A0A061AL29_CAEEL Loading...

Bestrophin homolog

Forms chloride channels.

AlphaFold DB , UniProt , Accession A0A061AL29, Species CAEEL (Caenorhabditis elegans), Gene best-22, Length 496 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
1M56.4Low81.2Confident95 Ų9584.3 Ų84.347%0.46847%0.467SS..  0109.60-65.4-141.8-72.800108.5Y5 D302M1-Y5 HydrophobicContact CE-CE1 3.99Å; M1-Y5 WeakPolarHBondContact CE-OH 3.28Å; M1-D302 WeakPolarHBondContact CA-O 3.39Å; M1-D302 VanDerWaalsContact CA-OD1 3.29Å; M1-D302 WeakPolarHBondContact CA-OD1 3.31Å; M1-D302 HydrophobicContact CB-CB 4.37Å; M1-D302 WeakPolarHBondContact CB-OD1 3.36Å; M1-D302 HydrophobicContact CG-CB 3.96Å; M1-D302 PolarHBondContact N-O 2.86Å
2T74.5Confident81.3Confident50 Ų5089.7 Ų89.731%0.30750%0.504SS..  trans-104.3-13.5-179.850.20000111.1S4 D301 D302 D303 E305T2-S4 PolarHBondContact O-N 2.72Å; T2-D301 PolarHBondContact OG1-O 2.91Å; T2-D302 PolarHBondContact N-OD1 3.45Å; T2-D303 WeakPolarHBondContact CG2-O 3.46Å; T2-D303 PolarHBondContact OG1-O 3.34Å; T2-E305 HydrophobicContact CG2-CB 4.35Å; T2-E305 HydrophobicContact CG2-CG 3.6Å; T2-E305 PolarHBondContact OG1-OE1 2.91Å
3I81.9Confident81.8Confident40 Ų4089 Ų8921%0.20550%0.499CS..SBendtrans-72100.8167.5-56.2-176.3000109.4Y5 R25 D301 D302I3-Y5 WeakPolarHBondContact O-CD1 3.4Å; I3-Y5 PolarHBondContact O-N 3.48Å; I3-R25 HydrophobicContact CD1-CB 3.75Å; I3-R25 WeakPolarHBondContact CD1-O 3.36Å; I3-D301 HydrophobicContact CD1-CB 4.04Å; I3-D302 PolarHBondContact N-OD1 3.45Å
4S84.6Confident82Confident86 Ų8692.6 Ų92.660%0.60152%0.516SS*.  trans-73.2125.7175.3-172.80000111.5T2 R23T2-S4 PolarHBondContact O-N 2.72Å; S4-R23 PolarHBondContact O-NH1 2.98Å
5Y86.8Confident82.2Confident87 Ų8796.4 Ų96.434%0.34153%0.528SS..  trans-128.48.7169.358.4-94.4000112.2M1 I3 L7 D8 V9 L20M1-Y5 HydrophobicContact CE-CE1 3.99Å; M1-Y5 WeakPolarHBondContact CE-OH 3.28Å; I3-Y5 WeakPolarHBondContact O-CD1 3.4Å; I3-Y5 PolarHBondContact O-N 3.48Å; Y5-L7 VanDerWaalsContact C-N 3.26Å; Y5-L7 PolarHBondContact O-N 3.22Å; Y5-D8 PolarHBondContact O-N 3.1Å; Y5-D8 VanDerWaalsContact O-N 3.11Å; Y5-V9 HydrophobicContact CD2-CG1 4.1Å; Y5-V9 HydrophobicContact CD2-CG2 4.13Å; Y5-V9 PolarHBondContact O-N 3.41Å; Y5-L20 HydrophobicContact CD2-CD1 3.54Å; Y5-L20 HydrophobicContact CE2-CD1 4.11Å; Y5-L20 HydrophobicContact CG-CD1 3.8Å
6T87.7Confident82.4Confident105 Ų10591.7 Ų91.764%0.64450%0.504SS*.THydrogen-bonded Turntrans-57.9-37.1-175.8-51.10000112.6S10T6-S10 PolarHBondContact O-N 3.01Å
7L85.9Confident82.5Confident139 Ų13993.3 Ų93.373%0.72851%0.505SS*.THydrogen-bonded Turntrans-67.6-42.1177.7-176.462.9000112Y5 V9 S10Y5-L7 VanDerWaalsContact C-N 3.26Å; Y5-L7 PolarHBondContact O-N 3.22Å; L7-V9 PolarHBondContact O-N 3.37Å; L7-S10 WeakPolarHBondContact O-CB 3.39Å; L7-S10 PolarHBondContact O-N 3.4Å; L7-S10 VanDerWaalsContact O-N 3.1Å; L7-S10 PolarHBondContact O-OG 2.78Å
8D81.2Confident82.6Confident57 Ų5794.7 Ų94.731%0.30551%0.506SS..THydrogen-bonded Turntrans-64.1-31.5-179.7-67.914.8000111.9Y5 S16 R23Y5-D8 PolarHBondContact O-N 3.1Å; Y5-D8 VanDerWaalsContact O-N 3.11Å; D8-S16 VanDerWaalsContact O-CB 3.22Å; D8-S16 WeakPolarHBondContact O-CB 3.43Å; D8-S16 PolarHBondContact O-OG 3.39Å; D8-R23 VanDerWaalsContact CG-NH2 3.32Å; D8-R23 IonicContact OD1-NH2 2.7Å; D8-R23 IonicContact OD2-CZ 3.15Å; D8-R23 VanDerWaalsContact OD2-CZ 3.32Å; D8-R23 IonicContact OD2-NE 3.93Å; D8-R23 PolarHBondContact OD2-NE 3.34Å; D8-R23 IonicContact OD2-NH2 3.81Å; D8-R23 PolarHBondContact OD2-NH2 2.96Å
9V85.8Confident82.7Confident65 Ų6592.3 Ų92.339%0.39450%0.497SS..THydrogen-bonded Turntrans-97.413.3176.9-57.30000113.4Y5 L7 Q11 L20Y5-V9 HydrophobicContact CD2-CG1 4.1Å; Y5-V9 HydrophobicContact CD2-CG2 4.13Å; Y5-V9 PolarHBondContact O-N 3.41Å; L7-V9 PolarHBondContact O-N 3.37Å; V9-Q11 PolarHBondContact O-N 2.65Å; V9-L20 HydrophobicContact CG1-CD1 4.05Å
10S85.4Confident83Confident85 Ų8590.9 Ų90.959%0.59449%0.489SS*.SBendtrans-63.5-20.2177.8630000113.4T6 L7T6-S10 PolarHBondContact O-N 3.01Å; L7-S10 WeakPolarHBondContact O-CB 3.39Å; L7-S10 PolarHBondContact O-N 3.4Å; L7-S10 VanDerWaalsContact O-N 3.1Å; L7-S10 PolarHBondContact O-OG 2.78Å
11Q83.1Confident83.2Confident118 Ų11889.6 Ų89.655%0.55148%0.482SS*.SBendtrans-126.7142.2173.9-61.5-175.1-1.700110.6V9 N13 S16V9-Q11 PolarHBondContact O-N 2.65Å; Q11-N13 VanDerWaalsContact C-N 3.28Å; Q11-N13 PolarHBondContact O-N 3.26Å; Q11-N13 PolarHBondContact OE1-ND2 2.86Å; Q11-N13 VanDerWaalsContact OE1-ND2 3.11Å; Q11-S16 WeakPolarHBondContact O-CB 3.31Å; Q11-S16 PolarHBondContact O-OG 3.47Å; Q11-S16 VanDerWaalsContact O-OG 3.1Å
12T82.6Confident84.7Confident149 Ų14992 Ų9291%0.91450%0.496SS*.  trans-84.968.8177.355.20000110.6
13N86.9Confident85.3Confident81 Ų8193 Ų9343%0.43349%0.494SS..  trans-112.4152.6179.3-59.5-0.6000110.2Q11 Q15 S16 F17Q11-N13 VanDerWaalsContact C-N 3.28Å; Q11-N13 PolarHBondContact O-N 3.26Å; Q11-N13 PolarHBondContact OE1-ND2 2.86Å; Q11-N13 VanDerWaalsContact OE1-ND2 3.11Å; N13-Q15 PolarHBondContact O-N 2.83Å; N13-S16 WeakPolarHBondContact O-CB 3.47Å; N13-S16 PolarHBondContact O-N 2.98Å; N13-F17 PolarHBondContact O-N 3.48Å
14L84.6Confident85.6Confident140 Ų14098.1 Ų98.173%0.73351%0.511SS*.Hα-helixtrans-57.9-37.1176.5-71.6173.2000112S16 F17 F18L14-S16 VanDerWaalsContact C-N 3.34Å; L14-S16 PolarHBondContact O-N 2.6Å; L14-F17 WeakPolarHBondContact O-CB 3.27Å; L14-F17 PolarHBondContact O-N 3.31Å; L14-F18 WeakPolarHBondContact O-CD2 3.5Å; L14-F18 PolarHBondContact O-N 2.81Å; L14-F18 VanDerWaalsContact O-N 3.09Å
15Q85.6Confident85.7Confident149 Ų149103.2 Ų103.270%0.69652%0.517SS*.Hα-helixtrans-60.2-43.3175.3-175.7177.5-2.400111.8N13 F17 F18 S19N13-Q15 PolarHBondContact O-N 2.83Å; Q15-F17 VanDerWaalsContact C-N 3.27Å; Q15-F17 PolarHBondContact O-N 3.31Å; Q15-F18 PolarHBondContact O-N 2.92Å; Q15-S19 WeakPolarHBondContact O-CB 3.37Å; Q15-S19 PolarHBondContact O-N 3.48Å; Q15-S19 PolarHBondContact O-OG 3.44Å
16S84.7Confident85.6Confident21 Ų21100.8 Ų100.815%0.14752%0.518CS..Hα-helixtrans-59.2-40.1177.8-530000111.8D8 Q11 N13 L14 L20D8-S16 VanDerWaalsContact O-CB 3.22Å; D8-S16 WeakPolarHBondContact O-CB 3.43Å; D8-S16 PolarHBondContact O-OG 3.39Å; Q11-S16 WeakPolarHBondContact O-CB 3.31Å; Q11-S16 PolarHBondContact O-OG 3.47Å; Q11-S16 VanDerWaalsContact O-OG 3.1Å; N13-S16 WeakPolarHBondContact O-CB 3.47Å; N13-S16 PolarHBondContact O-N 2.98Å; L14-S16 VanDerWaalsContact C-N 3.34Å; L14-S16 PolarHBondContact O-N 2.6Å; S16-L20 PolarHBondContact O-N 3.09Å; S16-L20 VanDerWaalsContact O-N 3.09Å
17F84.6Confident85.7Confident119 Ų11996.7 Ų96.752%0.52249%0.494SS..Hα-helixtrans-64-48.1175.5177.1-104.3000112.3N13 L14 Q15 L20 L21N13-F17 PolarHBondContact O-N 3.48Å; L14-F17 WeakPolarHBondContact O-CB 3.27Å; L14-F17 PolarHBondContact O-N 3.31Å; Q15-F17 VanDerWaalsContact C-N 3.27Å; Q15-F17 PolarHBondContact O-N 3.31Å; F17-L20 WeakPolarHBondContact O-CB 3.45Å; F17-L20 PolarHBondContact O-N 3.15Å; F17-L21 HydrophobicContact CD1-CD1 3.96Å; F17-L21 HydrophobicContact CE1-CD1 3.33Å; F17-L21 HydrophobicContact CE1-CG 4.23Å; F17-L21 HydrophobicContact CE2-CD1 4.26Å; F17-L21 HydrophobicContact CE2-CG 4.41Å; F17-L21 HydrophobicContact CZ-CD1 3.51Å; F17-L21 HydrophobicContact CZ-CG 4.13Å; F17-L21 PolarHBondContact O-N 2.82Å
18F85.2Confident85.9Confident118 Ų11893 Ų9352%0.51848%0.476SS..Hα-helixtrans-67.4-39.2178.2-75.3-67.7000112.8L14 Q15 L20 L21 L22L14-F18 WeakPolarHBondContact O-CD2 3.5Å; L14-F18 PolarHBondContact O-N 2.81Å; L14-F18 VanDerWaalsContact O-N 3.09Å; Q15-F18 PolarHBondContact O-N 2.92Å; F18-L20 VanDerWaalsContact C-N 3.27Å; F18-L20 PolarHBondContact O-N 3.37Å; F18-L21 PolarHBondContact O-N 3.27Å; F18-L22 WeakPolarHBondContact O-CG 3.48Å; F18-L22 PolarHBondContact O-N 3.35Å
19S84.1Confident86.4Confident50 Ų5094.6 Ų94.635%0.3548%0.479SS..Hα-helixtrans-58.6-39.8174.3-67.30000111.6Q15Q15-S19 WeakPolarHBondContact O-CB 3.37Å; Q15-S19 PolarHBondContact O-N 3.48Å; Q15-S19 PolarHBondContact O-OG 3.44Å
20L87.5Confident86.7Confident63 Ų6396.1 Ų96.133%0.3348%0.48SS..Hα-helixtrans-65.7-47.8174.7-168.594.8000111.5Y5 V9 S16 F17 F18 L22 R23Y5-L20 HydrophobicContact CD2-CD1 3.54Å; Y5-L20 HydrophobicContact CE2-CD1 4.11Å; Y5-L20 HydrophobicContact CG-CD1 3.8Å; V9-L20 HydrophobicContact CG1-CD1 4.05Å; S16-L20 PolarHBondContact O-N 3.09Å; S16-L20 VanDerWaalsContact O-N 3.09Å; F17-L20 WeakPolarHBondContact O-CB 3.45Å; F17-L20 PolarHBondContact O-N 3.15Å; F18-L20 VanDerWaalsContact C-N 3.27Å; F18-L20 PolarHBondContact O-N 3.37Å; L20-L22 VanDerWaalsContact C-N 3.27Å; L20-L22 PolarHBondContact O-N 2.94Å; L20-R23 PolarHBondContact O-N 3.43Å
21L87.1Confident86.9Confident64 Ų6494.1 Ų94.134%0.33547%0.468SS..Hα-helixtrans-62.2-31.9-179.1-75.5-179.1000113.1F17 F18 R23 W29F17-L21 HydrophobicContact CD1-CD1 3.96Å; F17-L21 HydrophobicContact CE1-CD1 3.33Å; F17-L21 HydrophobicContact CE1-CG 4.23Å; F17-L21 HydrophobicContact CE2-CD1 4.26Å; F17-L21 HydrophobicContact CE2-CG 4.41Å; F17-L21 HydrophobicContact CZ-CD1 3.51Å; F17-L21 HydrophobicContact CZ-CG 4.13Å; F17-L21 PolarHBondContact O-N 2.82Å; F18-L21 PolarHBondContact O-N 3.27Å; L21-R23 VanDerWaalsContact C-N 3.31Å; L21-R23 PolarHBondContact O-N 3.31Å; L21-W29 PolarHBondContact O-NE1 3.22Å
22L88Confident87.5Confident145 Ų14588.5 Ų88.576%0.75944%0.442SS*.THydrogen-bonded Turntrans-83.8-1.3-178-67.8172.6000114F18 L20F18-L22 WeakPolarHBondContact O-CG 3.48Å; F18-L22 PolarHBondContact O-N 3.35Å; L20-L22 VanDerWaalsContact C-N 3.27Å; L20-L22 PolarHBondContact O-N 2.94Å
23R87.8Confident88Confident73 Ų7387.1 Ų87.128%0.27542%0.424SS..  trans-69.4142.7175.8-75.1179.5169.8-138.4-0.8111.2S4 D8 L20 L21 S27S4-R23 PolarHBondContact O-NH1 2.98Å; D8-R23 VanDerWaalsContact CG-NH2 3.32Å; D8-R23 IonicContact OD1-NH2 2.7Å; D8-R23 IonicContact OD2-CZ 3.15Å; D8-R23 VanDerWaalsContact OD2-CZ 3.32Å; D8-R23 IonicContact OD2-NE 3.93Å; D8-R23 PolarHBondContact OD2-NE 3.34Å; D8-R23 IonicContact OD2-NH2 3.81Å; D8-R23 PolarHBondContact OD2-NH2 2.96Å; L20-R23 PolarHBondContact O-N 3.43Å; L21-R23 VanDerWaalsContact C-N 3.31Å; L21-R23 PolarHBondContact O-N 3.31Å; R23-S27 WeakPolarHBondContact O-CB 3.22Å; R23-S27 PolarHBondContact O-OG 2.98Å
24W88.8Confident88.3Confident146 Ų14685.5 Ų85.555%0.55343%0.426SS*.  trans-99.6-47179.1-177.1-102.1000113.8S27 W29 K30W24-S27 PolarHBondContact O-N 3.13Å; W24-S27 PolarHBondContact O-OG 2.89Å; W24-W29 HydrophobicContact CE3-CB 3.99Å; W24-W29 HydrophobicContact CZ3-CB 3.79Å; W24-K30 HydrophobicContact CD2-CB 4.44Å; W24-K30 HydrophobicContact CZ2-CB 4.26Å; W24-K30 HydrophobicContact CZ2-CG 4.31Å; W24-K30 WeakPolarHBondContact O-CB 3.49Å
25R86.4Confident88.8Confident194 Ų19481.9 Ų81.973%0.73241%0.405SS*.THydrogen-bonded Turntrans-69.1135.3-179.5-67.4-173.2177.1179-1.9110.4I3 S27I3-R25 HydrophobicContact CD1-CB 3.75Å; I3-R25 WeakPolarHBondContact CD1-O 3.36Å; R25-S27 PolarHBondContact O-N 3.2Å; R25-S27 VanDerWaalsContact O-N 3.1Å
26G84.3Confident89.3Confident35 Ų3575.5 Ų75.536%0.36138%0.376SS..THydrogen-bonded Turntrans5618.6-174.900000115.3D301 D302G26-D301 PolarHBondContact N-OD2 3.5Å; G26-D301 VanDerWaalsContact N-OD2 3.1Å; G26-D302 WeakPolarHBondContact CA-OD2 3.39Å
27S90.7Very high89.9Confident20 Ų2076.8 Ų76.814%0.1439%0.388CS..SBendtrans-96.6161.9-175.583.40000113.3R23 W24 R25 W29 K30 A31R23-S27 WeakPolarHBondContact O-CB 3.22Å; R23-S27 PolarHBondContact O-OG 2.98Å; W24-S27 PolarHBondContact O-N 3.13Å; W24-S27 PolarHBondContact O-OG 2.89Å; R25-S27 PolarHBondContact O-N 3.2Å; R25-S27 VanDerWaalsContact O-N 3.1Å; S27-W29 PolarHBondContact O-N 3.42Å; S27-W29 PolarHBondContact OG-N 3.34Å; S27-K30 PolarHBondContact O-N 3.41Å; S27-A31 PolarHBondContact O-N 2.92Å
28V90.3Very high90.5Very high60 Ų6075.8 Ų75.836%0.36439%0.391SS..Hα-helixtrans-56.6-30.8173.768.60000112A31 V32V28-A31 PolarHBondContact O-N 3.07Å; V28-V32 HydrophobicContact CG2-CG2 3.9Å; V28-V32 WeakPolarHBondContact O-CB 3.32Å; V28-V32 WeakPolarHBondContact O-CG2 3.42Å; V28-V32 PolarHBondContact O-N 2.97Å
29W91.6Very high91.1Very high92 Ų9270.9 Ų70.935%0.34837%0.369SS..Hα-helixtrans-65.9-51.1178.9-52.7115.4000111.1L21 W24 S27 A31 V32 F33 L281L21-W29 PolarHBondContact O-NE1 3.22Å; W24-W29 HydrophobicContact CE3-CB 3.99Å; W24-W29 HydrophobicContact CZ3-CB 3.79Å; S27-W29 PolarHBondContact O-N 3.42Å; S27-W29 PolarHBondContact OG-N 3.34Å; W29-A31 PolarHBondContact O-N 3.19Å; W29-V32 PolarHBondContact O-N 2.9Å; W29-F33 WeakPolarHBondContact O-CB 3.36Å; W29-F33 PolarHBondContact O-N 2.8Å; W29-L281 HydrophobicContact CE3-CD2 4.4Å; W29-L281 HydrophobicContact CH2-CD1 4.39Å; W29-L281 HydrophobicContact CZ3-CD1 3.93Å; W29-L281 HydrophobicContact CZ3-CD2 4.05Å
30K91.5Very high91.7Very high97 Ų9769.4 Ų69.442%0.42236%0.358SS..Hα-helixtrans-59-38.4177.3-171.4-173.2-177.2-1640111.4W24 S27 D301W24-K30 HydrophobicContact CD2-CB 4.44Å; W24-K30 HydrophobicContact CZ2-CB 4.26Å; W24-K30 HydrophobicContact CZ2-CG 4.31Å; W24-K30 WeakPolarHBondContact O-CB 3.49Å; S27-K30 PolarHBondContact O-N 3.41Å; K30-D301 WeakPolarHBondContact CD-OD2 3.33Å; K30-D301 IonicContact NZ-OD1 3.68Å; K30-D301 PolarHBondContact NZ-OD1 3.3Å; K30-D301 IonicContact NZ-OD2 3.27Å; K30-D301 PolarHBondContact NZ-OD2 3.38Å
31A90.6Very high92.1Very high42 Ų4269.2 Ų69.235%0.34737%0.366SS..Hα-helixtrans-74.9-35.2-176.800000114.6S27 V28 W29 K288S27-A31 PolarHBondContact O-N 2.92Å; V28-A31 PolarHBondContact O-N 3.07Å; W29-A31 PolarHBondContact O-N 3.19Å; A31-K288 HydrophobicContact CB-CB 4.13Å; A31-K288 HydrophobicContact CB-CD 4.32Å; A31-K288 HydrophobicContact CB-CG 4.13Å
32V94.4Very high92.6Very high0 Ų068.8 Ų68.80%037%0.366CS..Hα-helixtrans-112.2-26.8-168.3-175.10000113.3V28 W29 G34 Q35 L36 F280 L281 M284 K288V28-V32 HydrophobicContact CG2-CG2 3.9Å; V28-V32 WeakPolarHBondContact O-CB 3.32Å; V28-V32 WeakPolarHBondContact O-CG2 3.42Å; V28-V32 PolarHBondContact O-N 2.97Å; W29-V32 PolarHBondContact O-N 2.9Å; V32-G34 VanDerWaalsContact C-N 3.35Å; V32-G34 PolarHBondContact O-N 2.69Å; V32-Q35 PolarHBondContact O-N 2.85Å; V32-L36 PolarHBondContact O-N 3.48Å; V32-F280 HydrophobicContact CG1-CD1 3.87Å; V32-F280 HydrophobicContact CG1-CE1 3.65Å; V32-L281 HydrophobicContact CB-CD2 4.42Å; V32-L281 HydrophobicContact CG1-CD2 4.01Å; V32-M284 HydrophobicContact CG1-CB 3.92Å; V32-M284 HydrophobicContact CG2-CB 4.38Å; V32-K288 HydrophobicContact CG2-CG 4.22Å
33F93.2Very high93Very high121 Ų12161.9 Ų61.953%0.53133%0.329SS..Hα-helixtrans-55.9-44-169.3-177.9-98000113.5W29 Q35 L36 A37W29-F33 WeakPolarHBondContact O-CB 3.36Å; W29-F33 PolarHBondContact O-N 2.8Å; F33-Q35 VanDerWaalsContact C-N 3.33Å; F33-Q35 PolarHBondContact O-N 2.65Å; F33-L36 PolarHBondContact O-N 3.29Å; F33-A37 WeakPolarHBondContact O-CB 3.32Å; F33-A37 PolarHBondContact O-N 3.28Å
34G94.3Very high93.4Very high47 Ų4761 Ų6149%0.48533%0.33SS..Hα-helixtrans-61.8-38.9177.800000113.2V32 V38V32-G34 VanDerWaalsContact C-N 3.35Å; V32-G34 PolarHBondContact O-N 2.69Å; G34-V38 WeakPolarHBondContact O-CG2 3.49Å; G34-V38 PolarHBondContact O-N 2.96Å
35Q95.1Very high93.8Very high63 Ų6359 Ų5929%0.29433%0.33SS..Hα-helixtrans-74.2-37.9179.1-63.5176.439.300111.5V32 F33 V38 W39 F280V32-Q35 PolarHBondContact O-N 2.85Å; F33-Q35 VanDerWaalsContact C-N 3.33Å; F33-Q35 PolarHBondContact O-N 2.65Å; Q35-V38 PolarHBondContact O-N 2.86Å; Q35-W39 WeakPolarHBondContact O-CB 3.4Å; Q35-W39 PolarHBondContact O-N 3.34Å; Q35-F280 HydrophobicContact CB-CE1 4.27Å; Q35-F280 HydrophobicContact CB-CZ 4.07Å
36L95.8Very high94.2Very high15 Ų1551.4 Ų51.48%0.07930%0.303CS..Hα-helixtrans-62.1-44.4173.1-179.763.9000110.8V32 F33 V38 W39 T40 M277 F280 L281V32-L36 PolarHBondContact O-N 3.48Å; F33-L36 PolarHBondContact O-N 3.29Å; L36-V38 PolarHBondContact O-N 3.35Å; L36-W39 HydrophobicContact CD1-CE3 4.46Å; L36-W39 PolarHBondContact O-N 3.49Å; L36-T40 WeakPolarHBondContact O-CB 3.44Å; L36-T40 PolarHBondContact O-N 3.27Å; L36-T40 PolarHBondContact O-OG1 3.42Å; L36-M277 HydrophobicContact CD1-CB 4.23Å; L36-M277 HydrophobicContact CD1-CE 4.23Å; L36-M277 HydrophobicContact CD1-CG 4.22Å; L36-M277 HydrophobicContact CD2-CE 4.24Å; L36-M277 HydrophobicContact CG-CE 4.34Å; L36-F280 HydrophobicContact CB-CD1 4.04Å; L36-F280 HydrophobicContact CB-CE1 3.86Å; L36-F280 HydrophobicContact CD1-CB 4.18Å; L36-F280 HydrophobicContact CD1-CD1 3.67Å; L36-F280 HydrophobicContact CD1-CE1 4.21Å; L36-F280 HydrophobicContact CD1-CG 3.98Å; L36-F280 HydrophobicContact CG-CD1 4.42Å; L36-L281 HydrophobicContact CD2-CD1 4.33Å; L36-L281 HydrophobicContact CD2-CD2 3.8Å; L36-L281 HydrophobicContact CD2-CG 3.99Å
37A96.4Very high94.7Very high49 Ų4949.8 Ų49.841%0.40529%0.286SS..Hα-helixtrans-59.8-44.9178.600000112F33 T40 A41F33-A37 WeakPolarHBondContact O-CB 3.32Å; F33-A37 PolarHBondContact O-N 3.28Å; A37-T40 PolarHBondContact O-N 3.23Å; A37-A41 WeakPolarHBondContact O-CB 3.32Å; A37-A41 PolarHBondContact O-N 3.23Å
38V97.1Very high94.8Very high97 Ų9751.1 Ų51.159%0.58830%0.295SS*.Hα-helixtrans-63.1-46.9174.7172.80000111.1G34 Q35 L36 T40 A41 V42G34-V38 WeakPolarHBondContact O-CG2 3.49Å; G34-V38 PolarHBondContact O-N 2.96Å; Q35-V38 PolarHBondContact O-N 2.86Å; L36-V38 PolarHBondContact O-N 3.35Å; V38-T40 VanDerWaalsContact C-N 3.35Å; V38-T40 PolarHBondContact O-N 2.88Å; V38-A41 PolarHBondContact O-N 3.09Å; V38-V42 WeakPolarHBondContact O-CG2 3.06Å; V38-V42 PolarHBondContact O-N 3.15Å
39W97.5Very high95Very high15 Ų1551.4 Ų51.46%0.05729%0.294CS..Hα-helixtrans-59.7-45178.5-176.591.5000111.7Q35 L36 V42 F43 F249 C252 L253 P273 T276 M277 F280Q35-W39 WeakPolarHBondContact O-CB 3.4Å; Q35-W39 PolarHBondContact O-N 3.34Å; L36-W39 HydrophobicContact CD1-CE3 4.46Å; L36-W39 PolarHBondContact O-N 3.49Å; W39-V42 PolarHBondContact O-N 3.41Å; W39-F43 HydrophobicContact CE3-CB 4.48Å; W39-F43 HydrophobicContact CH2-CB 4.4Å; W39-F43 AromaticContact CH2-CD2 3.69Å; W39-F43 HydrophobicContact CH2-CD2 3.69Å; W39-F43 HydrophobicContact CH2-CE2 4.28Å; W39-F43 HydrophobicContact CH2-CG 4.17Å; W39-F43 HydrophobicContact CZ2-CD2 4.01Å; W39-F43 HydrophobicContact CZ3-CB 4.26Å; W39-F43 HydrophobicContact CZ3-CD2 4.31Å; W39-F43 HydrophobicContact CZ3-CG 4.34Å; W39-F43 WeakPolarHBondContact O-CB 3.4Å; W39-F43 PolarHBondContact O-N 3.01Å; W39-F249 PolarHBondContact NE1-O 2.86Å; W39-C252 HydrophobicContact CZ2-CB 4.22Å; W39-L253 HydrophobicContact CD2-CD2 4.06Å; W39-L253 HydrophobicContact CG-CD2 4.04Å; W39-L253 HydrophobicContact CZ2-CD2 4.19Å; W39-P273 HydrophobicContact CH2-CG 3.72Å; W39-P273 HydrophobicContact CZ3-CG 3.84Å; W39-T276 HydrophobicContact CH2-CG2 3.58Å; W39-T276 HydrophobicContact CZ2-CG2 3.75Å; W39-M277 HydrophobicContact CZ3-CG 3.96Å; W39-F280 HydrophobicContact CB-CE2 3.92Å; W39-F280 HydrophobicContact CB-CZ 4.18Å; W39-F280 AromaticContact CD1-CE2 3.8Å; W39-F280 HydrophobicContact CD2-CD2 4.24Å; W39-F280 HydrophobicContact CD2-CE2 4.42Å; W39-F280 HydrophobicContact CG-CD2 4.05Å; W39-F280 AromaticContact CG-CE2 3.76Å; W39-F280 HydrophobicContact CG-CE2 3.76Å; W39-F280 HydrophobicContact CG-CZ 4.49Å
40T96.6Very high95.1Very high19 Ų1947 Ų4712%0.11728%0.277CS..Hα-helixtrans-64.3-41.6177-61.90000111.7L36 A37 V38 V42 F43 L44 L272L36-T40 WeakPolarHBondContact O-CB 3.44Å; L36-T40 PolarHBondContact O-N 3.27Å; L36-T40 PolarHBondContact O-OG1 3.42Å; A37-T40 PolarHBondContact O-N 3.23Å; V38-T40 VanDerWaalsContact C-N 3.35Å; V38-T40 PolarHBondContact O-N 2.88Å; T40-V42 PolarHBondContact O-N 2.9Å; T40-F43 PolarHBondContact O-N 3.07Å; T40-L44 HydrophobicContact CG2-CD1 4.08Å; T40-L44 HydrophobicContact CG2-CG 4.37Å; T40-L44 WeakPolarHBondContact O-CB 3.45Å; T40-L44 VanDerWaalsContact O-CG 3.31Å; T40-L44 WeakPolarHBondContact O-CG 3.36Å; T40-L44 PolarHBondContact O-N 3.4Å; T40-L272 HydrophobicContact CG2-CD2 3.73Å
41A97Very high95Very high59 Ų5944.7 Ų44.749%0.48827%0.266SS..Hα-helixtrans-61.4-43.9176.600000111.9A37 V38 L44 L45A37-A41 WeakPolarHBondContact O-CB 3.32Å; A37-A41 PolarHBondContact O-N 3.23Å; V38-A41 PolarHBondContact O-N 3.09Å; A41-L44 PolarHBondContact O-N 2.97Å; A41-L45 WeakPolarHBondContact O-CB 3.26Å; A41-L45 PolarHBondContact O-N 3.5Å
42V97.5Very high95.1Very high55 Ų5550.7 Ų50.733%0.33328%0.281SS..Hα-helixtrans-66.8-41.4176.11770000111.2V38 W39 T40 L44 L45 I46 L253V38-V42 WeakPolarHBondContact O-CG2 3.06Å; V38-V42 PolarHBondContact O-N 3.15Å; W39-V42 PolarHBondContact O-N 3.41Å; T40-V42 PolarHBondContact O-N 2.9Å; V42-L44 PolarHBondContact O-N 3.01Å; V42-L45 WeakPolarHBondContact O-CB 3.43Å; V42-L45 PolarHBondContact O-N 2.91Å; V42-I46 HydrophobicContact CG1-CD1 3.96Å; V42-I46 HydrophobicContact CG1-CG1 4.5Å; V42-I46 WeakPolarHBondContact O-CG1 3.31Å; V42-I46 PolarHBondContact O-N 3.41Å; V42-L253 HydrophobicContact CB-CD2 4.21Å; V42-L253 HydrophobicContact CG1-CD1 3.87Å; V42-L253 HydrophobicContact CG1-CD2 4.05Å
43F96.7Very high95Very high0 Ų057.7 Ų57.70%032%0.315CS..Hα-helixtrans-59.1-47.3176.5-175.5-82.9000111.6W39 T40 I46 S47 L253 R256 Q257 F258 P273W39-F43 HydrophobicContact CE3-CB 4.48Å; W39-F43 HydrophobicContact CH2-CB 4.4Å; W39-F43 AromaticContact CH2-CD2 3.69Å; W39-F43 HydrophobicContact CH2-CD2 3.69Å; W39-F43 HydrophobicContact CH2-CE2 4.28Å; W39-F43 HydrophobicContact CH2-CG 4.17Å; W39-F43 HydrophobicContact CZ2-CD2 4.01Å; W39-F43 HydrophobicContact CZ3-CB 4.26Å; W39-F43 HydrophobicContact CZ3-CD2 4.31Å; W39-F43 HydrophobicContact CZ3-CG 4.34Å; W39-F43 WeakPolarHBondContact O-CB 3.4Å; W39-F43 PolarHBondContact O-N 3.01Å; T40-F43 PolarHBondContact O-N 3.07Å; F43-I46 PolarHBondContact O-N 3.1Å; F43-S47 PolarHBondContact O-N 2.95Å; F43-L253 HydrophobicContact CB-CD2 3.95Å; F43-L253 HydrophobicContact CD2-CD2 4.49Å; F43-R256 HydrophobicContact CE2-CB 4.43Å; F43-R256 WeakPolarHBondContact CE2-O 3.43Å; F43-R256 VanDerWaalsContact CZ-O 3.29Å; F43-R256 WeakPolarHBondContact CZ-O 3.4Å; F43-Q257 HydrophobicContact CE2-CG 4.21Å; F43-Q257 HydrophobicContact CZ-CG 4.35Å; F43-Q257 PolarHBondContact O-NE2 3.19Å; F43-F258 HydrophobicContact CZ-CD2 4.45Å; F43-F258 HydrophobicContact CZ-CE2 4.43Å; F43-P273 HydrophobicContact CD1-CG 3.82Å; F43-P273 HydrophobicContact CD2-CG 4.04Å; F43-P273 HydrophobicContact CE1-CB 4.18Å; F43-P273 VanDerWaalsContact CE1-CD 3.43Å; F43-P273 HydrophobicContact CE1-CG 3.57Å; F43-P273 HydrophobicContact CE2-CB 4.23Å; F43-P273 HydrophobicContact CE2-CG 3.78Å; F43-P273 HydrophobicContact CG-CG 4.07Å; F43-P273 HydrophobicContact CZ-CB 3.82Å; F43-P273 HydrophobicContact CZ-CG 3.53Å
44L95.9Very high95Very high55 Ų5554 Ų5429%0.28830%0.301SS..Hα-helixtrans-64.9-40.2177.4-72175.6000111.8T40 A41 V42 I46 S47 C48 W271 L272T40-L44 HydrophobicContact CG2-CD1 4.08Å; T40-L44 HydrophobicContact CG2-CG 4.37Å; T40-L44 WeakPolarHBondContact O-CB 3.45Å; T40-L44 VanDerWaalsContact O-CG 3.31Å; T40-L44 WeakPolarHBondContact O-CG 3.36Å; T40-L44 PolarHBondContact O-N 3.4Å; A41-L44 PolarHBondContact O-N 2.97Å; V42-L44 PolarHBondContact O-N 3.01Å; L44-I46 PolarHBondContact O-N 2.97Å; L44-S47 WeakPolarHBondContact O-CB 3.33Å; L44-S47 PolarHBondContact O-N 3.26Å; L44-C48 PolarHBondContact O-N 3.39Å; L44-C48 PolarHBondContact O-SG 3.43Å; L44-C48 VanDerWaalsContact O-SG 3.36Å; L44-W271 VanDerWaalsContact CD2-O 3.22Å; L44-W271 WeakPolarHBondContact CD2-O 3.07Å; L44-L272 HydrophobicContact CD1-CD2 4.1Å; L44-L272 HydrophobicContact CD2-CD2 3.92Å; L44-L272 HydrophobicContact CG-CD2 4.21Å
45L96.4Very high94.9Very high104 Ų10453.9 Ų53.955%0.54529%0.293SS..Hα-helixtrans-58.9-46.9175.3178.664.6000111.5A41 V42 S47 C48 I49A41-L45 WeakPolarHBondContact O-CB 3.26Å; A41-L45 PolarHBondContact O-N 3.5Å; V42-L45 WeakPolarHBondContact O-CB 3.43Å; V42-L45 PolarHBondContact O-N 2.91Å; L45-S47 VanDerWaalsContact C-N 3.32Å; L45-S47 PolarHBondContact O-N 3.02Å; L45-C48 PolarHBondContact O-N 2.9Å; L45-I49 HydrophobicContact CD1-CD1 4.41Å; L45-I49 HydrophobicContact CG-CD1 4.14Å; L45-I49 VanDerWaalsContact O-CG1 3.32Å; L45-I49 WeakPolarHBondContact O-CG1 3.4Å; L45-I49 PolarHBondContact O-N 3.39Å
46I95.8Very high94.6Very high35 Ų3555.6 Ų55.618%0.17931%0.309CS..Hα-helixtrans-61.4-42.2176-66.9166.2000110.5V42 F43 L44 C48 I49 Y50 F62 L253 Q257V42-I46 HydrophobicContact CG1-CD1 3.96Å; V42-I46 HydrophobicContact CG1-CG1 4.5Å; V42-I46 WeakPolarHBondContact O-CG1 3.31Å; V42-I46 PolarHBondContact O-N 3.41Å; F43-I46 PolarHBondContact O-N 3.1Å; L44-I46 PolarHBondContact O-N 2.97Å; I46-C48 PolarHBondContact O-N 3.36Å; I46-I49 PolarHBondContact O-N 3.47Å; I46-Y50 PolarHBondContact O-N 3.37Å; I46-F62 HydrophobicContact CG2-CE2 4.28Å; I46-F62 HydrophobicContact CG2-CZ 3.64Å; I46-L253 HydrophobicContact CD1-CB 3.98Å; I46-Q257 HydrophobicContact CG2-CG 4.11Å
47S93.6Very high94.3Very high0 Ų058.6 Ų58.60%033%0.331CS..Hα-helixtrans-61.7-42176.7-1580000112.2F43 L44 L45 Y50 R51F43-S47 PolarHBondContact O-N 2.95Å; L44-S47 WeakPolarHBondContact O-CB 3.33Å; L44-S47 PolarHBondContact O-N 3.26Å; L45-S47 VanDerWaalsContact C-N 3.32Å; L45-S47 PolarHBondContact O-N 3.02Å; S47-Y50 PolarHBondContact O-N 3Å; S47-R51 WeakPolarHBondContact O-CG 3.42Å; S47-R51 PolarHBondContact O-N 3.41Å; S47-R51 PolarHBondContact OG-NE 3.02Å
48C94.3Very high94Very high49 Ų4961.1 Ų61.133%0.33134%0.335SS..Hα-helixtrans-63.1-42.4174.8-72.80000112.2L44 L45 I46 R51 Y52L44-C48 PolarHBondContact O-N 3.39Å; L44-C48 PolarHBondContact O-SG 3.43Å; L44-C48 VanDerWaalsContact O-SG 3.36Å; L45-C48 PolarHBondContact O-N 2.9Å; I46-C48 PolarHBondContact O-N 3.36Å; C48-R51 PolarHBondContact O-N 2.9Å; C48-Y52 HydrophobicContact CB-CD2 4.37Å; C48-Y52 WeakPolarHBondContact O-CB 3.48Å; C48-Y52 WeakPolarHBondContact O-CD2 3.28Å; C48-Y52 PolarHBondContact O-N 3.31Å
49I94.7Very high93.7Very high65 Ų6557.7 Ų57.733%0.33331%0.312SS..Iπ-helixtrans-60.6-47.7175.9-68.3165.4000109.9L45 I46 R51 M53 L54L45-I49 HydrophobicContact CD1-CD1 4.41Å; L45-I49 HydrophobicContact CG-CD1 4.14Å; L45-I49 VanDerWaalsContact O-CG1 3.32Å; L45-I49 WeakPolarHBondContact O-CG1 3.4Å; L45-I49 PolarHBondContact O-N 3.39Å; I46-I49 PolarHBondContact O-N 3.47Å; I49-R51 PolarHBondContact O-N 3.2Å; I49-M53 HydrophobicContact CG1-SD 3.92Å; I49-M53 HydrophobicContact CG2-CB 4.3Å; I49-M53 WeakPolarHBondContact O-CA 3.46Å; I49-M53 WeakPolarHBondContact O-CB 3.31Å; I49-M53 PolarHBondContact O-N 2.64Å; I49-L54 HydrophobicContact CG2-CD2 4.31Å; I49-L54 HydrophobicContact CG2-CG 4.29Å; I49-L54 PolarHBondContact O-N 3.44Å; I49-L54 VanDerWaalsContact O-N 3.08Å
50Y92.6Very high93.3Very high1 Ų160.8 Ų60.80%0.00433%0.33CS..Iπ-helixtrans-58.3-46.7178165.6-112.7000112.6I46 S47 L54 Q59 F62 E63 F258 V260 T261I46-Y50 PolarHBondContact O-N 3.37Å; S47-Y50 PolarHBondContact O-N 3Å; Y50-L54 HydrophobicContact CD2-CD1 4.25Å; Y50-Q59 HydrophobicContact CD2-CB 4.38Å; Y50-Q59 HydrophobicContact CD2-CG 3.98Å; Y50-Q59 HydrophobicContact CE2-CB 3.87Å; Y50-Q59 HydrophobicContact CE2-CG 3.84Å; Y50-Q59 PolarHBondContact O-NE2 2.93Å; Y50-F62 HydrophobicContact CD2-CB 4.49Å; Y50-F62 AromaticContact CD2-CD1 3.34Å; Y50-F62 HydrophobicContact CD2-CD1 3.34Å; Y50-F62 AromaticContact CD2-CE1 3.89Å; Y50-F62 HydrophobicContact CD2-CE1 3.89Å; Y50-F62 HydrophobicContact CD2-CG 4.25Å; Y50-F62 AromaticContact CE2-CD1 3.97Å; Y50-F62 HydrophobicContact CE2-CD1 3.97Å; Y50-F62 AromaticContact CG-CD1 3.83Å; Y50-F62 HydrophobicContact CG-CD1 3.83Å; Y50-F62 AromaticContact CG-CE1 3.88Å; Y50-F62 HydrophobicContact CG-CE1 3.88Å; Y50-E63 HydrophobicContact CE2-CG 4.13Å; Y50-E63 PolarHBondContact OH-OE1 3Å; Y50-F258 WeakPolarHBondContact CE1-O 3.4Å; Y50-V260 HydrophobicContact CE1-CB 4.24Å; Y50-V260 HydrophobicContact CE1-CG2 4.06Å; Y50-V260 PolarHBondContact OH-N 3.4Å; Y50-T261 PolarHBondContact OH-N 3.31Å
51R89.7Confident93Very high47 Ų4764.4 Ų64.418%0.17735%0.352CS..Iπ-helixtrans-76.7-38.2-174.7-67.3172.5-168-107.9-0.1114.2S47 C48 I49 D269 W271S47-R51 WeakPolarHBondContact O-CG 3.42Å; S47-R51 PolarHBondContact O-N 3.41Å; S47-R51 PolarHBondContact OG-NE 3.02Å; C48-R51 PolarHBondContact O-N 2.9Å; I49-R51 PolarHBondContact O-N 3.2Å; R51-D269 IonicContact CZ-OD1 2.63Å; R51-D269 IonicContact CZ-OD2 3.66Å; R51-D269 VanDerWaalsContact CZ-OD2 3.31Å; R51-D269 IonicContact NH1-OD1 2.69Å; R51-D269 IonicContact NH1-OD2 3.8Å; R51-D269 PolarHBondContact NH1-OD2 2.77Å; R51-D269 VanDerWaalsContact NH2-CG 3.26Å; R51-D269 IonicContact NH2-OD1 2.78Å; R51-D269 PolarHBondContact NH2-OD1 3.45Å; R51-D269 IonicContact NH2-OD2 2.66Å; R51-D269 PolarHBondContact NH2-OD2 3.47Å; R51-D269 VanDerWaalsContact NH2-OD2 3.08Å; R51-W271 VanDerWaalsContact CD-CH2 3.48Å
52Y91.9Very high92.8Very high169 Ų16963.1 Ų63.166%0.66334%0.335SS*.Iπ-helixtrans-113.4-22.3-168.3-59.8-62.8000114.8C48 W271C48-Y52 HydrophobicContact CB-CD2 4.37Å; C48-Y52 WeakPolarHBondContact O-CB 3.48Å; C48-Y52 WeakPolarHBondContact O-CD2 3.28Å; C48-Y52 PolarHBondContact O-N 3.31Å; Y52-W271 AromaticContact CE2-CH2 3.84Å; Y52-W271 HydrophobicContact CE2-CH2 3.84Å
53M94Very high92.5Very high146 Ų14660.7 Ų60.772%0.71932%0.32SS*.Iπ-helixtrans-109.4-32.2-173.3-60.3-174.87000113.7I49I49-M53 HydrophobicContact CG1-SD 3.92Å; I49-M53 HydrophobicContact CG2-CB 4.3Å; I49-M53 WeakPolarHBondContact O-CA 3.46Å; I49-M53 WeakPolarHBondContact O-CB 3.31Å; I49-M53 PolarHBondContact O-N 2.64Å
54L92.5Very high92.2Very high45 Ų4566.8 Ų66.824%0.23635%0.349CS..SBendtrans-76.4138.5-178-65.4-174000112.1I49 Y50 Q58 Q59 F62I49-L54 HydrophobicContact CG2-CD2 4.31Å; I49-L54 HydrophobicContact CG2-CG 4.29Å; I49-L54 PolarHBondContact O-N 3.44Å; I49-L54 VanDerWaalsContact O-N 3.08Å; Y50-L54 HydrophobicContact CD2-CD1 4.25Å; L54-Q58 HydrophobicContact CB-CB 4.07Å; L54-Q58 HydrophobicContact CD2-CB 4.11Å; L54-Q58 HydrophobicContact CG-CB 4.48Å; L54-Q59 HydrophobicContact CB-CG 3.75Å; L54-F62 HydrophobicContact CD1-CB 4Å; L54-F62 HydrophobicContact CD1-CG 4.15Å
55S92.5Very high92Very high44 Ų4467.4 Ų67.431%0.30835%0.352SS..  trans-70.4160.5169.568.80000111.2S57 Q58 Q59S55-S57 VanDerWaalsContact C-N 3.28Å; S55-S57 PolarHBondContact O-N 3.18Å; S55-S57 PolarHBondContact OG-OG 3.08Å; S55-S57 VanDerWaalsContact OG-OG 3.08Å; S55-Q58 VanDerWaalsContact N-OE1 3.08Å; S55-Q58 CarbonylContact O-C 3.59Å; S55-Q58 WeakPolarHBondContact O-CA 3.48Å; S55-Q58 WeakPolarHBondContact O-CB 3.27Å; S55-Q58 PolarHBondContact O-N 3.29Å; S55-Q58 VanDerWaalsContact OG-CG 3.3Å; S55-Q58 WeakPolarHBondContact OG-CG 3.41Å; S55-Q58 PolarHBondContact OG-OE1 3.17Å; S55-Q59 WeakPolarHBondContact O-CG 3.47Å; S55-Q59 PolarHBondContact O-N 2.8Å
56P88.6Confident91.8Very high99 Ų9962.8 Ų62.864%0.64333%0.328SS*.Hα-helixtrans-54.1-41.9179.9-28.535.7000113.8Q58 Q59 D60P56-Q58 VanDerWaalsContact C-N 3.32Å; P56-Q58 PolarHBondContact O-N 2.95Å; P56-Q59 WeakPolarHBondContact O-CB 3.16Å; P56-Q59 PolarHBondContact O-N 3.4Å; P56-D60 PolarHBondContact O-N 3.02Å; P56-D60 VanDerWaalsContact O-N 3.09Å
57S88.4Confident91.5Very high78 Ų7865.8 Ų65.855%0.54534%0.337SS..Hα-helixtrans-64.5-32175.253.40000113.9S55S55-S57 VanDerWaalsContact C-N 3.28Å; S55-S57 PolarHBondContact O-N 3.18Å; S55-S57 PolarHBondContact OG-OG 3.08Å; S55-S57 VanDerWaalsContact OG-OG 3.08Å
58Q90.8Very high91.4Very high101 Ų10174.1 Ų74.147%0.47237%0.369SS..Hα-helixtrans-78.7-33.9176.1-70.3172.7-25.500111.6L54 S55 P56 D60 V61 F62L54-Q58 HydrophobicContact CB-CB 4.07Å; L54-Q58 HydrophobicContact CD2-CB 4.11Å; L54-Q58 HydrophobicContact CG-CB 4.48Å; S55-Q58 VanDerWaalsContact N-OE1 3.08Å; S55-Q58 CarbonylContact O-C 3.59Å; S55-Q58 WeakPolarHBondContact O-CA 3.48Å; S55-Q58 WeakPolarHBondContact O-CB 3.27Å; S55-Q58 PolarHBondContact O-N 3.29Å; S55-Q58 VanDerWaalsContact OG-CG 3.3Å; S55-Q58 WeakPolarHBondContact OG-CG 3.41Å; S55-Q58 PolarHBondContact OG-OE1 3.17Å; P56-Q58 VanDerWaalsContact C-N 3.32Å; P56-Q58 PolarHBondContact O-N 2.95Å; Q58-D60 VanDerWaalsContact C-N 3.34Å; Q58-V61 PolarHBondContact O-N 3.39Å; Q58-F62 WeakPolarHBondContact O-CB 3.38Å; Q58-F62 PolarHBondContact O-N 2.8Å
59Q90.4Very high91.3Very high26 Ų2674.5 Ų74.512%0.12137%0.365CS..Hα-helixtrans-60.1-44.5172.7-71.8179.1-16.700110.5Y50 L54 S55 P56 V61 F62 E63Y50-Q59 HydrophobicContact CD2-CB 4.38Å; Y50-Q59 HydrophobicContact CD2-CG 3.98Å; Y50-Q59 HydrophobicContact CE2-CB 3.87Å; Y50-Q59 HydrophobicContact CE2-CG 3.84Å; Y50-Q59 PolarHBondContact O-NE2 2.93Å; L54-Q59 HydrophobicContact CB-CG 3.75Å; S55-Q59 WeakPolarHBondContact O-CG 3.47Å; S55-Q59 PolarHBondContact O-N 2.8Å; P56-Q59 WeakPolarHBondContact O-CB 3.16Å; P56-Q59 PolarHBondContact O-N 3.4Å; Q59-V61 VanDerWaalsContact C-N 3.33Å; Q59-V61 PolarHBondContact O-N 3.06Å; Q59-F62 PolarHBondContact O-N 3.02Å; Q59-F62 VanDerWaalsContact O-N 3.15Å; Q59-E63 VanDerWaalsContact O-CG 3.29Å; Q59-E63 WeakPolarHBondContact O-CG 3.39Å; Q59-E63 PolarHBondContact O-N 3.4Å
60D89Confident91Very high80 Ų8074.7 Ų74.743%0.42837%0.367SS..Hα-helixtrans-57.3-43.9176-72.9-30.4000112.8P56 Q58 E63 Q64P56-D60 PolarHBondContact O-N 3.02Å; P56-D60 VanDerWaalsContact O-N 3.09Å; Q58-D60 VanDerWaalsContact C-N 3.34Å; D60-E63 PolarHBondContact O-N 3.26Å; D60-Q64 WeakPolarHBondContact O-CG 3.35Å; D60-Q64 PolarHBondContact O-N 2.88Å; D60-Q64 VanDerWaalsContact O-N 3.13Å
61V90.9Very high90.8Very high95 Ų9579.9 Ų79.958%0.57640%0.395SS*.Hα-helixtrans-67.3-41.5177.4176.30000110.9Q58 Q59 E63 Q64 L65Q58-V61 PolarHBondContact O-N 3.39Å; Q59-V61 VanDerWaalsContact C-N 3.33Å; Q59-V61 PolarHBondContact O-N 3.06Å; V61-E63 VanDerWaalsContact C-N 3.34Å; V61-E63 PolarHBondContact O-N 3.4Å; V61-Q64 PolarHBondContact O-N 2.89Å; V61-L65 PolarHBondContact O-N 2.74Å
