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Thyrotropin-releasing hormone receptor

Receptor for thyrotropin-releasing hormone (TRH). Upon ligand binding, this G-protein-coupled receptor triggers activation of the phosphatidylinositol (IP3)-calcium-protein kinase C (PKC) pathway.

AlphaFold DB , UniProt , Accession A0A060WXZ3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110489825, Length 406 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
1M33.8Very low37Very low232 Ų232148 Ų148100%1.14380%0.8SS**  0133.90-91.7161.9166.800107.1
2E34.3Very low38.2Very low180 Ų180142 Ų14284%0.84177%0.772SS**  trans70.296.2162.5-61.5170.3177.900118
3N25.1Very low40Very low149 Ų149137.1 Ų137.180%0.79774%0.744SS**  -163.582.6102.2-121.2-6.1000109.4T5N3-T5 VanDerWaalsContact C-N 3.33Å; N3-T5 PolarHBondContact O-N 3.01Å
4V35.5Very low42.2Very low132 Ų132130.4 Ų130.480%0.872%0.724SS**  trans-75.293.1161.9175.80000105.3S6V4-S6 PolarHBondContact O-N 3.08Å
5T31.7Very low44.1Very low125 Ų125127.5 Ų127.577%0.76771%0.713SS**  trans-71.784.2159.510.30000106.8N3 I7N3-T5 VanDerWaalsContact C-N 3.33Å; N3-T5 PolarHBondContact O-N 3.01Å; T5-I7 PolarHBondContact O-N 3.43Å; T5-I7 VanDerWaalsContact O-N 3.1Å
6S32.4Very low46.1Very low95 Ų95123.6 Ų123.666%0.66468%0.683SS**  trans-52.3109.5157.848.60000107.5V4V4-S6 PolarHBondContact O-N 3.08Å
7I36.9Very low47.9Very low139 Ų139122.9 Ų122.971%0.71368%0.684SS**  trans-56.7128.7163.5-60.3172.8000105.6T5 D9T5-I7 PolarHBondContact O-N 3.43Å; T5-I7 VanDerWaalsContact O-N 3.1Å; I7-D9 PolarHBondContact O-N 2.8Å; I7-D9 VanDerWaalsContact O-N 3.14Å
8P37.9Very low49.8Very low96 Ų96120.3 Ų120.362%0.62367%0.668SS**  trans-64118.6177.523.9-29.7000109.1N10P8-N10 PolarHBondContact O-N 3.17Å
9D44.8Very low51.6Low159 Ų159116.7 Ų116.785%0.8564%0.644SS**SBendtrans-63.121.3179.2-80.5-35.8000114.9I7I7-D9 PolarHBondContact O-N 2.8Å; I7-D9 VanDerWaalsContact O-N 3.14Å
10N44.7Very low53.5Low152 Ų152113.7 Ų113.781%0.81363%0.632SS**  trans-136.444.5-173.6-87.4-14.2000112.6P8P8-N10 PolarHBondContact O-N 3.17Å
11Q49.5Very low55.2Low169 Ų169115.1 Ų115.179%0.7964%0.635SS**  trans-9596.9157.8-80.4-174.5-8.200108.1L13Q11-L13 PolarHBondContact O-N 3.35Å
12T51.3Low57.9Low76 Ų76110.9 Ų110.947%0.46661%0.613SS.*  trans-62.5126.1162.747.50000108I170 D172T12-I170 HydrophobicContact CG2-CG2 4.36Å; T12-D172 WeakPolarHBondContact CB-OD1 3.39Å; T12-D172 PolarHBondContact OG1-OD1 3.31Å
13L61.6Low60.6Low78 Ų78102.3 Ų102.341%0.40857%0.573SS.*BIsolated β-bridgetrans-64.7139.1166.4-72.7150.3000106.7Q11 L169 I170 Y171 D172Q11-L13 PolarHBondContact O-N 3.35Å; L13-L169 HydrophobicContact CD1-CB 4Å; L13-L169 HydrophobicContact CD1-CD2 3.99Å; L13-L169 HydrophobicContact CD1-CG 4.46Å; L13-I170 PolarHBondContact N-O 2.78Å; L13-I170 VanDerWaalsContact N-O 3.1Å; L13-Y171 HydrophobicContact CB-CD1 3.32Å; L13-Y171 HydrophobicContact CB-CE1 3.46Å; L13-Y171 VanDerWaalsContact CB-CE1 3.46Å; L13-Y171 HydrophobicContact CB-CG 4.08Å; L13-Y171 HydrophobicContact CD1-CD1 4.44Å; L13-Y171 HydrophobicContact CD1-CE1 4.02Å; L13-Y171 HydrophobicContact CD1-CE2 4.43Å; L13-Y171 HydrophobicContact CG-CD1 4.48Å; L13-Y171 HydrophobicContact CG-CE1 4.26Å; L13-Y171 WeakPolarHBondContact O-CA 3.32Å; L13-D172 PolarHBondContact O-N 3.46Å
14G71.9Confident63.8Low44 Ų4496.4 Ų96.445%0.45454%0.54SS..SBendtrans-53.4174.5179.100000112.6W16 Y171G14-W16 PolarHBondContact O-N 3.19Å; G14-W16 VanDerWaalsContact O-N 3.1Å; G14-Y171 VanDerWaalsContact O-CD1 3.25Å; G14-Y171 WeakPolarHBondContact O-CD1 3.21Å
15P70.3Confident66.5Low86 Ų8694.8 Ų94.856%0.55853%0.53SS*.  trans-54122.1-165.821.9-33.8000112.7T17P15-T17 PolarHBondContact O-N 3.32Å
16W76.3Confident69.4Low65 Ų6591.4 Ų91.425%0.24651%0.509CS..  trans-63.6124.4175.1-177.984.8000109.8G14 D18 G88 Y171 I174 V176G14-W16 PolarHBondContact O-N 3.19Å; G14-W16 VanDerWaalsContact O-N 3.1Å; W16-D18 HydrophobicContact CE3-CB 4.37Å; W16-D18 HydrophobicContact CH2-CB 3.47Å; W16-D18 VanDerWaalsContact CH2-CB 3.47Å; W16-D18 VanDerWaalsContact CH2-CG 3.47Å; W16-D18 HydrophobicContact CZ2-CB 4.34Å; W16-D18 HydrophobicContact CZ3-CB 3.49Å; W16-D18 VanDerWaalsContact CZ3-CB 3.49Å; W16-G88 VanDerWaalsContact CZ2-O 3.3Å; W16-G88 WeakPolarHBondContact CZ2-O 3.48Å; W16-Y171 HydrophobicContact CB-CD1 3.76Å; W16-Y171 HydrophobicContact CB-CD2 4.02Å; W16-Y171 HydrophobicContact CB-CE1 4.28Å; W16-Y171 HydrophobicContact CB-CG 3.61Å; W16-Y171 AromaticContact CD1-CD2 3.92Å; W16-Y171 AromaticContact CD1-CE2 3.64Å; W16-Y171 AromaticContact CD1-CZ 3.7Å; W16-Y171 HydrophobicContact CG-CD1 4.48Å; W16-Y171 HydrophobicContact CG-CD2 4.25Å; W16-Y171 HydrophobicContact CG-CE2 4.39Å; W16-Y171 HydrophobicContact CG-CG 4.3Å; W16-I174 HydrophobicContact CB-CG2 3.88Å; W16-I174 HydrophobicContact CD2-CG2 4.18Å; W16-I174 HydrophobicContact CE3-CG2 4.19Å; W16-I174 HydrophobicContact CG-CG2 4.09Å; W16-V176 HydrophobicContact CD2-CG2 4.41Å; W16-V176 HydrophobicContact CG-CG2 4.3Å
17T77.1Confident72.3Confident113 Ų11386.9 Ų86.969%0.69348%0.477SS*.  trans-106.9122.2172.455.90000109.1P15P15-T17 PolarHBondContact O-N 3.32Å
18D80.6Confident75Confident75 Ų7581.9 Ų81.940%0.40145%0.452SS..PPolyproline II helixtrans-59.1156.7170.7-160.4-5.6000110.6W16 K24 G88W16-D18 HydrophobicContact CE3-CB 4.37Å; W16-D18 HydrophobicContact CH2-CB 3.47Å; W16-D18 VanDerWaalsContact CH2-CB 3.47Å; W16-D18 VanDerWaalsContact CH2-CG 3.47Å; W16-D18 HydrophobicContact CZ2-CB 4.34Å; W16-D18 HydrophobicContact CZ3-CB 3.49Å; W16-D18 VanDerWaalsContact CZ3-CB 3.49Å; D18-K24 WeakPolarHBondContact OD1-CE 3.33Å; D18-K24 IonicContact OD1-NZ 2.72Å; D18-K24 PolarHBondContact OD1-NZ 3.39Å; D18-K24 IonicContact OD2-NZ 2.87Å; D18-K24 PolarHBondContact OD2-NZ 3.35Å; D18-G88 WeakPolarHBondContact OD1-CA 3.23Å
19Y85.2Confident77.7Confident52 Ų5283.2 Ų83.220%0.20445%0.448CS..PPolyproline II helixtrans-61.7144175.1-61-35000111.1Y23 K24 G89 L297Y19-Y23 AromaticContact CD2-CD1 3.98Å; Y19-Y23 HydrophobicContact CD2-CD1 3.98Å; Y19-Y23 AromaticContact CD2-CE1 3.76Å; Y19-Y23 HydrophobicContact CD2-CE1 3.76Å; Y19-Y23 HydrophobicContact CE2-CE1 4.18Å; Y19-Y23 AromaticContact CG-CD1 3.88Å; Y19-Y23 HydrophobicContact CG-CD1 3.88Å; Y19-Y23 HydrophobicContact CG-CE1 4.04Å; Y19-K24 WeakPolarHBondContact O-CE 3.33Å; Y19-G89 WeakPolarHBondContact OH-CA 3.47Å; Y19-L297 HydrophobicContact CD1-CD1 4.08Å; Y19-L297 HydrophobicContact CD1-CD2 3.38Å; Y19-L297 HydrophobicContact CD1-CG 4.38Å; Y19-L297 HydrophobicContact CE1-CD1 3.55Å; Y19-L297 HydrophobicContact CE1-CD2 3.75Å; Y19-L297 HydrophobicContact CE1-CG 4.3Å; Y19-L297 HydrophobicContact CG-CD2 3.99Å
20S89.1Confident80Confident57 Ų5779.8 Ų79.840%0.39943%0.426SS..PPolyproline II helixtrans-59.3147.5177.2680000111.1E22 Y23 K24S20-E22 PolarHBondContact O-N 3.37Å; S20-Y23 WeakPolarHBondContact O-CB 3.29Å; S20-Y23 PolarHBondContact O-N 3.35Å; S20-Y23 WeakPolarHBondContact OG-CB 3.07Å; S20-Y23 PolarHBondContact OG-N 2.92Å; S20-K24 PolarHBondContact O-N 3.31Å
21M88.9Confident82.4Confident144 Ų14472.6 Ų72.671%0.70939%0.387SS*.Hα-helixtrans-58.7-36.2178.7-66.1-60.8-82.900111.6K24 V25M21-K24 PolarHBondContact O-N 3.36Å; M21-K24 HydrophobicContact SD-CD 4.45Å; M21-V25 WeakPolarHBondContact O-CB 3.44Å; M21-V25 VanDerWaalsContact O-CG2 3.28Å; M21-V25 WeakPolarHBondContact O-CG2 3.22Å; M21-V25 PolarHBondContact O-N 3.39Å
22E91Very high84.6Confident143 Ų14369 Ų6967%0.66837%0.372SS*.Hα-helixtrans-58.2-49.4173.5-62.2176.2-173.700111.5S20 K24 V25 V26 W298S20-E22 PolarHBondContact O-N 3.37Å; E22-K24 PolarHBondContact O-N 3.46Å; E22-V25 PolarHBondContact O-N 3.35Å; E22-V26 WeakPolarHBondContact O-CB 3.42Å; E22-V26 WeakPolarHBondContact O-CG2 3.22Å; E22-V26 PolarHBondContact O-N 3.48Å; E22-W298 HydrophobicContact CB-CH2 4.33Å
23Y90.4Very high86.6Confident0 Ų069.2 Ų69.20%037%0.37CS..Hα-helixtrans-60.5-46.1177.6175.6-91.3000111.6Y19 S20 V25 V26 S27 L297 W298 L301Y19-Y23 AromaticContact CD2-CD1 3.98Å; Y19-Y23 HydrophobicContact CD2-CD1 3.98Å; Y19-Y23 AromaticContact CD2-CE1 3.76Å; Y19-Y23 HydrophobicContact CD2-CE1 3.76Å; Y19-Y23 HydrophobicContact CE2-CE1 4.18Å; Y19-Y23 AromaticContact CG-CD1 3.88Å; Y19-Y23 HydrophobicContact CG-CD1 3.88Å; Y19-Y23 HydrophobicContact CG-CE1 4.04Å; S20-Y23 WeakPolarHBondContact O-CB 3.29Å; S20-Y23 PolarHBondContact O-N 3.35Å; S20-Y23 WeakPolarHBondContact OG-CB 3.07Å; S20-Y23 PolarHBondContact OG-N 2.92Å; Y23-V25 PolarHBondContact O-N 2.86Å; Y23-V26 PolarHBondContact O-N 3.04Å; Y23-S27 WeakPolarHBondContact O-CB 3.33Å; Y23-S27 PolarHBondContact O-N 2.97Å; Y23-L297 HydrophobicContact CD1-CD2 3.85Å; Y23-L297 HydrophobicContact CD1-CG 4.44Å; Y23-L297 HydrophobicContact CD2-CD2 3.65Å; Y23-L297 HydrophobicContact CD2-CG 3.74Å; Y23-L297 HydrophobicContact CE1-CD1 4.16Å; Y23-L297 HydrophobicContact CE1-CD2 3.97Å; Y23-L297 HydrophobicContact CE1-CG 4.14Å; Y23-L297 HydrophobicContact CE2-CB 4.49Å; Y23-L297 HydrophobicContact CE2-CD1 3.98Å; Y23-L297 HydrophobicContact CE2-CD2 3.78Å; Y23-L297 HydrophobicContact CE2-CG 3.39Å; Y23-L297 HydrophobicContact CG-CD2 3.68Å; Y23-L297 HydrophobicContact CG-CG 4.25Å; Y23-W298 VanDerWaalsContact CA-CH2 3.45Å; Y23-W298 HydrophobicContact CD2-CD2 4.21Å; Y23-W298 AromaticContact CD2-CE3 3.91Å; Y23-W298 HydrophobicContact CD2-CE3 3.91Å; Y23-W298 HydrophobicContact CD2-CH2 4.23Å; Y23-W298 HydrophobicContact CD2-CZ2 4.49Å; Y23-W298 AromaticContact CD2-CZ3 3.91Å; Y23-W298 HydrophobicContact CD2-CZ3 3.91Å; Y23-L301 HydrophobicContact CD2-CD2 4.06Å; Y23-L301 HydrophobicContact CE2-CB 3.73Å; Y23-L301 HydrophobicContact CE2-CD2 3.66Å; Y23-L301 HydrophobicContact CE2-CG 4.19Å
24K92.1Very high88.2Confident25 Ų2566.1 Ų66.111%0.10935%0.354CS..Hα-helixtrans-59-50.2179.4-66.6-172.4-179.8-168.30111.1D18 Y19 S20 M21 E22 I28 L86D18-K24 WeakPolarHBondContact OD1-CE 3.33Å; D18-K24 IonicContact OD1-NZ 2.72Å; D18-K24 PolarHBondContact OD1-NZ 3.39Å; D18-K24 IonicContact OD2-NZ 2.87Å; D18-K24 PolarHBondContact OD2-NZ 3.35Å; Y19-K24 WeakPolarHBondContact O-CE 3.33Å; S20-K24 PolarHBondContact O-N 3.31Å; M21-K24 PolarHBondContact O-N 3.36Å; M21-K24 HydrophobicContact SD-CD 4.45Å; E22-K24 PolarHBondContact O-N 3.46Å; K24-I28 HydrophobicContact CB-CD1 4.49Å; K24-I28 VanDerWaalsContact O-CB 3.26Å; K24-I28 WeakPolarHBondContact O-CB 3.39Å; K24-I28 WeakPolarHBondContact O-CD1 3.48Å; K24-I28 WeakPolarHBondContact O-CG1 3.06Å; K24-I28 PolarHBondContact O-N 3.36Å; K24-L86 PolarHBondContact NZ-O 2.89Å; K24-L86 VanDerWaalsContact NZ-O 3.14Å
25V93Very high89.3Confident98 Ų9864 Ų6459%0.59433%0.332SS*.Hα-helixtrans-62-48.4-179.31720000111M21 E22 Y23 F29M21-V25 WeakPolarHBondContact O-CB 3.44Å; M21-V25 VanDerWaalsContact O-CG2 3.28Å; M21-V25 WeakPolarHBondContact O-CG2 3.22Å; M21-V25 PolarHBondContact O-N 3.39Å; E22-V25 PolarHBondContact O-N 3.35Å; Y23-V25 PolarHBondContact O-N 2.86Å; V25-F29 WeakPolarHBondContact O-CB 3.43Å; V25-F29 PolarHBondContact O-N 2.81Å
26V93.4Very high90.5Very high54 Ų5461.7 Ų61.733%0.32732%0.324SS..Hα-helixtrans-63.9-49.5-178.9171.40000111.2E22 Y23 F29 F30 W298 L301E22-V26 WeakPolarHBondContact O-CB 3.42Å; E22-V26 WeakPolarHBondContact O-CG2 3.22Å; E22-V26 PolarHBondContact O-N 3.48Å; Y23-V26 PolarHBondContact O-N 3.04Å; V26-F29 PolarHBondContact O-N 3.09Å; V26-F30 HydrophobicContact CG1-CD2 3.74Å; V26-F30 HydrophobicContact CG1-CE2 3.85Å; V26-F30 VanDerWaalsContact O-CD2 3.28Å; V26-F30 WeakPolarHBondContact O-CD2 3.26Å; V26-F30 PolarHBondContact O-N 3.45Å; V26-F30 VanDerWaalsContact O-N 3.09Å; V26-W298 HydrophobicContact CB-CZ3 4.38Å; V26-W298 HydrophobicContact CG1-CZ3 4.32Å; V26-L301 HydrophobicContact CG1-CD2 4.27Å
27S92.3Very high91.3Very high0 Ų062.9 Ų62.90%033%0.334CS..Hα-helixtrans-57.9-54.3179.6178.80000111.1Y23 F29 F30 V31 S85 L301Y23-S27 WeakPolarHBondContact O-CB 3.33Å; Y23-S27 PolarHBondContact O-N 2.97Å; S27-F29 PolarHBondContact O-N 3.06Å; S27-F30 PolarHBondContact O-N 3.21Å; S27-V31 WeakPolarHBondContact O-CB 3.27Å; S27-V31 WeakPolarHBondContact O-CG2 3.36Å; S27-V31 PolarHBondContact O-N 3.39Å; S27-S85 PolarHBondContact OG-OG 3.32Å; S27-L301 WeakPolarHBondContact OG-CD1 3.21Å
28I93.6Very high92.1Very high33 Ų3357.5 Ų57.517%0.16930%0.301CS..Hα-helixtrans-61.8-44.8-176.8-67168000110.8K24 I32 I82 L86K24-I28 HydrophobicContact CB-CD1 4.49Å; K24-I28 VanDerWaalsContact O-CB 3.26Å; K24-I28 WeakPolarHBondContact O-CB 3.39Å; K24-I28 WeakPolarHBondContact O-CD1 3.48Å; K24-I28 WeakPolarHBondContact O-CG1 3.06Å; K24-I28 PolarHBondContact O-N 3.36Å; I28-I32 HydrophobicContact CG2-CD1 3.52Å; I28-I32 HydrophobicContact CG2-CG1 4.27Å; I28-I32 VanDerWaalsContact O-CB 3.32Å; I28-I32 WeakPolarHBondContact O-CB 3.34Å; I28-I32 VanDerWaalsContact O-CG1 3.24Å; I28-I32 WeakPolarHBondContact O-CG1 3.31Å; I28-I32 PolarHBondContact O-N 3.05Å; I28-I82 HydrophobicContact CG1-CG2 4.28Å; I28-I82 HydrophobicContact CG2-CG2 4.26Å; I28-L86 HydrophobicContact CD1-CD2 3.44Å; I28-L86 VanDerWaalsContact CD1-CD2 3.44Å; I28-L86 HydrophobicContact CD1-CG 3.75Å
29F94.7Very high92.8Very high124 Ų12456 Ų5654%0.54429%0.293SS..Hα-helixtrans-59-52.3179.6175.4-99.9000112.1V25 V26 S27 L33V25-F29 WeakPolarHBondContact O-CB 3.43Å; V25-F29 PolarHBondContact O-N 2.81Å; V26-F29 PolarHBondContact O-N 3.09Å; S27-F29 PolarHBondContact O-N 3.06Å; F29-L33 HydrophobicContact CE1-CD2 4.42Å; F29-L33 HydrophobicContact CZ-CD2 4.5Å; F29-L33 WeakPolarHBondContact O-CB 3.19Å; F29-L33 PolarHBondContact O-N 2.84Å
30F94.1Very high93.2Very high88 Ų8857.8 Ų57.839%0.38631%0.309SS..Hα-helixtrans-67.2-42.7-179-80.4-64.2000112.3V26 S27 L33 I34 I305V26-F30 HydrophobicContact CG1-CD2 3.74Å; V26-F30 HydrophobicContact CG1-CE2 3.85Å; V26-F30 VanDerWaalsContact O-CD2 3.28Å; V26-F30 WeakPolarHBondContact O-CD2 3.26Å; V26-F30 PolarHBondContact O-N 3.45Å; V26-F30 VanDerWaalsContact O-N 3.09Å; S27-F30 PolarHBondContact O-N 3.21Å; F30-L33 PolarHBondContact O-N 3.07Å; F30-I34 HydrophobicContact CB-CD1 4.35Å; F30-I34 WeakPolarHBondContact O-CB 3.39Å; F30-I34 WeakPolarHBondContact O-CD1 3.49Å; F30-I34 WeakPolarHBondContact O-CG1 3.31Å; F30-I34 PolarHBondContact O-N 3.22Å; F30-I305 HydrophobicContact CB-CD1 3.98Å; F30-I305 HydrophobicContact CB-CG1 4.43Å; F30-I305 HydrophobicContact CD2-CD1 4.36Å; F30-I305 HydrophobicContact CG-CD1 4.28Å
31V94.2Very high93.3Very high0 Ų055.9 Ų55.90%030%0.298CS..Hα-helixtrans-63.2-44.5179.9174.80000110.8S27 C35 G78 I82 Y308S27-V31 WeakPolarHBondContact O-CB 3.27Å; S27-V31 WeakPolarHBondContact O-CG2 3.36Å; S27-V31 PolarHBondContact O-N 3.39Å; V31-C35 WeakPolarHBondContact O-CB 3.3Å; V31-C35 PolarHBondContact O-N 3.37Å; V31-C35 PolarHBondContact O-SG 3.15Å; V31-G78 VanDerWaalsContact CG1-O 3.29Å; V31-G78 WeakPolarHBondContact CG1-O 3.4Å; V31-I82 HydrophobicContact CB-CG1 4.26Å; V31-I82 HydrophobicContact CG1-CD1 4.12Å; V31-I82 HydrophobicContact CG1-CG1 3.65Å; V31-Y308 HydrophobicContact CG1-CE2 4.41Å; V31-Y308 HydrophobicContact CG2-CD2 4.21Å; V31-Y308 HydrophobicContact CG2-CE2 3.95Å
32I94.9Very high93.6Very high94 Ų9449 Ų4948%0.48226%0.264SS..Hα-helixtrans-61.7-47.1176.2-72.4174.4000110.9I28 G36 I82I28-I32 HydrophobicContact CG2-CD1 3.52Å; I28-I32 HydrophobicContact CG2-CG1 4.27Å; I28-I32 VanDerWaalsContact O-CB 3.32Å; I28-I32 WeakPolarHBondContact O-CB 3.34Å; I28-I32 VanDerWaalsContact O-CG1 3.24Å; I28-I32 WeakPolarHBondContact O-CG1 3.31Å; I28-I32 PolarHBondContact O-N 3.05Å; I32-G36 WeakPolarHBondContact O-CA 3.38Å; I32-G36 PolarHBondContact O-N 3.14Å; I32-I82 HydrophobicContact CD1-CD1 4.42Å; I32-I82 HydrophobicContact CG1-CD1 3.6Å; I32-I82 HydrophobicContact CG1-CG1 4.39Å
33L95Very high93.8Very high81 Ų8145 Ų4542%0.42425%0.249SC..Hα-helixtrans-60.8-50.2-178.8-179.864.9000111.4F29 F30 I37F29-L33 HydrophobicContact CE1-CD2 4.42Å; F29-L33 HydrophobicContact CZ-CD2 4.5Å; F29-L33 WeakPolarHBondContact O-CB 3.19Å; F29-L33 PolarHBondContact O-N 2.84Å; F30-L33 PolarHBondContact O-N 3.07Å; L33-I37 HydrophobicContact CD1-CD1 3.87Å; L33-I37 HydrophobicContact CG-CD1 4.1Å; L33-I37 VanDerWaalsContact O-CG1 3.3Å; L33-I37 WeakPolarHBondContact O-CG1 3.39Å; L33-I37 PolarHBondContact O-N 2.91Å
34I94.9Very high93.7Very high12 Ų1247.1 Ų47.16%0.06226%0.259CS..Hα-helixtrans-68.7-46.7-176.5-64.7162.6000110.6F30 G36 I37 G38 I305 L309 A312F30-I34 HydrophobicContact CB-CD1 4.35Å; F30-I34 WeakPolarHBondContact O-CB 3.39Å; F30-I34 WeakPolarHBondContact O-CD1 3.49Å; F30-I34 WeakPolarHBondContact O-CG1 3.31Å; F30-I34 PolarHBondContact O-N 3.22Å; I34-G36 VanDerWaalsContact C-N 3.34Å; I34-G36 PolarHBondContact O-N 2.97Å; I34-I37 PolarHBondContact O-N 2.93Å; I34-G38 PolarHBondContact O-N 3.03Å; I34-I305 HydrophobicContact CD1-CG2 3.77Å; I34-L309 HydrophobicContact CD1-CD2 3.9Å; I34-L309 HydrophobicContact CD1-CG 3.88Å; I34-L309 HydrophobicContact CG1-CD2 3.86Å; I34-L309 HydrophobicContact CG1-CG 4.35Å; I34-L309 HydrophobicContact CG2-CD2 4.13Å; I34-L309 HydrophobicContact CG2-CG 4.37Å; I34-A312 HydrophobicContact CG2-CB 3.7Å
