å; V70-W217 HydrophobicContact CG2-CZ2 4.02Å; W73-W217 HydrophobicContact CB-CH2 3.74Å; W73-W217 HydrophobicContact CB-CZ2 4.23Å; W73-W217 AromaticContact CD1-CH2 3.29Å; W73-W217 AromaticContact CD1-CZ3 3.38Å; W73-W217 AromaticContact CG-CH2 3.66Å; W73-W217 HydrophobicContact CG-CH2 3.66Å; W73-W217 AromaticContact CG-CZ3 4Å; W73-W217 HydrophobicContact CG-CZ3 4Å; W73-W217 AromaticContact NE1-CZ3 3.83Å; K178-W217 HydrophobicContact CG-CZ2 4.48Å; T213-W217 WeakPolarHBondContact O-CB 3.42Å; T213-W217 PolarHBondContact O-N 2.85Å; E215-W217 VanDerWaalsContact C-N 3.32Å; E215-W217 PolarHBondContact O-N 3.47Å; W217-S221 PolarHBondContact O-N 3.27Å; W217-S221 PolarHBondContact O-OG 3.28Å
218Q95.2Very high94.2Very high85 Ų8578.9 Ų78.940%0.39742%0.418SS..Hα-helixtrans-67.3-46.5176.6-179.8171.9-23.200110.5W73 P214 E215 F220 S221 T222W73-Q218 HydrophobicContact CH2-CG 4.06Å; W73-Q218 HydrophobicContact CZ2-CG 3.46Å; W73-Q218 VanDerWaalsContact CZ2-CG 3.46Å; P214-Q218 WeakPolarHBondContact O-CB 3.32Å; P214-Q218 PolarHBondContact O-N 2.84Å; E215-Q218 PolarHBondContact O-N 3.21Å; Q218-F220 VanDerWaalsContact C-N 3.27Å; Q218-F220 PolarHBondContact O-N 2.7Å; Q218-S221 WeakPolarHBondContact O-CB 3.3Å; Q218-S221 PolarHBondContact O-N 3.37Å; Q218-T222 PolarHBondContact O-N 3.03Å; Q218-T222 PolarHBondContact O-OG1 3.4Å; Q218-T222 VanDerWaalsContact O-OG1 3.12Å
219T95.9Very high94.5Very high92 Ų9275.6 Ų75.656%0.56441%0.405SS*.Hα-helixtrans-56.3-41.2176.3-63.80000111.8E215 E216 S221 T222 A223E215-T219 WeakPolarHBondContact O-CB 3.34Å; E215-T219 PolarHBondContact O-N 3.43Å; E215-T219 PolarHBondContact O-OG1 3.46Å; E215-T219 VanDerWaalsContact O-OG1 3.05Å; E216-T219 PolarHBondContact O-N 2.88Å; T219-S221 VanDerWaalsContact C-N 3.34Å; T219-S221 PolarHBondContact O-N 3.23Å; T219-T222 PolarHBondContact O-N 2.97Å; T219-A223 VanDerWaalsContact O-CB 3.28Å; T219-A223 WeakPolarHBondContact O-CB 3.39Å; T219-A223 PolarHBondContact O-N 2.87Å
220F95Very high95Very high121 Ų12176.2 Ų76.253%0.53140%0.396SS..Hα-helixtrans-58.5-45.6174.6179.3-95.2000112.2D174 E216 Q218 S224D174-F220 HydrophobicContact CB-CE1 4.14Å; D174-F220 WeakPolarHBondContact OD1-CE1 3.23Å; E216-F220 PolarHBondContact O-N 3.2Å; Q218-F220 VanDerWaalsContact C-N 3.27Å; Q218-F220 PolarHBondContact O-N 2.7Å; F220-S224 WeakPolarHBondContact O-CB 3.46Å; F220-S224 PolarHBondContact O-N 3.33Å
221S94.6Very high95.4Very high0 Ų069.5 Ų69.50%036%0.359CS..Hα-helixtrans-67.1-45.1-179.6-51.60000111.5K178 W217 Q218 T219 S224 I225K178-S221 VanDerWaalsContact CE-OG 3.31Å; K178-S221 WeakPolarHBondContact CE-OG 3.32Å; K178-S221 PolarHBondContact NZ-OG 2.9Å; W217-S221 PolarHBondContact O-N 3.27Å; W217-S221 PolarHBondContact O-OG 3.28Å; Q218-S221 WeakPolarHBondContact O-CB 3.3Å; Q218-S221 PolarHBondContact O-N 3.37Å; T219-S221 VanDerWaalsContact C-N 3.34Å; T219-S221 PolarHBondContact O-N 3.23Å; S221-S224 WeakPolarHBondContact O-CB 3.3Å; S221-S224 PolarHBondContact O-N 3.04Å; S221-I225 WeakPolarHBondContact O-CG1 3.34Å; S221-I225 PolarHBondContact O-N 3.31Å; S221-I225 VanDerWaalsContact O-N 3.09Å
222T96Very high95.7Very high41 Ų4167.1 Ų67.125%0.25234%0.342SS..Hα-helixtrans-59.4-48.8175.3-57.40000111.2W73 Q218 T219 S224 I225 E226W73-T222 WeakPolarHBondContact CH2-OG1 3.43Å; Q218-T222 PolarHBondContact O-N 3.03Å; Q218-T222 PolarHBondContact O-OG1 3.4Å; Q218-T222 VanDerWaalsContact O-OG1 3.12Å; T219-T222 PolarHBondContact O-N 2.97Å; T222-S224 VanDerWaalsContact C-N 3.26Å; T222-S224 PolarHBondContact O-N 3.41Å; T222-I225 PolarHBondContact O-N 2.89Å; T222-I225 VanDerWaalsContact O-N 3.12Å; T222-E226 HydrophobicContact CG2-CG 4.21Å; T222-E226 WeakPolarHBondContact CG2-OE1 3.48Å; T222-E226 WeakPolarHBondContact O-CG 3.31Å; T222-E226 PolarHBondContact O-N 3.42Å
223A95.5Very high95.9Very high50 Ų5063.9 Ų63.941%0.41333%0.329SS..Hα-helixtrans-62.1-34.9179.600000112.5T219 N227T219-A223 VanDerWaalsContact O-CB 3.28Å; T219-A223 WeakPolarHBondContact O-CB 3.39Å; T219-A223 PolarHBondContact O-N 2.87Å; A223-N227 VanDerWaalsContact O-CB 3.24Å; A223-N227 WeakPolarHBondContact O-CB 3.49Å; A223-N227 PolarHBondContact O-N 3.24Å
224S93.3Very high96Very high16 Ų1663.6 Ų63.611%0.11233%0.325CS..Hα-helixtrans-63-46.9174-169.60000111.3M171 F220 S221 T222 N227 G228M171-S224 WeakPolarHBondContact CE-O 3.45Å; F220-S224 WeakPolarHBondContact O-CB 3.46Å; F220-S224 PolarHBondContact O-N 3.33Å; S221-S224 WeakPolarHBondContact O-CB 3.3Å; S221-S224 PolarHBondContact O-N 3.04Å; T222-S224 VanDerWaalsContact C-N 3.26Å; T222-S224 PolarHBondContact O-N 3.41Å; S224-N227 PolarHBondContact O-N 2.98Å; S224-G228 PolarHBondContact O-N 2.92Å
225I95.9Very high96.3Very high26 Ų2659.9 Ų59.913%0.13330%0.301CS..Hα-helixtrans-64.2-49.1177.9-68.4165.2000111W73 E76 V77 K80 S221 T222 N227 G228 D229W73-I225 HydrophobicContact CE3-CD1 4.07Å; W73-I225 HydrophobicContact CZ3-CD1 3.91Å; E76-I225 HydrophobicContact CB-CD1 3.83Å; V77-I225 HydrophobicContact CG2-CD1 4.18Å; V77-I225 HydrophobicContact CG2-CG1 4.19Å; K80-I225 HydrophobicContact CG-CG2 4.26Å; S221-I225 WeakPolarHBondContact O-CG1 3.34Å; S221-I225 PolarHBondContact O-N 3.31Å; S221-I225 VanDerWaalsContact O-N 3.09Å; T222-I225 PolarHBondContact O-N 2.89Å; T222-I225 VanDerWaalsContact O-N 3.12Å; I225-N227 VanDerWaalsContact C-N 3.31Å; I225-N227 PolarHBondContact O-N 2.88Å; I225-G228 CarbonylContact O-C 3.55Å; I225-G228 VanDerWaalsContact O-CA 3.26Å; I225-G228 WeakPolarHBondContact O-CA 3.29Å; I225-G228 PolarHBondContact O-N 2.91Å; I225-D229 PolarHBondContact O-N 2.92Å
226E96.8Very high96.4Very high122 Ų12257.9 Ų57.957%0.5729%0.292SS*.Hα-helixtrans-59.4-41.1178.2-73176.2173.600112T222 G228 D229 K230T222-E226 HydrophobicContact CG2-CG 4.21Å; T222-E226 WeakPolarHBondContact CG2-OE1 3.48Å; T222-E226 WeakPolarHBondContact O-CG 3.31Å; T222-E226 PolarHBondContact O-N 3.42Å; E226-G228 VanDerWaalsContact C-N 3.26Å; E226-G228 PolarHBondContact O-N 3.15Å; E226-D229 PolarHBondContact O-N 3.39Å; E226-K230 WeakPolarHBondContact O-CB 3.42Å; E226-K230 PolarHBondContact O-N 3.38Å
227N96.3Very high96.5Very high64 Ų6458 Ų5834%0.34229%0.292SS..Hα-helixtrans-64-35.5173.9177.269.9000111.6A223 S224 I225 Q231A223-N227 VanDerWaalsContact O-CB 3.24Å; A223-N227 WeakPolarHBondContact O-CB 3.49Å; A223-N227 PolarHBondContact O-N 3.24Å; S224-N227 PolarHBondContact O-N 2.98Å; I225-N227 VanDerWaalsContact C-N 3.31Å; I225-N227 PolarHBondContact O-N 2.88Å; N227-Q231 WeakPolarHBondContact O-CG 3.47Å; N227-Q231 PolarHBondContact O-N 3.41Å; N227-Q231 VanDerWaalsContact O-N 3.11Å
228G97.2Very high96.7Very high0 Ų056.8 Ų56.80%029%0.288CS..Hα-helixtrans-58.8-53.6170.400000113.8S224 I225 E226 K230 Q231 L232S224-G228 PolarHBondContact O-N 2.92Å; I225-G228 CarbonylContact O-C 3.55Å; I225-G228 VanDerWaalsContact O-CA 3.26Å; I225-G228 WeakPolarHBondContact O-CA 3.29Å; I225-G228 PolarHBondContact O-N 2.91Å; E226-G228 VanDerWaalsContact C-N 3.26Å; E226-G228 PolarHBondContact O-N 3.15Å; G228-K230 VanDerWaalsContact C-N 3.26Å; G228-K230 PolarHBondContact O-N 2.89Å; G228-Q231 PolarHBondContact O-N 2.77Å; G228-L232 PolarHBondContact O-N 2.9Å
229D96.9Very high96.8Very high69 Ų6955 Ų5537%0.36928%0.278SS..Hα-helixtrans-59.1-39.6178.1-76.4-35.3000111.8K80 I225 E226 Q231 L232 Q233K80-D229 VanDerWaalsContact CD-OD1 3.3Å; K80-D229 WeakPolarHBondContact CD-OD1 3.38Å; K80-D229 WeakPolarHBondContact CE-OD1 3.36Å; K80-D229 IonicContact NZ-OD1 3.6Å; K80-D229 PolarHBondContact NZ-OD1 2.83Å; I225-D229 PolarHBondContact O-N 2.92Å; E226-D229 PolarHBondContact O-N 3.39Å; D229-Q231 PolarHBondContact O-N 2.82Å; D229-L232 WeakPolarHBondContact O-CB 3.47Å; D229-L232 PolarHBondContact O-N 3.01Å; D229-Q233 WeakPolarHBondContact O-CB 3.45Å; D229-Q233 PolarHBondContact O-N 3.18Å
230K98Very high96.8Very high128 Ų12854.7 Ų54.756%0.55728%0.28SS*.Hα-helixtrans-59.9-45.2173.6-176.8177.9-179.9177.10112.1E226 G228 N234E226-K230 WeakPolarHBondContact O-CB 3.42Å; E226-K230 PolarHBondContact O-N 3.38Å; G228-K230 VanDerWaalsContact C-N 3.26Å; G228-K230 PolarHBondContact O-N 2.89Å; K230-N234 WeakPolarHBondContact O-CB 3.48Å; K230-N234 PolarHBondContact O-N 3.3Å; K230-N234 PolarHBondContact O-OD1 3.16Å
231Q98.1Very high96.9Very high11 Ų1153.2 Ų53.25%0.05128%0.277CS..Hα-helixtrans-68-38.7178.8-66.5-28-61.200112.2I84 Q160 A167 N227 G228 D229 S235I84-Q231 HydrophobicContact CD1-CB 3.68Å; I84-Q231 HydrophobicContact CD1-CG 4.29Å; Q160-Q231 PolarHBondContact NE2-O 3.17Å; A167-Q231 HydrophobicContact CB-CG 4.02Å; N227-Q231 WeakPolarHBondContact O-CG 3.47Å; N227-Q231 PolarHBondContact O-N 3.41Å; N227-Q231 VanDerWaalsContact O-N 3.11Å; G228-Q231 PolarHBondContact O-N 2.77Å; D229-Q231 PolarHBondContact O-N 2.82Å; Q231-S235 VanDerWaalsContact O-CB 3.3Å; Q231-S235 WeakPolarHBondContact O-CB 3.48Å; Q231-S235 PolarHBondContact O-N 3.41Å
232L97.3Very high97.1Very high15 Ų1553.2 Ų53.28%0.07928%0.277CS..Hα-helixtrans-58.1-51.4173.4-79.7172.4000111.6K80 D83 I84 E87 G228 D229 N234 S235 H236K80-L232 HydrophobicContact CD-CD1 3.66Å; D83-L232 HydrophobicContact CB-CD1 3.71Å; D83-L232 HydrophobicContact CB-CD2 4.36Å; I84-L232 HydrophobicContact CB-CD2 4.15Å; I84-L232 HydrophobicContact CB-CG 4.21Å; I84-L232 HydrophobicContact CG1-CD2 4.45Å; I84-L232 HydrophobicContact CG1-CG 4.47Å; E87-L232 HydrophobicContact CB-CD2 3.48Å; E87-L232 VanDerWaalsContact CB-CD2 3.48Å; E87-L232 HydrophobicContact CG-CD2 3.77Å; G228-L232 PolarHBondContact O-N 2.9Å; D229-L232 WeakPolarHBondContact O-CB 3.47Å; D229-L232 PolarHBondContact O-N 3.01Å; L232-N234 PolarHBondContact O-N 3.02Å; L232-S235 WeakPolarHBondContact O-CB 3.32Å; L232-S235 PolarHBondContact O-N 3.23Å; L232-S235 VanDerWaalsContact O-N 3.16Å; L232-H236 PolarHBondContact O-CD2 2.8Å; L232-H236 PolarHBondContact O-N 3.29Å
233Q97.9Very high97.1Very high99 Ų9953 Ų5346%0.46327%0.274SS..Hα-helixtrans-60.5-47.1-179.5-176.259.427.900111.6D229 S235 H236 E237D229-Q233 WeakPolarHBondContact O-CB 3.45Å; D229-Q233 PolarHBondContact O-N 3.18Å; Q233-S235 VanDerWaalsContact C-N 3.28Å; Q233-S235 PolarHBondContact O-N 3.21Å; Q233-H236 PolarHBondContact O-N 3.27Å; Q233-E237 WeakPolarHBondContact CG-OE1 3.21Å; Q233-E237 PolarHBondContact NE2-OE1 3.09Å; Q233-E237 WeakPolarHBondContact O-CG 3.45Å; Q233-E237 PolarHBondContact O-N 3.02Å
234N98.3Very high97.1Very high54 Ų5452.4 Ų52.429%0.28927%0.272SS..Hα-helixtrans-59.8-39.6176.5-70.3-3.7000112K230 L232 L238K230-N234 WeakPolarHBondContact O-CB 3.48Å; K230-N234 PolarHBondContact O-N 3.3Å; K230-N234 PolarHBondContact O-OD1 3.16Å; L232-N234 PolarHBondContact O-N 3.02Å; N234-L238 VanDerWaalsContact O-CB 3.24Å; N234-L238 WeakPolarHBondContact O-CB 3.44Å; N234-L238 PolarHBondContact O-N 3.12Å
235S98.3Very high97.3Very high0 Ų053.1 Ų53.10%028%0.275CS..Hα-helixtrans-65.5-46.1178-167.90000111.6E87 L91 Q231 L232 Q233 E237 L238 R239E87-S235 WeakPolarHBondContact CG-OG 3.49Å; E87-S235 VanDerWaalsContact OE1-CB 3.25Å; E87-S235 WeakPolarHBondContact OE1-CB 3.21Å; E87-S235 PolarHBondContact OE1-OG 3.27Å; L91-S235 WeakPolarHBondContact CD2-OG 3.35Å; Q231-S235 VanDerWaalsContact O-CB 3.3Å; Q231-S235 WeakPolarHBondContact O-CB 3.48Å; Q231-S235 PolarHBondContact O-N 3.41Å; L232-S235 WeakPolarHBondContact O-CB 3.32Å; L232-S235 PolarHBondContact O-N 3.23Å; L232-S235 VanDerWaalsContact O-N 3.16Å; Q233-S235 VanDerWaalsContact C-N 3.28Å; Q233-S235 PolarHBondContact O-N 3.21Å; S235-E237 PolarHBondContact O-N 3.44Å; S235-L238 PolarHBondContact O-N 3.46Å; S235-R239 WeakPolarHBondContact O-CG 3.35Å; S235-R239 PolarHBondContact O-N 2.96Å
236H97.6Very high97.3Very high83 Ų8352 Ų5238%0.38427%0.269SS..Hα-helixtrans-59-47.5175.2-73.1-47.8000112.6E87 L232 Q233 L238 R239 S240E87-H236 IonicContact OE1-ND1 2.71Å; E87-H236 IonicContact OE2-CE1 3.91Å; E87-H236 PolarHBondContact OE2-CE1 2.95Å; E87-H236 IonicContact OE2-ND1 2.56Å; E87-H236 PolarHBondContact OE2-ND1 2.88Å; L232-H236 PolarHBondContact O-CD2 2.8Å; L232-H236 PolarHBondContact O-N 3.29Å; Q233-H236 PolarHBondContact O-N 3.27Å; H236-L238 VanDerWaalsContact C-N 3.33Å; H236-L238 PolarHBondContact O-N 3.17Å; H236-R239 PolarHBondContact CE1-NH2 3.22Å; H236-R239 PolarHBondContact ND1-NH2 3.12Å; H236-R239 PolarHBondContact O-N 3.39Å; H236-S240 PolarHBondContact O-N 3.01Å
237E98Very high97.3Very high99 Ų9952.5 Ų52.546%0.46327%0.272SS..Hα-helixtrans-61.3-43.7177.3-73.2175.5-167.500111.3Q233 S235 R239 S240 I241Q233-E237 WeakPolarHBondContact CG-OE1 3.21Å; Q233-E237 PolarHBondContact NE2-OE1 3.09Å; Q233-E237 WeakPolarHBondContact O-CG 3.45Å; Q233-E237 PolarHBondContact O-N 3.02Å; S235-E237 PolarHBondContact O-N 3.44Å; E237-R239 PolarHBondContact O-N 3.47Å; E237-S240 WeakPolarHBondContact O-CB 3.46Å; E237-S240 PolarHBondContact O-N 2.87Å; E237-I241 WeakPolarHBondContact O-CG1 3.45Å; E237-I241 PolarHBondContact O-N 3.25Å
238L98.1Very high97.3Very high17 Ų1754.4 Ų54.49%0.08928%0.278CS..Hα-helixtrans-63.2-41178.7-174.856.3000111.8L91 Q156 A157 Q160 N234 S235 H236 S240 I241 V242L91-L238 HydrophobicContact CD1-CD2 4.34Å; Q156-L238 HydrophobicContact CB-CD1 4.26Å; A157-L238 HydrophobicContact CB-CD2 4.15Å; Q160-L238 HydrophobicContact CB-CD2 3.75Å; Q160-L238 HydrophobicContact CG-CD2 4.19Å; N234-L238 VanDerWaalsContact O-CB 3.24Å; N234-L238 WeakPolarHBondContact O-CB 3.44Å; N234-L238 PolarHBondContact O-N 3.12Å; S235-L238 PolarHBondContact O-N 3.46Å; H236-L238 VanDerWaalsContact C-N 3.33Å; H236-L238 PolarHBondContact O-N 3.17Å; L238-S240 VanDerWaalsContact C-N 3.33Å; L238-S240 PolarHBondContact O-N 2.91Å; L238-I241 WeakPolarHBondContact O-CB 3.18Å; L238-I241 PolarHBondContact O-N 2.9Å; L238-V242 HydrophobicContact CD1-CG2 4.31Å; L238-V242 HydrophobicContact CG-CG2 4.36Å; L238-V242 WeakPolarHBondContact O-CB 3.38Å; L238-V242 WeakPolarHBondContact O-CG2 3.4Å; L238-V242 PolarHBondContact O-N 3.36Å
239R97.8Very high97.2Very high47 Ų4754.7 Ų54.718%0.17728%0.28CS..Hα-helixtrans-59.6-42.8175.5-72.6-166.1-66.5112.6-15.5112.4E87 L91 Y94 S235 H236 E237 I241 V242 D243E87-R239 IonicContact OE1-CZ 3.78Å; E87-R239 IonicContact OE1-NE 2.71Å; E87-R239 PolarHBondContact OE1-NE 3.21Å; E87-R239 IonicContact OE1-NH2 3.87Å; E87-R239 IonicContact OE2-CZ 3.3Å; E87-R239 IonicContact OE2-NE 2.72Å; E87-R239 PolarHBondContact OE2-NE 3.31Å; E87-R239 IonicContact OE2-NH2 2.93Å; E87-R239 PolarHBondContact OE2-NH2 3.34Å; L91-R239 HydrophobicContact CD1-CG 3.89Å; Y94-R239 HydrophobicContact CD1-CB 3.94Å; Y94-R239 HydrophobicContact CD1-CG 3.88Å; Y94-R239 HydrophobicContact CD2-CG 4.18Å; Y94-R239 HydrophobicContact CE1-CB 3.78Å; Y94-R239 HydrophobicContact CE1-CG 4.12Å; Y94-R239 WeakPolarHBondContact CE1-O 3.38Å; Y94-R239 HydrophobicContact CE2-CG 4.4Å; Y94-R239 HydrophobicContact CG-CB 4.46Å; Y94-R239 HydrophobicContact CG-CG 3.92Å; S235-R239 WeakPolarHBondContact O-CG 3.35Å; S235-R239 PolarHBondContact O-N 2.96Å; H236-R239 PolarHBondContact CE1-NH2 3.22Å; H236-R239 PolarHBondContact ND1-NH2 3.12Å; H236-R239 PolarHBondContact O-N 3.39Å; E237-R239 PolarHBondContact O-N 3.47Å; R239-I241 VanDerWaalsContact C-N 3.34Å; R239-I241 PolarHBondContact O-N 2.89Å; R239-V242 WeakPolarHBondContact O-CB 3.44Å; R239-V242 PolarHBondContact O-N 3.48Å; R239-D243 PolarHBondContact O-N 3.49Å