62F92.4Very high90.5Very high32 Ų3284.6 Ų84.614%0.1442%0.417CS..Hα-helixtrans-63-41.1176.7-173-108.3000111.5I46 Y50 L54 Q58 Q59 Q64 L65 I66 I254 Q257I46-F62 HydrophobicContact CG2-CE2 4.28Å; I46-F62 HydrophobicContact CG2-CZ 3.64Å; Y50-F62 HydrophobicContact CD2-CB 4.49Å; Y50-F62 AromaticContact CD2-CD1 3.34Å; Y50-F62 HydrophobicContact CD2-CD1 3.34Å; Y50-F62 AromaticContact CD2-CE1 3.89Å; Y50-F62 HydrophobicContact CD2-CE1 3.89Å; Y50-F62 HydrophobicContact CD2-CG 4.25Å; Y50-F62 AromaticContact CE2-CD1 3.97Å; Y50-F62 HydrophobicContact CE2-CD1 3.97Å; Y50-F62 AromaticContact CG-CD1 3.83Å; Y50-F62 HydrophobicContact CG-CD1 3.83Å; Y50-F62 AromaticContact CG-CE1 3.88Å; Y50-F62 HydrophobicContact CG-CE1 3.88Å; L54-F62 HydrophobicContact CD1-CB 4Å; L54-F62 HydrophobicContact CD1-CG 4.15Å; Q58-F62 WeakPolarHBondContact O-CB 3.38Å; Q58-F62 PolarHBondContact O-N 2.8Å; Q59-F62 PolarHBondContact O-N 3.02Å; Q59-F62 VanDerWaalsContact O-N 3.15Å; F62-Q64 VanDerWaalsContact C-N 3.34Å; F62-Q64 PolarHBondContact O-N 3.17Å; F62-L65 CarbonylContact O-C 3.41Å; F62-L65 WeakPolarHBondContact O-CA 3.48Å; F62-L65 VanDerWaalsContact O-CB 3.31Å; F62-L65 WeakPolarHBondContact O-CB 3.36Å; F62-L65 PolarHBondContact O-N 3.4Å; F62-I66 HydrophobicContact CD1-CD1 3.71Å; F62-I66 HydrophobicContact CD1-CG1 4.14Å; F62-I66 HydrophobicContact CE1-CD1 3.59Å; F62-I66 HydrophobicContact CE1-CG1 3.97Å; F62-I66 HydrophobicContact CZ-CD1 4.43Å; F62-I66 HydrophobicContact CZ-CG1 4.38Å; F62-I66 WeakPolarHBondContact O-CG1 3.35Å; F62-I66 PolarHBondContact O-N 3.23Å; F62-I254 HydrophobicContact CE2-CG2 4.08Å; F62-I254 HydrophobicContact CZ-CG2 4.38Å; F62-Q257 HydrophobicContact CE1-CB 4.34Å; F62-Q257 HydrophobicContact CE1-CG 4.38Å; F62-Q257 HydrophobicContact CZ-CG 4.19Å
63E91.3Very high90.3Very high4 Ų476.9 Ų76.92%0.01939%0.387CS..Hα-helixtrans-63.7-37.6176.2-72-179.9-16600113Y50 Q59 D60 V61 L65 I66 R67 I259 T261 G262Y50-E63 HydrophobicContact CE2-CG 4.13Å; Y50-E63 PolarHBondContact OH-OE1 3Å; Q59-E63 VanDerWaalsContact O-CG 3.29Å; Q59-E63 WeakPolarHBondContact O-CG 3.39Å; Q59-E63 PolarHBondContact O-N 3.4Å; D60-E63 PolarHBondContact O-N 3.26Å; V61-E63 VanDerWaalsContact C-N 3.34Å; V61-E63 PolarHBondContact O-N 3.4Å; E63-L65 VanDerWaalsContact C-N 3.3Å; E63-I66 PolarHBondContact O-N 2.95Å; E63-R67 WeakPolarHBondContact O-CG 3.28Å; E63-R67 PolarHBondContact O-N 3.2Å; E63-R67 VanDerWaalsContact O-N 3.09Å; E63-I259 HydrophobicContact CB-CD1 4.35Å; E63-I259 HydrophobicContact CG-CB 4.49Å; E63-I259 HydrophobicContact CG-CD1 4.35Å; E63-I259 HydrophobicContact CG-CG1 4.15Å; E63-I259 HydrophobicContact CG-CG2 3.76Å; E63-I259 WeakPolarHBondContact OE1-CG2 2.96Å; E63-I259 WeakPolarHBondContact OE2-CG2 2.96Å; E63-T261 VanDerWaalsContact OE1-O 3.08Å; E63-G262 WeakPolarHBondContact OE2-CA 3.25Å
64Q89.9Confident89.8Confident128 Ų12873.8 Ų73.860%0.59837%0.374SS*.Hα-helixtrans-63-39.5171.2-69.4173.735.800111.4D60 V61 F62 R67 Y68D60-Q64 WeakPolarHBondContact O-CG 3.35Å; D60-Q64 PolarHBondContact O-N 2.88Å; D60-Q64 VanDerWaalsContact O-N 3.13Å; V61-Q64 PolarHBondContact O-N 2.89Å; F62-Q64 VanDerWaalsContact C-N 3.34Å; F62-Q64 PolarHBondContact O-N 3.17Å; Q64-R67 PolarHBondContact O-N 3.41Å; Q64-Y68 WeakPolarHBondContact O-CB 3.3Å; Q64-Y68 PolarHBondContact O-N 3.07Å
65L91.9Very high89.3Confident67 Ų6775.3 Ų75.335%0.35139%0.392SS..Hα-helixtrans-66.2-41.9177.1-169.767.7000112.1V61 F62 E63 R67 Y68 F69 I254V61-L65 PolarHBondContact O-N 2.74Å; F62-L65 CarbonylContact O-C 3.41Å; F62-L65 WeakPolarHBondContact O-CA 3.48Å; F62-L65 VanDerWaalsContact O-CB 3.31Å; F62-L65 WeakPolarHBondContact O-CB 3.36Å; F62-L65 PolarHBondContact O-N 3.4Å; E63-L65 VanDerWaalsContact C-N 3.3Å; L65-R67 VanDerWaalsContact C-N 3.35Å; L65-R67 PolarHBondContact O-N 2.75Å; L65-Y68 PolarHBondContact O-N 3.03Å; L65-F69 HydrophobicContact CD1-CD2 3.93Å; L65-F69 HydrophobicContact CD1-CE2 3.43Å; L65-F69 VanDerWaalsContact CD1-CE2 3.43Å; L65-F69 HydrophobicContact CD1-CZ 4.12Å; L65-F69 HydrophobicContact CD2-CE2 4.01Å; L65-F69 HydrophobicContact CG-CD2 3.74Å; L65-F69 HydrophobicContact CG-CE2 3.53Å; L65-F69 WeakPolarHBondContact O-CD2 3.11Å; L65-F69 PolarHBondContact O-N 2.87Å; L65-I254 HydrophobicContact CD2-CG2 3.99Å; L65-I254 HydrophobicContact CG-CG2 4.1Å
66I92.4Very high89Confident7 Ų778.7 Ų78.74%0.03641%0.407CS..Hα-helixtrans-54.8-53.5172.8-65.2170.9000109.2F62 E63 Y68 F69 D70 I254 G255 Q257 I259F62-I66 HydrophobicContact CD1-CD1 3.71Å; F62-I66 HydrophobicContact CD1-CG1 4.14Å; F62-I66 HydrophobicContact CE1-CD1 3.59Å; F62-I66 HydrophobicContact CE1-CG1 3.97Å; F62-I66 HydrophobicContact CZ-CD1 4.43Å; F62-I66 HydrophobicContact CZ-CG1 4.38Å; F62-I66 WeakPolarHBondContact O-CG1 3.35Å; F62-I66 PolarHBondContact O-N 3.23Å; E63-I66 PolarHBondContact O-N 2.95Å; I66-Y68 VanDerWaalsContact C-N 3.32Å; I66-Y68 PolarHBondContact O-N 3.41Å; I66-F69 PolarHBondContact O-N 3.37Å; I66-D70 WeakPolarHBondContact O-CB 2.83Å; I66-D70 PolarHBondContact O-N 3.48Å; I66-I254 WeakPolarHBondContact CG1-O 3.3Å; I66-G255 WeakPolarHBondContact CG2-O 3.15Å; I66-Q257 HydrophobicContact CD1-CB 3.71Å; I66-Q257 HydrophobicContact CG1-CB 4.13Å; I66-I259 HydrophobicContact CB-CD1 4.45Å; I66-I259 HydrophobicContact CD1-CD1 4.42Å; I66-I259 HydrophobicContact CD1-CG1 3.81Å; I66-I259 HydrophobicContact CG2-CD1 4.18Å; I66-I259 HydrophobicContact CG2-CG1 4.35Å
67R89.9Confident88.9Confident98 Ų9875.7 Ų75.737%0.3739%0.385SS..Hα-helixtrans-61.6-39.5-179.4-69.3174.9-173.5164.48.9112.2E63 Q64 L65 N71 I259E63-R67 WeakPolarHBondContact O-CG 3.28Å; E63-R67 PolarHBondContact O-N 3.2Å; E63-R67 VanDerWaalsContact O-N 3.09Å; Q64-R67 PolarHBondContact O-N 3.41Å; L65-R67 VanDerWaalsContact C-N 3.35Å; L65-R67 PolarHBondContact O-N 2.75Å; R67-N71 WeakPolarHBondContact O-CB 3.14Å; R67-N71 PolarHBondContact O-N 3.38Å; R67-I259 HydrophobicContact CG-CD1 4.37Å
68Y91.4Very high89Confident175 Ų17575.2 Ų75.269%0.68638%0.38SS*.Hα-helixtrans-60.9-46.5176.8175.6-98.9000111.7Q64 L65 I66Q64-Y68 WeakPolarHBondContact O-CB 3.3Å; Q64-Y68 PolarHBondContact O-N 3.07Å; L65-Y68 PolarHBondContact O-N 3.03Å; I66-Y68 VanDerWaalsContact C-N 3.32Å; I66-Y68 PolarHBondContact O-N 3.41Å
69F91.9Very high89Confident57 Ų5770.6 Ų70.625%0.2536%0.359CS..Hα-helixtrans-74.6-32.5-178.2-79.7-51000114.1L65 I66 L73 I251 I254L65-F69 HydrophobicContact CD1-CD2 3.93Å; L65-F69 HydrophobicContact CD1-CE2 3.43Å; L65-F69 VanDerWaalsContact CD1-CE2 3.43Å; L65-F69 HydrophobicContact CD1-CZ 4.12Å; L65-F69 HydrophobicContact CD2-CE2 4.01Å; L65-F69 HydrophobicContact CG-CD2 3.74Å; L65-F69 HydrophobicContact CG-CE2 3.53Å; L65-F69 WeakPolarHBondContact O-CD2 3.11Å; L65-F69 PolarHBondContact O-N 2.87Å; I66-F69 PolarHBondContact O-N 3.37Å; F69-L73 WeakPolarHBondContact O-CB 3.37Å; F69-I251 HydrophobicContact CB-CG2 3.69Å; F69-I251 HydrophobicContact CD1-CG2 3.59Å; F69-I251 HydrophobicContact CE1-CG2 4.47Å; F69-I251 HydrophobicContact CG-CG2 3.85Å; F69-I254 HydrophobicContact CD2-CB 4Å; F69-I254 HydrophobicContact CD2-CD1 4.48Å; F69-I254 HydrophobicContact CD2-CG2 3.74Å; F69-I254 HydrophobicContact CE2-CB 4.41Å; F69-I254 HydrophobicContact CE2-CD1 4.03Å; F69-I254 HydrophobicContact CE2-CG2 4.17Å
70D89.3Confident89.1Confident70 Ų7073 Ų7337%0.37438%0.375SS..Hα-helixtrans-78-31.1178.2-162.843.4000112.5I66 K72 L73 G255 R256I66-D70 WeakPolarHBondContact O-CB 2.83Å; I66-D70 PolarHBondContact O-N 3.48Å; D70-K72 PolarHBondContact O-N 3.01Å; D70-L73 PolarHBondContact O-N 3.25Å; D70-L73 VanDerWaalsContact O-N 3.16Å; D70-G255 WeakPolarHBondContact CB-O 3.47Å; D70-R256 WeakPolarHBondContact OD1-CD 3.38Å; D70-R256 IonicContact OD1-CZ 3.76Å; D70-R256 IonicContact OD1-NE 3.56Å; D70-R256 PolarHBondContact OD1-NE 3.22Å; D70-R256 IonicContact OD1-NH2 3.29Å
71N88.1Confident89.2Confident109 Ų10975.3 Ų75.358%0.58338%0.382SS*.THydrogen-bonded Turntrans-60.1112-176.2-17420.9000111.5R67 L73R67-N71 WeakPolarHBondContact O-CB 3.14Å; R67-N71 PolarHBondContact O-N 3.38Å; N71-L73 PolarHBondContact O-N 3.26Å
72K83.1Confident89.2Confident146 Ų14673.3 Ų73.364%0.63537%0.367SS*.THydrogen-bonded Turntrans58.522.5-179.6-62-178.2178.6-177.10114.6D70 D74 A75 N76D70-K72 PolarHBondContact O-N 3.01Å; K72-D74 VanDerWaalsContact C-N 3.31Å; K72-D74 PolarHBondContact O-N 2.81Å; K72-A75 HydrophobicContact CB-CB 4.32Å; K72-A75 PolarHBondContact O-N 3.48Å; K72-A75 VanDerWaalsContact O-N 3.09Å; K72-N76 WeakPolarHBondContact O-CB 3.4Å; K72-N76 PolarHBondContact O-N 3.46Å; K72-N76 PolarHBondContact O-ND2 3Å
73L87.8Confident89.3Confident8 Ų871.8 Ų71.84%0.04236%0.361CS..Hα-helixtrans-52.9-49.4178.4-175.959.5000112.3F69 D70 N71 A75 N76 I77 Y248 I251 C252F69-L73 WeakPolarHBondContact O-CB 3.37Å; D70-L73 PolarHBondContact O-N 3.25Å; D70-L73 VanDerWaalsContact O-N 3.16Å; N71-L73 PolarHBondContact O-N 3.26Å; L73-A75 VanDerWaalsContact C-N 3.26Å; L73-A75 PolarHBondContact O-N 3.28Å; L73-N76 PolarHBondContact O-N 3.3Å; L73-I77 HydrophobicContact CD1-CD1 4.2Å; L73-I77 PolarHBondContact O-N 2.85Å; L73-I77 VanDerWaalsContact O-N 3.1Å; L73-Y248 HydrophobicContact CD1-CD2 4.3Å; L73-Y248 HydrophobicContact CD2-CD2 4.35Å; L73-Y248 HydrophobicContact CD2-CE2 4.02Å; L73-Y248 HydrophobicContact CG-CD2 4.03Å; L73-Y248 HydrophobicContact CG-CE2 3.76Å; L73-I251 HydrophobicContact CD1-CB 4.23Å; L73-I251 HydrophobicContact CD1-CD1 4.16Å; L73-I251 HydrophobicContact CD1-CG2 3.68Å; L73-I251 HydrophobicContact CD2-CG2 3.99Å; L73-I251 HydrophobicContact CG-CG2 4.49Å; L73-C252 VanDerWaalsContact CD2-SG 3.59Å
74D82.9Confident89.5Confident81 Ų8172.4 Ų72.443%0.43337%0.368SS..Hα-helixtrans-67.7-25.4-177.8-64.3-17.4000112.9K72 Y248 R256K72-D74 VanDerWaalsContact C-N 3.31Å; K72-D74 PolarHBondContact O-N 2.81Å; D74-Y248 WeakPolarHBondContact OD1-CE2 3.36Å; D74-Y248 PolarHBondContact OD1-OH 2.96Å; D74-R256 IonicContact OD1-NH2 3.27Å; D74-R256 PolarHBondContact OD1-NH2 3.33Å; D74-R256 IonicContact OD2-NH2 2.75Å; D74-R256 PolarHBondContact OD2-NH2 2.89Å
75A82.9Confident89.7Confident76 Ų7672 Ų7263%0.62837%0.365SS*.Hα-helixtrans-84.5-32.9176.300000112.2K72 L73K72-A75 HydrophobicContact CB-CB 4.32Å; K72-A75 PolarHBondContact O-N 3.48Å; K72-A75 VanDerWaalsContact O-N 3.09Å; L73-A75 VanDerWaalsContact C-N 3.26Å; L73-A75 PolarHBondContact O-N 3.28Å
76N85.3Confident89.9Confident115 Ų11568.8 Ų68.862%0.61535%0.348SS*.Hα-helixtrans-75.7-33.7-178.7-68.2-20.6000112.1K72 L73 P78K72-N76 WeakPolarHBondContact O-CB 3.4Å; K72-N76 PolarHBondContact O-N 3.46Å; K72-N76 PolarHBondContact O-ND2 3Å; L73-N76 PolarHBondContact O-N 3.3Å; N76-P78 WeakPolarHBondContact O-CD 3.41Å
77I87.6Confident90Very high37 Ų3769 Ų6919%0.1935%0.35CS..SBendtrans-119.691.2-179.9-52.1178.4000109.1L73 L79 Y248 I251L73-I77 HydrophobicContact CD1-CD1 4.2Å; L73-I77 PolarHBondContact O-N 2.85Å; L73-I77 VanDerWaalsContact O-N 3.1Å; I77-L79 HydrophobicContact CG2-CD2 3.63Å; I77-L79 HydrophobicContact CG2-CG 3.99Å; I77-L79 PolarHBondContact O-N 3.33Å; I77-Y248 HydrophobicContact CB-CD2 4.17Å; I77-Y248 HydrophobicContact CD1-CD2 4.33Å; I77-Y248 HydrophobicContact CG2-CD2 4.39Å; I77-I251 HydrophobicContact CD1-CD1 4.23Å
78P89.2Confident90.3Very high67 Ų6768.1 Ų68.144%0.43536%0.359SS..  trans-7870.7-17732.6-36.4000111.7N76 T80 F81 L82N76-P78 WeakPolarHBondContact O-CD 3.41Å; P78-T80 VanDerWaalsContact C-N 3.26Å; P78-T80 PolarHBondContact O-N 3.14Å; P78-F81 HydrophobicContact CB-CB 4.43Å; P78-F81 PolarHBondContact O-N 3.49Å; P78-L82 PolarHBondContact O-N 2.9Å
79L91.8Very high90.5Very high4 Ų464.1 Ų64.12%0.02135%0.345CS..Hα-helixtrans-55.7-38.8-176.9-70.5-173.6000112.9I77 F81 L82 L83 A244 V245 Y248 Y283I77-L79 HydrophobicContact CG2-CD2 3.63Å; I77-L79 HydrophobicContact CG2-CG 3.99Å; I77-L79 PolarHBondContact O-N 3.33Å; L79-F81 VanDerWaalsContact C-N 3.34Å; L79-F81 PolarHBondContact O-N 2.83Å; L79-L82 PolarHBondContact O-N 3.24Å; L79-L83 VanDerWaalsContact O-CB 3.32Å; L79-L83 WeakPolarHBondContact O-CB 3.41Å; L79-L83 PolarHBondContact O-N 3.15Å; L79-A244 HydrophobicContact CD2-CB 4.31Å; L79-V245 HydrophobicContact CD2-CB 4.49Å; L79-V245 HydrophobicContact CD2-CG2 3.94Å; L79-Y248 HydrophobicContact CD1-CD1 3.47Å; L79-Y248 VanDerWaalsContact CD1-CD1 3.47Å; L79-Y248 HydrophobicContact CD1-CD2 3.9Å; L79-Y248 HydrophobicContact CD1-CE1 3.94Å; L79-Y248 HydrophobicContact CD1-CE2 4.32Å; L79-Y248 HydrophobicContact CD1-CG 3.45Å; L79-Y248 VanDerWaalsContact CD1-CG 3.45Å; L79-Y248 HydrophobicContact CG-CD2 4.27Å; L79-Y248 HydrophobicContact CG-CG 4.19Å; L79-Y283 HydrophobicContact CB-CD1 4.08Å; L79-Y283 HydrophobicContact CB-CE1 3.95Å; L79-Y283 HydrophobicContact CD1-CD1 4.41Å; L79-Y283 HydrophobicContact CD1-CD2 4.31Å; L79-Y283 HydrophobicContact CD1-CG 4.18Å
80T92.5Very high90.7Very high77 Ų7761.5 Ų61.547%0.47233%0.333SS..Hα-helixtrans-60.7-42.9-178.3-50.40000112.6P78 G84 Y283 W286P78-T80 VanDerWaalsContact C-N 3.26Å; P78-T80 PolarHBondContact O-N 3.14Å; T80-G84 PolarHBondContact O-N 3.38Å; T80-Y283 PolarHBondContact OG1-OH 3.38Å; T80-Y283 VanDerWaalsContact OG1-OH 3.08Å; T80-W286 HydrophobicContact CG2-CH2 4.34Å; T80-W286 HydrophobicContact CG2-CZ3 4.14Å; T80-W286 WeakPolarHBondContact O-CH2 3.31Å
81F91.5Very high91Very high129 Ų12961 Ų6157%0.56633%0.332SS*.Hα-helixtrans-67.1-51.6178178.7-88.9000110P78 L79 L83 G84 F85P78-F81 HydrophobicContact CB-CB 4.43Å; P78-F81 PolarHBondContact O-N 3.49Å; L79-F81 VanDerWaalsContact C-N 3.34Å; L79-F81 PolarHBondContact O-N 2.83Å; F81-L83 PolarHBondContact O-N 2.84Å; F81-G84 PolarHBondContact O-N 3.27Å; F81-F85 HydrophobicContact CD1-CD2 4.04Å; F81-F85 HydrophobicContact CD1-CE2 4.31Å; F81-F85 AromaticContact CD2-CD2 4Å; F81-F85 HydrophobicContact CD2-CD2 4Å; F81-F85 AromaticContact CD2-CE2 3.51Å; F81-F85 HydrophobicContact CD2-CE2 3.51Å; F81-F85 AromaticContact CE1-CD2 3.82Å; F81-F85 HydrophobicContact CE1-CD2 3.82Å; F81-F85 AromaticContact CE1-CE2 3.96Å; F81-F85 HydrophobicContact CE1-CE2 3.96Å; F81-F85 AromaticContact CE2-CD2 3.82Å; F81-F85 HydrophobicContact CE2-CD2 3.82Å; F81-F85 AromaticContact CE2-CE2 3.12Å; F81-F85 HydrophobicContact CE2-CE2 3.12Å; F81-F85 AromaticContact CE2-CZ 3.96Å; F81-F85 HydrophobicContact CE2-CZ 3.96Å; F81-F85 HydrophobicContact CG-CD2 4.11Å; F81-F85 HydrophobicContact CG-CE2 4.1Å; F81-F85 AromaticContact CZ-CD2 3.7Å; F81-F85 HydrophobicContact CZ-CD2 3.7Å; F81-F85 AromaticContact CZ-CE2 3.35Å; F81-F85 HydrophobicContact CZ-CE2 3.35Å; F81-F85 HydrophobicContact CZ-CZ 4.14Å; F81-F85 VanDerWaalsContact O-CD2 3.3Å; F81-F85 WeakPolarHBondContact O-CD2 3.43Å; F81-F85 PolarHBondContact O-N 3.39Å; F81-F85 VanDerWaalsContact O-N 3.15Å
82L91Very high91.4Very high52 Ų5258.7 Ų58.727%0.27233%0.329SS..Hα-helixtrans-56.8-50.7-178.7-70.2174.2000112.2P78 L79 F86 I241 A244P78-L82 PolarHBondContact O-N 2.9Å; L79-L82 PolarHBondContact O-N 3.24Å; L82-F86 WeakPolarHBondContact O-CB 3.11Å; L82-F86 PolarHBondContact O-N 2.96Å; L82-I241 HydrophobicContact CB-CD1 3.69Å; L82-I241 HydrophobicContact CD2-CD1 4.16Å; L82-I241 HydrophobicContact CG-CD1 4.42Å; L82-A244 HydrophobicContact CD1-CB 4.46Å
83L94.3Very high92Very high0 Ų053.5 Ų53.50%031%0.305CS..Hα-helixtrans-67.4-39.9178.3-78166.4000112.2L79 F81 F85 F86 V87 I241 V245 Y283 W286 M287L79-L83 VanDerWaalsContact O-CB 3.32Å; L79-L83 WeakPolarHBondContact O-CB 3.41Å; L79-L83 PolarHBondContact O-N 3.15Å; F81-L83 PolarHBondContact O-N 2.84Å; L83-F85 PolarHBondContact O-N 3.41Å; L83-F86 PolarHBondContact O-N 2.99Å; L83-V87 VanDerWaalsContact O-CB 3.28Å; L83-V87 WeakPolarHBondContact O-CB 3.42Å; L83-V87 WeakPolarHBondContact O-CG2 3.35Å; L83-V87 PolarHBondContact O-N 3.24Å; L83-I241 HydrophobicContact CD2-CG2 3.77Å; L83-I241 HydrophobicContact CG-CG2 4.44Å; L83-V245 HydrophobicContact CD1-CG2 3.89Å; L83-V245 HydrophobicContact CD2-CG2 4.09Å; L83-V245 HydrophobicContact CG-CG2 4.12Å; L83-Y283 HydrophobicContact CD1-CD1 3.77Å; L83-W286 HydrophobicContact CB-CD2 3.94Å; L83-W286 HydrophobicContact CB-CE3 3.57Å; L83-W286 HydrophobicContact CB-CH2 4.21Å; L83-W286 HydrophobicContact CB-CZ3 3.72Å; L83-W286 HydrophobicContact CD1-CE3 3.89Å; L83-W286 HydrophobicContact CG-CE3 4.36Å; L83-M287 HydrophobicContact CD2-CB 3.92Å; L83-M287 HydrophobicContact CD2-CG 4.44Å
84G94.6Very high92.3Very high17 Ų1756 Ų5618%0.17531%0.314CS..Hα-helixtrans-57.6-49.1-18000000113T80 F81 S88 W286T80-G84 PolarHBondContact O-N 3.38Å; F81-G84 PolarHBondContact O-N 3.27Å; G84-S88 VanDerWaalsContact O-CB 3.29Å; G84-S88 WeakPolarHBondContact O-CB 3.46Å; G84-S88 PolarHBondContact O-N 3.11Å; G84-S88 VanDerWaalsContact O-N 3.16Å; G84-S88 PolarHBondContact O-OG 3.43Å; G84-W286 VanDerWaalsContact CA-CH2 3.5Å; G84-W286 VanDerWaalsContact CA-CZ2 3.46Å
85F94.1Very high92.8Very high120 Ų12053 Ų5353%0.52630%0.303SS..Hα-helixtrans-66.6-45.3176.7-79.7-77.1000112.2F81 L83 F89F81-F85 HydrophobicContact CD1-CD2 4.04Å; F81-F85 HydrophobicContact CD1-CE2 4.31Å; F81-F85 AromaticContact CD2-CD2 4Å; F81-F85 HydrophobicContact CD2-CD2 4Å; F81-F85 AromaticContact CD2-CE2 3.51Å; F81-F85 HydrophobicContact CD2-CE2 3.51Å; F81-F85 AromaticContact CE1-CD2 3.82Å; F81-F85 HydrophobicContact CE1-CD2 3.82Å; F81-F85 AromaticContact CE1-CE2 3.96Å; F81-F85 HydrophobicContact CE1-CE2 3.96Å; F81-F85 AromaticContact CE2-CD2 3.82Å; F81-F85 HydrophobicContact CE2-CD2 3.82Å; F81-F85 AromaticContact CE2-CE2 3.12Å; F81-F85 HydrophobicContact CE2-CE2 3.12Å; F81-F85 AromaticContact CE2-CZ 3.96Å; F81-F85 HydrophobicContact CE2-CZ 3.96Å; F81-F85 HydrophobicContact CG-CD2 4.11Å; F81-F85 HydrophobicContact CG-CE2 4.1Å; F81-F85 AromaticContact CZ-CD2 3.7Å; F81-F85 HydrophobicContact CZ-CD2 3.7Å; F81-F85 AromaticContact CZ-CE2 3.35Å; F81-F85 HydrophobicContact CZ-CE2 3.35Å; F81-F85 HydrophobicContact CZ-CZ 4.14Å; F81-F85 VanDerWaalsContact O-CD2 3.3Å; F81-F85 WeakPolarHBondContact O-CD2 3.43Å; F81-F85 PolarHBondContact O-N 3.39Å; F81-F85 VanDerWaalsContact O-N 3.15Å; L83-F85 PolarHBondContact O-N 3.41Å; F85-F89 WeakPolarHBondContact O-CB 3.45Å; F85-F89 PolarHBondContact O-N 3.34Å
86F95.6Very high93.4Very high0 Ų051.5 Ų51.50%029%0.288CS..Hα-helixtrans-64.2-49.2-177.6-179-113.5000112.3L82 L83 S88 F89 V90 V233 Y237 P238 I241 F242 A290 L294L82-F86 WeakPolarHBondContact O-CB 3.11Å; L82-F86 PolarHBondContact O-N 2.96Å; L83-F86 PolarHBondContact O-N 2.99Å; F86-S88 PolarHBondContact O-N 3.18Å; F86-F89 PolarHBondContact O-N 3.18Å; F86-V90 HydrophobicContact CD2-CG2 4.37Å; F86-V90 HydrophobicContact CE1-CG2 4.19Å; F86-V90 HydrophobicContact CE2-CG2 3.98Å; F86-V90 HydrophobicContact CZ-CG2 3.88Å; F86-V90 WeakPolarHBondContact O-CG2 3.38Å; F86-V90 PolarHBondContact O-N 3.33Å; F86-V233 HydrophobicContact CE2-CG1 4.38Å; F86-Y237 HydrophobicContact CB-CE2 4.47Å; F86-Y237 HydrophobicContact CD2-CD1 4.23Å; F86-Y237 HydrophobicContact CD2-CD2 4.16Å; F86-Y237 HydrophobicContact CD2-CE1 4.13Å; F86-Y237 HydrophobicContact CD2-CE2 4.05Å; F86-Y237 HydrophobicContact CD2-CG 4.26Å; F86-Y237 HydrophobicContact CE2-CG 4.44Å; F86-P238 HydrophobicContact CE2-CB 4.43Å; F86-P238 HydrophobicContact CE2-CG 4.03Å; F86-P238 HydrophobicContact CZ-CB 4Å; F86-P238 HydrophobicContact CZ-CG 3.95Å; F86-I241 HydrophobicContact CB-CD1 4.26Å; F86-I241 HydrophobicContact CB-CG1 4.06Å; F86-I241 HydrophobicContact CB-CG2 4.42Å; F86-I241 HydrophobicContact CD1-CB 4.31Å; F86-I241 HydrophobicContact CD1-CG1 4.34Å; F86-I241 HydrophobicContact CD1-CG2 3.85Å; F86-I241 HydrophobicContact CD2-CG1 4.21Å; F86-I241 HydrophobicContact CE1-CG2 4.43Å; F86-I241 HydrophobicContact CG-CB 4.42Å; F86-I241 HydrophobicContact CG-CG1 3.95Å; F86-I241 HydrophobicContact CG-CG2 4.24Å; F86-F242 AromaticContact CE1-CE1 3.84Å; F86-F242 HydrophobicContact CE1-CE1 3.84Å; F86-F242 HydrophobicContact CE1-CZ 4.24Å; F86-F242 HydrophobicContact CZ-CE1 4.43Å; F86-F242 HydrophobicContact CZ-CZ 4.46Å; F86-A290 HydrophobicContact CD1-CB 3.77Å; F86-A290 HydrophobicContact CE1-CB 3.51Å; F86-L294 HydrophobicContact CZ-CD1 4.46Å; F86-L294 HydrophobicContact CZ-CD2 4.37Å
87V95.9Very high93.8Very high11 Ų1146.4 Ų46.47%0.06726%0.26CS..Hα-helixtrans-63.1-43.8179.7174.70000110.5L83 F89 V90 V91 W286 V289 A290L83-V87 VanDerWaalsContact O-CB 3.28Å; L83-V87 WeakPolarHBondContact O-CB 3.42Å; L83-V87 WeakPolarHBondContact O-CG2 3.35Å; L83-V87 PolarHBondContact O-N 3.24Å; V87-F89 VanDerWaalsContact C-N 3.3Å; V87-F89 PolarHBondContact O-N 3.44Å; V87-V90 PolarHBondContact O-N 3.39Å; V87-V91 HydrophobicContact CG1-CG2 4.15Å; V87-V91 WeakPolarHBondContact O-CB 3.41Å; V87-V91 VanDerWaalsContact O-CG2 3.27Å; V87-V91 WeakPolarHBondContact O-CG2 3.41Å; V87-V91 PolarHBondContact O-N 2.7Å; V87-W286 HydrophobicContact CG2-CG 4.25Å; V87-V289 HydrophobicContact CG1-CG1 4.35Å; V87-A290 HydrophobicContact CG2-CB 3.85Å
88S96Very high94.1Very high80 Ų8047.7 Ų47.756%0.55927%0.267SS*.Hα-helixtrans-60.2-41.7177.7-58.80000112G84 F86 A92G84-S88 VanDerWaalsContact O-CB 3.29Å; G84-S88 WeakPolarHBondContact O-CB 3.46Å; G84-S88 PolarHBondContact O-N 3.11Å; G84-S88 VanDerWaalsContact O-N 3.16Å; G84-S88 PolarHBondContact O-OG 3.43Å; F86-S88 PolarHBondContact O-N 3.18Å; S88-A92 WeakPolarHBondContact O-CB 3.32Å; S88-A92 PolarHBondContact O-N 3.17Å
89F95.7Very high94.2Very high91 Ų9151.1 Ų51.140%0.39928%0.282SS..Hα-helixtrans-63.3-46.2175.4169.7-100.1000112.3F85 F86 V87 A92 R93 V233F85-F89 WeakPolarHBondContact O-CB 3.45Å; F85-F89 PolarHBondContact O-N 3.34Å; F86-F89 PolarHBondContact O-N 3.18Å; V87-F89 VanDerWaalsContact C-N 3.3Å; V87-F89 PolarHBondContact O-N 3.44Å; F89-A92 PolarHBondContact O-N 2.82Å; F89-R93 WeakPolarHBondContact O-CB 3.49Å; F89-R93 PolarHBondContact O-N 3.19Å; F89-V233 HydrophobicContact CE1-CB 4.28Å; F89-V233 HydrophobicContact CE1-CG1 3.74Å; F89-V233 HydrophobicContact CE1-CG2 3.64Å; F89-V233 HydrophobicContact CZ-CG2 4.41Å
90V95.9Very high94.2Very high1 Ų151.2 Ų51.21%0.00628%0.284CS..Hα-helixtrans-63.7-42.4178.1173.90000111.3F86 V87 A92 R93 W94 A290 L293 L294F86-V90 HydrophobicContact CD2-CG2 4.37Å; F86-V90 HydrophobicContact CE1-CG2 4.19Å; F86-V90 HydrophobicContact CE2-CG2 3.98Å; F86-V90 HydrophobicContact CZ-CG2 3.88Å; F86-V90 WeakPolarHBondContact O-CG2 3.38Å; F86-V90 PolarHBondContact O-N 3.33Å; V87-V90 PolarHBondContact O-N 3.39Å; V90-A92 PolarHBondContact O-N 3.17Å; V90-R93 PolarHBondContact O-N 3.13Å; V90-W94 WeakPolarHBondContact O-CB 3.48Å; V90-W94 PolarHBondContact O-N 3.37Å; V90-A290 HydrophobicContact CB-CB 4.46Å; V90-A290 HydrophobicContact CG2-CB 4.36Å; V90-L293 HydrophobicContact CG1-CB 3.64Å; V90-L294 HydrophobicContact CG1-CG 4.46Å; V90-L294 HydrophobicContact CG2-CD2 4Å; V90-L294 HydrophobicContact CG2-CG 4.46Å
91V95.4Very high94.2Very high59 Ų5948.2 Ų48.236%0.35827%0.265SS..Hα-helixtrans-62.5-42.2176.61710000111.6V87 R93 W94 G95 L293V87-V91 HydrophobicContact CG1-CG2 4.15Å; V87-V91 WeakPolarHBondContact O-CB 3.41Å; V87-V91 VanDerWaalsContact O-CG2 3.27Å; V87-V91 WeakPolarHBondContact O-CG2 3.41Å; V87-V91 PolarHBondContact O-N 2.7Å; V91-R93 VanDerWaalsContact C-N 3.34Å; V91-R93 PolarHBondContact O-N 3.1Å; V91-W94 WeakPolarHBondContact O-CB 3.4Å; V91-W94 PolarHBondContact O-N 3.38Å; V91-G95 PolarHBondContact O-N 2.7Å; V91-L293 HydrophobicContact CG2-CD1 3.75Å
92A96.1Very high94.1Very high61 Ų6142.4 Ų42.450%0.50424%0.241SC..Hα-helixtrans-63.5-40.9176.700000112.1S88 F89 V90 G95 S96S88-A92 WeakPolarHBondContact O-CB 3.32Å; S88-A92 PolarHBondContact O-N 3.17Å; F89-A92 PolarHBondContact O-N 2.82Å; V90-A92 PolarHBondContact O-N 3.17Å; A92-G95 PolarHBondContact O-N 3.38Å; A92-S96 PolarHBondContact O-N 3.4Å; A92-S96 VanDerWaalsContact O-N 3.13Å; A92-S96 PolarHBondContact O-OG 3.26Å
93R95Very high94.4Very high38 Ų3845.7 Ų45.714%0.14325%0.25CC..Hα-helixtrans-64.3-45.9174.5-179.3178165.6100.11.7111.6F89 V90 V91 G95 S96 I97 Y228 V231F89-R93 WeakPolarHBondContact O-CB 3.49Å; F89-R93 PolarHBondContact O-N 3.19Å; V90-R93 PolarHBondContact O-N 3.13Å; V91-R93 VanDerWaalsContact C-N 3.34Å; V91-R93 PolarHBondContact O-N 3.1Å; R93-G95 VanDerWaalsContact C-N 3.33Å; R93-G95 PolarHBondContact O-N 3.26Å; R93-S96 WeakPolarHBondContact O-CB 3.34Å; R93-S96 PolarHBondContact O-N 3.2Å; R93-I97 HydrophobicContact CG-CD1 4.39Å; R93-I97 PolarHBondContact O-N 3.19Å; R93-Y228 HydrophobicContact CG-CD1 3.92Å; R93-Y228 HydrophobicContact CG-CE1 3.83Å; R93-Y228 PolarHBondContact NH2-O 3.46Å; R93-V231 PolarHBondContact NH1-O 3.05Å; R93-V231 PolarHBondContact NH2-O 3.23Å; R93-V231 VanDerWaalsContact NH2-O 3.09Å
94W94.6Very high94.5Very high59 Ų5945.7 Ų45.722%0.22325%0.25CC..Hα-helixtrans-54.7-47.4174.1167.481.2000111.9V90 V91 S96 I97 L98 L293V90-W94 WeakPolarHBondContact O-CB 3.48Å; V90-W94 PolarHBondContact O-N 3.37Å; V91-W94 WeakPolarHBondContact O-CB 3.4Å; V91-W94 PolarHBondContact O-N 3.38Å; W94-S96 PolarHBondContact O-N 3.1Å; W94-I97 WeakPolarHBondContact O-CB 3.49Å; W94-I97 PolarHBondContact O-N 3.35Å; W94-I97 VanDerWaalsContact O-N 3.13Å; W94-L98 HydrophobicContact CH2-CD2 3.95Å; W94-L98 HydrophobicContact CZ2-CD2 4.08Å; W94-L98 PolarHBondContact O-N 2.63Å; W94-L293 HydrophobicContact CB-CB 4.46Å; W94-L293 HydrophobicContact CD2-CD2 4.35Å; W94-L293 HydrophobicContact CG-CD2 4Å
95G94.6Very high94.6Very high19 Ų1947.2 Ų47.220%0.19625%0.254CS..Hα-helixtrans-60.9-3417700000112.7V91 A92 R93 L98 N99V91-G95 PolarHBondContact O-N 2.7Å; A92-G95 PolarHBondContact O-N 3.38Å; R93-G95 VanDerWaalsContact C-N 3.33Å; R93-G95 PolarHBondContact O-N 3.26Å; G95-L98 PolarHBondContact O-N 3.14Å; G95-N99 VanDerWaalsContact O-CG 3.22Å; G95-N99 PolarHBondContact O-N 3.01Å; G95-N99 PolarHBondContact O-ND2 3Å
96S94.5Very high94.7Very high45 Ų4546.3 Ų46.332%0.31525%0.254SS..Hα-helixtrans-72.4-34.3176-56.40000113.2A92 R93 W94 G100 Y228A92-S96 PolarHBondContact O-N 3.4Å; A92-S96 VanDerWaalsContact O-N 3.13Å; A92-S96 PolarHBondContact O-OG 3.26Å; R93-S96 WeakPolarHBondContact O-CB 3.34Å; R93-S96 PolarHBondContact O-N 3.2Å; W94-S96 PolarHBondContact O-N 3.1Å; S96-G100 PolarHBondContact O-N 3.41Å; S96-Y228 WeakPolarHBondContact CB-OH 3.4Å
97I94.2Very high94.7Very high7 Ų746.4 Ų46.44%0.03626%0.255CS..Hα-helixtrans-64.6-46.4171.4-66.3167.6000109.6R93 W94 N99 G100 I101 L225 Y228 P296 L304R93-I97 HydrophobicContact CG-CD1 4.39Å; R93-I97 PolarHBondContact O-N 3.19Å; W94-I97 WeakPolarHBondContact O-CB 3.49Å; W94-I97 PolarHBondContact O-N 3.35Å; W94-I97 VanDerWaalsContact O-N 3.13Å; I97-N99 VanDerWaalsContact C-N 3.31Å; I97-N99 PolarHBondContact O-N 3.24Å; I97-G100 WeakPolarHBondContact O-CA 3.13Å; I97-G100 PolarHBondContact O-N 3.02Å; I97-I101 PolarHBondContact O-N 3.36Å; I97-L225 HydrophobicContact CG2-CD2 3.84Å; I97-L225 VanDerWaalsContact O-CD2 3.26Å; I97-L225 WeakPolarHBondContact O-CD2 3.27Å; I97-Y228 HydrophobicContact CD1-CG 4.3Å; I97-Y228 HydrophobicContact CG1-CD1 4.14Å; I97-Y228 HydrophobicContact CG1-CD2 3.76Å; I97-Y228 HydrophobicContact CG1-CE2 4.4Å; I97-Y228 HydrophobicContact CG1-CG 3.64Å; I97-P296 HydrophobicContact CB-CG 4.35Å; I97-P296 HydrophobicContact CD1-CG 3.83Å; I97-P296 HydrophobicContact CG2-CG 3.93Å; I97-L304 HydrophobicContact CG2-CD1 4.35Å
98L93Very high94.8Very high64 Ų6445.9 Ų45.934%0.33525%0.252SS..Hα-helixtrans-57.5-43.7177.4-17965.5000112W94 G95 G100 I101 L304W94-L98 HydrophobicContact CH2-CD2 3.95Å; W94-L98 HydrophobicContact CZ2-CD2 4.08Å; W94-L98 PolarHBondContact O-N 2.63Å; G95-L98 PolarHBondContact O-N 3.14Å; L98-G100 PolarHBondContact O-N 3.37Å; L98-I101 HydrophobicContact CD1-CD1 3.89Å; L98-I101 WeakPolarHBondContact O-CB 3.37Å; L98-I101 WeakPolarHBondContact O-CG1 3.42Å; L98-I101 PolarHBondContact O-N 3.44Å; L98-L304 HydrophobicContact CD1-CD2 3.77Å
99N92.1Very high94.7Very high140 Ų14046.6 Ų46.675%0.74925%0.249SC*.Hα-helixtrans-67.5-19.5176.2-69.5-23.2000113.5G95 I97 I101G95-N99 VanDerWaalsContact O-CG 3.22Å; G95-N99 PolarHBondContact O-N 3.01Å; G95-N99 PolarHBondContact O-ND2 3Å; I97-N99 VanDerWaalsContact C-N 3.31Å; I97-N99 PolarHBondContact O-N 3.24Å; N99-I101 VanDerWaalsContact C-N 3.34Å
100G91.4Very high94.7Very high5 Ų543.7 Ų43.75%0.05224%0.238CC..Hα-helixtrans-80.3-12.7176.400000114.1S96 I97 L98 G102 G221S96-G100 PolarHBondContact O-N 3.41Å; I97-G100 WeakPolarHBondContact O-CA 3.13Å; I97-G100 PolarHBondContact O-N 3.02Å; L98-G100 PolarHBondContact O-N 3.37Å; G100-G102 PolarHBondContact O-N 2.89Å; G100-G221 CarbonylContact O-C 3.54Å; G100-G221 WeakPolarHBondContact O-CA 3.34Å
101I93.1Very high94.6Very high15 Ų1543.7 Ų43.78%0.07724%0.238CC..SBendtrans-66.2120.7178-59.9178.7000109.5I97 L98 N99 W103 L304 I309I97-I101 PolarHBondContact O-N 3.36Å; L98-I101 HydrophobicContact CD1-CD1 3.89Å; L98-I101 WeakPolarHBondContact O-CB 3.37Å; L98-I101 WeakPolarHBondContact O-CG1 3.42Å; L98-I101 PolarHBondContact O-N 3.44Å; N99-I101 VanDerWaalsContact C-N 3.34Å; I101-W103 PolarHBondContact O-N 3.24Å; I101-L304 HydrophobicContact CD1-CD1 3.72Å; I101-L304 HydrophobicContact CD1-CD2 4.11Å; I101-L304 HydrophobicContact CD1-CG 4.39Å; I101-I309 HydrophobicContact CD1-CD1 3.98Å; I101-I309 HydrophobicContact CG2-CD1 3.84Å; I101-I309 HydrophobicContact CG2-CG2 3.9Å
102G89.9Confident94.5Very high6 Ų642.5 Ų42.56%0.06223%0.234CC..PPolyproline II helixtrans-72123.1176.900000112.3G100 Q137 N313G100-G102 PolarHBondContact O-N 2.89Å; G102-Q137 PolarHBondContact O-NE2 2.83Å; G102-N313 PolarHBondContact O-ND2 3.48Å
103W95.5Very high94.2Very high121 Ų12142.8 Ų42.846%0.45823%0.229SC..PPolyproline II helixtrans-101.8137.1168.1-63.896000109.6I101 D105 I309 K312I101-W103 PolarHBondContact O-N 3.24Å; W103-D105 VanDerWaalsContact C-N 3.31Å; W103-I309 HydrophobicContact CH2-CG1 4.45Å; W103-K312 HydrophobicContact CE3-CD 4.13Å; W103-K312 HydrophobicContact CZ3-CD 3.92Å
104I97.2Very high94.1Very high0 Ų044.4 Ų44.40%024%0.236CC..SBendtrans-81.4-13.8-171.8-157.645.2000113.7D106 A107 S108 V130 L133 V134 N313I104-D106 PolarHBondContact O-N 2.79Å; I104-A107 PolarHBondContact O-N 3.42Å; I104-S108 WeakPolarHBondContact CG1-OG 3.39Å; I104-S108 WeakPolarHBondContact O-CB 3.41Å; I104-S108 PolarHBondContact O-N 3.25Å; I104-S108 PolarHBondContact O-OG 2.8Å; I104-V130 HydrophobicContact CD1-CG1 4.44Å; I104-V130 HydrophobicContact CG1-CG1 4.01Å; I104-L133 HydrophobicContact CD1-CB 3.73Å; I104-L133 HydrophobicContact CD1-CD1 3.67Å; I104-L133 HydrophobicContact CD1-CG 4.35Å; I104-V134 HydrophobicContact CD1-CG2 4.29Å; I104-V134 HydrophobicContact CG1-CG2 4.27Å; I104-N313 HydrophobicContact CB-CB 3.85Å; I104-N313 HydrophobicContact CG2-CB 3.97Å; I104-N313 WeakPolarHBondContact CG2-O 3.41Å; I104-N313 PolarHBondContact N-OD1 3.37Å
105D96.2Very high94.1Very high50 Ų5041.6 Ų41.627%0.26723%0.225SC..Hα-helixtrans-63.2-48.7-161.3-53-125.6000111W103 S108 L109 K312 M320W103-D105 VanDerWaalsContact C-N 3.31Å; D105-S108 PolarHBondContact O-N 3.01Å; D105-L109 WeakPolarHBondContact O-CB 3.29Å; D105-L109 PolarHBondContact O-N 2.88Å; D105-K312 IonicContact OD1-NZ 3.93Å; D105-K312 PolarHBondContact OD1-NZ 3.31Å; D105-K312 IonicContact OD2-NZ 3.67Å; D105-K312 PolarHBondContact OD2-NZ 2.86Å; D105-M320 HydrophobicContact CB-CE 4.49Å; D105-M320 HydrophobicContact CB-SD 4.4Å; D105-M320 VanDerWaalsContact O-CE 3.26Å; D105-M320 WeakPolarHBondContact O-CE 3.44Å
106D96.2Very high93.8Very high100 Ų10047.4 Ų47.454%0.53524%0.241SC..Hα-helixtrans-61.2-49.4179-67.7-33.5000111I104 S108 L109 L110 E214I104-D106 PolarHBondContact O-N 2.79Å; D106-S108 PolarHBondContact O-N 3.19Å; D106-L109 PolarHBondContact O-N 3.46Å; D106-L110 WeakPolarHBondContact O-CG 3.41Å; D106-L110 PolarHBondContact O-N 3.31Å; D106-L110 VanDerWaalsContact O-N 3.16Å; D106-E214 HydrophobicContact CB-CG 4.05Å
107A97.1Very high93.4Very high2 Ų246.7 Ų46.72%0.01724%0.241CC..Hα-helixtrans-61.5-43.7178.100000112I104 L109 L110 F111 L133 E214I104-A107 PolarHBondContact O-N 3.42Å; A107-L109 PolarHBondContact O-N 3.47Å; A107-L110 PolarHBondContact O-N 3.48Å; A107-F111 HydrophobicContact CB-CE2 3.96Å; A107-F111 HydrophobicContact CB-CZ 3.98Å; A107-F111 WeakPolarHBondContact O-CD1 3.28Å; A107-F111 VanDerWaalsContact O-CD2 3.26Å; A107-F111 WeakPolarHBondContact O-CD2 3.37Å; A107-F111 WeakPolarHBondContact O-CG 3.44Å; A107-F111 PolarHBondContact O-N 2.9Å; A107-L133 HydrophobicContact CB-CD1 3.57Å; A107-E214 HydrophobicContact CB-CG 4.14Å
108S96.1Very high93Very high0 Ų049.4 Ų49.40%027%0.265CS..Hα-helixtrans-64.6-39.5180-590000112.3I104 D105 D106 L110 F111 A112 G317I104-S108 WeakPolarHBondContact CG1-OG 3.39Å; I104-S108 WeakPolarHBondContact O-CB 3.41Å; I104-S108 PolarHBondContact O-N 3.25Å; I104-S108 PolarHBondContact O-OG 2.8Å; D105-S108 PolarHBondContact O-N 3.01Å; D106-S108 PolarHBondContact O-N 3.19Å; S108-L110 VanDerWaalsContact C-N 3.32Å; S108-L110 PolarHBondContact O-N 3.43Å; S108-F111 PolarHBondContact O-N 3.03Å; S108-A112 WeakPolarHBondContact O-CB 3.46Å; S108-A112 PolarHBondContact O-N 3.16Å; S108-G317 WeakPolarHBondContact OG-CA 3.48Å
109L94.5Very high92.9Very high96 Ų9649.4 Ų49.450%0.50327%0.265SS..Hα-helixtrans-62.4-41.7176.1-173.165.1000111.1D105 D106 A107 A112 T113 M320D105-L109 WeakPolarHBondContact O-CB 3.29Å; D105-L109 PolarHBondContact O-N 2.88Å; D106-L109 PolarHBondContact O-N 3.46Å; A107-L109 PolarHBondContact O-N 3.47Å; L109-A112 PolarHBondContact O-N 3.47Å; L109-T113 HydrophobicContact CD1-CG2 4.43Å; L109-T113 WeakPolarHBondContact O-CB 3.38Å; L109-T113 VanDerWaalsContact O-CG2 3.31Å; L109-T113 WeakPolarHBondContact O-CG2 3.26Å; L109-T113 PolarHBondContact O-N 2.93Å; L109-T113 VanDerWaalsContact O-N 3.07Å; L109-T113 PolarHBondContact O-OG1 2.71Å; L109-M320 HydrophobicContact CB-CE 3.91Å; L109-M320 HydrophobicContact CD1-CE 4.43Å
110L95.1Very high92.8Very high30 Ų3050.4 Ų50.416%0.15727%0.265CS..Hα-helixtrans-66.9-42.4175.5-61.9-177.1000111.8D106 A107 S108 A112 T113 Y114 I211 E214D106-L110 WeakPolarHBondContact O-CG 3.41Å; D106-L110 PolarHBondContact O-N 3.31Å; D106-L110 VanDerWaalsContact O-N 3.16Å; A107-L110 PolarHBondContact O-N 3.48Å; S108-L110 VanDerWaalsContact C-N 3.32Å; S108-L110 PolarHBondContact O-N 3.43Å; L110-A112 VanDerWaalsContact C-N 3.34Å; L110-A112 PolarHBondContact O-N 3.36Å; L110-T113 PolarHBondContact O-N 3.22Å; L110-T113 PolarHBondContact O-OG1 3.44Å; L110-Y114 HydrophobicContact CB-CD2 4.4Å; L110-Y114 HydrophobicContact CD2-CD2 4.1Å; L110-Y114 HydrophobicContact CD2-CE2 3.59Å; L110-Y114 WeakPolarHBondContact O-CB 3.49Å; L110-Y114 PolarHBondContact O-N 3.34Å; L110-I211 HydrophobicContact CB-CG1 4.26Å; L110-E214 HydrophobicContact CD1-CB 3.58Å; L110-E214 HydrophobicContact CD1-CG 3.87Å