35C94.9Very high93.7Very high1 Ų146 Ų461%0.00725%0.254CS..Hα-helixtrans-64.7-40.1178.1-65.60000111.3V31 G38 I39V31-C35 WeakPolarHBondContact O-CB 3.3Å; V31-C35 PolarHBondContact O-N 3.37Å; V31-C35 PolarHBondContact O-SG 3.15Å; C35-G38 PolarHBondContact O-N 3.45Å; C35-I39 HydrophobicContact CB-CD1 4.33Å; C35-I39 VanDerWaalsContact O-CB 3.24Å; C35-I39 WeakPolarHBondContact O-CB 3.34Å; C35-I39 WeakPolarHBondContact O-CD1 3.45Å; C35-I39 WeakPolarHBondContact O-CG1 3.39Å; C35-I39 PolarHBondContact O-N 2.78Å
36G93.9Very high93.6Very high36 Ų3642.7 Ų42.737%0.37123%0.233SC..Hα-helixtrans-59.8-51.9176.700000112.2I32 I34 G38 V40I32-G36 WeakPolarHBondContact O-CA 3.38Å; I32-G36 PolarHBondContact O-N 3.14Å; I34-G36 VanDerWaalsContact C-N 3.34Å; I34-G36 PolarHBondContact O-N 2.97Å; G36-G38 PolarHBondContact O-N 3.31Å; G36-V40 WeakPolarHBondContact O-CB 3.32Å; G36-V40 VanDerWaalsContact O-CG2 3.29Å; G36-V40 WeakPolarHBondContact O-CG2 3.04Å; G36-V40 PolarHBondContact O-N 3.17Å; G36-V40 VanDerWaalsContact O-N 3.13Å
37I93.1Very high93.5Very high91 Ų9143.8 Ų43.847%0.46724%0.237SC..Hα-helixtrans-61.7-45.7177.5-66.5167.6000110.7L33 I34 G41L33-I37 HydrophobicContact CD1-CD1 3.87Å; L33-I37 HydrophobicContact CG-CD1 4.1Å; L33-I37 VanDerWaalsContact O-CG1 3.3Å; L33-I37 WeakPolarHBondContact O-CG1 3.39Å; L33-I37 PolarHBondContact O-N 2.91Å; I34-I37 PolarHBondContact O-N 2.93Å; I37-G41 PolarHBondContact O-N 3.13Å
38G94.6Very high93.2Very high0 Ų043.9 Ų43.90%024%0.237CC..Hα-helixtrans-66.8-42.2-177.300000113.3I34 C35 G36 G41 N42 L74I34-G38 PolarHBondContact O-N 3.03Å; C35-G38 PolarHBondContact O-N 3.45Å; G36-G38 PolarHBondContact O-N 3.31Å; G38-G41 PolarHBondContact O-N 2.94Å; G38-N42 VanDerWaalsContact O-CB 3.31Å; G38-N42 WeakPolarHBondContact O-CB 3.43Å; G38-N42 PolarHBondContact O-N 3.46Å; G38-N42 PolarHBondContact O-ND2 2.79Å; G38-L74 VanDerWaalsContact C-CD1 3.41Å
39I95.6Very high92.9Very high44 Ų4442.5 Ų42.523%0.22623%0.231CC..Hα-helixtrans-65-50.9178.5-70.2165.4000109.8C35 G41 N42 V43 L71 L74 T75C35-I39 HydrophobicContact CB-CD1 4.33Å; C35-I39 VanDerWaalsContact O-CB 3.24Å; C35-I39 WeakPolarHBondContact O-CB 3.34Å; C35-I39 WeakPolarHBondContact O-CD1 3.45Å; C35-I39 WeakPolarHBondContact O-CG1 3.39Å; C35-I39 PolarHBondContact O-N 2.78Å; I39-G41 VanDerWaalsContact C-N 3.33Å; I39-G41 PolarHBondContact O-N 3.31Å; I39-N42 PolarHBondContact O-N 3.21Å; I39-V43 HydrophobicContact CG2-CG2 4.38Å; I39-V43 WeakPolarHBondContact O-CB 3.49Å; I39-V43 VanDerWaalsContact O-CG2 3.27Å; I39-V43 WeakPolarHBondContact O-CG2 3.19Å; I39-V43 PolarHBondContact O-N 3.03Å; I39-L71 HydrophobicContact CB-CD2 4.15Å; I39-L71 HydrophobicContact CG1-CD2 4.16Å; I39-L71 HydrophobicContact CG2-CD2 3.99Å; I39-L74 HydrophobicContact CD1-CB 4.44Å; I39-L74 HydrophobicContact CG1-CB 3.99Å; I39-L74 HydrophobicContact CG1-CD1 4.15Å; I39-T75 HydrophobicContact CD1-CG2 4.23Å
40V93.6Very high92.6Very high89 Ų8941.2 Ų41.254%0.53923%0.229SC..Hα-helixtrans-59.4-46.8178.7173.50000110.6G36 M44G36-V40 WeakPolarHBondContact O-CB 3.32Å; G36-V40 VanDerWaalsContact O-CG2 3.29Å; G36-V40 WeakPolarHBondContact O-CG2 3.04Å; G36-V40 PolarHBondContact O-N 3.17Å; G36-V40 VanDerWaalsContact O-N 3.13Å; V40-M44 HydrophobicContact CG1-CG 4.45Å; V40-M44 WeakPolarHBondContact O-CB 3.24Å; V40-M44 WeakPolarHBondContact O-CG 3.37Å; V40-M44 PolarHBondContact O-N 2.96Å
41G92.1Very high92.1Very high16 Ų1640.2 Ų40.217%0.16523%0.23CC..Hα-helixtrans-60.8-47.9179.800000113.1I37 G38 I39 M44 V45I37-G41 PolarHBondContact O-N 3.13Å; G38-G41 PolarHBondContact O-N 2.94Å; I39-G41 VanDerWaalsContact C-N 3.33Å; I39-G41 PolarHBondContact O-N 3.31Å; G41-M44 WeakPolarHBondContact O-CB 3.48Å; G41-M44 PolarHBondContact O-N 2.85Å; G41-V45 WeakPolarHBondContact O-CG2 3.48Å; G41-V45 PolarHBondContact O-N 2.79Å
42N94.8Very high91.6Very high1 Ų142.3 Ų42.31%0.00524%0.243CC..Hα-helixtrans-71.3-38.2-177.6-75.8-59.6000112.2G38 I39 M44 V45 I46 A67 L71 S311 P315G38-N42 VanDerWaalsContact O-CB 3.31Å; G38-N42 WeakPolarHBondContact O-CB 3.43Å; G38-N42 PolarHBondContact O-N 3.46Å; G38-N42 PolarHBondContact O-ND2 2.79Å; I39-N42 PolarHBondContact O-N 3.21Å; N42-M44 VanDerWaalsContact C-N 3.3Å; N42-M44 PolarHBondContact O-N 2.96Å; N42-V45 WeakPolarHBondContact O-CB 3.36Å; N42-V45 PolarHBondContact O-N 3.12Å; N42-I46 WeakPolarHBondContact O-CG1 3.16Å; N42-I46 PolarHBondContact O-N 2.82Å; N42-I46 VanDerWaalsContact O-N 3.13Å; N42-A67 HydrophobicContact CB-CB 4.05Å; N42-A67 WeakPolarHBondContact OD1-CA 3.34Å; N42-L71 HydrophobicContact CB-CD1 4.26Å; N42-L71 HydrophobicContact CB-CD2 3.92Å; N42-L71 HydrophobicContact CB-CG 3.71Å; N42-S311 PolarHBondContact ND2-O 3.33Å; N42-P315 HydrophobicContact CB-CG 4.33Å; N42-P315 VanDerWaalsContact OD1-CG 3.3Å; N42-P315 WeakPolarHBondContact OD1-CG 3.29Å
43V94.2Very high90.8Very high58 Ų5846.2 Ų46.235%0.35226%0.257SS..Hα-helixtrans-59-44.1171.1170.10000110.4I39 V45 I46 L47 L71I39-V43 HydrophobicContact CG2-CG2 4.38Å; I39-V43 WeakPolarHBondContact O-CB 3.49Å; I39-V43 VanDerWaalsContact O-CG2 3.27Å; I39-V43 WeakPolarHBondContact O-CG2 3.19Å; I39-V43 PolarHBondContact O-N 3.03Å; V43-V45 VanDerWaalsContact C-N 3.35Å; V43-V45 PolarHBondContact O-N 3.42Å; V43-I46 PolarHBondContact O-N 3.47Å; V43-L47 HydrophobicContact CG1-CD1 3.87Å; V43-L47 HydrophobicContact CG1-CG 4.19Å; V43-L47 WeakPolarHBondContact O-CG 3.49Å; V43-L47 PolarHBondContact O-N 3.3Å; V43-L71 HydrophobicContact CG2-CD1 3.98Å; V43-L71 HydrophobicContact CG2-CD2 3.98Å
44M89.6Confident89.9Confident44 Ų4448.9 Ų48.922%0.21727%0.267CS..Hα-helixtrans-62.1-39.2177.5-73.9-72.1-158.600112.8V40 G41 N42 I46 L47 V48 F329 L332V40-M44 HydrophobicContact CG1-CG 4.45Å; V40-M44 WeakPolarHBondContact O-CB 3.24Å; V40-M44 WeakPolarHBondContact O-CG 3.37Å; V40-M44 PolarHBondContact O-N 2.96Å; G41-M44 WeakPolarHBondContact O-CB 3.48Å; G41-M44 PolarHBondContact O-N 2.85Å; N42-M44 VanDerWaalsContact C-N 3.3Å; N42-M44 PolarHBondContact O-N 2.96Å; M44-I46 VanDerWaalsContact C-N 3.33Å; M44-I46 PolarHBondContact O-N 2.97Å; M44-L47 PolarHBondContact O-N 3.16Å; M44-V48 WeakPolarHBondContact O-CB 3.42Å; M44-V48 VanDerWaalsContact O-CG2 3.28Å; M44-V48 WeakPolarHBondContact O-CG2 3.41Å; M44-V48 PolarHBondContact O-N 3.4Å; M44-F329 HydrophobicContact CB-CD2 4.32Å; M44-F329 HydrophobicContact CB-CE2 3.98Å; M44-F329 HydrophobicContact CE-CE2 4.2Å; M44-F329 HydrophobicContact CG-CE2 3.83Å; M44-F329 HydrophobicContact SD-CE2 4.04Å; M44-L332 HydrophobicContact SD-CD2 4Å
45V90.6Very high89.1Confident1 Ų149 Ų491%0.00627%0.267CS..Hα-helixtrans-57.3-47.91731720000110.9G41 N42 V43 V49 L63 A67 P315 Y318 F325G41-V45 WeakPolarHBondContact O-CG2 3.48Å; G41-V45 PolarHBondContact O-N 2.79Å; N42-V45 WeakPolarHBondContact O-CB 3.36Å; N42-V45 PolarHBondContact O-N 3.12Å; V43-V45 VanDerWaalsContact C-N 3.35Å; V43-V45 PolarHBondContact O-N 3.42Å; V45-V49 WeakPolarHBondContact O-CG2 3.28Å; V45-V49 PolarHBondContact O-N 3.03Å; V45-L63 HydrophobicContact CG1-CB 4.33Å; V45-A67 HydrophobicContact CB-CB 4.18Å; V45-A67 HydrophobicContact CG1-CB 4.04Å; V45-P315 HydrophobicContact CG2-CB 4.07Å; V45-P315 HydrophobicContact CG2-CG 4.18Å; V45-Y318 HydrophobicContact CG2-CD2 4.38Å; V45-F325 HydrophobicContact CB-CE2 4.49Å; V45-F325 HydrophobicContact CB-CZ 4.14Å; V45-F325 HydrophobicContact CG1-CE2 4.48Å; V45-F325 HydrophobicContact CG2-CE1 4.38Å; V45-F325 HydrophobicContact CG2-CE2 4.16Å; V45-F325 HydrophobicContact CG2-CZ 3.52Å
46I92.6Very high88.6Confident30 Ų3055.1 Ų55.115%0.15429%0.29CS..Hα-helixtrans-61.1-50.3178.6-63.4170.6000110.1N42 V43 M44 V48 V49 L50 V64 A67 V68 L71N42-I46 WeakPolarHBondContact O-CG1 3.16Å; N42-I46 PolarHBondContact O-N 2.82Å; N42-I46 VanDerWaalsContact O-N 3.13Å; V43-I46 PolarHBondContact O-N 3.47Å; M44-I46 VanDerWaalsContact C-N 3.33Å; M44-I46 PolarHBondContact O-N 2.97Å; I46-V48 PolarHBondContact O-N 2.85Å; I46-V49 PolarHBondContact O-N 3.03Å; I46-L50 HydrophobicContact CG2-CD1 3.59Å; I46-L50 HydrophobicContact CG2-CG 4.21Å; I46-L50 WeakPolarHBondContact O-CB 3.32Å; I46-L50 VanDerWaalsContact O-CG 3.28Å; I46-L50 WeakPolarHBondContact O-CG 3.25Å; I46-L50 PolarHBondContact O-N 3.46Å; I46-V64 HydrophobicContact CG1-CG1 4.36Å; I46-A67 HydrophobicContact CD1-CB 4.16Å; I46-A67 HydrophobicContact CG1-CB 3.82Å; I46-V68 HydrophobicContact CD1-CG2 3.78Å; I46-L71 HydrophobicContact CD1-CD1 3.59Å
47L89.4Confident88.2Confident76 Ų7655.9 Ų55.940%0.39829%0.287SS..Hα-helixtrans-59.9-47.5-179.3-69.7176.6000112.3V43 M44 V49 L50 T51 L332V43-L47 HydrophobicContact CG1-CD1 3.87Å; V43-L47 HydrophobicContact CG1-CG 4.19Å; V43-L47 WeakPolarHBondContact O-CG 3.49Å; V43-L47 PolarHBondContact O-N 3.3Å; M44-L47 PolarHBondContact O-N 3.16Å; L47-V49 VanDerWaalsContact C-N 3.33Å; L47-V49 PolarHBondContact O-N 3.48Å; L47-L50 PolarHBondContact O-N 3.49Å; L47-T51 VanDerWaalsContact O-CB 3.28Å; L47-T51 WeakPolarHBondContact O-CB 3.44Å; L47-T51 WeakPolarHBondContact O-CG2 3.49Å; L47-T51 PolarHBondContact O-N 3.29Å; L47-T51 PolarHBondContact O-OG1 3.48Å; L47-L332 HydrophobicContact CB-CD2 3.89Å; L47-L332 HydrophobicContact CD1-CD2 4.48Å
48V87.3Confident87.8Confident2 Ų252.5 Ų52.51%0.01227%0.272CS..Hα-helixtrans-59.3-44-178.9164.80000111.5M44 I46 T51 T52 M55 F325 L332M44-V48 WeakPolarHBondContact O-CB 3.42Å; M44-V48 VanDerWaalsContact O-CG2 3.28Å; M44-V48 WeakPolarHBondContact O-CG2 3.41Å; M44-V48 PolarHBondContact O-N 3.4Å; I46-V48 PolarHBondContact O-N 2.85Å; V48-T51 PolarHBondContact O-OG1 3.38Å; V48-T52 VanDerWaalsContact O-CB 3.26Å; V48-T52 WeakPolarHBondContact O-CB 3.37Å; V48-T52 PolarHBondContact O-N 3.41Å; V48-T52 VanDerWaalsContact O-N 3.17Å; V48-T52 PolarHBondContact O-OG1 3.38Å; V48-M55 HydrophobicContact CG1-CE 4.37Å; V48-F325 HydrophobicContact CB-CE2 4.3Å; V48-F325 HydrophobicContact CG1-CD2 4.29Å; V48-F325 HydrophobicContact CG1-CE2 4.06Å; V48-L332 HydrophobicContact CG2-CD2 4.08Å
49V87.6Confident87.3Confident5 Ų553.2 Ų53.23%0.0328%0.276CS..Hα-helixtrans-72.7-39.8-178.5176.40000111.6V45 I46 L47 N60 V64V45-V49 WeakPolarHBondContact O-CG2 3.28Å; V45-V49 PolarHBondContact O-N 3.03Å; I46-V49 PolarHBondContact O-N 3.03Å; L47-V49 VanDerWaalsContact C-N 3.33Å; L47-V49 PolarHBondContact O-N 3.48Å; V49-N60 HydrophobicContact CG1-CB 3.91Å; V49-N60 HydrophobicContact CG2-CB 3.94Å; V49-V64 HydrophobicContact CB-CG2 3.62Å; V49-V64 HydrophobicContact CG1-CG2 3.62Å; V49-V64 HydrophobicContact CG2-CG2 4Å
50L87.5Confident87Confident96 Ų9652.1 Ų52.150%0.50327%0.27SS..Hα-helixtrans-73.8-36.8-179.1-67.1-177.3000112.7I46 L47 R56I46-L50 HydrophobicContact CG2-CD1 3.59Å; I46-L50 HydrophobicContact CG2-CG 4.21Å; I46-L50 WeakPolarHBondContact O-CB 3.32Å; I46-L50 VanDerWaalsContact O-CG 3.28Å; I46-L50 WeakPolarHBondContact O-CG 3.25Å; I46-L50 PolarHBondContact O-N 3.46Å; L47-L50 PolarHBondContact O-N 3.49Å; L50-R56 PolarHBondContact O-NE 3.34Å; L50-R56 PolarHBondContact O-NH2 3.5Å
51T84.3Confident86.8Confident67 Ų6749 Ų4941%0.41125%0.252SS..Hα-helixtrans-80.2-33.1-17857.60000113.2L47 V48L47-T51 VanDerWaalsContact O-CB 3.28Å; L47-T51 WeakPolarHBondContact O-CB 3.44Å; L47-T51 WeakPolarHBondContact O-CG2 3.49Å; L47-T51 PolarHBondContact O-N 3.29Å; L47-T51 PolarHBondContact O-OG1 3.48Å; V48-T51 PolarHBondContact O-OG1 3.38Å
52T82.3Confident86.8Confident45 Ų4548.9 Ų48.928%0.27625%0.247SC..  trans-96.6105.1-175-53.90000111.3V48 H54 M55V48-T52 VanDerWaalsContact O-CB 3.26Å; V48-T52 WeakPolarHBondContact O-CB 3.37Å; V48-T52 PolarHBondContact O-N 3.41Å; V48-T52 VanDerWaalsContact O-N 3.17Å; V48-T52 PolarHBondContact O-OG1 3.38Å; T52-H54 VanDerWaalsContact C-N 3.29Å; T52-H54 PolarHBondContact O-N 2.94Å; T52-M55 HydrophobicContact CG2-CB 4.18Å; T52-M55 HydrophobicContact CG2-CG 3.58Å; T52-M55 WeakPolarHBondContact O-CB 3.19Å; T52-M55 PolarHBondContact O-N 2.89Å
53K79.6Confident86.6Confident176 Ų17649.5 Ų49.577%0.76525%0.25SS*.G310 helixtrans-51.5-42.9-178.8-70.6-176.5-178.2178.30113.5M55 R56K53-M55 PolarHBondContact O-N 3.12Å; K53-R56 WeakPolarHBondContact O-CB 3.4Å; K53-R56 PolarHBondContact O-N 2.98Å
54H76.4Confident86.5Confident137 Ų13747.9 Ų47.963%0.63424%0.241SC*.G310 helixtrans-67.4-18.4179.3180-92.6000113.7T52 R56T52-H54 VanDerWaalsContact C-N 3.29Å; T52-H54 PolarHBondContact O-N 2.94Å; H54-R56 VanDerWaalsContact C-N 3.35Å
55M77.8Confident86.8Confident13 Ų1346.1 Ų46.16%0.06423%0.233CC..G310 helixtrans-890.3177.1-64.4-68.4-78.800112.5V48 T52 K53 T57 N60 F325V48-M55 HydrophobicContact CG1-CE 4.37Å; T52-M55 HydrophobicContact CG2-CB 4.18Å; T52-M55 HydrophobicContact CG2-CG 3.58Å; T52-M55 WeakPolarHBondContact O-CB 3.19Å; T52-M55 PolarHBondContact O-N 2.89Å; K53-M55 PolarHBondContact O-N 3.12Å; M55-T57 PolarHBondContact O-N 3.45Å; M55-N60 WeakPolarHBondContact O-CB 3.32Å; M55-N60 PolarHBondContact O-ND2 3.33Å; M55-F325 HydrophobicContact CE-CD2 4.39Å
56R83.1Confident86.9Confident130 Ų13046.3 Ų46.349%0.49123%0.233SC..  trans-81.370.7176.7-62.9-179.6-177.3174-2110.6L50 K53 H54 L139L50-R56 PolarHBondContact O-NE 3.34Å; L50-R56 PolarHBondContact O-NH2 3.5Å; K53-R56 WeakPolarHBondContact O-CB 3.4Å; K53-R56 PolarHBondContact O-N 2.98Å; H54-R56 VanDerWaalsContact C-N 3.35Å; R56-L139 WeakPolarHBondContact O-CD2 3.16Å
57T85.9Confident87Confident52 Ų5245 Ų4532%0.31923%0.227SC..  trans-105.8157175.463.30000110.5M55 T59 N60 C61 L139M55-T57 PolarHBondContact O-N 3.45Å; T57-T59 VanDerWaalsContact C-N 3.26Å; T57-T59 PolarHBondContact O-N 2.91Å; T57-N60 PolarHBondContact O-N 3.43Å; T57-N60 VanDerWaalsContact OG1-CG 3.24Å; T57-N60 PolarHBondContact OG1-N 2.86Å; T57-N60 PolarHBondContact OG1-ND2 2.72Å; T57-C61 PolarHBondContact O-N 3.44Å; T57-L139 VanDerWaalsContact C-CD2 3.45Å
58P84.4Confident87.3Confident21 Ų2144 Ų4414%0.13622%0.224CC..Hα-helixtrans-51-47.1179.3-23.529.3000112.3N60 C61 Y62 C137 L139 A142P58-N60 VanDerWaalsContact C-N 3.35Å; P58-N60 PolarHBondContact O-N 2.96Å; P58-C61 VanDerWaalsContact O-CB 3.32Å; P58-C61 WeakPolarHBondContact O-CB 3.25Å; P58-C61 PolarHBondContact O-N 2.85Å; P58-C61 VanDerWaalsContact O-N 3.12Å; P58-Y62 VanDerWaalsContact O-CD2 3.29Å; P58-Y62 WeakPolarHBondContact O-CD2 3.27Å; P58-Y62 PolarHBondContact O-N 3.28Å; P58-C137 WeakPolarHBondContact CG-O 3.38Å; P58-L139 HydrophobicContact CG-CD2 4.19Å; P58-L139 HydrophobicContact CG-CG 4.26Å; P58-A142 HydrophobicContact CB-CB 3.9Å
59T85.4Confident87.8Confident14 Ų1444 Ų449%0.08622%0.224CC..Hα-helixtrans-51.4-50.5172.3-60.70000113.1T57 C61 Y62 L63 F119 E122 R123T57-T59 VanDerWaalsContact C-N 3.26Å; T57-T59 PolarHBondContact O-N 2.91Å; T59-C61 PolarHBondContact O-N 3.41Å; T59-Y62 WeakPolarHBondContact O-CB 3.26Å; T59-Y62 PolarHBondContact O-N 3.36Å; T59-Y62 VanDerWaalsContact O-N 3.07Å; T59-L63 PolarHBondContact O-N 2.88Å; T59-L63 VanDerWaalsContact O-N 3.12Å; T59-F119 HydrophobicContact CG2-CD2 4.41Å; T59-F119 HydrophobicContact CG2-CE2 3.68Å; T59-E122 VanDerWaalsContact CA-OE1 3.26Å; T59-E122 WeakPolarHBondContact CA-OE1 3.45Å; T59-E122 VanDerWaalsContact CA-OE2 3.24Å; T59-E122 WeakPolarHBondContact CA-OE2 3.22Å; T59-E122 PolarHBondContact N-OE1 3.38Å; T59-E122 PolarHBondContact OG1-OE1 2.97Å; T59-E122 PolarHBondContact OG1-OE2 3.12Å; T59-R123 PolarHBondContact OG1-NH1 3.07Å
60N88.5Confident88.1Confident21 Ų2143.7 Ų43.711%0.11222%0.222CC..Hα-helixtrans-70.6-23.3-175.5-70.2-9.4000111.3V49 M55 T57 P58 L63 V64V49-N60 HydrophobicContact CG1-CB 3.91Å; V49-N60 HydrophobicContact CG2-CB 3.94Å; M55-N60 WeakPolarHBondContact O-CB 3.32Å; M55-N60 PolarHBondContact O-ND2 3.33Å; T57-N60 PolarHBondContact O-N 3.43Å; T57-N60 VanDerWaalsContact OG1-CG 3.24Å; T57-N60 PolarHBondContact OG1-N 2.86Å; T57-N60 PolarHBondContact OG1-ND2 2.72Å; P58-N60 VanDerWaalsContact C-N 3.35Å; P58-N60 PolarHBondContact O-N 2.96Å; N60-L63 PolarHBondContact O-N 3.05Å; N60-V64 WeakPolarHBondContact O-CG2 3.27Å; N60-V64 PolarHBondContact O-N 3.18Å
61C90.4Very high88.6Confident24 Ų2440.6 Ų40.616%0.16221%0.206CC..Hα-helixtrans-65-39.5168.2-650000112.2T57 P58 T59 L63 V64 S65 I146T57-C61 PolarHBondContact O-N 3.44Å; P58-C61 VanDerWaalsContact O-CB 3.32Å; P58-C61 WeakPolarHBondContact O-CB 3.25Å; P58-C61 PolarHBondContact O-N 2.85Å; P58-C61 VanDerWaalsContact O-N 3.12Å; T59-C61 PolarHBondContact O-N 3.41Å; C61-L63 VanDerWaalsContact C-N 3.33Å; C61-V64 PolarHBondContact O-N 3.37Å; C61-S65 PolarHBondContact O-N 3.38Å; C61-I146 HydrophobicContact CB-CD1 3.84Å; C61-I146 WeakPolarHBondContact O-CD1 3.28Å