240S96.6Very high97.1Very high87 Ų8752.1 Ų52.161%0.60827%0.268SS*.Hα-helixtrans-60.2-44.3175.5-1750000111.9H236 E237 L238 V242 D243 G244H236-S240 PolarHBondContact O-N 3.01Å; E237-S240 WeakPolarHBondContact O-CB 3.46Å; E237-S240 PolarHBondContact O-N 2.87Å; L238-S240 VanDerWaalsContact C-N 3.33Å; L238-S240 PolarHBondContact O-N 2.91Å; S240-V242 VanDerWaalsContact C-N 3.34Å; S240-V242 PolarHBondContact O-N 3.44Å; S240-D243 PolarHBondContact O-N 3.37Å; S240-G244 PolarHBondContact O-N 3.32Å; S240-G244 VanDerWaalsContact O-N 3.14Å
241I97.5Very high97Very high89 Ų8948.2 Ų48.246%0.45626%0.257SS..Hα-helixtrans-61.8-43.3175.4-67.5166.2000110.8E237 L238 R239 G244 I245E237-I241 WeakPolarHBondContact O-CG1 3.45Å; E237-I241 PolarHBondContact O-N 3.25Å; L238-I241 WeakPolarHBondContact O-CB 3.18Å; L238-I241 PolarHBondContact O-N 2.9Å; R239-I241 VanDerWaalsContact C-N 3.34Å; R239-I241 PolarHBondContact O-N 2.89Å; I241-G244 PolarHBondContact O-N 2.96Å; I241-I245 HydrophobicContact CG2-CD1 3.65Å; I241-I245 HydrophobicContact CG2-CG1 4.3Å; I241-I245 WeakPolarHBondContact O-CB 3.42Å; I241-I245 VanDerWaalsContact O-CG1 3.32Å; I241-I245 WeakPolarHBondContact O-CG1 3.2Å; I241-I245 PolarHBondContact O-N 2.79Å
242V97.7Very high97Very high0 Ų050.2 Ų50.20%027%0.268CS..Hα-helixtrans-61.2-48.7179.9167.30000111.7Y94 L98 T153 L238 R239 S240 G244 I245 I246Y94-V242 HydrophobicContact CD1-CB 3.9Å; Y94-V242 HydrophobicContact CD1-CG1 3.57Å; Y94-V242 HydrophobicContact CE1-CG1 4.33Å; Y94-V242 HydrophobicContact CG-CG1 4.47Å; L98-V242 HydrophobicContact CD1-CG1 3.95Å; L98-V242 HydrophobicContact CD1-CG2 3.7Å; L98-V242 HydrophobicContact CD2-CG1 3.7Å; L98-V242 HydrophobicContact CD2-CG2 4.33Å; L98-V242 HydrophobicContact CG-CG1 3.57Å; L98-V242 HydrophobicContact CG-CG2 4.23Å; T153-V242 HydrophobicContact CG2-CG2 3.59Å; L238-V242 HydrophobicContact CD1-CG2 4.31Å; L238-V242 HydrophobicContact CG-CG2 4.36Å; L238-V242 WeakPolarHBondContact O-CB 3.38Å; L238-V242 WeakPolarHBondContact O-CG2 3.4Å; L238-V242 PolarHBondContact O-N 3.36Å; R239-V242 WeakPolarHBondContact O-CB 3.44Å; R239-V242 PolarHBondContact O-N 3.48Å; S240-V242 VanDerWaalsContact C-N 3.34Å; S240-V242 PolarHBondContact O-N 3.44Å; V242-G244 VanDerWaalsContact C-N 3.31Å; V242-G244 PolarHBondContact O-N 2.92Å; V242-I245 PolarHBondContact O-N 2.89Å; V242-I246 HydrophobicContact CG1-CD1 3.68Å; V242-I246 HydrophobicContact CG1-CG1 4.35Å; V242-I246 WeakPolarHBondContact O-CG1 3.49Å; V242-I246 PolarHBondContact O-N 3.29Å
243D95.7Very high96.9Very high37 Ų3749.5 Ų49.520%0.19826%0.264CS..Hα-helixtrans-59.6-44.1177.5-85-37.4000111.3Y94 R97 R239 S240 I245 I246 Q247Y94-D243 VanDerWaalsContact CE1-CG 3.47Å; Y94-D243 WeakPolarHBondContact CE1-OD2 3.13Å; Y94-D243 VanDerWaalsContact CZ-OD2 3.32Å; Y94-D243 PolarHBondContact OH-OD2 3.44Å; R97-D243 IonicContact CZ-OD1 2.61Å; R97-D243 IonicContact NH1-OD1 2.6Å; R97-D243 PolarHBondContact NH1-OD1 3.06Å; R239-D243 PolarHBondContact O-N 3.49Å; S240-D243 PolarHBondContact O-N 3.37Å; D243-I245 PolarHBondContact O-N 3.13Å; D243-I246 PolarHBondContact O-N 3.07Å; D243-Q247 WeakPolarHBondContact O-CB 3.39Å; D243-Q247 VanDerWaalsContact O-CG 3.31Å; D243-Q247 WeakPolarHBondContact O-CG 3.3Å; D243-Q247 PolarHBondContact O-N 3.29Å
244G96.9Very high96.8Very high37 Ų3750.5 Ų50.538%0.38127%0.267SS..Hα-helixtrans-60.1-44.2176.400000112.8S240 I241 V242 Q248S240-G244 PolarHBondContact O-N 3.32Å; S240-G244 VanDerWaalsContact O-N 3.14Å; I241-G244 PolarHBondContact O-N 2.96Å; V242-G244 VanDerWaalsContact C-N 3.31Å; V242-G244 PolarHBondContact O-N 2.92Å; G244-Q248 VanDerWaalsContact O-CB 3.29Å; G244-Q248 WeakPolarHBondContact O-CB 3.36Å; G244-Q248 PolarHBondContact O-N 3.01Å
245I97.4Very high96.7Very high32 Ų3255.1 Ų55.116%0.16428%0.281CS..Hα-helixtrans-64.9-45.9178-73173.8000111.2I149 L150 T153 I241 V242 D243 Q247 Q248 V249I149-I245 HydrophobicContact CG2-CD1 4Å; I149-I245 HydrophobicContact CG2-CG1 4.22Å; I149-I245 HydrophobicContact CG2-CG2 3.74Å; L150-I245 HydrophobicContact CD2-CG2 3.91Å; T153-I245 HydrophobicContact CG2-CD1 4.03Å; T153-I245 WeakPolarHBondContact OG1-CD1 3.43Å; I241-I245 HydrophobicContact CG2-CD1 3.65Å; I241-I245 HydrophobicContact CG2-CG1 4.3Å; I241-I245 WeakPolarHBondContact O-CB 3.42Å; I241-I245 VanDerWaalsContact O-CG1 3.32Å; I241-I245 WeakPolarHBondContact O-CG1 3.2Å; I241-I245 PolarHBondContact O-N 2.79Å; V242-I245 PolarHBondContact O-N 2.89Å; D243-I245 PolarHBondContact O-N 3.13Å; I245-Q247 VanDerWaalsContact C-N 3.33Å; I245-Q247 PolarHBondContact O-N 3.13Å; I245-Q248 PolarHBondContact O-N 3.46Å; I245-V249 HydrophobicContact CG2-CG2 4.23Å; I245-V249 WeakPolarHBondContact O-CB 3.41Å; I245-V249 WeakPolarHBondContact O-CG2 3.46Å; I245-V249 PolarHBondContact O-N 3.45Å
246I96.1Very high96.7Very high3 Ų355.7 Ų55.72%0.01528%0.283CS..Hα-helixtrans-60.3-45.9179.8-70.7171.1000110.2R97 L98 T101 V242 D243 A250R97-I246 HydrophobicContact CG-CD1 3.99Å; L98-I246 HydrophobicContact CD2-CD1 4.19Å; L98-I246 HydrophobicContact CD2-CG1 4.11Å; L98-I246 HydrophobicContact CG-CD1 4.47Å; T101-I246 HydrophobicContact CG2-CG2 4.45Å; V242-I246 HydrophobicContact CG1-CD1 3.68Å; V242-I246 HydrophobicContact CG1-CG1 4.35Å; V242-I246 WeakPolarHBondContact O-CG1 3.49Å; V242-I246 PolarHBondContact O-N 3.29Å; D243-I246 PolarHBondContact O-N 3.07Å; I246-A250 VanDerWaalsContact O-CB 3.25Å; I246-A250 WeakPolarHBondContact O-CB 3.49Å; I246-A250 PolarHBondContact O-N 3.16Å
247Q95.6Very high96.6Very high132 Ų13252.4 Ų52.462%0.61727%0.269SS*.Hα-helixtrans-63.9-45178.5-71.4177.26.500112.1D243 I245 A250 S251D243-Q247 WeakPolarHBondContact O-CB 3.39Å; D243-Q247 VanDerWaalsContact O-CG 3.31Å; D243-Q247 WeakPolarHBondContact O-CG 3.3Å; D243-Q247 PolarHBondContact O-N 3.29Å; I245-Q247 VanDerWaalsContact C-N 3.33Å; I245-Q247 PolarHBondContact O-N 3.13Å; Q247-A250 PolarHBondContact O-N 3.39Å; Q247-S251 WeakPolarHBondContact O-CB 3.5Å; Q247-S251 PolarHBondContact O-N 3.33Å
248Q96.2Very high96.6Very high104 Ų10451.5 Ų51.549%0.48626%0.264SS..Hα-helixtrans-63.6-49.7-179.7-176.359.836.500111.3G244 I245 A250 S251 D252G244-Q248 VanDerWaalsContact O-CB 3.29Å; G244-Q248 WeakPolarHBondContact O-CB 3.36Å; G244-Q248 PolarHBondContact O-N 3.01Å; I245-Q248 PolarHBondContact O-N 3.46Å; Q248-A250 VanDerWaalsContact C-N 3.31Å; Q248-A250 PolarHBondContact O-N 2.62Å; Q248-S251 PolarHBondContact O-N 3.14Å; Q248-D252 PolarHBondContact NE2-OD1 3.12Å; Q248-D252 PolarHBondContact NE2-OD2 3.03Å; Q248-D252 WeakPolarHBondContact O-CB 3.18Å; Q248-D252 VanDerWaalsContact O-CG 3.31Å; Q248-D252 PolarHBondContact O-N 3.14Å
249V96.5Very high96.5Very high5 Ų551.6 Ų51.63%0.0327%0.267CS..Hα-helixtrans-58.6-45.3177.3165.10000110.9A146 L150 I245 S251 D252 I253A146-V249 HydrophobicContact CB-CB 4.33Å; A146-V249 HydrophobicContact CB-CG1 3.65Å; A146-V249 HydrophobicContact CB-CG2 3.89Å; L150-V249 HydrophobicContact CD1-CG1 4.03Å; L150-V249 HydrophobicContact CD2-CG2 4.5Å; L150-V249 HydrophobicContact CG-CG2 4.26Å; I245-V249 HydrophobicContact CG2-CG2 4.23Å; I245-V249 WeakPolarHBondContact O-CB 3.41Å; I245-V249 WeakPolarHBondContact O-CG2 3.46Å; I245-V249 PolarHBondContact O-N 3.45Å; V249-S251 VanDerWaalsContact C-N 3.32Å; V249-S251 PolarHBondContact O-N 3.42Å; V249-D252 PolarHBondContact O-N 3.5Å; V249-I253 HydrophobicContact CG1-CD1 3.67Å; V249-I253 HydrophobicContact CG1-CG1 4.32Å; V249-I253 WeakPolarHBondContact O-CB 3.42Å; V249-I253 WeakPolarHBondContact O-CG1 3.24Å; V249-I253 PolarHBondContact O-N 3.47Å
250A94.7Very high96.6Very high15 Ų1549.3 Ų49.312%0.12426%0.259CS..Hα-helixtrans-62-42.8-179.600000111.9I246 Q247 Q248 K254 F399I246-A250 VanDerWaalsContact O-CB 3.25Å; I246-A250 WeakPolarHBondContact O-CB 3.49Å; I246-A250 PolarHBondContact O-N 3.16Å; Q247-A250 PolarHBondContact O-N 3.39Å; Q248-A250 VanDerWaalsContact C-N 3.31Å; Q248-A250 PolarHBondContact O-N 2.62Å; A250-K254 VanDerWaalsContact O-CB 3.24Å; A250-K254 WeakPolarHBondContact O-CB 3.48Å; A250-K254 PolarHBondContact O-N 3.35Å; A250-K254 VanDerWaalsContact O-N 3.12Å; A250-F399 HydrophobicContact CB-CE1 4.28Å
251S95.5Very high96.6Very high47 Ų4747 Ų4733%0.32924%0.24SC..Hα-helixtrans-63.4-46.4176167.50000112.2Q247 Q248 V249 K254 R255Q247-S251 WeakPolarHBondContact O-CB 3.5Å; Q247-S251 PolarHBondContact O-N 3.33Å; Q248-S251 PolarHBondContact O-N 3.14Å; V249-S251 VanDerWaalsContact C-N 3.32Å; V249-S251 PolarHBondContact O-N 3.42Å; S251-K254 PolarHBondContact O-N 2.94Å; S251-R255 VanDerWaalsContact O-CB 3.28Å; S251-R255 WeakPolarHBondContact O-CB 3.22Å; S251-R255 PolarHBondContact O-N 2.97Å
252D96.8Very high96.6Very high52 Ų5249.7 Ų49.728%0.27824%0.244SC..Hα-helixtrans-67.6-45.7-175.6-71.7-19000111.9V142 Q248 V249 R255 Q256V142-D252 HydrophobicContact CG1-CB 4.26Å; Q248-D252 PolarHBondContact NE2-OD1 3.12Å; Q248-D252 PolarHBondContact NE2-OD2 3.03Å; Q248-D252 WeakPolarHBondContact O-CB 3.18Å; Q248-D252 VanDerWaalsContact O-CG 3.31Å; Q248-D252 PolarHBondContact O-N 3.14Å; V249-D252 PolarHBondContact O-N 3.5Å; D252-R255 PolarHBondContact O-N 3.47Å; D252-Q256 WeakPolarHBondContact O-CB 3.42Å; D252-Q256 PolarHBondContact O-N 2.84Å
253I96.4Very high96.7Very high0 Ų050.3 Ų50.30%025%0.249CC..Hα-helixtrans-61-48.3176.1-69.4177.9000110T105 I143 A146 V249 R255 Q256 I257 F399T105-I253 HydrophobicContact CG2-CD1 3.67Å; I143-I253 HydrophobicContact CG1-CD1 4.39Å; I143-I253 HydrophobicContact CG1-CG1 4.13Å; I143-I253 HydrophobicContact CG1-CG2 4.44Å; A146-I253 HydrophobicContact CB-CD1 4.03Å; A146-I253 HydrophobicContact CB-CG1 4.36Å; V249-I253 HydrophobicContact CG1-CD1 3.67Å; V249-I253 HydrophobicContact CG1-CG1 4.32Å; V249-I253 WeakPolarHBondContact O-CB 3.42Å; V249-I253 WeakPolarHBondContact O-CG1 3.24Å; V249-I253 PolarHBondContact O-N 3.47Å; I253-R255 PolarHBondContact O-N 3.21Å; I253-Q256 PolarHBondContact O-N 2.9Å; I253-I257 HydrophobicContact CG2-CD1 3.56Å; I253-I257 HydrophobicContact CG2-CG1 4.33Å; I253-I257 VanDerWaalsContact O-CG1 3.29Å; I253-I257 WeakPolarHBondContact O-CG1 3.33Å; I253-I257 PolarHBondContact O-N 3.41Å; I253-F399 HydrophobicContact CB-CD1 4.38Å; I253-F399 HydrophobicContact CB-CE1 3.83Å; I253-F399 HydrophobicContact CB-CZ 4.09Å; I253-F399 HydrophobicContact CD1-CE1 4.45Å; I253-F399 HydrophobicContact CD1-CE2 4.24Å; I253-F399 HydrophobicContact CD1-CZ 3.82Å; I253-F399 HydrophobicContact CG2-CD1 3.81Å; I253-F399 HydrophobicContact CG2-CD2 4.35Å; I253-F399 HydrophobicContact CG2-CE1 3.7Å; I253-F399 HydrophobicContact CG2-CE2 4.26Å; I253-F399 HydrophobicContact CG2-CG 4.13Å; I253-F399 HydrophobicContact CG2-CZ 3.94Å
254K95.5Very high96.8Very high121 Ų12148.5 Ų48.553%0.52624%0.239SC..Hα-helixtrans-59.4-48.3179.2-175.4-179.4178.5-1780111.9A250 S251 Q256 I257 E258A250-K254 VanDerWaalsContact O-CB 3.24Å; A250-K254 WeakPolarHBondContact O-CB 3.48Å; A250-K254 PolarHBondContact O-N 3.35Å; A250-K254 VanDerWaalsContact O-N 3.12Å; S251-K254 PolarHBondContact O-N 2.94Å; K254-Q256 VanDerWaalsContact C-N 3.27Å; K254-Q256 PolarHBondContact O-N 3.46Å; K254-I257 PolarHBondContact O-N 3.49Å; K254-E258 WeakPolarHBondContact CE-OE1 3.46Å; K254-E258 WeakPolarHBondContact O-CG 3.32Å; K254-E258 PolarHBondContact O-N 3.26Å
255R96.6Very high96.8Very high150 Ų15050.7 Ų50.757%0.56624%0.242SC*.Hα-helixtrans-60.1-40.3179.5-175.6-175.7-61.9160.54.6111.6S251 D252 I253 A259S251-R255 VanDerWaalsContact O-CB 3.28Å; S251-R255 WeakPolarHBondContact O-CB 3.22Å; S251-R255 PolarHBondContact O-N 2.97Å; D252-R255 PolarHBondContact O-N 3.47Å; I253-R255 PolarHBondContact O-N 3.21Å; R255-A259 PolarHBondContact O-N 2.99Å
256Q97.7Very high96.9Very high12 Ų1254.3 Ų54.36%0.05626%0.257CS..Hα-helixtrans-72.1-42.1-179.4-17253.744.900111.7E135 K138 E139 V142 D252 I253 K254 E258 A259 T260E135-Q256 PolarHBondContact O-NE2 3.2Å; E135-Q256 PolarHBondContact OE2-NE2 3.05Å; K138-Q256 VanDerWaalsContact CE-OE1 3.24Å; E139-Q256 VanDerWaalsContact CA-CG 3.47Å; E139-Q256 HydrophobicContact CB-CG 3.82Å; E139-Q256 HydrophobicContact CG-CG 4.14Å; V142-Q256 HydrophobicContact CB-CB 4.45Å; V142-Q256 HydrophobicContact CB-CG 4.17Å; V142-Q256 HydrophobicContact CG1-CB 4.21Å; V142-Q256 HydrophobicContact CG1-CG 4.48Å; V142-Q256 HydrophobicContact CG2-CB 4.47Å; V142-Q256 HydrophobicContact CG2-CG 4.06Å; D252-Q256 WeakPolarHBondContact O-CB 3.42Å; D252-Q256 PolarHBondContact O-N 2.84Å; I253-Q256 PolarHBondContact O-N 2.9Å; K254-Q256 VanDerWaalsContact C-N 3.27Å; K254-Q256 PolarHBondContact O-N 3.46Å; Q256-E258 VanDerWaalsContact C-N 3.28Å; Q256-E258 PolarHBondContact O-N 3.47Å; Q256-A259 WeakPolarHBondContact O-CB 3.47Å; Q256-A259 PolarHBondContact O-N 3.05Å; Q256-A259 VanDerWaalsContact O-N 3.08Å; Q256-T260 PolarHBondContact O-N 3.47Å; Q256-T260 PolarHBondContact O-OG1 2.96Å; Q256-T260 VanDerWaalsContact O-OG1 3.05Å
257I96.5Very high96.9Very high15 Ų1556.4 Ų56.48%0.07727%0.265CS..Hα-helixtrans-55.4-45.5172.4-70.8162.2000110.8P108 I253 K254 A259 T260 N261 R394 I397 F399P108-I257 HydrophobicContact CB-CD1 4.36Å; I253-I257 HydrophobicContact CG2-CD1 3.56Å; I253-I257 HydrophobicContact CG2-CG1 4.33Å; I253-I257 VanDerWaalsContact O-CG1 3.29Å; I253-I257 WeakPolarHBondContact O-CG1 3.33Å; I253-I257 PolarHBondContact O-N 3.41Å; K254-I257 PolarHBondContact O-N 3.49Å; I257-A259 PolarHBondContact O-N 3.25Å; I257-T260 PolarHBondContact O-N 3.22Å; I257-N261 WeakPolarHBondContact O-CB 3.43Å; I257-N261 PolarHBondContact O-N 2.99Å; I257-N261 PolarHBondContact O-OD1 2.71Å; I257-R394 PolarHBondContact O-NH2 3.49Å; I257-I397 HydrophobicContact CD1-CG2 4.02Å; I257-I397 HydrophobicContact CG2-CD1 4.32Å; I257-F399 HydrophobicContact CD1-CB 4.38Å
258E96Very high97Very high80 Ų8050.5 Ų50.537%0.37424%0.237SC..Hα-helixtrans-64.2-37.9177.5-70.7173.4-173.900112.5K254 Q256 R262K254-E258 WeakPolarHBondContact CE-OE1 3.46Å; K254-E258 WeakPolarHBondContact O-CG 3.32Å; K254-E258 PolarHBondContact O-N 3.26Å; Q256-E258 VanDerWaalsContact C-N 3.28Å; Q256-E258 PolarHBondContact O-N 3.47Å; E258-R262 WeakPolarHBondContact O-CG 3.45Å; E258-R262 PolarHBondContact O-N 3.18Å; E258-R262 IonicContact OE2-NH1 2.78Å