111F95.3Very high92.9Very high1 Ų154.5 Ų54.50%0.00428%0.283CS..Hα-helixtrans-61.1-43.1175.7-57.5-29.6000111.8A107 S108 I115 R126 L129 V130 L133 I211 I215 V321A107-F111 HydrophobicContact CB-CE2 3.96Å; A107-F111 HydrophobicContact CB-CZ 3.98Å; A107-F111 WeakPolarHBondContact O-CD1 3.28Å; A107-F111 VanDerWaalsContact O-CD2 3.26Å; A107-F111 WeakPolarHBondContact O-CD2 3.37Å; A107-F111 WeakPolarHBondContact O-CG 3.44Å; A107-F111 PolarHBondContact O-N 2.9Å; S108-F111 PolarHBondContact O-N 3.03Å; F111-I115 HydrophobicContact CB-CD1 4.24Å; F111-I115 HydrophobicContact CD1-CD1 4.13Å; F111-I115 VanDerWaalsContact O-CB 3.3Å; F111-I115 WeakPolarHBondContact O-CB 3.4Å; F111-I115 PolarHBondContact O-N 3.24Å; F111-R126 VanDerWaalsContact O-CD 3.28Å; F111-R126 WeakPolarHBondContact O-CD 3.48Å; F111-L129 HydrophobicContact CD1-CB 4.4Å; F111-L129 HydrophobicContact CD1-CD1 3.89Å; F111-L129 HydrophobicContact CD2-CB 3.87Å; F111-L129 HydrophobicContact CE1-CB 4.19Å; F111-L129 HydrophobicContact CE1-CD1 4.08Å; F111-L129 HydrophobicContact CE2-CB 3.66Å; F111-L129 HydrophobicContact CG-CB 4.25Å; F111-L129 HydrophobicContact CG-CD1 4.19Å; F111-L129 HydrophobicContact CZ-CB 3.84Å; F111-V130 HydrophobicContact CD2-CG2 3.95Å; F111-V130 HydrophobicContact CE2-CG2 4.3Å; F111-L133 HydrophobicContact CE2-CD1 3.85Å; F111-L133 HydrophobicContact CZ-CD1 3.75Å; F111-I211 HydrophobicContact CD1-CG2 3.75Å; F111-I211 HydrophobicContact CE1-CG2 3.43Å; F111-I211 VanDerWaalsContact CE1-CG2 3.43Å; F111-I215 HydrophobicContact CE1-CD1 4.1Å; F111-I215 HydrophobicContact CE1-CG1 4.25Å; F111-I215 HydrophobicContact CZ-CD1 4.26Å; F111-I215 HydrophobicContact CZ-CG1 4.11Å; F111-V321 HydrophobicContact CB-CG1 3.98Å
112A92.6Very high92.9Very high33 Ų3353.8 Ų53.827%0.27328%0.28SS..Hα-helixtrans-66-37.1-179.900000112.7S108 L109 L110 M320 V321S108-A112 WeakPolarHBondContact O-CB 3.46Å; S108-A112 PolarHBondContact O-N 3.16Å; L109-A112 PolarHBondContact O-N 3.47Å; L110-A112 VanDerWaalsContact C-N 3.34Å; L110-A112 PolarHBondContact O-N 3.36Å; A112-M320 VanDerWaalsContact CB-O 3.31Å; A112-M320 WeakPolarHBondContact CB-O 3.43Å; A112-V321 HydrophobicContact CB-CG1 4.41Å
113T90.7Very high93Very high68 Ų6858.8 Ų58.842%0.41730%0.297SS..Hα-helixtrans-91.2-37.4-172.852.80000113.8L109 L110L109-T113 HydrophobicContact CD1-CG2 4.43Å; L109-T113 WeakPolarHBondContact O-CB 3.38Å; L109-T113 VanDerWaalsContact O-CG2 3.31Å; L109-T113 WeakPolarHBondContact O-CG2 3.26Å; L109-T113 PolarHBondContact O-N 2.93Å; L109-T113 VanDerWaalsContact O-N 3.07Å; L109-T113 PolarHBondContact O-OG1 2.71Å; L110-T113 PolarHBondContact O-N 3.22Å; L110-T113 PolarHBondContact O-OG1 3.44Å
114Y93.1Very high92.9Very high71 Ų7156.3 Ų56.328%0.27829%0.294SS..Hα-helixtrans-100-17.8-172.3-63.1-16.6000114.1L110 L207 K210 I211L110-Y114 HydrophobicContact CB-CD2 4.4Å; L110-Y114 HydrophobicContact CD2-CD2 4.1Å; L110-Y114 HydrophobicContact CD2-CE2 3.59Å; L110-Y114 WeakPolarHBondContact O-CB 3.49Å; L110-Y114 PolarHBondContact O-N 3.34Å; Y114-L207 HydrophobicContact CD1-CD1 4.3Å; Y114-L207 HydrophobicContact CD1-CD2 4.06Å; Y114-L207 HydrophobicContact CD2-CB 4.11Å; Y114-L207 HydrophobicContact CD2-CD2 4.17Å; Y114-L207 HydrophobicContact CE1-CD2 3.84Å; Y114-L207 HydrophobicContact CE2-CD2 3.92Å; Y114-L207 HydrophobicContact CG-CB 4.2Å; Y114-L207 HydrophobicContact CG-CD1 4.47Å; Y114-L207 HydrophobicContact CG-CD2 4.25Å; Y114-K210 HydrophobicContact CE2-CB 4.08Å; Y114-I211 HydrophobicContact CD2-CD1 4.47Å; Y114-I211 HydrophobicContact CD2-CG1 4.08Å
115I93.6Very high92.9Very high0 Ų057 Ų570%030%0.298CS..SBendtrans-98.892.6173.8-52.5176.1000108.6F111 T122 R126 L129 K201 V202 I211F111-I115 HydrophobicContact CB-CD1 4.24Å; F111-I115 HydrophobicContact CD1-CD1 4.13Å; F111-I115 VanDerWaalsContact O-CB 3.3Å; F111-I115 WeakPolarHBondContact O-CB 3.4Å; F111-I115 PolarHBondContact O-N 3.24Å; I115-T122 HydrophobicContact CG2-CG2 3.8Å; I115-R126 HydrophobicContact CB-CG 4.16Å; I115-R126 HydrophobicContact CG2-CG 4.16Å; I115-R126 PolarHBondContact O-NH1 2.81Å; I115-L129 HydrophobicContact CD1-CD1 3.21Å; I115-K201 HydrophobicContact CG2-CB 4.44Å; I115-V202 HydrophobicContact CG1-CG2 4.18Å; I115-I211 HydrophobicContact CD1-CD1 4.45Å; I115-I211 HydrophobicContact CG1-CD1 4.05Å
116R88Confident92.8Very high141 Ų14155.2 Ų55.253%0.53229%0.287SS..  trans-84.1144.8-174.6-63.3-174.8177.4165.310.1111.5K201 D203R116-K201 PolarHBondContact N-O 3.06Å; R116-D203 IonicContact CZ-OD1 3.34Å; R116-D203 IonicContact CZ-OD2 2.65Å; R116-D203 IonicContact NE-OD2 3.42Å; R116-D203 IonicContact NH1-OD1 3.65Å; R116-D203 PolarHBondContact NH1-OD1 3.21Å; R116-D203 IonicContact NH1-OD2 2.78Å; R116-D203 PolarHBondContact NH1-OD2 3.07Å; R116-D203 IonicContact NH2-OD2 3.61Å; R116-D203 PolarHBondContact NH2-OD2 3.42Å; R116-D203 VanDerWaalsContact NH2-OD2 3.15Å
117G86.8Confident92.8Very high30 Ų3054 Ų5431%0.30928%0.276SS..  trans141.2131.1-179.900000111.5D119 R126G117-D119 WeakPolarHBondContact CA-OD1 3.33Å; G117-R126 PolarHBondContact O-NH1 3.11Å; G117-R126 PolarHBondContact O-NH2 2.88Å
118A85.4Confident92.8Very high65 Ų6555.7 Ų55.754%0.53728%0.284SS..  trans-97-5.1173.700000112.1E323A118-E323 VanDerWaalsContact CB-OE1 3.26Å; A118-E323 WeakPolarHBondContact CB-OE1 3.44Å
119D90.1Very high92.9Very high64 Ų6455.7 Ų55.734%0.34228%0.284SS..SBendtrans-65.7149.817558.4-66.4000111.6G117 E121 T122 R123 K201G117-D119 WeakPolarHBondContact CA-OD1 3.33Å; D119-E121 PolarHBondContact O-N 3.03Å; D119-E121 WeakPolarHBondContact OD2-CB 3.31Å; D119-T122 PolarHBondContact O-N 2.99Å; D119-T122 VanDerWaalsContact O-N 3.15Å; D119-T122 WeakPolarHBondContact OD1-CB 3.35Å; D119-T122 PolarHBondContact OD1-OG1 3.4Å; D119-T122 PolarHBondContact OD2-N 2.91Å; D119-T122 PolarHBondContact OD2-OG1 3.41Å; D119-R123 PolarHBondContact O-N 2.69Å; D119-R123 VanDerWaalsContact O-N 3.09Å; D119-K201 IonicContact OD2-NZ 3.49Å; D119-K201 PolarHBondContact OD2-NZ 3.23Å
120E91.6Very high93.1Very high160 Ų16051.1 Ų51.175%0.74826%0.26SS*.Hα-helixtrans-56.5-38.1179.5-175.2174.2-171.300111.8T122 R123 V124E120-T122 PolarHBondContact O-N 3.19Å; E120-R123 WeakPolarHBondContact O-CB 3.31Å; E120-R123 PolarHBondContact O-N 3.32Å; E120-V124 HydrophobicContact CG-CG2 4.49Å; E120-V124 VanDerWaalsContact O-CG2 3.32Å; E120-V124 WeakPolarHBondContact O-CG2 3.41Å; E120-V124 PolarHBondContact O-N 2.85Å
121E92.9Very high93.2Very high92 Ų9250.4 Ų50.443%0.4326%0.255SS..Hα-helixtrans-61.1-47.6177.7-175.8-158.5-170.500111.3D119 R123 V124 I125 K199 K201D119-E121 PolarHBondContact O-N 3.03Å; D119-E121 WeakPolarHBondContact OD2-CB 3.31Å; E121-R123 VanDerWaalsContact C-N 3.31Å; E121-R123 PolarHBondContact O-N 3.24Å; E121-V124 PolarHBondContact O-N 3.25Å; E121-I125 HydrophobicContact CG-CD1 4.23Å; E121-I125 VanDerWaalsContact O-CG1 3.32Å; E121-I125 WeakPolarHBondContact O-CG1 3.46Å; E121-I125 PolarHBondContact O-N 2.67Å; E121-K199 IonicContact OE1-NZ 2.73Å; E121-K199 PolarHBondContact OE1-NZ 3.44Å; E121-K201 VanDerWaalsContact CD-NZ 3.32Å; E121-K201 IonicContact OE2-NZ 2.69Å; E121-K201 PolarHBondContact OE2-NZ 3.45Å
122T92.8Very high93.4Very high0 Ų051.6 Ų51.60%026%0.26CS..Hα-helixtrans-61.5-40.4176-55.50000111.7I115 D119 E120 V124 I125 R126 K201I115-T122 HydrophobicContact CG2-CG2 3.8Å; D119-T122 PolarHBondContact O-N 2.99Å; D119-T122 VanDerWaalsContact O-N 3.15Å; D119-T122 WeakPolarHBondContact OD1-CB 3.35Å; D119-T122 PolarHBondContact OD1-OG1 3.4Å; D119-T122 PolarHBondContact OD2-N 2.91Å; D119-T122 PolarHBondContact OD2-OG1 3.41Å; E120-T122 PolarHBondContact O-N 3.19Å; T122-V124 PolarHBondContact O-N 3.16Å; T122-I125 PolarHBondContact O-N 2.81Å; T122-R126 PolarHBondContact O-N 2.83Å; T122-K201 HydrophobicContact CG2-CD 4.23Å; T122-K201 VanDerWaalsContact OG1-CD 3.31Å; T122-K201 WeakPolarHBondContact OG1-CD 3.47Å; T122-K201 VanDerWaalsContact OG1-CE 3.27Å; T122-K201 WeakPolarHBondContact OG1-CE 3.4Å; T122-K201 PolarHBondContact OG1-NZ 2.92Å
123R92.3Very high93.7Very high111 Ų11150 Ų5042%0.41925%0.247SC..Hα-helixtrans-61-44.8176.4-174.4-179.6179.5-154.8-0.4111.4D119 E120 E121 I125 R126 R127 E322D119-R123 PolarHBondContact O-N 2.69Å; D119-R123 VanDerWaalsContact O-N 3.09Å; E120-R123 WeakPolarHBondContact O-CB 3.31Å; E120-R123 PolarHBondContact O-N 3.32Å; E121-R123 VanDerWaalsContact C-N 3.31Å; E121-R123 PolarHBondContact O-N 3.24Å; R123-I125 VanDerWaalsContact C-N 3.33Å; R123-I125 PolarHBondContact O-N 3.29Å; R123-R126 PolarHBondContact O-N 3.22Å; R123-R127 WeakPolarHBondContact O-CG 3.4Å; R123-R127 PolarHBondContact O-N 3.35Å; R123-E322 IonicContact CZ-OE2 3.43Å; R123-E322 IonicContact NE-OE1 3.56Å; R123-E322 IonicContact NE-OE2 2.83Å; R123-E322 PolarHBondContact NE-OE2 2.85Å; R123-E322 IonicContact NH2-OE1 2.8Å; R123-E322 IonicContact NH2-OE2 3.23Å; R123-E322 PolarHBondContact NH2-OE2 3.08Å
124V94.4Very high94Very high68 Ų6846.8 Ų46.841%0.41223%0.227SC..Hα-helixtrans-60.3-43.6175.2169.80000110.8E120 E121 T122 R127 N128E120-V124 HydrophobicContact CG-CG2 4.49Å; E120-V124 VanDerWaalsContact O-CG2 3.32Å; E120-V124 WeakPolarHBondContact O-CG2 3.41Å; E120-V124 PolarHBondContact O-N 2.85Å; E121-V124 PolarHBondContact O-N 3.25Å; T122-V124 PolarHBondContact O-N 3.16Å; V124-R127 PolarHBondContact O-N 2.93Å; V124-N128 WeakPolarHBondContact CG1-ND2 3.5Å; V124-N128 WeakPolarHBondContact O-CB 3.47Å; V124-N128 PolarHBondContact O-N 3.42Å
125I95.6Very high94.2Very high14 Ų1443.4 Ų43.47%0.07221%0.214CC..Hα-helixtrans-61.6-48.8178.4-66163.2000111.3E121 T122 R123 R127 N128 L129 L192 C196 K201E121-I125 HydrophobicContact CG-CD1 4.23Å; E121-I125 VanDerWaalsContact O-CG1 3.32Å; E121-I125 WeakPolarHBondContact O-CG1 3.46Å; E121-I125 PolarHBondContact O-N 2.67Å; T122-I125 PolarHBondContact O-N 2.81Å; R123-I125 VanDerWaalsContact C-N 3.33Å; R123-I125 PolarHBondContact O-N 3.29Å; I125-R127 VanDerWaalsContact C-N 3.31Å; I125-R127 PolarHBondContact O-N 2.91Å; I125-N128 PolarHBondContact O-N 3.32Å; I125-L129 HydrophobicContact CG2-CD1 4.05Å; I125-L129 HydrophobicContact CG2-CG 4.35Å; I125-L129 WeakPolarHBondContact O-CG 3.4Å; I125-L129 PolarHBondContact O-N 3.32Å; I125-L192 HydrophobicContact CG2-CB 4.41Å; I125-C196 VanDerWaalsContact CG2-SG 3.56Å; I125-K201 HydrophobicContact CD1-CD 4.45Å
126R95.4Very high94.4Very high13 Ų1343.4 Ų43.45%0.04921%0.214CC..Hα-helixtrans-60.3-41.2179.1-67.6-166.8-66.5-92.9-6.7112F111 I115 G117 T122 R123 L129 V130 V321F111-R126 VanDerWaalsContact O-CD 3.28Å; F111-R126 WeakPolarHBondContact O-CD 3.48Å; I115-R126 HydrophobicContact CB-CG 4.16Å; I115-R126 HydrophobicContact CG2-CG 4.16Å; I115-R126 PolarHBondContact O-NH1 2.81Å; G117-R126 PolarHBondContact O-NH1 3.11Å; G117-R126 PolarHBondContact O-NH2 2.88Å; T122-R126 PolarHBondContact O-N 2.83Å; R123-R126 PolarHBondContact O-N 3.22Å; R126-L129 PolarHBondContact O-N 3.47Å; R126-V130 PolarHBondContact O-N 3.38Å; R126-V321 HydrophobicContact CB-CB 3.88Å; R126-V321 HydrophobicContact CB-CG1 4.4Å; R126-V321 HydrophobicContact CB-CG2 4.13Å; R126-V321 PolarHBondContact NE-O 3.23Å
127R95.9Very high94.8Very high76 Ų7636.7 Ų36.729%0.28719%0.189SC..Hα-helixtrans-65-42.3175.5-69.7178.264.774.110.2111.8R123 V124 I125 V130 R131 Y318 V321 E322R123-R127 WeakPolarHBondContact O-CG 3.4Å; R123-R127 PolarHBondContact O-N 3.35Å; V124-R127 PolarHBondContact O-N 2.93Å; I125-R127 VanDerWaalsContact C-N 3.31Å; I125-R127 PolarHBondContact O-N 2.91Å; R127-V130 PolarHBondContact O-N 3.14Å; R127-R131 WeakPolarHBondContact O-CB 2.97Å; R127-R131 PolarHBondContact O-N 2.9Å; R127-Y318 HydrophobicContact CB-CD1 4.39Å; R127-Y318 HydrophobicContact CB-CE1 4.11Å; R127-Y318 HydrophobicContact CG-CD1 4.37Å; R127-Y318 VanDerWaalsContact NH2-CD2 3.33Å; R127-Y318 WeakPolarHBondContact O-CE1 3.43Å; R127-V321 HydrophobicContact CG-CG2 4.31Å; R127-E322 WeakPolarHBondContact CD-OE1 3.17Å; R127-E322 IonicContact CZ-OE1 2.65Å; R127-E322 IonicContact NE-OE1 2.98Å; R127-E322 IonicContact NH1-OE1 3.29Å; R127-E322 PolarHBondContact NH1-OE1 3.26Å
128N97.3Very high95.3Very high37 Ų3735.3 Ų35.320%0.19817%0.174CC..Hα-helixtrans-66.6-36.7177.8-76.7-20.6000112.5V124 I125 V130 R131 Y132 L192V124-N128 WeakPolarHBondContact CG1-ND2 3.5Å; V124-N128 WeakPolarHBondContact O-CB 3.47Å; V124-N128 PolarHBondContact O-N 3.42Å; I125-N128 PolarHBondContact O-N 3.32Å; N128-V130 PolarHBondContact O-N 3Å; N128-R131 PolarHBondContact O-N 2.96Å; N128-R131 PolarHBondContact OD1-NE 3.38Å; N128-R131 PolarHBondContact OD1-NH2 3Å; N128-Y132 HydrophobicContact CB-CE2 4.43Å; N128-Y132 WeakPolarHBondContact O-CB 3.49Å; N128-Y132 PolarHBondContact O-N 3.38Å; N128-L192 HydrophobicContact CB-CD1 4.08Å
129L98.1Very high95.8Very high0 Ų032.4 Ų32.40%015%0.149CC..Hα-helixtrans-60-45.8174.5-75.1170.2000112.5F111 I115 I125 R126 L133 S189 L192 V193F111-L129 HydrophobicContact CD1-CB 4.4Å; F111-L129 HydrophobicContact CD1-CD1 3.89Å; F111-L129 HydrophobicContact CD2-CB 3.87Å; F111-L129 HydrophobicContact CE1-CB 4.19Å; F111-L129 HydrophobicContact CE1-CD1 4.08Å; F111-L129 HydrophobicContact CE2-CB 3.66Å; F111-L129 HydrophobicContact CG-CB 4.25Å; F111-L129 HydrophobicContact CG-CD1 4.19Å; F111-L129 HydrophobicContact CZ-CB 3.84Å; I115-L129 HydrophobicContact CD1-CD1 3.21Å; I125-L129 HydrophobicContact CG2-CD1 4.05Å; I125-L129 HydrophobicContact CG2-CG 4.35Å; I125-L129 WeakPolarHBondContact O-CG 3.4Å; I125-L129 PolarHBondContact O-N 3.32Å; R126-L129 PolarHBondContact O-N 3.47Å; L129-L133 PolarHBondContact O-N 3.15Å; L129-S189 WeakPolarHBondContact CD2-O 3.29Å; L129-L192 HydrophobicContact CD2-CB 3.91Å; L129-L192 HydrophobicContact CD2-CD1 4.27Å; L129-L192 HydrophobicContact CG-CB 4.46Å; L129-L192 HydrophobicContact CG-CD1 4.38Å; L129-V193 HydrophobicContact CD1-CG2 4.22Å; L129-V193 HydrophobicContact CD2-CG2 3.88Å
130V98.1Very high96.1Very high0 Ų029.4 Ų29.40%013%0.133CC..Hα-helixtrans-59.7-51.2172.8171.70000110.1I104 F111 R126 R127 N128 Y132 L133 V134 Y318 V321I104-V130 HydrophobicContact CD1-CG1 4.44Å; I104-V130 HydrophobicContact CG1-CG1 4.01Å; F111-V130 HydrophobicContact CD2-CG2 3.95Å; F111-V130 HydrophobicContact CE2-CG2 4.3Å; R126-V130 PolarHBondContact O-N 3.38Å; R127-V130 PolarHBondContact O-N 3.14Å; N128-V130 PolarHBondContact O-N 3Å; V130-Y132 VanDerWaalsContact C-N 3.31Å; V130-Y132 PolarHBondContact O-N 3.09Å; V130-L133 PolarHBondContact O-N 3.37Å; V130-V134 HydrophobicContact CG1-CG2 4.42Å; V130-V134 WeakPolarHBondContact O-CG2 3.45Å; V130-V134 PolarHBondContact O-N 3.3Å; V130-Y318 HydrophobicContact CB-CD1 4.18Å; V130-Y318 HydrophobicContact CB-CE1 4.23Å; V130-Y318 HydrophobicContact CG1-CD1 3.91Å; V130-Y318 HydrophobicContact CG1-CE1 4.09Å; V130-V321 HydrophobicContact CG2-CG1 3.81Å; V130-V321 HydrophobicContact CG2-CG2 4.15Å
131R98.1Very high96.4Very high15 Ų1522 Ų226%0.05710%0.099CC..Hα-helixtrans-59.7-39.5-177.2-170.7171.354.982.5-3.7112.3R127 N128 V134 L135 L163 E168 Y318R127-R131 WeakPolarHBondContact O-CB 2.97Å; R127-R131 PolarHBondContact O-N 2.9Å; N128-R131 PolarHBondContact O-N 2.96Å; N128-R131 PolarHBondContact OD1-NE 3.38Å; N128-R131 PolarHBondContact OD1-NH2 3Å; R131-V134 PolarHBondContact O-N 3.03Å; R131-L135 WeakPolarHBondContact O-CB 3.3Å; R131-L135 PolarHBondContact O-N 2.83Å; R131-L163 VanDerWaalsContact CG-O 3.27Å; R131-L163 WeakPolarHBondContact CG-O 3.45Å; R131-L163 PolarHBondContact NH1-O 3.49Å; R131-E168 IonicContact CZ-OE1 2.76Å; R131-E168 IonicContact CZ-OE2 2.67Å; R131-E168 IonicContact NH1-OE1 3.32Å; R131-E168 PolarHBondContact NH1-OE1 2.85Å; R131-E168 IonicContact NH1-OE2 2.76Å; R131-E168 PolarHBondContact NH1-OE2 2.69Å; R131-E168 IonicContact NH2-OE1 2.62Å; R131-E168 PolarHBondContact NH2-OE1 2.98Å; R131-E168 IonicContact NH2-OE2 2.81Å; R131-Y318 HydrophobicContact CB-CE1 4.37Å; R131-Y318 WeakPolarHBondContact CD-OH 3.46Å
132Y98.3Very high96.5Very high25 Ų2518.6 Ų18.610%0.0988%0.082CC..Hα-helixtrans-69.7-36.1179.5-71.2-11.5000113.8N128 V130 S136 E168 S185 W188 S189 L192N128-Y132 HydrophobicContact CB-CE2 4.43Å; N128-Y132 WeakPolarHBondContact O-CB 3.49Å; N128-Y132 PolarHBondContact O-N 3.38Å; V130-Y132 VanDerWaalsContact C-N 3.31Å; V130-Y132 PolarHBondContact O-N 3.09Å; Y132-S136 PolarHBondContact O-N 2.95Å; Y132-E168 WeakPolarHBondContact CE1-OE1 3.02Å; Y132-E168 PolarHBondContact OH-OE1 3.42Å; Y132-S185 WeakPolarHBondContact O-CB 3.41Å; Y132-S185 PolarHBondContact O-OG 3.25Å; Y132-W188 HydrophobicContact CD1-CE3 4.06Å; Y132-W188 HydrophobicContact CD2-CB 3.63Å; Y132-W188 AromaticContact CE1-CE3 3.82Å; Y132-W188 HydrophobicContact CE1-CE3 3.82Å; Y132-W188 HydrophobicContact CE1-CZ3 4.33Å; Y132-W188 HydrophobicContact CE2-CB 3.47Å; Y132-W188 VanDerWaalsContact CE2-CB 3.47Å; Y132-W188 HydrophobicContact CE2-CE3 4.3Å; Y132-W188 HydrophobicContact CE2-CG 4.38Å; Y132-W188 HydrophobicContact CG-CB 4.44Å; Y132-W188 HydrophobicContact CG-CE3 4.4Å; Y132-W188 AromaticContact CZ-CE3 3.95Å; Y132-S189 WeakPolarHBondContact CB-OG 3.42Å; Y132-L192 HydrophobicContact CD2-CD1 3.96Å; Y132-L192 HydrophobicContact CE2-CD1 3.48Å; Y132-L192 VanDerWaalsContact CE2-CD1 3.48Å; Y132-L192 HydrophobicContact CE2-CG 4.35Å
133L98.3Very high96.5Very high0 Ų022.9 Ų22.90%011%0.105CC..Hα-helixtrans-65.2-47.5171.2-71.8-178.6000110.9I104 A107 F111 L129 V130 L135 S136 Q137 I186 I215 F218I104-L133 HydrophobicContact CD1-CB 3.73Å; I104-L133 HydrophobicContact CD1-CD1 3.67Å; I104-L133 HydrophobicContact CD1-CG 4.35Å; A107-L133 HydrophobicContact CB-CD1 3.57Å; F111-L133 HydrophobicContact CE2-CD1 3.85Å; F111-L133 HydrophobicContact CZ-CD1 3.75Å; L129-L133 PolarHBondContact O-N 3.15Å; V130-L133 PolarHBondContact O-N 3.37Å; L133-L135 VanDerWaalsContact C-N 3.3Å; L133-L135 PolarHBondContact O-N 3.36Å; L133-S136 WeakPolarHBondContact O-CB 3.49Å; L133-S136 PolarHBondContact O-N 3.03Å; L133-Q137 PolarHBondContact O-N 3.33Å; L133-I186 HydrophobicContact CD2-CD1 3.68Å; L133-I215 HydrophobicContact CD2-CG1 4.33Å; L133-I215 HydrophobicContact CD2-CG2 4.09Å; L133-F218 HydrophobicContact CB-CD1 4.34Å; L133-F218 HydrophobicContact CB-CE1 4.06Å; L133-F218 HydrophobicContact CB-CZ 4.29Å; L133-F218 HydrophobicContact CD2-CB 4.45Å; L133-F218 HydrophobicContact CD2-CD1 3.89Å; L133-F218 HydrophobicContact CD2-CE1 4.41Å; L133-F218 HydrophobicContact CD2-CG 4.26Å; L133-F218 VanDerWaalsContact O-CE1 3.28Å; L133-F218 WeakPolarHBondContact O-CE1 3.12Å
134V98.1Very high96.7Very high0 Ų018.2 Ų18.20%09%0.089CC..Hα-helixtrans-64.8-36.61781800000111.4I104 V130 R131 Q137 A138 L163 I310 N313 L314I104-V134 HydrophobicContact CD1-CG2 4.29Å; I104-V134 HydrophobicContact CG1-CG2 4.27Å; V130-V134 HydrophobicContact CG1-CG2 4.42Å; V130-V134 WeakPolarHBondContact O-CG2 3.45Å; V130-V134 PolarHBondContact O-N 3.3Å; R131-V134 PolarHBondContact O-N 3.03Å; V134-Q137 WeakPolarHBondContact O-CB 3.44Å; V134-Q137 PolarHBondContact O-N 2.88Å; V134-A138 WeakPolarHBondContact O-CB 3.15Å; V134-A138 PolarHBondContact O-N 3.4Å; V134-L163 HydrophobicContact CG1-CD2 3.77Å; V134-I310 HydrophobicContact CG1-CG2 4.04Å; V134-N313 HydrophobicContact CG2-CB 3.93Å; V134-L314 HydrophobicContact CB-CD1 4.42Å; V134-L314 HydrophobicContact CG1-CB 4.27Å; V134-L314 HydrophobicContact CG1-CD1 4.37Å
135L97.7Very high96.8Very high0 Ų015.1 Ų15.10%07%0.07CC..Hα-helixtrans-61.7-44.2173.717258.2000111.3R131 L133 Q137 A138 L139 L158 L163 M164 W188R131-L135 WeakPolarHBondContact O-CB 3.3Å; R131-L135 PolarHBondContact O-N 2.83Å; L133-L135 VanDerWaalsContact C-N 3.3Å; L133-L135 PolarHBondContact O-N 3.36Å; L135-Q137 VanDerWaalsContact C-N 3.29Å; L135-Q137 PolarHBondContact O-N 2.81Å; L135-A138 PolarHBondContact O-N 3.27Å; L135-L139 HydrophobicContact CD1-CD1 4.1Å; L135-L139 HydrophobicContact CD1-CG 4.01Å; L135-L139 HydrophobicContact CG-CD1 4.17Å; L135-L139 WeakPolarHBondContact O-CB 3.47Å; L135-L139 VanDerWaalsContact O-CG 3.29Å; L135-L139 WeakPolarHBondContact O-CG 3.34Å; L135-L139 PolarHBondContact O-N 2.87Å; L135-L158 HydrophobicContact CD1-CD2 3.88Å; L135-L158 HydrophobicContact CD1-CG 4.41Å; L135-L163 HydrophobicContact CD1-CB 4.49Å; L135-M164 HydrophobicContact CD1-CB 4.21Å; L135-M164 HydrophobicContact CD1-CE 3.28Å; L135-M164 HydrophobicContact CD2-CB 3.94Å; L135-M164 HydrophobicContact CD2-CE 4.14Å; L135-M164 HydrophobicContact CG-CE 4.28Å; L135-W188 HydrophobicContact CD2-CZ3 4.22Å
136S97.1Very high96.7Very high0 Ų019.5 Ų19.50%09%0.091CC..Hα-helixtrans-59.3-44.2175.1-159.90000111.1Y132 L133 L139 V140 Y182 S185 I186Y132-S136 PolarHBondContact O-N 2.95Å; L133-S136 WeakPolarHBondContact O-CB 3.49Å; L133-S136 PolarHBondContact O-N 3.03Å; S136-L139 PolarHBondContact O-N 3.36Å; S136-V140 WeakPolarHBondContact O-CG2 3.34Å; S136-V140 PolarHBondContact O-N 2.85Å; S136-Y182 WeakPolarHBondContact OG-CD2 3.02Å; S136-Y182 PolarHBondContact OG-O 3.13Å; S136-S185 WeakPolarHBondContact CA-OG 3.5Å; S136-S185 VanDerWaalsContact CB-OG 3.25Å; S136-S185 WeakPolarHBondContact CB-OG 3.48Å; S136-S185 PolarHBondContact N-OG 3.15Å; S136-I186 WeakPolarHBondContact OG-CG1 3.34Å
137Q97.5Very high96.7Very high1 Ų120.3 Ų20.31%0.00510%0.096CC..Hα-helixtrans-62.3-44.9175.9171.6173.47100112G102 L133 V134 L135 V140 L141 F218 L222 I310 N313G102-Q137 PolarHBondContact O-NE2 2.83Å; L133-Q137 PolarHBondContact O-N 3.33Å; V134-Q137 WeakPolarHBondContact O-CB 3.44Å; V134-Q137 PolarHBondContact O-N 2.88Å; L135-Q137 VanDerWaalsContact C-N 3.29Å; L135-Q137 PolarHBondContact O-N 2.81Å; Q137-V140 PolarHBondContact O-N 2.87Å; Q137-L141 HydrophobicContact CG-CD1 3.58Å; Q137-L141 HydrophobicContact CG-CG 4.14Å; Q137-L141 WeakPolarHBondContact O-CB 3.29Å; Q137-L141 VanDerWaalsContact O-CG 3.28Å; Q137-L141 WeakPolarHBondContact O-CG 3.44Å; Q137-L141 PolarHBondContact O-N 3.28Å; Q137-F218 HydrophobicContact CB-CE1 4.1Å; Q137-F218 HydrophobicContact CB-CZ 3.94Å; Q137-L222 HydrophobicContact CB-CD1 4.24Å; Q137-L222 HydrophobicContact CB-CD2 4.04Å; Q137-L222 HydrophobicContact CG-CD2 4.2Å; Q137-I310 HydrophobicContact CG-CG1 4.47Å; Q137-N313 PolarHBondContact NE2-ND2 2.83Å; Q137-N313 PolarHBondContact OE1-ND2 2.79Å
138A97.1Very high96.7Very high0 Ų016.7 Ų16.70%08%0.082CC..Hα-helixtrans-65-41179.200000111.8V134 L135 R142 L158 L163 I310V134-A138 WeakPolarHBondContact O-CB 3.15Å; V134-A138 PolarHBondContact O-N 3.4Å; L135-A138 PolarHBondContact O-N 3.27Å; A138-R142 WeakPolarHBondContact O-CB 3.28Å; A138-R142 PolarHBondContact O-N 3.46Å; A138-L158 HydrophobicContact CB-CD1 4.01Å; A138-L163 HydrophobicContact CB-CD1 3.84Å; A138-I310 HydrophobicContact CB-CD1 4.2Å
139L95.9Very high96.7Very high4 Ų420.1 Ų20.12%0.0219%0.092CC..Hα-helixtrans-60.1-47.7174.3-71.5171.7000111.4L135 S136 D143 M155 L158 M164L135-L139 HydrophobicContact CD1-CD1 4.1Å; L135-L139 HydrophobicContact CD1-CG 4.01Å; L135-L139 HydrophobicContact CG-CD1 4.17Å; L135-L139 WeakPolarHBondContact O-CB 3.47Å; L135-L139 VanDerWaalsContact O-CG 3.29Å; L135-L139 WeakPolarHBondContact O-CG 3.34Å; L135-L139 PolarHBondContact O-N 2.87Å; S136-L139 PolarHBondContact O-N 3.36Å; L139-D143 PolarHBondContact O-N 3.49Å; L139-M155 HydrophobicContact CD2-CE 3.81Å; L139-M155 HydrophobicContact CD2-SD 3.91Å; L139-L158 HydrophobicContact CD2-CD2 3.52Å; L139-L158 HydrophobicContact CG-CD2 4.15Å; L139-M164 HydrophobicContact CD2-CE 4.44Å
140V96.4Very high96.6Very high1 Ų126.1 Ų26.11%0.00612%0.118CC..Hα-helixtrans-63.7-52.8177.9168.10000111.3S136 Q137 R142 D143 I144 Y182 L222 L226S136-V140 WeakPolarHBondContact O-CG2 3.34Å; S136-V140 PolarHBondContact O-N 2.85Å; Q137-V140 PolarHBondContact O-N 2.87Å; V140-R142 VanDerWaalsContact C-N 3.28Å; V140-R142 PolarHBondContact O-N 2.86Å; V140-D143 PolarHBondContact O-N 3.37Å; V140-I144 HydrophobicContact CG1-CD1 4.05Å; V140-I144 WeakPolarHBondContact O-CG1 3.34Å; V140-I144 PolarHBondContact O-N 3.1Å; V140-Y182 HydrophobicContact CG2-CD1 3.69Å; V140-Y182 HydrophobicContact CG2-CD2 3.73Å; V140-Y182 HydrophobicContact CG2-CE1 4.33Å; V140-Y182 HydrophobicContact CG2-CE2 4.31Å; V140-Y182 HydrophobicContact CG2-CG 3.41Å; V140-Y182 VanDerWaalsContact CG2-CG 3.41Å; V140-L222 HydrophobicContact CG1-CB 4.38Å; V140-L222 HydrophobicContact CG2-CB 4.21Å; V140-L222 HydrophobicContact CG2-CD1 4.29Å; V140-L226 HydrophobicContact CG1-CD1 4.46Å; V140-L226 HydrophobicContact CG1-CD2 3.97Å; V140-L226 HydrophobicContact CG1-CG 3.91Å; V140-L226 HydrophobicContact CG2-CD1 4.17Å; V140-L226 HydrophobicContact CG2-CG 4.5Å
141L96.6Very high96.6Very high6 Ų630.3 Ų30.33%0.03113%0.134CC..Hα-helixtrans-64.2-32.6-177.4-69.3176.8000112.4Q137 D143 I144 S145 V148 L225 C306 I310Q137-L141 HydrophobicContact CG-CD1 3.58Å; Q137-L141 HydrophobicContact CG-CG 4.14Å; Q137-L141 WeakPolarHBondContact O-CB 3.29Å; Q137-L141 VanDerWaalsContact O-CG 3.28Å; Q137-L141 WeakPolarHBondContact O-CG 3.44Å; Q137-L141 PolarHBondContact O-N 3.28Å; L141-D143 PolarHBondContact O-N 3.15Å; L141-I144 HydrophobicContact CD2-CD1 4.38Å; L141-I144 PolarHBondContact O-N 3.43Å; L141-S145 WeakPolarHBondContact O-CA 3.23Å; L141-S145 VanDerWaalsContact O-CB 3.23Å; L141-S145 WeakPolarHBondContact O-CB 3.44Å; L141-S145 PolarHBondContact O-N 3.42Å; L141-V148 HydrophobicContact CB-CB 4.34Å; L141-V148 HydrophobicContact CB-CG1 4.16Å; L141-V148 HydrophobicContact CB-CG2 4.04Å; L141-L225 HydrophobicContact CD2-CD1 4.26Å; L141-C306 HydrophobicContact CD1-CB 4.3Å; L141-I310 HydrophobicContact CB-CD1 4.49Å; L141-I310 HydrophobicContact CD1-CD1 4.01Å; L141-I310 HydrophobicContact CD1-CG1 3.92Å
142R95.3Very high96.5Very high19 Ų1929.8 Ų29.87%0.07213%0.132CC..Hα-helixtrans-63-30.7173.9-172.2-155.968.5-151.11.6112.3A138 V140 V148 R149 F152 M155A138-R142 WeakPolarHBondContact O-CB 3.28Å; A138-R142 PolarHBondContact O-N 3.46Å; V140-R142 VanDerWaalsContact C-N 3.28Å; V140-R142 PolarHBondContact O-N 2.86Å; R142-V148 HydrophobicContact CB-CG1 3.96Å; R142-R149 WeakPolarHBondContact O-CB 3.42Å; R142-R149 WeakPolarHBondContact O-CD 3.11Å; R142-F152 WeakPolarHBondContact CD-O 3.33Å; R142-F152 HydrophobicContact CG-CB 4.31Å; R142-F152 WeakPolarHBondContact CG-O 3.35Å; R142-M155 PolarHBondContact NH1-SD 3.5Å
143D93.9Very high96.4Very high91 Ų9131.6 Ų31.649%0.48715%0.147SC..Hα-helixtrans-84.8-21.2-178.1-66.4-14000112.5L139 V140 L141 R149L139-D143 PolarHBondContact O-N 3.49Å; V140-D143 PolarHBondContact O-N 3.37Å; L141-D143 PolarHBondContact O-N 3.15Å; D143-R149 IonicContact OD1-NH1 2.69Å
144I95.2Very high96.2Very high13 Ų1334.7 Ų34.77%0.06717%0.166CC..Hα-helixtrans-118.4-7.3-176.467.3177.8000115.3V140 L141 L225 L226 D229 L297V140-I144 HydrophobicContact CG1-CD1 4.05Å; V140-I144 WeakPolarHBondContact O-CG1 3.34Å; V140-I144 PolarHBondContact O-N 3.1Å; L141-I144 HydrophobicContact CD2-CD1 4.38Å; L141-I144 PolarHBondContact O-N 3.43Å; I144-L225 HydrophobicContact CD1-CB 3.69Å; I144-L226 HydrophobicContact CG2-CD2 3.77Å; I144-D229 HydrophobicContact CB-CB 4.05Å; I144-D229 HydrophobicContact CG2-CB 3.6Å; I144-L297 HydrophobicContact CB-CD1 4.31Å; I144-L297 HydrophobicContact CD1-CD1 3.61Å; I144-L297 HydrophobicContact CG1-CD1 3.82Å
145S96.2Very high95.9Very high2 Ų235.6 Ų35.61%0.01417%0.17CC..  trans-125125.2179178.80000111.7L141 Q147 V148 R149 L297L141-S145 WeakPolarHBondContact O-CA 3.23Å; L141-S145 VanDerWaalsContact O-CB 3.23Å; L141-S145 WeakPolarHBondContact O-CB 3.44Å; L141-S145 PolarHBondContact O-N 3.42Å; S145-Q147 VanDerWaalsContact C-N 3.31Å; S145-Q147 PolarHBondContact O-N 3.49Å; S145-Q147 PolarHBondContact OG-N 3.16Å; S145-V148 PolarHBondContact O-N 3.11Å; S145-R149 WeakPolarHBondContact O-CB 3.38Å; S145-R149 PolarHBondContact O-N 3.03Å; S145-L297 WeakPolarHBondContact CA-O 3.33Å; S145-L297 WeakPolarHBondContact CB-O 3.26Å; S145-L297 PolarHBondContact OG-O 3.45Å
146M94.1Very high95.7Very high106 Ų10640.1 Ų40.152%0.52220%0.195SC..Hα-helixtrans-64.2-35.3178-73.8-56.9-59.100112.6V148 R149 K150 E299M146-V148 VanDerWaalsContact C-N 3.33Å; M146-V148 PolarHBondContact O-N 3.42Å; M146-R149 PolarHBondContact O-N 2.92Å; M146-K150 WeakPolarHBondContact O-CG 3.23Å; M146-K150 PolarHBondContact O-N 3.35Å; M146-E299 HydrophobicContact CB-CG 4.18Å
147Q94.9Very high95.6Very high31 Ų3142.6 Ų42.615%0.14521%0.21CC..Hα-helixtrans-60.9-43.3177.1-60.7-179.443.400111.8S145 R151 G298 E299 L304 N307S145-Q147 VanDerWaalsContact C-N 3.31Å; S145-Q147 PolarHBondContact O-N 3.49Å; S145-Q147 PolarHBondContact OG-N 3.16Å; Q147-R151 PolarHBondContact O-N 2.96Å; Q147-G298 VanDerWaalsContact CG-O 3.26Å; Q147-G298 WeakPolarHBondContact CG-O 3.36Å; Q147-G298 PolarHBondContact NE2-O 3.16Å; Q147-E299 HydrophobicContact CG-CG 3.9Å; Q147-L304 PolarHBondContact NE2-O 3.21Å; Q147-N307 PolarHBondContact O-ND2 2.86Å
148V96.8Very high95.4Very high0 Ų042.6 Ų42.60%021%0.21CC..Hα-helixtrans-76.8-36.6-179.8-176.10000110.3L141 R142 S145 M146 K150 R151 F152 C306 I310L141-V148 HydrophobicContact CB-CB 4.34Å; L141-V148 HydrophobicContact CB-CG1 4.16Å; L141-V148 HydrophobicContact CB-CG2 4.04Å; R142-V148 HydrophobicContact CB-CG1 3.96Å; S145-V148 PolarHBondContact O-N 3.11Å; M146-V148 VanDerWaalsContact C-N 3.33Å; M146-V148 PolarHBondContact O-N 3.42Å; V148-K150 VanDerWaalsContact C-N 3.32Å; V148-K150 PolarHBondContact O-N 3.39Å; V148-R151 PolarHBondContact O-N 2.75Å; V148-R151 VanDerWaalsContact O-N 3.16Å; V148-F152 HydrophobicContact CG1-CD2 3.75Å; V148-F152 HydrophobicContact CG1-CE2 4.18Å; V148-F152 PolarHBondContact O-N 3.44Å; V148-C306 HydrophobicContact CG2-CB 3.47Å; V148-C306 VanDerWaalsContact CG2-CB 3.47Å; V148-I310 HydrophobicContact CG1-CD1 3.79Å; V148-I310 HydrophobicContact CG2-CD1 4.11Å
149R96.4Very high95.3Very high109 Ų10943 Ų4341%0.41121%0.213SC..Hα-helixtrans-61.3-38.6174.4-173.561.8-178.2-161.96.9112.8R142 D143 S145 M146 F152 P153R142-R149 WeakPolarHBondContact O-CB 3.42Å; R142-R149 WeakPolarHBondContact O-CD 3.11Å; D143-R149 IonicContact OD1-NH1 2.69Å; S145-R149 WeakPolarHBondContact O-CB 3.38Å; S145-R149 PolarHBondContact O-N 3.03Å; M146-R149 PolarHBondContact O-N 2.92Å; R149-F152 CarbonylContact O-C 3.59Å; R149-F152 VanDerWaalsContact O-C 3.28Å; R149-P153 VanDerWaalsContact O-CA 3.32Å; R149-P153 WeakPolarHBondContact O-CA 3.22Å
150K96.6Very high95.2Very high125 Ų12547 Ų4754%0.54325%0.246SC..Hα-helixtrans-69.1-34.7174.4-74.1178.3-174.9172.90112.4M146 V148 P153 E299M146-K150 WeakPolarHBondContact O-CG 3.23Å; M146-K150 PolarHBondContact O-N 3.35Å; V148-K150 VanDerWaalsContact C-N 3.32Å; V148-K150 PolarHBondContact O-N 3.39Å; K150-P153 WeakPolarHBondContact O-CG 3.33Å; K150-E299 WeakPolarHBondContact CD-OE1 3.2Å; K150-E299 WeakPolarHBondContact CE-OE1 3.49Å; K150-E299 IonicContact NZ-OE1 2.74Å; K150-E299 PolarHBondContact NZ-OE1 3.13Å; K150-E299 IonicContact NZ-OE2 3.17Å; K150-E299 PolarHBondContact NZ-OE2 3.23Å
151R96.9Very high95.1Very high88 Ų8849.2 Ų49.233%0.33226%0.262SS..Hα-helixtrans-70.6-40.8175.7-176.1-179.2176.1-174.6-0.6112.5Q147 V148 P153 N307 D311Q147-R151 PolarHBondContact O-N 2.96Å; V148-R151 PolarHBondContact O-N 2.75Å; V148-R151 VanDerWaalsContact O-N 3.16Å; R151-P153 VanDerWaalsContact C-CD 3.5Å; R151-P153 WeakPolarHBondContact O-CD 3.37Å; R151-N307 WeakPolarHBondContact CD-OD1 3.47Å; R151-N307 PolarHBondContact NH1-O 3.42Å; R151-D311 IonicContact CZ-OD1 2.85Å; R151-D311 IonicContact CZ-OD2 3.45Å; R151-D311 VanDerWaalsContact NH1-CG 3.35Å; R151-D311 IonicContact NH1-OD1 2.98Å; R151-D311 PolarHBondContact NH1-OD1 3.21Å; R151-D311 IonicContact NH1-OD2 2.64Å; R151-D311 PolarHBondContact NH1-OD2 3.47Å; R151-D311 IonicContact NH2-OD1 3.78Å; R151-D311 PolarHBondContact NH2-OD1 3.38Å; R151-D311 IonicContact NH2-OD2 3.91Å
152F96.7Very high95Very high5 Ų551 Ų512%0.02228%0.283CS..  trans-123.874.4179.8-51-60.8000111.3R142 V148 R149 T154 T157 L158 L163 I310R142-F152 WeakPolarHBondContact CD-O 3.33Å; R142-F152 HydrophobicContact CG-CB 4.31Å; R142-F152 WeakPolarHBondContact CG-O 3.35Å; V148-F152 HydrophobicContact CG1-CD2 3.75Å; V148-F152 HydrophobicContact CG1-CE2 4.18Å; V148-F152 PolarHBondContact O-N 3.44Å; R149-F152 CarbonylContact O-C 3.59Å; R149-F152 VanDerWaalsContact O-C 3.28Å; F152-T154 VanDerWaalsContact C-N 3.3Å; F152-T154 PolarHBondContact O-N 3.27Å; F152-T157 WeakPolarHBondContact CA-OG1 3.42Å; F152-L158 HydrophobicContact CB-CB 4.5Å; F152-L158 HydrophobicContact CB-CD1 4.06Å; F152-L158 HydrophobicContact CD1-CD1 3.9Å; F152-L158 HydrophobicContact CD2-CD1 3.76Å; F152-L158 HydrophobicContact CE1-CD1 4.23Å; F152-L158 HydrophobicContact CE2-CD1 4.11Å; F152-L158 HydrophobicContact CG-CD1 3.64Å; F152-L158 HydrophobicContact CZ-CD1 4.31Å; F152-L163 HydrophobicContact CE1-CD1 4.46Å; F152-L163 HydrophobicContact CE2-CD1 4.25Å; F152-L163 HydrophobicContact CZ-CD1 3.88Å; F152-I310 HydrophobicContact CE2-CD1 4.27Å
153P95.8Very high95Very high62 Ų6250.3 Ų50.340%0.40328%0.28SS..  trans-65.1-32-177.7-23.435.1000114R149 K150 R151 T157R149-P153 VanDerWaalsContact O-CA 3.32Å; R149-P153 WeakPolarHBondContact O-CA 3.22Å; K150-P153 WeakPolarHBondContact O-CG 3.33Å; R151-P153 VanDerWaalsContact C-CD 3.5Å; R151-P153 WeakPolarHBondContact O-CD 3.37Å; P153-T157 WeakPolarHBondContact CD-OG1 3.26Å
154T94Very high95Very high66 Ų6646.2 Ų46.241%0.40526%0.258SS..SBendtrans-128.7162.9-177.372.40000111.9F152 D156 T157 L158F152-T154 VanDerWaalsContact C-N 3.3Å; F152-T154 PolarHBondContact O-N 3.27Å; T154-D156 PolarHBondContact O-N 3.34Å; T154-D156 PolarHBondContact OG1-N 3.39Å; T154-T157 PolarHBondContact N-OG1 3.32Å; T154-T157 VanDerWaalsContact N-OG1 3.1Å; T154-T157 PolarHBondContact O-N 3.44Å; T154-T157 PolarHBondContact O-OG1 3.09Å; T154-T157 PolarHBondContact OG1-N 3.49Å; T154-T157 VanDerWaalsContact OG1-N 3.17Å; T154-L158 PolarHBondContact O-N 3.44Å