62Y90.9Very high89.2Confident14 Ų1439 Ų396%0.05519%0.194CC..Hα-helixtrans-64.7-38.1173-68.4-68.5000112P58 T59 V64 S65 L66 A118 E122 A142 I145 I146P58-Y62 VanDerWaalsContact O-CD2 3.29Å; P58-Y62 WeakPolarHBondContact O-CD2 3.27Å; P58-Y62 PolarHBondContact O-N 3.28Å; T59-Y62 WeakPolarHBondContact O-CB 3.26Å; T59-Y62 PolarHBondContact O-N 3.36Å; T59-Y62 VanDerWaalsContact O-N 3.07Å; Y62-V64 VanDerWaalsContact C-N 3.33Å; Y62-V64 PolarHBondContact O-N 3.29Å; Y62-S65 WeakPolarHBondContact O-CB 3.41Å; Y62-S65 PolarHBondContact O-N 3.41Å; Y62-L66 WeakPolarHBondContact O-CB 3.4Å; Y62-L66 PolarHBondContact O-N 2.98Å; Y62-A118 HydrophobicContact CD1-CB 4.07Å; Y62-A118 HydrophobicContact CE1-CB 3.72Å; Y62-E122 HydrophobicContact CD2-CG 4.48Å; Y62-E122 VanDerWaalsContact CD2-OE2 3.27Å; Y62-E122 WeakPolarHBondContact CD2-OE2 3.37Å; Y62-E122 HydrophobicContact CE2-CB 4.11Å; Y62-E122 HydrophobicContact CE2-CG 4.05Å; Y62-A142 HydrophobicContact CE2-CB 3.88Å; Y62-I145 HydrophobicContact CE1-CB 4.44Å; Y62-I145 HydrophobicContact CE1-CG2 3.97Å; Y62-I145 VanDerWaalsContact OH-CD1 3.23Å; Y62-I145 WeakPolarHBondContact OH-CD1 3.33Å; Y62-I146 HydrophobicContact CD1-CD1 4.16Å; Y62-I146 HydrophobicContact CD1-CG1 3.89Å; Y62-I146 HydrophobicContact CE1-CD1 4.43Å; Y62-I146 HydrophobicContact CE1-CG1 3.93Å
63L90Very high89.8Confident13 Ų1336.9 Ų36.97%0.06818%0.181CC..Hα-helixtrans-62.7-38.8174.1-62.4-177.5000112.3V45 T59 N60 C61 L66 A67 F119 Y318V45-L63 HydrophobicContact CG1-CB 4.33Å; T59-L63 PolarHBondContact O-N 2.88Å; T59-L63 VanDerWaalsContact O-N 3.12Å; N60-L63 PolarHBondContact O-N 3.05Å; C61-L63 VanDerWaalsContact C-N 3.33Å; L63-L66 PolarHBondContact O-N 2.87Å; L63-A67 WeakPolarHBondContact O-CB 3.27Å; L63-A67 PolarHBondContact O-N 3.49Å; L63-F119 HydrophobicContact CD2-CD2 4.45Å; L63-F119 HydrophobicContact CD2-CE2 3.92Å; L63-F119 HydrophobicContact CD2-CZ 4.1Å; L63-F119 HydrophobicContact CG-CE2 4.43Å; L63-Y318 HydrophobicContact CD2-CD1 4.29Å; L63-Y318 HydrophobicContact CD2-CD2 4.48Å; L63-Y318 HydrophobicContact CD2-CE1 3.63Å; L63-Y318 HydrophobicContact CD2-CE2 3.86Å; L63-Y318 VanDerWaalsContact CD2-CZ 3.41Å
64V93Very high90.6Very high25 Ų2528.5 Ų28.515%0.15215%0.145CC..Hα-helixtrans-65.9-44.8173.6170.20000111.1I46 V49 N60 C61 Y62 L66 A67 V68I46-V64 HydrophobicContact CG1-CG1 4.36Å; V49-V64 HydrophobicContact CB-CG2 3.62Å; V49-V64 HydrophobicContact CG1-CG2 3.62Å; V49-V64 HydrophobicContact CG2-CG2 4Å; N60-V64 WeakPolarHBondContact O-CG2 3.27Å; N60-V64 PolarHBondContact O-N 3.18Å; C61-V64 PolarHBondContact O-N 3.37Å; Y62-V64 VanDerWaalsContact C-N 3.33Å; Y62-V64 PolarHBondContact O-N 3.29Å; V64-L66 VanDerWaalsContact C-N 3.29Å; V64-L66 PolarHBondContact O-N 3.34Å; V64-A67 PolarHBondContact O-N 3.4Å; V64-V68 HydrophobicContact CG1-CG2 4.5Å; V64-V68 WeakPolarHBondContact O-CG2 3.4Å; V64-V68 PolarHBondContact O-N 3.38Å
65S94.8Very high91.5Very high7 Ų725 Ų255%0.04913%0.133CC..Hα-helixtrans-56-46.3175.4-176.50000111.4C61 Y62 V68 A69 S115 W150C61-S65 PolarHBondContact O-N 3.38Å; Y62-S65 WeakPolarHBondContact O-CB 3.41Å; Y62-S65 PolarHBondContact O-N 3.41Å; S65-V68 PolarHBondContact O-N 3.4Å; S65-A69 PolarHBondContact O-N 3.17Å; S65-A69 VanDerWaalsContact O-N 3.1Å; S65-S115 PolarHBondContact OG-OG 2.72Å; S65-W150 PolarHBondContact OG-NE1 3.25Å
66L92.8Very high92.2Very high4 Ų424.9 Ų24.92%0.02113%0.134CC..Hα-helixtrans-63.3-44.9177.2-176.359.9000111.9Y62 L63 V64 V68 A69 D70 S112 I116 Y318Y62-L66 WeakPolarHBondContact O-CB 3.4Å; Y62-L66 PolarHBondContact O-N 2.98Å; L63-L66 PolarHBondContact O-N 2.87Å; V64-L66 VanDerWaalsContact C-N 3.29Å; V64-L66 PolarHBondContact O-N 3.34Å; L66-V68 VanDerWaalsContact C-N 3.31Å; L66-V68 PolarHBondContact O-N 2.91Å; L66-A69 PolarHBondContact O-N 2.98Å; L66-A69 VanDerWaalsContact O-N 3.17Å; L66-D70 WeakPolarHBondContact O-CB 3.27Å; L66-D70 PolarHBondContact O-N 3.28Å; L66-S112 WeakPolarHBondContact CD1-OG 3.3Å; L66-I116 HydrophobicContact CD1-CD1 4.21Å; L66-I116 HydrophobicContact CD1-CG1 3.82Å; L66-I116 HydrophobicContact CD2-CG1 4.06Å; L66-Y318 VanDerWaalsContact CD2-OH 3.25Å; L66-Y318 WeakPolarHBondContact CD2-OH 3.5Å
67A95.1Very high92.7Very high2 Ų219.2 Ų19.22%0.01712%0.115CC..Hα-helixtrans-61.8-36.3177.700000112.9N42 V45 I46 L63 V64 L71N42-A67 HydrophobicContact CB-CB 4.05Å; N42-A67 WeakPolarHBondContact OD1-CA 3.34Å; V45-A67 HydrophobicContact CB-CB 4.18Å; V45-A67 HydrophobicContact CG1-CB 4.04Å; I46-A67 HydrophobicContact CD1-CB 4.16Å; I46-A67 HydrophobicContact CG1-CB 3.82Å; L63-A67 WeakPolarHBondContact O-CB 3.27Å; L63-A67 PolarHBondContact O-N 3.49Å; V64-A67 PolarHBondContact O-N 3.4Å; A67-L71 WeakPolarHBondContact O-CB 3.38Å; A67-L71 VanDerWaalsContact O-CG 3.26Å; A67-L71 WeakPolarHBondContact O-CG 3.25Å; A67-L71 PolarHBondContact O-N 3.29Å
68V96.7Very high92.9Very high57 Ų5716.7 Ų16.735%0.34510%0.1SC..Hα-helixtrans-66.6-43.8174.3173.40000110.9I46 V64 S65 L66 L71 M72 W150I46-V68 HydrophobicContact CD1-CG2 3.78Å; V64-V68 HydrophobicContact CG1-CG2 4.5Å; V64-V68 WeakPolarHBondContact O-CG2 3.4Å; V64-V68 PolarHBondContact O-N 3.38Å; S65-V68 PolarHBondContact O-N 3.4Å; L66-V68 VanDerWaalsContact C-N 3.31Å; L66-V68 PolarHBondContact O-N 2.91Å; V68-L71 PolarHBondContact O-N 3.46Å; V68-M72 PolarHBondContact O-N 3.34Å; V68-M72 VanDerWaalsContact O-N 3.09Å; V68-W150 HydrophobicContact CB-CH2 4.48Å; V68-W150 HydrophobicContact CB-CZ2 4.15Å; V68-W150 HydrophobicContact CG1-CH2 3.77Å; V68-W150 HydrophobicContact CG1-CZ2 3.83Å
69A96.6Very high93.3Very high0 Ų019.3 Ų19.30%011%0.112CC..Hα-helixtrans-63.2-44.1176.600000111.8S65 L66 M72 V73 A111 W150S65-A69 PolarHBondContact O-N 3.17Å; S65-A69 VanDerWaalsContact O-N 3.1Å; L66-A69 PolarHBondContact O-N 2.98Å; L66-A69 VanDerWaalsContact O-N 3.17Å; A69-M72 WeakPolarHBondContact O-CB 3.42Å; A69-M72 PolarHBondContact O-N 3.5Å; A69-V73 WeakPolarHBondContact O-CG2 3.23Å; A69-V73 PolarHBondContact O-N 3.31Å; A69-A111 HydrophobicContact CB-CB 4.06Å; A69-W150 HydrophobicContact CB-CH2 4.21Å; A69-W150 HydrophobicContact CB-CZ2 4.17Å
70D95.7Very high93.6Very high0 Ų019.2 Ų19.20%011%0.111CC..Hα-helixtrans-64.8-40.1177.7-73.7-27000112.3L66 M72 V73 L74 S112 S311 N314L66-D70 WeakPolarHBondContact O-CB 3.27Å; L66-D70 PolarHBondContact O-N 3.28Å; D70-M72 VanDerWaalsContact C-N 3.28Å; D70-M72 PolarHBondContact O-N 3.31Å; D70-V73 PolarHBondContact O-N 3.01Å; D70-L74 VanDerWaalsContact O-CG 3.31Å; D70-L74 WeakPolarHBondContact O-CG 3.19Å; D70-L74 PolarHBondContact O-N 3.47Å; D70-S112 PolarHBondContact OD1-OG 3.38Å; D70-S311 WeakPolarHBondContact OD1-CA 3.27Å; D70-S311 WeakPolarHBondContact OD1-CB 3.2Å; D70-S311 PolarHBondContact OD1-OG 2.99Å; D70-N314 PolarHBondContact OD2-ND2 3.08Å
71L96.9Very high93.7Very high30 Ų3018.3 Ų18.316%0.15711%0.107CC..Hα-helixtrans-60.8-38.8172.5-77.8171.1000112.3I39 N42 V43 I46 A67 V68 L74 T75I39-L71 HydrophobicContact CB-CD2 4.15Å; I39-L71 HydrophobicContact CG1-CD2 4.16Å; I39-L71 HydrophobicContact CG2-CD2 3.99Å; N42-L71 HydrophobicContact CB-CD1 4.26Å; N42-L71 HydrophobicContact CB-CD2 3.92Å; N42-L71 HydrophobicContact CB-CG 3.71Å; V43-L71 HydrophobicContact CG2-CD1 3.98Å; V43-L71 HydrophobicContact CG2-CD2 3.98Å; I46-L71 HydrophobicContact CD1-CD1 3.59Å; A67-L71 WeakPolarHBondContact O-CB 3.38Å; A67-L71 VanDerWaalsContact O-CG 3.26Å; A67-L71 WeakPolarHBondContact O-CG 3.25Å; A67-L71 PolarHBondContact O-N 3.29Å; V68-L71 PolarHBondContact O-N 3.46Å; L71-L74 PolarHBondContact O-N 2.91Å; L71-T75 WeakPolarHBondContact O-CB 3.49Å; L71-T75 VanDerWaalsContact O-CG2 3.32Å; L71-T75 WeakPolarHBondContact O-CG2 3.49Å; L71-T75 PolarHBondContact O-N 2.86Å; L71-T75 PolarHBondContact O-OG1 3.18Å
72M96.2Very high93.7Very high34 Ų3418.5 Ų18.517%0.16711%0.106CC..Hα-helixtrans-63.5-42.4176.5-170179.5-68.800111V68 A69 D70 T75 A76 F104 L107 W150V68-M72 PolarHBondContact O-N 3.34Å; V68-M72 VanDerWaalsContact O-N 3.09Å; A69-M72 WeakPolarHBondContact O-CB 3.42Å; A69-M72 PolarHBondContact O-N 3.5Å; D70-M72 VanDerWaalsContact C-N 3.28Å; D70-M72 PolarHBondContact O-N 3.31Å; M72-T75 PolarHBondContact O-OG1 3.46Å; M72-A76 WeakPolarHBondContact O-CB 3.09Å; M72-A76 PolarHBondContact O-N 2.93Å; M72-F104 HydrophobicContact CE-CD1 4.1Å; M72-F104 HydrophobicContact CG-CB 3.97Å; M72-F104 HydrophobicContact CG-CD1 4.3Å; M72-F104 WeakPolarHBondContact CG-O 3.18Å; M72-F104 HydrophobicContact SD-CB 4.22Å; M72-F104 HydrophobicContact SD-CD1 3.78Å; M72-F104 HydrophobicContact SD-CG 4.48Å; M72-F104 VanDerWaalsContact SD-O 3.34Å; M72-L107 HydrophobicContact CE-CD2 4.23Å; M72-L107 HydrophobicContact SD-CB 4.02Å; M72-L107 HydrophobicContact SD-CD2 3.89Å; M72-L107 HydrophobicContact SD-CG 3.84Å; M72-W150 HydrophobicContact CE-CH2 4.08Å; M72-W150 HydrophobicContact CE-CZ3 3.83Å
73V95.4Very high93.6Very high0 Ų019.5 Ų19.50%011%0.113CC..Hα-helixtrans-63.6-47.6175.4177.60000111.4A69 D70 T75 A77 G78 G108 I109 I307A69-V73 WeakPolarHBondContact O-CG2 3.23Å; A69-V73 PolarHBondContact O-N 3.31Å; D70-V73 PolarHBondContact O-N 3.01Å; V73-T75 VanDerWaalsContact C-N 3.34Å; V73-T75 PolarHBondContact O-N 3.2Å; V73-A77 HydrophobicContact CG1-CB 4.46Å; V73-A77 WeakPolarHBondContact O-CA 3.4Å; V73-A77 VanDerWaalsContact O-CB 3.23Å; V73-A77 WeakPolarHBondContact O-CB 2.87Å; V73-A77 PolarHBondContact O-N 3.31Å; V73-G78 PolarHBondContact O-N 3.05Å; V73-G108 VanDerWaalsContact CG2-C 3.44Å; V73-I109 HydrophobicContact CG1-CG1 4.35Å; V73-I109 HydrophobicContact CG2-CG1 3.72Å; V73-I307 HydrophobicContact CG1-CG2 3.88Å
74L96.3Very high93.5Very high0 Ų021 Ų210%012%0.12CC..Iπ-helixtrans-66.7-36-177.3-64.4174.2000112.4G38 I39 D70 L71 G78 L79G38-L74 VanDerWaalsContact C-CD1 3.41Å; I39-L74 HydrophobicContact CD1-CB 4.44Å; I39-L74 HydrophobicContact CG1-CB 3.99Å; I39-L74 HydrophobicContact CG1-CD1 4.15Å; D70-L74 VanDerWaalsContact O-CG 3.31Å; D70-L74 WeakPolarHBondContact O-CG 3.19Å; D70-L74 PolarHBondContact O-N 3.47Å; L71-L74 PolarHBondContact O-N 2.91Å; L74-G78 WeakPolarHBondContact O-CA 3.48Å; L74-G78 PolarHBondContact O-N 3.46Å; L74-G78 VanDerWaalsContact O-N 3.17Å; L74-L79 PolarHBondContact O-N 2.97Å; L74-L79 VanDerWaalsContact O-N 3.14Å
75T95.2Very high93.2Very high64 Ų6419.9 Ų19.939%0.39311%0.113SC..Iπ-helixtrans-83.4-40.5-18057.20000113.1I39 L71 M72 V73 L79 P80I39-T75 HydrophobicContact CD1-CG2 4.23Å; L71-T75 WeakPolarHBondContact O-CB 3.49Å; L71-T75 VanDerWaalsContact O-CG2 3.32Å; L71-T75 WeakPolarHBondContact O-CG2 3.49Å; L71-T75 PolarHBondContact O-N 2.86Å; L71-T75 PolarHBondContact O-OG1 3.18Å; M72-T75 PolarHBondContact O-OG1 3.46Å; V73-T75 VanDerWaalsContact C-N 3.34Å; V73-T75 PolarHBondContact O-N 3.2Å; T75-L79 HydrophobicContact CG2-CD1 4.43Å; T75-P80 VanDerWaalsContact O-CD 3.29Å; T75-P80 WeakPolarHBondContact O-CD 3.41Å
76A94Very high92.9Very high10 Ų1023.7 Ų23.78%0.08313%0.133CC..Iπ-helixtrans-82.7-38.7-179.200000112.6M72 P80 I101 F104 Q105M72-A76 WeakPolarHBondContact O-CB 3.09Å; M72-A76 PolarHBondContact O-N 2.93Å; A76-P80 VanDerWaalsContact O-CD 3.24Å; A76-P80 WeakPolarHBondContact O-CD 3.41Å; A76-P80 WeakPolarHBondContact O-CG 3.36Å; A76-I101 WeakPolarHBondContact O-CG2 3.28Å; A76-F104 HydrophobicContact CB-CB 3.73Å; A76-Q105 HydrophobicContact CB-CB 4.44Å
77A91.8Very high92.6Very high11 Ų1130.4 Ų30.49%0.09116%0.159CC..Iπ-helixtrans-98.6-38.318000000112.9V73 Q105 Y308V73-A77 HydrophobicContact CG1-CB 4.46Å; V73-A77 WeakPolarHBondContact O-CA 3.4Å; V73-A77 VanDerWaalsContact O-CB 3.23Å; V73-A77 WeakPolarHBondContact O-CB 2.87Å; V73-A77 PolarHBondContact O-N 3.31Å; A77-Q105 HydrophobicContact CB-CB 3.81Å; A77-Y308 HydrophobicContact CB-CE1 3.84Å; A77-Y308 PolarHBondContact O-OH 2.92Å
78G91.6Very high91.8Very high0 Ų030.5 Ų30.50%016%0.16CC..Iπ-helixtrans-72.2-56.6-174.900000113V31 V73 L74 N81V31-G78 VanDerWaalsContact CG1-O 3.29Å; V31-G78 WeakPolarHBondContact CG1-O 3.4Å; V73-G78 PolarHBondContact O-N 3.05Å; L74-G78 WeakPolarHBondContact O-CA 3.48Å; L74-G78 PolarHBondContact O-N 3.46Å; L74-G78 VanDerWaalsContact O-N 3.17Å; G78-N81 VanDerWaalsContact O-CB 3.26Å; G78-N81 WeakPolarHBondContact O-CB 3.24Å; G78-N81 PolarHBondContact O-N 2.9Å; G78-N81 VanDerWaalsContact O-N 3.11Å
79L92.5Very high91Very high76 Ų7628.4 Ų28.440%0.39815%0.15SC..Hα-helixtrans-63.5-43.8-176.3-58.8178.9000113.4L74 T75 N81 I82L74-L79 PolarHBondContact O-N 2.97Å; L74-L79 VanDerWaalsContact O-N 3.14Å; T75-L79 HydrophobicContact CG2-CD1 4.43Å; L79-N81 PolarHBondContact O-N 2.96Å; L79-I82 HydrophobicContact CD2-CD1 4.21Å; L79-I82 WeakPolarHBondContact O-CB 3.37Å; L79-I82 PolarHBondContact O-N 3.5Å; L79-I82 VanDerWaalsContact O-N 3.12Å
80P91.9Very high90.4Very high11 Ų1128.9 Ų28.97%0.07116%0.155CC..Hα-helixtrans-63.3-20.9174.6-3042.8000114.2T75 A76 I82 T83 Q84 Y93 I101T75-P80 VanDerWaalsContact O-CD 3.29Å; T75-P80 WeakPolarHBondContact O-CD 3.41Å; A76-P80 VanDerWaalsContact O-CD 3.24Å; A76-P80 WeakPolarHBondContact O-CD 3.41Å; A76-P80 WeakPolarHBondContact O-CG 3.36Å; P80-I82 VanDerWaalsContact C-N 3.28Å; P80-I82 PolarHBondContact O-N 2.94Å; P80-T83 PolarHBondContact O-N 3.31Å; P80-T83 PolarHBondContact O-OG1 3.09Å; P80-Q84 WeakPolarHBondContact O-CB 3.44Å; P80-Q84 PolarHBondContact O-N 3.43Å; P80-Y93 HydrophobicContact CB-CD2 4.46Å; P80-Y93 HydrophobicContact CB-CE2 3.68Å; P80-Y93 HydrophobicContact CG-CE2 4.27Å; P80-I101 HydrophobicContact CB-CD1 4.35Å; P80-I101 HydrophobicContact CB-CG2 4.49Å; P80-I101 HydrophobicContact CG-CD1 3.91Å; P80-I101 HydrophobicContact CG-CG1 4.43Å; P80-I101 HydrophobicContact CG-CG2 4.22Å
81N89.1Confident90Very high3 Ų330.4 Ų30.42%0.01616%0.161CC..Hα-helixtrans-68.4-29.4175.4-166-100.9000112.9G78 L79 S85 R304 Y308G78-N81 VanDerWaalsContact O-CB 3.26Å; G78-N81 WeakPolarHBondContact O-CB 3.24Å; G78-N81 PolarHBondContact O-N 2.9Å; G78-N81 VanDerWaalsContact O-N 3.11Å; L79-N81 PolarHBondContact O-N 2.96Å; N81-S85 WeakPolarHBondContact O-CB 3.49Å; N81-S85 PolarHBondContact O-N 3.32Å; N81-S85 PolarHBondContact O-OG 2.86Å; N81-R304 WeakPolarHBondContact ND2-CD 3.37Å; N81-R304 PolarHBondContact ND2-NE 3.48Å; N81-R304 PolarHBondContact ND2-NH1 2.9Å; N81-R304 VanDerWaalsContact ND2-NH1 3.12Å; N81-Y308 WeakPolarHBondContact CB-OH 3.17Å
82I90.7Very high89.7Confident28 Ų2832.7 Ų32.714%0.14418%0.175CC..Hα-helixtrans-64.9-50.2176.6-59.6170.3000109.5I28 V31 I32 L79 P80 S85 L86I28-I82 HydrophobicContact CG1-CG2 4.28Å; I28-I82 HydrophobicContact CG2-CG2 4.26Å; V31-I82 HydrophobicContact CB-CG1 4.26Å; V31-I82 HydrophobicContact CG1-CD1 4.12Å; V31-I82 HydrophobicContact CG1-CG1 3.65Å; I32-I82 HydrophobicContact CD1-CD1 4.42Å; I32-I82 HydrophobicContact CG1-CD1 3.6Å; I32-I82 HydrophobicContact CG1-CG1 4.39Å; L79-I82 HydrophobicContact CD2-CD1 4.21Å; L79-I82 WeakPolarHBondContact O-CB 3.37Å; L79-I82 PolarHBondContact O-N 3.5Å; L79-I82 VanDerWaalsContact O-N 3.12Å; P80-I82 VanDerWaalsContact C-N 3.28Å; P80-I82 PolarHBondContact O-N 2.94Å; I82-S85 PolarHBondContact O-N 3.38Å; I82-L86 HydrophobicContact CG2-CD1 4.25Å; I82-L86 WeakPolarHBondContact O-CG 3.35Å; I82-L86 PolarHBondContact O-N 3.38Å
83T89.7Confident89.3Confident34 Ų3435.2 Ų35.221%0.20918%0.184CC..Hα-helixtrans-65.4-42.2178.7550000110.9P80 S85 L86 Y87 Y93P80-T83 PolarHBondContact O-N 3.31Å; P80-T83 PolarHBondContact O-OG1 3.09Å; T83-S85 VanDerWaalsContact C-N 3.28Å; T83-S85 PolarHBondContact O-N 3.27Å; T83-L86 PolarHBondContact O-N 3.34Å; T83-L86 VanDerWaalsContact O-N 3.14Å; T83-Y87 VanDerWaalsContact O-CD2 3.24Å; T83-Y87 WeakPolarHBondContact O-CD2 3.36Å; T83-Y87 PolarHBondContact O-N 3.3Å; T83-Y93 WeakPolarHBondContact CG2-OH 3.47Å; T83-Y93 WeakPolarHBondContact OG1-CE2 3.27Å; T83-Y93 PolarHBondContact OG1-OH 2.97Å
84Q86.8Confident89Confident45 Ų4536.8 Ų36.821%0.2120%0.2CC..Hα-helixtrans-60-37.7174.7-171.1176.310.200112.3P80 G88 G89P80-Q84 WeakPolarHBondContact O-CB 3.44Å; P80-Q84 PolarHBondContact O-N 3.43Å; Q84-G88 PolarHBondContact O-N 3.14Å; Q84-G89 WeakPolarHBondContact O-CA 3.46Å; Q84-G89 PolarHBondContact O-N 3.23Å
85S87.8Confident88.7Confident1 Ų142.7 Ų42.71%0.00722%0.223CC..Hα-helixtrans-69.8-35.9176.4-610000112.2S27 N81 I82 T83S27-S85 PolarHBondContact OG-OG 3.32Å; N81-S85 WeakPolarHBondContact O-CB 3.49Å; N81-S85 PolarHBondContact O-N 3.32Å; N81-S85 PolarHBondContact O-OG 2.86Å; I82-S85 PolarHBondContact O-N 3.38Å; T83-S85 VanDerWaalsContact C-N 3.28Å; T83-S85 PolarHBondContact O-N 3.27Å