259A98Very high97.2Very high18 Ų1849.2 Ų49.215%0.14924%0.24CC..Hα-helixtrans-64.5-48176.300000111.7R255 Q256 I257 N261 R262 A263R255-A259 PolarHBondContact O-N 2.99Å; Q256-A259 WeakPolarHBondContact O-CB 3.47Å; Q256-A259 PolarHBondContact O-N 3.05Å; Q256-A259 VanDerWaalsContact O-N 3.08Å; I257-A259 PolarHBondContact O-N 3.25Å; A259-N261 PolarHBondContact O-N 2.66Å; A259-R262 WeakPolarHBondContact O-CB 3.25Å; A259-R262 PolarHBondContact O-N 3.32Å; A259-A263 PolarHBondContact O-N 2.87Å
260T98Very high97.2Very high0 Ų052.9 Ų52.90%026%0.256CS..Hα-helixtrans-60.8-43.6175.1-51.40000111.9E135 L136 E139 Q256 I257 R262 A263 L264E135-T260 HydrophobicContact CB-CG2 4.33Å; E135-T260 PolarHBondContact O-OG1 2.86Å; L136-T260 HydrophobicContact CD2-CG2 3.61Å; L136-T260 HydrophobicContact CG-CG2 3.74Å; E139-T260 WeakPolarHBondContact OE2-CB 3.42Å; E139-T260 WeakPolarHBondContact OE2-CG2 3.34Å; E139-T260 PolarHBondContact OE2-OG1 3.17Å; Q256-T260 PolarHBondContact O-N 3.47Å; Q256-T260 PolarHBondContact O-OG1 2.96Å; Q256-T260 VanDerWaalsContact O-OG1 3.05Å; I257-T260 PolarHBondContact O-N 3.22Å; T260-R262 VanDerWaalsContact C-N 3.31Å; T260-R262 PolarHBondContact O-N 3.23Å; T260-A263 PolarHBondContact O-N 3.5Å; T260-A263 VanDerWaalsContact O-N 3.17Å; T260-L264 HydrophobicContact CG2-CD1 4.13Å; T260-L264 PolarHBondContact O-N 3.36Å
261N97.4Very high97.4Very high38 Ų3852.3 Ų52.320%0.20325%0.251CS..Hα-helixtrans-61.4-39.7176.9-72.9-2.9000111.6I257 A259 N265 R394I257-N261 WeakPolarHBondContact O-CB 3.43Å; I257-N261 PolarHBondContact O-N 2.99Å; I257-N261 PolarHBondContact O-OD1 2.71Å; A259-N261 PolarHBondContact O-N 2.66Å; N261-N265 WeakPolarHBondContact O-CB 3.39Å; N261-N265 PolarHBondContact O-N 2.93Å; N261-N265 PolarHBondContact O-ND2 3.03Å; N261-R394 VanDerWaalsContact OD1-CZ 3.28Å; N261-R394 PolarHBondContact OD1-NE 3.29Å; N261-R394 PolarHBondContact OD1-NH2 3.49Å
262R98Very high97.5Very high146 Ų14656 Ų5655%0.55126%0.258SS*.Hα-helixtrans-64.5-43.3174.5-75.5-173.7-62.6-93.3-0.3111.7E258 A259 T260 N265 K266E258-R262 WeakPolarHBondContact O-CG 3.45Å; E258-R262 PolarHBondContact O-N 3.18Å; E258-R262 IonicContact OE2-NH1 2.78Å; A259-R262 WeakPolarHBondContact O-CB 3.25Å; A259-R262 PolarHBondContact O-N 3.32Å; T260-R262 VanDerWaalsContact C-N 3.31Å; T260-R262 PolarHBondContact O-N 3.23Å; R262-N265 PolarHBondContact O-N 2.99Å; R262-K266 WeakPolarHBondContact O-CB 3.36Å; R262-K266 PolarHBondContact O-N 2.6Å
263A98.4Very high97.6Very high12 Ų1256.5 Ų56.510%0.09927%0.265CS..Hα-helixtrans-64.3-44.3178.800000112.1D131 A132 E135 A259 T260 K266 R267D131-A263 HydrophobicContact CB-CB 4.49Å; A132-A263 HydrophobicContact CB-CB 4.35Å; E135-A263 HydrophobicContact CB-CB 4.14Å; E135-A263 HydrophobicContact CG-CB 3.87Å; A259-A263 PolarHBondContact O-N 2.87Å; T260-A263 PolarHBondContact O-N 3.5Å; T260-A263 VanDerWaalsContact O-N 3.17Å; A263-K266 PolarHBondContact O-N 2.62Å; A263-R267 WeakPolarHBondContact O-CB 3.42Å; A263-R267 PolarHBondContact O-N 3.29Å
264L97.9Very high97.7Very high0 Ų058.8 Ų58.80%028%0.282CS..Hα-helixtrans-61.3-48.8174.6-78.7167.1000111.9A132 T260 K266 R267 I268 C390 M391A132-L264 HydrophobicContact CB-CD2 3.89Å; A132-L264 HydrophobicContact CB-CG 4.19Å; T260-L264 HydrophobicContact CG2-CD1 4.13Å; T260-L264 PolarHBondContact O-N 3.36Å; L264-K266 VanDerWaalsContact C-N 3.33Å; L264-K266 PolarHBondContact O-N 2.73Å; L264-R267 PolarHBondContact O-N 2.67Å; L264-R267 VanDerWaalsContact O-N 3.1Å; L264-I268 VanDerWaalsContact O-CG1 3.31Å; L264-I268 WeakPolarHBondContact O-CG1 3.31Å; L264-I268 PolarHBondContact O-N 3.24Å; L264-C390 HydrophobicContact CD1-CB 4.48Å; L264-C390 HydrophobicContact CD2-CB 4.41Å; L264-M391 HydrophobicContact CB-CG 4.45Å; L264-M391 HydrophobicContact CB-SD 3.78Å; L264-M391 HydrophobicContact CD1-SD 3.89Å; L264-M391 HydrophobicContact CG-SD 4.48Å
265N98.2Very high97.8Very high83 Ų8355.5 Ų55.544%0.44427%0.267SS..Hα-helixtrans-61.5-40.6178.7-79.6-52.7000112.7N261 R262 R267 I268 S269N261-N265 WeakPolarHBondContact O-CB 3.39Å; N261-N265 PolarHBondContact O-N 2.93Å; N261-N265 PolarHBondContact O-ND2 3.03Å; R262-N265 PolarHBondContact O-N 2.99Å; N265-R267 VanDerWaalsContact C-N 3.33Å; N265-I268 PolarHBondContact O-N 3.06Å; N265-S269 PolarHBondContact O-N 3.3Å
266K98.3Very high97.9Very high107 Ų10750.8 Ų50.847%0.46526%0.26SS..Hα-helixtrans-59.2-47173.1-179.4-173.1168.4-159.10110.3D131 R262 A263 L264 I268 S269 E270D131-K266 IonicContact OD2-NZ 2.79Å; D131-K266 PolarHBondContact OD2-NZ 3.06Å; R262-K266 WeakPolarHBondContact O-CB 3.36Å; R262-K266 PolarHBondContact O-N 2.6Å; A263-K266 PolarHBondContact O-N 2.62Å; L264-K266 VanDerWaalsContact C-N 3.33Å; L264-K266 PolarHBondContact O-N 2.73Å; K266-I268 PolarHBondContact O-N 3.48Å; K266-S269 WeakPolarHBondContact O-CB 3.44Å; K266-S269 PolarHBondContact O-N 2.92Å; K266-E270 VanDerWaalsContact CE-OE1 3.22Å; K266-E270 WeakPolarHBondContact CE-OE1 3.4Å; K266-E270 WeakPolarHBondContact O-CG 3.3Å; K266-E270 PolarHBondContact O-N 3.07Å
267R97.2Very high97.9Very high48 Ų4855.9 Ų55.918%0.18128%0.282CS..Hα-helixtrans-64-41.2180-168.760.8178.6143.810112.8D130 A132 A263 L264 N265 S269 E270 T271D130-R267 WeakPolarHBondContact OD2-CD 3.48Å; D130-R267 WeakPolarHBondContact OD2-CG 3.35Å; D130-R267 IonicContact OD2-CZ 2.73Å; D130-R267 IonicContact OD2-NE 3.39Å; D130-R267 PolarHBondContact OD2-NE 2.78Å; A132-R267 HydrophobicContact CB-CB 4.29Å; A263-R267 WeakPolarHBondContact O-CB 3.42Å; A263-R267 PolarHBondContact O-N 3.29Å; L264-R267 PolarHBondContact O-N 2.67Å; L264-R267 VanDerWaalsContact O-N 3.1Å; N265-R267 VanDerWaalsContact C-N 3.33Å; R267-S269 VanDerWaalsContact C-N 3.33Å; R267-S269 PolarHBondContact O-N 3.27Å; R267-E270 IonicContact NH1-OE2 3.68Å; R267-E270 PolarHBondContact NH1-OE2 2.84Å; R267-E270 PolarHBondContact O-N 3.31Å; R267-T271 PolarHBondContact O-N 3.27Å; R267-T271 PolarHBondContact O-OG1 3.16Å
268I98.2Very high98Very high8 Ų856.6 Ų56.64%0.04129%0.286CS..Hα-helixtrans-58.7-46.2173.5-69.1163.7000110.3L264 N265 K266 E270 T271 R272 L383 D386 E387 M391L264-I268 VanDerWaalsContact O-CG1 3.31Å; L264-I268 WeakPolarHBondContact O-CG1 3.31Å; L264-I268 PolarHBondContact O-N 3.24Å; N265-I268 PolarHBondContact O-N 3.06Å; K266-I268 PolarHBondContact O-N 3.48Å; I268-E270 PolarHBondContact O-N 2.97Å; I268-T271 PolarHBondContact O-N 3.48Å; I268-R272 HydrophobicContact CG2-CG 4.48Å; I268-R272 WeakPolarHBondContact O-CB 3.43Å; I268-R272 WeakPolarHBondContact O-CG 3.34Å; I268-R272 PolarHBondContact O-N 3.46Å; I268-L383 HydrophobicContact CG2-CD2 4.12Å; I268-D386 HydrophobicContact CD1-CB 4.07Å; I268-D386 HydrophobicContact CG1-CB 3.61Å; I268-E387 HydrophobicContact CD1-CB 4.17Å; I268-E387 HydrophobicContact CG1-CB 4.5Å; I268-M391 HydrophobicContact CD1-CG 3.62Å
269S98.5Very high98.2Very high77 Ų7756.6 Ų56.654%0.53829%0.286SS..Hα-helixtrans-62.1-41.9178.5-1730000112.6N265 K266 R267 S273N265-S269 PolarHBondContact O-N 3.3Å; K266-S269 WeakPolarHBondContact O-CB 3.44Å; K266-S269 PolarHBondContact O-N 2.92Å; R267-S269 VanDerWaalsContact C-N 3.33Å; R267-S269 PolarHBondContact O-N 3.27Å; S269-S273 WeakPolarHBondContact O-CB 3.47Å; S269-S273 PolarHBondContact O-N 3.12Å
270E98.1Very high98.2Very high81 Ų8162.2 Ų62.238%0.37931%0.309SS..Hα-helixtrans-62.6-47.2175.7-71.9171.3-173.700111.6K266 R267 I268 R272 S273 S274K266-E270 VanDerWaalsContact CE-OE1 3.22Å; K266-E270 WeakPolarHBondContact CE-OE1 3.4Å; K266-E270 WeakPolarHBondContact O-CG 3.3Å; K266-E270 PolarHBondContact O-N 3.07Å; R267-E270 IonicContact NH1-OE2 3.68Å; R267-E270 PolarHBondContact NH1-OE2 2.84Å; R267-E270 PolarHBondContact O-N 3.31Å; I268-E270 PolarHBondContact O-N 2.97Å; E270-R272 PolarHBondContact O-N 3.4Å; E270-S273 PolarHBondContact O-N 3.36Å; E270-S274 WeakPolarHBondContact O-CB 3.48Å; E270-S274 PolarHBondContact O-N 2.94Å
271T98Very high98.2Very high4 Ų469.3 Ų69.33%0.02534%0.337CS..Hα-helixtrans-64.7-40.6-179.9-55.90000111.4R267 I268 S274 K275 K379 T382 L383R267-T271 PolarHBondContact O-N 3.27Å; R267-T271 PolarHBondContact O-OG1 3.16Å; I268-T271 PolarHBondContact O-N 3.48Å; T271-S274 PolarHBondContact O-N 3.07Å; T271-K275 WeakPolarHBondContact O-CB 3.41Å; T271-K275 PolarHBondContact O-N 3.49Å; T271-K379 HydrophobicContact CG2-CB 4.17Å; T271-K379 HydrophobicContact CG2-CD 4.1Å; T271-T382 HydrophobicContact CG2-CG2 4.01Å; T271-L383 HydrophobicContact CG2-CD1 4.42Å; T271-L383 HydrophobicContact CG2-CD2 3.86Å; T271-L383 HydrophobicContact CG2-CG 3.73Å
272R98.3Very high98.2Very high125 Ų12568.6 Ų68.647%0.47233%0.333SS..Hα-helixtrans-60.9-45.2173.3-75.6-179.1-179.8170.4-10.8112.1I268 E270 S274 K275 A276 L383 E387I268-R272 HydrophobicContact CG2-CG 4.48Å; I268-R272 WeakPolarHBondContact O-CB 3.43Å; I268-R272 WeakPolarHBondContact O-CG 3.34Å; I268-R272 PolarHBondContact O-N 3.46Å; E270-R272 PolarHBondContact O-N 3.4Å; R272-S274 VanDerWaalsContact C-N 3.34Å; R272-S274 PolarHBondContact O-N 3.02Å; R272-K275 PolarHBondContact O-N 3.39Å; R272-A276 WeakPolarHBondContact O-CB 3.31Å; R272-A276 PolarHBondContact O-N 3.47Å; R272-L383 HydrophobicContact CG-CD1 3.96Å; R272-L383 HydrophobicContact CG-CD2 3.63Å; R272-L383 HydrophobicContact CG-CG 4.48Å; R272-E387 IonicContact CZ-OE1 3.76Å; R272-E387 IonicContact CZ-OE2 2.84Å; R272-E387 IonicContact NE-OE2 3.7Å; R272-E387 PolarHBondContact NE-OE2 3.31Å; R272-E387 IonicContact NH2-OE1 3.7Å; R272-E387 PolarHBondContact NH2-OE1 2.95Å; R272-E387 IonicContact NH2-OE2 3.54Å; R272-E387 PolarHBondContact NH2-OE2 2.79Å
273S98.4Very high98.3Very high61 Ų6165.3 Ų65.343%0.42733%0.333SS..Hα-helixtrans-62.5-42.3177.7-175.90000111.8S269 E270 A276 K277S269-S273 WeakPolarHBondContact O-CB 3.47Å; S269-S273 PolarHBondContact O-N 3.12Å; E270-S273 PolarHBondContact O-N 3.36Å; S273-A276 PolarHBondContact O-N 3.25Å; S273-K277 WeakPolarHBondContact O-CG 3.3Å; S273-K277 PolarHBondContact O-N 3.38Å; S273-K277 VanDerWaalsContact O-N 3.12Å
274S98Very high98.3Very high49 Ų4967.5 Ų67.534%0.34335%0.35SS..Hα-helixtrans-62.8-47.7175.7-169.90000111.6E270 T271 R272 A276 K277 L278E270-S274 WeakPolarHBondContact O-CB 3.48Å; E270-S274 PolarHBondContact O-N 2.94Å; T271-S274 PolarHBondContact O-N 3.07Å; R272-S274 VanDerWaalsContact C-N 3.34Å; R272-S274 PolarHBondContact O-N 3.02Å; S274-A276 PolarHBondContact O-N 3.07Å; S274-K277 PolarHBondContact O-N 3.38Å; S274-L278 WeakPolarHBondContact O-CG 3.5Å; S274-L278 PolarHBondContact O-N 2.94Å
275K98.4Very high98.3Very high52 Ų5269 Ų6923%0.22636%0.358CS..Hα-helixtrans-58.5-47.6176.7-173.1-176.2172.4-159.10112T271 R272 K277 L278 E279 I376 K379 L383T271-K275 WeakPolarHBondContact O-CB 3.41Å; T271-K275 PolarHBondContact O-N 3.49Å; R272-K275 PolarHBondContact O-N 3.39Å; K275-K277 VanDerWaalsContact C-N 3.3Å; K275-K277 PolarHBondContact O-N 3.35Å; K275-L278 WeakPolarHBondContact O-CB 3.34Å; K275-L278 PolarHBondContact O-N 2.88Å; K275-L278 VanDerWaalsContact O-N 3.11Å; K275-E279 WeakPolarHBondContact CE-OE1 3.42Å; K275-E279 IonicContact NZ-OE1 2.79Å; K275-E279 WeakPolarHBondContact O-CG 3.49Å; K275-E279 PolarHBondContact O-N 3.48Å; K275-I376 HydrophobicContact CG-CG2 4.34Å; K275-K379 HydrophobicContact CB-CB 3.94Å; K275-K379 HydrophobicContact CD-CB 4.47Å; K275-K379 HydrophobicContact CG-CB 4.16Å; K275-L383 HydrophobicContact CD-CD1 3.87Å
276A98.6Very high98.3Very high51 Ų5168.9 Ų68.942%0.42136%0.357SS..Hα-helixtrans-60.3-39.3179.300000112.3R272 S273 S274 E279 E280R272-A276 WeakPolarHBondContact O-CB 3.31Å; R272-A276 PolarHBondContact O-N 3.47Å; S273-A276 PolarHBondContact O-N 3.25Å; S274-A276 PolarHBondContact O-N 3.07Å; A276-E279 PolarHBondContact O-N 3.41Å; A276-E280 PolarHBondContact O-N 2.97Å
277K98.4Very high98.3Very high119 Ų11970.7 Ų70.752%0.51737%0.365SS..Hα-helixtrans-65.4-41.6174-72.9177.8-178.7-178.80112.1S273 S274 K275 E279 E280 Y281S273-K277 WeakPolarHBondContact O-CG 3.3Å; S273-K277 PolarHBondContact O-N 3.38Å; S273-K277 VanDerWaalsContact O-N 3.12Å; S274-K277 PolarHBondContact O-N 3.38Å; K275-K277 VanDerWaalsContact C-N 3.3Å; K275-K277 PolarHBondContact O-N 3.35Å; K277-E279 VanDerWaalsContact C-N 3.31Å; K277-E279 PolarHBondContact O-N 3.35Å; K277-E280 WeakPolarHBondContact O-CB 3.5Å; K277-E280 PolarHBondContact O-N 3.5Å; K277-Y281 WeakPolarHBondContact O-CD2 3.19Å; K277-Y281 PolarHBondContact O-N 3.03Å
278L98.5Very high98.3Very high30 Ų3072.4 Ų72.416%0.15738%0.375CS..Hα-helixtrans-61.9-40.8175.9-68167000111.2S274 K275 Y281 L282 L372 E375 I376 K379S274-L278 WeakPolarHBondContact O-CG 3.5Å; S274-L278 PolarHBondContact O-N 2.94Å; K275-L278 WeakPolarHBondContact O-CB 3.34Å; K275-L278 PolarHBondContact O-N 2.88Å; K275-L278 VanDerWaalsContact O-N 3.11Å; L278-Y281 PolarHBondContact O-N 2.97Å; L278-L282 VanDerWaalsContact O-CB 3.31Å; L278-L282 WeakPolarHBondContact O-CB 3.44Å; L278-L282 PolarHBondContact O-N 3.38Å; L278-L372 HydrophobicContact CD2-CD2 3.6Å; L278-E375 HydrophobicContact CD1-CB 3.91Å; L278-E375 HydrophobicContact CD2-CB 4.41Å; L278-I376 HydrophobicContact CB-CD1 4.12Å; L278-I376 HydrophobicContact CB-CG1 3.57Å; L278-I376 HydrophobicContact CD1-CG1 4.4Å; L278-K379 HydrophobicContact CD1-CG 3.9Å
279E98.5Very high98.3Very high80 Ų8072.7 Ų72.737%0.37438%0.376SS..Hα-helixtrans-64.2-37.4175.3-70.4170.2160.100112.3K275 A276 K277 L282 S283 I376K275-E279 WeakPolarHBondContact CE-OE1 3.42Å; K275-E279 IonicContact NZ-OE1 2.79Å; K275-E279 WeakPolarHBondContact O-CG 3.49Å; K275-E279 PolarHBondContact O-N 3.48Å; A276-E279 PolarHBondContact O-N 3.41Å; K277-E279 VanDerWaalsContact C-N 3.31Å; K277-E279 PolarHBondContact O-N 3.35Å; E279-L282 PolarHBondContact O-N 3.14Å; E279-S283 WeakPolarHBondContact O-CB 3.34Å; E279-S283 PolarHBondContact O-N 3.17Å; E279-S283 PolarHBondContact O-OG 3.44Å; E279-I376 HydrophobicContact CB-CD1 4.49Å; E279-I376 HydrophobicContact CG-CD1 3.84Å; E279-I376 HydrophobicContact CG-CG1 4.16Å; E279-I376 HydrophobicContact CG-CG2 4.26Å
280E98.4Very high98.3Very high135 Ų13571.7 Ų71.763%0.63137%0.369SS*.Hα-helixtrans-63.5-49.7172.6-175.5-173.4167.500111.4A276 K277 L282 S283 A284A276-E280 PolarHBondContact O-N 2.97Å; K277-E280 WeakPolarHBondContact O-CB 3.5Å; K277-E280 PolarHBondContact O-N 3.5Å; E280-L282 VanDerWaalsContact C-N 3.32Å; E280-L282 PolarHBondContact O-N 3.4Å; E280-S283 WeakPolarHBondContact O-CB 3.3Å; E280-S283 PolarHBondContact O-N 2.88Å; E280-A284 PolarHBondContact O-N 2.57Å