155M92.2Very high95Very high18 Ų1848.3 Ų48.39%0.08927%0.272CS..Hα-helixtrans-60.4-36.4172-66.8-59.4-120.600111.4L139 R142 T157 L158 A159 M169 L172L139-M155 HydrophobicContact CD2-CE 3.81Å; L139-M155 HydrophobicContact CD2-SD 3.91Å; R142-M155 PolarHBondContact NH1-SD 3.5Å; M155-T157 VanDerWaalsContact C-N 3.35Å; M155-T157 PolarHBondContact O-N 3.29Å; M155-L158 CarbonylContact O-C 3.53Å; M155-L158 WeakPolarHBondContact O-CA 3.25Å; M155-L158 VanDerWaalsContact O-CB 3.31Å; M155-L158 WeakPolarHBondContact O-CB 3.22Å; M155-L158 PolarHBondContact O-N 3.4Å; M155-L158 HydrophobicContact SD-CD2 4.43Å; M155-A159 PolarHBondContact O-N 2.81Å; M155-M169 HydrophobicContact CB-CG 4.15Å; M155-M169 HydrophobicContact CB-SD 4Å; M155-L172 HydrophobicContact CE-CD1 4.35Å
156D94.1Very high94.9Very high96 Ų9654.3 Ų54.351%0.51330%0.299SS..Hα-helixtrans-60.4-42.1175.7-51.8-88.3000112.5T154 L158 A159 A160T154-D156 PolarHBondContact O-N 3.34Å; T154-D156 PolarHBondContact OG1-N 3.39Å; D156-L158 PolarHBondContact O-N 3.17Å; D156-A159 PolarHBondContact O-N 3.42Å; D156-A160 VanDerWaalsContact O-CB 3.28Å; D156-A160 WeakPolarHBondContact O-CB 3.44Å; D156-A160 PolarHBondContact O-N 3.49Å
157T95.2Very high94.9Very high52 Ų5256.5 Ų56.532%0.31931%0.308SS..Hα-helixtrans-66-31.1176.456.70000112.3F152 P153 T154 M155 S161F152-T157 WeakPolarHBondContact CA-OG1 3.42Å; P153-T157 WeakPolarHBondContact CD-OG1 3.26Å; T154-T157 PolarHBondContact N-OG1 3.32Å; T154-T157 VanDerWaalsContact N-OG1 3.1Å; T154-T157 PolarHBondContact O-N 3.44Å; T154-T157 PolarHBondContact O-OG1 3.09Å; T154-T157 PolarHBondContact OG1-N 3.49Å; T154-T157 VanDerWaalsContact OG1-N 3.17Å; M155-T157 VanDerWaalsContact C-N 3.35Å; M155-T157 PolarHBondContact O-N 3.29Å; T157-S161 WeakPolarHBondContact O-CB 3.45Å; T157-S161 PolarHBondContact O-N 2.78Å
158L93.8Very high94.9Very high0 Ų055.8 Ų55.80%031%0.305CS..Hα-helixtrans-70.7-41.5174.5-166.768.8000110.8L135 A138 L139 F152 T154 M155 D156 S161 L163 M164L135-L158 HydrophobicContact CD1-CD2 3.88Å; L135-L158 HydrophobicContact CD1-CG 4.41Å; A138-L158 HydrophobicContact CB-CD1 4.01Å; L139-L158 HydrophobicContact CD2-CD2 3.52Å; L139-L158 HydrophobicContact CG-CD2 4.15Å; F152-L158 HydrophobicContact CB-CB 4.5Å; F152-L158 HydrophobicContact CB-CD1 4.06Å; F152-L158 HydrophobicContact CD1-CD1 3.9Å; F152-L158 HydrophobicContact CD2-CD1 3.76Å; F152-L158 HydrophobicContact CE1-CD1 4.23Å; F152-L158 HydrophobicContact CE2-CD1 4.11Å; F152-L158 HydrophobicContact CG-CD1 3.64Å; F152-L158 HydrophobicContact CZ-CD1 4.31Å; T154-L158 PolarHBondContact O-N 3.44Å; M155-L158 CarbonylContact O-C 3.53Å; M155-L158 WeakPolarHBondContact O-CA 3.25Å; M155-L158 VanDerWaalsContact O-CB 3.31Å; M155-L158 WeakPolarHBondContact O-CB 3.22Å; M155-L158 PolarHBondContact O-N 3.4Å; M155-L158 HydrophobicContact SD-CD2 4.43Å; D156-L158 PolarHBondContact O-N 3.17Å; L158-S161 PolarHBondContact O-N 3.27Å; L158-S161 PolarHBondContact O-OG 3.21Å; L158-L163 HydrophobicContact CD1-CB 4.41Å; L158-L163 HydrophobicContact CD1-CD1 3.64Å; L158-L163 HydrophobicContact CG-CB 4.48Å; L158-M164 HydrophobicContact CD2-CE 3.54Å; L158-M164 HydrophobicContact CG-CE 4.15Å
159A93.9Very high94.8Very high8 Ų856.3 Ų56.37%0.06631%0.307CS..Hα-helixtrans-64.8-47.8173.900000112.3M155 D156 S161 G162 M164 M169M155-A159 PolarHBondContact O-N 2.81Å; D156-A159 PolarHBondContact O-N 3.42Å; A159-S161 PolarHBondContact O-N 3.25Å; A159-S161 VanDerWaalsContact O-N 3.13Å; A159-G162 PolarHBondContact O-N 2.88Å; A159-M164 VanDerWaalsContact CA-CG 3.45Å; A159-M164 WeakPolarHBondContact CA-O 3.42Å; A159-M164 HydrophobicContact CB-CG 3.63Å; A159-M164 HydrophobicContact CB-SD 4.18Å; A159-M169 HydrophobicContact CB-SD 3.87Å
160A93.7Very high94.6Very high88 Ų8855.1 Ų55.173%0.72731%0.309SS*.Hα-helixtrans-59.9-25.6177.500000112.9D156 G162D156-A160 VanDerWaalsContact O-CB 3.28Å; D156-A160 WeakPolarHBondContact O-CB 3.44Å; D156-A160 PolarHBondContact O-N 3.49Å; A160-G162 PolarHBondContact O-N 2.63Å
161S94Very high94.5Very high49 Ų4953.4 Ų53.434%0.34331%0.305SS..THydrogen-bonded Turntrans-74.2-7.6174.379.10000114.5T157 L158 A159T157-S161 WeakPolarHBondContact O-CB 3.45Å; T157-S161 PolarHBondContact O-N 2.78Å; L158-S161 PolarHBondContact O-N 3.27Å; L158-S161 PolarHBondContact O-OG 3.21Å; A159-S161 PolarHBondContact O-N 3.25Å; A159-S161 VanDerWaalsContact O-N 3.13Å
162G94.6Very high94.2Very high44 Ų4449.2 Ų49.245%0.45429%0.289SS..THydrogen-bonded Turntrans84.27.4-179.400000114.9A159 A160A159-G162 PolarHBondContact O-N 2.88Å; A160-G162 PolarHBondContact O-N 2.63Å
163L95.5Very high93.9Very high4 Ų452.8 Ų52.82%0.02131%0.309CS..SBendtrans-77-28176.2-72.2173.9000112.8R131 V134 L135 A138 F152 L158 I310 L314R131-L163 VanDerWaalsContact CG-O 3.27Å; R131-L163 WeakPolarHBondContact CG-O 3.45Å; R131-L163 PolarHBondContact NH1-O 3.49Å; V134-L163 HydrophobicContact CG1-CD2 3.77Å; L135-L163 HydrophobicContact CD1-CB 4.49Å; A138-L163 HydrophobicContact CB-CD1 3.84Å; F152-L163 HydrophobicContact CE1-CD1 4.46Å; F152-L163 HydrophobicContact CE2-CD1 4.25Å; F152-L163 HydrophobicContact CZ-CD1 3.88Å; L158-L163 HydrophobicContact CD1-CB 4.41Å; L158-L163 HydrophobicContact CD1-CD1 3.64Å; L158-L163 HydrophobicContact CG-CB 4.48Å; L163-I310 HydrophobicContact CD1-CG2 4.2Å; L163-L314 HydrophobicContact CD2-CD1 4.14Å; L163-L314 HydrophobicContact CD2-CD2 3.88Å
164M94.8Very high93.7Very high5 Ų557 Ų573%0.02532%0.323CS..SBendtrans-137.7153.9172.264.3176.35600110.7L135 L139 L158 A159 E168 M169 L172L135-M164 HydrophobicContact CD1-CB 4.21Å; L135-M164 HydrophobicContact CD1-CE 3.28Å; L135-M164 HydrophobicContact CD2-CB 3.94Å; L135-M164 HydrophobicContact CD2-CE 4.14Å; L135-M164 HydrophobicContact CG-CE 4.28Å; L139-M164 HydrophobicContact CD2-CE 4.44Å; L158-M164 HydrophobicContact CD2-CE 3.54Å; L158-M164 HydrophobicContact CG-CE 4.15Å; A159-M164 VanDerWaalsContact CA-CG 3.45Å; A159-M164 WeakPolarHBondContact CA-O 3.42Å; A159-M164 HydrophobicContact CB-CG 3.63Å; A159-M164 HydrophobicContact CB-SD 4.18Å; M164-E168 VanDerWaalsContact CA-OE2 3.32Å; M164-E168 WeakPolarHBondContact CA-OE2 3.26Å; M164-E168 HydrophobicContact CB-CB 4.37Å; M164-M169 HydrophobicContact SD-CB 3.66Å; M164-M169 HydrophobicContact SD-CG 3.85Å; M164-L172 HydrophobicContact CE-CD1 3.49Å; M164-L172 VanDerWaalsContact CE-CD1 3.49Å; M164-L172 HydrophobicContact SD-CD1 4.2Å
165T95.6Very high93.6Very high57 Ų5755.8 Ų55.835%0.3531%0.313SS..  trans-82.9165.2169.369.30000110.6E167 E168 M169T165-E167 VanDerWaalsContact C-N 3.32Å; T165-E167 PolarHBondContact O-N 2.96Å; T165-E168 PolarHBondContact N-OE2 3.41Å; T165-E168 PolarHBondContact O-N 3.44Å; T165-E168 WeakPolarHBondContact OG1-CB 3.19Å; T165-E168 VanDerWaalsContact OG1-CG 3.22Å; T165-E168 WeakPolarHBondContact OG1-CG 3.47Å; T165-E168 PolarHBondContact OG1-N 2.95Å; T165-M169 PolarHBondContact O-N 2.93Å
166H92.9Very high93.4Very high128 Ų12865 Ų6559%0.59335%0.353SS*.Hα-helixtrans-61.1-40.7173.6-76.9-72.1000112.2E168 M169 D170H166-E168 VanDerWaalsContact C-N 3.33Å; H166-E168 PolarHBondContact O-N 2.6Å; H166-M169 WeakPolarHBondContact O-CB 3.48Å; H166-M169 PolarHBondContact O-N 3.17Å; H166-D170 PolarHBondContact O-N 2.99Å
167E93.8Very high93Very high152 Ų15262.6 Ų62.671%0.7134%0.34SS*.Hα-helixtrans-61.8-41.4177-62.9177.9179.200112T165 D170 I171T165-E167 VanDerWaalsContact C-N 3.32Å; T165-E167 PolarHBondContact O-N 2.96Å; E167-D170 PolarHBondContact O-N 3.2Å; E167-I171 VanDerWaalsContact O-CG1 3.28Å; E167-I171 WeakPolarHBondContact O-CG1 3.04Å; E167-I171 PolarHBondContact O-N 2.8Å
168E95.8Very high92.5Very high16 Ų1665.5 Ų65.58%0.07536%0.359CS..Hα-helixtrans-67-37.7176-71.5160.9-172.300112.1R131 Y132 M164 T165 H166 I171 L172 W188R131-E168 IonicContact CZ-OE1 2.76Å; R131-E168 IonicContact CZ-OE2 2.67Å; R131-E168 IonicContact NH1-OE1 3.32Å; R131-E168 PolarHBondContact NH1-OE1 2.85Å; R131-E168 IonicContact NH1-OE2 2.76Å; R131-E168 PolarHBondContact NH1-OE2 2.69Å; R131-E168 IonicContact NH2-OE1 2.62Å; R131-E168 PolarHBondContact NH2-OE1 2.98Å; R131-E168 IonicContact NH2-OE2 2.81Å; Y132-E168 WeakPolarHBondContact CE1-OE1 3.02Å; Y132-E168 PolarHBondContact OH-OE1 3.42Å; M164-E168 VanDerWaalsContact CA-OE2 3.32Å; M164-E168 WeakPolarHBondContact CA-OE2 3.26Å; M164-E168 HydrophobicContact CB-CB 4.37Å; T165-E168 PolarHBondContact N-OE2 3.41Å; T165-E168 PolarHBondContact O-N 3.44Å; T165-E168 WeakPolarHBondContact OG1-CB 3.19Å; T165-E168 VanDerWaalsContact OG1-CG 3.22Å; T165-E168 WeakPolarHBondContact OG1-CG 3.47Å; T165-E168 PolarHBondContact OG1-N 2.95Å; H166-E168 VanDerWaalsContact C-N 3.33Å; H166-E168 PolarHBondContact O-N 2.6Å; E168-I171 PolarHBondContact O-N 3.28Å; E168-L172 WeakPolarHBondContact O-CG 3.46Å; E168-L172 PolarHBondContact O-N 3.36Å; E168-W188 HydrophobicContact CB-CH2 3.76Å; E168-W188 HydrophobicContact CB-CZ3 3.88Å; E168-W188 HydrophobicContact CG-CH2 4.09Å; E168-W188 HydrophobicContact CG-CZ3 3.92Å
169M94.1Very high92Very high11 Ų1175.6 Ų75.65%0.05440%0.399CS..Hα-helixtrans-61.7-46.8173.8-171.3178.474.900110.9M155 A159 M164 T165 H166 I171 L172 D173M155-M169 HydrophobicContact CB-CG 4.15Å; M155-M169 HydrophobicContact CB-SD 4Å; A159-M169 HydrophobicContact CB-SD 3.87Å; M164-M169 HydrophobicContact SD-CB 3.66Å; M164-M169 HydrophobicContact SD-CG 3.85Å; T165-M169 PolarHBondContact O-N 2.93Å; H166-M169 WeakPolarHBondContact O-CB 3.48Å; H166-M169 PolarHBondContact O-N 3.17Å; M169-I171 VanDerWaalsContact C-N 3.31Å; M169-I171 PolarHBondContact O-N 3.23Å; M169-L172 WeakPolarHBondContact O-CB 3.45Å; M169-L172 PolarHBondContact O-N 2.69Å; M169-L172 VanDerWaalsContact O-N 3.07Å; M169-D173 PolarHBondContact O-N 3.36Å
170D93Very high91.4Very high84 Ų8476.7 Ų76.745%0.44941%0.406SS..Hα-helixtrans-58.8-44.4176.5-70.4-20.8000110.6H166 E167 L172 D173 H174H166-D170 PolarHBondContact O-N 2.99Å; E167-D170 PolarHBondContact O-N 3.2Å; D170-L172 VanDerWaalsContact C-N 3.32Å; D170-L172 PolarHBondContact O-N 3.5Å; D170-D173 PolarHBondContact O-N 2.86Å; D170-H174 PolarHBondContact O-N 2.74Å; D170-H174 VanDerWaalsContact O-N 3.1Å; D170-H174 PolarHBondContact O-ND1 3.31Å
171I93.4Very high91.2Very high89 Ų8976.3 Ų76.346%0.45639%0.386SS..Hα-helixtrans-58.8-45.5175.4-65163.7000110.5E167 E168 M169 D173 H174 I175 W188E167-I171 VanDerWaalsContact O-CG1 3.28Å; E167-I171 WeakPolarHBondContact O-CG1 3.04Å; E167-I171 PolarHBondContact O-N 2.8Å; E168-I171 PolarHBondContact O-N 3.28Å; M169-I171 VanDerWaalsContact C-N 3.31Å; M169-I171 PolarHBondContact O-N 3.23Å; I171-D173 VanDerWaalsContact C-N 3.31Å; I171-D173 PolarHBondContact O-N 3.26Å; I171-H174 PolarHBondContact O-N 2.87Å; I171-I175 WeakPolarHBondContact O-CG1 3.43Å; I171-W188 HydrophobicContact CB-CZ2 4.08Å; I171-W188 HydrophobicContact CG2-CZ2 3.71Å
172L91.9Very high91Very high0 Ų075.5 Ų75.50%038%0.376CS..Hα-helixtrans-62.6-34.5178.5-74169.3000113M155 M164 E168 M169 D170 I175 R181 T184 W188M155-L172 HydrophobicContact CE-CD1 4.35Å; M164-L172 HydrophobicContact CE-CD1 3.49Å; M164-L172 VanDerWaalsContact CE-CD1 3.49Å; M164-L172 HydrophobicContact SD-CD1 4.2Å; E168-L172 WeakPolarHBondContact O-CG 3.46Å; E168-L172 PolarHBondContact O-N 3.36Å; M169-L172 WeakPolarHBondContact O-CB 3.45Å; M169-L172 PolarHBondContact O-N 2.69Å; M169-L172 VanDerWaalsContact O-N 3.07Å; D170-L172 VanDerWaalsContact C-N 3.32Å; D170-L172 PolarHBondContact O-N 3.5Å; L172-I175 HydrophobicContact CD2-CD1 4.19Å; L172-I175 PolarHBondContact O-N 3.26Å; L172-R181 HydrophobicContact CD2-CB 4.33Å; L172-R181 VanDerWaalsContact O-CD 3.31Å; L172-R181 WeakPolarHBondContact O-CD 3.39Å; L172-T184 HydrophobicContact CD2-CG2 3.88Å; L172-W188 HydrophobicContact CD1-CH2 4.24Å; L172-W188 HydrophobicContact CD2-CH2 4.17Å; L172-W188 HydrophobicContact CD2-CZ2 4.49Å; L172-W188 HydrophobicContact CG-CH2 3.84Å; L172-W188 HydrophobicContact CG-CZ2 4.41Å
173D90.2Very high91Very high80 Ų8077.7 Ų77.743%0.42837%0.37SS..Hα-helixtrans-77.1-24.7179.9-74.8-22.7000112.9M169 D170 I171 I175 R181M169-D173 PolarHBondContact O-N 3.36Å; D170-D173 PolarHBondContact O-N 2.86Å; I171-D173 VanDerWaalsContact C-N 3.31Å; I171-D173 PolarHBondContact O-N 3.26Å; D173-I175 VanDerWaalsContact C-N 3.29Å; D173-I175 PolarHBondContact O-N 3.18Å; D173-R181 IonicContact OD1-NH1 3.33Å; D173-R181 PolarHBondContact OD1-NH1 3.09Å
174H92.1Very high90.9Very high151 Ų15177.8 Ų77.870%0.69937%0.371SS*.THydrogen-bonded Turntrans-78.9-8.3173.7-73.581.8000113.9D170 I171 K176D170-H174 PolarHBondContact O-N 2.74Å; D170-H174 VanDerWaalsContact O-N 3.1Å; D170-H174 PolarHBondContact O-ND1 3.31Å; I171-H174 PolarHBondContact O-N 2.87Å; H174-K176 PolarHBondContact O-N 2.78Å
175I91.5Very high91Very high39 Ų3977.5 Ų77.520%0.237%0.369CS..  trans-72.3119179.3-63177.8000110.1I171 L172 D173 D177 W183 T184I171-I175 WeakPolarHBondContact O-CG1 3.43Å; L172-I175 HydrophobicContact CD2-CD1 4.19Å; L172-I175 PolarHBondContact O-N 3.26Å; D173-I175 VanDerWaalsContact C-N 3.29Å; D173-I175 PolarHBondContact O-N 3.18Å; I175-D177 HydrophobicContact CG2-CB 3.73Å; I175-D177 PolarHBondContact O-N 2.86Å; I175-W183 HydrophobicContact CG2-CZ2 4.02Å; I175-T184 HydrophobicContact CD1-CG2 3.47Å; I175-T184 VanDerWaalsContact CD1-CG2 3.47Å; I175-T184 WeakPolarHBondContact CD1-OG1 3.47Å
176K87.3Confident91.1Very high213 Ų21375.2 Ų75.293%0.92636%0.355SS*.  trans-83.151.8176.5-59.2-177.4-178179.60111.9H174H174-K176 PolarHBondContact O-N 2.78Å
177D86.2Confident91.3Very high45 Ų4573.6 Ų73.624%0.24135%0.347CS..  trans-114.6111.7173.1-174.8-8.1000108.9I175 Y179 S180 W183I175-D177 HydrophobicContact CG2-CB 3.73Å; I175-D177 PolarHBondContact O-N 2.86Å; D177-Y179 PolarHBondContact O-N 3.22Å; D177-Y179 WeakPolarHBondContact OD1-CB 3.31Å; D177-Y179 WeakPolarHBondContact OD1-CD2 3.23Å; D177-Y179 PolarHBondContact OD1-N 3.17Å; D177-S180 VanDerWaalsContact CG-O 3.27Å; D177-S180 PolarHBondContact OD1-N 3.09Å; D177-W183 PolarHBondContact OD2-NE1 3.29Å; D177-W183 VanDerWaalsContact OD2-NE1 3.07Å
178P83.9Confident91.4Very high112 Ų11268.3 Ų68.373%0.72732%0.321SS*.SBendtrans-75.4-11.6179.532.4-35.2000113.1
179Y83Confident91.5Very high213 Ų21367.5 Ų67.584%0.83532%0.317SS*.SBendtrans-96.9-50.3-171.2-57.8-70.5000113D177D177-Y179 PolarHBondContact O-N 3.22Å; D177-Y179 WeakPolarHBondContact OD1-CB 3.31Å; D177-Y179 WeakPolarHBondContact OD1-CD2 3.23Å; D177-Y179 PolarHBondContact OD1-N 3.17Å
180S81.8Confident91.7Very high31 Ų3169.9 Ų69.922%0.21733%0.33CS..  trans-157.1146.1-171.5175.20000112.9D177 Y182 W183D177-S180 VanDerWaalsContact CG-O 3.27Å; D177-S180 PolarHBondContact OD1-N 3.09Å; S180-Y182 WeakPolarHBondContact OG-CD1 3.28Å; S180-Y182 WeakPolarHBondContact OG-CE1 3.49Å; S180-W183 PolarHBondContact O-NE1 3.07Å
181R89.2Confident92Very high79 Ų7970 Ų7030%0.29833%0.331SS..  trans-123.8-1.4176.9-63-178-76.8167.7-3.3113.5L172 D173 W183 T184L172-R181 HydrophobicContact CD2-CB 4.33Å; L172-R181 VanDerWaalsContact O-CD 3.31Å; L172-R181 WeakPolarHBondContact O-CD 3.39Å; D173-R181 IonicContact OD1-NH1 3.33Å; D173-R181 PolarHBondContact OD1-NH1 3.09Å; R181-W183 VanDerWaalsContact C-N 3.26Å; R181-W183 PolarHBondContact O-N 2.98Å; R181-T184 PolarHBondContact O-N 3.13Å; R181-T184 PolarHBondContact O-OG1 3.04Å
182Y91.3Very high92.1Very high33 Ų3367.7 Ų67.713%0.12932%0.319CS..THydrogen-bonded Turntrans-71-22-177.379.5-97.3000113.1S136 V140 S180 T184 S185 R219 L226S136-Y182 WeakPolarHBondContact OG-CD2 3.02Å; S136-Y182 PolarHBondContact OG-O 3.13Å; V140-Y182 HydrophobicContact CG2-CD1 3.69Å; V140-Y182 HydrophobicContact CG2-CD2 3.73Å; V140-Y182 HydrophobicContact CG2-CE1 4.33Å; V140-Y182 HydrophobicContact CG2-CE2 4.31Å; V140-Y182 HydrophobicContact CG2-CG 3.41Å; V140-Y182 VanDerWaalsContact CG2-CG 3.41Å; S180-Y182 WeakPolarHBondContact OG-CD1 3.28Å; S180-Y182 WeakPolarHBondContact OG-CE1 3.49Å; Y182-T184 PolarHBondContact O-N 2.95Å; Y182-S185 PolarHBondContact O-OG 2.93Å; Y182-R219 HydrophobicContact CE2-CG 4.44Å; Y182-L226 HydrophobicContact CD1-CD1 3.83Å; Y182-L226 HydrophobicContact CE1-CD1 3.19Å
183W93.6Very high92.4Very high90 Ų9067.7 Ų67.734%0.34132%0.319SS..Hα-helixtrans-69.1-23.6-179.962.3-99.3000112.3I175 D177 S180 R181 I186 Q187I175-W183 HydrophobicContact CG2-CZ2 4.02Å; D177-W183 PolarHBondContact OD2-NE1 3.29Å; D177-W183 VanDerWaalsContact OD2-NE1 3.07Å; S180-W183 PolarHBondContact O-NE1 3.07Å; R181-W183 VanDerWaalsContact C-N 3.26Å; R181-W183 PolarHBondContact O-N 2.98Å; W183-I186 WeakPolarHBondContact O-CB 3.49Å; W183-I186 PolarHBondContact O-N 3.05Å; W183-Q187 HydrophobicContact CE3-CB 4.46Å; W183-Q187 PolarHBondContact O-N 3.15Å
184T94.6Very high92.7Very high5 Ų570.1 Ų70.13%0.03132%0.323CS..Hα-helixtrans-64.6-45.4-175-490000111.8L172 I175 R181 Y182 I186 Q187 W188L172-T184 HydrophobicContact CD2-CG2 3.88Å; I175-T184 HydrophobicContact CD1-CG2 3.47Å; I175-T184 VanDerWaalsContact CD1-CG2 3.47Å; I175-T184 WeakPolarHBondContact CD1-OG1 3.47Å; R181-T184 PolarHBondContact O-N 3.13Å; R181-T184 PolarHBondContact O-OG1 3.04Å; Y182-T184 PolarHBondContact O-N 2.95Å; T184-I186 VanDerWaalsContact C-N 3.26Å; T184-I186 PolarHBondContact O-N 3.42Å; T184-Q187 WeakPolarHBondContact O-CB 2.97Å; T184-Q187 PolarHBondContact O-N 2.84Å; T184-Q187 VanDerWaalsContact O-N 3.1Å; T184-W188 HydrophobicContact CG2-CD2 4.28Å; T184-W188 VanDerWaalsContact CG2-CE2 3.49Å; T184-W188 HydrophobicContact CG2-CH2 4.3Å; T184-W188 HydrophobicContact CG2-CZ2 3.5Å; T184-W188 VanDerWaalsContact CG2-CZ2 3.5Å; T184-W188 PolarHBondContact O-N 3.05Å
185S95.6Very high92.9Very high0 Ų066.6 Ų66.60%031%0.307CS..Hα-helixtrans-66.6-31.3178.170.90000112Y132 S136 Y182 W188 S189Y132-S185 WeakPolarHBondContact O-CB 3.41Å; Y132-S185 PolarHBondContact O-OG 3.25Å; S136-S185 WeakPolarHBondContact CA-OG 3.5Å; S136-S185 VanDerWaalsContact CB-OG 3.25Å; S136-S185 WeakPolarHBondContact CB-OG 3.48Å; S136-S185 PolarHBondContact N-OG 3.15Å; Y182-S185 PolarHBondContact O-OG 2.93Å; S185-W188 PolarHBondContact O-N 2.99Å; S185-S189 PolarHBondContact O-N 3.18Å; S185-S189 PolarHBondContact O-OG 3.46Å
186I97.3Very high93Very high8 Ų864.7 Ų64.74%0.04130%0.297CS..Hα-helixtrans-64.2-44171.5-57.8-61.9000110.6L133 S136 W183 T184 S189 L190 I215 R219L133-I186 HydrophobicContact CD2-CD1 3.68Å; S136-I186 WeakPolarHBondContact OG-CG1 3.34Å; W183-I186 WeakPolarHBondContact O-CB 3.49Å; W183-I186 PolarHBondContact O-N 3.05Å; T184-I186 VanDerWaalsContact C-N 3.26Å; T184-I186 PolarHBondContact O-N 3.42Å; I186-S189 WeakPolarHBondContact O-CB 2.98Å; I186-S189 PolarHBondContact O-N 3.05Å; I186-L190 HydrophobicContact CG2-CD1 4.48Å; I186-L190 WeakPolarHBondContact O-CG 3.47Å; I186-L190 PolarHBondContact O-N 2.82Å; I186-I215 HydrophobicContact CG2-CG2 3.84Å; I186-R219 HydrophobicContact CD1-CB 4.37Å; I186-R219 HydrophobicContact CG1-CB 4.39Å; I186-R219 HydrophobicContact CG1-CG 4.19Å; I186-R219 HydrophobicContact CG2-CB 4.32Å; I186-R219 HydrophobicContact CG2-CG 4.28Å
187Q96.8Very high93.4Very high94 Ų9456 Ų5644%0.43926%0.26SS..Hα-helixtrans-63.3-40.6175.9179.3168.9-24.600112W183 T184 S189 L190 N191W183-Q187 HydrophobicContact CE3-CB 4.46Å; W183-Q187 PolarHBondContact O-N 3.15Å; T184-Q187 WeakPolarHBondContact O-CB 2.97Å; T184-Q187 PolarHBondContact O-N 2.84Å; T184-Q187 VanDerWaalsContact O-N 3.1Å; Q187-S189 VanDerWaalsContact C-N 3.29Å; Q187-S189 PolarHBondContact O-N 2.96Å; Q187-L190 PolarHBondContact O-N 3.31Å; Q187-N191 PolarHBondContact O-N 3.25Å
188W97.8Very high93.9Very high41 Ų4160.8 Ų60.816%0.15528%0.278CS..Hα-helixtrans-59.3-41.6173.1-60.8-23.7000111.7Y132 L135 E168 I171 L172 T184 S185 N191 L192Y132-W188 HydrophobicContact CD1-CE3 4.06Å; Y132-W188 HydrophobicContact CD2-CB 3.63Å; Y132-W188 AromaticContact CE1-CE3 3.82Å; Y132-W188 HydrophobicContact CE1-CE3 3.82Å; Y132-W188 HydrophobicContact CE1-CZ3 4.33Å; Y132-W188 HydrophobicContact CE2-CB 3.47Å; Y132-W188 VanDerWaalsContact CE2-CB 3.47Å; Y132-W188 HydrophobicContact CE2-CE3 4.3Å; Y132-W188 HydrophobicContact CE2-CG 4.38Å; Y132-W188 HydrophobicContact CG-CB 4.44Å; Y132-W188 HydrophobicContact CG-CE3 4.4Å; Y132-W188 AromaticContact CZ-CE3 3.95Å; L135-W188 HydrophobicContact CD2-CZ3 4.22Å; E168-W188 HydrophobicContact CB-CH2 3.76Å; E168-W188 HydrophobicContact CB-CZ3 3.88Å; E168-W188 HydrophobicContact CG-CH2 4.09Å; E168-W188 HydrophobicContact CG-CZ3 3.92Å; I171-W188 HydrophobicContact CB-CZ2 4.08Å; I171-W188 HydrophobicContact CG2-CZ2 3.71Å; L172-W188 HydrophobicContact CD1-CH2 4.24Å; L172-W188 HydrophobicContact CD2-CH2 4.17Å; L172-W188 HydrophobicContact CD2-CZ2 4.49Å; L172-W188 HydrophobicContact CG-CH2 3.84Å; L172-W188 HydrophobicContact CG-CZ2 4.41Å; T184-W188 HydrophobicContact CG2-CD2 4.28Å; T184-W188 VanDerWaalsContact CG2-CE2 3.49Å; T184-W188 HydrophobicContact CG2-CH2 4.3Å; T184-W188 HydrophobicContact CG2-CZ2 3.5Å; T184-W188 VanDerWaalsContact CG2-CZ2 3.5Å; T184-W188 PolarHBondContact O-N 3.05Å; S185-W188 PolarHBondContact O-N 2.99Å; W188-N191 PolarHBondContact O-N 3.26Å; W188-L192 WeakPolarHBondContact O-CG 3.21Å; W188-L192 PolarHBondContact O-N 3Å
189S97.9Very high94.3Very high0 Ų060.4 Ų60.40%027%0.265CS..Hα-helixtrans-60.8-45.6175.1-61.60000112.5L129 Y132 S185 I186 Q187 N191 L192 V193L129-S189 WeakPolarHBondContact CD2-O 3.29Å; Y132-S189 WeakPolarHBondContact CB-OG 3.42Å; S185-S189 PolarHBondContact O-N 3.18Å; S185-S189 PolarHBondContact O-OG 3.46Å; I186-S189 WeakPolarHBondContact O-CB 2.98Å; I186-S189 PolarHBondContact O-N 3.05Å; Q187-S189 VanDerWaalsContact C-N 3.29Å; Q187-S189 PolarHBondContact O-N 2.96Å; S189-N191 VanDerWaalsContact C-N 3.35Å; S189-N191 PolarHBondContact O-N 2.79Å; S189-L192 PolarHBondContact O-N 2.93Å; S189-V193 WeakPolarHBondContact O-CG2 3.46Å; S189-V193 PolarHBondContact O-N 3.04Å
190L97.9Very high94.9Very high61 Ų6152.9 Ų52.932%0.31925%0.253SS..Hα-helixtrans-62.9-41.7178.3-65.9175.4000111.9I186 Q187 V193 Y194 V212 I215I186-L190 HydrophobicContact CG2-CD1 4.48Å; I186-L190 WeakPolarHBondContact O-CG 3.47Å; I186-L190 PolarHBondContact O-N 2.82Å; Q187-L190 PolarHBondContact O-N 3.31Å; L190-V193 PolarHBondContact O-N 3.01Å; L190-Y194 PolarHBondContact O-N 2.98Å; L190-V212 HydrophobicContact CD2-CB 4.24Å; L190-V212 HydrophobicContact CD2-CG1 3.85Å; L190-V212 HydrophobicContact CD2-CG2 3.98Å; L190-I215 HydrophobicContact CD2-CB 4.3Å; L190-I215 HydrophobicContact CD2-CD1 4.17Å; L190-I215 HydrophobicContact CD2-CG2 3.91Å; L190-I215 HydrophobicContact CG-CG2 4.3Å
191N97.8Very high95.4Very high86 Ų8652.4 Ų52.446%0.4625%0.247SC..Hα-helixtrans-64.8-40.6176.4-73-14.1000112Q187 W188 S189 V193 Y194 E195Q187-N191 PolarHBondContact O-N 3.25Å; W188-N191 PolarHBondContact O-N 3.26Å; S189-N191 VanDerWaalsContact C-N 3.35Å; S189-N191 PolarHBondContact O-N 2.79Å; N191-V193 VanDerWaalsContact C-N 3.34Å; N191-V193 PolarHBondContact O-N 3.2Å; N191-Y194 WeakPolarHBondContact O-CB 3.39Å; N191-Y194 PolarHBondContact O-N 2.7Å; N191-E195 WeakPolarHBondContact O-CG 3.34Å; N191-E195 PolarHBondContact O-N 3.42Å
192L97.1Very high95.7Very high40 Ų4048.8 Ų48.821%0.20923%0.234CC..Hα-helixtrans-62.3-41174.7-78.2-178.9000112.1I125 N128 L129 Y132 W188 S189 Y194 E195 C196I125-L192 HydrophobicContact CG2-CB 4.41Å; N128-L192 HydrophobicContact CB-CD1 4.08Å; L129-L192 HydrophobicContact CD2-CB 3.91Å; L129-L192 HydrophobicContact CD2-CD1 4.27Å; L129-L192 HydrophobicContact CG-CB 4.46Å; L129-L192 HydrophobicContact CG-CD1 4.38Å; Y132-L192 HydrophobicContact CD2-CD1 3.96Å; Y132-L192 HydrophobicContact CE2-CD1 3.48Å; Y132-L192 VanDerWaalsContact CE2-CD1 3.48Å; Y132-L192 HydrophobicContact CE2-CG 4.35Å; W188-L192 WeakPolarHBondContact O-CG 3.21Å; W188-L192 PolarHBondContact O-N 3Å; S189-L192 PolarHBondContact O-N 2.93Å; L192-Y194 VanDerWaalsContact C-N 3.33Å; L192-E195 PolarHBondContact O-N 3.46Å; L192-C196 PolarHBondContact O-N 3.01Å; L192-C196 PolarHBondContact O-SG 3.48Å; L192-C196 VanDerWaalsContact O-SG 3.41Å
193V97.5Very high95.6Very high1 Ų151.7 Ų51.71%0.00625%0.251CS..Hα-helixtrans-63.3-41.1175.81710000111L129 S189 L190 N191 C196 Q197 M208 I211 V212 I215L129-V193 HydrophobicContact CD1-CG2 4.22Å; L129-V193 HydrophobicContact CD2-CG2 3.88Å; S189-V193 WeakPolarHBondContact O-CG2 3.46Å; S189-V193 PolarHBondContact O-N 3.04Å; L190-V193 PolarHBondContact O-N 3.01Å; N191-V193 VanDerWaalsContact C-N 3.34Å; N191-V193 PolarHBondContact O-N 3.2Å; V193-C196 WeakPolarHBondContact O-CB 3.39Å; V193-C196 PolarHBondContact O-N 3.2Å; V193-Q197 PolarHBondContact O-N 3.19Å; V193-Q197 VanDerWaalsContact O-N 3.09Å; V193-M208 HydrophobicContact CG1-CG 3.6Å; V193-I211 HydrophobicContact CG1-CB 4.36Å; V193-I211 HydrophobicContact CG1-CG2 4.22Å; V193-I211 HydrophobicContact CG2-CG2 3.69Å; V193-V212 HydrophobicContact CG1-CG2 4.23Å; V193-I215 HydrophobicContact CG2-CD1 4Å
194Y96.6Very high95.7Very high131 Ų13150 Ų5051%0.51425%0.253SS..Hα-helixtrans-63.2-45175.4-176.5-98.7000112.2L190 N191 L192 C196 Q197 K198L190-Y194 PolarHBondContact O-N 2.98Å; N191-Y194 WeakPolarHBondContact O-CB 3.39Å; N191-Y194 PolarHBondContact O-N 2.7Å; L192-Y194 VanDerWaalsContact C-N 3.33Å; Y194-C196 VanDerWaalsContact C-N 3.33Å; Y194-C196 PolarHBondContact O-N 3.25Å; Y194-Q197 WeakPolarHBondContact O-CB 3.44Å; Y194-Q197 PolarHBondContact O-N 2.87Å; Y194-Q197 VanDerWaalsContact O-N 3.15Å; Y194-K198 PolarHBondContact O-N 2.91Å
195E95.6Very high95.6Very high76 Ų7656.5 Ų56.536%0.35528%0.278SS..Hα-helixtrans-61.9-38.8175.2-75.7-64.2144.400112.2N191 L192 Q197 K198 K199N191-E195 WeakPolarHBondContact O-CG 3.34Å; N191-E195 PolarHBondContact O-N 3.42Å; L192-E195 PolarHBondContact O-N 3.46Å; E195-Q197 VanDerWaalsContact C-N 3.32Å; E195-Q197 PolarHBondContact O-N 3.28Å; E195-K198 PolarHBondContact O-N 3.47Å; E195-K199 WeakPolarHBondContact O-CB 3.49Å; E195-K199 VanDerWaalsContact O-CG 3.31Å; E195-K199 WeakPolarHBondContact O-CG 3.25Å; E195-K199 PolarHBondContact O-N 2.96Å
196C95.3Very high95.6Very high0 Ų063.5 Ų63.50%031%0.305CS..Hα-helixtrans-59.7-41.9172.9-79.40000112.3I125 L192 V193 Y194 K199 G200 K201 V202I125-C196 VanDerWaalsContact CG2-SG 3.56Å; L192-C196 PolarHBondContact O-N 3.01Å; L192-C196 PolarHBondContact O-SG 3.48Å; L192-C196 VanDerWaalsContact O-SG 3.41Å; V193-C196 WeakPolarHBondContact O-CB 3.39Å; V193-C196 PolarHBondContact O-N 3.2Å; Y194-C196 VanDerWaalsContact C-N 3.33Å; Y194-C196 PolarHBondContact O-N 3.25Å; C196-K199 PolarHBondContact O-N 3.44Å; C196-G200 PolarHBondContact O-N 3.34Å; C196-K201 HydrophobicContact CB-CB 4.15Å; C196-K201 WeakPolarHBondContact O-CB 3.42Å; C196-K201 PolarHBondContact O-N 3.47Å; C196-V202 HydrophobicContact CB-CG2 3.96Å
197Q95.4Very high95.6Very high30 Ų3064.5 Ų64.514%0.1431%0.311CS..Hα-helixtrans-65.4-45.2176.7-173.1-77.9-2400111V193 Y194 E195 K199 G200 V202 Y205 M208V193-Q197 PolarHBondContact O-N 3.19Å; V193-Q197 VanDerWaalsContact O-N 3.09Å; Y194-Q197 WeakPolarHBondContact O-CB 3.44Å; Y194-Q197 PolarHBondContact O-N 2.87Å; Y194-Q197 VanDerWaalsContact O-N 3.15Å; E195-Q197 VanDerWaalsContact C-N 3.32Å; E195-Q197 PolarHBondContact O-N 3.28Å; Q197-K199 VanDerWaalsContact C-N 3.28Å; Q197-K199 PolarHBondContact O-N 3.35Å; Q197-G200 PolarHBondContact O-N 3.49Å; Q197-V202 HydrophobicContact CB-CB 4.45Å; Q197-Y205 HydrophobicContact CG-CD1 4.16Å; Q197-Y205 HydrophobicContact CG-CE1 4.06Å; Q197-Y205 PolarHBondContact NE2-OH 3.48Å; Q197-Y205 VanDerWaalsContact NE2-OH 3.13Å; Q197-M208 HydrophobicContact CB-CG 4.4Å; Q197-M208 HydrophobicContact CB-SD 3.75Å; Q197-M208 HydrophobicContact CG-SD 3.82Å
198K95.1Very high95.6Very high145 Ų14561.2 Ų61.263%0.6330%0.296SS*.Hα-helixtrans-61.3-36177.7-173.9-178175.4-172.90112.6Y194 E195 G200Y194-K198 PolarHBondContact O-N 2.91Å; E195-K198 PolarHBondContact O-N 3.47Å; K198-G200 VanDerWaalsContact C-N 3.25Å; K198-G200 PolarHBondContact O-N 2.83Å
199K94.1Very high95.5Very high104 Ų10463.1 Ų63.145%0.45231%0.309SS..THydrogen-bonded Turntrans-800.6175.2-69.4176.8179.6-179.80113.7E121 E195 C196 Q197 K201E121-K199 IonicContact OE1-NZ 2.73Å; E121-K199 PolarHBondContact OE1-NZ 3.44Å; E195-K199 WeakPolarHBondContact O-CB 3.49Å; E195-K199 VanDerWaalsContact O-CG 3.31Å; E195-K199 WeakPolarHBondContact O-CG 3.25Å; E195-K199 PolarHBondContact O-N 2.96Å; C196-K199 PolarHBondContact O-N 3.44Å; Q197-K199 VanDerWaalsContact C-N 3.28Å; Q197-K199 PolarHBondContact O-N 3.35Å; K199-K201 HydrophobicContact CB-CG 4.18Å; K199-K201 PolarHBondContact O-N 3.43Å
200G93.7Very high95.5Very high55 Ų5567 Ų6757%0.56733%0.326SS*.THydrogen-bonded Turntrans69.916.3-178.600000114.7C196 Q197 K198 V202C196-G200 PolarHBondContact O-N 3.34Å; Q197-G200 PolarHBondContact O-N 3.49Å; K198-G200 VanDerWaalsContact C-N 3.25Å; K198-G200 PolarHBondContact O-N 2.83Å; G200-V202 VanDerWaalsContact C-N 3.27Å
201K92.9Very high95.5Very high21 Ų2164.1 Ų64.19%0.09131%0.311CS..SBendtrans-75.7-18.2174.7-59.8-170.2176.5-164.80112.3I115 R116 D119 E121 T122 I125 C196 K199I115-K201 HydrophobicContact CG2-CB 4.44Å; R116-K201 PolarHBondContact N-O 3.06Å; D119-K201 IonicContact OD2-NZ 3.49Å; D119-K201 PolarHBondContact OD2-NZ 3.23Å; E121-K201 VanDerWaalsContact CD-NZ 3.32Å; E121-K201 IonicContact OE2-NZ 2.69Å; E121-K201 PolarHBondContact OE2-NZ 3.45Å; T122-K201 HydrophobicContact CG2-CD 4.23Å; T122-K201 VanDerWaalsContact OG1-CD 3.31Å; T122-K201 WeakPolarHBondContact OG1-CD 3.47Å; T122-K201 VanDerWaalsContact OG1-CE 3.27Å; T122-K201 WeakPolarHBondContact OG1-CE 3.4Å; T122-K201 PolarHBondContact OG1-NZ 2.92Å; I125-K201 HydrophobicContact CD1-CD 4.45Å; C196-K201 HydrophobicContact CB-CB 4.15Å; C196-K201 WeakPolarHBondContact O-CB 3.42Å; C196-K201 PolarHBondContact O-N 3.47Å; K199-K201 HydrophobicContact CB-CG 4.18Å; K199-K201 PolarHBondContact O-N 3.43Å
202V95.4Very high95.5Very high4 Ų462.3 Ų62.32%0.02430%0.303CS..SBendtrans-116.3119.6172.4179.70000108.4I115 C196 Q197 G200 S204 L207 M208 I211I115-V202 HydrophobicContact CG1-CG2 4.18Å; C196-V202 HydrophobicContact CB-CG2 3.96Å; Q197-V202 HydrophobicContact CB-CB 4.45Å; G200-V202 VanDerWaalsContact C-N 3.27Å; V202-S204 VanDerWaalsContact C-N 3.33Å; V202-S204 PolarHBondContact O-N 3.24Å; V202-L207 HydrophobicContact CG1-CB 3.96Å; V202-M208 HydrophobicContact CG1-CB 4.25Å; V202-I211 HydrophobicContact CG2-CD1 4.5Å
203D90.7Very high95.5Very high94 Ų9464.6 Ų64.650%0.50332%0.315SS..SBendtrans-62.3-34.2-170.8-65-4.8000114.3R116 L207R116-D203 IonicContact CZ-OD1 3.34Å; R116-D203 IonicContact CZ-OD2 2.65Å; R116-D203 IonicContact NE-OD2 3.42Å; R116-D203 IonicContact NH1-OD1 3.65Å; R116-D203 PolarHBondContact NH1-OD1 3.21Å; R116-D203 IonicContact NH1-OD2 2.78Å; R116-D203 PolarHBondContact NH1-OD2 3.07Å; R116-D203 IonicContact NH2-OD2 3.61Å; R116-D203 PolarHBondContact NH2-OD2 3.42Å; R116-D203 VanDerWaalsContact NH2-OD2 3.15Å; D203-L207 HydrophobicContact CB-CD1 4.23Å
204S93.8Very high95.5Very high54 Ų5465.7 Ų65.738%0.37832%0.32SS..  trans-145.3144.8-170.5175.50000112.4V202 Y206 L207 M208V202-S204 VanDerWaalsContact C-N 3.33Å; V202-S204 PolarHBondContact O-N 3.24Å; S204-Y206 PolarHBondContact O-N 2.95Å; S204-Y206 PolarHBondContact OG-N 3.03Å; S204-L207 PolarHBondContact O-N 3.03Å; S204-M208 PolarHBondContact O-N 3.44Å; S204-M208 VanDerWaalsContact O-N 3.08Å
205Y94.4Very high95.6Very high142 Ų14259.5 Ų59.556%0.55730%0.296SS*.Hα-helixtrans-56.5-28.1170.7-70.2-75.6000112.7Q197 M208 N209Q197-Y205 HydrophobicContact CG-CD1 4.16Å; Q197-Y205 HydrophobicContact CG-CE1 4.06Å; Q197-Y205 PolarHBondContact NE2-OH 3.48Å; Q197-Y205 VanDerWaalsContact NE2-OH 3.13Å; Y205-M208 HydrophobicContact CD1-CE 3.93Å; Y205-M208 HydrophobicContact CD1-SD 4.33Å; Y205-M208 WeakPolarHBondContact O-CB 3.45Å; Y205-M208 PolarHBondContact O-N 3.33Å; Y205-N209 PolarHBondContact O-N 3.36Å
206Y95.6Very high95.6Very high146 Ų14656.8 Ų56.857%0.57329%0.288SS*.Hα-helixtrans-63-45.3173.8177.9-95.7000111.8S204 N209 K210S204-Y206 PolarHBondContact O-N 2.95Å; S204-Y206 PolarHBondContact OG-N 3.03Å; Y206-N209 PolarHBondContact O-N 2.77Å; Y206-K210 HydrophobicContact CE1-CG 4.25Å; Y206-K210 PolarHBondContact O-N 3.24Å; Y206-K210 WeakPolarHBondContact OH-CE 3.39Å
207L95.6Very high95.7Very high30 Ų3062.7 Ų62.716%0.15731%0.314CS..Hα-helixtrans-67.3-39.6177.6-60.9179.9000111Y114 V202 D203 S204 N209 K210 I211Y114-L207 HydrophobicContact CD1-CD1 4.3Å; Y114-L207 HydrophobicContact CD1-CD2 4.06Å; Y114-L207 HydrophobicContact CD2-CB 4.11Å; Y114-L207 HydrophobicContact CD2-CD2 4.17Å; Y114-L207 HydrophobicContact CE1-CD2 3.84Å; Y114-L207 HydrophobicContact CE2-CD2 3.92Å; Y114-L207 HydrophobicContact CG-CB 4.2Å; Y114-L207 HydrophobicContact CG-CD1 4.47Å; Y114-L207 HydrophobicContact CG-CD2 4.25Å; V202-L207 HydrophobicContact CG1-CB 3.96Å; D203-L207 HydrophobicContact CB-CD1 4.23Å; S204-L207 PolarHBondContact O-N 3.03Å; L207-N209 VanDerWaalsContact C-N 3.34Å; L207-N209 PolarHBondContact O-N 2.73Å; L207-K210 WeakPolarHBondContact O-CB 3.39Å; L207-K210 PolarHBondContact O-N 3.49Å; L207-I211 WeakPolarHBondContact O-CG1 3.41Å; L207-I211 PolarHBondContact O-N 2.89Å
208M96.6Very high95.8Very high24 Ų2461.7 Ų61.712%0.11831%0.309CS..Hα-helixtrans-56-48173-170.5-169.175.200111.3V193 Q197 V202 S204 Y205 K210 I211 V212V193-M208 HydrophobicContact CG1-CG 3.6Å; Q197-M208 HydrophobicContact CB-CG 4.4Å; Q197-M208 HydrophobicContact CB-SD 3.75Å; Q197-M208 HydrophobicContact CG-SD 3.82Å; V202-M208 HydrophobicContact CG1-CB 4.25Å; S204-M208 PolarHBondContact O-N 3.44Å; S204-M208 VanDerWaalsContact O-N 3.08Å; Y205-M208 HydrophobicContact CD1-CE 3.93Å; Y205-M208 HydrophobicContact CD1-SD 4.33Å; Y205-M208 WeakPolarHBondContact O-CB 3.45Å; Y205-M208 PolarHBondContact O-N 3.33Å; M208-K210 VanDerWaalsContact C-N 3.29Å; M208-K210 PolarHBondContact O-N 2.72Å; M208-I211 WeakPolarHBondContact O-CB 3.44Å; M208-I211 PolarHBondContact O-N 2.67Å; M208-I211 VanDerWaalsContact O-N 3.11Å; M208-V212 WeakPolarHBondContact O-CG2 3.24Å; M208-V212 PolarHBondContact O-N 3.44Å