86L87.9Confident88.5Confident88 Ų8844.7 Ų44.746%0.46124%0.235SC..Hα-helixtrans-67.4-45.2178.1-75169.2000112.3K24 I28 I82 T83 G88K24-L86 PolarHBondContact NZ-O 2.89Å; K24-L86 VanDerWaalsContact NZ-O 3.14Å; I28-L86 HydrophobicContact CD1-CD2 3.44Å; I28-L86 VanDerWaalsContact CD1-CD2 3.44Å; I28-L86 HydrophobicContact CD1-CG 3.75Å; I82-L86 HydrophobicContact CG2-CD1 4.25Å; I82-L86 WeakPolarHBondContact O-CG 3.35Å; I82-L86 PolarHBondContact O-N 3.38Å; T83-L86 PolarHBondContact O-N 3.34Å; T83-L86 VanDerWaalsContact O-N 3.14Å; L86-G88 VanDerWaalsContact C-N 3.28Å; L86-G88 PolarHBondContact O-N 3.34Å
87Y86.1Confident88.3Confident145 Ų14544.8 Ų44.857%0.56924%0.237SC*.THydrogen-bonded Turntrans-90.826.4-177.8-65-74.5000113.5T83 G89 G90 V92T83-Y87 VanDerWaalsContact O-CD2 3.24Å; T83-Y87 WeakPolarHBondContact O-CD2 3.36Å; T83-Y87 PolarHBondContact O-N 3.3Å; Y87-G89 PolarHBondContact O-N 2.9Å; Y87-G89 VanDerWaalsContact O-N 3.11Å; Y87-G90 PolarHBondContact O-N 2.87Å; Y87-V92 HydrophobicContact CD2-CG1 3.8Å; Y87-V92 HydrophobicContact CE2-CG1 4.13Å; Y87-V92 HydrophobicContact CG-CG1 4.09Å
88G79.6Confident88.3Confident3 Ų344.2 Ų44.23%0.03123%0.233CC..THydrogen-bonded Turntrans59.129.7172.400000114.8W16 D18 Q84 L86W16-G88 VanDerWaalsContact CZ2-O 3.3Å; W16-G88 WeakPolarHBondContact CZ2-O 3.48Å; D18-G88 WeakPolarHBondContact OD1-CA 3.23Å; Q84-G88 PolarHBondContact O-N 3.14Å; L86-G88 VanDerWaalsContact C-N 3.28Å; L86-G88 PolarHBondContact O-N 3.34Å
89G79.4Confident88.3Confident14 Ų1445.4 Ų45.414%0.14424%0.239CC..THydrogen-bonded Turntrans99.7-9.8-177.800000114.8Y19 Q84 Y87Y19-G89 WeakPolarHBondContact OH-CA 3.47Å; Q84-G89 WeakPolarHBondContact O-CA 3.46Å; Q84-G89 PolarHBondContact O-N 3.23Å; Y87-G89 PolarHBondContact O-N 2.9Å; Y87-G89 VanDerWaalsContact O-N 3.11Å
90G84.5Confident88.2Confident10 Ų1043.5 Ų43.510%0.10323%0.232CC..  trans-64.6141.9-179.300000113.9Y87Y87-G90 PolarHBondContact O-N 2.87Å
91W87.1Confident88.3Confident32 Ų3244.1 Ų44.112%0.12124%0.235CC..  trans-94.5113.9178.3-171-93.3000111.8Y93 G94 C98 I101 M166 V177 C179W91-Y93 HydrophobicContact CD2-CD2 4.41Å; W91-Y93 HydrophobicContact CH2-CD2 4.17Å; W91-Y93 AromaticContact CZ2-CD2 3.93Å; W91-Y93 HydrophobicContact CZ2-CD2 3.93Å; W91-Y93 HydrophobicContact CZ2-CG 4.29Å; W91-Y93 HydrophobicContact CZ3-CD2 4.49Å; W91-G94 PolarHBondContact NE1-O 3.43Å; W91-C98 HydrophobicContact CZ2-CB 4.18Å; W91-I101 HydrophobicContact CH2-CB 3.96Å; W91-I101 HydrophobicContact CH2-CD1 3.82Å; W91-I101 HydrophobicContact CH2-CG1 4.49Å; W91-I101 HydrophobicContact CH2-CG2 3.81Å; W91-I101 HydrophobicContact CZ2-CB 4.24Å; W91-I101 HydrophobicContact CZ2-CD1 3.76Å; W91-M166 HydrophobicContact CB-CE 4.42Å; W91-M166 HydrophobicContact CB-SD 4.44Å; W91-M166 VanDerWaalsContact CD1-CE 3.43Å; W91-M166 HydrophobicContact CG-CE 4.21Å; W91-M166 HydrophobicContact CG-SD 3.98Å; W91-V177 WeakPolarHBondContact CB-O 3.48Å; W91-V177 PolarHBondContact N-O 3.47Å; W91-C179 HydrophobicContact CB-CB 4.42Å; W91-C179 HydrophobicContact CD2-CB 3.59Å; W91-C179 HydrophobicContact CE3-CB 3.77Å; W91-C179 HydrophobicContact CG-CB 3.88Å; W91-C179 HydrophobicContact CZ3-CB 4.3Å
92V89.3Confident88.4Confident77 Ų7744.5 Ų44.547%0.46724%0.237SC..  trans-104.2-4.9-174.3-60.80000114.5Y87 G94Y87-V92 HydrophobicContact CD2-CG1 3.8Å; Y87-V92 HydrophobicContact CE2-CG1 4.13Å; Y87-V92 HydrophobicContact CG-CG1 4.09Å; V92-G94 VanDerWaalsContact C-N 3.31Å; V92-G94 PolarHBondContact O-N 3.28Å
93Y88.5Confident88.6Confident87 Ų8744.6 Ų44.634%0.34124%0.236SC..SBendtrans-89.36-174.1-59.9-81.1000114P80 T83 W91 G97 I101P80-Y93 HydrophobicContact CB-CD2 4.46Å; P80-Y93 HydrophobicContact CB-CE2 3.68Å; P80-Y93 HydrophobicContact CG-CE2 4.27Å; T83-Y93 WeakPolarHBondContact CG2-OH 3.47Å; T83-Y93 WeakPolarHBondContact OG1-CE2 3.27Å; T83-Y93 PolarHBondContact OG1-OH 2.97Å; W91-Y93 HydrophobicContact CD2-CD2 4.41Å; W91-Y93 HydrophobicContact CH2-CD2 4.17Å; W91-Y93 AromaticContact CZ2-CD2 3.93Å; W91-Y93 HydrophobicContact CZ2-CD2 3.93Å; W91-Y93 HydrophobicContact CZ2-CG 4.29Å; W91-Y93 HydrophobicContact CZ3-CD2 4.49Å; Y93-G97 WeakPolarHBondContact O-CA 3.36Å; Y93-G97 PolarHBondContact O-N 3.39Å; Y93-I101 HydrophobicContact CD1-CD1 4.07Å; Y93-I101 HydrophobicContact CD2-CD1 3.85Å; Y93-I101 HydrophobicContact CE2-CD1 4.36Å; Y93-I101 HydrophobicContact CG-CD1 3.69Å
94G89.8Confident88.8Confident34 Ų3447.2 Ų47.235%0.35124%0.244SC..Hα-helixtrans62.6-172.8-176.500000113.7W91 V92 G97 C98W91-G94 PolarHBondContact NE1-O 3.43Å; V92-G94 VanDerWaalsContact C-N 3.31Å; V92-G94 PolarHBondContact O-N 3.28Å; G94-G97 PolarHBondContact O-N 2.87Å; G94-C98 PolarHBondContact O-N 3.3Å
95Y89.2Confident89.2Confident123 Ų12346.9 Ų46.948%0.48224%0.243SC..Hα-helixtrans-64-47.6-176.5-178.8-106.1000113G97 C98 L99 D165 M166Y95-G97 PolarHBondContact O-N 3.37Å; Y95-C98 WeakPolarHBondContact O-CB 3.47Å; Y95-C98 PolarHBondContact O-N 3.49Å; Y95-C98 VanDerWaalsContact O-N 3.11Å; Y95-L99 HydrophobicContact CD1-CD1 4.15Å; Y95-L99 HydrophobicContact CE1-CD1 3.51Å; Y95-L99 HydrophobicContact CE1-CG 4.27Å; Y95-L99 HydrophobicContact CE2-CD1 4.4Å; Y95-L99 HydrophobicContact CE2-CG 4.43Å; Y95-L99 PolarHBondContact O-N 2.93Å; Y95-L99 VanDerWaalsContact O-N 3.1Å; Y95-D165 WeakPolarHBondContact CE2-OD1 3.36Å; Y95-M166 HydrophobicContact CD2-CB 4.4Å; Y95-M166 HydrophobicContact CD2-CG 3.94Å
96V90.5Very high89.4Confident106 Ų10647.1 Ų47.164%0.64224%0.244SC*.Hα-helixtrans-60.1-39.2177.8177.80000111.1S100V96-S100 VanDerWaalsContact O-CB 3.24Å; V96-S100 WeakPolarHBondContact O-CB 3.3Å; V96-S100 PolarHBondContact O-N 2.93Å; V96-S100 PolarHBondContact O-OG 2.9Å
97G90.8Very high89.7Confident12 Ų1243.2 Ų43.212%0.12422%0.223CC..Hα-helixtrans-62.9-47.7174.100000112Y93 G94 Y95 L99 S100 I101Y93-G97 WeakPolarHBondContact O-CA 3.36Å; Y93-G97 PolarHBondContact O-N 3.39Å; G94-G97 PolarHBondContact O-N 2.87Å; Y95-G97 PolarHBondContact O-N 3.37Å; G97-L99 VanDerWaalsContact C-N 3.31Å; G97-L99 PolarHBondContact O-N 3.39Å; G97-S100 PolarHBondContact O-N 2.88Å; G97-I101 WeakPolarHBondContact O-CB 3.4Å; G97-I101 WeakPolarHBondContact O-CG1 3.35Å; G97-I101 PolarHBondContact O-N 3.49Å
98C91Very high90.1Very high0 Ų036.3 Ų36.30%020%0.196CC..Hα-helixtrans-54.9-48.4179.8173.40000111.5W91 G94 Y95 T102 D165 M166 C179W91-C98 HydrophobicContact CZ2-CB 4.18Å; G94-C98 PolarHBondContact O-N 3.3Å; Y95-C98 WeakPolarHBondContact O-CB 3.47Å; Y95-C98 PolarHBondContact O-N 3.49Å; Y95-C98 VanDerWaalsContact O-N 3.11Å; C98-T102 WeakPolarHBondContact O-CB 3.27Å; C98-T102 PolarHBondContact O-N 2.87Å; C98-T102 PolarHBondContact O-OG1 3.36Å; C98-D165 PolarHBondContact SG-O 2.88Å; C98-M166 HydrophobicContact CB-CG 3.94Å; C98-M166 HydrophobicContact CB-SD 3.62Å; C98-C179 WeakPolarHBondContact CA-SG 3.39Å; C98-C179 HydrophobicContact CB-CB 3.75Å; C98-C179 WeakPolarHBondContact CB-SG 3.28Å; C98-C179 WeakPolarHBondContact SG-CB 3.25Å; C98-C179 CovalentContact SG-SG 2.03Å; C98-C179 PolarHBondContact SG-SG 3.38Å
99L91.5Very high90.8Very high24 Ų2436.5 Ų36.513%0.12620%0.196CC..Hα-helixtrans-64.1-52.8177-67.5-171000112.6Y95 G97 Y103 F161 S164Y95-L99 HydrophobicContact CD1-CD1 4.15Å; Y95-L99 HydrophobicContact CE1-CD1 3.51Å; Y95-L99 HydrophobicContact CE1-CG 4.27Å; Y95-L99 HydrophobicContact CE2-CD1 4.4Å; Y95-L99 HydrophobicContact CE2-CG 4.43Å; Y95-L99 PolarHBondContact O-N 2.93Å; Y95-L99 VanDerWaalsContact O-N 3.1Å; G97-L99 VanDerWaalsContact C-N 3.31Å; G97-L99 PolarHBondContact O-N 3.39Å; L99-Y103 WeakPolarHBondContact O-CB 3.29Å; L99-Y103 PolarHBondContact O-N 2.95Å; L99-F161 HydrophobicContact CB-CD1 3.96Å; L99-F161 HydrophobicContact CB-CE1 4.23Å; L99-F161 WeakPolarHBondContact CD2-O 3.31Å; L99-S164 WeakPolarHBondContact CD2-O 3.3Å
100S91.9Very high91.5Very high37 Ų3735.9 Ų35.926%0.25919%0.19SC..Hα-helixtrans-71.4-44.9-171.1-54.60000112.3V96 G97 T102 Y103 F104V96-S100 VanDerWaalsContact O-CB 3.24Å; V96-S100 WeakPolarHBondContact O-CB 3.3Å; V96-S100 PolarHBondContact O-N 2.93Å; V96-S100 PolarHBondContact O-OG 2.9Å; G97-S100 PolarHBondContact O-N 2.88Å; S100-T102 VanDerWaalsContact C-N 3.33Å; S100-T102 PolarHBondContact O-N 2.92Å; S100-Y103 PolarHBondContact O-N 3Å; S100-F104 WeakPolarHBondContact O-CD2 3.29Å; S100-F104 PolarHBondContact O-N 3.36Å
101I93Very high92Very high24 Ų2435.4 Ų35.412%0.12319%0.185CC..Hα-helixtrans-62.6-44.6178.8-72.9167.1000109.8A76 P80 W91 Y93 G97 Y103 F104 Q105A76-I101 WeakPolarHBondContact O-CG2 3.28Å; P80-I101 HydrophobicContact CB-CD1 4.35Å; P80-I101 HydrophobicContact CB-CG2 4.49Å; P80-I101 HydrophobicContact CG-CD1 3.91Å; P80-I101 HydrophobicContact CG-CG1 4.43Å; P80-I101 HydrophobicContact CG-CG2 4.22Å; W91-I101 HydrophobicContact CH2-CB 3.96Å; W91-I101 HydrophobicContact CH2-CD1 3.82Å; W91-I101 HydrophobicContact CH2-CG1 4.49Å; W91-I101 HydrophobicContact CH2-CG2 3.81Å; W91-I101 HydrophobicContact CZ2-CB 4.24Å; W91-I101 HydrophobicContact CZ2-CD1 3.76Å; Y93-I101 HydrophobicContact CD1-CD1 4.07Å; Y93-I101 HydrophobicContact CD2-CD1 3.85Å; Y93-I101 HydrophobicContact CE2-CD1 4.36Å; Y93-I101 HydrophobicContact CG-CD1 3.69Å; G97-I101 WeakPolarHBondContact O-CB 3.4Å; G97-I101 WeakPolarHBondContact O-CG1 3.35Å; G97-I101 PolarHBondContact O-N 3.49Å; I101-Y103 PolarHBondContact O-N 2.83Å; I101-F104 PolarHBondContact O-N 3.41Å; I101-Q105 WeakPolarHBondContact O-CG 3.18Å; I101-Q105 PolarHBondContact O-N 2.91Å
102T91.4Very high92.3Very high10 Ų1033.9 Ų33.96%0.06118%0.179CC..Hα-helixtrans-63.1-42177.2-56.40000111.6C98 S100 Q105 Y106 S164C98-T102 WeakPolarHBondContact O-CB 3.27Å; C98-T102 PolarHBondContact O-N 2.87Å; C98-T102 PolarHBondContact O-OG1 3.36Å; S100-T102 VanDerWaalsContact C-N 3.33Å; S100-T102 PolarHBondContact O-N 2.92Å; T102-Q105 WeakPolarHBondContact O-CG 3.24Å; T102-Y106 HydrophobicContact CG2-CD2 3.82Å; T102-Y106 HydrophobicContact CG2-CE2 3.72Å; T102-Y106 WeakPolarHBondContact O-CD2 3.25Å; T102-Y106 PolarHBondContact O-N 3.38Å; T102-S164 VanDerWaalsContact CG2-OG 3.27Å; T102-S164 WeakPolarHBondContact CG2-OG 3.49Å
103Y93.9Very high92.4Very high30 Ų3030.4 Ų30.412%0.11816%0.158CC..Hα-helixtrans-61.2-52.3174.8172.1-98.1000112.3L99 S100 I101 Q105 Y106 L107 C157 F161L99-Y103 WeakPolarHBondContact O-CB 3.29Å; L99-Y103 PolarHBondContact O-N 2.95Å; S100-Y103 PolarHBondContact O-N 3Å; I101-Y103 PolarHBondContact O-N 2.83Å; Y103-Q105 PolarHBondContact O-N 3.39Å; Y103-Y106 PolarHBondContact O-N 3.3Å; Y103-L107 HydrophobicContact CE1-CD2 3.72Å; Y103-L107 WeakPolarHBondContact O-CB 3.26Å; Y103-L107 PolarHBondContact O-N 3.06Å; Y103-C157 HydrophobicContact CD2-CB 4.02Å; Y103-C157 WeakPolarHBondContact CD2-O 3.45Å; Y103-C157 HydrophobicContact CE2-CB 3.75Å; Y103-F161 HydrophobicContact CD1-CE2 4.05Å; Y103-F161 AromaticContact CD1-CZ 3.79Å; Y103-F161 HydrophobicContact CD1-CZ 3.79Å; Y103-F161 AromaticContact CD2-CD2 3.84Å; Y103-F161 HydrophobicContact CD2-CD2 3.84Å; Y103-F161 AromaticContact CD2-CE2 3.3Å; Y103-F161 HydrophobicContact CD2-CE2 3.3Å; Y103-F161 AromaticContact CD2-CZ 3.79Å; Y103-F161 HydrophobicContact CD2-CZ 3.79Å; Y103-F161 HydrophobicContact CE1-CE2 4.36Å; Y103-F161 HydrophobicContact CE1-CZ 4.41Å; Y103-F161 HydrophobicContact CE2-CD2 4.32Å; Y103-F161 AromaticContact CE2-CE2 3.68Å; Y103-F161 HydrophobicContact CE2-CE2 3.68Å; Y103-F161 HydrophobicContact CE2-CZ 4.4Å; Y103-F161 HydrophobicContact CG-CD2 4.31Å; Y103-F161 HydrophobicContact CG-CE1 4.21Å; Y103-F161 AromaticContact CG-CE2 3.5Å; Y103-F161 HydrophobicContact CG-CE2 3.5Å; Y103-F161 AromaticContact CG-CZ 3.44Å; Y103-F161 HydrophobicContact CG-CZ 3.44Å; Y103-F161 VanDerWaalsContact CG-CZ 3.44Å
104F95.3Very high92.7Very high89 Ų8927.3 Ų27.339%0.3915%0.149SC..Hα-helixtrans-67.8-36.3-174.9-75.2-58.9000112.8M72 A76 S100 I101 L107 G108M72-F104 HydrophobicContact CE-CD1 4.1Å; M72-F104 HydrophobicContact CG-CB 3.97Å; M72-F104 HydrophobicContact CG-CD1 4.3Å; M72-F104 WeakPolarHBondContact CG-O 3.18Å; M72-F104 HydrophobicContact SD-CB 4.22Å; M72-F104 HydrophobicContact SD-CD1 3.78Å; M72-F104 HydrophobicContact SD-CG 4.48Å; M72-F104 VanDerWaalsContact SD-O 3.34Å; A76-F104 HydrophobicContact CB-CB 3.73Å; S100-F104 WeakPolarHBondContact O-CD2 3.29Å; S100-F104 PolarHBondContact O-N 3.36Å; I101-F104 PolarHBondContact O-N 3.41Å; F104-L107 HydrophobicContact CD1-CD2 4.42Å; F104-L107 PolarHBondContact O-N 3.49Å; F104-G108 PolarHBondContact O-N 3.01Å
105Q93.7Very high92.8Very high39 Ų3925.9 Ų25.918%0.18213%0.133CC..Hα-helixtrans-59.9-49.4174.167.3-178.814.300110.5A76 A77 I101 T102 Y103 L107 G108 I109A76-Q105 HydrophobicContact CB-CB 4.44Å; A77-Q105 HydrophobicContact CB-CB 3.81Å; I101-Q105 WeakPolarHBondContact O-CG 3.18Å; I101-Q105 PolarHBondContact O-N 2.91Å; T102-Q105 WeakPolarHBondContact O-CG 3.24Å; Y103-Q105 PolarHBondContact O-N 3.39Å; Q105-L107 PolarHBondContact O-N 3.26Å; Q105-G108 PolarHBondContact O-N 3.33Å; Q105-I109 WeakPolarHBondContact O-CG1 3.25Å; Q105-I109 PolarHBondContact O-N 3.43Å
106Y92Very high92.8Very high6 Ų620.3 Ų20.32%0.02411%0.112CC..Hα-helixtrans-70.1-36.6-177-77.7-65.6000111.9T102 Y103 I109 N110 W160 Y181 Y280T102-Y106 HydrophobicContact CG2-CD2 3.82Å; T102-Y106 HydrophobicContact CG2-CE2 3.72Å; T102-Y106 WeakPolarHBondContact O-CD2 3.25Å; T102-Y106 PolarHBondContact O-N 3.38Å; Y103-Y106 PolarHBondContact O-N 3.3Å; Y106-I109 PolarHBondContact O-N 3.1Å; Y106-N110 WeakPolarHBondContact O-CB 3.44Å; Y106-N110 PolarHBondContact O-N 3.39Å; Y106-W160 AromaticContact CD1-CE2 3.96Å; Y106-W160 AromaticContact CD1-CZ2 3.86Å; Y106-W160 HydrophobicContact CD1-CZ2 3.86Å; Y106-W160 AromaticContact CD2-CD1 3.95Å; Y106-W160 AromaticContact CD2-CD2 3.53Å; Y106-W160 HydrophobicContact CD2-CD2 3.53Å; Y106-W160 AromaticContact CD2-CE2 3.51Å; Y106-W160 HydrophobicContact CD2-CE3 4Å; Y106-W160 AromaticContact CD2-CG 3.85Å; Y106-W160 HydrophobicContact CD2-CG 3.85Å; Y106-W160 HydrophobicContact CD2-CH2 4.41Å; Y106-W160 AromaticContact CD2-CZ2 3.97Å; Y106-W160 HydrophobicContact CD2-CZ2 3.97Å; Y106-W160 HydrophobicContact CD2-CZ3 4.42Å; Y106-W160 AromaticContact CD2-NE1 3.77Å; Y106-W160 HydrophobicContact CE1-CH2 4.19Å; Y106-W160 AromaticContact CE1-CZ2 3.85Å; Y106-W160 HydrophobicContact CE1-CZ2 3.85Å; Y106-W160 AromaticContact CE2-CD2 3.89Å; Y106-W160 HydrophobicContact CE2-CD2 3.89Å; Y106-W160 AromaticContact CE2-CE2 3.93Å; Y106-W160 AromaticContact CE2-CE3 3.87Å; Y106-W160 HydrophobicContact CE2-CE3 3.87Å; Y106-W160 AromaticContact CE2-CH2 4Å; Y106-W160 HydrophobicContact CE2-CH2 4Å; Y106-W160 AromaticContact CE2-CZ2 3.99Å; Y106-W160 HydrophobicContact CE2-CZ2 3.99Å; Y106-W160 AromaticContact CE2-CZ3 3.94Å; Y106-W160 HydrophobicContact CE2-CZ3 3.94Å; Y106-W160 AromaticContact CG-CD1 3.93Å; Y106-W160 HydrophobicContact CG-CD2 4.06Å; Y106-W160 AromaticContact CG-CE2 3.56Å; Y106-W160 HydrophobicContact CG-CG 4.29Å; Y106-W160 AromaticContact CG-CZ2 3.94Å; Y106-W160 HydrophobicContact CG-CZ2 3.94Å; Y106-W160 AromaticContact CG-NE1 3.48Å; Y106-W160 AromaticContact CZ-CH2 3.88Å; Y106-W160 AromaticContact CZ-CZ2 3.93Å; Y106-Y181 WeakPolarHBondContact CE2-OH 3.21Å; Y106-Y181 PolarHBondContact OH-OH 3.01Å; Y106-Y280 PolarHBondContact OH-OH 3.43Å
107L95.5Very high92.8Very high6 Ų616.5 Ų16.53%0.0319%0.089CC..Hα-helixtrans-59.3-49.1172.8176.557.1000111.4M72 Y103 F104 Q105 I109 N110 A111 W150 T153 C157M72-L107 HydrophobicContact CE-CD2 4.23Å; M72-L107 HydrophobicContact SD-CB 4.02Å; M72-L107 HydrophobicContact SD-CD2 3.89Å; M72-L107 HydrophobicContact SD-CG 3.84Å; Y103-L107 HydrophobicContact CE1-CD2 3.72Å; Y103-L107 WeakPolarHBondContact O-CB 3.26Å; Y103-L107 PolarHBondContact O-N 3.06Å; F104-L107 HydrophobicContact CD1-CD2 4.42Å; F104-L107 PolarHBondContact O-N 3.49Å; Q105-L107 PolarHBondContact O-N 3.26Å; L107-I109 VanDerWaalsContact C-N 3.33Å; L107-I109 PolarHBondContact O-N 3.48Å; L107-N110 PolarHBondContact O-N 3.46Å; L107-A111 WeakPolarHBondContact O-CB 3.32Å; L107-A111 PolarHBondContact O-N 3.39Å; L107-W150 HydrophobicContact CD2-CZ3 4.38Å; L107-W150 HydrophobicContact CG-CZ3 4.3Å; L107-T153 WeakPolarHBondContact CD1-OG1 3.44Å; L107-C157 HydrophobicContact CB-CB 4.35Å
108G95.1Very high92.8Very high0 Ų016.5 Ų16.50%09%0.088CC..Hα-helixtrans-60-43.9178.600000112V73 F104 Q105 S112V73-G108 VanDerWaalsContact CG2-C 3.44Å; F104-G108 PolarHBondContact O-N 3.01Å; Q105-G108 PolarHBondContact O-N 3.33Å; G108-S112 WeakPolarHBondContact O-CB 3.41Å; G108-S112 PolarHBondContact O-N 3.34Å