281Y98.3Very high98.3Very high149 Ų14970.9 Ų70.958%0.58437%0.367SS*.Hα-helixtrans-62.6-38.9176.5-79.1-66.5000112K277 L278 S283 A284 I285K277-Y281 WeakPolarHBondContact O-CD2 3.19Å; K277-Y281 PolarHBondContact O-N 3.03Å; L278-Y281 PolarHBondContact O-N 2.97Å; Y281-S283 VanDerWaalsContact C-N 3.34Å; Y281-A284 PolarHBondContact O-N 2.83Å; Y281-I285 VanDerWaalsContact O-CG1 3.29Å; Y281-I285 WeakPolarHBondContact O-CG1 3.43Å; Y281-I285 PolarHBondContact O-N 2.91Å
282L98.5Very high98.3Very high24 Ų2471.8 Ų71.813%0.12637%0.372CS..Hα-helixtrans-61.1-45.6175.4177.661.1000110.6L278 E279 E280 A284 I285 I286 Q369 L372 E373 I376L278-L282 VanDerWaalsContact O-CB 3.31Å; L278-L282 WeakPolarHBondContact O-CB 3.44Å; L278-L282 PolarHBondContact O-N 3.38Å; E279-L282 PolarHBondContact O-N 3.14Å; E280-L282 VanDerWaalsContact C-N 3.32Å; E280-L282 PolarHBondContact O-N 3.4Å; L282-A284 VanDerWaalsContact C-N 3.31Å; L282-A284 PolarHBondContact O-N 2.89Å; L282-I285 PolarHBondContact O-N 3.07Å; L282-I286 HydrophobicContact CD1-CD1 3.99Å; L282-I286 HydrophobicContact CD1-CG1 4.21Å; L282-I286 HydrophobicContact CG-CD1 3.87Å; L282-I286 HydrophobicContact CG-CG1 4.5Å; L282-I286 VanDerWaalsContact O-CG1 3.3Å; L282-I286 WeakPolarHBondContact O-CG1 3.4Å; L282-I286 PolarHBondContact O-N 3.4Å; L282-Q369 HydrophobicContact CD1-CB 4.42Å; L282-Q369 HydrophobicContact CD1-CG 3.63Å; L282-L372 HydrophobicContact CB-CB 4.34Å; L282-L372 HydrophobicContact CB-CD1 4.36Å; L282-L372 HydrophobicContact CD1-CB 4.23Å; L282-E373 HydrophobicContact CD1-CG 3.94Å; L282-E373 HydrophobicContact CD2-CG 3.85Å; L282-I376 HydrophobicContact CB-CD1 4.11Å; L282-I376 HydrophobicContact CD2-CD1 3.61Å; L282-I376 HydrophobicContact CG-CD1 4.48Å
283S98.4Very high98.3Very high77 Ų7770.9 Ų70.954%0.53837%0.373SS..Hα-helixtrans-60.6-40.6176.7-58.60000112E279 E280 Y281 K287E279-S283 WeakPolarHBondContact O-CB 3.34Å; E279-S283 PolarHBondContact O-N 3.17Å; E279-S283 PolarHBondContact O-OG 3.44Å; E280-S283 WeakPolarHBondContact O-CB 3.3Å; E280-S283 PolarHBondContact O-N 2.88Å; Y281-S283 VanDerWaalsContact C-N 3.34Å; S283-K287 PolarHBondContact O-N 3.47Å; S283-K287 VanDerWaalsContact O-N 3.11Å
284A98.3Very high98.3Very high57 Ų5772.7 Ų72.747%0.47138%0.378SS..Hα-helixtrans-65.7-42175.400000112.3E280 Y281 L282 K287 E288E280-A284 PolarHBondContact O-N 2.57Å; Y281-A284 PolarHBondContact O-N 2.83Å; L282-A284 VanDerWaalsContact C-N 3.31Å; L282-A284 PolarHBondContact O-N 2.89Å; A284-K287 PolarHBondContact O-N 3.07Å; A284-E288 PolarHBondContact O-N 3.36Å
285I98.3Very high98.2Very high32 Ų3273.5 Ų73.516%0.16438%0.381CS..Hα-helixtrans-64.8-43.9176.8-70.6-68.9000111.1Y281 L282 K287 E288 I289 L365 R368 Q369 L372Y281-I285 VanDerWaalsContact O-CG1 3.29Å; Y281-I285 WeakPolarHBondContact O-CG1 3.43Å; Y281-I285 PolarHBondContact O-N 2.91Å; L282-I285 PolarHBondContact O-N 3.07Å; I285-K287 VanDerWaalsContact C-N 3.31Å; I285-K287 PolarHBondContact O-N 3.36Å; I285-E288 PolarHBondContact O-N 3.46Å; I285-E288 VanDerWaalsContact O-N 3.13Å; I285-I289 HydrophobicContact CG2-CD1 3.87Å; I285-I289 HydrophobicContact CG2-CG1 4.36Å; I285-I289 VanDerWaalsContact O-CG1 3.3Å; I285-I289 WeakPolarHBondContact O-CG1 3.26Å; I285-I289 PolarHBondContact O-N 2.87Å; I285-L365 HydrophobicContact CD1-CD2 3.66Å; I285-R368 HydrophobicContact CD1-CB 4.41Å; I285-Q369 HydrophobicContact CG2-CB 4.01Å; I285-L372 HydrophobicContact CG1-CD1 3.94Å
286I98.4Very high98.2Very high81 Ų8171.8 Ų71.842%0.41537%0.374SS..Hα-helixtrans-60.4-42.5177-69.8167.5000110.8L282 E288 I289 S290 Q369L282-I286 HydrophobicContact CD1-CD1 3.99Å; L282-I286 HydrophobicContact CD1-CG1 4.21Å; L282-I286 HydrophobicContact CG-CD1 3.87Å; L282-I286 HydrophobicContact CG-CG1 4.5Å; L282-I286 VanDerWaalsContact O-CG1 3.3Å; L282-I286 WeakPolarHBondContact O-CG1 3.4Å; L282-I286 PolarHBondContact O-N 3.4Å; I286-E288 VanDerWaalsContact C-N 3.34Å; I286-E288 PolarHBondContact O-N 3.35Å; I286-I289 PolarHBondContact O-N 2.9Å; I286-S290 PolarHBondContact O-N 3.22Å; I286-S290 VanDerWaalsContact O-N 3.14Å; I286-Q369 HydrophobicContact CG1-CG 4.48Å
287K98.3Very high98.1Very high144 Ų14474.8 Ų74.863%0.62638%0.379SS*.Hα-helixtrans-61.8-43174.7-175.1-178.3178.7-1760111.7S283 A284 I285 S290 N291S283-K287 PolarHBondContact O-N 3.47Å; S283-K287 VanDerWaalsContact O-N 3.11Å; A284-K287 PolarHBondContact O-N 3.07Å; I285-K287 VanDerWaalsContact C-N 3.31Å; I285-K287 PolarHBondContact O-N 3.36Å; K287-S290 PolarHBondContact O-N 3.47Å; K287-N291 VanDerWaalsContact O-CG 3.24Å; K287-N291 PolarHBondContact O-N 3.14Å; K287-N291 PolarHBondContact O-ND2 2.78Å; K287-N291 PolarHBondContact O-OD1 2.83Å
288E98.2Very high98.1Very high84 Ų8474 Ų7439%0.39338%0.377SS..Hα-helixtrans-70.4-32-179.7-165.858.7-163.100112.8A284 I285 I286 N291 M292 L365A284-E288 PolarHBondContact O-N 3.36Å; I285-E288 PolarHBondContact O-N 3.46Å; I285-E288 VanDerWaalsContact O-N 3.13Å; I286-E288 VanDerWaalsContact C-N 3.34Å; I286-E288 PolarHBondContact O-N 3.35Å; E288-N291 PolarHBondContact O-N 2.96Å; E288-N291 PolarHBondContact OE2-ND2 3.4Å; E288-M292 VanDerWaalsContact O-CB 3.29Å; E288-M292 WeakPolarHBondContact O-CB 3.42Å; E288-M292 PolarHBondContact O-N 3.32Å; E288-L365 HydrophobicContact CB-CD1 4.31Å; E288-L365 HydrophobicContact CB-CD2 4.41Å; E288-L365 HydrophobicContact CG-CD1 3.88Å; E288-L365 HydrophobicContact CG-CD2 4.22Å
289I98.2Very high98.1Very high14 Ų1473.9 Ų73.97%0.07238%0.377CS..Hα-helixtrans-58-51.6169.5-74.1169.5000109.7I285 I286 N291 M292 E293 L362 L365 Q369I285-I289 HydrophobicContact CG2-CD1 3.87Å; I285-I289 HydrophobicContact CG2-CG1 4.36Å; I285-I289 VanDerWaalsContact O-CG1 3.3Å; I285-I289 WeakPolarHBondContact O-CG1 3.26Å; I285-I289 PolarHBondContact O-N 2.87Å; I286-I289 PolarHBondContact O-N 2.9Å; I289-N291 PolarHBondContact O-N 2.99Å; I289-M292 PolarHBondContact O-N 2.92Å; I289-M292 VanDerWaalsContact O-N 3.13Å; I289-E293 WeakPolarHBondContact O-CG 3.5Å; I289-E293 PolarHBondContact O-N 3.04Å; I289-L362 HydrophobicContact CB-CD1 4.34Å; I289-L362 HydrophobicContact CG1-CD1 4.34Å; I289-L362 HydrophobicContact CG2-CD1 3.87Å; I289-L365 HydrophobicContact CD1-CB 4.2Å; I289-L365 HydrophobicContact CG1-CB 3.59Å; I289-L365 HydrophobicContact CG1-CD1 4.3Å; I289-Q369 HydrophobicContact CD1-CB 4.15Å; I289-Q369 VanDerWaalsContact CD1-OE1 3.28Å
290S98.1Very high98Very high56 Ų5674.7 Ų74.739%0.39238%0.38SS..Hα-helixtrans-59.4-44.6177.4-175.50000112.2I286 K287 M292 E293 D294I286-S290 PolarHBondContact O-N 3.22Å; I286-S290 VanDerWaalsContact O-N 3.14Å; K287-S290 PolarHBondContact O-N 3.47Å; S290-M292 VanDerWaalsContact C-N 3.28Å; S290-M292 PolarHBondContact O-N 2.94Å; S290-E293 PolarHBondContact O-N 2.95Å; S290-D294 PolarHBondContact O-N 3.37Å
291N98.1Very high98Very high64 Ų6472.7 Ų72.734%0.34237%0.37SS..Hα-helixtrans-61.3-38.3176.7-64.9-23.9000111.9K287 E288 I289 T295K287-N291 VanDerWaalsContact O-CG 3.24Å; K287-N291 PolarHBondContact O-N 3.14Å; K287-N291 PolarHBondContact O-ND2 2.78Å; K287-N291 PolarHBondContact O-OD1 2.83Å; E288-N291 PolarHBondContact O-N 2.96Å; E288-N291 PolarHBondContact OE2-ND2 3.4Å; I289-N291 PolarHBondContact O-N 2.99Å; N291-T295 WeakPolarHBondContact O-CB 3.14Å; N291-T295 PolarHBondContact O-N 2.97Å; N291-T295 PolarHBondContact O-OG1 2.92Å
292M97.8Very high97.9Very high24 Ų2466.4 Ų66.412%0.11835%0.348CS..Hα-helixtrans-71.3-37.6179.3-169.160.858.700111.3E288 I289 S290 T295 L296 A358 L362 L365E288-M292 VanDerWaalsContact O-CB 3.29Å; E288-M292 WeakPolarHBondContact O-CB 3.42Å; E288-M292 PolarHBondContact O-N 3.32Å; I289-M292 PolarHBondContact O-N 2.92Å; I289-M292 VanDerWaalsContact O-N 3.13Å; S290-M292 VanDerWaalsContact C-N 3.28Å; S290-M292 PolarHBondContact O-N 2.94Å; M292-T295 WeakPolarHBondContact O-CB 3.43Å; M292-T295 PolarHBondContact O-N 3.11Å; M292-L296 VanDerWaalsContact O-CG 3.31Å; M292-L296 WeakPolarHBondContact O-CG 3.45Å; M292-L296 PolarHBondContact O-N 3.32Å; M292-A358 HydrophobicContact SD-CB 3.72Å; M292-L362 HydrophobicContact CB-CD1 4.31Å; M292-L362 HydrophobicContact CG-CB 3.88Å; M292-L362 HydrophobicContact CG-CD1 4.41Å; M292-L365 HydrophobicContact CB-CD1 4.32Å
293E98Very high97.9Very high105 Ų10565.9 Ų65.949%0.49135%0.346SS..Hα-helixtrans-61.6-44.8172.2-71.4174.3158.600111.7I289 S290 T295 L296 H297 L362I289-E293 WeakPolarHBondContact O-CG 3.5Å; I289-E293 PolarHBondContact O-N 3.04Å; S290-E293 PolarHBondContact O-N 2.95Å; E293-T295 VanDerWaalsContact C-N 3.32Å; E293-T295 PolarHBondContact O-N 3.43Å; E293-L296 WeakPolarHBondContact O-CB 3.24Å; E293-L296 PolarHBondContact O-N 3.47Å; E293-H297 PolarHBondContact O-N 3.4Å; E293-L362 HydrophobicContact CG-CD1 4.18Å; E293-L362 HydrophobicContact CG-CD2 4.11Å
294D97.8Very high97.8Very high99 Ų9970.1 Ų70.153%0.52935%0.354SS..Hα-helixtrans-61.7-41.8173.5-72-23000111.4S290 L296 H297 E298S290-D294 PolarHBondContact O-N 3.37Å; D294-L296 VanDerWaalsContact C-N 3.33Å; D294-L296 PolarHBondContact O-N 3.37Å; D294-H297 WeakPolarHBondContact O-CB 3.47Å; D294-H297 PolarHBondContact O-N 3.38Å; D294-E298 PolarHBondContact O-N 2.65Å
295T97.7Very high97.7Very high67 Ų6772.3 Ų72.341%0.41136%0.355SS..Hα-helixtrans-62.4-40.7176.6-60.70000111.5N291 M292 E293 E298 L299N291-T295 WeakPolarHBondContact O-CB 3.14Å; N291-T295 PolarHBondContact O-N 2.97Å; N291-T295 PolarHBondContact O-OG1 2.92Å; M292-T295 WeakPolarHBondContact O-CB 3.43Å; M292-T295 PolarHBondContact O-N 3.11Å; E293-T295 VanDerWaalsContact C-N 3.32Å; E293-T295 PolarHBondContact O-N 3.43Å; T295-E298 PolarHBondContact O-N 3.02Å; T295-L299 HydrophobicContact CG2-CD1 4.01Å; T295-L299 HydrophobicContact CG2-CG 4.41Å; T295-L299 WeakPolarHBondContact O-CB 3.3Å; T295-L299 VanDerWaalsContact O-CG 3.23Å; T295-L299 WeakPolarHBondContact O-CG 3.42Å; T295-L299 PolarHBondContact O-N 2.92Å
296L97.6Very high97.6Very high15 Ų1574 Ų748%0.07936%0.361CS..Hα-helixtrans-61-46.3173.9-73.9175.6000111M292 E293 D294 E298 L299 E300 L355 A358 H359 L362M292-L296 VanDerWaalsContact O-CG 3.31Å; M292-L296 WeakPolarHBondContact O-CG 3.45Å; M292-L296 PolarHBondContact O-N 3.32Å; E293-L296 WeakPolarHBondContact O-CB 3.24Å; E293-L296 PolarHBondContact O-N 3.47Å; D294-L296 VanDerWaalsContact C-N 3.33Å; D294-L296 PolarHBondContact O-N 3.37Å; L296-E298 PolarHBondContact O-N 3.34Å; L296-L299 PolarHBondContact O-N 2.9Å; L296-E300 WeakPolarHBondContact O-CG 3.49Å; L296-E300 PolarHBondContact O-N 3.02Å; L296-L355 HydrophobicContact CD2-CD1 3.61Å; L296-L355 HydrophobicContact CD2-CG 4.44Å; L296-A358 HydrophobicContact CD2-CB 3.48Å; L296-A358 VanDerWaalsContact CD2-CB 3.48Å; L296-A358 HydrophobicContact CG-CB 4.24Å; L296-H359 VanDerWaalsContact CD2-ND1 3.28Å; L296-H359 WeakPolarHBondContact CD2-ND1 3.2Å; L296-L362 HydrophobicContact CD1-CD2 3.56Å
297H97.2Very high97.4Very high114 Ų11472.2 Ų72.253%0.52835%0.352SS..Hα-helixtrans-60.1-46.3178.3-173.968.4000112.4E293 D294 E300 K301E293-H297 PolarHBondContact O-N 3.4Å; D294-H297 WeakPolarHBondContact O-CB 3.47Å; D294-H297 PolarHBondContact O-N 3.38Å; H297-E300 PolarHBondContact O-N 2.84Å; H297-K301 WeakPolarHBondContact O-CB 3.34Å; H297-K301 PolarHBondContact O-N 3.47Å
298E97.7Very high97.2Very high104 Ų10466.6 Ų66.649%0.48634%0.335SS..Hα-helixtrans-67.1-35.6178.1-71.8-59.8142.600112.3D294 T295 L296 K301 A302D294-E298 PolarHBondContact O-N 2.65Å; T295-E298 PolarHBondContact O-N 3.02Å; L296-E298 PolarHBondContact O-N 3.34Å; E298-K301 IonicContact OE1-NZ 3.27Å; E298-K301 IonicContact OE2-NZ 2.78Å; E298-A302 VanDerWaalsContact O-CB 3.26Å; E298-A302 WeakPolarHBondContact O-CB 3.26Å; E298-A302 PolarHBondContact O-N 3.11Å
299L97.5Very high97.1Very high27 Ų2764.4 Ų64.414%0.14133%0.332CS..Hα-helixtrans-64.8-44.7173.2-75.8171000111.8T295 L296 A302 I303 L351 R354 L355 A358T295-L299 HydrophobicContact CG2-CD1 4.01Å; T295-L299 HydrophobicContact CG2-CG 4.41Å; T295-L299 WeakPolarHBondContact O-CB 3.3Å; T295-L299 VanDerWaalsContact O-CG 3.23Å; T295-L299 WeakPolarHBondContact O-CG 3.42Å; T295-L299 PolarHBondContact O-N 2.92Å; L296-L299 PolarHBondContact O-N 2.9Å; L299-A302 PolarHBondContact O-N 2.96Å; L299-I303 WeakPolarHBondContact O-CD1 2.94Å; L299-I303 VanDerWaalsContact O-CG1 3.23Å; L299-I303 WeakPolarHBondContact O-CG1 3.23Å; L299-I303 PolarHBondContact O-N 3.45Å; L299-L351 HydrophobicContact CD2-CD2 3.88Å; L299-R354 HydrophobicContact CD1-CB 4.35Å; L299-R354 HydrophobicContact CD2-CB 4.25Å; L299-L355 HydrophobicContact CB-CB 4.49Å; L299-L355 HydrophobicContact CB-CD1 3.78Å; L299-L355 HydrophobicContact CD1-CB 4.5Å; L299-L355 HydrophobicContact CD1-CD1 4.41Å; L299-A358 HydrophobicContact CD1-CB 4.15Å
300E97.8Very high96.9Very high97 Ų9765.4 Ų65.445%0.45334%0.337SS..Hα-helixtrans-61.9-44.7176.6-73.9-179.6169.600112L296 H297 I303 K304 L355L296-E300 WeakPolarHBondContact O-CG 3.49Å; L296-E300 PolarHBondContact O-N 3.02Å; H297-E300 PolarHBondContact O-N 2.84Å; E300-I303 PolarHBondContact O-N 2.99Å; E300-K304 WeakPolarHBondContact O-CB 3.25Å; E300-K304 PolarHBondContact O-N 2.99Å; E300-L355 HydrophobicContact CG-CD1 3.8Å; E300-L355 HydrophobicContact CG-CD2 4.17Å
301K97.3Very high96.8Very high92 Ų9271 Ų7140%0.435%0.349SS..Hα-helixtrans-61.2-46.8175.3179.5-177.5166.8-162.20111.2H297 E298 I303 K304 E305H297-K301 WeakPolarHBondContact O-CB 3.34Å; H297-K301 PolarHBondContact O-N 3.47Å; E298-K301 IonicContact OE1-NZ 3.27Å; E298-K301 IonicContact OE2-NZ 2.78Å; K301-I303 PolarHBondContact O-N 3.32Å; K301-K304 PolarHBondContact O-N 2.91Å; K301-E305 WeakPolarHBondContact O-CG 3.31Å; K301-E305 PolarHBondContact O-N 3.47Å
302A97.4Very high96.7Very high17 Ų1772 Ų7214%0.1435%0.354CS..Hα-helixtrans-59.3-46.717600000111E298 L299 K304 E305 K306 L351E298-A302 VanDerWaalsContact O-CB 3.26Å; E298-A302 WeakPolarHBondContact O-CB 3.26Å; E298-A302 PolarHBondContact O-N 3.11Å; L299-A302 PolarHBondContact O-N 2.96Å; A302-K304 VanDerWaalsContact C-N 3.31Å; A302-K304 PolarHBondContact O-N 3.27Å; A302-E305 PolarHBondContact O-N 3.45Å; A302-K306 WeakPolarHBondContact O-CD 3.46Å; A302-K306 PolarHBondContact O-N 2.92Å; A302-L351 HydrophobicContact CB-CD1 4.08Å; A302-L351 HydrophobicContact CB-CD2 4.46Å