209N96.6Very high95.9Very high82 Ų8258.4 Ų58.444%0.43929%0.293SS..Hα-helixtrans-60.3-37.5177.9-78.8-20000112.4Y205 Y206 L207 I211 V212 D213Y205-N209 PolarHBondContact O-N 3.36Å; Y206-N209 PolarHBondContact O-N 2.77Å; L207-N209 VanDerWaalsContact C-N 3.34Å; L207-N209 PolarHBondContact O-N 2.73Å; N209-I211 VanDerWaalsContact C-N 3.32Å; N209-I211 PolarHBondContact O-N 3.1Å; N209-V212 PolarHBondContact O-N 2.81Å; N209-D213 WeakPolarHBondContact O-CB 3.31Å; N209-D213 PolarHBondContact O-N 3.48Å
210K97.3Very high96Very high82 Ų8258.9 Ų58.936%0.35730%0.296SS..Hα-helixtrans-61.5-40.3174.6-67.8-60.5-177.4-172.60112.8Y114 Y206 L207 M208 E214Y114-K210 HydrophobicContact CE2-CB 4.08Å; Y206-K210 HydrophobicContact CE1-CG 4.25Å; Y206-K210 PolarHBondContact O-N 3.24Å; Y206-K210 WeakPolarHBondContact OH-CE 3.39Å; L207-K210 WeakPolarHBondContact O-CB 3.39Å; L207-K210 PolarHBondContact O-N 3.49Å; M208-K210 VanDerWaalsContact C-N 3.29Å; M208-K210 PolarHBondContact O-N 2.72Å; K210-E214 PolarHBondContact O-N 3.26Å
211I97.7Very high96.1Very high0 Ų057 Ų570%028%0.277CS..Hα-helixtrans-65.5-46175.4-59.6171000110.5L110 F111 Y114 I115 V193 V202 L207 M208 N209 E214 I215L110-I211 HydrophobicContact CB-CG1 4.26Å; F111-I211 HydrophobicContact CD1-CG2 3.75Å; F111-I211 HydrophobicContact CE1-CG2 3.43Å; F111-I211 VanDerWaalsContact CE1-CG2 3.43Å; Y114-I211 HydrophobicContact CD2-CD1 4.47Å; Y114-I211 HydrophobicContact CD2-CG1 4.08Å; I115-I211 HydrophobicContact CD1-CD1 4.45Å; I115-I211 HydrophobicContact CG1-CD1 4.05Å; V193-I211 HydrophobicContact CG1-CB 4.36Å; V193-I211 HydrophobicContact CG1-CG2 4.22Å; V193-I211 HydrophobicContact CG2-CG2 3.69Å; V202-I211 HydrophobicContact CG2-CD1 4.5Å; L207-I211 WeakPolarHBondContact O-CG1 3.41Å; L207-I211 PolarHBondContact O-N 2.89Å; M208-I211 WeakPolarHBondContact O-CB 3.44Å; M208-I211 PolarHBondContact O-N 2.67Å; M208-I211 VanDerWaalsContact O-N 3.11Å; N209-I211 VanDerWaalsContact C-N 3.32Å; N209-I211 PolarHBondContact O-N 3.1Å; I211-E214 PolarHBondContact O-N 2.76Å; I211-I215 HydrophobicContact CG2-CD1 3.99Å; I211-I215 WeakPolarHBondContact O-CG1 3.4Å; I211-I215 PolarHBondContact O-N 3.05Å
212V97.9Very high96.3Very high47 Ų4756 Ų5629%0.28527%0.272SS..Hα-helixtrans-62.5-43.3179.7170.70000111.6L190 V193 M208 N209 E214 I215 G216L190-V212 HydrophobicContact CD2-CB 4.24Å; L190-V212 HydrophobicContact CD2-CG1 3.85Å; L190-V212 HydrophobicContact CD2-CG2 3.98Å; V193-V212 HydrophobicContact CG1-CG2 4.23Å; M208-V212 WeakPolarHBondContact O-CG2 3.24Å; M208-V212 PolarHBondContact O-N 3.44Å; N209-V212 PolarHBondContact O-N 2.81Å; V212-E214 VanDerWaalsContact C-N 3.27Å; V212-E214 PolarHBondContact O-N 2.76Å; V212-I215 PolarHBondContact O-N 3.43Å; V212-G216 PolarHBondContact O-N 2.93Å
213D97.7Very high96.2Very high89 Ų8956.4 Ų56.448%0.47628%0.276SS..Hα-helixtrans-57.8-42.4175.8-75.1-18.4000110.9N209 G216 K217N209-D213 WeakPolarHBondContact O-CB 3.31Å; N209-D213 PolarHBondContact O-N 3.48Å; D213-G216 CarbonylContact O-C 3.44Å; D213-G216 WeakPolarHBondContact O-CA 3.42Å; D213-G216 PolarHBondContact O-N 2.88Å; D213-K217 WeakPolarHBondContact O-CG 3.49Å; D213-K217 PolarHBondContact O-N 2.83Å
214E97.6Very high96.5Very high24 Ų2453.7 Ų53.711%0.11227%0.265CS..Hα-helixtrans-71.2-42.9-178.6-161.553.2-125.700112.6D106 A107 L110 K210 I211 V212 G216 K217 F218D106-E214 HydrophobicContact CB-CG 4.05Å; A107-E214 HydrophobicContact CB-CG 4.14Å; L110-E214 HydrophobicContact CD1-CB 3.58Å; L110-E214 HydrophobicContact CD1-CG 3.87Å; K210-E214 PolarHBondContact O-N 3.26Å; I211-E214 PolarHBondContact O-N 2.76Å; V212-E214 VanDerWaalsContact C-N 3.27Å; V212-E214 PolarHBondContact O-N 2.76Å; E214-G216 PolarHBondContact O-N 3.4Å; E214-K217 PolarHBondContact O-N 3.34Å; E214-K217 IonicContact OE2-NZ 3.08Å; E214-K217 PolarHBondContact OE2-NZ 2.95Å; E214-F218 PolarHBondContact O-N 3.46Å
215I98.1Very high96.5Very high1 Ų151.2 Ų51.21%0.00525%0.247CC..Hα-helixtrans-56.2-42.1168.8-68.9169000110F111 L133 I186 L190 V193 I211 V212 F218 R219F111-I215 HydrophobicContact CE1-CD1 4.1Å; F111-I215 HydrophobicContact CE1-CG1 4.25Å; F111-I215 HydrophobicContact CZ-CD1 4.26Å; F111-I215 HydrophobicContact CZ-CG1 4.11Å; L133-I215 HydrophobicContact CD2-CG1 4.33Å; L133-I215 HydrophobicContact CD2-CG2 4.09Å; I186-I215 HydrophobicContact CG2-CG2 3.84Å; L190-I215 HydrophobicContact CD2-CB 4.3Å; L190-I215 HydrophobicContact CD2-CD1 4.17Å; L190-I215 HydrophobicContact CD2-CG2 3.91Å; L190-I215 HydrophobicContact CG-CG2 4.3Å; V193-I215 HydrophobicContact CG2-CD1 4Å; I211-I215 HydrophobicContact CG2-CD1 3.99Å; I211-I215 WeakPolarHBondContact O-CG1 3.4Å; I211-I215 PolarHBondContact O-N 3.05Å; V212-I215 PolarHBondContact O-N 3.43Å; I215-F218 PolarHBondContact O-N 3.15Å; I215-R219 PolarHBondContact O-N 2.86Å
216G97.2Very high96.6Very high18 Ų1846.5 Ų46.519%0.18623%0.232CC..Hα-helixtrans-58.2-51.917500000112V212 D213 E214 F218 R219 H220V212-G216 PolarHBondContact O-N 2.93Å; D213-G216 CarbonylContact O-C 3.44Å; D213-G216 WeakPolarHBondContact O-CA 3.42Å; D213-G216 PolarHBondContact O-N 2.88Å; E214-G216 PolarHBondContact O-N 3.4Å; G216-F218 VanDerWaalsContact C-N 3.35Å; G216-F218 PolarHBondContact O-N 3.46Å; G216-R219 WeakPolarHBondContact O-CB 3.42Å; G216-R219 PolarHBondContact O-N 3.35Å; G216-H220 VanDerWaalsContact C-ND1 3.34Å; G216-H220 PolarHBondContact O-N 3.38Å; G216-H220 PolarHBondContact O-ND1 3.46Å
217K96.8Very high96.5Very high125 Ų12546.1 Ų46.154%0.54323%0.233SC..Hα-helixtrans-57.7-45.8178-71.4179.2-154.7156.50111.9D213 E214 R219 H220 G221D213-K217 WeakPolarHBondContact O-CG 3.49Å; D213-K217 PolarHBondContact O-N 2.83Å; E214-K217 PolarHBondContact O-N 3.34Å; E214-K217 IonicContact OE2-NZ 3.08Å; E214-K217 PolarHBondContact OE2-NZ 2.95Å; K217-R219 VanDerWaalsContact C-N 3.34Å; K217-R219 PolarHBondContact O-N 3.2Å; K217-H220 PolarHBondContact O-N 3.27Å; K217-H220 VanDerWaalsContact O-N 3.11Å; K217-G221 PolarHBondContact O-N 2.7Å
218F97.3Very high96.5Very high9 Ų947.5 Ų47.54%0.03924%0.236CC..Hα-helixtrans-56.3-48.8176.3-170.1-85.7000111.4L133 Q137 E214 I215 G216 H220 G221 L222L133-F218 HydrophobicContact CB-CD1 4.34Å; L133-F218 HydrophobicContact CB-CE1 4.06Å; L133-F218 HydrophobicContact CB-CZ 4.29Å; L133-F218 HydrophobicContact CD2-CB 4.45Å; L133-F218 HydrophobicContact CD2-CD1 3.89Å; L133-F218 HydrophobicContact CD2-CE1 4.41Å; L133-F218 HydrophobicContact CD2-CG 4.26Å; L133-F218 VanDerWaalsContact O-CE1 3.28Å; L133-F218 WeakPolarHBondContact O-CE1 3.12Å; Q137-F218 HydrophobicContact CB-CE1 4.1Å; Q137-F218 HydrophobicContact CB-CZ 3.94Å; E214-F218 PolarHBondContact O-N 3.46Å; I215-F218 PolarHBondContact O-N 3.15Å; G216-F218 VanDerWaalsContact C-N 3.35Å; G216-F218 PolarHBondContact O-N 3.46Å; F218-H220 PolarHBondContact O-N 3.04Å; F218-G221 PolarHBondContact O-N 3.47Å; F218-L222 HydrophobicContact CD1-CD1 4.05Å; F218-L222 HydrophobicContact CD1-CG 4.3Å; F218-L222 HydrophobicContact CE1-CD1 3.72Å; F218-L222 HydrophobicContact CE1-CD2 4.48Å; F218-L222 HydrophobicContact CE1-CG 4.14Å; F218-L222 PolarHBondContact O-N 3.16Å; F218-L222 VanDerWaalsContact O-N 3.13Å
219R96.6Very high96.4Very high76 Ų7650.2 Ų50.229%0.28725%0.251SS..Hα-helixtrans-61-39.3175.3-174.9-144.97486.4-2.3112.7Y182 I186 I215 G216 K217 G221 L222 A223Y182-R219 HydrophobicContact CE2-CG 4.44Å; I186-R219 HydrophobicContact CD1-CB 4.37Å; I186-R219 HydrophobicContact CG1-CB 4.39Å; I186-R219 HydrophobicContact CG1-CG 4.19Å; I186-R219 HydrophobicContact CG2-CB 4.32Å; I186-R219 HydrophobicContact CG2-CG 4.28Å; I215-R219 PolarHBondContact O-N 2.86Å; G216-R219 WeakPolarHBondContact O-CB 3.42Å; G216-R219 PolarHBondContact O-N 3.35Å; K217-R219 VanDerWaalsContact C-N 3.34Å; K217-R219 PolarHBondContact O-N 3.2Å; R219-G221 VanDerWaalsContact C-N 3.34Å; R219-L222 PolarHBondContact O-N 3.32Å; R219-A223 WeakPolarHBondContact O-CB 3.49Å; R219-A223 PolarHBondContact O-N 3.18Å
220H96.2Very high96.3Very high113 Ų11356 Ų5652%0.52327%0.267SS..Hα-helixtrans-64.6-38.8176.8-73.399.7000111.9G216 K217 F218 A223 S224G216-H220 VanDerWaalsContact C-ND1 3.34Å; G216-H220 PolarHBondContact O-N 3.38Å; G216-H220 PolarHBondContact O-ND1 3.46Å; K217-H220 PolarHBondContact O-N 3.27Å; K217-H220 VanDerWaalsContact O-N 3.11Å; F218-H220 PolarHBondContact O-N 3.04Å; H220-A223 PolarHBondContact O-N 2.82Å; H220-S224 WeakPolarHBondContact O-CB 3.04Å; H220-S224 PolarHBondContact O-N 3.41Å
221G96.3Very high96.2Very high15 Ų1555.7 Ų55.716%0.15527%0.272CS..Hα-helixtrans-57-53.4171.800000111.5G100 K217 F218 R219 A223 S224 L225G100-G221 CarbonylContact O-C 3.54Å; G100-G221 WeakPolarHBondContact O-CA 3.34Å; K217-G221 PolarHBondContact O-N 2.7Å; F218-G221 PolarHBondContact O-N 3.47Å; R219-G221 VanDerWaalsContact C-N 3.34Å; G221-A223 VanDerWaalsContact C-N 3.34Å; G221-A223 PolarHBondContact O-N 2.86Å; G221-S224 WeakPolarHBondContact O-CA 3.34Å; G221-S224 WeakPolarHBondContact O-CB 3.37Å; G221-S224 PolarHBondContact O-N 2.82Å; G221-L225 PolarHBondContact O-N 3.3Å; G221-L225 VanDerWaalsContact O-N 3.11Å
222L96.1Very high96Very high0 Ų059.6 Ų59.60%030%0.297CS..Hα-helixtrans-58.8-42177.1-62.6-174.1000113.1Q137 V140 F218 R219 S224 L225 L226Q137-L222 HydrophobicContact CB-CD1 4.24Å; Q137-L222 HydrophobicContact CB-CD2 4.04Å; Q137-L222 HydrophobicContact CG-CD2 4.2Å; V140-L222 HydrophobicContact CG1-CB 4.38Å; V140-L222 HydrophobicContact CG2-CB 4.21Å; V140-L222 HydrophobicContact CG2-CD1 4.29Å; F218-L222 HydrophobicContact CD1-CD1 4.05Å; F218-L222 HydrophobicContact CD1-CG 4.3Å; F218-L222 HydrophobicContact CE1-CD1 3.72Å; F218-L222 HydrophobicContact CE1-CD2 4.48Å; F218-L222 HydrophobicContact CE1-CG 4.14Å; F218-L222 PolarHBondContact O-N 3.16Å; F218-L222 VanDerWaalsContact O-N 3.13Å; R219-L222 PolarHBondContact O-N 3.32Å; L222-S224 VanDerWaalsContact C-N 3.28Å; L222-S224 PolarHBondContact O-N 3.32Å; L222-L225 HydrophobicContact CD2-CD1 4.29Å; L222-L225 WeakPolarHBondContact O-CB 3.12Å; L222-L225 PolarHBondContact O-N 3.33Å; L222-L226 PolarHBondContact O-N 3.47Å; L222-L226 VanDerWaalsContact O-N 3.16Å
223A94.9Very high95.8Very high13 Ų1358 Ų5811%0.10729%0.287CS..Hα-helixtrans-65.5-32.3176.300000112.4R219 H220 G221 L226 K227R219-A223 WeakPolarHBondContact O-CB 3.49Å; R219-A223 PolarHBondContact O-N 3.18Å; H220-A223 PolarHBondContact O-N 2.82Å; G221-A223 VanDerWaalsContact C-N 3.34Å; G221-A223 PolarHBondContact O-N 2.86Å; A223-L226 PolarHBondContact O-N 3.03Å; A223-K227 WeakPolarHBondContact O-CG 3.25Å; A223-K227 PolarHBondContact O-N 3.28Å; A223-K227 VanDerWaalsContact O-N 3.1Å
224S95.4Very high95.7Very high38 Ų3857.7 Ų57.727%0.26629%0.29SS..Hα-helixtrans-63.3-43.5173-166.60000110.9H220 G221 L222 L226 K227 Y228H220-S224 WeakPolarHBondContact O-CB 3.04Å; H220-S224 PolarHBondContact O-N 3.41Å; G221-S224 WeakPolarHBondContact O-CA 3.34Å; G221-S224 WeakPolarHBondContact O-CB 3.37Å; G221-S224 PolarHBondContact O-N 2.82Å; L222-S224 VanDerWaalsContact C-N 3.28Å; L222-S224 PolarHBondContact O-N 3.32Å; S224-L226 PolarHBondContact O-N 3.06Å; S224-K227 WeakPolarHBondContact O-CB 3.06Å; S224-K227 PolarHBondContact O-N 3.46Å; S224-K227 VanDerWaalsContact O-N 3.15Å; S224-Y228 WeakPolarHBondContact O-CD2 3.47Å; S224-Y228 PolarHBondContact O-N 3.3Å
225L95.6Very high95.5Very high2 Ų262.4 Ų62.41%0.0132%0.316CS..Hα-helixtrans-58.7-46.4176.2-60.3177.6000111.7I97 L141 I144 G221 L222 K227 Y228 D229I97-L225 HydrophobicContact CG2-CD2 3.84Å; I97-L225 VanDerWaalsContact O-CD2 3.26Å; I97-L225 WeakPolarHBondContact O-CD2 3.27Å; L141-L225 HydrophobicContact CD2-CD1 4.26Å; I144-L225 HydrophobicContact CD1-CB 3.69Å; G221-L225 PolarHBondContact O-N 3.3Å; G221-L225 VanDerWaalsContact O-N 3.11Å; L222-L225 HydrophobicContact CD2-CD1 4.29Å; L222-L225 WeakPolarHBondContact O-CB 3.12Å; L222-L225 PolarHBondContact O-N 3.33Å; L225-K227 VanDerWaalsContact C-N 3.3Å; L225-K227 PolarHBondContact O-N 3.36Å; L225-Y228 PolarHBondContact O-N 3.03Å; L225-Y228 VanDerWaalsContact O-N 3.17Å; L225-D229 PolarHBondContact O-N 3.24Å
226L94.8Very high95.4Very high43 Ų4366.7 Ų66.723%0.22534%0.342CS..Hα-helixtrans-60.5-37.6175.7-69.5172.8000112.7V140 I144 Y182 L222 A223 S224 D229 W230V140-L226 HydrophobicContact CG1-CD1 4.46Å; V140-L226 HydrophobicContact CG1-CD2 3.97Å; V140-L226 HydrophobicContact CG1-CG 3.91Å; V140-L226 HydrophobicContact CG2-CD1 4.17Å; V140-L226 HydrophobicContact CG2-CG 4.5Å; I144-L226 HydrophobicContact CG2-CD2 3.77Å; Y182-L226 HydrophobicContact CD1-CD1 3.83Å; Y182-L226 HydrophobicContact CE1-CD1 3.19Å; L222-L226 PolarHBondContact O-N 3.47Å; L222-L226 VanDerWaalsContact O-N 3.16Å; A223-L226 PolarHBondContact O-N 3.03Å; S224-L226 PolarHBondContact O-N 3.06Å; L226-D229 PolarHBondContact O-N 3.23Å; L226-W230 VanDerWaalsContact O-CB 3.23Å; L226-W230 WeakPolarHBondContact O-CB 3.17Å; L226-W230 PolarHBondContact O-N 2.85Å
227K94.3Very high95.3Very high137 Ų13769.9 Ų69.960%0.59635%0.349SS*.Hα-helixtrans-66.9-38.8176-72171.9-175-179.40111.9A223 S224 L225 V231A223-K227 WeakPolarHBondContact O-CG 3.25Å; A223-K227 PolarHBondContact O-N 3.28Å; A223-K227 VanDerWaalsContact O-N 3.1Å; S224-K227 WeakPolarHBondContact O-CB 3.06Å; S224-K227 PolarHBondContact O-N 3.46Å; S224-K227 VanDerWaalsContact O-N 3.15Å; L225-K227 VanDerWaalsContact C-N 3.3Å; L225-K227 PolarHBondContact O-N 3.36Å; K227-V231 PolarHBondContact O-N 2.93Å
228Y94.8Very high95.3Very high60 Ų6064.6 Ų64.624%0.23533%0.327CS..Hα-helixtrans-64.9-44.9174.9-79.2-62.8000110.6R93 S96 I97 S224 L225 V231R93-Y228 HydrophobicContact CG-CD1 3.92Å; R93-Y228 HydrophobicContact CG-CE1 3.83Å; R93-Y228 PolarHBondContact NH2-O 3.46Å; S96-Y228 WeakPolarHBondContact CB-OH 3.4Å; I97-Y228 HydrophobicContact CD1-CG 4.3Å; I97-Y228 HydrophobicContact CG1-CD1 4.14Å; I97-Y228 HydrophobicContact CG1-CD2 3.76Å; I97-Y228 HydrophobicContact CG1-CE2 4.4Å; I97-Y228 HydrophobicContact CG1-CG 3.64Å; S224-Y228 WeakPolarHBondContact O-CD2 3.47Å; S224-Y228 PolarHBondContact O-N 3.3Å; L225-Y228 PolarHBondContact O-N 3.03Å; L225-Y228 VanDerWaalsContact O-N 3.17Å; Y228-V231 CarbonylContact O-C 3.6Å
229D94.6Very high95.2Very high80 Ų8069.1 Ų69.143%0.42835%0.349SS..Hα-helixtrans-62.4-47.9175.6-17571.5000112.5I144 L225 L226 V231I144-D229 HydrophobicContact CB-CB 4.05Å; I144-D229 HydrophobicContact CG2-CB 3.6Å; L225-D229 PolarHBondContact O-N 3.24Å; L226-D229 PolarHBondContact O-N 3.23Å; D229-V231 PolarHBondContact O-N 2.9Å
230W94.6Very high95.1Very high203 Ų20369.2 Ų69.277%0.76936%0.357SS*.Hα-helixtrans-64.5-39.4-179176.846.5000113.7L226 P232L226-W230 VanDerWaalsContact O-CB 3.23Å; L226-W230 WeakPolarHBondContact O-CB 3.17Å; L226-W230 PolarHBondContact O-N 2.85Å; W230-P232 VanDerWaalsContact C-CD 3.44Å; W230-P232 WeakPolarHBondContact O-CD 3.33Å
231V95.4Very high95.1Very high76 Ų7663.9 Ų63.946%0.46133%0.333SS..SBendtrans-111.483.8-180-170.30000109.3R93 K227 Y228 D229R93-V231 PolarHBondContact NH1-O 3.05Å; R93-V231 PolarHBondContact NH2-O 3.23Å; R93-V231 VanDerWaalsContact NH2-O 3.09Å; K227-V231 PolarHBondContact O-N 2.93Å; Y228-V231 CarbonylContact O-C 3.6Å; D229-V231 PolarHBondContact O-N 2.9Å
232P93.1Very high95Very high83 Ų8365 Ų6554%0.53933%0.333SS..PPolyproline II helixtrans-69.4172173.131-36000111.1W230W230-P232 VanDerWaalsContact C-CD 3.44Å; W230-P232 WeakPolarHBondContact O-CD 3.33Å
233V94.1Very high94.9Very high12 Ų1269.9 Ų69.97%0.07336%0.359CS..SBendtrans-57134.2169.7-1750000108.9F86 F89 L235 Y237 P238 L294F86-V233 HydrophobicContact CE2-CG1 4.38Å; F89-V233 HydrophobicContact CE1-CB 4.28Å; F89-V233 HydrophobicContact CE1-CG1 3.74Å; F89-V233 HydrophobicContact CE1-CG2 3.64Å; F89-V233 HydrophobicContact CZ-CG2 4.41Å; V233-L235 PolarHBondContact O-N 3.01Å; V233-L235 VanDerWaalsContact O-N 3.15Å; V233-Y237 HydrophobicContact CG1-CD1 4.17Å; V233-P238 HydrophobicContact CB-CG 4.33Å; V233-P238 HydrophobicContact CG1-CG 4.09Å; V233-L294 HydrophobicContact CB-CD2 4.25Å; V233-L294 HydrophobicContact CG2-CD2 3.74Å
234P95.3Very high94.9Very high83 Ų8370.1 Ų70.154%0.53936%0.361SS..PPolyproline II helixtrans-51.2124.2-179.6-28.835.2000111.3V236 Y237 P238P234-V236 HydrophobicContact CB-CG1 4.46Å; P234-V236 PolarHBondContact O-N 3.39Å; P234-Y237 WeakPolarHBondContact O-CB 3.37Å; P234-Y237 PolarHBondContact O-N 3.35Å; P234-P238 WeakPolarHBondContact O-CD 3.29Å
235L94.6Very high94.9Very high123 Ų12368.3 Ų68.364%0.64435%0.349SS*.THydrogen-bonded Turntrans-51.5-38.2-168.6177.361.9000113.8V233 Y237 P238 Q239V233-L235 PolarHBondContact O-N 3.01Å; V233-L235 VanDerWaalsContact O-N 3.15Å; L235-Y237 PolarHBondContact O-N 3.35Å; L235-P238 WeakPolarHBondContact O-CD 3.35Å; L235-Q239 HydrophobicContact CD1-CG 4.19Å; L235-Q239 HydrophobicContact CG-CG 4.27Å; L235-Q239 WeakPolarHBondContact O-CB 3.45Å; L235-Q239 WeakPolarHBondContact O-CG 3.41Å; L235-Q239 PolarHBondContact O-N 3.19Å
236V96.6Very high94.9Very high92 Ų9272.5 Ų72.556%0.55836%0.364SS*.Hα-helixtrans-57.9-31.7177.865.70000112.7P234 Q239 V240P234-V236 HydrophobicContact CB-CG1 4.46Å; P234-V236 PolarHBondContact O-N 3.39Å; V236-Q239 PolarHBondContact O-N 3.4Å; V236-V240 HydrophobicContact CG2-CG2 4.13Å; V236-V240 WeakPolarHBondContact O-CB 3.11Å; V236-V240 VanDerWaalsContact O-CG2 3.25Å; V236-V240 WeakPolarHBondContact O-CG2 3.34Å; V236-V240 PolarHBondContact O-N 3.1Å
237Y94.9Very high94.9Very high84 Ų8474 Ų7433%0.32937%0.372SS..Hα-helixtrans-73.2-54.2-173.2-168.7-168.5000111.9F86 V233 P234 L235 Q239 V240 I241F86-Y237 HydrophobicContact CB-CE2 4.47Å; F86-Y237 HydrophobicContact CD2-CD1 4.23Å; F86-Y237 HydrophobicContact CD2-CD2 4.16Å; F86-Y237 HydrophobicContact CD2-CE1 4.13Å; F86-Y237 HydrophobicContact CD2-CE2 4.05Å; F86-Y237 HydrophobicContact CD2-CG 4.26Å; F86-Y237 HydrophobicContact CE2-CG 4.44Å; V233-Y237 HydrophobicContact CG1-CD1 4.17Å; P234-Y237 WeakPolarHBondContact O-CB 3.37Å; P234-Y237 PolarHBondContact O-N 3.35Å; L235-Y237 PolarHBondContact O-N 3.35Å; Y237-Q239 VanDerWaalsContact C-N 3.27Å; Y237-Q239 PolarHBondContact O-N 3.21Å; Y237-V240 PolarHBondContact O-N 3.24Å; Y237-I241 HydrophobicContact CD2-CG1 3.98Å; Y237-I241 HydrophobicContact CE2-CD1 4.13Å; Y237-I241 HydrophobicContact CE2-CG1 4Å; Y237-I241 WeakPolarHBondContact O-CG1 3.37Å; Y237-I241 PolarHBondContact O-N 3.24Å
238P95.5Very high94.9Very high14 Ų1467.6 Ų67.69%0.09134%0.344CS..Hα-helixtrans-56.7-40.2169-23.432.8000112.5F86 V233 P234 L235 V240 I241 F242 L294F86-P238 HydrophobicContact CE2-CB 4.43Å; F86-P238 HydrophobicContact CE2-CG 4.03Å; F86-P238 HydrophobicContact CZ-CB 4Å; F86-P238 HydrophobicContact CZ-CG 3.95Å; V233-P238 HydrophobicContact CB-CG 4.33Å; V233-P238 HydrophobicContact CG1-CG 4.09Å; P234-P238 WeakPolarHBondContact O-CD 3.29Å; L235-P238 WeakPolarHBondContact O-CD 3.35Å; P238-V240 PolarHBondContact O-N 3.04Å; P238-I241 PolarHBondContact O-N 2.62Å; P238-F242 HydrophobicContact CB-CD2 4.06Å; P238-F242 HydrophobicContact CB-CE2 3.78Å; P238-F242 HydrophobicContact CB-CZ 4.21Å; P238-F242 WeakPolarHBondContact O-CB 3.4Å; P238-F242 WeakPolarHBondContact O-CD2 3.31Å; P238-F242 WeakPolarHBondContact O-CG 3.3Å; P238-F242 PolarHBondContact O-N 3.3Å; P238-L294 HydrophobicContact CB-CD1 4.5Å
239Q95.6Very high95Very high105 Ų10565 Ų6549%0.49133%0.333SS..Hα-helixtrans-57-50.8178.5-77.2175.2-21.100112.3L235 V236 Y237 I241 L243L235-Q239 HydrophobicContact CD1-CG 4.19Å; L235-Q239 HydrophobicContact CG-CG 4.27Å; L235-Q239 WeakPolarHBondContact O-CB 3.45Å; L235-Q239 WeakPolarHBondContact O-CG 3.41Å; L235-Q239 PolarHBondContact O-N 3.19Å; V236-Q239 PolarHBondContact O-N 3.4Å; Y237-Q239 VanDerWaalsContact C-N 3.27Å; Y237-Q239 PolarHBondContact O-N 3.21Å; Q239-I241 PolarHBondContact O-N 3.18Å; Q239-L243 WeakPolarHBondContact O-CB 3.27Å; Q239-L243 PolarHBondContact O-N 2.93Å
240V95.1Very high95.1Very high77 Ų7767 Ų6747%0.46734%0.342SS..Hα-helixtrans-60.6-45.6180167.70000111V236 Y237 P238 A244V236-V240 HydrophobicContact CG2-CG2 4.13Å; V236-V240 WeakPolarHBondContact O-CB 3.11Å; V236-V240 VanDerWaalsContact O-CG2 3.25Å; V236-V240 WeakPolarHBondContact O-CG2 3.34Å; V236-V240 PolarHBondContact O-N 3.1Å; Y237-V240 PolarHBondContact O-N 3.24Å; P238-V240 PolarHBondContact O-N 3.04Å; V240-A244 WeakPolarHBondContact O-CB 3.48Å; V240-A244 PolarHBondContact O-N 3.11Å
241I95.4Very high95.1Very high2 Ų258.9 Ų58.91%0.0131%0.313CS..Hα-helixtrans-67.7-48.9-178-59.2-66.9000110.9L82 L83 F86 Y237 P238 Q239 L243 A244 V245L82-I241 HydrophobicContact CB-CD1 3.69Å; L82-I241 HydrophobicContact CD2-CD1 4.16Å; L82-I241 HydrophobicContact CG-CD1 4.42Å; L83-I241 HydrophobicContact CD2-CG2 3.77Å; L83-I241 HydrophobicContact CG-CG2 4.44Å; F86-I241 HydrophobicContact CB-CD1 4.26Å; F86-I241 HydrophobicContact CB-CG1 4.06Å; F86-I241 HydrophobicContact CB-CG2 4.42Å; F86-I241 HydrophobicContact CD1-CB 4.31Å; F86-I241 HydrophobicContact CD1-CG1 4.34Å; F86-I241 HydrophobicContact CD1-CG2 3.85Å; F86-I241 HydrophobicContact CD2-CG1 4.21Å; F86-I241 HydrophobicContact CE1-CG2 4.43Å; F86-I241 HydrophobicContact CG-CB 4.42Å; F86-I241 HydrophobicContact CG-CG1 3.95Å; F86-I241 HydrophobicContact CG-CG2 4.24Å; Y237-I241 HydrophobicContact CD2-CG1 3.98Å; Y237-I241 HydrophobicContact CE2-CD1 4.13Å; Y237-I241 HydrophobicContact CE2-CG1 4Å; Y237-I241 WeakPolarHBondContact O-CG1 3.37Å; Y237-I241 PolarHBondContact O-N 3.24Å; P238-I241 PolarHBondContact O-N 2.62Å; Q239-I241 PolarHBondContact O-N 3.18Å; I241-L243 VanDerWaalsContact C-N 3.3Å; I241-L243 PolarHBondContact O-N 2.87Å; I241-A244 PolarHBondContact O-N 3.2Å; I241-V245 WeakPolarHBondContact O-CG2 3.44Å; I241-V245 PolarHBondContact O-N 3.43Å; I241-V245 VanDerWaalsContact O-N 3.09Å
242F94.9Very high95.1Very high37 Ų3755.3 Ų55.316%0.16229%0.291CS..Hα-helixtrans-64.3-35.9-179.5-69.1-10.3000112.6F86 P238 R246 M287 E291 L294F86-F242 AromaticContact CE1-CE1 3.84Å; F86-F242 HydrophobicContact CE1-CE1 3.84Å; F86-F242 HydrophobicContact CE1-CZ 4.24Å; F86-F242 HydrophobicContact CZ-CE1 4.43Å; F86-F242 HydrophobicContact CZ-CZ 4.46Å; P238-F242 HydrophobicContact CB-CD2 4.06Å; P238-F242 HydrophobicContact CB-CE2 3.78Å; P238-F242 HydrophobicContact CB-CZ 4.21Å; P238-F242 WeakPolarHBondContact O-CB 3.4Å; P238-F242 WeakPolarHBondContact O-CD2 3.31Å; P238-F242 WeakPolarHBondContact O-CG 3.3Å; P238-F242 PolarHBondContact O-N 3.3Å; F242-R246 WeakPolarHBondContact O-CB 3.48Å; F242-R246 VanDerWaalsContact O-CG 3.31Å; F242-R246 WeakPolarHBondContact O-CG 3.47Å; F242-R246 PolarHBondContact O-N 3.35Å; F242-R246 PolarHBondContact O-NH1 3.49Å; F242-M287 HydrophobicContact CB-SD 4.36Å; F242-M287 HydrophobicContact CD1-CG 3.51Å; F242-M287 HydrophobicContact CD1-SD 3.68Å; F242-M287 HydrophobicContact CE1-CG 3.69Å; F242-M287 HydrophobicContact CE1-SD 4.39Å; F242-M287 HydrophobicContact CG-SD 4.31Å; F242-E291 HydrophobicContact CZ-CB 4.16Å; F242-E291 HydrophobicContact CZ-CG 4.26Å; F242-L294 HydrophobicContact CE2-CD1 4.08Å; F242-L294 HydrophobicContact CZ-CD1 3.72Å
243L94.4Very high95.2Very high103 Ų10351.8 Ų51.854%0.53927%0.268SS..Hα-helixtrans-72.3-45.8174.9-175.265.7000111Q239 I241 V245 R246 I247Q239-L243 WeakPolarHBondContact O-CB 3.27Å; Q239-L243 PolarHBondContact O-N 2.93Å; I241-L243 VanDerWaalsContact C-N 3.3Å; I241-L243 PolarHBondContact O-N 2.87Å; L243-V245 VanDerWaalsContact C-N 3.35Å; L243-V245 PolarHBondContact O-N 2.97Å; L243-R246 PolarHBondContact O-N 3.44Å; L243-I247 HydrophobicContact CD1-CD1 3.77Å; L243-I247 HydrophobicContact CD1-CG1 3.92Å; L243-I247 HydrophobicContact CD2-CD1 4.05Å; L243-I247 HydrophobicContact CG-CD1 3.56Å; L243-I247 HydrophobicContact CG-CG1 4.05Å; L243-I247 WeakPolarHBondContact O-CB 3.38Å; L243-I247 WeakPolarHBondContact O-CG1 3.4Å; L243-I247 PolarHBondContact O-N 3.13Å
244A94.8Very high95.3Very high18 Ų1853.3 Ų53.315%0.14928%0.276CS..Hα-helixtrans-57.9-45.8-179.500000112.1L79 L82 V240 I241 Y248L79-A244 HydrophobicContact CD2-CB 4.31Å; L82-A244 HydrophobicContact CD1-CB 4.46Å; V240-A244 WeakPolarHBondContact O-CB 3.48Å; V240-A244 PolarHBondContact O-N 3.11Å; I241-A244 PolarHBondContact O-N 3.2Å; A244-Y248 VanDerWaalsContact O-CB 3.27Å; A244-Y248 WeakPolarHBondContact O-CB 3.5Å; A244-Y248 PolarHBondContact O-N 2.78Å
245V95.7Very high95.1Very high1 Ų149.5 Ų49.51%0.00625%0.251CS..Hα-helixtrans-62.8-44.5177.2179.20000111L79 L83 I241 L243 Y248 F249 M284 M287L79-V245 HydrophobicContact CD2-CB 4.49Å; L79-V245 HydrophobicContact CD2-CG2 3.94Å; L83-V245 HydrophobicContact CD1-CG2 3.89Å; L83-V245 HydrophobicContact CD2-CG2 4.09Å; L83-V245 HydrophobicContact CG-CG2 4.12Å; I241-V245 WeakPolarHBondContact O-CG2 3.44Å; I241-V245 PolarHBondContact O-N 3.43Å; I241-V245 VanDerWaalsContact O-N 3.09Å; L243-V245 VanDerWaalsContact C-N 3.35Å; L243-V245 PolarHBondContact O-N 2.97Å; V245-Y248 PolarHBondContact O-N 3.3Å; V245-F249 HydrophobicContact CG1-CD2 4.01Å; V245-F249 HydrophobicContact CG1-CE2 3.89Å; V245-F249 WeakPolarHBondContact O-CD2 3.36Å; V245-F249 PolarHBondContact O-N 3.26Å; V245-F249 VanDerWaalsContact O-N 3.16Å; V245-M284 HydrophobicContact CG1-CG 4.42Å; V245-M284 HydrophobicContact CG1-SD 3.49Å; V245-M284 WeakPolarHBondContact CG1-SD 3.27Å; V245-M287 HydrophobicContact CB-SD 3.9Å; V245-M287 HydrophobicContact CG1-SD 4.05Å; V245-M287 HydrophobicContact CG2-SD 4.22Å
246R94.8Very high95Very high90 Ų9045.6 Ų45.634%0.3423%0.228SC..Hα-helixtrans-68.3-43.8179.9-73.8175.8179.876.5-4.6112.2F242 L243 Y248 F249 M250 M287F242-R246 WeakPolarHBondContact O-CB 3.48Å; F242-R246 VanDerWaalsContact O-CG 3.31Å; F242-R246 WeakPolarHBondContact O-CG 3.47Å; F242-R246 PolarHBondContact O-N 3.35Å; F242-R246 PolarHBondContact O-NH1 3.49Å; L243-R246 PolarHBondContact O-N 3.44Å; R246-Y248 VanDerWaalsContact C-N 3.32Å; R246-Y248 PolarHBondContact O-N 2.95Å; R246-F249 PolarHBondContact O-N 3.45Å; R246-M250 VanDerWaalsContact O-CG 3.28Å; R246-M250 WeakPolarHBondContact O-CG 3.17Å; R246-M250 PolarHBondContact O-N 3.24Å; R246-M287 PolarHBondContact NH1-SD 3.18Å
247I94.4Very high94.9Very high74 Ų7441.5 Ų41.538%0.37920%0.203SC..Hα-helixtrans-61-43.8176.2-72.5179.6000110.3L243 F249 M250 I251L243-I247 HydrophobicContact CD1-CD1 3.77Å; L243-I247 HydrophobicContact CD1-CG1 3.92Å; L243-I247 HydrophobicContact CD2-CD1 4.05Å; L243-I247 HydrophobicContact CG-CD1 3.56Å; L243-I247 HydrophobicContact CG-CG1 4.05Å; L243-I247 WeakPolarHBondContact O-CB 3.38Å; L243-I247 WeakPolarHBondContact O-CG1 3.4Å; L243-I247 PolarHBondContact O-N 3.13Å; I247-F249 VanDerWaalsContact C-N 3.32Å; I247-F249 PolarHBondContact O-N 3.35Å; I247-M250 WeakPolarHBondContact O-CB 3.4Å; I247-M250 PolarHBondContact O-N 3.39Å; I247-M250 VanDerWaalsContact O-N 3.16Å; I247-I251 HydrophobicContact CG2-CD1 3.79Å; I247-I251 HydrophobicContact CG2-CG1 4.33Å; I247-I251 WeakPolarHBondContact O-CG1 3.36Å; I247-I251 PolarHBondContact O-N 3.09Å
248Y95.7Very high94.6Very high3 Ų339.1 Ų39.11%0.01219%0.194CC..Hα-helixtrans-54.7-49175.5175.2-89000111.2L73 D74 I77 L79 A244 V245 R246 M250 I251 C252L73-Y248 HydrophobicContact CD1-CD2 4.3Å; L73-Y248 HydrophobicContact CD2-CD2 4.35Å; L73-Y248 HydrophobicContact CD2-CE2 4.02Å; L73-Y248 HydrophobicContact CG-CD2 4.03Å; L73-Y248 HydrophobicContact CG-CE2 3.76Å; D74-Y248 WeakPolarHBondContact OD1-CE2 3.36Å; D74-Y248 PolarHBondContact OD1-OH 2.96Å; I77-Y248 HydrophobicContact CB-CD2 4.17Å; I77-Y248 HydrophobicContact CD1-CD2 4.33Å; I77-Y248 HydrophobicContact CG2-CD2 4.39Å; L79-Y248 HydrophobicContact CD1-CD1 3.47Å; L79-Y248 VanDerWaalsContact CD1-CD1 3.47Å; L79-Y248 HydrophobicContact CD1-CD2 3.9Å; L79-Y248 HydrophobicContact CD1-CE1 3.94Å; L79-Y248 HydrophobicContact CD1-CE2 4.32Å; L79-Y248 HydrophobicContact CD1-CG 3.45Å; L79-Y248 VanDerWaalsContact CD1-CG 3.45Å; L79-Y248 HydrophobicContact CG-CD2 4.27Å; L79-Y248 HydrophobicContact CG-CG 4.19Å; A244-Y248 VanDerWaalsContact O-CB 3.27Å; A244-Y248 WeakPolarHBondContact O-CB 3.5Å; A244-Y248 PolarHBondContact O-N 2.78Å; V245-Y248 PolarHBondContact O-N 3.3Å; R246-Y248 VanDerWaalsContact C-N 3.32Å; R246-Y248 PolarHBondContact O-N 2.95Å; Y248-M250 PolarHBondContact O-N 3.15Å; Y248-I251 PolarHBondContact O-N 2.81Å; Y248-C252 PolarHBondContact O-N 3.1Å; Y248-C252 PolarHBondContact O-SG 2.98Å
249F96.1Very high94.2Very high4 Ų439 Ų392%0.01819%0.192CC..Hα-helixtrans-73.4-24.4178.3-72.7-61.7000114.6W39 V245 R246 I247 C252 L253 F280 Y283 M284W39-F249 PolarHBondContact NE1-O 2.86Å; V245-F249 HydrophobicContact CG1-CD2 4.01Å; V245-F249 HydrophobicContact CG1-CE2 3.89Å; V245-F249 WeakPolarHBondContact O-CD2 3.36Å; V245-F249 PolarHBondContact O-N 3.26Å; V245-F249 VanDerWaalsContact O-N 3.16Å; R246-F249 PolarHBondContact O-N 3.45Å; I247-F249 VanDerWaalsContact C-N 3.32Å; I247-F249 PolarHBondContact O-N 3.35Å; F249-C252 HydrophobicContact CD1-CB 4.43Å; F249-C252 PolarHBondContact O-N 3.44Å; F249-L253 PolarHBondContact O-N 3.35Å; F249-F280 HydrophobicContact CB-CD2 4.06Å; F249-F280 HydrophobicContact CB-CE2 4.1Å; F249-F280 HydrophobicContact CD1-CB 4.24Å; F249-F280 AromaticContact CD1-CD2 3.58Å; F249-F280 HydrophobicContact CD1-CD2 3.58Å; F249-F280 HydrophobicContact CD1-CE2 4.44Å; F249-F280 HydrophobicContact CD1-CG 4.35Å; F249-F280 AromaticContact CD2-CD2 3.88Å; F249-F280 HydrophobicContact CD2-CD2 3.88Å; F249-F280 HydrophobicContact CD2-CE2 4.22Å; F249-F280 HydrophobicContact CE1-CB 3.82Å; F249-F280 AromaticContact CE1-CD2 3.98Å; F249-F280 HydrophobicContact CE1-CD2 3.98Å; F249-F280 HydrophobicContact CE1-CG 4.32Å; F249-F280 HydrophobicContact CE2-CD2 4.25Å; F249-F280 AromaticContact CG-CD2 3.55Å; F249-F280 HydrophobicContact CG-CD2 3.55Å; F249-F280 AromaticContact CG-CE2 4Å; F249-F280 HydrophobicContact CG-CE2 4Å; F249-F280 HydrophobicContact CZ-CB 4.1Å; F249-F280 HydrophobicContact CZ-CD2 4.32Å; F249-F280 HydrophobicContact CZ-CG 4.48Å; F249-Y283 AromaticContact CZ-CD2 3.99Å; F249-Y283 HydrophobicContact CZ-CD2 3.99Å; F249-Y283 HydrophobicContact CZ-CG 4.42Å; F249-M284 HydrophobicContact CD2-CG 3.94Å; F249-M284 HydrophobicContact CD2-SD 3.96Å; F249-M284 HydrophobicContact CE2-CG 3.81Å; F249-M284 HydrophobicContact CE2-SD 4.24Å
250M95.4Very high93.2Very high122 Ų12237 Ų3760%0.60119%0.187SC*.Hα-helixtrans-67.2-40.7168.9-74-63.3-6400111.3R246 I247 Y248 C252 L253R246-M250 VanDerWaalsContact O-CG 3.28Å; R246-M250 WeakPolarHBondContact O-CG 3.17Å; R246-M250 PolarHBondContact O-N 3.24Å; I247-M250 WeakPolarHBondContact O-CB 3.4Å; I247-M250 PolarHBondContact O-N 3.39Å; I247-M250 VanDerWaalsContact O-N 3.16Å; Y248-M250 PolarHBondContact O-N 3.15Å; M250-C252 VanDerWaalsContact C-N 3.34Å; M250-L253 HydrophobicContact CE-CD1 4.15Å; M250-L253 WeakPolarHBondContact O-CB 3.32Å; M250-L253 PolarHBondContact O-N 3.16Å; M250-L253 HydrophobicContact SD-CD1 3.76Å
251I95.4Very high91.7Very high34 Ų3437.2 Ų37.217%0.17419%0.189CC..Hα-helixtrans-65.3-41174-65.7166.8000110F69 L73 I77 I247 Y248 L253 I254 G255F69-I251 HydrophobicContact CB-CG2 3.69Å; F69-I251 HydrophobicContact CD1-CG2 3.59Å; F69-I251 HydrophobicContact CE1-CG2 4.47Å; F69-I251 HydrophobicContact CG-CG2 3.85Å; L73-I251 HydrophobicContact CD1-CB 4.23Å; L73-I251 HydrophobicContact CD1-CD1 4.16Å; L73-I251 HydrophobicContact CD1-CG2 3.68Å; L73-I251 HydrophobicContact CD2-CG2 3.99Å; L73-I251 HydrophobicContact CG-CG2 4.49Å; I77-I251 HydrophobicContact CD1-CD1 4.23Å; I247-I251 HydrophobicContact CG2-CD1 3.79Å; I247-I251 HydrophobicContact CG2-CG1 4.33Å; I247-I251 WeakPolarHBondContact O-CG1 3.36Å; I247-I251 PolarHBondContact O-N 3.09Å; Y248-I251 PolarHBondContact O-N 2.81Å; I251-L253 PolarHBondContact O-N 3.1Å; I251-I254 PolarHBondContact O-N 3.42Å; I251-G255 PolarHBondContact O-N 3.04Å
252C95.4Very high90.1Very high0 Ų038.3 Ų38.30%020%0.201CC..Hα-helixtrans-60.2-23.5175.4-70.80000114.1W39 L73 Y248 F249 M250 I254 R256 T276W39-C252 HydrophobicContact CZ2-CB 4.22Å; L73-C252 VanDerWaalsContact CD2-SG 3.59Å; Y248-C252 PolarHBondContact O-N 3.1Å; Y248-C252 PolarHBondContact O-SG 2.98Å; F249-C252 HydrophobicContact CD1-CB 4.43Å; F249-C252 PolarHBondContact O-N 3.44Å; M250-C252 VanDerWaalsContact C-N 3.34Å; C252-I254 PolarHBondContact O-N 3.19Å; C252-R256 HydrophobicContact CB-CG 4.07Å; C252-R256 WeakPolarHBondContact O-CB 3.28Å; C252-R256 PolarHBondContact O-N 3.44Å; C252-T276 HydrophobicContact CB-CG2 4.09Å
253L96.3Very high88.3Confident10 Ų1042 Ų425%0.05223%0.228CC..Hα-helixtrans-60.8-29174.4-73.2170.3000112.5W39 V42 F43 I46 F249 M250 I251 Q257W39-L253 HydrophobicContact CD2-CD2 4.06Å; W39-L253 HydrophobicContact CG-CD2 4.04Å; W39-L253 HydrophobicContact CZ2-CD2 4.19Å; V42-L253 HydrophobicContact CB-CD2 4.21Å; V42-L253 HydrophobicContact CG1-CD1 3.87Å; V42-L253 HydrophobicContact CG1-CD2 4.05Å; F43-L253 HydrophobicContact CB-CD2 3.95Å; F43-L253 HydrophobicContact CD2-CD2 4.49Å; I46-L253 HydrophobicContact CD1-CB 3.98Å; F249-L253 PolarHBondContact O-N 3.35Å; M250-L253 HydrophobicContact CE-CD1 4.15Å; M250-L253 WeakPolarHBondContact O-CB 3.32Å; M250-L253 PolarHBondContact O-N 3.16Å; M250-L253 HydrophobicContact SD-CD1 3.76Å; I251-L253 PolarHBondContact O-N 3.1Å; L253-Q257 VanDerWaalsContact O-CG 3.32Å; L253-Q257 WeakPolarHBondContact O-CG 3.41Å; L253-Q257 PolarHBondContact O-NE2 3.34Å