109I92.5Very high92.6Very high7 Ų716.8 Ų16.84%0.0369%0.089CC..Hα-helixtrans-61.7-52.2178.6-67.7176.4000111.4V73 Q105 Y106 L107 S112 S113 W277 R281 I307V73-I109 HydrophobicContact CG1-CG1 4.35Å; V73-I109 HydrophobicContact CG2-CG1 3.72Å; Q105-I109 WeakPolarHBondContact O-CG1 3.25Å; Q105-I109 PolarHBondContact O-N 3.43Å; Y106-I109 PolarHBondContact O-N 3.1Å; L107-I109 VanDerWaalsContact C-N 3.33Å; L107-I109 PolarHBondContact O-N 3.48Å; I109-S112 PolarHBondContact O-N 3.28Å; I109-S113 PolarHBondContact O-N 3.04Å; I109-S113 VanDerWaalsContact O-N 3.13Å; I109-W277 HydrophobicContact CB-CH2 3.78Å; I109-W277 HydrophobicContact CB-CZ2 4.41Å; I109-W277 HydrophobicContact CB-CZ3 4.36Å; I109-W277 HydrophobicContact CD1-CH2 3.67Å; I109-W277 HydrophobicContact CD1-CZ3 4.06Å; I109-W277 HydrophobicContact CG1-CH2 3.43Å; I109-W277 VanDerWaalsContact CG1-CH2 3.43Å; I109-W277 HydrophobicContact CG1-CZ2 4.22Å; I109-W277 HydrophobicContact CG1-CZ3 4.21Å; I109-W277 HydrophobicContact CG2-CE3 4.27Å; I109-W277 HydrophobicContact CG2-CH2 3.17Å; I109-W277 HydrophobicContact CG2-CZ2 3.87Å; I109-W277 HydrophobicContact CG2-CZ3 3.35Å; I109-R281 VanDerWaalsContact CG2-NH2 3.27Å; I109-I307 HydrophobicContact CD1-CG2 4.47Å
110N94.1Very high92.3Very high0 Ų015.8 Ų15.80%08%0.084CC..Hα-helixtrans-71.5-37.2-175.2-71.7-9000111.2Y106 L107 S113 C114 T153 D196 F200 R281Y106-N110 WeakPolarHBondContact O-CB 3.44Å; Y106-N110 PolarHBondContact O-N 3.39Å; L107-N110 PolarHBondContact O-N 3.46Å; N110-S113 PolarHBondContact O-N 2.92Å; N110-C114 PolarHBondContact O-N 2.85Å; N110-C114 VanDerWaalsContact O-N 3.11Å; N110-T153 HydrophobicContact CB-CG2 4.38Å; N110-D196 PolarHBondContact ND2-OD1 3.36Å; N110-F200 HydrophobicContact CB-CD1 3.67Å; N110-F200 HydrophobicContact CB-CD2 4.25Å; N110-F200 HydrophobicContact CB-CE1 3.73Å; N110-F200 HydrophobicContact CB-CE2 4.31Å; N110-F200 HydrophobicContact CB-CG 3.94Å; N110-F200 HydrophobicContact CB-CZ 4.06Å; N110-F200 WeakPolarHBondContact OD1-CG 3.42Å; N110-R281 PolarHBondContact OD1-NH2 2.93Å
111A95.1Very high92.2Very high0 Ų017.2 Ų17.20%09%0.088CC..Hα-helixtrans-65.5-37.4172.700000112.8A69 L107 S115 W150 T153A69-A111 HydrophobicContact CB-CB 4.06Å; L107-A111 WeakPolarHBondContact O-CB 3.32Å; L107-A111 PolarHBondContact O-N 3.39Å; A111-S115 WeakPolarHBondContact O-CB 3.47Å; A111-S115 PolarHBondContact O-N 3.02Å; A111-S115 PolarHBondContact O-OG 2.83Å; A111-W150 HydrophobicContact CB-CE3 4.45Å; A111-W150 HydrophobicContact CB-CH2 4.23Å; A111-W150 HydrophobicContact CB-CZ2 4.35Å; A111-W150 HydrophobicContact CB-CZ3 4.28Å; A111-T153 HydrophobicContact CB-CG2 4.48Å
112S93.8Very high91.8Very high1 Ų116.6 Ų16.61%0.0079%0.085CC..Hα-helixtrans-62.1-48.1175.7-176.60000110.7L66 D70 G108 I109 C114 S115 I116L66-S112 WeakPolarHBondContact CD1-OG 3.3Å; D70-S112 PolarHBondContact OD1-OG 3.38Å; G108-S112 WeakPolarHBondContact O-CB 3.41Å; G108-S112 PolarHBondContact O-N 3.34Å; I109-S112 PolarHBondContact O-N 3.28Å; S112-C114 PolarHBondContact O-N 3.4Å; S112-S115 PolarHBondContact O-N 3.4Å; S112-I116 WeakPolarHBondContact O-CG1 3.26Å; S112-I116 PolarHBondContact O-N 2.98Å
113S92.4Very high91.4Very high3 Ų318.6 Ų18.62%0.0219%0.091CC..Hα-helixtrans-59.5-48.1176.8-178.10000113.3I109 N110 S115 I116 T117 F200 P204 F273I109-S113 PolarHBondContact O-N 3.04Å; I109-S113 VanDerWaalsContact O-N 3.13Å; N110-S113 PolarHBondContact O-N 2.92Å; S113-S115 VanDerWaalsContact C-N 3.32Å; S113-S115 PolarHBondContact O-N 3.28Å; S113-I116 PolarHBondContact O-N 2.86Å; S113-T117 PolarHBondContact O-N 2.91Å; S113-T117 PolarHBondContact O-OG1 3.07Å; S113-F200 WeakPolarHBondContact CB-O 3.32Å; S113-F200 PolarHBondContact OG-O 3.3Å; S113-P204 WeakPolarHBondContact OG-CG 3.14Å; S113-F273 WeakPolarHBondContact OG-CZ 3.33Å
114C93.4Very high90.9Very high23 Ų2319.3 Ų19.316%0.1559%0.094CC..Hα-helixtrans-63.8-36.8175.7-72.70000112.4N110 S112 T117 A118 V149 T153N110-C114 PolarHBondContact O-N 2.85Å; N110-C114 VanDerWaalsContact O-N 3.11Å; S112-C114 PolarHBondContact O-N 3.4Å; C114-T117 WeakPolarHBondContact O-CB 3.23Å; C114-T117 PolarHBondContact O-N 3.41Å; C114-A118 WeakPolarHBondContact O-CB 2.99Å; C114-A118 PolarHBondContact O-N 3.49Å; C114-V149 HydrophobicContact CB-CG1 3.48Å; C114-V149 VanDerWaalsContact CB-CG1 3.48Å; C114-V149 HydrophobicContact CB-CG2 4.38Å; C114-T153 HydrophobicContact CB-CG2 4.41Å
115S92.4Very high90.4Very high3 Ų316.7 Ų16.72%0.0218%0.084CC..Hα-helixtrans-66.5-41.5177.2-64.60000112S65 A111 S112 S113 T117 A118 F119S65-S115 PolarHBondContact OG-OG 2.72Å; A111-S115 WeakPolarHBondContact O-CB 3.47Å; A111-S115 PolarHBondContact O-N 3.02Å; A111-S115 PolarHBondContact O-OG 2.83Å; S112-S115 PolarHBondContact O-N 3.4Å; S113-S115 VanDerWaalsContact C-N 3.32Å; S113-S115 PolarHBondContact O-N 3.28Å; S115-T117 VanDerWaalsContact C-N 3.31Å; S115-T117 PolarHBondContact O-N 3.42Å; S115-A118 PolarHBondContact O-N 3.48Å; S115-F119 VanDerWaalsContact O-CB 3.28Å; S115-F119 WeakPolarHBondContact O-CB 3.14Å; S115-F119 PolarHBondContact O-N 3.1Å
116I88.9Confident89.7Confident7 Ų716.6 Ų16.64%0.0369%0.089CC..Hα-helixtrans-62.9-40.5174.4-68.7166.9000110.7L66 S112 S113 F119 T120 F273L66-I116 HydrophobicContact CD1-CD1 4.21Å; L66-I116 HydrophobicContact CD1-CG1 3.82Å; L66-I116 HydrophobicContact CD2-CG1 4.06Å; S112-I116 WeakPolarHBondContact O-CG1 3.26Å; S112-I116 PolarHBondContact O-N 2.98Å; S113-I116 PolarHBondContact O-N 2.86Å; I116-F119 PolarHBondContact O-N 3.19Å; I116-T120 WeakPolarHBondContact O-CB 3.49Å; I116-T120 PolarHBondContact O-N 3.02Å; I116-T120 PolarHBondContact O-OG1 3.35Å; I116-F273 HydrophobicContact CD1-CD2 3.64Å; I116-F273 HydrophobicContact CD1-CE2 4.18Å; I116-F273 HydrophobicContact CD1-CG 4.35Å
117T90.9Very high88.8Confident25 Ų2518.3 Ų18.315%0.15310%0.099CC..Hα-helixtrans-63.3-50.3177.1-56.10000111S113 C114 S115 F119 T120 I121 P204 L207S113-T117 PolarHBondContact O-N 2.91Å; S113-T117 PolarHBondContact O-OG1 3.07Å; C114-T117 WeakPolarHBondContact O-CB 3.23Å; C114-T117 PolarHBondContact O-N 3.41Å; S115-T117 VanDerWaalsContact C-N 3.31Å; S115-T117 PolarHBondContact O-N 3.42Å; T117-F119 VanDerWaalsContact C-N 3.32Å; T117-F119 PolarHBondContact O-N 3.4Å; T117-T120 WeakPolarHBondContact O-CB 3.26Å; T117-T120 PolarHBondContact O-N 3.12Å; T117-T120 VanDerWaalsContact O-N 3.12Å; T117-I121 HydrophobicContact CG2-CD1 4.26Å; T117-I121 WeakPolarHBondContact O-CG1 3.36Å; T117-I121 PolarHBondContact O-N 2.91Å; T117-P204 WeakPolarHBondContact OG1-CB 3.3Å; T117-L207 HydrophobicContact CG2-CD2 3.43Å; T117-L207 VanDerWaalsContact CG2-CD2 3.43Å
118A90.9Very high87.9Confident13 Ų1318.9 Ų18.911%0.10710%0.103CC..Hα-helixtrans-60-42.7177.700000112Y62 C114 S115 I121 E122 I145Y62-A118 HydrophobicContact CD1-CB 4.07Å; Y62-A118 HydrophobicContact CE1-CB 3.72Å; C114-A118 WeakPolarHBondContact O-CB 2.99Å; C114-A118 PolarHBondContact O-N 3.49Å; S115-A118 PolarHBondContact O-N 3.48Å; A118-I121 PolarHBondContact O-N 3.42Å; A118-E122 PolarHBondContact O-N 2.91Å; A118-I145 HydrophobicContact CB-CG2 4.24Å
119F87.1Confident87.1Confident6 Ų622.2 Ų22.23%0.02612%0.119CC..Hα-helixtrans-61-42.9173.8176.5-111.1000111.9T59 L63 S115 I116 T117 I121 E122 R123 L266T59-F119 HydrophobicContact CG2-CD2 4.41Å; T59-F119 HydrophobicContact CG2-CE2 3.68Å; L63-F119 HydrophobicContact CD2-CD2 4.45Å; L63-F119 HydrophobicContact CD2-CE2 3.92Å; L63-F119 HydrophobicContact CD2-CZ 4.1Å; L63-F119 HydrophobicContact CG-CE2 4.43Å; S115-F119 VanDerWaalsContact O-CB 3.28Å; S115-F119 WeakPolarHBondContact O-CB 3.14Å; S115-F119 PolarHBondContact O-N 3.1Å; I116-F119 PolarHBondContact O-N 3.19Å; T117-F119 VanDerWaalsContact C-N 3.32Å; T117-F119 PolarHBondContact O-N 3.4Å; F119-I121 PolarHBondContact O-N 3.47Å; F119-E122 PolarHBondContact O-N 2.79Å; F119-R123 HydrophobicContact CD2-CG 4.44Å; F119-R123 HydrophobicContact CE1-CG 4.32Å; F119-R123 HydrophobicContact CE2-CG 4.23Å; F119-R123 HydrophobicContact CZ-CG 4.16Å; F119-R123 WeakPolarHBondContact O-CB 3.47Å; F119-R123 VanDerWaalsContact O-CG 3.27Å; F119-R123 WeakPolarHBondContact O-CG 3.37Å; F119-R123 PolarHBondContact O-N 3.49Å; F119-L266 HydrophobicContact CD1-CD2 4.16Å; F119-L266 HydrophobicContact CE1-CD2 3.18Å; F119-L266 HydrophobicContact CZ-CD2 3.61Å
120T85.9Confident86.3Confident2 Ų225.2 Ų25.21%0.01214%0.138CC..Hα-helixtrans-63.5-42.6177.7-62.60000111.9I116 T117 R123 Y124 A208 L211 Y212I116-T120 WeakPolarHBondContact O-CB 3.49Å; I116-T120 PolarHBondContact O-N 3.02Å; I116-T120 PolarHBondContact O-OG1 3.35Å; T117-T120 WeakPolarHBondContact O-CB 3.26Å; T117-T120 PolarHBondContact O-N 3.12Å; T117-T120 VanDerWaalsContact O-N 3.12Å; T120-R123 PolarHBondContact O-N 3.49Å; T120-Y124 WeakPolarHBondContact O-CB 3.43Å; T120-Y124 PolarHBondContact O-N 3.34Å; T120-A208 HydrophobicContact CG2-CB 4.35Å; T120-L211 HydrophobicContact CG2-CB 4.28Å; T120-L211 HydrophobicContact CG2-CD1 4Å; T120-Y212 HydrophobicContact CG2-CD2 4.22Å; T120-Y212 HydrophobicContact CG2-CE2 3.39Å; T120-Y212 PolarHBondContact OG1-OH 3.42Å
121I88.1Confident85.4Confident67 Ų6731.2 Ų31.234%0.34417%0.169SC..Hα-helixtrans-61.7-46.6175-64.7165.3000110.7T117 A118 F119 R123 Y124 I125 L207 L211T117-I121 HydrophobicContact CG2-CD1 4.26Å; T117-I121 WeakPolarHBondContact O-CG1 3.36Å; T117-I121 PolarHBondContact O-N 2.91Å; A118-I121 PolarHBondContact O-N 3.42Å; F119-I121 PolarHBondContact O-N 3.47Å; I121-R123 VanDerWaalsContact C-N 3.29Å; I121-R123 PolarHBondContact O-N 2.91Å; I121-Y124 WeakPolarHBondContact O-CB 3.2Å; I121-Y124 PolarHBondContact O-N 3.31Å; I121-I125 HydrophobicContact CG2-CD1 3.86Å; I121-I125 HydrophobicContact CG2-CG1 4.48Å; I121-I125 WeakPolarHBondContact O-CG1 3.29Å; I121-I125 PolarHBondContact O-N 2.96Å; I121-L207 HydrophobicContact CD1-CD2 3.69Å; I121-L207 HydrophobicContact CG1-CD2 3.76Å; I121-L211 HydrophobicContact CG1-CD1 3.84Å
122E86.4Confident84.6Confident12 Ų1237.5 Ų37.56%0.05620%0.196CC..Hα-helixtrans-57.5-44.9177-172.8-149.8-175.800110.9T59 Y62 A118 F119 I125 A126T59-E122 VanDerWaalsContact CA-OE1 3.26Å; T59-E122 WeakPolarHBondContact CA-OE1 3.45Å; T59-E122 VanDerWaalsContact CA-OE2 3.24Å; T59-E122 WeakPolarHBondContact CA-OE2 3.22Å; T59-E122 PolarHBondContact N-OE1 3.38Å; T59-E122 PolarHBondContact OG1-OE1 2.97Å; T59-E122 PolarHBondContact OG1-OE2 3.12Å; Y62-E122 HydrophobicContact CD2-CG 4.48Å; Y62-E122 VanDerWaalsContact CD2-OE2 3.27Å; Y62-E122 WeakPolarHBondContact CD2-OE2 3.37Å; Y62-E122 HydrophobicContact CE2-CB 4.11Å; Y62-E122 HydrophobicContact CE2-CG 4.05Å; A118-E122 PolarHBondContact O-N 2.91Å; F119-E122 PolarHBondContact O-N 2.79Å; E122-I125 PolarHBondContact O-N 3.27Å; E122-A126 WeakPolarHBondContact O-CB 3.11Å; E122-A126 PolarHBondContact O-N 3.29Å
123R82.9Confident83.8Confident52 Ų5238.1 Ų38.120%0.19620%0.201CC..Hα-helixtrans-64.9-42178-70.4-51.9-165.7-164.211.8113.2T59 F119 T120 I121 A126 I127 L266T59-R123 PolarHBondContact OG1-NH1 3.07Å; F119-R123 HydrophobicContact CD2-CG 4.44Å; F119-R123 HydrophobicContact CE1-CG 4.32Å; F119-R123 HydrophobicContact CE2-CG 4.23Å; F119-R123 HydrophobicContact CZ-CG 4.16Å; F119-R123 WeakPolarHBondContact O-CB 3.47Å; F119-R123 VanDerWaalsContact O-CG 3.27Å; F119-R123 WeakPolarHBondContact O-CG 3.37Å; F119-R123 PolarHBondContact O-N 3.49Å; T120-R123 PolarHBondContact O-N 3.49Å; I121-R123 VanDerWaalsContact C-N 3.29Å; I121-R123 PolarHBondContact O-N 2.91Å; R123-A126 PolarHBondContact O-N 3.36Å; R123-I127 WeakPolarHBondContact O-CB 3.35Å; R123-I127 WeakPolarHBondContact O-CD1 3.46Å; R123-I127 VanDerWaalsContact O-CG1 3.24Å; R123-I127 WeakPolarHBondContact O-CG1 3.28Å; R123-I127 PolarHBondContact O-N 3.27Å; R123-L266 HydrophobicContact CB-CD1 3.75Å; R123-L266 HydrophobicContact CG-CD1 3.64Å; R123-L266 HydrophobicContact CG-CD2 3.95Å; R123-L266 HydrophobicContact CG-CG 4.47Å
124Y83.6Confident82.9Confident45 Ų4544.7 Ų44.718%0.17623%0.232CC..Hα-helixtrans-56.7-50.3172.9169.7-99.4000111.1T120 I121 A126 I127 C128 H129 L211 F214 I215T120-Y124 WeakPolarHBondContact O-CB 3.43Å; T120-Y124 PolarHBondContact O-N 3.34Å; I121-Y124 WeakPolarHBondContact O-CB 3.2Å; I121-Y124 PolarHBondContact O-N 3.31Å; Y124-A126 VanDerWaalsContact C-N 3.35Å; Y124-A126 PolarHBondContact O-N 3.37Å; Y124-I127 PolarHBondContact O-N 3.42Å; Y124-C128 HydrophobicContact CD2-CB 4.17Å; Y124-C128 HydrophobicContact CE2-CB 3.83Å; Y124-C128 VanDerWaalsContact CE2-SG 3.52Å; Y124-C128 VanDerWaalsContact O-CB 3.3Å; Y124-C128 WeakPolarHBondContact O-CB 3.2Å; Y124-C128 PolarHBondContact O-N 3.06Å; Y124-H129 PolarHBondContact OH-NE2 3.46Å; Y124-L211 HydrophobicContact CD1-CD2 3.86Å; Y124-L211 HydrophobicContact CD2-CB 4.31Å; Y124-L211 HydrophobicContact CD2-CD2 3.91Å; Y124-L211 HydrophobicContact CE1-CD2 4.2Å; Y124-L211 HydrophobicContact CE2-CD2 4.24Å; Y124-L211 HydrophobicContact CG-CB 4.44Å; Y124-L211 HydrophobicContact CG-CD2 3.72Å; Y124-F214 HydrophobicContact CE2-CB 3.87Å; Y124-F214 HydrophobicContact CE2-CD2 4.37Å; Y124-I215 HydrophobicContact CD2-CD1 4.33Å; Y124-I215 HydrophobicContact CD2-CG1 3.98Å
125I83.9Confident82Confident33 Ų3350.2 Ų50.217%0.16925%0.253CS..Hα-helixtrans-60.9-45.5179.4-64.4166.6000110.6I121 E122 I127 H129 A133 M136I121-I125 HydrophobicContact CG2-CD1 3.86Å; I121-I125 HydrophobicContact CG2-CG1 4.48Å; I121-I125 WeakPolarHBondContact O-CG1 3.29Å; I121-I125 PolarHBondContact O-N 2.96Å; E122-I125 PolarHBondContact O-N 3.27Å; I125-I127 VanDerWaalsContact C-N 3.32Å; I125-I127 PolarHBondContact O-N 3.12Å; I125-H129 CarbonylContact O-C 3.16Å; I125-H129 WeakPolarHBondContact O-CA 3.19Å; I125-H129 PolarHBondContact O-N 2.92Å; I125-H129 VanDerWaalsContact O-O 3.11Å; I125-A133 HydrophobicContact CG2-CB 4.11Å; I125-M136 HydrophobicContact CG2-CB 4.34Å
126A78.9Confident81.2Confident37 Ų3754.6 Ų54.631%0.30628%0.275SS..Hα-helixtrans-62.7-34.4-179.600000113.8E122 R123 Y124 A133E122-A126 WeakPolarHBondContact O-CB 3.11Å; E122-A126 PolarHBondContact O-N 3.29Å; R123-A126 PolarHBondContact O-N 3.36Å; Y124-A126 VanDerWaalsContact C-N 3.35Å; Y124-A126 PolarHBondContact O-N 3.37Å; A126-A133 HydrophobicContact CB-CB 4.42Å
127I73.9Confident80.7Confident42 Ų4255.8 Ų55.822%0.21528%0.283CS..Hα-helixtrans-89.3-49.1-176.1-65167.3000111.2R123 Y124 I125 I215 L266R123-I127 WeakPolarHBondContact O-CB 3.35Å; R123-I127 WeakPolarHBondContact O-CD1 3.46Å; R123-I127 VanDerWaalsContact O-CG1 3.24Å; R123-I127 WeakPolarHBondContact O-CG1 3.28Å; R123-I127 PolarHBondContact O-N 3.27Å; Y124-I127 PolarHBondContact O-N 3.42Å; I125-I127 VanDerWaalsContact C-N 3.32Å; I125-I127 PolarHBondContact O-N 3.12Å; I127-I215 HydrophobicContact CG2-CG2 4.29Å; I127-L266 HydrophobicContact CD1-CD1 4.3Å
128C76.8Confident80.4Confident18 Ų1856.9 Ų56.912%0.12229%0.29CS..Hα-helixtrans-85.1-25.5-172.6-60.80000112.8Y124 I218Y124-C128 HydrophobicContact CD2-CB 4.17Å; Y124-C128 HydrophobicContact CE2-CB 3.83Å; Y124-C128 VanDerWaalsContact CE2-SG 3.52Å; Y124-C128 VanDerWaalsContact O-CB 3.3Å; Y124-C128 WeakPolarHBondContact O-CB 3.2Å; Y124-C128 PolarHBondContact O-N 3.06Å; C128-I218 HydrophobicContact CB-CD1 3.83Å; C128-I218 VanDerWaalsContact SG-CD1 3.51Å
129H78.3Confident80.2Confident71 Ų7159.5 Ų59.533%0.32930%0.302SS..  trans-135.465.9-177.1-59.2-58000112.1Y124 I125 I131 K132 A133Y124-H129 PolarHBondContact OH-NE2 3.46Å; I125-H129 CarbonylContact O-C 3.16Å; I125-H129 WeakPolarHBondContact O-CA 3.19Å; I125-H129 PolarHBondContact O-N 2.92Å; I125-H129 VanDerWaalsContact O-O 3.11Å; H129-I131 VanDerWaalsContact C-N 3.28Å; H129-I131 PolarHBondContact O-N 3.26Å; H129-K132 HydrophobicContact CB-CB 3.99Å; H129-K132 HydrophobicContact CB-CD 4.2Å; H129-K132 HydrophobicContact CB-CG 4.29Å; H129-K132 PolarHBondContact O-N 2.86Å; H129-A133 PolarHBondContact O-N 3.22Å
130P75Confident80.2Confident69 Ų6963.8 Ų63.845%0.44833%0.333SS..Hα-helixtrans-59.1-34.3-172.123.5-34.5000113.9A133 Q134P130-A133 WeakPolarHBondContact O-CB 3.46Å; P130-A133 PolarHBondContact O-N 3.16Å; P130-Q134 PolarHBondContact O-N 3.18Å
131I75.8Confident80.4Confident127 Ų12769.5 Ų69.565%0.65135%0.354SS*.Hα-helixtrans-68.2-45.1176.7-59172000110.5H129 A133 Q134 F135H129-I131 VanDerWaalsContact C-N 3.28Å; H129-I131 PolarHBondContact O-N 3.26Å; I131-A133 VanDerWaalsContact C-N 3.28Å; I131-A133 PolarHBondContact O-N 3.33Å; I131-Q134 PolarHBondContact O-N 2.96Å; I131-F135 HydrophobicContact CG2-CE2 4.49Å; I131-F135 VanDerWaalsContact O-CD2 3.29Å; I131-F135 WeakPolarHBondContact O-CD2 3.08Å