303I97.5Very high96.5Very high14 Ų1470.9 Ų70.97%0.07235%0.349CS..Hα-helixtrans-56.7-47.2176.4-70.3161.6000110.5L299 E300 K301 E305 K306 D307 V348 L351 R352 L355L299-I303 WeakPolarHBondContact O-CD1 2.94Å; L299-I303 VanDerWaalsContact O-CG1 3.23Å; L299-I303 WeakPolarHBondContact O-CG1 3.23Å; L299-I303 PolarHBondContact O-N 3.45Å; E300-I303 PolarHBondContact O-N 2.99Å; K301-I303 PolarHBondContact O-N 3.32Å; I303-E305 PolarHBondContact O-N 2.89Å; I303-K306 PolarHBondContact O-N 3.41Å; I303-D307 WeakPolarHBondContact O-CB 3.39Å; I303-D307 PolarHBondContact O-N 2.78Å; I303-V348 HydrophobicContact CG2-CG1 4.47Å; I303-L351 HydrophobicContact CD1-CB 4.15Å; I303-L351 HydrophobicContact CG1-CB 3.55Å; I303-L351 HydrophobicContact CG1-CD1 4.27Å; I303-R352 HydrophobicContact CD1-CG 3.87Å; I303-R352 HydrophobicContact CG1-CG 4.33Å; I303-R352 HydrophobicContact CG2-CG 4.42Å; I303-L355 HydrophobicContact CD1-CB 4.14Å; I303-L355 HydrophobicContact CD1-CD2 3.82Å; I303-L355 HydrophobicContact CD1-CG 4.49Å
304K96.7Very high96.3Very high165 Ų16567.4 Ų67.472%0.71734%0.341SS*.Hα-helixtrans-61.4-42.1179.9-174.9179.9179.8-179.80112.9E300 K301 A302 G308E300-K304 WeakPolarHBondContact O-CB 3.25Å; E300-K304 PolarHBondContact O-N 2.99Å; K301-K304 PolarHBondContact O-N 2.91Å; A302-K304 VanDerWaalsContact C-N 3.31Å; A302-K304 PolarHBondContact O-N 3.27Å; K304-G308 PolarHBondContact O-N 2.98Å
305E95.9Very high96.2Very high103 Ų10366.9 Ų66.948%0.48134%0.342SS..Hα-helixtrans-61.5-45.8175.4-73.3171.8179.700111.5K301 A302 I303 G308 A309K301-E305 WeakPolarHBondContact O-CG 3.31Å; K301-E305 PolarHBondContact O-N 3.47Å; A302-E305 PolarHBondContact O-N 3.45Å; I303-E305 PolarHBondContact O-N 2.89Å; E305-G308 WeakPolarHBondContact O-CA 3.38Å; E305-G308 PolarHBondContact O-N 2.72Å; E305-G308 VanDerWaalsContact O-N 3.09Å; E305-A309 PolarHBondContact O-N 3.43Å
306K96.2Very high96.1Very high69 Ų6969.4 Ų69.430%0.334%0.344SS..Hα-helixtrans-75.8-32.1-176.5-76.277.7-170.71680111.3A302 I303 G308 A309 L310 T344 V348 L351A302-K306 WeakPolarHBondContact O-CD 3.46Å; A302-K306 PolarHBondContact O-N 2.92Å; I303-K306 PolarHBondContact O-N 3.41Å; K306-G308 PolarHBondContact O-N 2.56Å; K306-A309 PolarHBondContact O-N 3.3Å; K306-L310 VanDerWaalsContact O-CB 3.29Å; K306-L310 WeakPolarHBondContact O-CB 3.34Å; K306-L310 PolarHBondContact O-N 3.09Å; K306-T344 HydrophobicContact CB-CG2 4.2Å; K306-T344 WeakPolarHBondContact O-CG2 3.37Å; K306-V348 HydrophobicContact CB-CG2 3.58Å; K306-L351 HydrophobicContact CD-CD1 4.24Å
307D95.2Very high95.9Very high43 Ų4370.1 Ų70.123%0.2335%0.347CS..Hα-helixtrans-62.2-32.8165.9-84.3-31.7000111.3I303 R311 R352I303-D307 WeakPolarHBondContact O-CB 3.39Å; I303-D307 PolarHBondContact O-N 2.78Å; D307-R311 WeakPolarHBondContact O-CB 3.28Å; D307-R311 VanDerWaalsContact O-CG 3.26Å; D307-R311 WeakPolarHBondContact O-CG 3.45Å; D307-R311 PolarHBondContact O-N 3.3Å; D307-R311 VanDerWaalsContact O-N 3.11Å; D307-R311 PolarHBondContact O-NE 3.26Å; D307-R352 IonicContact OD1-NH2 2.78Å; D307-R352 PolarHBondContact OD1-NH2 3.1Å; D307-R352 IonicContact OD2-NH2 3.5Å; D307-R352 PolarHBondContact OD2-NH2 3.5Å
308G94.4Very high95.7Very high25 Ų2566.1 Ų66.126%0.25834%0.337SS..Hα-helixtrans-62.3-50.9168.600000112.9K304 E305 K306 R311 L312K304-G308 PolarHBondContact O-N 2.98Å; E305-G308 WeakPolarHBondContact O-CA 3.38Å; E305-G308 PolarHBondContact O-N 2.72Å; E305-G308 VanDerWaalsContact O-N 3.09Å; K306-G308 PolarHBondContact O-N 2.56Å; G308-R311 PolarHBondContact O-N 3.06Å; G308-L312 PolarHBondContact O-N 3.32Å; G308-L312 VanDerWaalsContact O-N 3.07Å
309A94.6Very high95.6Very high39 Ų3966.6 Ų66.632%0.32234%0.342SS..Hα-helixtrans-62.4-43.2177.600000112.4E305 K306 R311 L312 A313 T344E305-A309 PolarHBondContact O-N 3.43Å; K306-A309 PolarHBondContact O-N 3.3Å; A309-R311 PolarHBondContact O-N 3.45Å; A309-L312 WeakPolarHBondContact O-CB 3.48Å; A309-L312 PolarHBondContact O-N 2.93Å; A309-L312 VanDerWaalsContact O-N 3.17Å; A309-A313 PolarHBondContact O-N 2.89Å; A309-T344 HydrophobicContact CB-CG2 4.32Å
310L95.2Very high95.4Very high35 Ų3567.7 Ų67.718%0.18334%0.344CS..Hα-helixtrans-61.2-43.2177.6-177.960.8000111.7K306 A313 G314 V341 T344 K345K306-L310 VanDerWaalsContact O-CB 3.29Å; K306-L310 WeakPolarHBondContact O-CB 3.34Å; K306-L310 PolarHBondContact O-N 3.09Å; L310-A313 PolarHBondContact O-N 2.86Å; L310-G314 PolarHBondContact O-N 3.12Å; L310-V341 HydrophobicContact CD1-CB 4.31Å; L310-V341 HydrophobicContact CD1-CG1 3.88Å; L310-V341 HydrophobicContact CD1-CG2 4.48Å; L310-T344 HydrophobicContact CB-CG2 3.86Å; L310-K345 HydrophobicContact CD1-CB 4.24Å; L310-K345 HydrophobicContact CD2-CB 4.4Å
311R94.9Very high95.1Very high174 Ų17469.8 Ų69.866%0.65735%0.351SS*.Hα-helixtrans-61.8-43.8174.1-76.9-178.9-63.2167.32.1111.5D307 G308 A309 G314 T315D307-R311 WeakPolarHBondContact O-CB 3.28Å; D307-R311 VanDerWaalsContact O-CG 3.26Å; D307-R311 WeakPolarHBondContact O-CG 3.45Å; D307-R311 PolarHBondContact O-N 3.3Å; D307-R311 VanDerWaalsContact O-N 3.11Å; D307-R311 PolarHBondContact O-NE 3.26Å; G308-R311 PolarHBondContact O-N 3.06Å; A309-R311 PolarHBondContact O-N 3.45Å; R311-G314 PolarHBondContact O-N 3.05Å; R311-T315 WeakPolarHBondContact O-CB 3.34Å; R311-T315 PolarHBondContact O-N 3.2Å; R311-T315 PolarHBondContact O-OG1 3.38Å
312L95.9Very high94.9Very high84 Ų8473.1 Ų73.144%0.4437%0.368SS..Hα-helixtrans-60.3-49.2177.6176.461.7000111.8G308 A309 G314 T315 R316G308-L312 PolarHBondContact O-N 3.32Å; G308-L312 VanDerWaalsContact O-N 3.07Å; A309-L312 WeakPolarHBondContact O-CB 3.48Å; A309-L312 PolarHBondContact O-N 2.93Å; A309-L312 VanDerWaalsContact O-N 3.17Å; L312-G314 VanDerWaalsContact C-N 3.35Å; L312-T315 PolarHBondContact O-N 2.71Å; L312-R316 HydrophobicContact CD1-CG 4.35Å; L312-R316 WeakPolarHBondContact O-CB 3.01Å; L312-R316 VanDerWaalsContact O-CG 3.3Å; L312-R316 WeakPolarHBondContact O-CG 3.38Å; L312-R316 PolarHBondContact O-N 2.67Å
313A94.2Very high94.7Very high0 Ų076 Ų760%038%0.375CS..Hα-helixtrans-61.6-43.5177.600000111.5A309 L310 R316 L317 E340 V341A309-A313 PolarHBondContact O-N 2.89Å; L310-A313 PolarHBondContact O-N 2.86Å; A313-R316 PolarHBondContact O-N 3.12Å; A313-L317 WeakPolarHBondContact O-CB 3.28Å; A313-L317 PolarHBondContact O-N 3.18Å; A313-E340 HydrophobicContact CB-CG 4.04Å; A313-V341 HydrophobicContact CB-CG2 3.64Å
314G93.9Very high94.4Very high33 Ų3379.4 Ų79.434%0.3440%0.399SS..Hα-helixtrans-62.6-43.3175.700000113.5L310 R311 L312 L317 G318L310-G314 PolarHBondContact O-N 3.12Å; R311-G314 PolarHBondContact O-N 3.05Å; L312-G314 VanDerWaalsContact C-N 3.35Å; G314-L317 PolarHBondContact O-N 2.87Å; G314-G318 PolarHBondContact O-N 3.35Å
315T95.7Very high94.2Very high87 Ų8779 Ų7953%0.53441%0.405SS..Hα-helixtrans-64.8-44.8175.3-620000111.2R311 L312 L317 G318 I319R311-T315 WeakPolarHBondContact O-CB 3.34Å; R311-T315 PolarHBondContact O-N 3.2Å; R311-T315 PolarHBondContact O-OG1 3.38Å; L312-T315 PolarHBondContact O-N 2.71Å; T315-L317 VanDerWaalsContact C-N 3.31Å; T315-L317 PolarHBondContact O-N 2.86Å; T315-G318 PolarHBondContact O-N 2.75Å; T315-G318 VanDerWaalsContact O-N 3.15Å; T315-I319 HydrophobicContact CG2-CD1 4Å; T315-I319 HydrophobicContact CG2-CG1 4.45Å; T315-I319 WeakPolarHBondContact O-CG1 3.31Å; T315-I319 PolarHBondContact O-N 3.47Å
316R96.1Very high94Very high121 Ų12180.2 Ų80.246%0.45742%0.419SS..Hα-helixtrans-57.5-45.1174.8-75.8170.9173.9168.5-2.2111.2L312 A313 I319 R320 L337L312-R316 HydrophobicContact CD1-CG 4.35Å; L312-R316 WeakPolarHBondContact O-CB 3.01Å; L312-R316 VanDerWaalsContact O-CG 3.3Å; L312-R316 WeakPolarHBondContact O-CG 3.38Å; L312-R316 PolarHBondContact O-N 2.67Å; A313-R316 PolarHBondContact O-N 3.12Å; R316-I319 PolarHBondContact O-N 3.4Å; R316-R320 WeakPolarHBondContact O-CG 3.31Å; R316-R320 PolarHBondContact O-N 3.48Å; R316-R320 VanDerWaalsContact O-N 3.16Å; R316-L337 HydrophobicContact CB-CD1 4.12Å; R316-L337 HydrophobicContact CB-CD2 3.93Å
317L93.1Very high93.8Very high30 Ų3081.7 Ų81.716%0.15743%0.426CS..Hα-helixtrans-64.7-39.5176.5-168.669.7000111.7A313 G314 T315 R320 K321 L337 I338A313-L317 WeakPolarHBondContact O-CB 3.28Å; A313-L317 PolarHBondContact O-N 3.18Å; G314-L317 PolarHBondContact O-N 2.87Å; T315-L317 VanDerWaalsContact C-N 3.31Å; T315-L317 PolarHBondContact O-N 2.86Å; L317-R320 PolarHBondContact O-N 2.88Å; L317-K321 PolarHBondContact O-N 3.3Å; L317-L337 HydrophobicContact CD1-CB 4.05Å; L317-I338 HydrophobicContact CD1-CG1 3.8Å; L317-I338 HydrophobicContact CD2-CG1 3.99Å
318G93.5Very high93.6Very high29 Ų2984.4 Ų84.430%0.29944%0.441SS..Hα-helixtrans-60.1-49174.200000112.7G314 T315 R320 K321G314-G318 PolarHBondContact O-N 3.35Å; T315-G318 PolarHBondContact O-N 2.75Å; T315-G318 VanDerWaalsContact O-N 3.15Å; G318-R320 PolarHBondContact O-N 3.47Å; G318-K321 WeakPolarHBondContact O-CB 3.29Å; G318-K321 PolarHBondContact O-N 3.01Å
319I94.2Very high93.2Very high115 Ų11586.3 Ų86.359%0.5945%0.449SS*.Hα-helixtrans-57.5-40.1176.7-67.6164.6000110.9T315 R316 K321 E322T315-I319 HydrophobicContact CG2-CD1 4Å; T315-I319 HydrophobicContact CG2-CG1 4.45Å; T315-I319 WeakPolarHBondContact O-CG1 3.31Å; T315-I319 PolarHBondContact O-N 3.47Å; R316-I319 PolarHBondContact O-N 3.4Å; I319-K321 PolarHBondContact O-N 3.42Å; I319-E322 WeakPolarHBondContact O-CB 3.45Å; I319-E322 PolarHBondContact O-N 2.89Å; I319-E322 VanDerWaalsContact O-N 3.16Å
320R93.3Very high92.9Very high49 Ų4993.7 Ų93.719%0.18547%0.469CS..Hα-helixtrans-65.7-23.3179-70.1-174.974.392.65.1113.5R316 L317 G318 E322 R323 L328 D331R316-R320 WeakPolarHBondContact O-CG 3.31Å; R316-R320 PolarHBondContact O-N 3.48Å; R316-R320 VanDerWaalsContact O-N 3.16Å; L317-R320 PolarHBondContact O-N 2.88Å; G318-R320 PolarHBondContact O-N 3.47Å; R320-E322 PolarHBondContact O-N 3.49Å; R320-R323 WeakPolarHBondContact O-CG 3.35Å; R320-R323 PolarHBondContact O-N 3.32Å; R320-L328 VanDerWaalsContact O-CD1 3.22Å; R320-L328 WeakPolarHBondContact O-CD1 3.38Å; R320-D331 IonicContact CZ-OD1 3.6Å; R320-D331 IonicContact CZ-OD2 3.25Å; R320-D331 IonicContact NE-OD1 3.89Å; R320-D331 IonicContact NH1-OD2 3.02Å; R320-D331 IonicContact NH2-OD1 2.65Å; R320-D331 PolarHBondContact NH2-OD1 3.04Å; R320-D331 IonicContact NH2-OD2 2.75Å; R320-D331 PolarHBondContact NH2-OD2 2.88Å
321K91.2Very high92.8Very high141 Ų14193.9 Ų93.961%0.61347%0.47SS*.Hα-helixtrans-69.3-21.1175.4-66.9177.7179.8-179.90113.2L317 G318 I319 R323L317-K321 PolarHBondContact O-N 3.3Å; G318-K321 WeakPolarHBondContact O-CB 3.29Å; G318-K321 PolarHBondContact O-N 3.01Å; I319-K321 PolarHBondContact O-N 3.42Å; K321-R323 VanDerWaalsContact C-N 3.28Å; K321-R323 PolarHBondContact O-N 3Å
322E93.3Very high92.8Very high163 Ų16390.9 Ų90.976%0.76247%0.473SS*.THydrogen-bonded Turntrans-84.20.6179.2-54.7-56.5138.500113I319 R320I319-E322 WeakPolarHBondContact O-CB 3.45Å; I319-E322 PolarHBondContact O-N 2.89Å; I319-E322 VanDerWaalsContact O-N 3.16Å; R320-E322 PolarHBondContact O-N 3.49Å
323R93.4Very high92.7Very high76 Ų7689.1 Ų89.129%0.28747%0.47SS..  trans-67.7131.9179-69.3-178.871.3179.3-3.7110.2R320 K321 E327 L328R320-R323 WeakPolarHBondContact O-CG 3.35Å; R320-R323 PolarHBondContact O-N 3.32Å; K321-R323 VanDerWaalsContact C-N 3.28Å; K321-R323 PolarHBondContact O-N 3Å; R323-E327 HydrophobicContact CB-CB 4.3Å; R323-E327 IonicContact CZ-OE2 3.94Å; R323-E327 PolarHBondContact NE-O 3.5Å; R323-E327 PolarHBondContact NH2-O 3.39Å; R323-E327 IonicContact NH2-OE2 2.83Å; R323-E327 PolarHBondContact NH2-OE2 2.86Å; R323-L328 HydrophobicContact CB-CD1 4.48Å; R323-L328 WeakPolarHBondContact O-CB 3.49Å
324P91.9Very high92.6Very high86 Ų8690.4 Ų90.456%0.55848%0.477SS*.  trans-79.8142.4-170.630.1-35.3000113.6V326 E327P324-V326 PolarHBondContact O-N 3.36Å; P324-E327 VanDerWaalsContact O-CB 3.29Å; P324-E327 WeakPolarHBondContact O-CB 3.37Å; P324-E327 PolarHBondContact O-N 3.36Å
325N92.5Very high92.6Very high158 Ų15894.8 Ų94.885%0.84548%0.484SS*.G310 helixtrans51.7-122.9169.7-55.5-44.6000113.4E327 L328N325-E327 VanDerWaalsContact C-N 3.25Å; N325-E327 PolarHBondContact O-N 3.43Å; N325-L328 PolarHBondContact O-N 2.95Å
326V91Very high92.6Very high128 Ų12896 Ų9678%0.77648%0.479SS*.G310 helixtrans-71.5-18.5-178.675.20000113P324 L328P324-V326 PolarHBondContact O-N 3.36Å; V326-L328 PolarHBondContact O-N 2.86Å
327E92.7Very high92.6Very high99 Ų9991.1 Ų91.146%0.46346%0.462SS..G310 helixtrans-70.8-14.4176-66.1-62.2143.200112.5R323 P324 N325 C329R323-E327 HydrophobicContact CB-CB 4.3Å; R323-E327 IonicContact CZ-OE2 3.94Å; R323-E327 PolarHBondContact NE-O 3.5Å; R323-E327 PolarHBondContact NH2-O 3.39Å; R323-E327 IonicContact NH2-OE2 2.83Å; R323-E327 PolarHBondContact NH2-OE2 2.86Å; P324-E327 VanDerWaalsContact O-CB 3.29Å; P324-E327 WeakPolarHBondContact O-CB 3.37Å; P324-E327 PolarHBondContact O-N 3.36Å; N325-E327 VanDerWaalsContact C-N 3.25Å; N325-E327 PolarHBondContact O-N 3.43Å; E327-C329 PolarHBondContact O-N 2.9Å
328L89.9Confident92.7Very high101 Ų10192.7 Ų92.753%0.52947%0.47SS..SBendtrans-71.564.3167.8-17158000110.6R320 R323 N325 V326R320-L328 VanDerWaalsContact O-CD1 3.22Å; R320-L328 WeakPolarHBondContact O-CD1 3.38Å; R323-L328 HydrophobicContact CB-CD1 4.48Å; R323-L328 WeakPolarHBondContact O-CB 3.49Å; N325-L328 PolarHBondContact O-N 2.95Å; V326-L328 PolarHBondContact O-N 2.86Å
329C86.5Confident92.8Very high64 Ų6495.8 Ų95.843%0.43248%0.477SS..  trans-89.9134.5-172.1-1710000111.2E327 D331E327-C329 PolarHBondContact O-N 2.9Å; C329-D331 PolarHBondContact O-N 3.12Å
330R88.5Confident92.9Very high195 Ų19592.6 Ų92.674%0.73646%0.459SS*.  trans-81.670.6168.3-63.5-179.4-178.2-178.9-0.3109.4Y335R330-Y335 HydrophobicContact CB-CE2 4.12Å; R330-Y335 WeakPolarHBondContact O-CE2 3.31Å
331D93.2Very high93Very high39 Ų3991.9 Ų91.921%0.20946%0.46CS..  trans-87.4172-179.469.1-7.8000111.9R320 C329 A333 N334 Y335R320-D331 IonicContact CZ-OD1 3.6Å; R320-D331 IonicContact CZ-OD2 3.25Å; R320-D331 IonicContact NE-OD1 3.89Å; R320-D331 IonicContact NH1-OD2 3.02Å; R320-D331 IonicContact NH2-OD1 2.65Å; R320-D331 PolarHBondContact NH2-OD1 3.04Å; R320-D331 IonicContact NH2-OD2 2.75Å; R320-D331 PolarHBondContact NH2-OD2 2.88Å; C329-D331 PolarHBondContact O-N 3.12Å; D331-A333 PolarHBondContact O-N 3.45Å; D331-N334 WeakPolarHBondContact O-CB 3.46Å; D331-N334 PolarHBondContact O-N 3.26Å; D331-N334 VanDerWaalsContact OD1-CB 3.25Å; D331-N334 WeakPolarHBondContact OD1-CB 3.37Å; D331-N334 PolarHBondContact OD1-N 2.95Å; D331-Y335 WeakPolarHBondContact O-CD2 3.44Å; D331-Y335 PolarHBondContact O-N 3.39Å; D331-Y335 VanDerWaalsContact O-N 3.1Å
332P94.8Very high93.2Very high111 Ų11190.4 Ų90.472%0.72146%0.455SS*.Hα-helixtrans-55.1-34.9178.3-29.237.3000113.8Y335 R336P332-Y335 PolarHBondContact O-N 3.39Å; P332-R336 WeakPolarHBondContact O-CB 3.46Å; P332-R336 PolarHBondContact O-N 2.95Å
333A92.9Very high93.4Very high46 Ų4685.8 Ų85.838%0.3843%0.434SS..Hα-helixtrans-65.1-41.8176.600000111.8D331 R336 L337D331-A333 PolarHBondContact O-N 3.45Å; A333-R336 PolarHBondContact O-N 3.5Å; A333-L337 WeakPolarHBondContact O-CB 3.31Å; A333-L337 WeakPolarHBondContact O-CG 3.34Å; A333-L337 PolarHBondContact O-N 3.41Å