254I94.8Very high86.7Confident44 Ų4442.5 Ų42.523%0.22623%0.232CC..Hα-helixtrans-104-53.6178.6-56.2173.7000109.6F62 L65 I66 F69 I251 C252 R256 Q257F62-I254 HydrophobicContact CE2-CG2 4.08Å; F62-I254 HydrophobicContact CZ-CG2 4.38Å; L65-I254 HydrophobicContact CD2-CG2 3.99Å; L65-I254 HydrophobicContact CG-CG2 4.1Å; I66-I254 WeakPolarHBondContact CG1-O 3.3Å; F69-I254 HydrophobicContact CD2-CB 4Å; F69-I254 HydrophobicContact CD2-CD1 4.48Å; F69-I254 HydrophobicContact CD2-CG2 3.74Å; F69-I254 HydrophobicContact CE2-CB 4.41Å; F69-I254 HydrophobicContact CE2-CD1 4.03Å; F69-I254 HydrophobicContact CE2-CG2 4.17Å; I251-I254 PolarHBondContact O-N 3.42Å; C252-I254 PolarHBondContact O-N 3.19Å; I254-R256 PolarHBondContact O-N 3.18Å; I254-R256 VanDerWaalsContact O-N 3.14Å; I254-Q257 WeakPolarHBondContact O-CB 3.48Å; I254-Q257 WeakPolarHBondContact O-CG 3.41Å; I254-Q257 PolarHBondContact O-N 3.45Å
255G92.1Very high85.5Confident2 Ų245.6 Ų45.62%0.02125%0.25CC..Hα-helixtrans-62.2-24.5-173.800000114.8I66 D70 I251I66-G255 WeakPolarHBondContact CG2-O 3.15Å; D70-G255 WeakPolarHBondContact CB-O 3.47Å; I251-G255 PolarHBondContact O-N 3.04Å
256R92.6Very high84.2Confident42 Ų4247.4 Ų47.416%0.15826%0.263CS..THydrogen-bonded Turntrans-103.716.9-179.4-59.2-69.7178.783.30.7113.8F43 D70 D74 C252 I254 T276F43-R256 HydrophobicContact CE2-CB 4.43Å; F43-R256 WeakPolarHBondContact CE2-O 3.43Å; F43-R256 VanDerWaalsContact CZ-O 3.29Å; F43-R256 WeakPolarHBondContact CZ-O 3.4Å; D70-R256 WeakPolarHBondContact OD1-CD 3.38Å; D70-R256 IonicContact OD1-CZ 3.76Å; D70-R256 IonicContact OD1-NE 3.56Å; D70-R256 PolarHBondContact OD1-NE 3.22Å; D70-R256 IonicContact OD1-NH2 3.29Å; D74-R256 IonicContact OD1-NH2 3.27Å; D74-R256 PolarHBondContact OD1-NH2 3.33Å; D74-R256 IonicContact OD2-NH2 2.75Å; D74-R256 PolarHBondContact OD2-NH2 2.89Å; C252-R256 HydrophobicContact CB-CG 4.07Å; C252-R256 WeakPolarHBondContact O-CB 3.28Å; C252-R256 PolarHBondContact O-N 3.44Å; I254-R256 PolarHBondContact O-N 3.18Å; I254-R256 VanDerWaalsContact O-N 3.14Å; R256-T276 HydrophobicContact CB-CG2 4.48Å; R256-T276 HydrophobicContact CG-CG2 4.28Å; R256-T276 PolarHBondContact NH1-OG1 3.09Å
257Q93.1Very high83Confident6 Ų647.1 Ų47.13%0.02829%0.288CS..PPolyproline II helixtrans-70147.2172.7-69.7-70.6-17.700111.3F43 I46 F62 I66 L253 I254F43-Q257 HydrophobicContact CE2-CG 4.21Å; F43-Q257 HydrophobicContact CZ-CG 4.35Å; F43-Q257 PolarHBondContact O-NE2 3.19Å; I46-Q257 HydrophobicContact CG2-CG 4.11Å; F62-Q257 HydrophobicContact CE1-CB 4.34Å; F62-Q257 HydrophobicContact CE1-CG 4.38Å; F62-Q257 HydrophobicContact CZ-CG 4.19Å; I66-Q257 HydrophobicContact CD1-CB 3.71Å; I66-Q257 HydrophobicContact CG1-CB 4.13Å; L253-Q257 VanDerWaalsContact O-CG 3.32Å; L253-Q257 WeakPolarHBondContact O-CG 3.41Å; L253-Q257 PolarHBondContact O-NE2 3.34Å; I254-Q257 WeakPolarHBondContact O-CB 3.48Å; I254-Q257 WeakPolarHBondContact O-CG 3.41Å; I254-Q257 PolarHBondContact O-N 3.45Å
258F90.3Very high82.1Confident33 Ų3349.7 Ų49.715%0.14530%0.301CS..PPolyproline II helixtrans-84.6125.2178.8-64.6-88.2000110.7F43 Y50 I268 D269 L270 P273F43-F258 HydrophobicContact CZ-CD2 4.45Å; F43-F258 HydrophobicContact CZ-CE2 4.43Å; Y50-F258 WeakPolarHBondContact CE1-O 3.4Å; F258-I268 VanDerWaalsContact CD1-O 3.24Å; F258-I268 WeakPolarHBondContact CD1-O 3.34Å; F258-I268 WeakPolarHBondContact CE1-O 3.39Å; F258-D269 VanDerWaalsContact CB-OD1 3.27Å; F258-D269 WeakPolarHBondContact CB-OD1 3.35Å; F258-L270 WeakPolarHBondContact CD2-O 3.22Å; F258-L270 HydrophobicContact CE1-CB 4.31Å; F258-L270 HydrophobicContact CE2-CB 4.33Å; F258-L270 WeakPolarHBondContact CE2-O 3.17Å; F258-L270 HydrophobicContact CZ-CB 3.92Å; F258-L270 WeakPolarHBondContact CZ-O 3.39Å; F258-P273 HydrophobicContact CE2-CB 3.92Å; F258-P273 HydrophobicContact CZ-CB 4.3Å
259I85.3Confident81.3Confident11 Ų1152.4 Ų52.46%0.05632%0.316CS..PPolyproline II helixtrans-86.2120179.8-61.6176.9000108.8E63 I66 R67 S266E63-I259 HydrophobicContact CB-CD1 4.35Å; E63-I259 HydrophobicContact CG-CB 4.49Å; E63-I259 HydrophobicContact CG-CD1 4.35Å; E63-I259 HydrophobicContact CG-CG1 4.15Å; E63-I259 HydrophobicContact CG-CG2 3.76Å; E63-I259 WeakPolarHBondContact OE1-CG2 2.96Å; E63-I259 WeakPolarHBondContact OE2-CG2 2.96Å; I66-I259 HydrophobicContact CB-CD1 4.45Å; I66-I259 HydrophobicContact CD1-CD1 4.42Å; I66-I259 HydrophobicContact CD1-CG1 3.81Å; I66-I259 HydrophobicContact CG2-CD1 4.18Å; I66-I259 HydrophobicContact CG2-CG1 4.35Å; R67-I259 HydrophobicContact CG-CD1 4.37Å; I259-S266 PolarHBondContact N-OG 3.23Å; I259-S266 PolarHBondContact O-N 3.28Å
260V76Confident80.6Confident63 Ų6356 Ų5638%0.38234%0.335SS..  trans-100-36.9-175.6-179.80000111.8Y50 D269Y50-V260 HydrophobicContact CE1-CB 4.24Å; Y50-V260 HydrophobicContact CE1-CG2 4.06Å; Y50-V260 PolarHBondContact OH-N 3.4Å; V260-D269 WeakPolarHBondContact CG2-OD2 3.49Å
261T63.5Low80.1Confident83 Ų8355.3 Ų55.351%0.50933%0.325SS..SBendtrans-132.770-163.1-80000111.6Y50 E63Y50-T261 PolarHBondContact OH-N 3.31Å; E63-T261 VanDerWaalsContact OE1-O 3.08Å
262G60.8Low79.8Confident25 Ų2557.3 Ų57.326%0.25834%0.336SS..SBendtrans-152.7172.9177.900000113.8E63 N264E63-G262 WeakPolarHBondContact OE2-CA 3.25Å; G262-N264 PolarHBondContact O-N 2.91Å; G262-N264 VanDerWaalsContact O-N 3.1Å
263P58.3Low79.6Confident113 Ų11357.6 Ų57.673%0.73434%0.338SS*.SBendtrans-64-15.6-178.523.8-32.9000114.2
264N61Low79.4Confident115 Ų11562 Ų6262%0.61536%0.36SS*.SBendtrans-135.384.2172.6-72.1-38.4000108.4G262G262-N264 PolarHBondContact O-N 2.91Å; G262-N264 VanDerWaalsContact O-N 3.1Å
265P69.1Low79.2Confident82 Ų8264.8 Ų64.853%0.53238%0.38SS..  trans-66.4153178.628-33.2000110.8G267P265-G267 PolarHBondContact O-N 3.4Å
266S67.6Low79.3Confident40 Ų4065 Ų6528%0.2838%0.381SS..  trans-61.1127.3168.7-65.20000108.6I259 I268I259-S266 PolarHBondContact N-OG 3.23Å; I259-S266 PolarHBondContact O-N 3.28Å; S266-I268 VanDerWaalsContact C-N 3.25Å; S266-I268 PolarHBondContact O-N 3.35Å; S266-I268 VanDerWaalsContact O-N 3.15Å
267G70.1Confident79.4Confident84 Ų8465 Ų6587%0.86638%0.383SS*.SBendtrans-56.8-34.8-170.200000114.7P265P265-G267 PolarHBondContact O-N 3.4Å
268I75.6Confident79.5Confident127 Ų12768.6 Ų68.665%0.65141%0.405SS*.SBendtrans-130.7124.2171.9-56.3176.7000107.8F258 S266 L270F258-I268 VanDerWaalsContact CD1-O 3.24Å; F258-I268 WeakPolarHBondContact CD1-O 3.34Å; F258-I268 WeakPolarHBondContact CE1-O 3.39Å; S266-I268 VanDerWaalsContact C-N 3.25Å; S266-I268 PolarHBondContact O-N 3.35Å; S266-I268 VanDerWaalsContact O-N 3.15Å; I268-L270 HydrophobicContact CG2-CD2 4.01Å; I268-L270 HydrophobicContact CG2-CG 3.92Å; I268-L270 PolarHBondContact O-N 3.25Å
269D79Confident79.7Confident60 Ų6069.2 Ų69.232%0.32141%0.409SS..  trans-92.894.3176.4-176.617.3000110.7R51 F258 V260R51-D269 IonicContact CZ-OD1 2.63Å; R51-D269 IonicContact CZ-OD2 3.66Å; R51-D269 VanDerWaalsContact CZ-OD2 3.31Å; R51-D269 IonicContact NH1-OD1 2.69Å; R51-D269 IonicContact NH1-OD2 3.8Å; R51-D269 PolarHBondContact NH1-OD2 2.77Å; R51-D269 VanDerWaalsContact NH2-CG 3.26Å; R51-D269 IonicContact NH2-OD1 2.78Å; R51-D269 PolarHBondContact NH2-OD1 3.45Å; R51-D269 IonicContact NH2-OD2 2.66Å; R51-D269 PolarHBondContact NH2-OD2 3.47Å; R51-D269 VanDerWaalsContact NH2-OD2 3.08Å; F258-D269 VanDerWaalsContact CB-OD1 3.27Å; F258-D269 WeakPolarHBondContact CB-OD1 3.35Å; V260-D269 WeakPolarHBondContact CG2-OD2 3.49Å
270L81.8Confident80.2Confident80 Ų8069 Ų6942%0.41941%0.407SS..  trans-95.8127170.8-61.2174.1000107.8F258 I268 L272F258-L270 WeakPolarHBondContact CD2-O 3.22Å; F258-L270 HydrophobicContact CE1-CB 4.31Å; F258-L270 HydrophobicContact CE2-CB 4.33Å; F258-L270 WeakPolarHBondContact CE2-O 3.17Å; F258-L270 HydrophobicContact CZ-CB 3.92Å; F258-L270 WeakPolarHBondContact CZ-O 3.39Å; I268-L270 HydrophobicContact CG2-CD2 4.01Å; I268-L270 HydrophobicContact CG2-CG 3.92Å; I268-L270 PolarHBondContact O-N 3.25Å; L270-L272 WeakPolarHBondContact CB-O 3.4Å; L270-L272 PolarHBondContact O-N 3.34Å
271W83.6Confident81.1Confident107 Ų10767.8 Ų67.841%0.40540%0.398SS..SBendtrans-57.5-24.3173-79.879.9000113L44 R51 Y52L44-W271 VanDerWaalsContact CD2-O 3.22Å; L44-W271 WeakPolarHBondContact CD2-O 3.07Å; R51-W271 VanDerWaalsContact CD-CH2 3.48Å; Y52-W271 AromaticContact CE2-CH2 3.84Å; Y52-W271 HydrophobicContact CE2-CH2 3.84Å
272L89.6Confident82.6Confident76 Ų7668 Ų6840%0.39840%0.399SS..SBendtrans-114.1128178.9-70.5171.1000111.4T40 L44 L270 I274 M277T40-L272 HydrophobicContact CG2-CD2 3.73Å; L44-L272 HydrophobicContact CD1-CD2 4.1Å; L44-L272 HydrophobicContact CD2-CD2 3.92Å; L44-L272 HydrophobicContact CG-CD2 4.21Å; L270-L272 WeakPolarHBondContact CB-O 3.4Å; L270-L272 PolarHBondContact O-N 3.34Å; L272-I274 VanDerWaalsContact C-N 3.31Å; L272-I274 PolarHBondContact O-N 2.92Å; L272-M277 HydrophobicContact CD2-SD 4.48Å
273P91.7Very high84.2Confident6 Ų669 Ų694%0.03940%0.396CS..  trans-83.673.3179.836.4-36.7000110.3W39 F43 F258 T275 T276 M277W39-P273 HydrophobicContact CH2-CG 3.72Å; W39-P273 HydrophobicContact CZ3-CG 3.84Å; F43-P273 HydrophobicContact CD1-CG 3.82Å; F43-P273 HydrophobicContact CD2-CG 4.04Å; F43-P273 HydrophobicContact CE1-CB 4.18Å; F43-P273 VanDerWaalsContact CE1-CD 3.43Å; F43-P273 HydrophobicContact CE1-CG 3.57Å; F43-P273 HydrophobicContact CE2-CB 4.23Å; F43-P273 HydrophobicContact CE2-CG 3.78Å; F43-P273 HydrophobicContact CG-CG 4.07Å; F43-P273 HydrophobicContact CZ-CB 3.82Å; F43-P273 HydrophobicContact CZ-CG 3.53Å; F258-P273 HydrophobicContact CE2-CB 3.92Å; F258-P273 HydrophobicContact CZ-CB 4.3Å; P273-T275 VanDerWaalsContact C-N 3.3Å; P273-T275 PolarHBondContact O-N 2.93Å; P273-T276 PolarHBondContact O-N 3Å; P273-M277 HydrophobicContact CG-CG 4.44Å; P273-M277 WeakPolarHBondContact O-CG 3.38Å; P273-M277 PolarHBondContact O-N 3.32Å
274I92.1Very high86Confident102 Ų10263.8 Ų63.852%0.52336%0.362SS..Hα-helixtrans-52.3-45.9-172.6-61.2173.7000111.9L272 T276 M277 V278L272-I274 VanDerWaalsContact C-N 3.31Å; L272-I274 PolarHBondContact O-N 2.92Å; I274-T276 PolarHBondContact O-N 2.94Å; I274-M277 WeakPolarHBondContact O-CB 3.49Å; I274-M277 PolarHBondContact O-N 3.19Å; I274-V278 WeakPolarHBondContact O-CG2 3.29Å; I274-V278 PolarHBondContact O-N 2.68Å
275T91.2Very high87.6Confident104 Ų10458.7 Ų58.764%0.63834%0.336SS*.Hα-helixtrans-61.2-43.3179.1-51.60000112.4P273 M277 V278 Q279P273-T275 VanDerWaalsContact C-N 3.3Å; P273-T275 PolarHBondContact O-N 2.93Å; T275-M277 VanDerWaalsContact C-N 3.34Å; T275-V278 PolarHBondContact O-N 3.1Å; T275-Q279 WeakPolarHBondContact O-CG 3.28Å; T275-Q279 PolarHBondContact O-N 3.12Å
276T93.4Very high88.9Confident7 Ų758.8 Ų58.84%0.04333%0.326CS..Hα-helixtrans-68.8-34.6177.2-54.60000111.2W39 C252 R256 P273 I274 Q279 F280W39-T276 HydrophobicContact CH2-CG2 3.58Å; W39-T276 HydrophobicContact CZ2-CG2 3.75Å; C252-T276 HydrophobicContact CB-CG2 4.09Å; R256-T276 HydrophobicContact CB-CG2 4.48Å; R256-T276 HydrophobicContact CG-CG2 4.28Å; R256-T276 PolarHBondContact NH1-OG1 3.09Å; P273-T276 PolarHBondContact O-N 3Å; I274-T276 PolarHBondContact O-N 2.94Å; T276-Q279 PolarHBondContact O-N 3.32Å; T276-F280 WeakPolarHBondContact O-CB 3.39Å; T276-F280 PolarHBondContact O-N 3.2Å
277M95.3Very high90.2Very high41 Ų4156.9 Ų56.920%0.20231%0.312CS..Hα-helixtrans-64.6-39.5173.5-67.8176.767.100111.9L36 W39 L272 P273 I274 T275 F280 L281L36-M277 HydrophobicContact CD1-CB 4.23Å; L36-M277 HydrophobicContact CD1-CE 4.23Å; L36-M277 HydrophobicContact CD1-CG 4.22Å; L36-M277 HydrophobicContact CD2-CE 4.24Å; L36-M277 HydrophobicContact CG-CE 4.34Å; W39-M277 HydrophobicContact CZ3-CG 3.96Å; L272-M277 HydrophobicContact CD2-SD 4.48Å; P273-M277 HydrophobicContact CG-CG 4.44Å; P273-M277 WeakPolarHBondContact O-CG 3.38Å; P273-M277 PolarHBondContact O-N 3.32Å; I274-M277 WeakPolarHBondContact O-CB 3.49Å; I274-M277 PolarHBondContact O-N 3.19Å; T275-M277 VanDerWaalsContact C-N 3.34Å; M277-F280 WeakPolarHBondContact O-CB 3.47Å; M277-F280 PolarHBondContact O-N 3.08Å; M277-L281 WeakPolarHBondContact O-CG 3.34Å; M277-L281 PolarHBondContact O-N 3.41Å
278V94.8Very high91.4Very high81 Ų8154.6 Ų54.649%0.49128%0.279SS..Hα-helixtrans-64.7-44.4173173.90000110.7I274 T275 F280 L281 V282I274-V278 WeakPolarHBondContact O-CG2 3.29Å; I274-V278 PolarHBondContact O-N 2.68Å; T275-V278 PolarHBondContact O-N 3.1Å; V278-F280 VanDerWaalsContact C-N 3.28Å; V278-F280 PolarHBondContact O-N 3.45Å; V278-L281 PolarHBondContact O-N 2.88Å; V278-V282 WeakPolarHBondContact O-CG2 3.12Å; V278-V282 PolarHBondContact O-N 3.45Å
279Q94.2Very high92.2Very high47 Ų4751.9 Ų51.922%0.2227%0.268CS..Hα-helixtrans-58.5-41173.6-72.8179-25.200111.8T275 T276 V282 Y283T275-Q279 WeakPolarHBondContact O-CG 3.28Å; T275-Q279 PolarHBondContact O-N 3.12Å; T276-Q279 PolarHBondContact O-N 3.32Å; Q279-V282 PolarHBondContact O-N 2.88Å; Q279-Y283 HydrophobicContact CB-CD2 4.36Å; Q279-Y283 HydrophobicContact CB-CE2 4.48Å; Q279-Y283 VanDerWaalsContact O-CD2 3.28Å; Q279-Y283 WeakPolarHBondContact O-CD2 3.22Å; Q279-Y283 PolarHBondContact O-N 2.95Å
280F95.8Very high92.9Very high7 Ų749 Ų493%0.03125%0.253CS..Hα-helixtrans-58.6-52.1174.7-170.9-79.6000111.3V32 Q35 L36 W39 F249 T276 M277 V278 V282 Y283 M284V32-F280 HydrophobicContact CG1-CD1 3.87Å; V32-F280 HydrophobicContact CG1-CE1 3.65Å; Q35-F280 HydrophobicContact CB-CE1 4.27Å; Q35-F280 HydrophobicContact CB-CZ 4.07Å; L36-F280 HydrophobicContact CB-CD1 4.04Å; L36-F280 HydrophobicContact CB-CE1 3.86Å; L36-F280 HydrophobicContact CD1-CB 4.18Å; L36-F280 HydrophobicContact CD1-CD1 3.67Å; L36-F280 HydrophobicContact CD1-CE1 4.21Å; L36-F280 HydrophobicContact CD1-CG 3.98Å; L36-F280 HydrophobicContact CG-CD1 4.42Å; W39-F280 HydrophobicContact CB-CE2 3.92Å; W39-F280 HydrophobicContact CB-CZ 4.18Å; W39-F280 AromaticContact CD1-CE2 3.8Å; W39-F280 HydrophobicContact CD2-CD2 4.24Å; W39-F280 HydrophobicContact CD2-CE2 4.42Å; W39-F280 HydrophobicContact CG-CD2 4.05Å; W39-F280 AromaticContact CG-CE2 3.76Å; W39-F280 HydrophobicContact CG-CE2 3.76Å; W39-F280 HydrophobicContact CG-CZ 4.49Å; F249-F280 HydrophobicContact CB-CD2 4.06Å; F249-F280 HydrophobicContact CB-CE2 4.1Å; F249-F280 HydrophobicContact CD1-CB 4.24Å; F249-F280 AromaticContact CD1-CD2 3.58Å; F249-F280 HydrophobicContact CD1-CD2 3.58Å; F249-F280 HydrophobicContact CD1-CE2 4.44Å; F249-F280 HydrophobicContact CD1-CG 4.35Å; F249-F280 AromaticContact CD2-CD2 3.88Å; F249-F280 HydrophobicContact CD2-CD2 3.88Å; F249-F280 HydrophobicContact CD2-CE2 4.22Å; F249-F280 HydrophobicContact CE1-CB 3.82Å; F249-F280 AromaticContact CE1-CD2 3.98Å; F249-F280 HydrophobicContact CE1-CD2 3.98Å; F249-F280 HydrophobicContact CE1-CG 4.32Å; F249-F280 HydrophobicContact CE2-CD2 4.25Å; F249-F280 AromaticContact CG-CD2 3.55Å; F249-F280 HydrophobicContact CG-CD2 3.55Å; F249-F280 AromaticContact CG-CE2 4Å; F249-F280 HydrophobicContact CG-CE2 4Å; F249-F280 HydrophobicContact CZ-CB 4.1Å; F249-F280 HydrophobicContact CZ-CD2 4.32Å; F249-F280 HydrophobicContact CZ-CG 4.48Å; T276-F280 WeakPolarHBondContact O-CB 3.39Å; T276-F280 PolarHBondContact O-N 3.2Å; M277-F280 WeakPolarHBondContact O-CB 3.47Å; M277-F280 PolarHBondContact O-N 3.08Å; V278-F280 VanDerWaalsContact C-N 3.28Å; V278-F280 PolarHBondContact O-N 3.45Å; F280-V282 VanDerWaalsContact C-N 3.29Å; F280-V282 PolarHBondContact O-N 3.22Å; F280-Y283 PolarHBondContact O-N 3.43Å; F280-M284 HydrophobicContact CD1-CB 4.12Å; F280-M284 HydrophobicContact CD1-CG 3.76Å; F280-M284 HydrophobicContact CD2-CG 4Å; F280-M284 HydrophobicContact CE1-CB 4.02Å; F280-M284 HydrophobicContact CE1-CG 3.62Å; F280-M284 HydrophobicContact CE2-CG 3.84Å; F280-M284 HydrophobicContact CE2-SD 4.47Å; F280-M284 HydrophobicContact CG-CG 3.96Å; F280-M284 HydrophobicContact CZ-CB 4.49Å; F280-M284 HydrophobicContact CZ-CE 4.03Å; F280-M284 HydrophobicContact CZ-CG 3.66Å; F280-M284 HydrophobicContact CZ-SD 4.38Å; F280-M284 WeakPolarHBondContact O-CB 3.27Å; F280-M284 WeakPolarHBondContact O-CG 3.5Å; F280-M284 PolarHBondContact O-N 2.86Å
281L95.5Very high93.5Very high36 Ų3648.5 Ų48.519%0.18825%0.248CC..Hα-helixtrans-55.9-43.8177.7-74.9171000112.1W29 V32 L36 M277 V278 G285W29-L281 HydrophobicContact CE3-CD2 4.4Å; W29-L281 HydrophobicContact CH2-CD1 4.39Å; W29-L281 HydrophobicContact CZ3-CD1 3.93Å; W29-L281 HydrophobicContact CZ3-CD2 4.05Å; V32-L281 HydrophobicContact CB-CD2 4.42Å; V32-L281 HydrophobicContact CG1-CD2 4.01Å; L36-L281 HydrophobicContact CD2-CD1 4.33Å; L36-L281 HydrophobicContact CD2-CD2 3.8Å; L36-L281 HydrophobicContact CD2-CG 3.99Å; M277-L281 WeakPolarHBondContact O-CG 3.34Å; M277-L281 PolarHBondContact O-N 3.41Å; V278-L281 PolarHBondContact O-N 2.88Å; L281-G285 VanDerWaalsContact O-CA 3.29Å; L281-G285 WeakPolarHBondContact O-CA 3.46Å; L281-G285 PolarHBondContact O-N 3.48Å
282V94.3Very high93.8Very high87 Ų8745.1 Ų45.153%0.52724%0.242SC..Hα-helixtrans-67.4-55.9-179.7173.70000111.5V278 Q279 F280 W286V278-V282 WeakPolarHBondContact O-CG2 3.12Å; V278-V282 PolarHBondContact O-N 3.45Å; Q279-V282 PolarHBondContact O-N 2.88Å; F280-V282 VanDerWaalsContact C-N 3.29Å; F280-V282 PolarHBondContact O-N 3.22Å; V282-W286 WeakPolarHBondContact O-CB 3.22Å; V282-W286 PolarHBondContact O-N 3.26Å
283Y95.4Very high93.9Very high47 Ų4742.8 Ų42.818%0.18423%0.23CC..Hα-helixtrans-74-40.3-174-70.5-62.1000113.1L79 T80 L83 F249 Q279 F280 W286 M287L79-Y283 HydrophobicContact CB-CD1 4.08Å; L79-Y283 HydrophobicContact CB-CE1 3.95Å; L79-Y283 HydrophobicContact CD1-CD1 4.41Å; L79-Y283 HydrophobicContact CD1-CD2 4.31Å; L79-Y283 HydrophobicContact CD1-CG 4.18Å; T80-Y283 PolarHBondContact OG1-OH 3.38Å; T80-Y283 VanDerWaalsContact OG1-OH 3.08Å; L83-Y283 HydrophobicContact CD1-CD1 3.77Å; F249-Y283 AromaticContact CZ-CD2 3.99Å; F249-Y283 HydrophobicContact CZ-CD2 3.99Å; F249-Y283 HydrophobicContact CZ-CG 4.42Å; Q279-Y283 HydrophobicContact CB-CD2 4.36Å; Q279-Y283 HydrophobicContact CB-CE2 4.48Å; Q279-Y283 VanDerWaalsContact O-CD2 3.28Å; Q279-Y283 WeakPolarHBondContact O-CD2 3.22Å; Q279-Y283 PolarHBondContact O-N 2.95Å; F280-Y283 PolarHBondContact O-N 3.43Å; Y283-W286 HydrophobicContact CD1-CE3 4.46Å; Y283-W286 PolarHBondContact O-N 3.41Å; Y283-M287 WeakPolarHBondContact O-CB 2.96Å; Y283-M287 PolarHBondContact O-N 3.49Å
284M95.7Very high94Very high4 Ų444.7 Ų44.72%0.0224%0.24CC..Hα-helixtrans-69.7-38.4175-65.9-69.7-6900111.2V32 V245 F249 F280 M287 K288V32-M284 HydrophobicContact CG1-CB 3.92Å; V32-M284 HydrophobicContact CG2-CB 4.38Å; V245-M284 HydrophobicContact CG1-CG 4.42Å; V245-M284 HydrophobicContact CG1-SD 3.49Å; V245-M284 WeakPolarHBondContact CG1-SD 3.27Å; F249-M284 HydrophobicContact CD2-CG 3.94Å; F249-M284 HydrophobicContact CD2-SD 3.96Å; F249-M284 HydrophobicContact CE2-CG 3.81Å; F249-M284 HydrophobicContact CE2-SD 4.24Å; F280-M284 HydrophobicContact CD1-CB 4.12Å; F280-M284 HydrophobicContact CD1-CG 3.76Å; F280-M284 HydrophobicContact CD2-CG 4Å; F280-M284 HydrophobicContact CE1-CB 4.02Å; F280-M284 HydrophobicContact CE1-CG 3.62Å; F280-M284 HydrophobicContact CE2-CG 3.84Å; F280-M284 HydrophobicContact CE2-SD 4.47Å; F280-M284 HydrophobicContact CG-CG 3.96Å; F280-M284 HydrophobicContact CZ-CB 4.49Å; F280-M284 HydrophobicContact CZ-CE 4.03Å; F280-M284 HydrophobicContact CZ-CG 3.66Å; F280-M284 HydrophobicContact CZ-SD 4.38Å; F280-M284 WeakPolarHBondContact O-CB 3.27Å; F280-M284 WeakPolarHBondContact O-CG 3.5Å; F280-M284 PolarHBondContact O-N 2.86Å; M284-M287 HydrophobicContact CE-CE 3.6Å; M284-M287 PolarHBondContact O-N 3.32Å; M284-M287 HydrophobicContact SD-CE 3.71Å; M284-K288 WeakPolarHBondContact O-CB 3.43Å; M284-K288 VanDerWaalsContact O-CG 3.27Å; M284-K288 WeakPolarHBondContact O-CG 3.29Å; M284-K288 PolarHBondContact O-N 3.16Å
285G95Very high94Very high7 Ų743.7 Ų43.77%0.07224%0.236CC..Hα-helixtrans-61-45.517300000111.7L281 M287 K288 V289L281-G285 VanDerWaalsContact O-CA 3.29Å; L281-G285 WeakPolarHBondContact O-CA 3.46Å; L281-G285 PolarHBondContact O-N 3.48Å; G285-M287 PolarHBondContact O-N 3.18Å; G285-K288 WeakPolarHBondContact O-CB 3.46Å; G285-K288 PolarHBondContact O-N 3.38Å; G285-K288 VanDerWaalsContact O-N 3.13Å; G285-V289 WeakPolarHBondContact O-CG2 3.38Å; G285-V289 PolarHBondContact O-N 3.25Å
286W95.1Very high94Very high84 Ų8438.8 Ų38.832%0.31821%0.206SC..Hα-helixtrans-65.6-39.6178.4-163.619.2000112.7T80 L83 G84 V87 V282 Y283 K288 V289 A290T80-W286 HydrophobicContact CG2-CH2 4.34Å; T80-W286 HydrophobicContact CG2-CZ3 4.14Å; T80-W286 WeakPolarHBondContact O-CH2 3.31Å; L83-W286 HydrophobicContact CB-CD2 3.94Å; L83-W286 HydrophobicContact CB-CE3 3.57Å; L83-W286 HydrophobicContact CB-CH2 4.21Å; L83-W286 HydrophobicContact CB-CZ3 3.72Å; L83-W286 HydrophobicContact CD1-CE3 3.89Å; L83-W286 HydrophobicContact CG-CE3 4.36Å; G84-W286 VanDerWaalsContact CA-CH2 3.5Å; G84-W286 VanDerWaalsContact CA-CZ2 3.46Å; V87-W286 HydrophobicContact CG2-CG 4.25Å; V282-W286 WeakPolarHBondContact O-CB 3.22Å; V282-W286 PolarHBondContact O-N 3.26Å; Y283-W286 HydrophobicContact CD1-CE3 4.46Å; Y283-W286 PolarHBondContact O-N 3.41Å; W286-K288 VanDerWaalsContact C-N 3.33Å; W286-V289 WeakPolarHBondContact O-CB 3.44Å; W286-V289 PolarHBondContact O-N 3.16Å; W286-A290 PolarHBondContact O-N 3.47Å
287M95.5Very high94Very high0 Ų038.9 Ų38.90%021%0.206CC..Hα-helixtrans-60.7-42.2170.2-177-17267.900111.7L83 F242 V245 R246 Y283 M284 G285 V289 A290 E291L83-M287 HydrophobicContact CD2-CB 3.92Å; L83-M287 HydrophobicContact CD2-CG 4.44Å; F242-M287 HydrophobicContact CB-SD 4.36Å; F242-M287 HydrophobicContact CD1-CG 3.51Å; F242-M287 HydrophobicContact CD1-SD 3.68Å; F242-M287 HydrophobicContact CE1-CG 3.69Å; F242-M287 HydrophobicContact CE1-SD 4.39Å; F242-M287 HydrophobicContact CG-SD 4.31Å; V245-M287 HydrophobicContact CB-SD 3.9Å; V245-M287 HydrophobicContact CG1-SD 4.05Å; V245-M287 HydrophobicContact CG2-SD 4.22Å; R246-M287 PolarHBondContact NH1-SD 3.18Å; Y283-M287 WeakPolarHBondContact O-CB 2.96Å; Y283-M287 PolarHBondContact O-N 3.49Å; M284-M287 HydrophobicContact CE-CE 3.6Å; M284-M287 PolarHBondContact O-N 3.32Å; M284-M287 HydrophobicContact SD-CE 3.71Å; G285-M287 PolarHBondContact O-N 3.18Å; M287-V289 VanDerWaalsContact C-N 3.31Å; M287-V289 PolarHBondContact O-N 3.48Å; M287-A290 PolarHBondContact O-N 2.87Å; M287-A290 VanDerWaalsContact O-N 3.15Å; M287-E291 PolarHBondContact O-N 2.94Å
288K94.3Very high93.7Very high37 Ų3737.5 Ų37.516%0.16120%0.202CC..Hα-helixtrans-64.8-32.3178.4-79.7-71.5178.3-1670113.2A31 V32 M284 G285 W286 A290 E291 A292A31-K288 HydrophobicContact CB-CB 4.13Å; A31-K288 HydrophobicContact CB-CD 4.32Å; A31-K288 HydrophobicContact CB-CG 4.13Å; V32-K288 HydrophobicContact CG2-CG 4.22Å; M284-K288 WeakPolarHBondContact O-CB 3.43Å; M284-K288 VanDerWaalsContact O-CG 3.27Å; M284-K288 WeakPolarHBondContact O-CG 3.29Å; M284-K288 PolarHBondContact O-N 3.16Å; G285-K288 WeakPolarHBondContact O-CB 3.46Å; G285-K288 PolarHBondContact O-N 3.38Å; G285-K288 VanDerWaalsContact O-N 3.13Å; W286-K288 VanDerWaalsContact C-N 3.33Å; K288-A290 VanDerWaalsContact C-N 3.34Å; K288-E291 HydrophobicContact CD-CB 4.5Å; K288-E291 WeakPolarHBondContact CD-OE2 3.25Å; K288-E291 VanDerWaalsContact CE-OE2 3.3Å; K288-E291 WeakPolarHBondContact CE-OE2 3.46Å; K288-E291 IonicContact NZ-OE1 2.98Å; K288-E291 PolarHBondContact NZ-OE1 2.85Å; K288-E291 IonicContact NZ-OE2 3.77Å; K288-E291 PolarHBondContact NZ-OE2 3.48Å; K288-E291 PolarHBondContact O-N 2.93Å; K288-A292 WeakPolarHBondContact O-CB 3.36Å; K288-A292 PolarHBondContact O-N 3.23Å
289V93.6Very high93.4Very high70 Ų7038.5 Ų38.542%0.42420%0.202SC..Hα-helixtrans-58.5-47.1170.6171.90000110.6V87 G285 W286 M287 L293V87-V289 HydrophobicContact CG1-CG1 4.35Å; G285-V289 WeakPolarHBondContact O-CG2 3.38Å; G285-V289 PolarHBondContact O-N 3.25Å; W286-V289 WeakPolarHBondContact O-CB 3.44Å; W286-V289 PolarHBondContact O-N 3.16Å; M287-V289 VanDerWaalsContact C-N 3.31Å; M287-V289 PolarHBondContact O-N 3.48Å; V289-L293 HydrophobicContact CG1-CD1 3.98Å; V289-L293 WeakPolarHBondContact O-CB 3.45Å; V289-L293 VanDerWaalsContact O-CG 3.25Å; V289-L293 WeakPolarHBondContact O-CG 3.36Å; V289-L293 PolarHBondContact O-N 3.36Å
290A93.9Very high93.1Very high0 Ų041 Ų410%022%0.216CC..Hα-helixtrans-66-40.4175.600000112.1F86 V87 V90 W286 M287 K288 A292 L293 L294F86-A290 HydrophobicContact CD1-CB 3.77Å; F86-A290 HydrophobicContact CE1-CB 3.51Å; V87-A290 HydrophobicContact CG2-CB 3.85Å; V90-A290 HydrophobicContact CB-CB 4.46Å; V90-A290 HydrophobicContact CG2-CB 4.36Å; W286-A290 PolarHBondContact O-N 3.47Å; M287-A290 PolarHBondContact O-N 2.87Å; M287-A290 VanDerWaalsContact O-N 3.15Å; K288-A290 VanDerWaalsContact C-N 3.34Å; A290-A292 PolarHBondContact O-N 3.41Å; A290-L293 PolarHBondContact O-N 3.1Å; A290-L294 WeakPolarHBondContact O-CG 3.38Å; A290-L294 PolarHBondContact O-N 2.83Å
291E92.8Very high92.6Very high69 Ų6943.5 Ų43.532%0.32223%0.23SC..Hα-helixtrans-58.4-47.3178.9-164.8179.3147.200112.2F242 M287 K288 L293 L294F242-E291 HydrophobicContact CZ-CB 4.16Å; F242-E291 HydrophobicContact CZ-CG 4.26Å; M287-E291 PolarHBondContact O-N 2.94Å; K288-E291 HydrophobicContact CD-CB 4.5Å; K288-E291 WeakPolarHBondContact CD-OE2 3.25Å; K288-E291 VanDerWaalsContact CE-OE2 3.3Å; K288-E291 WeakPolarHBondContact CE-OE2 3.46Å; K288-E291 IonicContact NZ-OE1 2.98Å; K288-E291 PolarHBondContact NZ-OE1 2.85Å; K288-E291 IonicContact NZ-OE2 3.77Å; K288-E291 PolarHBondContact NZ-OE2 3.48Å; K288-E291 PolarHBondContact O-N 2.93Å; E291-L293 VanDerWaalsContact C-N 3.34Å; E291-L293 PolarHBondContact O-N 3.29Å; E291-L294 PolarHBondContact O-N 3.08Å
292A91Very high92.2Very high35 Ų3543 Ų4329%0.28923%0.228SC..Hα-helixtrans-65.6-34.8177.500000112.6K288 A290K288-A292 WeakPolarHBondContact O-CB 3.36Å; K288-A292 PolarHBondContact O-N 3.23Å; A290-A292 PolarHBondContact O-N 3.41Å
293L92.4Very high92.1Very high28 Ų2839.2 Ų39.215%0.14720%0.204CC..Hα-helixtrans-86.2-6.9-177.8-64178.2000114.1V90 V91 W94 V289 A290 E291 N295V90-L293 HydrophobicContact CG1-CB 3.64Å; V91-L293 HydrophobicContact CG2-CD1 3.75Å; W94-L293 HydrophobicContact CB-CB 4.46Å; W94-L293 HydrophobicContact CD2-CD2 4.35Å; W94-L293 HydrophobicContact CG-CD2 4Å; V289-L293 HydrophobicContact CG1-CD1 3.98Å; V289-L293 WeakPolarHBondContact O-CB 3.45Å; V289-L293 VanDerWaalsContact O-CG 3.25Å; V289-L293 WeakPolarHBondContact O-CG 3.36Å; V289-L293 PolarHBondContact O-N 3.36Å; A290-L293 PolarHBondContact O-N 3.1Å; E291-L293 VanDerWaalsContact C-N 3.34Å; E291-L293 PolarHBondContact O-N 3.29Å; L293-N295 VanDerWaalsContact C-N 3.32Å; L293-N295 PolarHBondContact O-N 3.23Å
294L92Very high91.9Very high45 Ų4537.5 Ų37.524%0.23620%0.198CC..SBendtrans-63.6-37.8179.1-89.5170.5000112.1F86 V90 V233 P238 F242 A290 E291F86-L294 HydrophobicContact CZ-CD1 4.46Å; F86-L294 HydrophobicContact CZ-CD2 4.37Å; V90-L294 HydrophobicContact CG1-CG 4.46Å; V90-L294 HydrophobicContact CG2-CD2 4Å; V90-L294 HydrophobicContact CG2-CG 4.46Å; V233-L294 HydrophobicContact CB-CD2 4.25Å; V233-L294 HydrophobicContact CG2-CD2 3.74Å; P238-L294 HydrophobicContact CB-CD1 4.5Å; F242-L294 HydrophobicContact CE2-CD1 4.08Å; F242-L294 HydrophobicContact CZ-CD1 3.72Å; A290-L294 WeakPolarHBondContact O-CG 3.38Å; A290-L294 PolarHBondContact O-N 2.83Å; E291-L294 PolarHBondContact O-N 3.08Å
295N92.3Very high91.8Very high81 Ų8141.6 Ų41.643%0.43322%0.217SC..  trans-13486.5175.5-176.910.6000111.1L293 L297 G298L293-N295 VanDerWaalsContact C-N 3.32Å; L293-N295 PolarHBondContact O-N 3.23Å; N295-L297 PolarHBondContact O-N 3.42Å; N295-L297 VanDerWaalsContact O-N 3.09Å; N295-L297 PolarHBondContact OD1-N 3.1Å; N295-G298 PolarHBondContact O-N 2.95Å
296P92.8Very high91.9Very high2 Ų241.3 Ų41.31%0.01321%0.214CC..THydrogen-bonded Turntrans-75.45.2-177.333.7-37.7000114.5I97 D303 L304I97-P296 HydrophobicContact CB-CG 4.35Å; I97-P296 HydrophobicContact CD1-CG 3.83Å; I97-P296 HydrophobicContact CG2-CG 3.93Å; P296-D303 WeakPolarHBondContact CA-OD1 3.34Å; P296-L304 HydrophobicContact CB-CD1 4.17Å; P296-L304 HydrophobicContact CB-CG 4.32Å; P296-L304 HydrophobicContact CG-CD1 4.41Å; P296-L304 WeakPolarHBondContact O-CB 3.48Å; P296-L304 WeakPolarHBondContact O-CG 3.38Å; P296-L304 PolarHBondContact O-N 2.86Å
297L91.6Very high91.9Very high9 Ų939 Ų395%0.04721%0.208CC..THydrogen-bonded Turntrans-105.19.6179-58.5173.9000111.9I144 S145 N295 L304I144-L297 HydrophobicContact CB-CD1 4.31Å; I144-L297 HydrophobicContact CD1-CD1 3.61Å; I144-L297 HydrophobicContact CG1-CD1 3.82Å; S145-L297 WeakPolarHBondContact CA-O 3.33Å; S145-L297 WeakPolarHBondContact CB-O 3.26Å; S145-L297 PolarHBondContact OG-O 3.45Å; N295-L297 PolarHBondContact O-N 3.42Å; N295-L297 VanDerWaalsContact O-N 3.09Å; N295-L297 PolarHBondContact OD1-N 3.1Å; L297-L304 HydrophobicContact CD2-CD1 3.81Å
298G89.3Confident91.9Very high12 Ų1245.9 Ų45.912%0.12424%0.235CC..SBendtrans-76.3-142.4178.600000113.3Q147 N295 D303Q147-G298 VanDerWaalsContact CG-O 3.26Å; Q147-G298 WeakPolarHBondContact CG-O 3.36Å; Q147-G298 PolarHBondContact NE2-O 3.16Å; N295-G298 PolarHBondContact O-N 2.95Å; G298-D303 WeakPolarHBondContact CA-OD2 3.36Å; G298-D303 PolarHBondContact N-OD2 2.72Å
299E89.2Confident92Very high102 Ų10244.6 Ų44.648%0.47723%0.23SC..SBendtrans-13217.1-178.3-54-170.7134.100112.8M146 Q147 K150 D303M146-E299 HydrophobicContact CB-CG 4.18Å; Q147-E299 HydrophobicContact CG-CG 3.9Å; K150-E299 WeakPolarHBondContact CD-OE1 3.2Å; K150-E299 WeakPolarHBondContact CE-OE1 3.49Å; K150-E299 IonicContact NZ-OE1 2.74Å; K150-E299 PolarHBondContact NZ-OE1 3.13Å; K150-E299 IonicContact NZ-OE2 3.17Å; K150-E299 PolarHBondContact NZ-OE2 3.23Å; E299-D303 PolarHBondContact N-OD2 3.04Å
300D88.3Confident92.2Very high98 Ų9841.3 Ų41.352%0.52421%0.21SC..SBendtrans-68.2156.9174.6-74-24.7000110.6D302 D303D300-D302 PolarHBondContact O-N 3.34Å; D300-D303 PolarHBondContact N-OD2 2.88Å; D300-D303 WeakPolarHBondContact O-CB 3.37Å; D300-D303 PolarHBondContact O-N 3.48Å
301D85.3Confident92.4Very high61 Ų6144.1 Ų44.133%0.32623%0.225SC..THydrogen-bonded Turntrans-54.8-23.5-176.7-67-4.1000113.7T2 I3 G26 K30T2-D301 PolarHBondContact OG1-O 2.91Å; I3-D301 HydrophobicContact CD1-CB 4.04Å; G26-D301 PolarHBondContact N-OD2 3.5Å; G26-D301 VanDerWaalsContact N-OD2 3.1Å; K30-D301 WeakPolarHBondContact CD-OD2 3.33Å; K30-D301 IonicContact NZ-OD1 3.68Å; K30-D301 PolarHBondContact NZ-OD1 3.3Å; K30-D301 IonicContact NZ-OD2 3.27Å; K30-D301 PolarHBondContact NZ-OD2 3.38Å
302D86.5Confident92.6Very high26 Ų2642.4 Ų42.414%0.13922%0.217CC..THydrogen-bonded Turntrans-111.44.4-175.4-91.5-48.7000114.1M1 T2 I3 G26 D300M1-D302 WeakPolarHBondContact CA-O 3.39Å; M1-D302 VanDerWaalsContact CA-OD1 3.29Å; M1-D302 WeakPolarHBondContact CA-OD1 3.31Å; M1-D302 HydrophobicContact CB-CB 4.37Å; M1-D302 WeakPolarHBondContact CB-OD1 3.36Å; M1-D302 HydrophobicContact CG-CB 3.96Å; M1-D302 PolarHBondContact N-O 2.86Å; T2-D302 PolarHBondContact N-OD1 3.45Å; I3-D302 PolarHBondContact N-OD1 3.45Å; G26-D302 WeakPolarHBondContact CA-OD2 3.39Å; D300-D302 PolarHBondContact O-N 3.34Å
303D92Very high92.9Very high6 Ų640.7 Ų40.73%0.03220%0.203CC..SBendtrans-67.6162.4174.9-76.2-19.3000111.5T2 P296 G298 E299 D300T2-D303 WeakPolarHBondContact CG2-O 3.46Å; T2-D303 PolarHBondContact OG1-O 3.34Å; P296-D303 WeakPolarHBondContact CA-OD1 3.34Å; G298-D303 WeakPolarHBondContact CA-OD2 3.36Å; G298-D303 PolarHBondContact N-OD2 2.72Å; E299-D303 PolarHBondContact N-OD2 3.04Å; D300-D303 PolarHBondContact N-OD2 2.88Å; D300-D303 WeakPolarHBondContact O-CB 3.37Å; D300-D303 PolarHBondContact O-N 3.48Å
304L92Very high93.2Very high11 Ų1140.8 Ų40.86%0.05820%0.203CC..  trans-69.4132.9-175.7-63.3165.9000111.2I97 L98 I101 Q147 P296 L297 C306I97-L304 HydrophobicContact CG2-CD1 4.35Å; L98-L304 HydrophobicContact CD1-CD2 3.77Å; I101-L304 HydrophobicContact CD1-CD1 3.72Å; I101-L304 HydrophobicContact CD1-CD2 4.11Å; I101-L304 HydrophobicContact CD1-CG 4.39Å; Q147-L304 PolarHBondContact NE2-O 3.21Å; P296-L304 HydrophobicContact CB-CD1 4.17Å; P296-L304 HydrophobicContact CB-CG 4.32Å; P296-L304 HydrophobicContact CG-CD1 4.41Å; P296-L304 WeakPolarHBondContact O-CB 3.48Å; P296-L304 WeakPolarHBondContact O-CG 3.38Å; P296-L304 PolarHBondContact O-N 2.86Å; L297-L304 HydrophobicContact CD2-CD1 3.81Å; L304-C306 PolarHBondContact O-N 3.23Å; L304-C306 PolarHBondContact O-SG 2.77Å
305E93.8Very high93.4Very high90 Ų9043.9 Ų43.942%0.42122%0.219SC..  trans-7271.2174.5-61.9-51.2151.300111.5T2 N307 Y308 I309T2-E305 HydrophobicContact CG2-CB 4.35Å; T2-E305 HydrophobicContact CG2-CG 3.6Å; T2-E305 PolarHBondContact OG1-OE1 2.91Å; E305-N307 VanDerWaalsContact C-N 3.3Å; E305-N307 PolarHBondContact O-N 2.83Å; E305-Y308 WeakPolarHBondContact O-CB 3.31Å; E305-Y308 PolarHBondContact O-N 3.39Å; E305-I309 WeakPolarHBondContact O-CG1 3.22Å; E305-I309 PolarHBondContact O-N 3.04Å; E305-I309 VanDerWaalsContact O-N 3.09Å
306C95.3Very high93.6Very high2 Ų242.1 Ų42.11%0.01421%0.211CC..Hα-helixtrans-62.6-36.9-175.1-66.60000112.4L141 V148 L304 I309 I310L141-C306 HydrophobicContact CD1-CB 4.3Å; V148-C306 HydrophobicContact CG2-CB 3.47Å; V148-C306 VanDerWaalsContact CG2-CB 3.47Å; L304-C306 PolarHBondContact O-N 3.23Å; L304-C306 PolarHBondContact O-SG 2.77Å; C306-I309 PolarHBondContact O-N 2.94Å; C306-I310 WeakPolarHBondContact O-CG1 3.34Å; C306-I310 PolarHBondContact O-N 3.27Å
307N96.2Very high93.7Very high36 Ų3642 Ų4219%0.19321%0.21CC..Hα-helixtrans-63.5-42.8176.1-76.3-44000112.2Q147 R151 E305 I309 I310 D311Q147-N307 PolarHBondContact O-ND2 2.86Å; R151-N307 WeakPolarHBondContact CD-OD1 3.47Å; R151-N307 PolarHBondContact NH1-O 3.42Å; E305-N307 VanDerWaalsContact C-N 3.3Å; E305-N307 PolarHBondContact O-N 2.83Å; N307-I309 VanDerWaalsContact C-N 3.34Å; N307-I309 PolarHBondContact O-N 3.49Å; N307-I310 PolarHBondContact O-N 3.48Å; N307-D311 PolarHBondContact O-N 2.99Å; N307-D311 VanDerWaalsContact O-N 3.14Å