132K76.4Confident80.5Confident132 Ų13266.4 Ų66.457%0.57434%0.338SS*.Hα-helixtrans-65.4-33.9175.2-65.9-175.5178.5177.80111.5H129 Q134 F135 M136H129-K132 HydrophobicContact CB-CB 3.99Å; H129-K132 HydrophobicContact CB-CD 4.2Å; H129-K132 HydrophobicContact CB-CG 4.29Å; H129-K132 PolarHBondContact O-N 2.86Å; K132-Q134 VanDerWaalsContact C-N 3.28Å; K132-Q134 PolarHBondContact O-N 2.76Å; K132-F135 PolarHBondContact O-N 3.31Å; K132-F135 VanDerWaalsContact O-N 3.14Å; K132-M136 VanDerWaalsContact O-CB 3.27Å; K132-M136 WeakPolarHBondContact O-CB 3.47Å; K132-M136 WeakPolarHBondContact O-CG 3.35Å; K132-M136 PolarHBondContact O-N 3.14Å
133A78.9Confident80.7Confident13 Ų1371.9 Ų71.911%0.10736%0.362CS..Hα-helixtrans-60.5-34.9179.400000112.9I125 A126 H129 P130 I131 F135 M136 C137I125-A133 HydrophobicContact CG2-CB 4.11Å; A126-A133 HydrophobicContact CB-CB 4.42Å; H129-A133 PolarHBondContact O-N 3.22Å; P130-A133 WeakPolarHBondContact O-CB 3.46Å; P130-A133 PolarHBondContact O-N 3.16Å; I131-A133 VanDerWaalsContact C-N 3.28Å; I131-A133 PolarHBondContact O-N 3.33Å; A133-F135 PolarHBondContact O-N 3.25Å; A133-M136 PolarHBondContact O-N 2.72Å; A133-C137 VanDerWaalsContact O-CB 3.26Å; A133-C137 WeakPolarHBondContact O-CB 3.31Å; A133-C137 PolarHBondContact O-N 2.89Å
134Q73.1Confident81.3Confident141 Ų14176.7 Ų76.766%0.65938%0.384SS*.Hα-helixtrans-60.6-34.3176.6-70.2-179.6-28.900112.7P130 I131 K132P130-Q134 PolarHBondContact O-N 3.18Å; I131-Q134 PolarHBondContact O-N 2.96Å; K132-Q134 VanDerWaalsContact C-N 3.28Å; K132-Q134 PolarHBondContact O-N 2.76Å
135F73.6Confident81.7Confident140 Ų14078.1 Ų78.161%0.61439%0.394SS*.Hα-helixtrans-91.8-27.5178.7-58-75.4000113.2I131 K132 A133 R141I131-F135 HydrophobicContact CG2-CE2 4.49Å; I131-F135 VanDerWaalsContact O-CD2 3.29Å; I131-F135 WeakPolarHBondContact O-CD2 3.08Å; K132-F135 PolarHBondContact O-N 3.31Å; K132-F135 VanDerWaalsContact O-N 3.14Å; A133-F135 PolarHBondContact O-N 3.25Å; F135-R141 PolarHBondContact O-NH1 3.45Å
136M75.1Confident82.3Confident94 Ų9477.8 Ų77.846%0.46339%0.393SS..Hα-helixtrans-94.4-40-172.6-67.2-67.1-66.200113.5I125 K132 A133 T138 R141I125-M136 HydrophobicContact CG2-CB 4.34Å; K132-M136 VanDerWaalsContact O-CB 3.27Å; K132-M136 WeakPolarHBondContact O-CB 3.47Å; K132-M136 WeakPolarHBondContact O-CG 3.35Å; K132-M136 PolarHBondContact O-N 3.14Å; A133-M136 PolarHBondContact O-N 2.72Å; M136-T138 VanDerWaalsContact C-N 3.29Å; M136-T138 PolarHBondContact O-N 3.17Å; M136-T138 VanDerWaalsContact O-N 3.07Å; M136-R141 WeakPolarHBondContact O-CD 3.24Å; M136-R141 PolarHBondContact SD-NH1 3.26Å
137C78.4Confident83.1Confident32 Ų3280.9 Ų80.922%0.21641%0.407CS..SBendtrans-87.865.3-177.6-600000110.1P58 A133P58-C137 WeakPolarHBondContact CG-O 3.38Å; A133-C137 VanDerWaalsContact O-CB 3.26Å; A133-C137 WeakPolarHBondContact O-CB 3.31Å; A133-C137 PolarHBondContact O-N 2.89Å
138T85.9Confident84.2Confident48 Ų4883 Ų8329%0.29442%0.422SS..  trans-102.6152.6175.365.60000111.3M136 S140 R141 A142M136-T138 VanDerWaalsContact C-N 3.29Å; M136-T138 PolarHBondContact O-N 3.17Å; M136-T138 VanDerWaalsContact O-N 3.07Å; T138-S140 VanDerWaalsContact C-N 3.33Å; T138-S140 PolarHBondContact O-N 3Å; T138-R141 PolarHBondContact O-N 3.36Å; T138-R141 WeakPolarHBondContact OG1-CB 3.45Å; T138-R141 WeakPolarHBondContact OG1-CD 3.44Å; T138-R141 VanDerWaalsContact OG1-CG 3.27Å; T138-R141 WeakPolarHBondContact OG1-CG 3.45Å; T138-A142 PolarHBondContact O-N 3.18Å
139L85.4Confident85.1Confident68 Ų6883.2 Ų83.236%0.35642%0.423SS..Hα-helixtrans-59.9-41.9-178.2-77.2169.9000112.7R56 T57 P58 R141 A142 K143R56-L139 WeakPolarHBondContact O-CD2 3.16Å; T57-L139 VanDerWaalsContact C-CD2 3.45Å; P58-L139 HydrophobicContact CG-CD2 4.19Å; P58-L139 HydrophobicContact CG-CG 4.26Å; L139-R141 VanDerWaalsContact C-N 3.34Å; L139-R141 PolarHBondContact O-N 3.04Å; L139-A142 PolarHBondContact O-N 2.82Å; L139-K143 WeakPolarHBondContact O-CG 3.35Å; L139-K143 PolarHBondContact O-N 2.95Å
140S88.6Confident86Confident97 Ų9782.1 Ų82.168%0.67842%0.416SS*.Hα-helixtrans-64.4-40.3180-530000111.7T138 K144T138-S140 VanDerWaalsContact C-N 3.33Å; T138-S140 PolarHBondContact O-N 3Å; S140-K144 PolarHBondContact O-N 2.82Å
141R89.2Confident87Confident121 Ų12181.6 Ų81.646%0.45742%0.418SS..Hα-helixtrans-68.3-44.1176.3-70.9-179.5-179.5-162.32.1111.6F135 M136 T138 L139 K143 K144 I145F135-R141 PolarHBondContact O-NH1 3.45Å; M136-R141 WeakPolarHBondContact O-CD 3.24Å; M136-R141 PolarHBondContact SD-NH1 3.26Å; T138-R141 PolarHBondContact O-N 3.36Å; T138-R141 WeakPolarHBondContact OG1-CB 3.45Å; T138-R141 WeakPolarHBondContact OG1-CD 3.44Å; T138-R141 VanDerWaalsContact OG1-CG 3.27Å; T138-R141 WeakPolarHBondContact OG1-CG 3.45Å; L139-R141 VanDerWaalsContact C-N 3.34Å; L139-R141 PolarHBondContact O-N 3.04Å; R141-K143 VanDerWaalsContact C-N 3.35Å; R141-K143 PolarHBondContact O-N 3.3Å; R141-K144 PolarHBondContact O-N 3.06Å; R141-K144 VanDerWaalsContact O-N 3.16Å; R141-I145 WeakPolarHBondContact O-CG1 3.35Å; R141-I145 PolarHBondContact O-N 3.38Å
142A90.6Very high88Confident2 Ų280 Ų802%0.01741%0.406CS..Hα-helixtrans-58.1-46.3176.500000111.8P58 Y62 T138 L139 K144 I145 I146P58-A142 HydrophobicContact CB-CB 3.9Å; Y62-A142 HydrophobicContact CE2-CB 3.88Å; T138-A142 PolarHBondContact O-N 3.18Å; L139-A142 PolarHBondContact O-N 2.82Å; A142-K144 PolarHBondContact O-N 3.01Å; A142-I145 PolarHBondContact O-N 2.95Å; A142-I146 VanDerWaalsContact O-CG1 3.28Å; A142-I146 WeakPolarHBondContact O-CG1 3.44Å; A142-I146 PolarHBondContact O-N 2.85Å
143K91.1Very high88.9Confident127 Ų12773.8 Ų73.855%0.55238%0.379SS*.Hα-helixtrans-59.3-44.1174.5-72.1178-177.4-178.40112.3L139 R141 I146 V147L139-K143 WeakPolarHBondContact O-CG 3.35Å; L139-K143 PolarHBondContact O-N 2.95Å; R141-K143 VanDerWaalsContact C-N 3.35Å; R141-K143 PolarHBondContact O-N 3.3Å; K143-I146 PolarHBondContact O-N 3.04Å; K143-V147 WeakPolarHBondContact O-CG2 3.22Å; K143-V147 PolarHBondContact O-N 3.44Å
144K94.1Very high89.7Confident154 Ų15474.7 Ų74.767%0.6739%0.385SS*.Hα-helixtrans-61.9-43.8177.2-170.9176.5-178.6177.90111.6S140 R141 A142 V147 V148S140-K144 PolarHBondContact O-N 2.82Å; R141-K144 PolarHBondContact O-N 3.06Å; R141-K144 VanDerWaalsContact O-N 3.16Å; A142-K144 PolarHBondContact O-N 3.01Å; K144-V147 PolarHBondContact O-N 3.34Å; K144-V148 VanDerWaalsContact O-CG2 3.32Å; K144-V148 WeakPolarHBondContact O-CG2 3.45Å; K144-V148 PolarHBondContact O-N 3.05Å
145I93.9Very high90.7Very high74 Ų7474.6 Ų74.638%0.37939%0.388SS..Hα-helixtrans-61.3-45.5176.7-68.3164.2000110.4Y62 A118 R141 A142 V147 V148 V149Y62-I145 HydrophobicContact CE1-CB 4.44Å; Y62-I145 HydrophobicContact CE1-CG2 3.97Å; Y62-I145 VanDerWaalsContact OH-CD1 3.23Å; Y62-I145 WeakPolarHBondContact OH-CD1 3.33Å; A118-I145 HydrophobicContact CB-CG2 4.24Å; R141-I145 WeakPolarHBondContact O-CG1 3.35Å; R141-I145 PolarHBondContact O-N 3.38Å; A142-I145 PolarHBondContact O-N 2.95Å; I145-V147 PolarHBondContact O-N 3.07Å; I145-V148 PolarHBondContact O-N 3.32Å; I145-V149 HydrophobicContact CG2-CG2 4.4Å; I145-V149 WeakPolarHBondContact O-CG2 3.38Å; I145-V149 PolarHBondContact O-N 3.21Å
146I95.3Very high91.6Very high27 Ų2770 Ų7014%0.13837%0.367CS..Hα-helixtrans-58.5-50.3176.3-69.4164.5000110.2C61 Y62 A142 K143 V148 V149 W150C61-I146 HydrophobicContact CB-CD1 3.84Å; C61-I146 WeakPolarHBondContact O-CD1 3.28Å; Y62-I146 HydrophobicContact CD1-CD1 4.16Å; Y62-I146 HydrophobicContact CD1-CG1 3.89Å; Y62-I146 HydrophobicContact CE1-CD1 4.43Å; Y62-I146 HydrophobicContact CE1-CG1 3.93Å; A142-I146 VanDerWaalsContact O-CG1 3.28Å; A142-I146 WeakPolarHBondContact O-CG1 3.44Å; A142-I146 PolarHBondContact O-N 2.85Å; K143-I146 PolarHBondContact O-N 3.04Å; I146-V148 VanDerWaalsContact C-N 3.29Å; I146-V148 PolarHBondContact O-N 3.07Å; I146-V149 WeakPolarHBondContact O-CB 3.28Å; I146-V149 PolarHBondContact O-N 2.86Å; I146-V149 VanDerWaalsContact O-N 3.11Å; I146-W150 PolarHBondContact O-N 2.88Å
147V96.2Very high92.4Very high101 Ų10165.5 Ų65.561%0.61235%0.345SS*.Hα-helixtrans-57.2-42.8178.1170.30000111.7K143 K144 I145 W150 A151K143-V147 WeakPolarHBondContact O-CG2 3.22Å; K143-V147 PolarHBondContact O-N 3.44Å; K144-V147 PolarHBondContact O-N 3.34Å; I145-V147 PolarHBondContact O-N 3.07Å; V147-W150 PolarHBondContact O-N 3.48Å; V147-A151 VanDerWaalsContact O-CB 3.3Å; V147-A151 WeakPolarHBondContact O-CB 3.34Å; V147-A151 PolarHBondContact O-N 2.85Å
148V96.2Very high93.1Very high88 Ų8865.7 Ų65.753%0.53335%0.348SS..Hα-helixtrans-63.2-44.2176.41700000111.4K144 I145 I146 A151 F152K144-V148 VanDerWaalsContact O-CG2 3.32Å; K144-V148 WeakPolarHBondContact O-CG2 3.45Å; K144-V148 PolarHBondContact O-N 3.05Å; I145-V148 PolarHBondContact O-N 3.32Å; I146-V148 VanDerWaalsContact C-N 3.29Å; I146-V148 PolarHBondContact O-N 3.07Å; V148-A151 PolarHBondContact O-N 3.38Å; V148-F152 VanDerWaalsContact O-CB 3.27Å; V148-F152 WeakPolarHBondContact O-CB 3.39Å; V148-F152 PolarHBondContact O-N 2.88Å
149V95.9Very high93.2Very high21 Ų2166.2 Ų66.213%0.12735%0.348CS..Hα-helixtrans-58-50.9176.7164.90000110.4C114 I145 I146 A151 F152 T153C114-V149 HydrophobicContact CB-CG1 3.48Å; C114-V149 VanDerWaalsContact CB-CG1 3.48Å; C114-V149 HydrophobicContact CB-CG2 4.38Å; I145-V149 HydrophobicContact CG2-CG2 4.4Å; I145-V149 WeakPolarHBondContact O-CG2 3.38Å; I145-V149 PolarHBondContact O-N 3.21Å; I146-V149 WeakPolarHBondContact O-CB 3.28Å; I146-V149 PolarHBondContact O-N 2.86Å; I146-V149 VanDerWaalsContact O-N 3.11Å; V149-A151 PolarHBondContact O-N 3.11Å; V149-F152 PolarHBondContact O-N 3.41Å; V149-T153 WeakPolarHBondContact O-CG2 3.44Å; V149-T153 PolarHBondContact O-N 3.03Å; V149-T153 PolarHBondContact O-OG1 2.86Å; V149-T153 VanDerWaalsContact O-OG1 3.05Å
150W97.3Very high93.2Very high48 Ų4863 Ų6318%0.18233%0.331CS..Hα-helixtrans-65-40.8-179.3-80.690.7000112.7S65 V68 A69 M72 L107 A111 I146 V147 T153 S154S65-W150 PolarHBondContact OG-NE1 3.25Å; V68-W150 HydrophobicContact CB-CH2 4.48Å; V68-W150 HydrophobicContact CB-CZ2 4.15Å; V68-W150 HydrophobicContact CG1-CH2 3.77Å; V68-W150 HydrophobicContact CG1-CZ2 3.83Å; A69-W150 HydrophobicContact CB-CH2 4.21Å; A69-W150 HydrophobicContact CB-CZ2 4.17Å; M72-W150 HydrophobicContact CE-CH2 4.08Å; M72-W150 HydrophobicContact CE-CZ3 3.83Å; L107-W150 HydrophobicContact CD2-CZ3 4.38Å; L107-W150 HydrophobicContact CG-CZ3 4.3Å; A111-W150 HydrophobicContact CB-CE3 4.45Å; A111-W150 HydrophobicContact CB-CH2 4.23Å; A111-W150 HydrophobicContact CB-CZ2 4.35Å; A111-W150 HydrophobicContact CB-CZ3 4.28Å; I146-W150 PolarHBondContact O-N 2.88Å; V147-W150 PolarHBondContact O-N 3.48Å; W150-T153 PolarHBondContact O-OG1 3.41Å; W150-S154 WeakPolarHBondContact O-CB 3.46Å; W150-S154 PolarHBondContact O-N 2.91Å; W150-S154 PolarHBondContact O-OG 3.36Å
151A97.1Very high93.2Very high59 Ų5962.2 Ų62.249%0.48832%0.316SS..Hα-helixtrans-62.7-46.1176.200000111.2V147 V148 V149 S154 L155V147-A151 VanDerWaalsContact O-CB 3.3Å; V147-A151 WeakPolarHBondContact O-CB 3.34Å; V147-A151 PolarHBondContact O-N 2.85Å; V148-A151 PolarHBondContact O-N 3.38Å; V149-A151 PolarHBondContact O-N 3.11Å; A151-S154 PolarHBondContact O-N 2.89Å; A151-L155 WeakPolarHBondContact O-CB 3.46Å; A151-L155 PolarHBondContact O-N 3.32Å
152F95.1Very high92.9Very high94 Ų9465.4 Ų65.441%0.41233%0.329SS..Hα-helixtrans-61-49.8177.5172.9-104.6000112V148 V149 S154 L155 Y156 M199 F200V148-F152 VanDerWaalsContact O-CB 3.27Å; V148-F152 WeakPolarHBondContact O-CB 3.39Å; V148-F152 PolarHBondContact O-N 2.88Å; V149-F152 PolarHBondContact O-N 3.41Å; F152-S154 PolarHBondContact O-N 3.34Å; F152-L155 PolarHBondContact O-N 3.39Å; F152-Y156 WeakPolarHBondContact O-CB 3.39Å; F152-Y156 PolarHBondContact O-N 3.5Å; F152-M199 HydrophobicContact CE1-SD 4.08Å; F152-M199 HydrophobicContact CZ-CE 4.24Å; F152-M199 HydrophobicContact CZ-SD 3.61Å; F152-F200 HydrophobicContact CE1-CE1 4.03Å; F152-F200 AromaticContact CE1-CZ 3.89Å; F152-F200 HydrophobicContact CE1-CZ 3.89Å
153T95.7Very high92.5Very high0 Ų066 Ų660%033%0.332CS..Hα-helixtrans-68.7-35.4-178.955.70000112.3L107 N110 A111 C114 V149 W150 C157 F200L107-T153 WeakPolarHBondContact CD1-OG1 3.44Å; N110-T153 HydrophobicContact CB-CG2 4.38Å; A111-T153 HydrophobicContact CB-CG2 4.48Å; C114-T153 HydrophobicContact CB-CG2 4.41Å; V149-T153 WeakPolarHBondContact O-CG2 3.44Å; V149-T153 PolarHBondContact O-N 3.03Å; V149-T153 PolarHBondContact O-OG1 2.86Å; V149-T153 VanDerWaalsContact O-OG1 3.05Å; W150-T153 PolarHBondContact O-OG1 3.41Å; T153-C157 VanDerWaalsContact O-CB 3.28Å; T153-C157 WeakPolarHBondContact O-CB 3.43Å; T153-C157 PolarHBondContact O-N 3.27Å; T153-C157 PolarHBondContact O-SG 3.43Å; T153-F200 HydrophobicContact CG2-CE1 4.02Å
154S95.7Very high92.2Very high33 Ų3360.1 Ų60.123%0.23131%0.307CS..Hα-helixtrans-65.7-45.2175.8-57.50000111.4W150 A151 F152 C157 A158W150-S154 WeakPolarHBondContact O-CB 3.46Å; W150-S154 PolarHBondContact O-N 2.91Å; W150-S154 PolarHBondContact O-OG 3.36Å; A151-S154 PolarHBondContact O-N 2.89Å; F152-S154 PolarHBondContact O-N 3.34Å; S154-C157 PolarHBondContact O-N 3.16Å; S154-A158 PolarHBondContact O-N 2.63Å
155L94.8Very high91.8Very high139 Ų13954.2 Ų54.273%0.72828%0.282SS*.Hα-helixtrans-62.2-45.8177179.861.7000111.4A151 F152 C157 A158A151-L155 WeakPolarHBondContact O-CB 3.46Å; A151-L155 PolarHBondContact O-N 3.32Å; F152-L155 PolarHBondContact O-N 3.39Å; L155-C157 VanDerWaalsContact C-N 3.34Å; L155-C157 PolarHBondContact O-N 2.92Å; L155-A158 WeakPolarHBondContact O-CB 3.14Å; L155-A158 PolarHBondContact O-N 3.26Å
156Y92.4Very high91.3Very high43 Ų4352.7 Ų52.717%0.16927%0.274CS..Hα-helixtrans-60.2-44.6176.2179.4-87.5000111.6F152 A158 D196 M199 F200F152-Y156 WeakPolarHBondContact O-CB 3.39Å; F152-Y156 PolarHBondContact O-N 3.5Å; Y156-A158 VanDerWaalsContact C-N 3.28Å; Y156-A158 PolarHBondContact O-N 2.87Å; Y156-D196 WeakPolarHBondContact CE1-OD1 3.45Å; Y156-D196 WeakPolarHBondContact OH-CA 3.33Å; Y156-D196 WeakPolarHBondContact OH-CB 3.46Å; Y156-D196 PolarHBondContact OH-N 3.29Å; Y156-D196 PolarHBondContact OH-OD1 2.87Å; Y156-M199 HydrophobicContact CD2-SD 4.31Å; Y156-M199 HydrophobicContact CE2-SD 4.21Å; Y156-F200 AromaticContact CD1-CE2 3.6Å; Y156-F200 HydrophobicContact CD1-CE2 3.6Å; Y156-F200 AromaticContact CD1-CZ 3.93Å; Y156-F200 HydrophobicContact CD1-CZ 3.93Å; Y156-F200 HydrophobicContact CD2-CE2 4.21Å; Y156-F200 HydrophobicContact CD2-CZ 4.46Å; Y156-F200 HydrophobicContact CE1-CD2 4.24Å; Y156-F200 AromaticContact CE1-CE2 3.45Å; Y156-F200 HydrophobicContact CE1-CE2 3.45Å; Y156-F200 VanDerWaalsContact CE1-CE2 3.45Å; Y156-F200 HydrophobicContact CE1-CZ 4.25Å; Y156-F200 HydrophobicContact CE2-CE2 4.06Å; Y156-F200 AromaticContact CG-CE2 3.99Å; Y156-F200 HydrophobicContact CG-CE2 3.99Å; Y156-F200 HydrophobicContact CG-CZ 4.05Å; Y156-F200 AromaticContact CZ-CE2 3.67Å
157C92.5Very high90.6Very high0 Ų054 Ų540%028%0.281CS..Hα-helixtrans-74.6-14.6-177.4-65.90000113.8Y103 L107 T153 S154 L155 M159 W160Y103-C157 HydrophobicContact CD2-CB 4.02Å; Y103-C157 WeakPolarHBondContact CD2-O 3.45Å; Y103-C157 HydrophobicContact CE2-CB 3.75Å; L107-C157 HydrophobicContact CB-CB 4.35Å; T153-C157 VanDerWaalsContact O-CB 3.28Å; T153-C157 WeakPolarHBondContact O-CB 3.43Å; T153-C157 PolarHBondContact O-N 3.27Å; T153-C157 PolarHBondContact O-SG 3.43Å; S154-C157 PolarHBondContact O-N 3.16Å; L155-C157 VanDerWaalsContact C-N 3.34Å; L155-C157 PolarHBondContact O-N 2.92Å; C157-M159 PolarHBondContact O-N 3.49Å; C157-M159 VanDerWaalsContact O-N 3.08Å; C157-W160 WeakPolarHBondContact O-CB 3.44Å; C157-W160 VanDerWaalsContact O-CD1 3.29Å; C157-W160 PolarHBondContact O-N 3.27Å
158A91.4Very high89.9Confident35 Ų3555.9 Ų55.929%0.28928%0.284SS..THydrogen-bonded Turntrans-56.4-28.5177.800000112.3S154 L155 Y156 W160 F161S154-A158 PolarHBondContact O-N 2.63Å; L155-A158 WeakPolarHBondContact O-CB 3.14Å; L155-A158 PolarHBondContact O-N 3.26Å; Y156-A158 VanDerWaalsContact C-N 3.28Å; Y156-A158 PolarHBondContact O-N 2.87Å; A158-W160 PolarHBondContact O-N 2.96Å; A158-F161 WeakPolarHBondContact O-CB 3.38Å; A158-F161 PolarHBondContact O-N 3.48Å; A158-F161 VanDerWaalsContact O-N 3.15Å
159M88.3Confident89.1Confident59 Ų5953.3 Ų53.329%0.29127%0.267SS..THydrogen-bonded Turntrans-57.2-31.5173.2170179152.400113.7C157 F161 Y162 L163 I192C157-M159 PolarHBondContact O-N 3.49Å; C157-M159 VanDerWaalsContact O-N 3.08Å; M159-F161 PolarHBondContact O-N 3.27Å; M159-Y162 PolarHBondContact O-N 3.06Å; M159-L163 HydrophobicContact CE-CD1 3.42Å; M159-L163 VanDerWaalsContact CE-CD1 3.42Å; M159-L163 HydrophobicContact CE-CD2 3.98Å; M159-L163 HydrophobicContact CE-CG 4.36Å; M159-L163 HydrophobicContact CG-CD1 3.4Å; M159-L163 WeakPolarHBondContact O-CD1 3.37Å; M159-L163 PolarHBondContact O-N 3.11Å; M159-L163 HydrophobicContact SD-CD1 4.33Å; M159-I192 HydrophobicContact CE-CB 3.84Å; M159-I192 HydrophobicContact CE-CD1 3.07Å; M159-I192 HydrophobicContact CE-CG1 3.3Å; M159-I192 HydrophobicContact CE-CG2 3.28Å