334N93Very high93.5Very high28 Ų2883 Ų8315%0.1543%0.425CS..Hα-helixtrans-62.8-45.3175.1-171.678.3000111.7D331 L337 I338D331-N334 WeakPolarHBondContact O-CB 3.46Å; D331-N334 PolarHBondContact O-N 3.26Å; D331-N334 VanDerWaalsContact OD1-CB 3.25Å; D331-N334 WeakPolarHBondContact OD1-CB 3.37Å; D331-N334 PolarHBondContact OD1-N 2.95Å; N334-L337 PolarHBondContact O-N 3.21Å; N334-I338 WeakPolarHBondContact O-CG1 3.31Å; N334-I338 PolarHBondContact O-N 2.84Å; N334-I338 VanDerWaalsContact O-N 3.14Å
335Y94.7Very high93.7Very high124 Ų12485 Ų8549%0.48643%0.425SS..Hα-helixtrans-62-43.1176.6-70.4-65.2000112.3R330 D331 P332 I338 Q339R330-Y335 HydrophobicContact CB-CE2 4.12Å; R330-Y335 WeakPolarHBondContact O-CE2 3.31Å; D331-Y335 WeakPolarHBondContact O-CD2 3.44Å; D331-Y335 PolarHBondContact O-N 3.39Å; D331-Y335 VanDerWaalsContact O-N 3.1Å; P332-Y335 PolarHBondContact O-N 3.39Å; Y335-I338 PolarHBondContact O-N 3.25Å; Y335-Q339 WeakPolarHBondContact O-CG 3.46Å; Y335-Q339 PolarHBondContact O-N 2.96Å
336R95.4Very high93.8Very high113 Ų11384.2 Ų84.243%0.42641%0.41SS..Hα-helixtrans-67.4-38.9179.1-175.664.1-163.2128.54.6112.5P332 A333 I338 Q339 E340 E343P332-R336 WeakPolarHBondContact O-CB 3.46Å; P332-R336 PolarHBondContact O-N 2.95Å; A333-R336 PolarHBondContact O-N 3.5Å; R336-I338 VanDerWaalsContact C-N 3.32Å; R336-I338 PolarHBondContact O-N 3.26Å; R336-Q339 PolarHBondContact O-N 3.42Å; R336-E340 WeakPolarHBondContact O-CB 3.4Å; R336-E340 PolarHBondContact O-N 2.82Å; R336-E343 IonicContact CZ-OE1 3.77Å; R336-E343 IonicContact CZ-OE2 3.23Å; R336-E343 VanDerWaalsContact NH1-CD 3.29Å; R336-E343 IonicContact NH1-OE1 3.87Å; R336-E343 PolarHBondContact NH1-OE1 3.39Å; R336-E343 IonicContact NH1-OE2 2.74Å; R336-E343 PolarHBondContact NH1-OE2 3Å; R336-E343 VanDerWaalsContact NH1-OE2 3.07Å; R336-E343 IonicContact NH2-OE1 2.99Å; R336-E343 IonicContact NH2-OE2 3.98Å; R336-E343 PolarHBondContact NH2-OE2 3.21Å
337L94.9Very high94.1Very high19 Ų1981.9 Ų81.910%0.09939%0.393CS..Hα-helixtrans-62.1-39.6175-78.3169.8000112.1R316 L317 A333 N334 E340 V341R316-L337 HydrophobicContact CB-CD1 4.12Å; R316-L337 HydrophobicContact CB-CD2 3.93Å; L317-L337 HydrophobicContact CD1-CB 4.05Å; A333-L337 WeakPolarHBondContact O-CB 3.31Å; A333-L337 WeakPolarHBondContact O-CG 3.34Å; A333-L337 PolarHBondContact O-N 3.41Å; N334-L337 PolarHBondContact O-N 3.21Å; L337-E340 PolarHBondContact O-N 3.05Å; L337-V341 WeakPolarHBondContact O-CG2 3.47Å; L337-V341 PolarHBondContact O-N 3.32Å
338I94.9Very high94.3Very high62 Ų6277.3 Ų77.332%0.31837%0.373SS..Hα-helixtrans-62.1-48.1174.4-67.4167.9000110L317 N334 Y335 R336 E340 V341 E342L317-I338 HydrophobicContact CD1-CG1 3.8Å; L317-I338 HydrophobicContact CD2-CG1 3.99Å; N334-I338 WeakPolarHBondContact O-CG1 3.31Å; N334-I338 PolarHBondContact O-N 2.84Å; N334-I338 VanDerWaalsContact O-N 3.14Å; Y335-I338 PolarHBondContact O-N 3.25Å; R336-I338 VanDerWaalsContact C-N 3.32Å; R336-I338 PolarHBondContact O-N 3.26Å; I338-E340 PolarHBondContact O-N 3.33Å; I338-V341 PolarHBondContact O-N 3.44Å; I338-E342 WeakPolarHBondContact O-CG 3.3Å; I338-E342 PolarHBondContact O-N 2.95Å
339Q95.7Very high94.6Very high95 Ų9577.7 Ų77.744%0.44437%0.371SS..Hα-helixtrans-61.4-42.4176.9-71176.6-16.300112.6Y335 R336 V341 E342 E343Y335-Q339 WeakPolarHBondContact O-CG 3.46Å; Y335-Q339 PolarHBondContact O-N 2.96Å; R336-Q339 PolarHBondContact O-N 3.42Å; Q339-V341 VanDerWaalsContact C-N 3.31Å; Q339-V341 PolarHBondContact O-N 3.01Å; Q339-E342 PolarHBondContact O-N 3.45Å; Q339-E342 VanDerWaalsContact O-N 3.17Å; Q339-E343 WeakPolarHBondContact O-CB 3.48Å; Q339-E343 VanDerWaalsContact O-CG 3.29Å; Q339-E343 WeakPolarHBondContact O-CG 3.28Å; Q339-E343 PolarHBondContact O-N 3.03Å
340E96.4Very high95.1Very high47 Ų4780.2 Ų80.222%0.2238%0.377CS..Hα-helixtrans-59.1-42.8177-179.6-175169.900111A313 R336 L337 I338 T344A313-E340 HydrophobicContact CB-CG 4.04Å; R336-E340 WeakPolarHBondContact O-CB 3.4Å; R336-E340 PolarHBondContact O-N 2.82Å; L337-E340 PolarHBondContact O-N 3.05Å; I338-E340 PolarHBondContact O-N 3.33Å; E340-T344 VanDerWaalsContact O-CB 3.27Å; E340-T344 WeakPolarHBondContact O-CB 3.39Å; E340-T344 PolarHBondContact O-N 3.23Å; E340-T344 PolarHBondContact O-OG1 2.69Å
341V96Very high95.6Very high34 Ų3472.8 Ų72.821%0.20635%0.352CS..Hα-helixtrans-62.8-45.4174.8168.30000111L310 A313 L337 I338 Q339 K345L310-V341 HydrophobicContact CD1-CB 4.31Å; L310-V341 HydrophobicContact CD1-CG1 3.88Å; L310-V341 HydrophobicContact CD1-CG2 4.48Å; A313-V341 HydrophobicContact CB-CG2 3.64Å; L337-V341 WeakPolarHBondContact O-CG2 3.47Å; L337-V341 PolarHBondContact O-N 3.32Å; I338-V341 PolarHBondContact O-N 3.44Å; Q339-V341 VanDerWaalsContact C-N 3.31Å; Q339-V341 PolarHBondContact O-N 3.01Å; V341-K345 WeakPolarHBondContact O-CB 3.34Å; V341-K345 PolarHBondContact O-N 3.48Å
342E95.7Very high95.8Very high111 Ų11177 Ų7752%0.51937%0.365SS..Hα-helixtrans-66.2-41179.2-71.8178.2169.900113.1I338 Q339 R346I338-E342 WeakPolarHBondContact O-CG 3.3Å; I338-E342 PolarHBondContact O-N 2.95Å; Q339-E342 PolarHBondContact O-N 3.45Å; Q339-E342 VanDerWaalsContact O-N 3.17Å; E342-R346 VanDerWaalsContact O-CG 3.3Å; E342-R346 WeakPolarHBondContact O-CG 3.39Å; E342-R346 PolarHBondContact O-N 3.43Å; E342-R346 PolarHBondContact O-NE 3.18Å
343E96.5Very high95.9Very high65 Ų6577.5 Ų77.530%0.30436%0.357SS..Hα-helixtrans-63-57173.8-73.6162.6-161.500110.5R336 Q339 K345 R346 D347R336-E343 IonicContact CZ-OE1 3.77Å; R336-E343 IonicContact CZ-OE2 3.23Å; R336-E343 VanDerWaalsContact NH1-CD 3.29Å; R336-E343 IonicContact NH1-OE1 3.87Å; R336-E343 PolarHBondContact NH1-OE1 3.39Å; R336-E343 IonicContact NH1-OE2 2.74Å; R336-E343 PolarHBondContact NH1-OE2 3Å; R336-E343 VanDerWaalsContact NH1-OE2 3.07Å; R336-E343 IonicContact NH2-OE1 2.99Å; R336-E343 IonicContact NH2-OE2 3.98Å; R336-E343 PolarHBondContact NH2-OE2 3.21Å; Q339-E343 WeakPolarHBondContact O-CB 3.48Å; Q339-E343 VanDerWaalsContact O-CG 3.29Å; Q339-E343 WeakPolarHBondContact O-CG 3.28Å; Q339-E343 PolarHBondContact O-N 3.03Å; E343-K345 VanDerWaalsContact C-N 3.27Å; E343-K345 PolarHBondContact O-N 2.94Å; E343-R346 WeakPolarHBondContact O-CB 3.41Å; E343-R346 PolarHBondContact O-N 2.82Å; E343-D347 PolarHBondContact O-N 3.45Å
344T95.4Very high96.1Very high17 Ų1783.7 Ų83.710%0.10437%0.371CS..Hα-helixtrans-62.1-36.9-176.8-490000111.4K306 A309 L310 E340 D347 V348K306-T344 HydrophobicContact CB-CG2 4.2Å; K306-T344 WeakPolarHBondContact O-CG2 3.37Å; A309-T344 HydrophobicContact CB-CG2 4.32Å; L310-T344 HydrophobicContact CB-CG2 3.86Å; E340-T344 VanDerWaalsContact O-CB 3.27Å; E340-T344 WeakPolarHBondContact O-CB 3.39Å; E340-T344 PolarHBondContact O-N 3.23Å; E340-T344 PolarHBondContact O-OG1 2.69Å; T344-D347 PolarHBondContact O-N 2.79Å; T344-V348 VanDerWaalsContact O-CG2 3.29Å; T344-V348 WeakPolarHBondContact O-CG2 3.35Å; T344-V348 PolarHBondContact O-N 3.31Å
345K96.2Very high96.4Very high130 Ų13083.8 Ų83.857%0.56537%0.371SS*.Hα-helixtrans-63.4-43.2175.5-176.1179.3177.6-174.70111.8L310 V341 E343 V348 E349L310-K345 HydrophobicContact CD1-CB 4.24Å; L310-K345 HydrophobicContact CD2-CB 4.4Å; V341-K345 WeakPolarHBondContact O-CB 3.34Å; V341-K345 PolarHBondContact O-N 3.48Å; E343-K345 VanDerWaalsContact C-N 3.27Å; E343-K345 PolarHBondContact O-N 2.94Å; K345-V348 PolarHBondContact O-N 3.16Å; K345-E349 PolarHBondContact O-N 3.38Å
346R96.5Very high96.5Very high140 Ų14083.7 Ų83.753%0.52838%0.375SS..Hα-helixtrans-64-42.6175.8-76.3-178.7-68162.3-0.9111.3E342 E343 E349 Q350E342-R346 VanDerWaalsContact O-CG 3.3Å; E342-R346 WeakPolarHBondContact O-CG 3.39Å; E342-R346 PolarHBondContact O-N 3.43Å; E342-R346 PolarHBondContact O-NE 3.18Å; E343-R346 WeakPolarHBondContact O-CB 3.41Å; E343-R346 PolarHBondContact O-N 2.82Å; R346-E349 PolarHBondContact O-N 3.08Å; R346-Q350 WeakPolarHBondContact O-CG 3.5Å; R346-Q350 PolarHBondContact O-N 3.08Å
347D96.6Very high96.6Very high79 Ų7980.8 Ų80.842%0.42238%0.375SS..Hα-helixtrans-62.9-43.8178.4-66-15.2000111.5E343 T344 E349 Q350 L351E343-D347 PolarHBondContact O-N 3.45Å; T344-D347 PolarHBondContact O-N 2.79Å; D347-E349 VanDerWaalsContact C-N 3.32Å; D347-E349 PolarHBondContact O-N 2.92Å; D347-Q350 PolarHBondContact O-N 2.95Å; D347-L351 WeakPolarHBondContact O-CG 3.3Å; D347-L351 PolarHBondContact O-N 2.86Å
348V96.8Very high96.7Very high4 Ų480.4 Ų80.42%0.02437%0.374CS..Hα-helixtrans-60.2-42.4174.3169.20000111.2I303 K306 T344 K345 L351 R352I303-V348 HydrophobicContact CG2-CG1 4.47Å; K306-V348 HydrophobicContact CB-CG2 3.58Å; T344-V348 VanDerWaalsContact O-CG2 3.29Å; T344-V348 WeakPolarHBondContact O-CG2 3.35Å; T344-V348 PolarHBondContact O-N 3.31Å; K345-V348 PolarHBondContact O-N 3.16Å; V348-L351 PolarHBondContact O-N 2.73Å; V348-R352 HydrophobicContact CG1-CG 4.49Å; V348-R352 WeakPolarHBondContact O-CB 3.22Å; V348-R352 WeakPolarHBondContact O-CG 3.19Å; V348-R352 PolarHBondContact O-N 3.36Å
349E96.4Very high96.8Very high108 Ų10880.6 Ų80.651%0.50537%0.374SS..Hα-helixtrans-64-43.7177.8-172.5171.3-173.100111.8K345 R346 D347 R352 Q353K345-E349 PolarHBondContact O-N 3.38Å; R346-E349 PolarHBondContact O-N 3.08Å; D347-E349 VanDerWaalsContact C-N 3.32Å; D347-E349 PolarHBondContact O-N 2.92Å; E349-R352 PolarHBondContact O-N 3.04Å; E349-Q353 WeakPolarHBondContact O-CG 3.33Å; E349-Q353 PolarHBondContact O-N 3.13Å
350Q97.2Very high96.9Very high117 Ų11779.4 Ų79.455%0.54737%0.371SS..Hα-helixtrans-62.1-43.5174.7-70.9-179.816.800112.1R346 D347 R352 Q353 R354R346-Q350 WeakPolarHBondContact O-CG 3.5Å; R346-Q350 PolarHBondContact O-N 3.08Å; D347-Q350 PolarHBondContact O-N 2.95Å; Q350-R352 VanDerWaalsContact C-N 3.34Å; Q350-R352 PolarHBondContact O-N 3.44Å; Q350-Q353 PolarHBondContact O-N 3.12Å; Q350-R354 WeakPolarHBondContact O-CG 3.42Å; Q350-R354 PolarHBondContact O-N 3.32Å
351L97.8Very high97Very high39 Ų3979.6 Ų79.620%0.20438%0.377CS..Hα-helixtrans-61.8-41.4176.2-72.4171.8000111.6L299 A302 I303 K306 D347 V348 R354 L355L299-L351 HydrophobicContact CD2-CD2 3.88Å; A302-L351 HydrophobicContact CB-CD1 4.08Å; A302-L351 HydrophobicContact CB-CD2 4.46Å; I303-L351 HydrophobicContact CD1-CB 4.15Å; I303-L351 HydrophobicContact CG1-CB 3.55Å; I303-L351 HydrophobicContact CG1-CD1 4.27Å; K306-L351 HydrophobicContact CD-CD1 4.24Å; D347-L351 WeakPolarHBondContact O-CG 3.3Å; D347-L351 PolarHBondContact O-N 2.86Å; V348-L351 PolarHBondContact O-N 2.73Å; L351-R354 PolarHBondContact O-N 2.92Å; L351-L355 WeakPolarHBondContact O-CB 3.38Å; L351-L355 PolarHBondContact O-N 3.37Å
352R97.8Very high97.1Very high128 Ų12879.2 Ų79.248%0.48337%0.374SS..Hα-helixtrans-64.2-38.9175.7-74.5176.2-177169.26.9112.4I303 D307 V348 E349 Q350 L355 H356I303-R352 HydrophobicContact CD1-CG 3.87Å; I303-R352 HydrophobicContact CG1-CG 4.33Å; I303-R352 HydrophobicContact CG2-CG 4.42Å; D307-R352 IonicContact OD1-NH2 2.78Å; D307-R352 PolarHBondContact OD1-NH2 3.1Å; D307-R352 IonicContact OD2-NH2 3.5Å; D307-R352 PolarHBondContact OD2-NH2 3.5Å; V348-R352 HydrophobicContact CG1-CG 4.49Å; V348-R352 WeakPolarHBondContact O-CB 3.22Å; V348-R352 WeakPolarHBondContact O-CG 3.19Å; V348-R352 PolarHBondContact O-N 3.36Å; E349-R352 PolarHBondContact O-N 3.04Å; Q350-R352 VanDerWaalsContact C-N 3.34Å; Q350-R352 PolarHBondContact O-N 3.44Å; R352-L355 PolarHBondContact O-N 3.48Å; R352-H356 PolarHBondContact O-N 2.99Å
353Q97.2Very high97.2Very high121 Ų12179.2 Ų79.257%0.56537%0.372SS*.Hα-helixtrans-62.8-42.6173.5-70.8173.99.800111.6E349 Q350 H356 A357E349-Q353 WeakPolarHBondContact O-CG 3.33Å; E349-Q353 PolarHBondContact O-N 3.13Å; Q350-Q353 PolarHBondContact O-N 3.12Å; Q353-H356 PolarHBondContact O-N 3.31Å; Q353-A357 PolarHBondContact O-N 3.22Å
354R97.6Very high97.2Very high177 Ų17778.5 Ų78.567%0.66838%0.377SS*.Hα-helixtrans-65.9-38.7175.5-67-61.6179.8-178.9-1.4112.5L299 Q350 L351 H356 A357 A358L299-R354 HydrophobicContact CD1-CB 4.35Å; L299-R354 HydrophobicContact CD2-CB 4.25Å; Q350-R354 WeakPolarHBondContact O-CG 3.42Å; Q350-R354 PolarHBondContact O-N 3.32Å; L351-R354 PolarHBondContact O-N 2.92Å; R354-H356 VanDerWaalsContact C-N 3.3Å; R354-H356 PolarHBondContact O-N 3.03Å; R354-A357 PolarHBondContact O-N 3.15Å; R354-A358 VanDerWaalsContact O-CB 3.31Å; R354-A358 WeakPolarHBondContact O-CB 3.46Å; R354-A358 PolarHBondContact O-N 3.34Å
355L97.8Very high97.4Very high30 Ų3078.8 Ų78.816%0.15738%0.378CS..Hα-helixtrans-59.9-41.5174.3-175.472.8000111.6L296 L299 E300 I303 L351 R352 H359L296-L355 HydrophobicContact CD2-CD1 3.61Å; L296-L355 HydrophobicContact CD2-CG 4.44Å; L299-L355 HydrophobicContact CB-CB 4.49Å; L299-L355 HydrophobicContact CB-CD1 3.78Å; L299-L355 HydrophobicContact CD1-CB 4.5Å; L299-L355 HydrophobicContact CD1-CD1 4.41Å; E300-L355 HydrophobicContact CG-CD1 3.8Å; E300-L355 HydrophobicContact CG-CD2 4.17Å; I303-L355 HydrophobicContact CD1-CB 4.14Å; I303-L355 HydrophobicContact CD1-CD2 3.82Å; I303-L355 HydrophobicContact CD1-CG 4.49Å; L351-L355 WeakPolarHBondContact O-CB 3.38Å; L351-L355 PolarHBondContact O-N 3.37Å; R352-L355 PolarHBondContact O-N 3.48Å; L355-H359 PolarHBondContact O-N 2.87Å; L355-H359 PolarHBondContact O-ND1 2.88Å
356H96.9Very high97.4Very high121 Ų12175 Ų7556%0.5637%0.367SS*.Hα-helixtrans-65.7-47.2176.5-174.548.7000112R352 Q353 R354 A358 H359 D360R352-H356 PolarHBondContact O-N 2.99Å; Q353-H356 PolarHBondContact O-N 3.31Å; R354-H356 VanDerWaalsContact C-N 3.3Å; R354-H356 PolarHBondContact O-N 3.03Å; H356-A358 VanDerWaalsContact C-N 3.31Å; H356-A358 PolarHBondContact O-N 3.41Å; H356-H359 WeakPolarHBondContact O-CB 3.41Å; H356-H359 PolarHBondContact O-N 2.92Å; H356-D360 IonicContact CE1-OD2 3.85Å; H356-D360 IonicContact NE2-OD2 3.96Å; H356-D360 PolarHBondContact O-N 3.28Å
357A97.5Very high97.5Very high52 Ų5276.4 Ų76.443%0.4337%0.373SS..Hα-helixtrans-61.2-38.6176.700000112.6Q353 R354 D360 S361Q353-A357 PolarHBondContact O-N 3.22Å; R354-A357 PolarHBondContact O-N 3.15Å; A357-D360 PolarHBondContact O-N 2.88Å; A357-S361 PolarHBondContact O-N 2.92Å
358A97.7Very high97.6Very high11 Ų1179.7 Ų79.79%0.09138%0.379CS..Hα-helixtrans-64.7-41.1175.500000111.9M292 L296 L299 R354 H356 D360 S361 L362M292-A358 HydrophobicContact SD-CB 3.72Å; L296-A358 HydrophobicContact CD2-CB 3.48Å; L296-A358 VanDerWaalsContact CD2-CB 3.48Å; L296-A358 HydrophobicContact CG-CB 4.24Å; L299-A358 HydrophobicContact CD1-CB 4.15Å; R354-A358 VanDerWaalsContact O-CB 3.31Å; R354-A358 WeakPolarHBondContact O-CB 3.46Å; R354-A358 PolarHBondContact O-N 3.34Å; H356-A358 VanDerWaalsContact C-N 3.31Å; H356-A358 PolarHBondContact O-N 3.41Å; A358-D360 VanDerWaalsContact C-N 3.34Å; A358-D360 PolarHBondContact O-N 3.43Å; A358-S361 PolarHBondContact O-N 2.71Å; A358-L362 WeakPolarHBondContact O-CB 3.44Å; A358-L362 PolarHBondContact O-N 3.02Å