308Y95.8Very high93.9Very high143 Ų14343.4 Ų43.456%0.56122%0.215SC*.Hα-helixtrans-61.4-42.3174.9167-100.7000111.6E305 I310 D311 K312E305-Y308 WeakPolarHBondContact O-CB 3.31Å; E305-Y308 PolarHBondContact O-N 3.39Å; Y308-I310 VanDerWaalsContact C-N 3.34Å; Y308-I310 PolarHBondContact O-N 3.31Å; Y308-D311 PolarHBondContact O-N 2.7Å; Y308-K312 HydrophobicContact CE1-CB 4.34Å; Y308-K312 HydrophobicContact CE2-CB 4.36Å; Y308-K312 VanDerWaalsContact O-CB 3.25Å; Y308-K312 WeakPolarHBondContact O-CB 3.35Å; Y308-K312 PolarHBondContact O-N 3.03Å
309I96.6Very high94Very high10 Ų1045.6 Ų45.65%0.05123%0.229CC..Hα-helixtrans-61.1-43.7-179.8-68.3157.8000110.9I101 W103 E305 C306 N307 N313I101-I309 HydrophobicContact CD1-CD1 3.98Å; I101-I309 HydrophobicContact CG2-CD1 3.84Å; I101-I309 HydrophobicContact CG2-CG2 3.9Å; W103-I309 HydrophobicContact CH2-CG1 4.45Å; E305-I309 WeakPolarHBondContact O-CG1 3.22Å; E305-I309 PolarHBondContact O-N 3.04Å; E305-I309 VanDerWaalsContact O-N 3.09Å; C306-I309 PolarHBondContact O-N 2.94Å; N307-I309 VanDerWaalsContact C-N 3.34Å; N307-I309 PolarHBondContact O-N 3.49Å; I309-N313 WeakPolarHBondContact O-CB 3.44Å; I309-N313 VanDerWaalsContact O-CG 3.23Å; I309-N313 PolarHBondContact O-N 3.29Å; I309-N313 PolarHBondContact O-ND2 2.94Å
310I97.4Very high94.2Very high1 Ų143.3 Ų43.31%0.00522%0.219CC..Hα-helixtrans-59.9-48.4176.4-66167.8000110.4V134 Q137 A138 L141 V148 F152 L163 C306 N307 Y308 N313 L314V134-I310 HydrophobicContact CG1-CG2 4.04Å; Q137-I310 HydrophobicContact CG-CG1 4.47Å; A138-I310 HydrophobicContact CB-CD1 4.2Å; L141-I310 HydrophobicContact CB-CD1 4.49Å; L141-I310 HydrophobicContact CD1-CD1 4.01Å; L141-I310 HydrophobicContact CD1-CG1 3.92Å; V148-I310 HydrophobicContact CG1-CD1 3.79Å; V148-I310 HydrophobicContact CG2-CD1 4.11Å; F152-I310 HydrophobicContact CE2-CD1 4.27Å; L163-I310 HydrophobicContact CD1-CG2 4.2Å; C306-I310 WeakPolarHBondContact O-CG1 3.34Å; C306-I310 PolarHBondContact O-N 3.27Å; N307-I310 PolarHBondContact O-N 3.48Å; Y308-I310 VanDerWaalsContact C-N 3.34Å; Y308-I310 PolarHBondContact O-N 3.31Å; I310-N313 PolarHBondContact O-N 3.47Å; I310-L314 PolarHBondContact O-N 3Å
311D97.7Very high94.4Very high59 Ų5938.8 Ų38.832%0.31620%0.195SC..Hα-helixtrans-65.9-46.1-177.7-66.5-16000111.9R151 N307 Y308 N313 L314 I315R151-D311 IonicContact CZ-OD1 2.85Å; R151-D311 IonicContact CZ-OD2 3.45Å; R151-D311 VanDerWaalsContact NH1-CG 3.35Å; R151-D311 IonicContact NH1-OD1 2.98Å; R151-D311 PolarHBondContact NH1-OD1 3.21Å; R151-D311 IonicContact NH1-OD2 2.64Å; R151-D311 PolarHBondContact NH1-OD2 3.47Å; R151-D311 IonicContact NH2-OD1 3.78Å; R151-D311 PolarHBondContact NH2-OD1 3.38Å; R151-D311 IonicContact NH2-OD2 3.91Å; N307-D311 PolarHBondContact O-N 2.99Å; N307-D311 VanDerWaalsContact O-N 3.14Å; Y308-D311 PolarHBondContact O-N 2.7Å; D311-N313 VanDerWaalsContact C-N 3.34Å; D311-N313 PolarHBondContact O-N 2.97Å; D311-L314 PolarHBondContact O-N 3.44Å; D311-I315 WeakPolarHBondContact O-CB 3.4Å; D311-I315 VanDerWaalsContact O-CG1 3.3Å; D311-I315 WeakPolarHBondContact O-CG1 3.33Å; D311-I315 PolarHBondContact O-N 2.82Å
312K97.1Very high94.4Very high33 Ų3336.7 Ų36.714%0.14318%0.183CC..Hα-helixtrans-56.9-50.4174.9-179.3-87.9177.1168.40110.1W103 D105 Y308 L314 I315 T316W103-K312 HydrophobicContact CE3-CD 4.13Å; W103-K312 HydrophobicContact CZ3-CD 3.92Å; D105-K312 IonicContact OD1-NZ 3.93Å; D105-K312 PolarHBondContact OD1-NZ 3.31Å; D105-K312 IonicContact OD2-NZ 3.67Å; D105-K312 PolarHBondContact OD2-NZ 2.86Å; Y308-K312 HydrophobicContact CE1-CB 4.34Å; Y308-K312 HydrophobicContact CE2-CB 4.36Å; Y308-K312 VanDerWaalsContact O-CB 3.25Å; Y308-K312 WeakPolarHBondContact O-CB 3.35Å; Y308-K312 PolarHBondContact O-N 3.03Å; K312-L314 VanDerWaalsContact C-N 3.3Å; K312-L314 PolarHBondContact O-N 2.81Å; K312-I315 PolarHBondContact O-N 3.24Å; K312-T316 WeakPolarHBondContact O-CB 3.28Å; K312-T316 PolarHBondContact O-N 3.05Å; K312-T316 PolarHBondContact O-OG1 2.97Å; K312-T316 VanDerWaalsContact O-OG1 3.09Å
313N98.1Very high93.5Very high0 Ų039.8 Ų39.80%020%0.196CC..Hα-helixtrans-63.7-37.7-176.8-78.9-17.7000111.6G102 I104 V134 Q137 I309 I310 D311 G317G102-N313 PolarHBondContact O-ND2 3.48Å; I104-N313 HydrophobicContact CB-CB 3.85Å; I104-N313 HydrophobicContact CG2-CB 3.97Å; I104-N313 WeakPolarHBondContact CG2-O 3.41Å; I104-N313 PolarHBondContact N-OD1 3.37Å; V134-N313 HydrophobicContact CG2-CB 3.93Å; Q137-N313 PolarHBondContact NE2-ND2 2.83Å; Q137-N313 PolarHBondContact OE1-ND2 2.79Å; I309-N313 WeakPolarHBondContact O-CB 3.44Å; I309-N313 VanDerWaalsContact O-CG 3.23Å; I309-N313 PolarHBondContact O-N 3.29Å; I309-N313 PolarHBondContact O-ND2 2.94Å; I310-N313 PolarHBondContact O-N 3.47Å; D311-N313 VanDerWaalsContact C-N 3.34Å; D311-N313 PolarHBondContact O-N 2.97Å; N313-G317 WeakPolarHBondContact O-CA 3.38Å; N313-G317 PolarHBondContact O-N 3.09Å
314L97.4Very high92.2Very high30 Ų3045.2 Ų45.216%0.15722%0.221CC..Hα-helixtrans-66.4-51.9175.7-167.865000112V134 L163 I310 D311 K312 Y318V134-L314 HydrophobicContact CB-CD1 4.42Å; V134-L314 HydrophobicContact CG1-CB 4.27Å; V134-L314 HydrophobicContact CG1-CD1 4.37Å; L163-L314 HydrophobicContact CD2-CD1 4.14Å; L163-L314 HydrophobicContact CD2-CD2 3.88Å; I310-L314 PolarHBondContact O-N 3Å; D311-L314 PolarHBondContact O-N 3.44Å; K312-L314 VanDerWaalsContact C-N 3.3Å; K312-L314 PolarHBondContact O-N 2.81Å; L314-Y318 HydrophobicContact CD1-CD2 4.46Å; L314-Y318 HydrophobicContact CD1-CE1 4.1Å; L314-Y318 HydrophobicContact CD1-CE2 3.78Å; L314-Y318 HydrophobicContact CD2-CE2 4.5Å; L314-Y318 HydrophobicContact CG-CD2 4.3Å; L314-Y318 HydrophobicContact CG-CE2 3.88Å; L314-Y318 WeakPolarHBondContact O-CB 3.47Å; L314-Y318 VanDerWaalsContact O-CG 3.3Å; L314-Y318 PolarHBondContact O-N 3.35Å
315I96.4Very high90.7Very high110 Ų11050.4 Ų50.456%0.56425%0.247SC*.Hα-helixtrans-69.6-48.1-173.6-64.5167.9000111.3D311 K312 S319D311-I315 WeakPolarHBondContact O-CB 3.4Å; D311-I315 VanDerWaalsContact O-CG1 3.3Å; D311-I315 WeakPolarHBondContact O-CG1 3.33Å; D311-I315 PolarHBondContact O-N 2.82Å; K312-I315 PolarHBondContact O-N 3.24Å; I315-S319 WeakPolarHBondContact O-CB 3.41Å; I315-S319 PolarHBondContact O-N 3.04Å; I315-S319 PolarHBondContact O-OG 3.07Å
316T95.9Very high89.4Confident43 Ų4349.6 Ų49.626%0.26426%0.256SS..Hα-helixtrans-65-45.8178-60.10000110.5K312 Y318 S319 M320K312-T316 WeakPolarHBondContact O-CB 3.28Å; K312-T316 PolarHBondContact O-N 3.05Å; K312-T316 PolarHBondContact O-OG1 2.97Å; K312-T316 VanDerWaalsContact O-OG1 3.09Å; T316-Y318 VanDerWaalsContact C-N 3.34Å; T316-Y318 PolarHBondContact O-N 3.29Å; T316-S319 PolarHBondContact O-N 3.1Å; T316-S319 VanDerWaalsContact O-N 3.15Å; T316-M320 HydrophobicContact CG2-CG 4.3Å; T316-M320 HydrophobicContact CG2-SD 3.87Å; T316-M320 VanDerWaalsContact O-CG 3.29Å; T316-M320 WeakPolarHBondContact O-CG 3.43Å; T316-M320 PolarHBondContact O-N 3.47Å
317G95.7Very high88.4Confident0 Ų057.6 Ų57.60%029%0.29CS..Hα-helixtrans-59.1-45.2179.200000111.9S108 N313 M320 V321S108-G317 WeakPolarHBondContact OG-CA 3.48Å; N313-G317 WeakPolarHBondContact O-CA 3.38Å; N313-G317 PolarHBondContact O-N 3.09Å; G317-M320 PolarHBondContact O-N 3.24Å; G317-V321 WeakPolarHBondContact O-CG2 3.42Å; G317-V321 PolarHBondContact O-N 3.28Å
318Y95.2Very high87.8Confident39 Ų3961.5 Ų61.515%0.15332%0.315CS..Hα-helixtrans-58.4-51.2172.5-75-13000112.2R127 V130 R131 L314 T316 M320 V321 E322R127-Y318 HydrophobicContact CB-CD1 4.39Å; R127-Y318 HydrophobicContact CB-CE1 4.11Å; R127-Y318 HydrophobicContact CG-CD1 4.37Å; R127-Y318 VanDerWaalsContact NH2-CD2 3.33Å; R127-Y318 WeakPolarHBondContact O-CE1 3.43Å; V130-Y318 HydrophobicContact CB-CD1 4.18Å; V130-Y318 HydrophobicContact CB-CE1 4.23Å; V130-Y318 HydrophobicContact CG1-CD1 3.91Å; V130-Y318 HydrophobicContact CG1-CE1 4.09Å; R131-Y318 HydrophobicContact CB-CE1 4.37Å; R131-Y318 WeakPolarHBondContact CD-OH 3.46Å; L314-Y318 HydrophobicContact CD1-CD2 4.46Å; L314-Y318 HydrophobicContact CD1-CE1 4.1Å; L314-Y318 HydrophobicContact CD1-CE2 3.78Å; L314-Y318 HydrophobicContact CD2-CE2 4.5Å; L314-Y318 HydrophobicContact CG-CD2 4.3Å; L314-Y318 HydrophobicContact CG-CE2 3.88Å; L314-Y318 WeakPolarHBondContact O-CB 3.47Å; L314-Y318 VanDerWaalsContact O-CG 3.3Å; L314-Y318 PolarHBondContact O-N 3.35Å; T316-Y318 VanDerWaalsContact C-N 3.34Å; T316-Y318 PolarHBondContact O-N 3.29Å; Y318-M320 PolarHBondContact O-N 3.26Å; Y318-V321 WeakPolarHBondContact O-CG2 3.27Å; Y318-V321 PolarHBondContact O-N 3.11Å; Y318-V321 VanDerWaalsContact O-N 3.1Å; Y318-E322 WeakPolarHBondContact O-CG 3.41Å; Y318-E322 PolarHBondContact O-N 2.83Å
319S93.1Very high87.5Confident58 Ų5859.7 Ų59.741%0.40632%0.321SS..Hα-helixtrans-56.4-37.2-179.1-56.90000112.4I315 T316 M325I315-S319 WeakPolarHBondContact O-CB 3.41Å; I315-S319 PolarHBondContact O-N 3.04Å; I315-S319 PolarHBondContact O-OG 3.07Å; T316-S319 PolarHBondContact O-N 3.1Å; T316-S319 VanDerWaalsContact O-N 3.15Å; S319-M325 WeakPolarHBondContact O-CG 3.48Å
320M92.6Very high87.3Confident54 Ų5463 Ų6327%0.26635%0.35SS..Hα-helixtrans-70.6-33.3179.7-69.7175.476.700113.6D105 L109 A112 T316 G317 Y318D105-M320 HydrophobicContact CB-CE 4.49Å; D105-M320 HydrophobicContact CB-SD 4.4Å; D105-M320 VanDerWaalsContact O-CE 3.26Å; D105-M320 WeakPolarHBondContact O-CE 3.44Å; L109-M320 HydrophobicContact CB-CE 3.91Å; L109-M320 HydrophobicContact CD1-CE 4.43Å; A112-M320 VanDerWaalsContact CB-O 3.31Å; A112-M320 WeakPolarHBondContact CB-O 3.43Å; T316-M320 HydrophobicContact CG2-CG 4.3Å; T316-M320 HydrophobicContact CG2-SD 3.87Å; T316-M320 VanDerWaalsContact O-CG 3.29Å; T316-M320 WeakPolarHBondContact O-CG 3.43Å; T316-M320 PolarHBondContact O-N 3.47Å; G317-M320 PolarHBondContact O-N 3.24Å; Y318-M320 PolarHBondContact O-N 3.26Å
321V92.8Very high87Confident3 Ų370.9 Ų70.92%0.01839%0.387CS..Hα-helixtrans-93.3-3.1-176.5-57.80000114.3F111 A112 R126 R127 V130 G317 Y318F111-V321 HydrophobicContact CB-CG1 3.98Å; A112-V321 HydrophobicContact CB-CG1 4.41Å; R126-V321 HydrophobicContact CB-CB 3.88Å; R126-V321 HydrophobicContact CB-CG1 4.4Å; R126-V321 HydrophobicContact CB-CG2 4.13Å; R126-V321 PolarHBondContact NE-O 3.23Å; R127-V321 HydrophobicContact CG-CG2 4.31Å; V130-V321 HydrophobicContact CG2-CG1 3.81Å; V130-V321 HydrophobicContact CG2-CG2 4.15Å; G317-V321 WeakPolarHBondContact O-CG2 3.42Å; G317-V321 PolarHBondContact O-N 3.28Å; Y318-V321 WeakPolarHBondContact O-CG2 3.27Å; Y318-V321 PolarHBondContact O-N 3.11Å; Y318-V321 VanDerWaalsContact O-N 3.1Å
322E85.4Confident86.8Confident17 Ų1776.7 Ų76.78%0.07941%0.409CS..SBendtrans-71145.2174.8-74.3-56.7148.200112.5R123 R127 Y318 H324 M325R123-E322 IonicContact CZ-OE2 3.43Å; R123-E322 IonicContact NE-OE1 3.56Å; R123-E322 IonicContact NE-OE2 2.83Å; R123-E322 PolarHBondContact NE-OE2 2.85Å; R123-E322 IonicContact NH2-OE1 2.8Å; R123-E322 IonicContact NH2-OE2 3.23Å; R123-E322 PolarHBondContact NH2-OE2 3.08Å; R127-E322 WeakPolarHBondContact CD-OE1 3.17Å; R127-E322 IonicContact CZ-OE1 2.65Å; R127-E322 IonicContact NE-OE1 2.98Å; R127-E322 IonicContact NH1-OE1 3.29Å; R127-E322 PolarHBondContact NH1-OE1 3.26Å; Y318-E322 WeakPolarHBondContact O-CG 3.41Å; Y318-E322 PolarHBondContact O-N 2.83Å; E322-H324 WeakPolarHBondContact CB-CE1 3.47Å; E322-H324 WeakPolarHBondContact CB-ND1 3.24Å; E322-H324 PolarHBondContact O-N 3.14Å; E322-M325 PolarHBondContact O-N 3.01Å
323E67.1Low86.5Confident90 Ų9082.4 Ų82.442%0.42143%0.434SS..G310 helixtrans-67.3-33.7-170.8-170.4-174.1169.300114.1A118 M325 A326A118-E323 VanDerWaalsContact CB-OE1 3.26Å; A118-E323 WeakPolarHBondContact CB-OE1 3.44Å; E323-M325 PolarHBondContact O-N 3.46Å; E323-M325 VanDerWaalsContact O-N 3.14Å; E323-A326 WeakPolarHBondContact O-CB 3.41Å; E323-A326 PolarHBondContact O-N 3.14Å
324H64.2Low86.1Confident120 Ų12086.6 Ų86.656%0.55646%0.456SS*.G310 helixtrans-63.1-22.7179.665.1-80.8000112.7E322E322-H324 WeakPolarHBondContact CB-CE1 3.47Å; E322-H324 WeakPolarHBondContact CB-ND1 3.24Å; E322-H324 PolarHBondContact O-N 3.14Å
325M60.9Low85.6Confident120 Ų12091.1 Ų91.159%0.59148%0.477SS*.G310 helixtrans-86.7-13.4177.4-62.1-63-78.300113S319 E322 E323 K327S319-M325 WeakPolarHBondContact O-CG 3.48Å; E322-M325 PolarHBondContact O-N 3.01Å; E323-M325 PolarHBondContact O-N 3.46Å; E323-M325 VanDerWaalsContact O-N 3.14Å; M325-K327 PolarHBondContact O-N 3.09Å
326A65.9Low85.3Confident74 Ų7490 Ų9061%0.61247%0.468SS*.G310 helixtrans-75.5-7.6173.100000112.9E323 T328E323-A326 WeakPolarHBondContact O-CB 3.41Å; E323-A326 PolarHBondContact O-N 3.14Å; A326-T328 PolarHBondContact O-N 3.36Å
327K75.1Confident85Confident170 Ų17095.6 Ų95.674%0.73949%0.485SS*.  trans-74.7108.1176.9-69.2-176.9-179.71780110.1M325M325-K327 PolarHBondContact O-N 3.09Å
328T83.9Confident84.7Confident117 Ų11798.4 Ų98.472%0.71851%0.513SS*.PPolyproline II helixtrans-74.5141.1168.953.50000110A326A326-T328 PolarHBondContact O-N 3.36Å
329P89.5Confident84.4Confident106 Ų106100.6 Ų100.669%0.68853%0.527SS*.PPolyproline II helixtrans-57.2151.6169.9-24.134000111.4Q331P329-Q331 PolarHBondContact O-N 3.18Å; P329-Q331 PolarHBondContact O-NE2 3.26Å
330A90.9Very high84.1Confident80 Ų80105.9 Ų105.966%0.66155%0.55SS**PPolyproline II helixtrans-58.4128174.400000110.3K332A330-K332 PolarHBondContact O-N 3.3Å
331Q92.9Very high83.8Confident166 Ų166112.3 Ų112.378%0.77658%0.577SS**PPolyproline II helixtrans-70.5125.8-178-57.4-57.4-61.300109.9P329P329-Q331 PolarHBondContact O-N 3.18Å; P329-Q331 PolarHBondContact O-NE2 3.26Å
332K92.2Very high83.6Confident180 Ų180117 Ų11778%0.78360%0.601SS**  trans-135.8156.4-178-66.1178.1-175.7177.90109.4A330 D334A330-K332 PolarHBondContact O-N 3.3Å; K332-D334 PolarHBondContact O-N 3.24Å
333K92.3Very high83.6Confident154 Ų154119.9 Ų119.967%0.6763%0.627SS**  trans-59.4130.9166.7-68.2176.3175179.90108.5W337K333-W337 HydrophobicContact CB-CB 3.91Å; K333-W337 HydrophobicContact CB-CD2 4.25Å; K333-W337 HydrophobicContact CB-CG 3.86Å; K333-W337 HydrophobicContact CD-CD2 4.2Å; K333-W337 HydrophobicContact CD-CG 3.87Å; K333-W337 HydrophobicContact CG-CB 4.4Å; K333-W337 HydrophobicContact CG-CD2 3.85Å; K333-W337 HydrophobicContact CG-CE3 4.4Å; K333-W337 HydrophobicContact CG-CG 3.8Å
334D89Confident84.7Confident87 Ų87119.3 Ų119.347%0.46563%0.631SS.*  trans-75.5171.3174.764.396.1000111.2K332 F336 W337K332-D334 PolarHBondContact O-N 3.24Å; D334-F336 PolarHBondContact O-N 2.92Å; D334-F336 VanDerWaalsContact OD1-CA 3.28Å; D334-F336 WeakPolarHBondContact OD1-CA 3.5Å; D334-F336 VanDerWaalsContact OD1-CB 3.23Å; D334-F336 WeakPolarHBondContact OD1-CB 3.44Å; D334-F336 PolarHBondContact OD1-N 3.46Å; D334-W337 VanDerWaalsContact O-CB 3.31Å; D334-W337 WeakPolarHBondContact O-CB 3.31Å; D334-W337 PolarHBondContact O-N 3.39Å; D334-W337 PolarHBondContact OD1-N 3.32Å
335E86.6Confident85.7Confident126 Ų126121.3 Ų121.359%0.58965%0.645SS**THydrogen-bonded Turntrans-67.5-15.9-178.1-63.2-176.2171.700113.5I339E335-I339 WeakPolarHBondContact O-CD1 3.32Å
336F91.1Very high86.9Confident85 Ų85123.3 Ų123.337%0.37365%0.647SS.*THydrogen-bonded Turntrans-98.30.1178.4-48-67.2000112.9D334 G338 I339 I342D334-F336 PolarHBondContact O-N 2.92Å; D334-F336 VanDerWaalsContact OD1-CA 3.28Å; D334-F336 WeakPolarHBondContact OD1-CA 3.5Å; D334-F336 VanDerWaalsContact OD1-CB 3.23Å; D334-F336 WeakPolarHBondContact OD1-CB 3.44Å; D334-F336 PolarHBondContact OD1-N 3.46Å; F336-G338 PolarHBondContact O-N 3.31Å; F336-G338 VanDerWaalsContact O-N 3.15Å; F336-I339 PolarHBondContact O-N 2.81Å; F336-I342 HydrophobicContact CB-CD1 4.06Å; F336-I342 HydrophobicContact CB-CG1 4.16Å; F336-I342 HydrophobicContact CD1-CG2 3.72Å; F336-I342 HydrophobicContact CE1-CG2 3.95Å; F336-I342 HydrophobicContact CG-CG1 4.5Å; F336-I342 HydrophobicContact CG-CG2 4.05Å; F336-I342 HydrophobicContact CZ-CG2 4.48Å
337W89.1Confident87.9Confident162 Ų162122.9 Ų122.961%0.61464%0.64SS**THydrogen-bonded Turntrans-59.8117.8-178.7-174.5-82.7000111.6K333 D334K333-W337 HydrophobicContact CB-CB 3.91Å; K333-W337 HydrophobicContact CB-CD2 4.25Å; K333-W337 HydrophobicContact CB-CG 3.86Å; K333-W337 HydrophobicContact CD-CD2 4.2Å; K333-W337 HydrophobicContact CD-CG 3.87Å; K333-W337 HydrophobicContact CG-CB 4.4Å; K333-W337 HydrophobicContact CG-CD2 3.85Å; K333-W337 HydrophobicContact CG-CE3 4.4Å; K333-W337 HydrophobicContact CG-CG 3.8Å; D334-W337 VanDerWaalsContact O-CB 3.31Å; D334-W337 WeakPolarHBondContact O-CB 3.31Å; D334-W337 PolarHBondContact O-N 3.39Å; D334-W337 PolarHBondContact OD1-N 3.32Å
338G88.3Confident88.3Confident58 Ų58119.9 Ų119.960%0.59863%0.63SS**THydrogen-bonded Turntrans81.811.3-179.600000115.1F336F336-G338 PolarHBondContact O-N 3.31Å; F336-G338 VanDerWaalsContact O-N 3.15Å
339I90.6Very high88.2Confident86 Ų86122 Ų12244%0.44163%0.632SS.*  trans-102116.3176.7-55.4-176.4000110.3E335 F336 K341E335-I339 WeakPolarHBondContact O-CD1 3.32Å; F336-I339 PolarHBondContact O-N 2.81Å; I339-K341 VanDerWaalsContact C-N 3.33Å; I339-K341 WeakPolarHBondContact CG2-O 3.46Å; I339-K341 PolarHBondContact O-N 3.02Å
340D86.3Confident88.1Confident169 Ų169120.1 Ų120.190%0.90462%0.621SS**SBendtrans-69-28.5179.1-68.9-24.2000113.8
341K86.3Confident87.9Confident188 Ų188118.3 Ų118.382%0.81761%0.606SS**SBendtrans-118.893.1-177.3-69-177.9-176.5172.60110.7I339I339-K341 VanDerWaalsContact C-N 3.33Å; I339-K341 WeakPolarHBondContact CG2-O 3.46Å; I339-K341 PolarHBondContact O-N 3.02Å
342I88.7Confident87.4Confident103 Ų103115 Ų11553%0.52859%0.59SS.*  trans-77.6126.8178.4-57.9178.7000109.7F336 P344F336-I342 HydrophobicContact CB-CD1 4.06Å; F336-I342 HydrophobicContact CB-CG1 4.16Å; F336-I342 HydrophobicContact CD1-CG2 3.72Å; F336-I342 HydrophobicContact CE1-CG2 3.95Å; F336-I342 HydrophobicContact CG-CG1 4.5Å; F336-I342 HydrophobicContact CG-CG2 4.05Å; F336-I342 HydrophobicContact CZ-CG2 4.48Å; I342-P344 HydrophobicContact CG2-CG 4.25Å
343A85.3Confident87Confident76 Ų76116.3 Ų116.363%0.62859%0.59SS**  trans-128.189.9176.300000109.9
344P89.1Confident86.4Confident78 Ų78113 Ų11351%0.50659%0.587SS.*  trans-61.2141.3177.2-21.634.5000111.2I342 Y346I342-P344 HydrophobicContact CG2-CG 4.25Å; P344-Y346 WeakPolarHBondContact O-CD2 3.44Å
345L86.9Confident86Confident162 Ų162114.3 Ų114.385%0.84860%0.598SS**  trans-79.4143.9-178.5-60.3178.8000111.3
346Y85.7Confident85.7Confident162 Ų162116.2 Ų116.264%0.63561%0.606SS**  trans-121.7152.3172.4-69.8-98.1000108.7P344P344-Y346 WeakPolarHBondContact O-CD2 3.44Å
347S87.1Confident85.3Confident66 Ų66116.3 Ų116.346%0.46262%0.615SS.*  trans-61.2153.816571.70000109.5E349 S350 A351S347-E349 PolarHBondContact O-N 3.06Å; S347-S350 PolarHBondContact O-N 3.45Å; S347-S350 VanDerWaalsContact O-N 3.08Å; S347-S350 WeakPolarHBondContact OG-CB 3.32Å; S347-S350 PolarHBondContact OG-N 2.87Å; S347-S350 PolarHBondContact OG-OG 2.84Å; S347-S350 VanDerWaalsContact OG-OG 3.12Å; S347-A351 WeakPolarHBondContact O-CB 3.19Å; S347-A351 PolarHBondContact O-N 3.35Å
348M81.7Confident85.2Confident106 Ų106117.5 Ų117.552%0.52263%0.633SS.*Hα-helixtrans-53.9-42.7179.7-73.9-61.2-63.700111.8A351 E352 R427M348-A351 PolarHBondContact O-N 3.26Å; M348-E352 WeakPolarHBondContact O-CG 3.46Å; M348-E352 PolarHBondContact O-N 2.96Å; M348-R427 HydrophobicContact CE-CG 3.8Å
349E83.4Confident85.1Confident163 Ų163118 Ų11876%0.76262%0.624SS**Hα-helixtrans-64.2-43.3177.6-173.8178.6-173.300112.7S347 A351 E352S347-E349 PolarHBondContact O-N 3.06Å; E349-A351 VanDerWaalsContact C-N 3.35Å; E349-E352 PolarHBondContact O-N 3.31Å
350S87.1Confident84.9Confident66 Ų66116.5 Ų116.546%0.46263%0.63SS.*Hα-helixtrans-71.7-30.3178.8-65.90000112.7S347 E352 R353S347-S350 PolarHBondContact O-N 3.45Å; S347-S350 VanDerWaalsContact O-N 3.08Å; S347-S350 WeakPolarHBondContact OG-CB 3.32Å; S347-S350 PolarHBondContact OG-N 2.87Å; S347-S350 PolarHBondContact OG-OG 2.84Å; S347-S350 VanDerWaalsContact OG-OG 3.12Å; S350-E352 VanDerWaalsContact C-N 3.26Å; S350-E352 PolarHBondContact O-N 3.46Å; S350-R353 WeakPolarHBondContact O-CB 3.36Å; S350-R353 PolarHBondContact O-N 2.97Å
351A86.4Confident85Confident41 Ų41114.3 Ų114.334%0.33963%0.628SS.*Hα-helixtrans-69.3-22.8178.600000113.2S347 M348 E349 R353 L423S347-A351 WeakPolarHBondContact O-CB 3.19Å; S347-A351 PolarHBondContact O-N 3.35Å; M348-A351 PolarHBondContact O-N 3.26Å; E349-A351 VanDerWaalsContact C-N 3.35Å; A351-R353 PolarHBondContact O-N 3.05Å; A351-L423 HydrophobicContact CB-CD1 4.19Å
352E83.4Confident85Confident97 Ų97108.4 Ų108.445%0.45361%0.614SS.*THydrogen-bonded Turntrans-72.8-21.8176.1-35.5-158.8169.500112.3M348 E349 S350 S354 L423 R427M348-E352 WeakPolarHBondContact O-CG 3.46Å; M348-E352 PolarHBondContact O-N 2.96Å; E349-E352 PolarHBondContact O-N 3.31Å; S350-E352 VanDerWaalsContact C-N 3.26Å; S350-E352 PolarHBondContact O-N 3.46Å; E352-S354 PolarHBondContact O-N 3.26Å; E352-L423 HydrophobicContact CB-CD2 4.33Å; E352-L423 HydrophobicContact CG-CD2 4.26Å; E352-R427 IonicContact OE1-CZ 3.73Å; E352-R427 IonicContact OE1-NE 2.67Å; E352-R427 IonicContact OE1-NH1 2.75Å; E352-R427 PolarHBondContact OE1-NH1 3.3Å; E352-R427 VanDerWaalsContact OE1-NH1 3.08Å; E352-R427 IonicContact OE1-NH2 3.19Å; E352-R427 PolarHBondContact OE1-NH2 3.38Å; E352-R427 IonicContact OE2-CZ 2.74Å; E352-R427 IonicContact OE2-NH1 3.92Å; E352-R427 PolarHBondContact OE2-NH1 2.97Å; E352-R427 IonicContact OE2-NH2 3.78Å; E352-R427 PolarHBondContact OE2-NH2 3.09Å
353R82.6Confident84.7Confident207 Ų207107 Ų10778%0.78161%0.614SS**SBendtrans-69.3124.8-176-168.6173.1-179168.10.7109.9S350 A351 V355S350-R353 WeakPolarHBondContact O-CB 3.36Å; S350-R353 PolarHBondContact O-N 2.97Å; A351-R353 PolarHBondContact O-N 3.05Å; R353-V355 PolarHBondContact O-N 2.96Å
354S80.8Confident84.6Confident85 Ų85108.9 Ų108.959%0.59461%0.607SS**PPolyproline II helixtrans-61.5126.6175.458.80000110.8E352E352-S354 PolarHBondContact O-N 3.26Å
355V80Confident84.4Confident115 Ų115110 Ų11070%0.69761%0.608SS**PPolyproline II helixtrans-97.7134174-179.80000109.3R353 P357R353-V355 PolarHBondContact O-N 2.96Å; V355-P357 VanDerWaalsContact O-CD 3.27Å; V355-P357 WeakPolarHBondContact O-CD 3.29Å
356H80.8Confident84.4Confident165 Ų165103.6 Ų103.676%0.76458%0.575SS**  trans-107.291172.5-60.8-63.2000108.9
357P82.8Confident84.4Confident87 Ų87103.2 Ų103.257%0.56558%0.583SS**  trans-66.5146-177.628.6-35.2000110.4V355 V359V355-P357 VanDerWaalsContact O-CD 3.27Å; V355-P357 WeakPolarHBondContact O-CD 3.29Å; P357-V359 VanDerWaalsContact C-N 3.26Å; P357-V359 HydrophobicContact CB-CG2 4.04Å; P357-V359 HydrophobicContact CG-CG2 3.98Å; P357-V359 PolarHBondContact O-N 3.23Å
358L85.5Confident84.3Confident188 Ų188101 Ų10198%0.98457%0.567SS**  trans-69.385.6175.3-175.368000109.8
359V85.8Confident84.2Confident69 Ų69103.4 Ų103.442%0.41857%0.574SS.*  trans-118.6127.2179.4174.30000107.4P357 S361 S363P357-V359 VanDerWaalsContact C-N 3.26Å; P357-V359 HydrophobicContact CB-CG2 4.04Å; P357-V359 HydrophobicContact CG-CG2 3.98Å; P357-V359 PolarHBondContact O-N 3.23Å; V359-S361 PolarHBondContact O-N 3.27Å; V359-S363 WeakPolarHBondContact CG1-OG 3.44Å
360G87.4Confident84.2Confident54 Ų54103 Ų10356%0.55758%0.577SS**  trans-53.1137.2-178.700000112A362 S363G360-A362 PolarHBondContact O-N 3.33Å; G360-A362 VanDerWaalsContact O-N 3.1Å; G360-S363 VanDerWaalsContact O-CB 3.31Å; G360-S363 WeakPolarHBondContact O-CB 3.5Å; G360-S363 PolarHBondContact O-N 2.98Å; G360-S363 PolarHBondContact O-OG 2.53Å
361S87.6Confident84.1Confident123 Ų123106 Ų10686%0.8658%0.582SS**THydrogen-bonded Turntrans-56.4-31.7-171.256.20000113.8V359V359-S361 PolarHBondContact O-N 3.27Å
362A86.5Confident83.9Confident64 Ų64112.1 Ų112.153%0.52960%0.601SS.*THydrogen-bonded Turntrans-90.2-10.7179.700000114.5G360 K364 I365G360-A362 PolarHBondContact O-N 3.33Å; G360-A362 VanDerWaalsContact O-N 3.1Å; A362-K364 VanDerWaalsContact C-N 3.26Å; A362-K364 PolarHBondContact O-N 2.94Å; A362-K364 VanDerWaalsContact O-N 3.16Å; A362-I365 HydrophobicContact CB-CD1 4.49Å; A362-I365 WeakPolarHBondContact O-CB 3.48Å; A362-I365 PolarHBondContact O-N 3.25Å
363S83.8Confident84.2Confident74 Ų74112 Ų11252%0.51760%0.601SS.*THydrogen-bonded Turntrans-64.5-27.2-167.363.70000114.4V359 G360V359-S363 WeakPolarHBondContact CG1-OG 3.44Å; G360-S363 VanDerWaalsContact O-CB 3.31Å; G360-S363 WeakPolarHBondContact O-CB 3.5Å; G360-S363 PolarHBondContact O-N 2.98Å; G360-S363 PolarHBondContact O-OG 2.53Å
364K81.8Confident84.5Confident114 Ų114104.9 Ų104.950%0.49658%0.577SS.*THydrogen-bonded Turntrans-93.6-6.7178.7-63-173.9-179-178.60113.2A362 H407A362-K364 VanDerWaalsContact C-N 3.26Å; A362-K364 PolarHBondContact O-N 2.94Å; A362-K364 VanDerWaalsContact O-N 3.16Å; K364-H407 PolarHBondContact O-CE1 3.23Å; K364-H407 PolarHBondContact O-NE2 3.39Å; K364-H407 VanDerWaalsContact O-NE2 3.11Å
365I85.7Confident84.9Confident101 Ų101105 Ų10552%0.51857%0.574SS.*  trans-79.8123.3-177-56-179.1000109.1A362 L367A362-I365 HydrophobicContact CB-CD1 4.49Å; A362-I365 WeakPolarHBondContact O-CB 3.48Å; A362-I365 PolarHBondContact O-N 3.25Å; I365-L367 HydrophobicContact CG2-CD2 3.63Å; I365-L367 HydrophobicContact CG2-CG 3.9Å
366N87Confident85.3Confident29 Ų29105 Ų10516%0.15557%0.568CS.*  trans-102.599.9168.3-179.1-3.4000109.7V368 K369 N404N366-V368 PolarHBondContact O-N 3.32Å; N366-V368 VanDerWaalsContact OD1-CG2 3.24Å; N366-V368 WeakPolarHBondContact OD1-CG2 3.35Å; N366-V368 PolarHBondContact OD1-N 3.09Å; N366-K369 PolarHBondContact OD1-N 3.25Å; N366-N404 PolarHBondContact ND2-OD1 3.27Å; N366-N404 PolarHBondContact OD1-OD1 2.89Å
367L86.1Confident85.7Confident153 Ų153101 Ų10180%0.80156%0.555SS**THydrogen-bonded Turntrans-76.1-9.1178.9-65.4176.4000113.7I365I365-L367 HydrophobicContact CG2-CD2 3.63Å; I365-L367 HydrophobicContact CG2-CG 3.9Å
368V85Confident85.9Confident21 Ų2198.7 Ų98.713%0.12754%0.54CS..THydrogen-bonded Turntrans-120.217.7-168.7-640000113.4N366 N370 K371 I374 V400 N404N366-V368 PolarHBondContact O-N 3.32Å; N366-V368 VanDerWaalsContact OD1-CG2 3.24Å; N366-V368 WeakPolarHBondContact OD1-CG2 3.35Å; N366-V368 PolarHBondContact OD1-N 3.09Å; V368-N370 PolarHBondContact O-N 2.74Å; V368-K371 HydrophobicContact CB-CB 4.42Å; V368-K371 PolarHBondContact O-N 3.31Å; V368-I374 HydrophobicContact CB-CD1 4.01Å; V368-I374 HydrophobicContact CB-CG1 4.45Å; V368-I374 HydrophobicContact CG1-CD1 3.16Å; V368-I374 HydrophobicContact CG1-CG1 3.74Å; V368-I374 HydrophobicContact CG2-CD1 4.27Å; V368-V400 HydrophobicContact CB-CG2 4.14Å; V368-V400 HydrophobicContact CG2-CB 4.28Å; V368-V400 HydrophobicContact CG2-CG2 4.06Å; V368-N404 PolarHBondContact O-ND2 2.87Å; V368-N404 PolarHBondContact O-OD1 3.24Å
369K79.1Confident86.1Confident156 Ų15695.4 Ų95.468%0.67852%0.52SS*.THydrogen-bonded Turntrans-44.5-37.4-175.7-170.9-179.4176.4-172.50115.2N366 N404N366-K369 PolarHBondContact OD1-N 3.25Å; K369-N404 WeakPolarHBondContact CA-OD1 3.32Å
370N83Confident86.3Confident155 Ų15599.4 Ų99.483%0.82953%0.531SS*.THydrogen-bonded Turntrans-110.611-177.1-61.8-15.9000113.6V368V368-N370 PolarHBondContact O-N 2.74Å
371K84.2Confident86.4Confident128 Ų128101.2 Ų101.256%0.55753%0.528SS*.  trans-107.1139.3-179.5-63.5-174.2179.4-178.40110.1V368 V400 N404V368-K371 HydrophobicContact CB-CB 4.42Å; V368-K371 PolarHBondContact O-N 3.31Å; K371-V400 WeakPolarHBondContact O-CG2 3.3Å; K371-N404 PolarHBondContact O-ND2 2.91Å
372K83.5Confident86.3Confident170 Ų170101 Ų10174%0.73951%0.512SS*.SBendtrans-87.2-30.2170.9-68-174.8179.1-178.60112N399 V400K372-N399 CarbonylContact O-C 3.46Å; K372-N399 WeakPolarHBondContact O-CA 3.48Å; K372-N399 PolarHBondContact O-OD1 2.76Å; K372-V400 PolarHBondContact O-N 3.2Å
373E89.1Confident86.2Confident95 Ų9599.6 Ų99.644%0.44450%0.495SS..EExtended strand (participates in β ladder)trans-138.1149.3-177.1-63.6178.118000111.1R397 V398E373-R397 IonicContact OE2-NH1 2.81Å; E373-V398 CarbonylContact C-O 3.28Å; E373-V398 VanDerWaalsContact CA-O 3.25Å; E373-V398 WeakPolarHBondContact CA-O 3.42Å
374I89.9Confident86.2Confident57 Ų57100.6 Ų100.629%0.29250%0.502SS..EExtended strand (participates in β ladder)trans-121.4132.2170.6-55.7172.4000108V368 M376 V398 V400V368-I374 HydrophobicContact CB-CD1 4.01Å; V368-I374 HydrophobicContact CB-CG1 4.45Å; V368-I374 HydrophobicContact CG1-CD1 3.16Å; V368-I374 HydrophobicContact CG1-CG1 3.74Å; V368-I374 HydrophobicContact CG2-CD1 4.27Å; I374-M376 HydrophobicContact CG2-CG 4.43Å; I374-V398 PolarHBondContact N-O 2.88Å; I374-V398 PolarHBondContact O-N 2.94Å; I374-V400 HydrophobicContact CD1-CB 4.47Å; I374-V400 HydrophobicContact CD1-CG1 3.62Å; I374-V400 HydrophobicContact CD1-CG2 4.25Å; I374-V400 HydrophobicContact CG1-CG1 3.92Å; I374-V400 HydrophobicContact CG1-CG2 4.02Å
375V88.9Confident86.5Confident88 Ų88101.4 Ų101.453%0.53351%0.508SS..EExtended strand (participates in β ladder)trans-85.9120.4168.5-173.80000108.1L395 R396 R397V375-L395 HydrophobicContact CG1-CD2 4.04Å; V375-R396 CarbonylContact C-O 3.59Å; V375-R396 WeakPolarHBondContact CA-O 3.43Å; V375-R397 HydrophobicContact CG2-CG 4.18Å
376M88.3Confident86.4Confident115 Ų11598.7 Ų98.757%0.56749%0.494SS*.EExtended strand (participates in β ladder)trans-99.9140.4172.7-59.7-167.875.200109.4I374 R396 V398I374-M376 HydrophobicContact CG2-CG 4.43Å; M376-R396 PolarHBondContact N-O 3.2Å; M376-R396 PolarHBondContact O-N 3.24Å; M376-V398 HydrophobicContact CG-CG2 4.05Å; M376-V398 HydrophobicContact SD-CG2 3.79Å
377T89.1Confident86.3Confident80 Ų80102.3 Ų102.349%0.49151%0.513SS..  trans-141.7152.2-178.9-168.80000109.3L383 L395T377-L383 HydrophobicContact CG2-CD1 4.41Å; T377-L395 WeakPolarHBondContact OG1-CD2 3.27Å
378P87.5Confident86Confident38 Ų3899.3 Ų99.325%0.24750%0.503CS..  trans-57.9160.3172.4-22.533.2000112.3K382 L383 Y394P378-K382 HydrophobicContact CB-CB 4.43Å; P378-L383 HydrophobicContact CB-CG 4.24Å; P378-L383 WeakPolarHBondContact O-CD1 3.48Å; P378-Y394 HydrophobicContact CG-CG 4.15Å
379H89.6Confident85.8Confident120 Ų120102.1 Ų102.156%0.55652%0.523SS*.  trans-61.4146175.3-175.2-98.5000110.9N381 K382 L383H379-N381 PolarHBondContact ND1-N 3.27Å; H379-N381 PolarHBondContact O-N 3.38Å; H379-K382 PolarHBondContact O-N 3.02Å; H379-L383 PolarHBondContact O-N 3.07Å; H379-L383 VanDerWaalsContact O-N 3.1Å
380K88.6Confident85.8Confident152 Ų15298.9 Ų98.966%0.66151%0.511SS*.Hα-helixtrans-50.1-36.9-174.663.9179.5-177.5175.80114.5K382 L383 S384K380-K382 VanDerWaalsContact C-N 3.3Å; K380-K382 PolarHBondContact O-N 3.4Å; K380-L383 PolarHBondContact O-N 2.94Å; K380-S384 PolarHBondContact O-N 3.02Å; K380-S384 PolarHBondContact O-OG 3.49Å
381N89.2Confident85.6Confident93 Ų9394.6 Ų94.650%0.49749%0.486SS..Hα-helixtrans-66.1-31.6179-60.74.5000112.7H379 S384H379-N381 PolarHBondContact ND1-N 3.27Å; H379-N381 PolarHBondContact O-N 3.38Å; N381-S384 PolarHBondContact O-OG 2.99Å
382K86.3Confident85.3Confident118 Ų11896.1 Ų96.151%0.51349%0.493SS..Hα-helixtrans-83.4-31.3175.1-72.4-56.1-172.5-172.70112.2P378 H379 K380 S384 E385 L386P378-K382 HydrophobicContact CB-CB 4.43Å; H379-K382 PolarHBondContact O-N 3.02Å; K380-K382 VanDerWaalsContact C-N 3.3Å; K380-K382 PolarHBondContact O-N 3.4Å; K382-S384 VanDerWaalsContact C-N 3.3Å; K382-S384 PolarHBondContact O-N 3.11Å; K382-E385 VanDerWaalsContact CD-OE2 3.31Å; K382-E385 WeakPolarHBondContact CD-OE2 3.4Å; K382-E385 IonicContact NZ-OE1 3.63Å; K382-E385 PolarHBondContact NZ-OE1 2.97Å; K382-E385 IonicContact NZ-OE2 2.8Å; K382-E385 PolarHBondContact NZ-OE2 3.35Å; K382-E385 PolarHBondContact O-N 3.42Å; K382-L386 WeakPolarHBondContact O-CG 3.19Å
383L84.1Confident85.3Confident34 Ų3493.4 Ų93.418%0.17849%0.49CS..Hα-helixtrans-62.6-37.3171.4-77.7160.9000112.3T377 P378 H379 K380 E385 L386 Q391T377-L383 HydrophobicContact CG2-CD1 4.41Å; P378-L383 HydrophobicContact CB-CG 4.24Å; P378-L383 WeakPolarHBondContact O-CD1 3.48Å; H379-L383 PolarHBondContact O-N 3.07Å; H379-L383 VanDerWaalsContact O-N 3.1Å; K380-L383 PolarHBondContact O-N 2.94Å; L383-E385 PolarHBondContact O-N 3.47Å; L383-L386 PolarHBondContact O-N 3.49Å; L383-Q391 HydrophobicContact CD2-CB 4.08Å; L383-Q391 HydrophobicContact CD2-CG 3.87Å; L383-Q391 PolarHBondContact O-NE2 3.34Å
384S84.8Confident84.9Confident95 Ų9594.7 Ų94.766%0.66449%0.492SS*.THydrogen-bonded Turntrans-68.4-17.7179.150.70000114.6K380 N381 K382K380-S384 PolarHBondContact O-N 3.02Å; K380-S384 PolarHBondContact O-OG 3.49Å; N381-S384 PolarHBondContact O-OG 2.99Å; K382-S384 VanDerWaalsContact C-N 3.3Å; K382-S384 PolarHBondContact O-N 3.11Å
385E87.1Confident84.6Confident132 Ų13296.2 Ų96.262%0.61750%0.5SS*.THydrogen-bonded Turntrans-89-9.7177.3-66.2169.5-166.800112.5K382 L383K382-E385 VanDerWaalsContact CD-OE2 3.31Å; K382-E385 WeakPolarHBondContact CD-OE2 3.4Å; K382-E385 IonicContact NZ-OE1 3.63Å; K382-E385 PolarHBondContact NZ-OE1 2.97Å; K382-E385 IonicContact NZ-OE2 2.8Å; K382-E385 PolarHBondContact NZ-OE2 3.35Å; K382-E385 PolarHBondContact O-N 3.42Å; L383-E385 PolarHBondContact O-N 3.47Å
386L83.6Confident84.5Confident43 Ų43100.8 Ų100.823%0.22551%0.508CS..SBendtrans-109.2145-171.1-66.4170.8000112.1K382 L383 E390 Q391 Y394K382-L386 WeakPolarHBondContact O-CG 3.19Å; L383-L386 PolarHBondContact O-N 3.49Å; L386-E390 HydrophobicContact CB-CB 4.3Å; L386-E390 HydrophobicContact CD2-CB 4.42Å; L386-E390 WeakPolarHBondContact CD2-OE2 3.31Å; L386-Q391 HydrophobicContact CB-CG 3.93Å; L386-Q391 PolarHBondContact O-NE2 2.93Å; L386-Y394 HydrophobicContact CD1-CD2 3.82Å; L386-Y394 HydrophobicContact CD1-CE2 3.91Å; L386-Y394 HydrophobicContact CD2-CE2 4.43Å
387D85.5Confident84.5Confident105 Ų105104.4 Ų104.456%0.56152%0.515SS*.  trans-68.9151.8174.6-83-27.2000111.8S389 E390 Q391D387-S389 PolarHBondContact O-N 2.96Å; D387-E390 HydrophobicContact CB-CG 4.33Å; D387-E390 PolarHBondContact N-OE2 3.42Å; D387-E390 WeakPolarHBondContact O-CA 3.36Å; D387-E390 WeakPolarHBondContact O-CB 3.46Å; D387-E390 PolarHBondContact O-N 3.46Å; D387-Q391 WeakPolarHBondContact O-CG 3.39Å; D387-Q391 PolarHBondContact O-N 3.22Å
388P80.7Confident84.5Confident90 Ų90103.4 Ų103.458%0.58451%0.509SS*.Hα-helixtrans-57.1-26.5-176.6-2734.8000115.3