160W86.8Confident88.3Confident2 Ų256.5 Ų56.51%0.00828%0.282CS..Hα-helixtrans-63.3-23.6177.9-67.1112.6000113.4Y106 C157 A158 Y162 L163 S164 Y181 I192 Y193Y106-W160 AromaticContact CD1-CE2 3.96Å; Y106-W160 AromaticContact CD1-CZ2 3.86Å; Y106-W160 HydrophobicContact CD1-CZ2 3.86Å; Y106-W160 AromaticContact CD2-CD1 3.95Å; Y106-W160 AromaticContact CD2-CD2 3.53Å; Y106-W160 HydrophobicContact CD2-CD2 3.53Å; Y106-W160 AromaticContact CD2-CE2 3.51Å; Y106-W160 HydrophobicContact CD2-CE3 4Å; Y106-W160 AromaticContact CD2-CG 3.85Å; Y106-W160 HydrophobicContact CD2-CG 3.85Å; Y106-W160 HydrophobicContact CD2-CH2 4.41Å; Y106-W160 AromaticContact CD2-CZ2 3.97Å; Y106-W160 HydrophobicContact CD2-CZ2 3.97Å; Y106-W160 HydrophobicContact CD2-CZ3 4.42Å; Y106-W160 AromaticContact CD2-NE1 3.77Å; Y106-W160 HydrophobicContact CE1-CH2 4.19Å; Y106-W160 AromaticContact CE1-CZ2 3.85Å; Y106-W160 HydrophobicContact CE1-CZ2 3.85Å; Y106-W160 AromaticContact CE2-CD2 3.89Å; Y106-W160 HydrophobicContact CE2-CD2 3.89Å; Y106-W160 AromaticContact CE2-CE2 3.93Å; Y106-W160 AromaticContact CE2-CE3 3.87Å; Y106-W160 HydrophobicContact CE2-CE3 3.87Å; Y106-W160 AromaticContact CE2-CH2 4Å; Y106-W160 HydrophobicContact CE2-CH2 4Å; Y106-W160 AromaticContact CE2-CZ2 3.99Å; Y106-W160 HydrophobicContact CE2-CZ2 3.99Å; Y106-W160 AromaticContact CE2-CZ3 3.94Å; Y106-W160 HydrophobicContact CE2-CZ3 3.94Å; Y106-W160 AromaticContact CG-CD1 3.93Å; Y106-W160 HydrophobicContact CG-CD2 4.06Å; Y106-W160 AromaticContact CG-CE2 3.56Å; Y106-W160 HydrophobicContact CG-CG 4.29Å; Y106-W160 AromaticContact CG-CZ2 3.94Å; Y106-W160 HydrophobicContact CG-CZ2 3.94Å; Y106-W160 AromaticContact CG-NE1 3.48Å; Y106-W160 AromaticContact CZ-CH2 3.88Å; Y106-W160 AromaticContact CZ-CZ2 3.93Å; C157-W160 WeakPolarHBondContact O-CB 3.44Å; C157-W160 VanDerWaalsContact O-CD1 3.29Å; C157-W160 PolarHBondContact O-N 3.27Å; A158-W160 PolarHBondContact O-N 2.96Å; W160-Y162 VanDerWaalsContact C-N 3.26Å; W160-Y162 PolarHBondContact O-N 3.13Å; W160-L163 HydrophobicContact CE3-CB 4.41Å; W160-L163 PolarHBondContact O-N 3.47Å; W160-S164 WeakPolarHBondContact O-CB 3.21Å; W160-S164 PolarHBondContact O-N 2.91Å; W160-S164 VanDerWaalsContact O-N 3.13Å; W160-S164 PolarHBondContact O-OG 3.33Å; W160-Y181 AromaticContact CE3-CE1 3.67Å; W160-Y181 HydrophobicContact CE3-CE1 3.67Å; W160-Y181 HydrophobicContact CZ3-CD1 4.27Å; W160-Y181 AromaticContact CZ3-CE1 3.39Å; W160-Y181 HydrophobicContact CZ3-CE1 3.39Å; W160-Y181 AromaticContact CZ3-CZ 3.78Å; W160-I192 HydrophobicContact CH2-CG2 4.47Å; W160-Y193 HydrophobicContact CH2-CD1 4.21Å; W160-Y193 AromaticContact CH2-CE1 3.57Å; W160-Y193 HydrophobicContact CH2-CE1 3.57Å; W160-Y193 HydrophobicContact CZ3-CE1 4.25Å
161F87.8Confident87.4Confident80 Ų8056.6 Ų56.635%0.35128%0.283SS..Hα-helixtrans-64.5-32.1171.9-74.5-63.1000112.7L99 Y103 A158 M159L99-F161 HydrophobicContact CB-CD1 3.96Å; L99-F161 HydrophobicContact CB-CE1 4.23Å; L99-F161 WeakPolarHBondContact CD2-O 3.31Å; Y103-F161 HydrophobicContact CD1-CE2 4.05Å; Y103-F161 AromaticContact CD1-CZ 3.79Å; Y103-F161 HydrophobicContact CD1-CZ 3.79Å; Y103-F161 AromaticContact CD2-CD2 3.84Å; Y103-F161 HydrophobicContact CD2-CD2 3.84Å; Y103-F161 AromaticContact CD2-CE2 3.3Å; Y103-F161 HydrophobicContact CD2-CE2 3.3Å; Y103-F161 AromaticContact CD2-CZ 3.79Å; Y103-F161 HydrophobicContact CD2-CZ 3.79Å; Y103-F161 HydrophobicContact CE1-CE2 4.36Å; Y103-F161 HydrophobicContact CE1-CZ 4.41Å; Y103-F161 HydrophobicContact CE2-CD2 4.32Å; Y103-F161 AromaticContact CE2-CE2 3.68Å; Y103-F161 HydrophobicContact CE2-CE2 3.68Å; Y103-F161 HydrophobicContact CE2-CZ 4.4Å; Y103-F161 HydrophobicContact CG-CD2 4.31Å; Y103-F161 HydrophobicContact CG-CE1 4.21Å; Y103-F161 AromaticContact CG-CE2 3.5Å; Y103-F161 HydrophobicContact CG-CE2 3.5Å; Y103-F161 AromaticContact CG-CZ 3.44Å; Y103-F161 HydrophobicContact CG-CZ 3.44Å; Y103-F161 VanDerWaalsContact CG-CZ 3.44Å; A158-F161 WeakPolarHBondContact O-CB 3.38Å; A158-F161 PolarHBondContact O-N 3.48Å; A158-F161 VanDerWaalsContact O-N 3.15Å; M159-F161 PolarHBondContact O-N 3.27Å
162Y83.2Confident86.4Confident188 Ų18858 Ų5874%0.73728%0.282SS*.Hα-helixtrans-85.1-28.1179.4-69-86.7000112.4M159 W160M159-Y162 PolarHBondContact O-N 3.06Å; W160-Y162 VanDerWaalsContact C-N 3.26Å; W160-Y162 PolarHBondContact O-N 3.13Å
163L82.4Confident85.7Confident14 Ų1459.5 Ų59.57%0.07330%0.295CS..Hα-helixtrans-85.2-26-177.2-88.390.3000114.1M159 W160 Y181 K182 L189 I192M159-L163 HydrophobicContact CE-CD1 3.42Å; M159-L163 VanDerWaalsContact CE-CD1 3.42Å; M159-L163 HydrophobicContact CE-CD2 3.98Å; M159-L163 HydrophobicContact CE-CG 4.36Å; M159-L163 HydrophobicContact CG-CD1 3.4Å; M159-L163 WeakPolarHBondContact O-CD1 3.37Å; M159-L163 PolarHBondContact O-N 3.11Å; M159-L163 HydrophobicContact SD-CD1 4.33Å; W160-L163 HydrophobicContact CE3-CB 4.41Å; W160-L163 PolarHBondContact O-N 3.47Å; L163-Y181 HydrophobicContact CB-CD1 4.14Å; L163-Y181 CarbonylContact O-C 3.45Å; L163-Y181 WeakPolarHBondContact O-CA 3.26Å; L163-K182 PolarHBondContact O-N 3.18Å; L163-L189 HydrophobicContact CD2-CD2 3.7Å; L163-I192 HydrophobicContact CD2-CD1 3.73Å
164S84.8Confident85Confident3 Ų363.5 Ų63.52%0.02132%0.315CS..EExtended strand (participates in β ladder)trans-90.4134.4-175.6-44.10000109.9L99 T102 W160L99-S164 WeakPolarHBondContact CD2-O 3.3Å; T102-S164 VanDerWaalsContact CG2-OG 3.27Å; T102-S164 WeakPolarHBondContact CG2-OG 3.49Å; W160-S164 WeakPolarHBondContact O-CB 3.21Å; W160-S164 PolarHBondContact O-N 2.91Å; W160-S164 VanDerWaalsContact O-N 3.13Å; W160-S164 PolarHBondContact O-OG 3.33Å
165D84.8Confident84.2Confident30 Ų3065.5 Ų65.516%0.1633%0.326CS..EExtended strand (participates in β ladder)trans-145.2167.9176.4-149.2-14.4000110.5Y95 C98 E180 K182Y95-D165 WeakPolarHBondContact CE2-OD1 3.36Å; C98-D165 PolarHBondContact SG-O 2.88Å; D165-E180 PolarHBondContact N-O 2.75Å; D165-E180 PolarHBondContact O-N 3.24Å; D165-K182 HydrophobicContact CB-CB 3.84Å; D165-K182 HydrophobicContact CB-CG 4.01Å; D165-K182 WeakPolarHBondContact OD2-CG 3.28Å; D165-K182 IonicContact OD2-NZ 2.58Å; D165-K182 PolarHBondContact OD2-NZ 3.37Å
166M84.3Confident83.6Confident42 Ų4259.6 Ų59.621%0.20730%0.296CS..EExtended strand (participates in β ladder)trans-100.7124.2177.6-72.2-77.3-78.300109.8W91 Y95 C98 V177 C179W91-M166 HydrophobicContact CB-CE 4.42Å; W91-M166 HydrophobicContact CB-SD 4.44Å; W91-M166 VanDerWaalsContact CD1-CE 3.43Å; W91-M166 HydrophobicContact CG-CE 4.21Å; W91-M166 HydrophobicContact CG-SD 3.98Å; Y95-M166 HydrophobicContact CD2-CB 4.4Å; Y95-M166 HydrophobicContact CD2-CG 3.94Å; C98-M166 HydrophobicContact CB-CG 3.94Å; C98-M166 HydrophobicContact CB-SD 3.62Å; M166-V177 HydrophobicContact CE-CB 4.42Å; M166-V177 HydrophobicContact CE-CG1 3.19Å; M166-V177 HydrophobicContact SD-CG1 4.33Å; M166-C179 HydrophobicContact SD-CB 4.02Å
167N80.9Confident83.2Confident54 Ų5460 Ų6029%0.28930%0.302SS..EExtended strand (participates in β ladder)trans-114.7134.2176.6-68.3-22.4000110S178 E180N167-S178 PolarHBondContact N-O 3.24Å; N167-S178 PolarHBondContact O-N 3.17Å; N167-S178 PolarHBondContact O-OG 3Å; N167-E180 WeakPolarHBondContact ND2-CB 3.37Å; N167-E180 PolarHBondContact ND2-OE2 3.4Å
168E81.3Confident82.7Confident141 Ų14160.6 Ų60.666%0.65931%0.307SS*.EExtended strand (participates in β ladder)trans-89.8113.8170.8-62.2-171.8173.500109T175 V177E168-T175 HydrophobicContact CB-CG2 4.12Å; E168-V177 HydrophobicContact CG-CG2 4.41Å
169L77.9Confident82.4Confident35 Ų3560.5 Ų60.518%0.18330%0.303CS..EExtended strand (participates in β ladder)trans-93109176-60176.6000108.2L13 Y171 T175 V176L13-L169 HydrophobicContact CD1-CB 4Å; L13-L169 HydrophobicContact CD1-CD2 3.99Å; L13-L169 HydrophobicContact CD1-CG 4.46Å; L169-Y171 HydrophobicContact CB-CD2 4.22Å; L169-Y171 HydrophobicContact CB-CE2 3.57Å; L169-Y171 HydrophobicContact CD1-CE2 4.34Å; L169-Y171 WeakPolarHBondContact O-CD2 3.31Å; L169-Y171 PolarHBondContact O-N 3.31Å; L169-T175 WeakPolarHBondContact O-CA 3.38Å; L169-V176 WeakPolarHBondContact CB-O 3.48Å; L169-V176 PolarHBondContact N-O 2.93Å; L169-V176 PolarHBondContact O-N 2.83Å
170I80.3Confident81.7Confident88 Ų8861.4 Ų61.445%0.45131%0.307SS..EExtended strand (participates in β ladder)trans-86.6107.8178.2-53.9174.1000108.1T12 L13 T175T12-I170 HydrophobicContact CG2-CG2 4.36Å; L13-I170 PolarHBondContact N-O 2.78Å; L13-I170 VanDerWaalsContact N-O 3.1Å; I170-T175 HydrophobicContact CG1-CG2 4.2Å
171Y78.8Confident81Confident50 Ų5064.7 Ų64.720%0.19632%0.32CS..BIsolated β-bridgetrans-97159.2170.9-61.9-93.7000110.2L13 G14 W16 L169 N173 I174 V176L13-Y171 HydrophobicContact CB-CD1 3.32Å; L13-Y171 HydrophobicContact CB-CE1 3.46Å; L13-Y171 VanDerWaalsContact CB-CE1 3.46Å; L13-Y171 HydrophobicContact CB-CG 4.08Å; L13-Y171 HydrophobicContact CD1-CD1 4.44Å; L13-Y171 HydrophobicContact CD1-CE1 4.02Å; L13-Y171 HydrophobicContact CD1-CE2 4.43Å; L13-Y171 HydrophobicContact CG-CD1 4.48Å; L13-Y171 HydrophobicContact CG-CE1 4.26Å; L13-Y171 WeakPolarHBondContact O-CA 3.32Å; G14-Y171 VanDerWaalsContact O-CD1 3.25Å; G14-Y171 WeakPolarHBondContact O-CD1 3.21Å; W16-Y171 HydrophobicContact CB-CD1 3.76Å; W16-Y171 HydrophobicContact CB-CD2 4.02Å; W16-Y171 HydrophobicContact CB-CE1 4.28Å; W16-Y171 HydrophobicContact CB-CG 3.61Å; W16-Y171 AromaticContact CD1-CD2 3.92Å; W16-Y171 AromaticContact CD1-CE2 3.64Å; W16-Y171 AromaticContact CD1-CZ 3.7Å; W16-Y171 HydrophobicContact CG-CD1 4.48Å; W16-Y171 HydrophobicContact CG-CD2 4.25Å; W16-Y171 HydrophobicContact CG-CE2 4.39Å; W16-Y171 HydrophobicContact CG-CG 4.3Å; L169-Y171 HydrophobicContact CB-CD2 4.22Å; L169-Y171 HydrophobicContact CB-CE2 3.57Å; L169-Y171 HydrophobicContact CD1-CE2 4.34Å; L169-Y171 WeakPolarHBondContact O-CD2 3.31Å; L169-Y171 PolarHBondContact O-N 3.31Å; Y171-N173 PolarHBondContact O-N 2.92Å; Y171-I174 WeakPolarHBondContact CA-O 3.21Å; Y171-I174 VanDerWaalsContact CB-O 3.25Å; Y171-I174 WeakPolarHBondContact CB-O 3.37Å; Y171-I174 PolarHBondContact N-O 3.38Å; Y171-I174 PolarHBondContact O-N 3.42Å; Y171-V176 HydrophobicContact CD2-CB 4.34Å; Y171-V176 HydrophobicContact CD2-CG2 4.03Å; Y171-V176 HydrophobicContact CE2-CB 4.05Å; Y171-V176 HydrophobicContact CE2-CG2 4.05Å
172D76.1Confident79.8Confident89 Ų8967.1 Ų67.148%0.47633%0.33SS..SBendtrans-51-29.1179.2-69.1-31.7000113.8T12 L13T12-D172 WeakPolarHBondContact CB-OD1 3.39Å; T12-D172 PolarHBondContact OG1-OD1 3.31Å; L13-D172 PolarHBondContact O-N 3.46Å
173N79.1Confident78.7Confident125 Ų12560.4 Ų60.467%0.66831%0.309SS*.SBendtrans-110.2-20.6-174.8-61.6-28.8000114.6Y171Y171-N173 PolarHBondContact O-N 2.92Å
174I80.7Confident77.5Confident83 Ų8363.9 Ų63.943%0.42633%0.334SS..  trans-163.6148.7-171.9-169.7163.9000111.8W16 Y171 V176W16-I174 HydrophobicContact CB-CG2 3.88Å; W16-I174 HydrophobicContact CD2-CG2 4.18Å; W16-I174 HydrophobicContact CE3-CG2 4.19Å; W16-I174 HydrophobicContact CG-CG2 4.09Å; Y171-I174 WeakPolarHBondContact CA-O 3.21Å; Y171-I174 VanDerWaalsContact CB-O 3.25Å; Y171-I174 WeakPolarHBondContact CB-O 3.37Å; Y171-I174 PolarHBondContact N-O 3.38Å; Y171-I174 PolarHBondContact O-N 3.42Å; I174-V176 HydrophobicContact CG2-CG2 3.95Å
175T80.3Confident76.3Confident75 Ų7569.8 Ų69.846%0.4636%0.356SS..EExtended strand (participates in β ladder)trans-92.8120.3167.6-51.30000109.7E168 L169 I170E168-T175 HydrophobicContact CB-CG2 4.12Å; L169-T175 WeakPolarHBondContact O-CA 3.38Å; I170-T175 HydrophobicContact CG1-CG2 4.2Å
176V81.5Confident75.1Confident16 Ų1674.8 Ų74.810%0.09738%0.383CS..EExtended strand (participates in β ladder)trans-109.5124.3177.3-177.40000109.3W16 L169 Y171 I174W16-V176 HydrophobicContact CD2-CG2 4.41Å; W16-V176 HydrophobicContact CG-CG2 4.3Å; L169-V176 WeakPolarHBondContact CB-O 3.48Å; L169-V176 PolarHBondContact N-O 2.93Å; L169-V176 PolarHBondContact O-N 2.83Å; Y171-V176 HydrophobicContact CD2-CB 4.34Å; Y171-V176 HydrophobicContact CD2-CG2 4.03Å; Y171-V176 HydrophobicContact CE2-CB 4.05Å; Y171-V176 HydrophobicContact CE2-CG2 4.05Å; I174-V176 HydrophobicContact CG2-CG2 3.95Å
177V84Confident73.9Confident50 Ų5078.9 Ų78.930%0.30341%0.405SS..EExtended strand (participates in β ladder)trans-84.2128.4174.8-167.80000109.2W91 M166 E168W91-V177 WeakPolarHBondContact CB-O 3.48Å; W91-V177 PolarHBondContact N-O 3.47Å; M166-V177 HydrophobicContact CE-CB 4.42Å; M166-V177 HydrophobicContact CE-CG1 3.19Å; M166-V177 HydrophobicContact SD-CG1 4.33Å; E168-V177 HydrophobicContact CG-CG2 4.41Å
178S83.3Confident73.1Confident14 Ų1483.4 Ų83.410%0.09842%0.419CS..EExtended strand (participates in β ladder)trans-126.5146.8-179.8670000111N167N167-S178 PolarHBondContact N-O 3.24Å; N167-S178 PolarHBondContact O-N 3.17Å; N167-S178 PolarHBondContact O-OG 3Å
179C83.7Confident72.5Confident32 Ų3277.2 Ų77.222%0.21639%0.39CS..EExtended strand (participates in β ladder)trans-92.8108.5170.8177.50000107.5W91 C98 M166W91-C179 HydrophobicContact CB-CB 4.42Å; W91-C179 HydrophobicContact CD2-CB 3.59Å; W91-C179 HydrophobicContact CE3-CB 3.77Å; W91-C179 HydrophobicContact CG-CB 3.88Å; W91-C179 HydrophobicContact CZ3-CB 4.3Å; C98-C179 WeakPolarHBondContact CA-SG 3.39Å; C98-C179 HydrophobicContact CB-CB 3.75Å; C98-C179 WeakPolarHBondContact CB-SG 3.28Å; C98-C179 WeakPolarHBondContact SG-CB 3.25Å; C98-C179 CovalentContact SG-SG 2.03Å; C98-C179 PolarHBondContact SG-SG 3.38Å; M166-C179 HydrophobicContact SD-CB 4.02Å
180E74.8Confident72.2Confident79 Ų7976.7 Ų76.737%0.36939%0.389SS..EExtended strand (participates in β ladder)trans-128.6173.7-174.4-78.1-170.7165.700111.1D165 N167D165-E180 PolarHBondContact N-O 2.75Å; D165-E180 PolarHBondContact O-N 3.24Å; N167-E180 WeakPolarHBondContact ND2-CB 3.37Å; N167-E180 PolarHBondContact ND2-OE2 3.4Å
181Y71.9Confident72.2Confident70 Ų7079.5 Ų79.528%0.27540%0.398SS..EExtended strand (participates in β ladder)trans-84.7128.2178.5-63.3-68.9000111.2Y106 W160 L163 V183 L189 Y193Y106-Y181 WeakPolarHBondContact CE2-OH 3.21Å; Y106-Y181 PolarHBondContact OH-OH 3.01Å; W160-Y181 AromaticContact CE3-CE1 3.67Å; W160-Y181 HydrophobicContact CE3-CE1 3.67Å; W160-Y181 HydrophobicContact CZ3-CD1 4.27Å; W160-Y181 AromaticContact CZ3-CE1 3.39Å; W160-Y181 HydrophobicContact CZ3-CE1 3.39Å; W160-Y181 AromaticContact CZ3-CZ 3.78Å; L163-Y181 HydrophobicContact CB-CD1 4.14Å; L163-Y181 CarbonylContact O-C 3.45Å; L163-Y181 WeakPolarHBondContact O-CA 3.26Å; Y181-V183 PolarHBondContact O-N 3.17Å; Y181-L189 HydrophobicContact CG-CD2 4.4Å; Y181-Y193 WeakPolarHBondContact CD2-OH 3.36Å; Y181-Y193 WeakPolarHBondContact CE2-OH 3.27Å; Y181-Y193 PolarHBondContact OH-OH 2.91Å
182K61Low72.4Confident131 Ų13178.1 Ų78.157%0.5739%0.394SS*.SBendtrans-58.5-28.1-178.6-161.5-176.7-176.994.40114.2L163 D165L163-K182 PolarHBondContact O-N 3.18Å; D165-K182 HydrophobicContact CB-CB 3.84Å; D165-K182 HydrophobicContact CB-CG 4.01Å; D165-K182 WeakPolarHBondContact OD2-CG 3.28Å; D165-K182 IonicContact OD2-NZ 2.58Å; D165-K182 PolarHBondContact OD2-NZ 3.37Å
183V60Low72.7Confident48 Ų4875 Ų7529%0.29138%0.376SS..SBendtrans-99.6137.3-165.2-174.80000110.8Y181 Y188 L189Y181-V183 PolarHBondContact O-N 3.17Å; V183-Y188 HydrophobicContact CG1-CD2 4.24Å; V183-L189 VanDerWaalsContact O-CD1 3.24Å; V183-L189 WeakPolarHBondContact O-CD1 3.3Å
184S57.6Low73Confident86 Ų8674.2 Ų74.260%0.60137%0.367SS*.  trans-57.2139.6174.959.90000111.6N186S184-N186 PolarHBondContact O-N 3.46Å
185R61.1Low73.3Confident127 Ų12772.1 Ų72.148%0.47936%0.358SS..THydrogen-bonded Turntrans-58.8-13.6-175.8-66.1-178.5-166.7-128.71.5114.8L189 P190R185-L189 HydrophobicContact CG-CD1 4.23Å; R185-P190 WeakPolarHBondContact O-CD 3.34Å
186N59.4Low73.7Confident136 Ų13668.6 Ų68.673%0.72734%0.336SS*.THydrogen-bonded Turntrans-92.60.5-158.3-68-30.2000116.6S184S184-N186 PolarHBondContact O-N 3.46Å
187L58Low74.1Confident127 Ų12769.9 Ų69.967%0.66534%0.34SS*.THydrogen-bonded Turntrans-146.6-45174.4-14477000115.8
188Y63.6Low74.3Confident149 Ų14969 Ų6958%0.58434%0.338SS*.THydrogen-bonded Turntrans-95.8-40.7-171.4-66.5-79.5000113.5V183 F191 I192V183-Y188 HydrophobicContact CG1-CD2 4.24Å; Y188-F191 PolarHBondContact O-N 2.88Å; Y188-I192 VanDerWaalsContact O-CD1 3.25Å; Y188-I192 WeakPolarHBondContact O-CD1 3.33Å; Y188-I192 WeakPolarHBondContact O-CG1 3.21Å; Y188-I192 PolarHBondContact O-N 3.15Å; Y188-I192 VanDerWaalsContact O-N 3.12Å