359H97.8Very high97.6Very high66 Ų6681.8 Ų81.831%0.30639%0.389SS..Hα-helixtrans-60.3-42.3173.2-88.387.2000112.3L296 L355 H356 L362 K363L296-H359 VanDerWaalsContact CD2-ND1 3.28Å; L296-H359 WeakPolarHBondContact CD2-ND1 3.2Å; L355-H359 PolarHBondContact O-N 2.87Å; L355-H359 PolarHBondContact O-ND1 2.88Å; H356-H359 WeakPolarHBondContact O-CB 3.41Å; H356-H359 PolarHBondContact O-N 2.92Å; H359-L362 PolarHBondContact O-N 2.64Å; H359-K363 WeakPolarHBondContact O-CG 3.38Å; H359-K363 PolarHBondContact O-N 2.97Å
360D97.7Very high97.7Very high71 Ų7181.8 Ų81.838%0.3839%0.391SS..Hα-helixtrans-68.7-38.2178.7-70.6-19.1000111.9H356 A357 A358 K363 A364H356-D360 IonicContact CE1-OD2 3.85Å; H356-D360 IonicContact NE2-OD2 3.96Å; H356-D360 PolarHBondContact O-N 3.28Å; A357-D360 PolarHBondContact O-N 2.88Å; A358-D360 VanDerWaalsContact C-N 3.34Å; A358-D360 PolarHBondContact O-N 3.43Å; D360-K363 PolarHBondContact O-N 3.37Å; D360-K363 IonicContact OD1-NZ 3.4Å; D360-A364 PolarHBondContact O-N 3.39Å
361S97.4Very high97.7Very high51 Ų5179.3 Ų79.336%0.35738%0.382SS..Hα-helixtrans-61.3-45.2171.7-167.80000111.6A357 A358 K363 A364 L365A357-S361 PolarHBondContact O-N 2.92Å; A358-S361 PolarHBondContact O-N 2.71Å; S361-K363 PolarHBondContact O-N 2.94Å; S361-A364 WeakPolarHBondContact O-CB 3.33Å; S361-A364 PolarHBondContact O-N 2.99Å; S361-A364 VanDerWaalsContact O-N 3.14Å; S361-L365 WeakPolarHBondContact O-CG 3.47Å; S361-L365 PolarHBondContact O-N 2.89Å
362L97.9Very high97.7Very high25 Ų2578.8 Ų78.813%0.13138%0.379CS..Hα-helixtrans-59.2-47.1177.3179.960.1000111.4I289 M292 E293 L296 A358 H359 A364 L365 C366I289-L362 HydrophobicContact CB-CD1 4.34Å; I289-L362 HydrophobicContact CG1-CD1 4.34Å; I289-L362 HydrophobicContact CG2-CD1 3.87Å; M292-L362 HydrophobicContact CB-CD1 4.31Å; M292-L362 HydrophobicContact CG-CB 3.88Å; M292-L362 HydrophobicContact CG-CD1 4.41Å; E293-L362 HydrophobicContact CG-CD1 4.18Å; E293-L362 HydrophobicContact CG-CD2 4.11Å; L296-L362 HydrophobicContact CD1-CD2 3.56Å; A358-L362 WeakPolarHBondContact O-CB 3.44Å; A358-L362 PolarHBondContact O-N 3.02Å; H359-L362 PolarHBondContact O-N 2.64Å; L362-A364 VanDerWaalsContact C-N 3.28Å; L362-A364 PolarHBondContact O-N 3.1Å; L362-L365 WeakPolarHBondContact O-CB 3.4Å; L362-L365 PolarHBondContact O-N 2.97Å; L362-L365 VanDerWaalsContact O-N 3.16Å; L362-C366 PolarHBondContact O-N 2.72Å; L362-C366 PolarHBondContact O-SG 2.99Å
363K97.8Very high97.8Very high112 Ų11276 Ų7649%0.48737%0.372SS..Hα-helixtrans-58.9-39.8175.1-70.9170.7-171.5164.50112.2H359 D360 S361 R367H359-K363 WeakPolarHBondContact O-CG 3.38Å; H359-K363 PolarHBondContact O-N 2.97Å; D360-K363 PolarHBondContact O-N 3.37Å; D360-K363 IonicContact OD1-NZ 3.4Å; S361-K363 PolarHBondContact O-N 2.94Å; K363-R367 WeakPolarHBondContact O-CG 3.48Å; K363-R367 PolarHBondContact O-N 3.35Å; K363-R367 VanDerWaalsContact O-N 3.15Å
364A97.7Very high97.8Very high50 Ų5076.2 Ų76.241%0.41337%0.373SS..Hα-helixtrans-65.1-42.3176.600000111.7D360 S361 L362 R367 R368D360-A364 PolarHBondContact O-N 3.39Å; S361-A364 WeakPolarHBondContact O-CB 3.33Å; S361-A364 PolarHBondContact O-N 2.99Å; S361-A364 VanDerWaalsContact O-N 3.14Å; L362-A364 VanDerWaalsContact C-N 3.28Å; L362-A364 PolarHBondContact O-N 3.1Å; A364-R367 PolarHBondContact O-N 3.48Å; A364-R368 WeakPolarHBondContact O-CG 3.26Å; A364-R368 PolarHBondContact O-N 3.46Å
365L98.2Very high97.8Very high23 Ų2370.9 Ų70.912%0.1236%0.355CS..Hα-helixtrans-61.9-46.6175.2-68.7168.5000111.8I285 E288 I289 M292 S361 L362 R367 R368 Q369I285-L365 HydrophobicContact CD1-CD2 3.66Å; E288-L365 HydrophobicContact CB-CD1 4.31Å; E288-L365 HydrophobicContact CB-CD2 4.41Å; E288-L365 HydrophobicContact CG-CD1 3.88Å; E288-L365 HydrophobicContact CG-CD2 4.22Å; I289-L365 HydrophobicContact CD1-CB 4.2Å; I289-L365 HydrophobicContact CG1-CB 3.59Å; I289-L365 HydrophobicContact CG1-CD1 4.3Å; M292-L365 HydrophobicContact CB-CD1 4.32Å; S361-L365 WeakPolarHBondContact O-CG 3.47Å; S361-L365 PolarHBondContact O-N 2.89Å; L362-L365 WeakPolarHBondContact O-CB 3.4Å; L362-L365 PolarHBondContact O-N 2.97Å; L362-L365 VanDerWaalsContact O-N 3.16Å; L365-R367 VanDerWaalsContact C-N 3.27Å; L365-R367 PolarHBondContact O-N 2.85Å; L365-R368 PolarHBondContact O-N 2.84Å; L365-R368 VanDerWaalsContact O-N 3.12Å; L365-Q369 PolarHBondContact O-N 3.3Å
366C98Very high97.8Very high49 Ų4970.1 Ų70.133%0.33135%0.351SS..Hα-helixtrans-58.3-37.7176.1-65.10000112.3L362 Q369 L370L362-C366 PolarHBondContact O-N 2.72Å; L362-C366 PolarHBondContact O-SG 2.99Å; C366-Q369 WeakPolarHBondContact O-CB 3.28Å; C366-Q369 PolarHBondContact O-N 2.87Å; C366-L370 WeakPolarHBondContact O-CG 3.13Å; C366-L370 PolarHBondContact O-N 3.39Å
367R98.1Very high97.8Very high170 Ų17070.7 Ų70.764%0.64235%0.354SS*.Hα-helixtrans-65.2-46.2175-71.1172.9-175.8177.41111.5K363 A364 L365 Q369 L370 D371K363-R367 WeakPolarHBondContact O-CG 3.48Å; K363-R367 PolarHBondContact O-N 3.35Å; K363-R367 VanDerWaalsContact O-N 3.15Å; A364-R367 PolarHBondContact O-N 3.48Å; L365-R367 VanDerWaalsContact C-N 3.27Å; L365-R367 PolarHBondContact O-N 2.85Å; R367-Q369 VanDerWaalsContact C-N 3.26Å; R367-Q369 PolarHBondContact O-N 3.49Å; R367-L370 PolarHBondContact O-N 2.61Å; R367-D371 PolarHBondContact O-N 3.44Å
368R97.7Very high97.9Very high148 Ų14869.2 Ų69.256%0.55834%0.339SS*.Hα-helixtrans-62.1-34.9176.6-66.7-62.395.5159.9-0.3112.1I285 A364 L365 D371 L372I285-R368 HydrophobicContact CD1-CB 4.41Å; A364-R368 WeakPolarHBondContact O-CG 3.26Å; A364-R368 PolarHBondContact O-N 3.46Å; L365-R368 PolarHBondContact O-N 2.84Å; L365-R368 VanDerWaalsContact O-N 3.12Å; R368-D371 IonicContact CZ-OD2 3.69Å; R368-D371 IonicContact NE-OD2 2.8Å; R368-D371 PolarHBondContact NE-OD2 3.34Å; R368-D371 IonicContact NH1-OD2 3.12Å; R368-D371 IonicContact NH2-OD2 3.88Å; R368-D371 PolarHBondContact NH2-OD2 3.2Å; R368-D371 PolarHBondContact O-N 3.17Å; R368-L372 WeakPolarHBondContact O-CB 3.23Å; R368-L372 WeakPolarHBondContact O-CG 3.32Å; R368-L372 PolarHBondContact O-N 2.87Å
369Q98.2Very high97.8Very high49 Ų4969.4 Ų69.423%0.22934%0.338CS..Hα-helixtrans-58.3-52.8173.4-175.6-167.5-15.400110.9L282 I285 I286 I289 L365 C366 R367 D371 L372 E373L282-Q369 HydrophobicContact CD1-CB 4.42Å; L282-Q369 HydrophobicContact CD1-CG 3.63Å; I285-Q369 HydrophobicContact CG2-CB 4.01Å; I286-Q369 HydrophobicContact CG1-CG 4.48Å; I289-Q369 HydrophobicContact CD1-CB 4.15Å; I289-Q369 VanDerWaalsContact CD1-OE1 3.28Å; L365-Q369 PolarHBondContact O-N 3.3Å; C366-Q369 WeakPolarHBondContact O-CB 3.28Å; C366-Q369 PolarHBondContact O-N 2.87Å; R367-Q369 VanDerWaalsContact C-N 3.26Å; R367-Q369 PolarHBondContact O-N 3.49Å; Q369-D371 VanDerWaalsContact C-N 3.35Å; Q369-D371 PolarHBondContact O-N 2.88Å; Q369-L372 PolarHBondContact O-N 3.32Å; Q369-E373 WeakPolarHBondContact CG-OE1 3.26Å; Q369-E373 PolarHBondContact NE2-OE1 2.83Å; Q369-E373 WeakPolarHBondContact O-CG 3.26Å; Q369-E373 PolarHBondContact O-N 3.49Å
370L97.8Very high97.9Very high107 Ų10767.7 Ų67.756%0.5634%0.335SS*.Hα-helixtrans-60.1-44.1178.9-66.5172.7000111.9C366 R367 L372 E373 E374C366-L370 WeakPolarHBondContact O-CG 3.13Å; C366-L370 PolarHBondContact O-N 3.39Å; R367-L370 PolarHBondContact O-N 2.61Å; L370-L372 VanDerWaalsContact C-N 3.32Å; L370-L372 PolarHBondContact O-N 3.08Å; L370-E373 PolarHBondContact O-N 3.38Å; L370-E374 WeakPolarHBondContact O-CB 3.46Å; L370-E374 PolarHBondContact O-N 2.9Å
371D97.5Very high97.9Very high65 Ų6566.5 Ų66.535%0.34834%0.335SS..Hα-helixtrans-59.4-42.7177.4-61.5-27.1000111.3R367 R368 Q369 E375R367-D371 PolarHBondContact O-N 3.44Å; R368-D371 IonicContact CZ-OD2 3.69Å; R368-D371 IonicContact NE-OD2 2.8Å; R368-D371 PolarHBondContact NE-OD2 3.34Å; R368-D371 IonicContact NH1-OD2 3.12Å; R368-D371 IonicContact NH2-OD2 3.88Å; R368-D371 PolarHBondContact NH2-OD2 3.2Å; R368-D371 PolarHBondContact O-N 3.17Å; Q369-D371 VanDerWaalsContact C-N 3.35Å; Q369-D371 PolarHBondContact O-N 2.88Å; D371-E375 WeakPolarHBondContact O-CG 3.27Å; D371-E375 PolarHBondContact O-N 3.45Å
372L98Very high97.9Very high28 Ų2864 Ų6415%0.14732%0.318CS..Hα-helixtrans-69.3-41.5178.2-72.9170.2000112.1L278 L282 I285 R368 Q369 L370 E375 I376L278-L372 HydrophobicContact CD2-CD2 3.6Å; L282-L372 HydrophobicContact CB-CB 4.34Å; L282-L372 HydrophobicContact CB-CD1 4.36Å; L282-L372 HydrophobicContact CD1-CB 4.23Å; I285-L372 HydrophobicContact CG1-CD1 3.94Å; R368-L372 WeakPolarHBondContact O-CB 3.23Å; R368-L372 WeakPolarHBondContact O-CG 3.32Å; R368-L372 PolarHBondContact O-N 2.87Å; Q369-L372 PolarHBondContact O-N 3.32Å; L370-L372 VanDerWaalsContact C-N 3.32Å; L370-L372 PolarHBondContact O-N 3.08Å; L372-E375 PolarHBondContact O-N 3.03Å; L372-I376 WeakPolarHBondContact O-CB 3.4Å; L372-I376 WeakPolarHBondContact O-CD1 3.38Å; L372-I376 WeakPolarHBondContact O-CG1 3.32Å; L372-I376 PolarHBondContact O-N 2.88Å
373E98.2Very high97.9Very high71 Ų7163.7 Ų63.733%0.33232%0.316SS..Hα-helixtrans-60.5-45176.1-75172.9-179.700111.1L282 Q369 L370 I376 Q377L282-E373 HydrophobicContact CD1-CG 3.94Å; L282-E373 HydrophobicContact CD2-CG 3.85Å; Q369-E373 WeakPolarHBondContact CG-OE1 3.26Å; Q369-E373 PolarHBondContact NE2-OE1 2.83Å; Q369-E373 WeakPolarHBondContact O-CG 3.26Å; Q369-E373 PolarHBondContact O-N 3.49Å; L370-E373 PolarHBondContact O-N 3.38Å; E373-I376 PolarHBondContact O-N 3.2Å; E373-Q377 WeakPolarHBondContact O-CG 3.36Å; E373-Q377 PolarHBondContact O-N 2.98Å
374E97.3Very high97.9Very high125 Ų12563.7 Ų63.758%0.58432%0.316SS*.Hα-helixtrans-60.9-48.5175.6-176175-171.800111.5L370 I376 Q377 I378L370-E374 WeakPolarHBondContact O-CB 3.46Å; L370-E374 PolarHBondContact O-N 2.9Å; E374-I376 VanDerWaalsContact C-N 3.33Å; E374-I376 PolarHBondContact O-N 3Å; E374-Q377 WeakPolarHBondContact O-CB 3.47Å; E374-Q377 PolarHBondContact O-N 3.43Å; E374-Q377 VanDerWaalsContact O-N 3.13Å; E374-I378 HydrophobicContact CG-CD1 4.2Å; E374-I378 WeakPolarHBondContact O-CG1 3.38Å; E374-I378 PolarHBondContact O-N 2.9Å
375E97.8Very high97.9Very high65 Ų6562 Ų6230%0.30430%0.3SS..Hα-helixtrans-61-39.8177.6-78.6-64.1148.600112.3L278 D371 L372 Q377 I378 K379L278-E375 HydrophobicContact CD1-CB 3.91Å; L278-E375 HydrophobicContact CD2-CB 4.41Å; D371-E375 WeakPolarHBondContact O-CG 3.27Å; D371-E375 PolarHBondContact O-N 3.45Å; L372-E375 PolarHBondContact O-N 3.03Å; E375-Q377 VanDerWaalsContact C-N 3.31Å; E375-Q377 PolarHBondContact O-N 3.4Å; E375-I378 PolarHBondContact O-N 3.4Å; E375-K379 VanDerWaalsContact O-CG 3.28Å; E375-K379 WeakPolarHBondContact O-CG 3.34Å; E375-K379 PolarHBondContact O-N 3.24Å; E375-K379 IonicContact OE2-NZ 3.07Å; E375-K379 PolarHBondContact OE2-NZ 3.42Å
376I98.2Very high97.9Very high13 Ų1360.9 Ų60.97%0.06729%0.294CS..Hα-helixtrans-61.5-41.3175.5-70.8161.7000110.9K275 L278 E279 L282 L372 E373 E374 K379 A380K275-I376 HydrophobicContact CG-CG2 4.34Å; L278-I376 HydrophobicContact CB-CD1 4.12Å; L278-I376 HydrophobicContact CB-CG1 3.57Å; L278-I376 HydrophobicContact CD1-CG1 4.4Å; E279-I376 HydrophobicContact CB-CD1 4.49Å; E279-I376 HydrophobicContact CG-CD1 3.84Å; E279-I376 HydrophobicContact CG-CG1 4.16Å; E279-I376 HydrophobicContact CG-CG2 4.26Å; L282-I376 HydrophobicContact CB-CD1 4.11Å; L282-I376 HydrophobicContact CD2-CD1 3.61Å; L282-I376 HydrophobicContact CG-CD1 4.48Å; L372-I376 WeakPolarHBondContact O-CB 3.4Å; L372-I376 WeakPolarHBondContact O-CD1 3.38Å; L372-I376 WeakPolarHBondContact O-CG1 3.32Å; L372-I376 PolarHBondContact O-N 2.88Å; E373-I376 PolarHBondContact O-N 3.2Å; E374-I376 VanDerWaalsContact C-N 3.33Å; E374-I376 PolarHBondContact O-N 3Å; I376-K379 PolarHBondContact O-N 2.85Å; I376-A380 WeakPolarHBondContact O-CB 3.45Å; I376-A380 PolarHBondContact O-N 2.74Å
377Q97.8Very high97.8Very high134 Ų13462.1 Ų62.163%0.62630%0.295SS*.Hα-helixtrans-64.3-42.5176-67.9-59.2-30.700111.7E373 E374 E375 K379 A380 A381E373-Q377 WeakPolarHBondContact O-CG 3.36Å; E373-Q377 PolarHBondContact O-N 2.98Å; E374-Q377 WeakPolarHBondContact O-CB 3.47Å; E374-Q377 PolarHBondContact O-N 3.43Å; E374-Q377 VanDerWaalsContact O-N 3.13Å; E375-Q377 VanDerWaalsContact C-N 3.31Å; E375-Q377 PolarHBondContact O-N 3.4Å; Q377-K379 PolarHBondContact O-N 3.37Å; Q377-A380 PolarHBondContact O-N 3.39Å; Q377-A381 PolarHBondContact O-N 2.84Å
378I98Very high97.7Very high21 Ų2157.9 Ų57.911%0.10829%0.288CS..Hα-helixtrans-59-48.6174.8-67.3169.4000110.3T123 D126 E374 E375 A380 A381 T382T123-I378 WeakPolarHBondContact O-CG2 3.35Å; D126-I378 HydrophobicContact CB-CG2 4.08Å; E374-I378 HydrophobicContact CG-CD1 4.2Å; E374-I378 WeakPolarHBondContact O-CG1 3.38Å; E374-I378 PolarHBondContact O-N 2.9Å; E375-I378 PolarHBondContact O-N 3.4Å; I378-A380 VanDerWaalsContact C-N 3.3Å; I378-A380 PolarHBondContact O-N 3.4Å; I378-A381 PolarHBondContact O-N 3.39Å; I378-T382 PolarHBondContact O-N 3.43Å; I378-T382 PolarHBondContact O-OG1 2.86Å; I378-T382 VanDerWaalsContact O-OG1 3.12Å
379K97.7Very high97.7Very high14 Ų1454.1 Ų54.16%0.06128%0.277CS..Hα-helixtrans-63.6-36.3178.4-59.5-66.9163.1-77.40111.8D126 T271 K275 L278 E375 I376 Q377 T382 L383D126-K379 VanDerWaalsContact OD1-CE 3.31Å; D126-K379 WeakPolarHBondContact OD1-CE 3.35Å; D126-K379 IonicContact OD1-NZ 3.81Å; D126-K379 PolarHBondContact OD1-NZ 2.9Å; D126-K379 WeakPolarHBondContact OD2-CD 3.49Å; D126-K379 IonicContact OD2-NZ 3.29Å; D126-K379 PolarHBondContact OD2-NZ 3.42Å; T271-K379 HydrophobicContact CG2-CB 4.17Å; T271-K379 HydrophobicContact CG2-CD 4.1Å; K275-K379 HydrophobicContact CB-CB 3.94Å; K275-K379 HydrophobicContact CD-CB 4.47Å; K275-K379 HydrophobicContact CG-CB 4.16Å; L278-K379 HydrophobicContact CD1-CG 3.9Å; E375-K379 VanDerWaalsContact O-CG 3.28Å; E375-K379 WeakPolarHBondContact O-CG 3.34Å; E375-K379 PolarHBondContact O-N 3.24Å; E375-K379 IonicContact OE2-NZ 3.07Å; E375-K379 PolarHBondContact OE2-NZ 3.42Å; I376-K379 PolarHBondContact O-N 2.85Å; Q377-K379 PolarHBondContact O-N 3.37Å; K379-T382 PolarHBondContact O-N 3.38Å; K379-L383 VanDerWaalsContact O-CG 3.31Å; K379-L383 WeakPolarHBondContact O-CG 3.43Å; K379-L383 PolarHBondContact O-N 3.45Å