389S79.6Confident84.6Confident80 Ų80106.1 Ų106.156%0.55952%0.521SS*.Hα-helixtrans-70.5-41.9173.146.40000111.6D387 T393D387-S389 PolarHBondContact O-N 2.96Å; S389-T393 PolarHBondContact O-OG1 3.29Å
390E78.4Confident84.6Confident89 Ų89101.1 Ų101.142%0.41650%0.499SS..Hα-helixtrans-71.9-38.9178.8-59.3-174.4142.600111.6L386 D387 K392 T393 Y394L386-E390 HydrophobicContact CB-CB 4.3Å; L386-E390 HydrophobicContact CD2-CB 4.42Å; L386-E390 WeakPolarHBondContact CD2-OE2 3.31Å; D387-E390 HydrophobicContact CB-CG 4.33Å; D387-E390 PolarHBondContact N-OE2 3.42Å; D387-E390 WeakPolarHBondContact O-CA 3.36Å; D387-E390 WeakPolarHBondContact O-CB 3.46Å; D387-E390 PolarHBondContact O-N 3.46Å; E390-K392 PolarHBondContact O-N 2.91Å; E390-T393 WeakPolarHBondContact O-CB 3.36Å; E390-T393 PolarHBondContact O-N 3.37Å; E390-Y394 WeakPolarHBondContact O-CD2 3.33Å; E390-Y394 PolarHBondContact O-N 3.46Å
391Q79.6Confident84.6Confident65 Ų6596.2 Ų96.230%0.30448%0.484SS..Hα-helixtrans-55-39.6175.7-67.8176.816.100112.1L383 L386 D387 T393 Y394L383-Q391 HydrophobicContact CD2-CB 4.08Å; L383-Q391 HydrophobicContact CD2-CG 3.87Å; L383-Q391 PolarHBondContact O-NE2 3.34Å; L386-Q391 HydrophobicContact CB-CG 3.93Å; L386-Q391 PolarHBondContact O-NE2 2.93Å; D387-Q391 WeakPolarHBondContact O-CG 3.39Å; D387-Q391 PolarHBondContact O-N 3.22Å; Q391-T393 VanDerWaalsContact C-N 3.32Å; Q391-T393 PolarHBondContact O-N 2.89Å; Q391-Y394 PolarHBondContact O-N 2.99Å
392K78.4Confident84.5Confident160 Ų16098 Ų9870%0.69649%0.493SS*.Hα-helixtrans-65.3-34.5178.2-72.1177.7-176.5178.20112.4E390 Y394 L395E390-K392 PolarHBondContact O-N 2.91Å; K392-Y394 PolarHBondContact O-N 2.86Å; K392-L395 PolarHBondContact O-N 3.04Å
393T82.1Confident84.6Confident112 Ų11296.8 Ų96.869%0.68749%0.489SS*.Hα-helixtrans-65.7-27.9178.7-51.40000112.3S389 E390 Q391S389-T393 PolarHBondContact O-OG1 3.29Å; E390-T393 WeakPolarHBondContact O-CB 3.36Å; E390-T393 PolarHBondContact O-N 3.37Å; Q391-T393 VanDerWaalsContact C-N 3.32Å; Q391-T393 PolarHBondContact O-N 2.89Å
394Y81.3Confident84.8Confident122 Ų12296.3 Ų96.348%0.47849%0.487SS..THydrogen-bonded Turntrans-91.5-0.1-179.3-65.6-72.3000114.9P378 L386 E390 Q391 K392P378-Y394 HydrophobicContact CG-CG 4.15Å; L386-Y394 HydrophobicContact CD1-CD2 3.82Å; L386-Y394 HydrophobicContact CD1-CE2 3.91Å; L386-Y394 HydrophobicContact CD2-CE2 4.43Å; E390-Y394 WeakPolarHBondContact O-CD2 3.33Å; E390-Y394 PolarHBondContact O-N 3.46Å; Q391-Y394 PolarHBondContact O-N 2.99Å; K392-Y394 PolarHBondContact O-N 2.86Å
395L84.7Confident84.9Confident89 Ų8994.9 Ų94.947%0.46648%0.481SS..  trans-79122.2172.6-70.3173000110.4V375 T377 K392V375-L395 HydrophobicContact CG1-CD2 4.04Å; T377-L395 WeakPolarHBondContact OG1-CD2 3.27Å; K392-L395 PolarHBondContact O-N 3.04Å
396R86.9Confident85Confident184 Ų18495.8 Ų95.869%0.69448%0.483SS*.EExtended strand (participates in β ladder)trans-118.5129.6177.2-63.3-174-179.5-171.20.6110.7V375 M376V375-R396 CarbonylContact C-O 3.59Å; V375-R396 WeakPolarHBondContact CA-O 3.43Å; M376-R396 PolarHBondContact N-O 3.2Å; M376-R396 PolarHBondContact O-N 3.24Å
397R88.5Confident85.2Confident192 Ų19295.5 Ų95.573%0.72548%0.48SS*.EExtended strand (participates in β ladder)trans-90.9121.3166.4-70-174.3-176.6-155.45.7108.8E373 V375E373-R397 IonicContact OE2-NH1 2.81Å; V375-R397 HydrophobicContact CG2-CG 4.18Å
398V87.9Confident85.2Confident58 Ų5893.6 Ų93.635%0.35248%0.479SS..EExtended strand (participates in β ladder)trans-112119.7179.5-177.60000108.3E373 I374 M376 V400E373-V398 CarbonylContact C-O 3.28Å; E373-V398 VanDerWaalsContact CA-O 3.25Å; E373-V398 WeakPolarHBondContact CA-O 3.42Å; I374-V398 PolarHBondContact N-O 2.88Å; I374-V398 PolarHBondContact O-N 2.94Å; M376-V398 HydrophobicContact CG-CG2 4.05Å; M376-V398 HydrophobicContact SD-CG2 3.79Å; V398-V400 HydrophobicContact CG1-CG1 4.34Å
399N89.6Confident85.6Confident95 Ų9596.7 Ų96.751%0.50848%0.483SS..EExtended strand (participates in β ladder)trans-71.6131.3172.3-171.9-40.2000109.6K372 S401K372-N399 CarbonylContact O-C 3.46Å; K372-N399 WeakPolarHBondContact O-CA 3.48Å; K372-N399 PolarHBondContact O-OD1 2.76Å; N399-S401 WeakPolarHBondContact OD1-CB 3.16Å; N399-S401 PolarHBondContact OD1-N 3.34Å; N399-S401 PolarHBondContact OD1-OG 3.46Å
400V90Very high86Confident15 Ų1597.7 Ų97.79%0.09148%0.479CS..  trans-12313.8-176.8-62.90000113.4V368 K371 K372 I374 V398 D402 H403 N404V368-V400 HydrophobicContact CB-CG2 4.14Å; V368-V400 HydrophobicContact CG2-CB 4.28Å; V368-V400 HydrophobicContact CG2-CG2 4.06Å; K371-V400 WeakPolarHBondContact O-CG2 3.3Å; K372-V400 PolarHBondContact O-N 3.2Å; I374-V400 HydrophobicContact CD1-CB 4.47Å; I374-V400 HydrophobicContact CD1-CG1 3.62Å; I374-V400 HydrophobicContact CD1-CG2 4.25Å; I374-V400 HydrophobicContact CG1-CG1 3.92Å; I374-V400 HydrophobicContact CG1-CG2 4.02Å; V398-V400 HydrophobicContact CG1-CG1 4.34Å; V400-D402 VanDerWaalsContact C-N 3.29Å; V400-D402 PolarHBondContact O-N 3Å; V400-H403 HydrophobicContact CB-CB 4.37Å; V400-H403 WeakPolarHBondContact O-CB 3.46Å; V400-H403 PolarHBondContact O-N 2.94Å; V400-N404 PolarHBondContact O-N 2.97Å; V400-N404 PolarHBondContact O-ND2 2.99Å
401S88.3Confident86.2Confident49 Ų4997.9 Ų97.934%0.34348%0.476SS..Hα-helixtrans-58.3-42.3176.358.90000112.2N399 H403 N404 A405N399-S401 WeakPolarHBondContact OD1-CB 3.16Å; N399-S401 PolarHBondContact OD1-N 3.34Å; N399-S401 PolarHBondContact OD1-OG 3.46Å; S401-H403 VanDerWaalsContact C-N 3.35Å; S401-H403 PolarHBondContact O-N 3.26Å; S401-N404 PolarHBondContact O-N 3.27Å; S401-A405 PolarHBondContact O-N 2.93Å
402D87.2Confident86.5Confident130 Ų13096.7 Ų96.770%0.69548%0.481SS*.Hα-helixtrans-68.8-36.8-178.5-63.3-11.2000111.6V400 A405 K406V400-D402 VanDerWaalsContact C-N 3.29Å; V400-D402 PolarHBondContact O-N 3Å; D402-A405 PolarHBondContact O-N 2.87Å; D402-K406 VanDerWaalsContact O-CB 3.29Å; D402-K406 WeakPolarHBondContact O-CB 3.22Å; D402-K406 PolarHBondContact O-N 2.91Å
403H87.8Confident86.8Confident93 Ų9393.7 Ų93.743%0.43147%0.472SS..Hα-helixtrans-60.1-48.3172.117487.2000110.9V400 S401 A405 K406 H407V400-H403 HydrophobicContact CB-CB 4.37Å; V400-H403 WeakPolarHBondContact O-CB 3.46Å; V400-H403 PolarHBondContact O-N 2.94Å; S401-H403 VanDerWaalsContact C-N 3.35Å; S401-H403 PolarHBondContact O-N 3.26Å; H403-A405 PolarHBondContact O-N 3.47Å; H403-K406 PolarHBondContact O-N 3.48Å; H403-H407 WeakPolarHBondContact O-CB 3.38Å; H403-H407 PolarHBondContact O-N 3.38Å
404N88.4Confident86.9Confident25 Ų2591.6 Ų91.613%0.13446%0.455CS..Hα-helixtrans-61.7-43.7179-75.6-29.6000112.3N366 V368 K369 K371 V400 S401 H407 A408N366-N404 PolarHBondContact ND2-OD1 3.27Å; N366-N404 PolarHBondContact OD1-OD1 2.89Å; V368-N404 PolarHBondContact O-ND2 2.87Å; V368-N404 PolarHBondContact O-OD1 3.24Å; K369-N404 WeakPolarHBondContact CA-OD1 3.32Å; K371-N404 PolarHBondContact O-ND2 2.91Å; V400-N404 PolarHBondContact O-N 2.97Å; V400-N404 PolarHBondContact O-ND2 2.99Å; S401-N404 PolarHBondContact O-N 3.27Å; N404-H407 PolarHBondContact O-N 3.2Å; N404-A408 WeakPolarHBondContact O-CB 3.45Å; N404-A408 PolarHBondContact O-N 3.03Å
405A87.8Confident86.9Confident64 Ų6494.9 Ų94.953%0.52947%0.466SS..Hα-helixtrans-62.8-45.1176.600000111.9S401 D402 H403 A408 K409S401-A405 PolarHBondContact O-N 2.93Å; D402-A405 PolarHBondContact O-N 2.87Å; H403-A405 PolarHBondContact O-N 3.47Å; A405-A408 PolarHBondContact O-N 3.44Å; A405-K409 PolarHBondContact O-N 3.21Å
406K88.2Confident86.8Confident152 Ų15292.9 Ų92.966%0.66146%0.463SS*.Hα-helixtrans-63-44.8177.3-172.7176.9-179.4178.80111.9D402 H403 K409 Q410D402-K406 VanDerWaalsContact O-CB 3.29Å; D402-K406 WeakPolarHBondContact O-CB 3.22Å; D402-K406 PolarHBondContact O-N 2.91Å; H403-K406 PolarHBondContact O-N 3.48Å; K406-K409 PolarHBondContact O-N 2.95Å; K406-Q410 WeakPolarHBondContact O-CB 3.47Å; K406-Q410 PolarHBondContact O-N 2.72Å
407H88.4Confident86.7Confident37 Ų3788.8 Ų88.817%0.17145%0.454CS..Hα-helixtrans-62.1-44.1177.9-166.5-84000111.3K364 H403 N404 K409 Q410 R411K364-H407 PolarHBondContact O-CE1 3.23Å; K364-H407 PolarHBondContact O-NE2 3.39Å; K364-H407 VanDerWaalsContact O-NE2 3.11Å; H403-H407 WeakPolarHBondContact O-CB 3.38Å; H403-H407 PolarHBondContact O-N 3.38Å; N404-H407 PolarHBondContact O-N 3.2Å; H407-K409 PolarHBondContact O-N 3.32Å; H407-Q410 PolarHBondContact O-N 3.09Å; H407-R411 VanDerWaalsContact O-CG 3.27Å; H407-R411 WeakPolarHBondContact O-CG 2.82Å; H407-R411 PolarHBondContact O-N 3.23Å
408A86.6Confident86.5Confident64 Ų6481.6 Ų81.653%0.52943%0.433SS..Hα-helixtrans-60.9-45.5175.800000112.5N404 A405 R411 G412N404-A408 WeakPolarHBondContact O-CB 3.45Å; N404-A408 PolarHBondContact O-N 3.03Å; A405-A408 PolarHBondContact O-N 3.44Å; A408-R411 PolarHBondContact O-N 2.87Å; A408-G412 PolarHBondContact O-N 3.44Å
409K89.2Confident86.3Confident156 Ų15683.5 Ų83.568%0.67845%0.447SS*.Hα-helixtrans-60.5-45.6176.4-174178.7-179178.80111.6A405 K406 H407 G412 L413A405-K409 PolarHBondContact O-N 3.21Å; K406-K409 PolarHBondContact O-N 2.95Å; H407-K409 PolarHBondContact O-N 3.32Å; K409-G412 PolarHBondContact O-N 3.14Å; K409-L413 PolarHBondContact O-N 3.18Å; K409-L413 VanDerWaalsContact O-N 3.07Å
410Q86.6Confident85.9Confident101 Ų10184.7 Ų84.747%0.47245%0.454SS..Hα-helixtrans-62.1-45.2178.8-176.4174.2-5.900111.8K406 H407 G412 L413 E414K406-Q410 WeakPolarHBondContact O-CB 3.47Å; K406-Q410 PolarHBondContact O-N 2.72Å; H407-Q410 PolarHBondContact O-N 3.09Å; Q410-G412 VanDerWaalsContact C-N 3.29Å; Q410-G412 PolarHBondContact O-N 2.9Å; Q410-L413 PolarHBondContact O-N 3.17Å; Q410-E414 WeakPolarHBondContact O-CG 2.88Å; Q410-E414 PolarHBondContact O-N 3.49Å
411R84Confident85.5Confident93 Ų9389.1 Ų89.135%0.35147%0.471SS..Hα-helixtrans-64.6-32.9177-66.8-65-68.8168.2-8.2112.8H407 A408 E414 R415H407-R411 VanDerWaalsContact O-CG 3.27Å; H407-R411 WeakPolarHBondContact O-CG 2.82Å; H407-R411 PolarHBondContact O-N 3.23Å; A408-R411 PolarHBondContact O-N 2.87Å; R411-E414 WeakPolarHBondContact CD-OE2 3.38Å; R411-E414 IonicContact CZ-OE2 3.31Å; R411-E414 IonicContact NE-OE2 2.7Å; R411-E414 IonicContact NH1-OE2 3.08Å; R411-E414 PolarHBondContact NH1-OE2 3Å; R411-R415 VanDerWaalsContact O-CG 3.3Å; R411-R415 WeakPolarHBondContact O-CG 3.3Å; R411-R415 PolarHBondContact O-N 3.23Å
412G84.6Confident85.2Confident40 Ų4089.1 Ų89.141%0.41247%0.471SS..Hα-helixtrans-62.7-47.5171.600000112.3A408 K409 Q410 R415 A416A408-G412 PolarHBondContact O-N 3.44Å; K409-G412 PolarHBondContact O-N 3.14Å; Q410-G412 VanDerWaalsContact C-N 3.29Å; Q410-G412 PolarHBondContact O-N 2.9Å; G412-R415 PolarHBondContact O-N 3.29Å; G412-A416 PolarHBondContact O-N 2.9Å
413L84.8Confident84.9Confident97 Ų9784.2 Ų84.251%0.50845%0.445SS..Hα-helixtrans-64-42.9177.8-70.7169.2000112.5K409 Q410 R415 A416 N417K409-L413 PolarHBondContact O-N 3.18Å; K409-L413 VanDerWaalsContact O-N 3.07Å; Q410-L413 PolarHBondContact O-N 3.17Å; L413-R415 VanDerWaalsContact C-N 3.29Å; L413-R415 PolarHBondContact O-N 3.27Å; L413-A416 PolarHBondContact O-N 2.75Å; L413-N417 WeakPolarHBondContact O-CB 3.44Å; L413-N417 PolarHBondContact O-N 3.38Å
414E84.2Confident84.5Confident68 Ų6882.6 Ų82.632%0.31844%0.444SS..Hα-helixtrans-59.4-39.6176.3-74.2175.9-177.200112.1Q410 R411 N417 S418Q410-E414 WeakPolarHBondContact O-CG 2.88Å; Q410-E414 PolarHBondContact O-N 3.49Å; R411-E414 WeakPolarHBondContact CD-OE2 3.38Å; R411-E414 IonicContact CZ-OE2 3.31Å; R411-E414 IonicContact NE-OE2 2.7Å; R411-E414 IonicContact NH1-OE2 3.08Å; R411-E414 PolarHBondContact NH1-OE2 3Å; E414-N417 CarbonylContact O-C 3.11Å; E414-S418 PolarHBondContact O-N 3.49Å
415R81.8Confident84.1Confident190 Ų19086.7 Ų86.772%0.71746%0.46SS*.Hα-helixtrans-70.2-40.1176.4-73172.8176.4-175.5-2.7112.3R411 G412 L413 N417R411-R415 VanDerWaalsContact O-CG 3.3Å; R411-R415 WeakPolarHBondContact O-CG 3.3Å; R411-R415 PolarHBondContact O-N 3.23Å; G412-R415 PolarHBondContact O-N 3.29Å; L413-R415 VanDerWaalsContact C-N 3.29Å; L413-R415 PolarHBondContact O-N 3.27Å; R415-N417 VanDerWaalsContact C-N 3.33Å
416A83.3Confident83.4Confident48 Ų4889.5 Ų89.540%0.39746%0.464SS..Hα-helixtrans-66.6-37.3179.600000112.2G412 L413G412-A416 PolarHBondContact O-N 2.9Å; L413-A416 PolarHBondContact O-N 2.75Å
417N84.3Confident82.6Confident98 Ų9888.3 Ų88.352%0.52446%0.455SS..THydrogen-bonded Turntrans-109.543.8-178.1-62.3-28.7000111.8L413 E414 R415L413-N417 WeakPolarHBondContact O-CB 3.44Å; L413-N417 PolarHBondContact O-N 3.38Å; E414-N417 CarbonylContact O-C 3.11Å; R415-N417 VanDerWaalsContact C-N 3.33Å
418S83.9Confident81.7Confident40 Ų4091 Ų9128%0.2848%0.479SS..  trans-57.6136.8173-178.10000109.9E414 D420 K421 C422E414-S418 PolarHBondContact O-N 3.49Å; S418-D420 VanDerWaalsContact C-N 3.29Å; S418-D420 PolarHBondContact O-N 3.27Å; S418-K421 WeakPolarHBondContact O-CA 3.46Å; S418-K421 WeakPolarHBondContact O-CB 3.43Å; S418-K421 PolarHBondContact O-N 2.93Å; S418-C422 PolarHBondContact O-N 3.16Å
419P83Confident80.9Confident99 Ų9995.6 Ų95.664%0.64348%0.482SS*.Hα-helixtrans-48.8-47.3179.5-29.335.5000113.3K421 C422 L423P419-K421 VanDerWaalsContact C-N 3.29Å; P419-K421 PolarHBondContact O-N 3.04Å; P419-C422 PolarHBondContact O-N 2.99Å; P419-C422 VanDerWaalsContact O-N 3.09Å; P419-L423 PolarHBondContact O-N 3.22Å
420D80.9Confident79.1Confident120 Ų12091 Ų9164%0.64247%0.47SS*.Hα-helixtrans-63.4-36.4-179.7-54.4-32.9000112.2S418 S424S418-D420 VanDerWaalsContact C-N 3.29Å; S418-D420 PolarHBondContact O-N 3.27Å; D420-S424 VanDerWaalsContact O-CB 3.27Å; D420-S424 WeakPolarHBondContact O-CB 3.42Å; D420-S424 PolarHBondContact O-N 3.19Å; D420-S424 PolarHBondContact O-OG 3.08Å
421K82Confident77.4Confident107 Ų10795.2 Ų95.247%0.46549%0.487SS..Hα-helixtrans-71-34.7177.1-167.4175.2-177.2179.10111.1S418 P419 S424 K425S418-K421 WeakPolarHBondContact O-CA 3.46Å; S418-K421 WeakPolarHBondContact O-CB 3.43Å; S418-K421 PolarHBondContact O-N 2.93Å; P419-K421 VanDerWaalsContact C-N 3.29Å; P419-K421 PolarHBondContact O-N 3.04Å; K421-S424 WeakPolarHBondContact CA-OG 3.37Å; K421-S424 PolarHBondContact O-OG 2.97Å; K421-S424 VanDerWaalsContact O-OG 3.09Å; K421-K425 WeakPolarHBondContact O-CB 3.29Å; K421-K425 WeakPolarHBondContact O-CD 3.46Å; K421-K425 WeakPolarHBondContact O-CG 3.34Å; K421-K425 PolarHBondContact O-N 2.87Å
422C82.6Confident75.8Confident50 Ų5094.8 Ų94.834%0.33850%0.498SS..Hα-helixtrans-71.8-42.6175.2-71.80000111.6S418 P419 K425 M426S418-C422 PolarHBondContact O-N 3.16Å; P419-C422 PolarHBondContact O-N 2.99Å; P419-C422 VanDerWaalsContact O-N 3.09Å; C422-K425 PolarHBondContact O-N 3.02Å; C422-M426 PolarHBondContact O-N 3.42Å; C422-M426 VanDerWaalsContact O-N 3.14Å
423L81.4Confident74.3Confident26 Ų2697.5 Ų97.514%0.13650%0.5CS..Hα-helixtrans-68.8-42.6179-170.964.9000112.1A351 E352 P419 K425 M426 R427A351-L423 HydrophobicContact CB-CD1 4.19Å; E352-L423 HydrophobicContact CB-CD2 4.33Å; E352-L423 HydrophobicContact CG-CD2 4.26Å; P419-L423 PolarHBondContact O-N 3.22Å; L423-K425 VanDerWaalsContact C-N 3.34Å; L423-K425 PolarHBondContact O-N 3.34Å; L423-M426 WeakPolarHBondContact O-CB 3.37Å; L423-M426 PolarHBondContact O-N 3Å; L423-M426 VanDerWaalsContact O-N 3.09Å; L423-R427 PolarHBondContact O-N 3.31Å
424S79.4Confident72.8Confident60 Ų6096.8 Ų96.842%0.4250%0.496SS..Hα-helixtrans-61.1-41.5174.752.40000112.2D420 K421 M426 R427 S428D420-S424 VanDerWaalsContact O-CB 3.27Å; D420-S424 WeakPolarHBondContact O-CB 3.42Å; D420-S424 PolarHBondContact O-N 3.19Å; D420-S424 PolarHBondContact O-OG 3.08Å; K421-S424 WeakPolarHBondContact CA-OG 3.37Å; K421-S424 PolarHBondContact O-OG 2.97Å; K421-S424 VanDerWaalsContact O-OG 3.09Å; S424-M426 VanDerWaalsContact C-N 3.27Å; S424-M426 PolarHBondContact O-N 3.36Å; S424-R427 PolarHBondContact O-N 3.03Å; S424-R427 VanDerWaalsContact O-N 3.14Å; S424-S428 PolarHBondContact O-N 2.96Å; S424-S428 PolarHBondContact O-OG 3.36Å
425K79.3Confident71.2Confident110 Ų11099.5 Ų99.548%0.47851%0.509SS..Hα-helixtrans-59.1-35.7172.2-79.9175.2179.8-177.10112.9K421 C422 L423 S428 R429K421-K425 WeakPolarHBondContact O-CB 3.29Å; K421-K425 WeakPolarHBondContact O-CD 3.46Å; K421-K425 WeakPolarHBondContact O-CG 3.34Å; K421-K425 PolarHBondContact O-N 2.87Å; C422-K425 PolarHBondContact O-N 3.02Å; L423-K425 VanDerWaalsContact C-N 3.34Å; L423-K425 PolarHBondContact O-N 3.34Å; K425-S428 PolarHBondContact O-OG 3.45Å; K425-R429 WeakPolarHBondContact O-CG 3.47Å
426M73.8Confident69.9Low124 Ų12499.7 Ų99.761%0.61151%0.511SS*.Hα-helixtrans-69.1-40.6174.1-73.5-169.6179.200111.8C422 L423 S424 R429C422-M426 PolarHBondContact O-N 3.42Å; C422-M426 VanDerWaalsContact O-N 3.14Å; L423-M426 WeakPolarHBondContact O-CB 3.37Å; L423-M426 PolarHBondContact O-N 3Å; L423-M426 VanDerWaalsContact O-N 3.09Å; S424-M426 VanDerWaalsContact C-N 3.27Å; S424-M426 PolarHBondContact O-N 3.36Å; M426-R429 PolarHBondContact O-N 2.95Å
427R71.6Confident69Low126 Ų126101.2 Ų101.248%0.47551%0.512SS..Hα-helixtrans-66.5-36.5177.7-67.4-172.1-159.9178.918.2113.4M348 E352 L423 S424 R429M348-R427 HydrophobicContact CE-CG 3.8Å; E352-R427 IonicContact OE1-CZ 3.73Å; E352-R427 IonicContact OE1-NE 2.67Å; E352-R427 IonicContact OE1-NH1 2.75Å; E352-R427 PolarHBondContact OE1-NH1 3.3Å; E352-R427 VanDerWaalsContact OE1-NH1 3.08Å; E352-R427 IonicContact OE1-NH2 3.19Å; E352-R427 PolarHBondContact OE1-NH2 3.38Å; E352-R427 IonicContact OE2-CZ 2.74Å; E352-R427 IonicContact OE2-NH1 3.92Å; E352-R427 PolarHBondContact OE2-NH1 2.97Å; E352-R427 IonicContact OE2-NH2 3.78Å; E352-R427 PolarHBondContact OE2-NH2 3.09Å; L423-R427 PolarHBondContact O-N 3.31Å; S424-R427 PolarHBondContact O-N 3.03Å; S424-R427 VanDerWaalsContact O-N 3.14Å; R427-R429 PolarHBondContact O-N 2.97Å
428S68.6Low68.3Low95 Ų95102.2 Ų102.266%0.66451%0.513SS*.THydrogen-bonded Turntrans-802.3-177.366.60000113.9S424 K425S424-S428 PolarHBondContact O-N 2.96Å; S424-S428 PolarHBondContact O-OG 3.36Å; K425-S428 PolarHBondContact O-OG 3.45Å
429R69Low67.8Low159 Ų159105.6 Ų105.660%0.652%0.523SS*.  trans-66134.9174.3-69.7-168.1172.4-177.3-5.7110K425 M426 R427 E433K425-R429 WeakPolarHBondContact O-CG 3.47Å; M426-R429 PolarHBondContact O-N 2.95Å; R427-R429 PolarHBondContact O-N 2.97Å; R429-E433 HydrophobicContact CB-CB 4.44Å; R429-E433 VanDerWaalsContact CB-OE2 3.31Å; R429-E433 WeakPolarHBondContact CB-OE2 3.46Å; R429-E433 WeakPolarHBondContact CD-OE2 3.48Å; R429-E433 VanDerWaalsContact CG-OE2 3.22Å; R429-E433 WeakPolarHBondContact CG-OE2 3.48Å; R429-E433 IonicContact NE-OE2 3.86Å
430S52.4Low67.6Low60 Ų60107.6 Ų107.642%0.4252%0.519SS..  trans-72.6161.9-173.2780000112S432 E433S430-S432 PolarHBondContact O-N 2.91Å; S430-S432 PolarHBondContact OG-N 3.39Å; S430-S432 PolarHBondContact OG-OG 3.08Å; S430-E433 PolarHBondContact O-N 2.86Å
431K51.4Low67.5Low189 Ų189106.6 Ų106.682%0.82251%0.51SS*.G310 helixtrans-54.1-24.3174.2-82.5-175.9176.21800114L434K431-L434 HydrophobicContact CB-CD1 4.13Å; K431-L434 HydrophobicContact CG-CD1 3.93Å; K431-L434 WeakPolarHBondContact O-CB 3.45Å
432S49.8Very low67.4Low84 Ų84108.4 Ų108.459%0.58753%0.525SS*.G310 helixtrans-77.4-20.1177.658.50000113.6S430S430-S432 PolarHBondContact O-N 2.91Å; S430-S432 PolarHBondContact OG-N 3.39Å; S430-S432 PolarHBondContact OG-OG 3.08Å
433E53.1Low67.1Low98 Ų98108.3 Ų108.346%0.45853%0.533SS..G310 helixtrans-88.5-4.4174.4-67.7-173.9161.700113.2R429 S430 Q435R429-E433 HydrophobicContact CB-CB 4.44Å; R429-E433 VanDerWaalsContact CB-OE2 3.31Å; R429-E433 WeakPolarHBondContact CB-OE2 3.46Å; R429-E433 WeakPolarHBondContact CD-OE2 3.48Å; R429-E433 VanDerWaalsContact CG-OE2 3.22Å; R429-E433 WeakPolarHBondContact CG-OE2 3.48Å; R429-E433 IonicContact NE-OE2 3.86Å; S430-E433 PolarHBondContact O-N 2.86Å; E433-Q435 PolarHBondContact O-N 2.92Å; E433-Q435 VanDerWaalsContact O-N 3.16Å
434L52.3Low66.8Low81 Ų81114.1 Ų114.142%0.42456%0.557SS.*G310 helixtrans-68.3-5.7173.4-58.4173000112.9K431 Y436 I437K431-L434 HydrophobicContact CB-CD1 4.13Å; K431-L434 HydrophobicContact CG-CD1 3.93Å; K431-L434 WeakPolarHBondContact O-CB 3.45Å; L434-Y436 PolarHBondContact O-N 3.28Å; L434-I437 HydrophobicContact CB-CD1 4.09Å; L434-I437 HydrophobicContact CB-CG1 4.49Å; L434-I437 HydrophobicContact CD2-CD1 3.3Å; L434-I437 HydrophobicContact CD2-CG1 4.29Å; L434-I437 HydrophobicContact CG-CD1 4.25Å; L434-I437 WeakPolarHBondContact O-CB 3.27Å; L434-I437 PolarHBondContact O-N 3.15Å; L434-I437 VanDerWaalsContact O-N 3.1Å
435Q51Low66.5Low126 Ų126115.4 Ų115.459%0.58956%0.555SS**G310 helixtrans-59.9-22.1174.3-75.7-178.9-17.200113.2E433E433-Q435 PolarHBondContact O-N 2.92Å; E433-Q435 VanDerWaalsContact O-N 3.16Å
436Y55Low66.1Low194 Ų194116.9 Ų116.976%0.76156%0.558SS**G310 helixtrans-93.91.6178.2-60-80.2000114L434 Q438L434-Y436 PolarHBondContact O-N 3.28Å; Y436-Q438 PolarHBondContact O-N 3.32Å
437I64.1Low65.7Low80 Ų80114.7 Ų114.741%0.4155%0.551SS.*PPolyproline II helixtrans-71.5116.3174.7-64.9-176.2000108.2L434 F439L434-I437 HydrophobicContact CB-CD1 4.09Å; L434-I437 HydrophobicContact CB-CG1 4.49Å; L434-I437 HydrophobicContact CD2-CD1 3.3Å; L434-I437 HydrophobicContact CD2-CG1 4.29Å; L434-I437 HydrophobicContact CG-CD1 4.25Å; L434-I437 WeakPolarHBondContact O-CB 3.27Å; L434-I437 PolarHBondContact O-N 3.15Å; L434-I437 VanDerWaalsContact O-N 3.1Å; I437-F439 HydrophobicContact CG2-CE2 4.42Å; I437-F439 HydrophobicContact CG2-CZ 4.45Å
438Q70.3Confident64.8Low118 Ų118112 Ų11255%0.55155%0.552SS**EExtended strand (participates in β ladder)trans-83125.6171.1-64.2-179.6-20.700109Y436 F445 R446 T447Y436-Q438 PolarHBondContact O-N 3.32Å; Q438-F445 HydrophobicContact CB-CB 4.1Å; Q438-F445 HydrophobicContact CB-CD1 3.65Å; Q438-F445 HydrophobicContact CB-CG 4.23Å; Q438-R446 CarbonylContact C-O 3.55Å; Q438-R446 WeakPolarHBondContact CA-O 3.46Å; Q438-T447 HydrophobicContact CG-CG2 4.06Å
439F74Confident63.9Low111 Ų111111.4 Ų111.449%0.48755%0.552SS.*EExtended strand (participates in β ladder)trans-87.9125171.2-63.5-91.8000108.5I437 F445 R446I437-F439 HydrophobicContact CG2-CE2 4.42Å; I437-F439 HydrophobicContact CG2-CZ 4.45Å; F439-F445 CarbonylContact O-C 3.52Å; F439-F445 VanDerWaalsContact O-CA 3.24Å; F439-F445 WeakPolarHBondContact O-CA 3.36Å; F439-R446 WeakPolarHBondContact CD2-O 3.46Å; F439-R446 PolarHBondContact N-O 2.83Å; F439-R446 PolarHBondContact O-N 3.46Å
440Y77.2Confident62.5Low141 Ų141111.8 Ų111.855%0.55357%0.566SS**EExtended strand (participates in β ladder)trans-93.7112.3173.1-168.9-100.3000109.5G443 K444 F445Y440-G443 WeakPolarHBondContact OH-CA 3.38Å; Y440-K444 WeakPolarHBondContact CA-O 3.24Å; Y440-F445 AromaticContact CD2-CD1 3.82Å; Y440-F445 HydrophobicContact CD2-CD1 3.82Å; Y440-F445 AromaticContact CD2-CD2 3.87Å; Y440-F445 HydrophobicContact CD2-CD2 3.87Å; Y440-F445 AromaticContact CD2-CE1 3.61Å; Y440-F445 HydrophobicContact CD2-CE1 3.61Å; Y440-F445 AromaticContact CD2-CE2 3.64Å; Y440-F445 HydrophobicContact CD2-CE2 3.64Å; Y440-F445 AromaticContact CD2-CG 3.97Å; Y440-F445 HydrophobicContact CD2-CG 3.97Å; Y440-F445 AromaticContact CD2-CZ 3.51Å; Y440-F445 HydrophobicContact CD2-CZ 3.51Å; Y440-F445 HydrophobicContact CE2-CD2 4.24Å; Y440-F445 AromaticContact CE2-CE2 3.88Å; Y440-F445 HydrophobicContact CE2-CE2 3.88Å; Y440-F445 HydrophobicContact CE2-CZ 4.08Å; Y440-F445 HydrophobicContact CG-CD1 4.42Å; Y440-F445 HydrophobicContact CG-CE1 4.13Å; Y440-F445 HydrophobicContact CG-CZ 4.32Å
441E79.9Confident61.8Low100 Ų100111.7 Ų111.747%0.46758%0.575SS.*EExtended strand (participates in β ladder)trans-140.4132.5179.3-168-173.8-16200109.6G443 K444 R446E441-G443 PolarHBondContact O-N 3.33Å; E441-K444 PolarHBondContact N-O 3.13Å; E441-K444 PolarHBondContact O-N 3.06Å; E441-R446 IonicContact OE2-NH1 3.94Å; E441-R446 PolarHBondContact OE2-NH1 3.5Å
442N79.5Confident61.4Low144 Ų144108.6 Ų108.677%0.7758%0.577SS**THydrogen-bonded Turntrans5239.2178.4-60.1-38.1000113.9K444N442-K444 VanDerWaalsContact C-N 3.35Å; N442-K444 PolarHBondContact O-N 3.35Å
443G75.3Confident60.8Low49 Ų49112.1 Ų112.151%0.50558%0.584SS.*THydrogen-bonded Turntrans78.612.4178.400000115.1Y440 E441Y440-G443 WeakPolarHBondContact OH-CA 3.38Å; E441-G443 PolarHBondContact O-N 3.33Å
444K76.1Confident60.1Low147 Ų147114.9 Ų114.964%0.63960%0.602SS**EExtended strand (participates in β ladder)trans-133.8140.9-179.3-63.9-174.9-179.1-178.20111.9Y440 E441 N442Y440-K444 WeakPolarHBondContact CA-O 3.24Å; E441-K444 PolarHBondContact N-O 3.13Å; E441-K444 PolarHBondContact O-N 3.06Å; N442-K444 VanDerWaalsContact C-N 3.35Å; N442-K444 PolarHBondContact O-N 3.35Å
445F72.8Confident59.5Low88 Ų88114.8 Ų114.839%0.38662%0.621SS.*EExtended strand (participates in β ladder)trans-80.4129.9168.2-71.1-75000110.7Q438 F439 Y440Q438-F445 HydrophobicContact CB-CB 4.1Å; Q438-F445 HydrophobicContact CB-CD1 3.65Å; Q438-F445 HydrophobicContact CB-CG 4.23Å; F439-F445 CarbonylContact O-C 3.52Å; F439-F445 VanDerWaalsContact O-CA 3.24Å; F439-F445 WeakPolarHBondContact O-CA 3.36Å; Y440-F445 AromaticContact CD2-CD1 3.82Å; Y440-F445 HydrophobicContact CD2-CD1 3.82Å; Y440-F445 AromaticContact CD2-CD2 3.87Å; Y440-F445 HydrophobicContact CD2-CD2 3.87Å; Y440-F445 AromaticContact CD2-CE1 3.61Å; Y440-F445 HydrophobicContact CD2-CE1 3.61Å; Y440-F445 AromaticContact CD2-CE2 3.64Å; Y440-F445 HydrophobicContact CD2-CE2 3.64Å; Y440-F445 AromaticContact CD2-CG 3.97Å; Y440-F445 HydrophobicContact CD2-CG 3.97Å; Y440-F445 AromaticContact CD2-CZ 3.51Å; Y440-F445 HydrophobicContact CD2-CZ 3.51Å; Y440-F445 HydrophobicContact CE2-CD2 4.24Å; Y440-F445 AromaticContact CE2-CE2 3.88Å; Y440-F445 HydrophobicContact CE2-CE2 3.88Å; Y440-F445 HydrophobicContact CE2-CZ 4.08Å; Y440-F445 HydrophobicContact CG-CD1 4.42Å; Y440-F445 HydrophobicContact CG-CE1 4.13Å; Y440-F445 HydrophobicContact CG-CZ 4.32Å
446R71.2Confident58.7Low141 Ų141113.2 Ų113.253%0.53262%0.62SS.*EExtended strand (participates in β ladder)trans-123.8138.4175.4-65.1-178.9171.9-179.6-6.6109.2Q438 F439 E441Q438-R446 CarbonylContact C-O 3.55Å; Q438-R446 WeakPolarHBondContact CA-O 3.46Å; F439-R446 WeakPolarHBondContact CD2-O 3.46Å; F439-R446 PolarHBondContact N-O 2.83Å; F439-R446 PolarHBondContact O-N 3.46Å; E441-R446 IonicContact OE2-NH1 3.94Å; E441-R446 PolarHBondContact OE2-NH1 3.5Å
447T64.9Low57.8Low78 Ų78109 Ų10948%0.47961%0.611SS.*EExtended strand (participates in β ladder)trans-93.3149.5171.847.50000110.2Q438 A449Q438-T447 HydrophobicContact CG-CG2 4.06Å; T447-A449 PolarHBondContact O-N 3.44Å
448S53.6Low56.3Low69 Ų69112.8 Ų112.848%0.48363%0.631SS.*PPolyproline II helixtrans-68120.9172.9-170.40000109.6
449A49.9Very low55Low82 Ų82116.5 Ų116.568%0.67864%0.64SS**SBendtrans-49.7131.3-173.700000112.9T447T447-A449 PolarHBondContact O-N 3.44Å
450N39.5Very low53.1Low167 Ų167116.1 Ų116.189%0.89365%0.647SS**SBend-134.1120.761.1-80.7-24.4000112.1
451G35.9Very low51Low59 Ų59121 Ų12161%0.60866%0.664SS**  trans145.493.3173.400000109.6Q453G451-Q453 VanDerWaalsContact C-N 3.29Å; G451-Q453 PolarHBondContact O-N 3.06Å
452S43.5Very low48.8Very low124 Ų124120.4 Ų120.487%0.86768%0.677SS**  trans-61.398.4162.363.50000108.1
453Q38.1Very low46.7Very low157 Ų157116.2 Ų116.273%0.73467%0.668SS**  trans-125.8100.9146.7-77.9-169.4-12.200105.9G451 G455G451-Q453 VanDerWaalsContact C-N 3.29Å; G451-Q453 PolarHBondContact O-N 3.06Å; Q453-G455 PolarHBondContact O-N 3.39Å
454N37.2Very low44.6Very low156 Ų156121.6 Ų121.683%0.83469%0.685SS**  trans-41.1127.9147.4-76.1-25.1000106.4V456N454-V456 PolarHBondContact O-N 3.08Å
455G39.5Very low42.3Very low80 Ų80122.1 Ų122.183%0.82569%0.693SS**  trans-40.7104.6-17900000110.1Q453 D457Q453-G455 PolarHBondContact O-N 3.39Å; G455-D457 PolarHBondContact O-N 3.09Å
456V35Very low40.2Very low93 Ų93126.4 Ų126.456%0.56471%0.714SS**  trans-69.4115.8168.8179.70000103.7N454 L458N454-V456 PolarHBondContact O-N 3.08Å; V456-L458 PolarHBondContact O-N 2.66Å
457D36.4Very low38.1Very low104 Ų104127.8 Ų127.856%0.55673%0.729SS**  trans-47.8113.1169.4-160.2-6.9000107.4G455 W459 T460G455-D457 PolarHBondContact O-N 3.09Å; D457-W459 PolarHBondContact O-N 2.7Å; D457-T460 PolarHBondContact O-N 3.01Å; D457-T460 PolarHBondContact O-OG1 3.44Å
458L33.3Very low36.2Very low161 Ų161131.4 Ų131.484%0.84375%0.745SS**THydrogen-bonded Turntrans-61.4-6.3-178-89.7152.1000111.9V456V456-L458 PolarHBondContact O-N 2.66Å
459W41.9Very low35Very low196 Ų196134.4 Ų134.474%0.74276%0.76SS**THydrogen-bonded Turntrans-97.4-6.8175.9-61.4104.4000115.2D457 R461D457-W459 PolarHBondContact O-N 2.7Å; W459-R461 PolarHBondContact O-N 3.2Å
460T34Very low33.9Very low103 Ų103134.8 Ų134.863%0.63276%0.763SS**THydrogen-bonded Turntrans-73.61.4171.46.60000113.9D457D457-T460 PolarHBondContact O-N 3.01Å; D457-T460 PolarHBondContact O-OG1 3.44Å
461R33.3Very low33.8Very low243 Ų243133 Ų13392%0.91776%0.759SS**THydrogen-bonded Turntrans-103.827.3176.6-107.1-173.5-175.6-1772.1114.4W459W459-R461 PolarHBondContact O-N 3.2Å
462A33.4Very low33.3Very low88 Ų88135.5 Ų135.573%0.72777%0.767SS**  trans-126.527.7167.900000112.5
463G36.2Very low32.6Very low56 Ų56137.1 Ų137.158%0.57777%0.766SS**  trans-92.7133160.900000109.1
464D30Very low32.2Very low162 Ų162135.1 Ų135.187%0.86677%0.766SS**  trans82.259.7172-46.6-22.4000116.2
465I29.3Very low32.1Very low157 Ų157135 Ų13581%0.80577%0.766SS**  trans-97.7100.5138.3-61.5177.2000105.8M467I465-M467 PolarHBondContact O-N 2.65Å
466E28.7Very low31.6Very low179 Ų179140.3 Ų140.384%0.83677%0.769SS**  trans-52.8103.1161.6-77.9-178.9148.700108.2N468E466-N468 VanDerWaalsContact C-N 3.33Å; E466-N468 PolarHBondContact O-N 3.47Å
467M26.2Very low31.4Very low170 Ų170141.9 Ų141.984%0.83778%0.779SS**  trans-71.497.5161.6-82.1-170178.500107.1I465 V469I465-M467 PolarHBondContact O-N 2.65Å; M467-V469 PolarHBondContact O-N 2.89Å
468N25.1Very low31Very low153 Ų153145.5 Ų145.582%0.81879%0.792SS**  trans-50.1108162.2-100.4-31.7000108.9E466 A470E466-N468 VanDerWaalsContact C-N 3.33Å; E466-N468 PolarHBondContact O-N 3.47Å; N468-A470 VanDerWaalsContact C-N 3.32Å; N468-A470 PolarHBondContact O-N 3.09Å
469V28.2Very low30.9Very low133 Ų133143 Ų14381%0.80679%0.785SS**  trans-73.990.6170.5179.20000107.4M467M467-V469 PolarHBondContact O-N 2.89Å
470A27.2Very low30.2Very low90 Ų90142.4 Ų142.474%0.74479%0.79SS**  trans-85.2107.3162.100000108.4N468 S472N468-A470 VanDerWaalsContact C-N 3.32Å; N468-A470 PolarHBondContact O-N 3.09Å; A470-S472 PolarHBondContact O-N 2.97Å
471T36.7Very low29.9Very low129 Ų129143.5 Ų143.579%0.79180%0.802SS**  trans-53.6122.7169.7440000112
472S26.2Very low29.7Very low112 Ų112138.9 Ų138.978%0.78379%0.794SS**  trans-166.8123.8146.949.90000114.2A470A470-S472 PolarHBondContact O-N 2.97Å
473N28.4Very low29.4Very low157 Ų157139.2 Ų139.284%0.8480%0.797SS**  trans61.1113.3153.6-91.8-11.7000122.6N475N473-N475 PolarHBondContact O-N 3.1Å
474P29.4Very low29.1Very low115 Ų115142.7 Ų142.775%0.74781%0.806SS**  trans-88.495162.133.9-23.4000108.8
475N35.9Very low29.1Very low153 Ų153144.1 Ų144.182%0.81881%0.805SS**  trans-177.491.1157.3-94.1-23.9000109.4N473N473-N475 PolarHBondContact O-N 3.1Å
476Q27.6Very low29.3Very low193 Ų193142 Ų14290%0.90280%0.802SS**  trans-162.7110146-110.9171.415.100109.9
477V31.7Very low29.5Very low126 Ų126139.4 Ų139.476%0.76480%0.801SS**  trans-80.6131.8175.4173.40000108.7
478H28.5Very low29.7Very low180 Ų180140.8 Ų140.883%0.83381%0.805SS**  trans-145.5148.5149-88.4-54000111
479P31.3Very low30Very low107 Ų107142.4 Ų142.470%0.69581%0.808SS**  trans-102.5142-14628.5-15.1000113.8
480H27Very low30.1Very low185 Ų185145.2 Ų145.286%0.85681%0.812SS**  trans-81.7117.9163.5-78.9-72.2000110I482H480-I482 PolarHBondContact O-N 3.31Å
481S27.5Very low30.3Very low125 Ų125149.7 Ų149.787%0.87482%0.817SS**  trans-80.2112.5164.8-72.10000109.9
482I28.9Very low30.1Very low146 Ų146149.4 Ų149.475%0.74982%0.815SS**  trans-82.6123.9167.3-66.2168.9000107.3H480 V484H480-I482 PolarHBondContact O-N 3.31Å; I482-V484 HydrophobicContact CG2-CG2 4.5Å; I482-V484 PolarHBondContact O-N 3.15Å
483A27.3Very low30.3Very low95 Ų95150 Ų15079%0.78582%0.815SS**  trans-78.1114.6171.400000109.6
484V30.6Very low30.4Very low129 Ų129147.6 Ų147.678%0.78281%0.81SS**PPolyproline II helixtrans-93.4126.91731750000108.2I482I482-V484 HydrophobicContact CG2-CG2 4.5Å; I482-V484 PolarHBondContact O-N 3.15Å
485F29Very low30.7Very low192 Ų192153.1 Ų153.184%0.84282%0.816SS**PPolyproline II helixtrans-76142.2168.1-76-89.2000110.1
486P33.5Very low30.6Very low113 Ų113158.2 Ų158.273%0.73483%0.834SS**PPolyproline II helixtrans-81155177.117.5-6.1000112.7
487P33.2Very low30.8Very low125 Ų125156.5 Ų156.581%0.81283%0.831SS**PPolyproline II helixtrans-86151.4-176.727.9-19.6000113.4
488E30.6Very low30.7Very low199 Ų199158.1 Ų158.193%0.9384%0.835SS**PPolyproline II helixtrans-66.9124.8171.8-70.4176.2148.500111.3
489E30.6Very low30.9Very low187 Ų187156.8 Ų156.887%0.87484%0.835SS**PPolyproline II helixtrans-86122.4168.7-88.1-177.9158.100110.9
490Q31.8Very low30.8Very low191 Ų191159.8 Ų159.889%0.89384%0.843SS**PPolyproline II helixtrans-74.6127.4160.5-72.3175.6-25.800109.6
491Q30.5Very low31.1Very low185 Ų185158.2 Ų158.286%0.86484%0.842SS**  trans-132.7131153.3-88-170.60.200111.5
492T32.5Very low31.3Very low122 Ų122160.4 Ų160.475%0.74884%0.84SS**  trans-81.1158.3176.638.70000112.9
493T31.5Very low31.5Very low125 Ų125161.4 Ų161.477%0.76785%0.846SS**  trans85.4118.8143.753.10000122.8
494S29.7Very low31.8Very low107 Ų107166.5 Ų166.575%0.74885%0.851SS**  103.8124.2123.575.30000121.1
495R34.6Very low31.9Very low230 Ų230169.7 Ų169.787%0.86886%0.857SS**  trans38112.1141.2-67.9-178.9174.9179.1-1.7118.6
496H35.7Very low32.2Very low260 Ų260167.6 Ų167.6100%1.20486%0.858SS**  -162.7092.3-110.8-61000111.4

Retrieved 496 of 496 residues in 206.4 ms (Link to these results)

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