380A98Very high97.6Very high30 Ų3051.8 Ų51.825%0.24827%0.266CS..Hα-helixtrans-65.2-42.2175.800000112.1I376 Q377 I378 L383 F384I376-A380 WeakPolarHBondContact O-CB 3.45Å; I376-A380 PolarHBondContact O-N 2.74Å; Q377-A380 PolarHBondContact O-N 3.39Å; I378-A380 VanDerWaalsContact C-N 3.3Å; I378-A380 PolarHBondContact O-N 3.4Å; A380-L383 PolarHBondContact O-N 3.01Å; A380-F384 PolarHBondContact O-N 2.69Å
381A97.9Very high97.6Very high46 Ų4647.5 Ų47.538%0.3824%0.243SC..Hα-helixtrans-63.5-42.717400000111.7Q377 I378 L383 F384 I385Q377-A381 PolarHBondContact O-N 2.84Å; I378-A381 PolarHBondContact O-N 3.39Å; A381-L383 VanDerWaalsContact C-N 3.35Å; A381-L383 PolarHBondContact O-N 2.83Å; A381-F384 WeakPolarHBondContact O-CB 3.3Å; A381-F384 PolarHBondContact O-N 2.69Å; A381-I385 WeakPolarHBondContact O-CG1 3.32Å; A381-I385 PolarHBondContact O-N 3.2Å
382T97.9Very high97.5Very high0 Ų046.1 Ų46.10%024%0.244CC..Hα-helixtrans-60.2-42.4174.5-630000112.3D126 T271 I378 K379 I385 D386D126-T382 HydrophobicContact CB-CG2 4.31Å; D126-T382 WeakPolarHBondContact CB-OG1 3.33Å; D126-T382 VanDerWaalsContact OD2-CB 3.31Å; D126-T382 WeakPolarHBondContact OD2-CB 3.44Å; D126-T382 PolarHBondContact OD2-OG1 3.03Å; T271-T382 HydrophobicContact CG2-CG2 4.01Å; I378-T382 PolarHBondContact O-N 3.43Å; I378-T382 PolarHBondContact O-OG1 2.86Å; I378-T382 VanDerWaalsContact O-OG1 3.12Å; K379-T382 PolarHBondContact O-N 3.38Å; T382-I385 PolarHBondContact O-N 3.36Å; T382-D386 PolarHBondContact O-N 2.99Å
383L98Very high97.3Very high18 Ų1846.4 Ų46.49%0.09425%0.245CC..Hα-helixtrans-64.1-42.1175.2-74.3170.6000111.9I268 T271 R272 K275 K379 A380 A381 I385 D386 E387I268-L383 HydrophobicContact CG2-CD2 4.12Å; T271-L383 HydrophobicContact CG2-CD1 4.42Å; T271-L383 HydrophobicContact CG2-CD2 3.86Å; T271-L383 HydrophobicContact CG2-CG 3.73Å; R272-L383 HydrophobicContact CG-CD1 3.96Å; R272-L383 HydrophobicContact CG-CD2 3.63Å; R272-L383 HydrophobicContact CG-CG 4.48Å; K275-L383 HydrophobicContact CD-CD1 3.87Å; K379-L383 VanDerWaalsContact O-CG 3.31Å; K379-L383 WeakPolarHBondContact O-CG 3.43Å; K379-L383 PolarHBondContact O-N 3.45Å; A380-L383 PolarHBondContact O-N 3.01Å; A381-L383 VanDerWaalsContact C-N 3.35Å; A381-L383 PolarHBondContact O-N 2.83Å; L383-I385 VanDerWaalsContact C-N 3.29Å; L383-I385 PolarHBondContact O-N 2.83Å; L383-D386 PolarHBondContact O-N 3.38Å; L383-E387 WeakPolarHBondContact O-CA 3.44Å; L383-E387 WeakPolarHBondContact O-CB 3.39Å; L383-E387 PolarHBondContact O-N 2.98Å
384F98Very high97.1Very high111 Ų11143.3 Ų43.349%0.48723%0.231SC..Iπ-helixtrans-58.6-43175.9179.3-102.7000111.8A380 A381 V388 Q389A380-F384 PolarHBondContact O-N 2.69Å; A381-F384 WeakPolarHBondContact O-CB 3.3Å; A381-F384 PolarHBondContact O-N 2.69Å; F384-V388 HydrophobicContact CD2-CB 3.9Å; F384-V388 HydrophobicContact CD2-CG1 4.31Å; F384-V388 HydrophobicContact CD2-CG2 3.8Å; F384-V388 HydrophobicContact CE2-CB 4Å; F384-V388 HydrophobicContact CE2-CG1 3.9Å; F384-V388 HydrophobicContact CE2-CG2 4.2Å; F384-V388 WeakPolarHBondContact O-CA 3.35Å; F384-V388 VanDerWaalsContact O-CB 3.23Å; F384-V388 WeakPolarHBondContact O-CB 3.06Å; F384-V388 PolarHBondContact O-N 2.82Å; F384-Q389 HydrophobicContact CD1-CG 4.36Å; F384-Q389 HydrophobicContact CE1-CG 4.04Å; F384-Q389 PolarHBondContact O-N 3.31Å; F384-Q389 VanDerWaalsContact O-N 3.11Å
385I97.9Very high96.8Very high14 Ų1444.8 Ų44.87%0.07224%0.238CC..Iπ-helixtrans-62.8-56.2176.6-67.9166.4000111S118 R119 R122 A381 T382 L383 Q389 C390S118-I385 WeakPolarHBondContact O-CG2 3.28Å; R119-I385 HydrophobicContact CG-CG2 3.97Å; R122-I385 HydrophobicContact CB-CD1 4.47Å; R122-I385 HydrophobicContact CG-CD1 3.63Å; A381-I385 WeakPolarHBondContact O-CG1 3.32Å; A381-I385 PolarHBondContact O-N 3.2Å; T382-I385 PolarHBondContact O-N 3.36Å; L383-I385 VanDerWaalsContact C-N 3.29Å; L383-I385 PolarHBondContact O-N 2.83Å; I385-Q389 WeakPolarHBondContact O-CA 3.48Å; I385-Q389 VanDerWaalsContact O-CB 3.29Å; I385-Q389 WeakPolarHBondContact O-CB 3.44Å; I385-Q389 PolarHBondContact O-N 3.21Å; I385-C390 PolarHBondContact O-N 3.4Å; I385-C390 PolarHBondContact O-SG 3.27Å
386D97.6Very high96.4Very high1 Ų144.3 Ų44.31%0.00524%0.242CC..Iπ-helixtrans-70.7-44.1-174.4-87.9-3.9000113.3R119 R122 I268 T382 L383 C390 M391R119-D386 IonicContact CZ-OD1 2.66Å; R119-D386 IonicContact NH1-OD1 3.42Å; R119-D386 PolarHBondContact NH1-OD1 3.03Å; R119-D386 IonicContact NH1-OD2 3.38Å; R119-D386 PolarHBondContact NH1-OD2 3.46Å; R122-D386 IonicContact CZ-OD1 2.7Å; R122-D386 IonicContact CZ-OD2 3.03Å; R122-D386 IonicContact NH2-OD1 3.65Å; R122-D386 PolarHBondContact NH2-OD1 3.32Å; R122-D386 IonicContact NH2-OD2 3.74Å; R122-D386 PolarHBondContact NH2-OD2 3.03Å; I268-D386 HydrophobicContact CD1-CB 4.07Å; I268-D386 HydrophobicContact CG1-CB 3.61Å; T382-D386 PolarHBondContact O-N 2.99Å; L383-D386 PolarHBondContact O-N 3.38Å; D386-C390 WeakPolarHBondContact O-CB 3.43Å; D386-M391 WeakPolarHBondContact O-CG 3.31Å; D386-M391 PolarHBondContact O-N 2.92Å
387E96.6Very high95.8Very high74 Ų7445 Ų4535%0.34625%0.245SC..Iπ-helixtrans-83-44.1-171.4-167.9-179.1157.400111.8I268 R272 L383 M391I268-E387 HydrophobicContact CD1-CB 4.17Å; I268-E387 HydrophobicContact CG1-CB 4.5Å; R272-E387 IonicContact CZ-OE1 3.76Å; R272-E387 IonicContact CZ-OE2 2.84Å; R272-E387 IonicContact NE-OE2 3.7Å; R272-E387 PolarHBondContact NE-OE2 3.31Å; R272-E387 IonicContact NH2-OE1 3.7Å; R272-E387 PolarHBondContact NH2-OE1 2.95Å; R272-E387 IonicContact NH2-OE2 3.54Å; R272-E387 PolarHBondContact NH2-OE2 2.79Å; L383-E387 WeakPolarHBondContact O-CA 3.44Å; L383-E387 WeakPolarHBondContact O-CB 3.39Å; L383-E387 PolarHBondContact O-N 2.98Å; E387-M391 WeakPolarHBondContact O-CB 3.41Å
388V96.2Very high94.7Very high81 Ų8147.1 Ų47.149%0.49125%0.252SS..Iπ-helixtrans-91.2-49.1-175.3-174.20000110.7F384 G392F384-V388 HydrophobicContact CD2-CB 3.9Å; F384-V388 HydrophobicContact CD2-CG1 4.31Å; F384-V388 HydrophobicContact CD2-CG2 3.8Å; F384-V388 HydrophobicContact CE2-CB 4Å; F384-V388 HydrophobicContact CE2-CG1 3.9Å; F384-V388 HydrophobicContact CE2-CG2 4.2Å; F384-V388 WeakPolarHBondContact O-CA 3.35Å; F384-V388 VanDerWaalsContact O-CB 3.23Å; F384-V388 WeakPolarHBondContact O-CB 3.06Å; F384-V388 PolarHBondContact O-N 2.82Å; V388-G392 VanDerWaalsContact O-CA 3.31Å; V388-G392 WeakPolarHBondContact O-CA 3.29Å; V388-G392 PolarHBondContact O-N 3.46Å
389Q96.8Very high93.6Very high69 Ų6947.5 Ų47.532%0.32225%0.253SS..Iπ-helixtrans-78.8-56.4-175.8-55.8-179.2-3100111.4F384 I385 I393F384-Q389 HydrophobicContact CD1-CG 4.36Å; F384-Q389 HydrophobicContact CE1-CG 4.04Å; F384-Q389 PolarHBondContact O-N 3.31Å; F384-Q389 VanDerWaalsContact O-N 3.11Å; I385-Q389 WeakPolarHBondContact O-CA 3.48Å; I385-Q389 VanDerWaalsContact O-CB 3.29Å; I385-Q389 WeakPolarHBondContact O-CB 3.44Å; I385-Q389 PolarHBondContact O-N 3.21Å; Q389-I393 WeakPolarHBondContact O-CG1 3.28Å; Q389-I393 WeakPolarHBondContact O-CG2 3.34Å; Q389-I393 PolarHBondContact O-N 2.87Å
390C97.2Very high91.8Very high0 Ų050.6 Ų50.60%028%0.276CS..Iπ-helixtrans-71.8-57.2-176-61.30000112.1C115 L264 I385 D386 G392 I393 R394C115-C390 HydrophobicContact CB-CB 4.25Å; L264-C390 HydrophobicContact CD1-CB 4.48Å; L264-C390 HydrophobicContact CD2-CB 4.41Å; I385-C390 PolarHBondContact O-N 3.4Å; I385-C390 PolarHBondContact O-SG 3.27Å; D386-C390 WeakPolarHBondContact O-CB 3.43Å; C390-G392 VanDerWaalsContact C-N 3.33Å; C390-G392 PolarHBondContact O-N 3.35Å; C390-I393 VanDerWaalsContact O-CG1 3.31Å; C390-I393 WeakPolarHBondContact O-CG1 3.38Å; C390-I393 PolarHBondContact O-N 2.9Å; C390-R394 WeakPolarHBondContact O-CB 3.36Å; C390-R394 WeakPolarHBondContact O-CG 3.41Å; C390-R394 PolarHBondContact O-N 2.98Å; C390-R394 VanDerWaalsContact O-N 3.12Å
391M96.5Very high89.8Confident18 Ų1854 Ų549%0.08930%0.299CS..Hα-helixtrans-66.9-35.8-179.2-71.6-59.2-59.100112L264 I268 D386 E387 I393 R394 E395L264-M391 HydrophobicContact CB-CG 4.45Å; L264-M391 HydrophobicContact CB-SD 3.78Å; L264-M391 HydrophobicContact CD1-SD 3.89Å; L264-M391 HydrophobicContact CG-SD 4.48Å; I268-M391 HydrophobicContact CD1-CG 3.62Å; D386-M391 WeakPolarHBondContact O-CG 3.31Å; D386-M391 PolarHBondContact O-N 2.92Å; E387-M391 WeakPolarHBondContact O-CB 3.41Å; M391-I393 PolarHBondContact O-N 2.93Å; M391-R394 PolarHBondContact O-N 3.47Å; M391-R394 VanDerWaalsContact O-N 3.11Å; M391-E395 WeakPolarHBondContact O-CG 3.26Å; M391-E395 PolarHBondContact O-N 3.49Å
392G94.8Very high87.9Confident35 Ų3557 Ų5736%0.36130%0.303SS..Hα-helixtrans-58.6-43.6176.600000113.9V388 C390V388-G392 VanDerWaalsContact O-CA 3.31Å; V388-G392 WeakPolarHBondContact O-CA 3.29Å; V388-G392 PolarHBondContact O-N 3.46Å; C390-G392 VanDerWaalsContact C-N 3.33Å; C390-G392 PolarHBondContact O-N 3.35Å
393I94.6Very high87.4Confident34 Ų3459.9 Ų59.917%0.17432%0.318CS..Hα-helixtrans-72.5-33.8174.367.4-179.8000112F111 Q114 Q389 C390 M391 E395 S396F111-I393 HydrophobicContact CB-CD1 4.18Å; F111-I393 HydrophobicContact CB-CG1 4.4Å; F111-I393 HydrophobicContact CD1-CB 4.5Å; F111-I393 HydrophobicContact CD1-CD1 4.4Å; F111-I393 HydrophobicContact CG-CD1 4.47Å; Q114-I393 HydrophobicContact CB-CD1 3.85Å; Q114-I393 HydrophobicContact CG-CD1 3.86Å; Q389-I393 WeakPolarHBondContact O-CG1 3.28Å; Q389-I393 WeakPolarHBondContact O-CG2 3.34Å; Q389-I393 PolarHBondContact O-N 2.87Å; C390-I393 VanDerWaalsContact O-CG1 3.31Å; C390-I393 WeakPolarHBondContact O-CG1 3.38Å; C390-I393 PolarHBondContact O-N 2.9Å; M391-I393 PolarHBondContact O-N 2.93Å; I393-E395 PolarHBondContact O-N 3.15Å; I393-S396 WeakPolarHBondContact O-CB 3.18Å; I393-S396 PolarHBondContact O-N 3.16Å; I393-S396 VanDerWaalsContact O-N 3.14Å; I393-S396 PolarHBondContact O-OG 2.86Å
394R94.3Very high86.9Confident6 Ų662.1 Ų62.12%0.02333%0.33CS..Hα-helixtrans-72.1-26.9-177.5-69.3179.873.276.63113.6E139 I257 N261 C390 M391 S396 I397E139-R394 IonicContact OE1-CZ 2.72Å; E139-R394 IonicContact OE1-NH1 3.8Å; E139-R394 PolarHBondContact OE1-NH1 2.96Å; E139-R394 IonicContact OE1-NH2 3.06Å; E139-R394 PolarHBondContact OE1-NH2 3.12Å; E139-R394 IonicContact OE2-CZ 2.86Å; E139-R394 IonicContact OE2-NH1 3.38Å; E139-R394 PolarHBondContact OE2-NH1 3.09Å; E139-R394 IonicContact OE2-NH2 2.62Å; E139-R394 PolarHBondContact OE2-NH2 3.1Å; I257-R394 PolarHBondContact O-NH2 3.49Å; N261-R394 VanDerWaalsContact OD1-CZ 3.28Å; N261-R394 PolarHBondContact OD1-NE 3.29Å; N261-R394 PolarHBondContact OD1-NH2 3.49Å; C390-R394 WeakPolarHBondContact O-CB 3.36Å; C390-R394 WeakPolarHBondContact O-CG 3.41Å; C390-R394 PolarHBondContact O-N 2.98Å; C390-R394 VanDerWaalsContact O-N 3.12Å; M391-R394 PolarHBondContact O-N 3.47Å; M391-R394 VanDerWaalsContact O-N 3.11Å; R394-S396 PolarHBondContact O-N 2.87Å; R394-I397 HydrophobicContact CB-CD1 3.99Å; R394-I397 HydrophobicContact CG-CD1 4.07Å; R394-I397 WeakPolarHBondContact O-CB 3.43Å; R394-I397 WeakPolarHBondContact O-CD1 3.24Å; R394-I397 WeakPolarHBondContact O-CG1 3.39Å; R394-I397 PolarHBondContact O-N 2.78Å
395E91Very high86.3Confident157 Ų15759.3 Ų59.373%0.73432%0.321SS*.THydrogen-bonded Turntrans-62-23.5170.8-75.9176.1-173.500112.9M391 I393 I397M391-E395 WeakPolarHBondContact O-CG 3.26Å; M391-E395 PolarHBondContact O-N 3.49Å; I393-E395 PolarHBondContact O-N 3.15Å; E395-I397 VanDerWaalsContact C-N 3.33Å
396S88.6Confident85.6Confident55 Ų5562 Ų6239%0.38534%0.336SS..THydrogen-bonded Turntrans-82-8.3177.776.80000114.4F111 I393 R394 K398F111-S396 VanDerWaalsContact CE2-OG 3.22Å; F111-S396 WeakPolarHBondContact CE2-OG 3.3Å; F111-S396 WeakPolarHBondContact CZ-OG 3.13Å; I393-S396 WeakPolarHBondContact O-CB 3.18Å; I393-S396 PolarHBondContact O-N 3.16Å; I393-S396 VanDerWaalsContact O-N 3.14Å; I393-S396 PolarHBondContact O-OG 2.86Å; R394-S396 PolarHBondContact O-N 2.87Å; S396-K398 PolarHBondContact O-N 3.41Å
397I87Confident84.8Confident27 Ų2765.8 Ų65.814%0.13836%0.357CS..  trans-62.1108.5-178.9-65.7166.5000110P108 F111 I257 R394 E395 F399P108-I397 HydrophobicContact CG-CG2 4.3Å; F111-I397 HydrophobicContact CD2-CD1 4.19Å; F111-I397 HydrophobicContact CD2-CG1 3.48Å; F111-I397 VanDerWaalsContact CD2-CG1 3.48Å; F111-I397 HydrophobicContact CE2-CG1 3.97Å; I257-I397 HydrophobicContact CD1-CG2 4.02Å; I257-I397 HydrophobicContact CG2-CD1 4.32Å; R394-I397 HydrophobicContact CB-CD1 3.99Å; R394-I397 HydrophobicContact CG-CD1 4.07Å; R394-I397 WeakPolarHBondContact O-CB 3.43Å; R394-I397 WeakPolarHBondContact O-CD1 3.24Å; R394-I397 WeakPolarHBondContact O-CG1 3.39Å; R394-I397 PolarHBondContact O-N 2.78Å; E395-I397 VanDerWaalsContact C-N 3.33Å; I397-F399 HydrophobicContact CG2-CB 3.9Å
398K74.7Confident84.1Confident179 Ų17965.3 Ų65.378%0.77836%0.358SS*.  trans-102.562.6174.5-68.9178.5-173.31750110.4S396 S400S396-K398 PolarHBondContact O-N 3.41Å; K398-S400 PolarHBondContact O-N 3.3Å
399F73.5Confident83.2Confident28 Ų2864.1 Ų64.112%0.12335%0.348CS..  trans-92.284175.5-163.6-95.6000110.6A104 T105 P108 A250 I253 I257 I397 F402A104-F399 HydrophobicContact CB-CE2 4.43Å; T105-F399 HydrophobicContact CG2-CE2 4.49Å; P108-F399 HydrophobicContact CG-CB 4.41Å; P108-F399 HydrophobicContact CG-CD2 3.97Å; P108-F399 HydrophobicContact CG-CG 4.45Å; A250-F399 HydrophobicContact CB-CE1 4.28Å; I253-F399 HydrophobicContact CB-CD1 4.38Å; I253-F399 HydrophobicContact CB-CE1 3.83Å; I253-F399 HydrophobicContact CB-CZ 4.09Å; I253-F399 HydrophobicContact CD1-CE1 4.45Å; I253-F399 HydrophobicContact CD1-CE2 4.24Å; I253-F399 HydrophobicContact CD1-CZ 3.82Å; I253-F399 HydrophobicContact CG2-CD1 3.81Å; I253-F399 HydrophobicContact CG2-CD2 4.35Å; I253-F399 HydrophobicContact CG2-CE1 3.7Å; I253-F399 HydrophobicContact CG2-CE2 4.26Å; I253-F399 HydrophobicContact CG2-CG 4.13Å; I253-F399 HydrophobicContact CG2-CZ 3.94Å; I257-F399 HydrophobicContact CD1-CB 4.38Å; I397-F399 HydrophobicContact CG2-CB 3.9Å; F399-F402 HydrophobicContact CE2-CE2 4.2Å
400S61.4Low82.1Confident79 Ų7963.8 Ų63.855%0.55235%0.35SS*.  trans-96.6146.1171.652.80000111K398 F402K398-S400 PolarHBondContact O-N 3.3Å; S400-F402 PolarHBondContact O-N 2.93Å
401S56.1Low80.9Confident103 Ų10369.1 Ų69.172%0.7238%0.379SS*.  trans-55.4127.3176.257.10000111.4
402F58.2Low79.5Confident108 Ų10873.7 Ų73.747%0.47441%0.406SS..  trans-78.60178.4-63.7-77.4000113.5R97 T101 A104 F399 S400R97-F402 PolarHBondContact NE-O 2.86Å; R97-F402 PolarHBondContact NH2-O 2.69Å; T101-F402 HydrophobicContact CG2-CD2 4.11Å; A104-F402 HydrophobicContact CB-CD2 4.41Å; A104-F402 HydrophobicContact CB-CE1 3.96Å; A104-F402 HydrophobicContact CB-CE2 3.26Å; A104-F402 HydrophobicContact CB-CZ 3Å; F399-F402 HydrophobicContact CE2-CE2 4.2Å; S400-F402 PolarHBondContact O-N 2.93Å

Retrieved 402 of 402 residues in 1513.9 ms (Link to these results)

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