189L68.5Low74.7Confident11 Ų1171.7 Ų71.76%0.05835%0.35CS..Hα-helixtrans-57.6-44-176.6-75.2170.5000113.8L163 Y181 V183 R185 F191 I192 Y193L163-L189 HydrophobicContact CD2-CD2 3.7Å; Y181-L189 HydrophobicContact CG-CD2 4.4Å; V183-L189 VanDerWaalsContact O-CD1 3.24Å; V183-L189 WeakPolarHBondContact O-CD1 3.3Å; R185-L189 HydrophobicContact CG-CD1 4.23Å; L189-F191 PolarHBondContact O-N 3.18Å; L189-I192 PolarHBondContact O-N 2.85Å; L189-Y193 HydrophobicContact CB-CD2 4.28Å; L189-Y193 HydrophobicContact CB-CE2 4.18Å; L189-Y193 HydrophobicContact CD2-CE2 3.8Å; L189-Y193 WeakPolarHBondContact O-CD2 3.28Å; L189-Y193 PolarHBondContact O-N 3.36Å
190P73.3Confident75Confident25 Ų2570.3 Ų70.316%0.16234%0.34CS..Hα-helixtrans-63-41.6178.9-21.933.3000112.8R185 I192 F194R185-P190 WeakPolarHBondContact O-CD 3.34Å; P190-I192 VanDerWaalsContact C-N 3.33Å; P190-I192 PolarHBondContact O-N 3.17Å; P190-F194 WeakPolarHBondContact O-CB 3.29Å; P190-F194 PolarHBondContact O-N 3.4Å
191F80.1Confident75.7Confident146 Ų14667.4 Ų67.464%0.6433%0.326SS*.Hα-helixtrans-63.5-40.8178.4179.7-98.7000111.8Y188 L189 T195Y188-F191 PolarHBondContact O-N 2.88Å; L189-F191 PolarHBondContact O-N 3.18Å; F191-T195 VanDerWaalsContact O-CB 3.27Å; F191-T195 WeakPolarHBondContact O-CB 3.36Å; F191-T195 PolarHBondContact O-N 2.81Å; F191-T195 PolarHBondContact O-OG1 2.94Å
192I82.6Confident76.6Confident21 Ų2166.7 Ų66.711%0.10833%0.329CS..Hα-helixtrans-67.1-51.7-179.6-66.7164.1000110.7M159 W160 L163 Y188 L189 P190 F194 T195 D196M159-I192 HydrophobicContact CE-CB 3.84Å; M159-I192 HydrophobicContact CE-CD1 3.07Å; M159-I192 HydrophobicContact CE-CG1 3.3Å; M159-I192 HydrophobicContact CE-CG2 3.28Å; W160-I192 HydrophobicContact CH2-CG2 4.47Å; L163-I192 HydrophobicContact CD2-CD1 3.73Å; Y188-I192 VanDerWaalsContact O-CD1 3.25Å; Y188-I192 WeakPolarHBondContact O-CD1 3.33Å; Y188-I192 WeakPolarHBondContact O-CG1 3.21Å; Y188-I192 PolarHBondContact O-N 3.15Å; Y188-I192 VanDerWaalsContact O-N 3.12Å; L189-I192 PolarHBondContact O-N 2.85Å; P190-I192 VanDerWaalsContact C-N 3.33Å; P190-I192 PolarHBondContact O-N 3.17Å; I192-F194 VanDerWaalsContact C-N 3.31Å; I192-F194 PolarHBondContact O-N 3.49Å; I192-T195 PolarHBondContact O-N 3.27Å; I192-D196 WeakPolarHBondContact O-CB 3.13Å; I192-D196 PolarHBondContact O-N 3Å
193Y82.6Confident78Confident24 Ų2464.9 Ų64.99%0.09433%0.328CS..Hα-helixtrans-65.7-36.4179.9-73.6-56.9000112.2W160 Y181 L189 F197 V284 S288W160-Y193 HydrophobicContact CH2-CD1 4.21Å; W160-Y193 AromaticContact CH2-CE1 3.57Å; W160-Y193 HydrophobicContact CH2-CE1 3.57Å; W160-Y193 HydrophobicContact CZ3-CE1 4.25Å; Y181-Y193 WeakPolarHBondContact CD2-OH 3.36Å; Y181-Y193 WeakPolarHBondContact CE2-OH 3.27Å; Y181-Y193 PolarHBondContact OH-OH 2.91Å; L189-Y193 HydrophobicContact CB-CD2 4.28Å; L189-Y193 HydrophobicContact CB-CE2 4.18Å; L189-Y193 HydrophobicContact CD2-CE2 3.8Å; L189-Y193 WeakPolarHBondContact O-CD2 3.28Å; L189-Y193 PolarHBondContact O-N 3.36Å; Y193-F197 WeakPolarHBondContact O-CB 3.27Å; Y193-F197 PolarHBondContact O-N 2.94Å; Y193-V284 HydrophobicContact CD1-CG1 3.11Å; Y193-V284 HydrophobicContact CD2-CG1 4.04Å; Y193-V284 HydrophobicContact CE1-CG1 3.4Å; Y193-V284 VanDerWaalsContact CE1-CG1 3.4Å; Y193-V284 HydrophobicContact CE2-CG1 4.3Å; Y193-V284 HydrophobicContact CG-CG1 3.45Å; Y193-V284 VanDerWaalsContact CG-CG1 3.45Å; Y193-S288 VanDerWaalsContact CD2-OG 3.29Å; Y193-S288 WeakPolarHBondContact CD2-OG 3.26Å
194F85.8Confident79.4Confident109 Ų10962.9 Ų62.948%0.47832%0.317SS..Hα-helixtrans-65-43.5173.2-176.9-95.4000111.8P190 I192 F197 A198P190-F194 WeakPolarHBondContact O-CB 3.29Å; P190-F194 PolarHBondContact O-N 3.4Å; I192-F194 VanDerWaalsContact C-N 3.31Å; I192-F194 PolarHBondContact O-N 3.49Å; F194-F197 PolarHBondContact O-N 3.25Å; F194-A198 WeakPolarHBondContact O-CB 3.38Å; F194-A198 PolarHBondContact O-N 3.44Å
195T87.1Confident80.9Confident38 Ų3860.7 Ų60.723%0.23330%0.298CS..Hα-helixtrans-63-44.8176.6-60.90000111F191 I192 A198 M199F191-T195 VanDerWaalsContact O-CB 3.27Å; F191-T195 WeakPolarHBondContact O-CB 3.36Å; F191-T195 PolarHBondContact O-N 2.81Å; F191-T195 PolarHBondContact O-OG1 2.94Å; I192-T195 PolarHBondContact O-N 3.27Å; T195-A198 PolarHBondContact O-N 3.39Å; T195-M199 WeakPolarHBondContact O-CB 3.38Å; T195-M199 PolarHBondContact O-N 3.47Å
196D88.3Confident82.3Confident1 Ų160.1 Ų60.11%0.00530%0.302CS..Hα-helixtrans-63.2-42.8177.5-166.881.2000111.5N110 Y156 I192 F200 R281N110-D196 PolarHBondContact ND2-OD1 3.36Å; Y156-D196 WeakPolarHBondContact CE1-OD1 3.45Å; Y156-D196 WeakPolarHBondContact OH-CA 3.33Å; Y156-D196 WeakPolarHBondContact OH-CB 3.46Å; Y156-D196 PolarHBondContact OH-N 3.29Å; Y156-D196 PolarHBondContact OH-OD1 2.87Å; I192-D196 WeakPolarHBondContact O-CB 3.13Å; I192-D196 PolarHBondContact O-N 3Å; D196-F200 WeakPolarHBondContact O-CB 3.2Å; D196-F200 PolarHBondContact O-N 2.92Å; D196-F200 WeakPolarHBondContact OD1-CD2 3.41Å; D196-R281 IonicContact OD2-CZ 2.83Å; D196-R281 VanDerWaalsContact OD2-CZ 3.32Å; D196-R281 IonicContact OD2-NH1 3.32Å; D196-R281 PolarHBondContact OD2-NH1 3.23Å; D196-R281 IonicContact OD2-NH2 2.65Å; D196-R281 PolarHBondContact OD2-NH2 3.37Å
197F88.5Confident83.7Confident44 Ų4456.8 Ų56.819%0.19328%0.284CS..Hα-helixtrans-59.8-49.7173.3177.1-108.9000112.3Y193 F194 Y201 V202 R281 V285Y193-F197 WeakPolarHBondContact O-CB 3.27Å; Y193-F197 PolarHBondContact O-N 2.94Å; F194-F197 PolarHBondContact O-N 3.25Å; F197-Y201 AromaticContact CD2-CD1 3.94Å; F197-Y201 HydrophobicContact CD2-CD1 3.94Å; F197-Y201 HydrophobicContact CD2-CG 4.41Å; F197-Y201 AromaticContact CE2-CD1 3.3Å; F197-Y201 HydrophobicContact CE2-CD1 3.3Å; F197-Y201 AromaticContact CE2-CE1 3.82Å; F197-Y201 HydrophobicContact CE2-CE1 3.82Å; F197-Y201 HydrophobicContact CE2-CG 4.15Å; F197-Y201 AromaticContact CZ-CD1 3.8Å; F197-Y201 HydrophobicContact CZ-CD1 3.8Å; F197-Y201 HydrophobicContact CZ-CE1 4.15Å; F197-Y201 WeakPolarHBondContact O-CA 3.32Å; F197-Y201 VanDerWaalsContact O-CB 3.28Å; F197-Y201 WeakPolarHBondContact O-CB 3.4Å; F197-Y201 PolarHBondContact O-N 2.86Å; F197-V202 HydrophobicContact CD1-CG2 3.86Å; F197-V202 HydrophobicContact CE1-CG2 3.46Å; F197-V202 VanDerWaalsContact CE1-CG2 3.46Å; F197-V202 HydrophobicContact CZ-CG2 3.85Å; F197-V202 PolarHBondContact O-N 3Å; F197-R281 HydrophobicContact CD2-CB 3.76Å; F197-R281 HydrophobicContact CD2-CG 4.45Å; F197-R281 HydrophobicContact CE2-CB 3.86Å; F197-V285 HydrophobicContact CB-CG2 3.85Å; F197-V285 HydrophobicContact CD1-CG2 4.33Å; F197-V285 HydrophobicContact CD2-CG2 4.23Å; F197-V285 HydrophobicContact CG-CG2 3.89Å
198A90.2Very high85Confident30 Ų3051 Ų5125%0.24826%0.255CS..Iπ-helixtrans-63.6-47.4-179.600000111.3F194 T195 V202 V203F194-A198 WeakPolarHBondContact O-CB 3.38Å; F194-A198 PolarHBondContact O-N 3.44Å; T195-A198 PolarHBondContact O-N 3.39Å; A198-V202 PolarHBondContact O-N 2.83Å; A198-V203 WeakPolarHBondContact O-CG2 3.47Å; A198-V203 PolarHBondContact O-N 3.25Å
199M90.4Very high86.1Confident72 Ų7247.8 Ų47.836%0.35525%0.251SS..Iπ-helixtrans-75.1-43.3-173.2-176.8177-77.900113.4F152 Y156 T195 P204F152-M199 HydrophobicContact CE1-SD 4.08Å; F152-M199 HydrophobicContact CZ-CE 4.24Å; F152-M199 HydrophobicContact CZ-SD 3.61Å; Y156-M199 HydrophobicContact CD2-SD 4.31Å; Y156-M199 HydrophobicContact CE2-SD 4.21Å; T195-M199 WeakPolarHBondContact O-CB 3.38Å; T195-M199 PolarHBondContact O-N 3.47Å; M199-P204 WeakPolarHBondContact O-CD 3.39Å
200F90.3Very high87Confident2 Ų250.6 Ų50.61%0.00927%0.268CS..Iπ-helixtrans-105.2-1.1-172.4-62.8-74.7000114.1N110 S113 F152 T153 Y156 D196N110-F200 HydrophobicContact CB-CD1 3.67Å; N110-F200 HydrophobicContact CB-CD2 4.25Å; N110-F200 HydrophobicContact CB-CE1 3.73Å; N110-F200 HydrophobicContact CB-CE2 4.31Å; N110-F200 HydrophobicContact CB-CG 3.94Å; N110-F200 HydrophobicContact CB-CZ 4.06Å; N110-F200 WeakPolarHBondContact OD1-CG 3.42Å; S113-F200 WeakPolarHBondContact CB-O 3.32Å; S113-F200 PolarHBondContact OG-O 3.3Å; F152-F200 HydrophobicContact CE1-CE1 4.03Å; F152-F200 AromaticContact CE1-CZ 3.89Å; F152-F200 HydrophobicContact CE1-CZ 3.89Å; T153-F200 HydrophobicContact CG2-CE1 4.02Å; Y156-F200 AromaticContact CD1-CE2 3.6Å; Y156-F200 HydrophobicContact CD1-CE2 3.6Å; Y156-F200 AromaticContact CD1-CZ 3.93Å; Y156-F200 HydrophobicContact CD1-CZ 3.93Å; Y156-F200 HydrophobicContact CD2-CE2 4.21Å; Y156-F200 HydrophobicContact CD2-CZ 4.46Å; Y156-F200 HydrophobicContact CE1-CD2 4.24Å; Y156-F200 AromaticContact CE1-CE2 3.45Å; Y156-F200 HydrophobicContact CE1-CE2 3.45Å; Y156-F200 VanDerWaalsContact CE1-CE2 3.45Å; Y156-F200 HydrophobicContact CE1-CZ 4.25Å; Y156-F200 HydrophobicContact CE2-CE2 4.06Å; Y156-F200 AromaticContact CG-CE2 3.99Å; Y156-F200 HydrophobicContact CG-CE2 3.99Å; Y156-F200 HydrophobicContact CG-CZ 4.05Å; Y156-F200 AromaticContact CZ-CE2 3.67Å; D196-F200 WeakPolarHBondContact O-CB 3.2Å; D196-F200 PolarHBondContact O-N 2.92Å; D196-F200 WeakPolarHBondContact OD1-CD2 3.41Å
201Y89.6Confident87.5Confident19 Ų1950.2 Ų50.28%0.07527%0.265CS..Iπ-helixtrans-125.6-59.7172.2-178.8-104.4000112.3F197 L205 F273 A274 W277 M278 R281F197-Y201 AromaticContact CD2-CD1 3.94Å; F197-Y201 HydrophobicContact CD2-CD1 3.94Å; F197-Y201 HydrophobicContact CD2-CG 4.41Å; F197-Y201 AromaticContact CE2-CD1 3.3Å; F197-Y201 HydrophobicContact CE2-CD1 3.3Å; F197-Y201 AromaticContact CE2-CE1 3.82Å; F197-Y201 HydrophobicContact CE2-CE1 3.82Å; F197-Y201 HydrophobicContact CE2-CG 4.15Å; F197-Y201 AromaticContact CZ-CD1 3.8Å; F197-Y201 HydrophobicContact CZ-CD1 3.8Å; F197-Y201 HydrophobicContact CZ-CE1 4.15Å; F197-Y201 WeakPolarHBondContact O-CA 3.32Å; F197-Y201 VanDerWaalsContact O-CB 3.28Å; F197-Y201 WeakPolarHBondContact O-CB 3.4Å; F197-Y201 PolarHBondContact O-N 2.86Å; Y201-L205 HydrophobicContact CE1-CD2 4.29Å; Y201-L205 WeakPolarHBondContact O-CB 3.07Å; Y201-L205 PolarHBondContact O-N 2.92Å; Y201-F273 HydrophobicContact CD2-CE1 4.14Å; Y201-F273 HydrophobicContact CD2-CZ 4.36Å; Y201-A274 PolarHBondContact OH-O 3.38Å; Y201-W277 HydrophobicContact CD2-CB 3.81Å; Y201-W277 HydrophobicContact CE2-CB 3.66Å; Y201-M278 WeakPolarHBondContact OH-CB 2.86Å; Y201-R281 HydrophobicContact CD2-CG 4.33Å; Y201-R281 HydrophobicContact CG-CG 4.28Å
202V90.4Very high87.4Confident54 Ų5444.5 Ų44.533%0.32724%0.239SC..Iπ-helixtrans-64.9-52.3-173.6179.90000112.1F197 A198 L205 M206F197-V202 HydrophobicContact CD1-CG2 3.86Å; F197-V202 HydrophobicContact CE1-CG2 3.46Å; F197-V202 VanDerWaalsContact CE1-CG2 3.46Å; F197-V202 HydrophobicContact CZ-CG2 3.85Å; F197-V202 PolarHBondContact O-N 3Å; A198-V202 PolarHBondContact O-N 2.83Å; V202-L205 PolarHBondContact O-N 3.32Å; V202-M206 HydrophobicContact CG1-CG 4.12Å; V202-M206 WeakPolarHBondContact O-CB 3.18Å; V202-M206 VanDerWaalsContact O-CG 3.25Å; V202-M206 WeakPolarHBondContact O-CG 3.35Å; V202-M206 PolarHBondContact O-N 2.92Å
203V90.3Very high87.3Confident93 Ų9345.3 Ų45.356%0.56425%0.253SS*.Hα-helixtrans-61-50.1-179167.80000111.9A198 L205 M206 L207A198-V203 WeakPolarHBondContact O-CG2 3.47Å; A198-V203 PolarHBondContact O-N 3.25Å; V203-L205 VanDerWaalsContact C-N 3.34Å; V203-L205 PolarHBondContact O-N 2.93Å; V203-M206 PolarHBondContact O-N 2.83Å; V203-L207 WeakPolarHBondContact O-CB 3.37Å; V203-L207 PolarHBondContact O-N 3.4Å
204P90.2Very high87.2Confident7 Ų748.4 Ų48.45%0.04527%0.267CS..Hα-helixtrans-52.9-46.3172.1-34.439.5000113.8S113 T117 M199 A208 F273S113-P204 WeakPolarHBondContact OG-CG 3.14Å; T117-P204 WeakPolarHBondContact OG1-CB 3.3Å; M199-P204 WeakPolarHBondContact O-CD 3.39Å; P204-A208 VanDerWaalsContact O-CB 3.25Å; P204-A208 WeakPolarHBondContact O-CB 3.48Å; P204-A208 PolarHBondContact O-N 3.48Å; P204-F273 HydrophobicContact CB-CE1 4.41Å
205L89.2Confident86.7Confident39 Ų3943.4 Ų43.420%0.20425%0.245CC..Hα-helixtrans-67.8-43.1-178.1-177.562.5000111.8Y201 V202 V203 A208 T209 V270 A274Y201-L205 HydrophobicContact CE1-CD2 4.29Å; Y201-L205 WeakPolarHBondContact O-CB 3.07Å; Y201-L205 PolarHBondContact O-N 2.92Å; V202-L205 PolarHBondContact O-N 3.32Å; V203-L205 VanDerWaalsContact C-N 3.34Å; V203-L205 PolarHBondContact O-N 2.93Å; L205-A208 PolarHBondContact O-N 3.47Å; L205-T209 WeakPolarHBondContact O-CB 3.33Å; L205-T209 PolarHBondContact O-N 3.49Å; L205-T209 PolarHBondContact O-OG1 2.92Å; L205-V270 HydrophobicContact CD1-CG1 4.35Å; L205-A274 HydrophobicContact CD1-CB 3.62Å; L205-A274 HydrophobicContact CD2-CB 4.37Å
206M89.9Confident86Confident115 Ų11543.2 Ų43.257%0.56725%0.247SC*.Hα-helixtrans-63.7-47.2177.1-73.5-61.2-71.100111V202 V203 A208 T209 V210V202-M206 HydrophobicContact CG1-CG 4.12Å; V202-M206 WeakPolarHBondContact O-CB 3.18Å; V202-M206 VanDerWaalsContact O-CG 3.25Å; V202-M206 WeakPolarHBondContact O-CG 3.35Å; V202-M206 PolarHBondContact O-N 2.92Å; V203-M206 PolarHBondContact O-N 2.83Å; M206-A208 VanDerWaalsContact C-N 3.35Å; M206-A208 PolarHBondContact O-N 3.34Å; M206-T209 PolarHBondContact O-N 2.91Å; M206-V210 WeakPolarHBondContact O-CB 3.35Å; M206-V210 VanDerWaalsContact O-CG2 3.31Å; M206-V210 WeakPolarHBondContact O-CG2 3.47Å; M206-V210 PolarHBondContact O-N 2.87Å
207L88.9Confident85.4Confident66 Ų6650.8 Ų50.835%0.34628%0.276SS..Hα-helixtrans-59.9-48.2176.9-171.276.7000110.6T117 I121 V203 T209 V210 L211T117-L207 HydrophobicContact CG2-CD2 3.43Å; T117-L207 VanDerWaalsContact CG2-CD2 3.43Å; I121-L207 HydrophobicContact CD1-CD2 3.69Å; I121-L207 HydrophobicContact CG1-CD2 3.76Å; V203-L207 WeakPolarHBondContact O-CB 3.37Å; V203-L207 PolarHBondContact O-N 3.4Å; L207-T209 VanDerWaalsContact C-N 3.35Å; L207-T209 PolarHBondContact O-N 3.48Å; L207-V210 PolarHBondContact O-N 3.39Å; L207-L211 HydrophobicContact CD1-CD1 4.35Å; L207-L211 HydrophobicContact CD1-CG 4.49Å; L207-L211 HydrophobicContact CD2-CD1 4.13Å; L207-L211 HydrophobicContact CG-CD1 3.81Å; L207-L211 HydrophobicContact CG-CG 4.25Å; L207-L211 WeakPolarHBondContact O-CB 3.46Å; L207-L211 WeakPolarHBondContact O-CG 3.43Å; L207-L211 PolarHBondContact O-N 3.41Å
208A86Confident84.6Confident7 Ų751.9 Ų51.96%0.05828%0.283CS..Hα-helixtrans-58.4-48.2178.100000111.4T120 P204 L205 M206 V210 L211 Y212 V270T120-A208 HydrophobicContact CG2-CB 4.35Å; P204-A208 VanDerWaalsContact O-CB 3.25Å; P204-A208 WeakPolarHBondContact O-CB 3.48Å; P204-A208 PolarHBondContact O-N 3.48Å; L205-A208 PolarHBondContact O-N 3.47Å; M206-A208 VanDerWaalsContact C-N 3.35Å; M206-A208 PolarHBondContact O-N 3.34Å; A208-V210 PolarHBondContact O-N 3.5Å; A208-L211 PolarHBondContact O-N 2.89Å; A208-Y212 HydrophobicContact CB-CD2 4.34Å; A208-Y212 HydrophobicContact CB-CE2 4.31Å; A208-Y212 WeakPolarHBondContact O-CB 3.33Å; A208-Y212 WeakPolarHBondContact O-CD2 3.49Å; A208-Y212 PolarHBondContact O-N 3.24Å; A208-V270 HydrophobicContact CB-CG1 3.73Å; A208-V270 HydrophobicContact CB-CG2 4.13Å
209T85.6Confident83.5Confident81 Ų8153 Ų5350%0.49729%0.285SS..Hα-helixtrans-59.6-45.1-179.9-56.60000111.7L205 M206 L207 G213L205-T209 WeakPolarHBondContact O-CB 3.33Å; L205-T209 PolarHBondContact O-N 3.49Å; L205-T209 PolarHBondContact O-OG1 2.92Å; M206-T209 PolarHBondContact O-N 2.91Å; L207-T209 VanDerWaalsContact C-N 3.35Å; L207-T209 PolarHBondContact O-N 3.48Å; T209-G213 PolarHBondContact O-N 3.32Å
210V87.2Confident82.4Confident70 Ų7056.9 Ų56.942%0.42430%0.3SS..Hα-helixtrans-64.1-47.1177.4170.60000111.2M206 L207 A208 G213 F214M206-V210 WeakPolarHBondContact O-CB 3.35Å; M206-V210 VanDerWaalsContact O-CG2 3.31Å; M206-V210 WeakPolarHBondContact O-CG2 3.47Å; M206-V210 PolarHBondContact O-N 2.87Å; L207-V210 PolarHBondContact O-N 3.39Å; A208-V210 PolarHBondContact O-N 3.5Å; V210-G213 PolarHBondContact O-N 3Å; V210-F214 HydrophobicContact CG1-CD2 3.92Å; V210-F214 HydrophobicContact CG1-CE2 3.37Å; V210-F214 HydrophobicContact CG1-CZ 3.97Å; V210-F214 WeakPolarHBondContact O-CD2 3.26Å; V210-F214 PolarHBondContact O-N 2.89Å
211L84.5Confident81.2Confident17 Ų1762.1 Ų62.19%0.08933%0.327CS..Hα-helixtrans-64.2-42.7-180-67177.7000111.9T120 I121 Y124 L207 A208 G213 F214 I215T120-L211 HydrophobicContact CG2-CB 4.28Å; T120-L211 HydrophobicContact CG2-CD1 4Å; I121-L211 HydrophobicContact CG1-CD1 3.84Å; Y124-L211 HydrophobicContact CD1-CD2 3.86Å; Y124-L211 HydrophobicContact CD2-CB 4.31Å; Y124-L211 HydrophobicContact CD2-CD2 3.91Å; Y124-L211 HydrophobicContact CE1-CD2 4.2Å; Y124-L211 HydrophobicContact CE2-CD2 4.24Å; Y124-L211 HydrophobicContact CG-CB 4.44Å; Y124-L211 HydrophobicContact CG-CD2 3.72Å; L207-L211 HydrophobicContact CD1-CD1 4.35Å; L207-L211 HydrophobicContact CD1-CG 4.49Å; L207-L211 HydrophobicContact CD2-CD1 4.13Å; L207-L211 HydrophobicContact CG-CD1 3.81Å; L207-L211 HydrophobicContact CG-CG 4.25Å; L207-L211 WeakPolarHBondContact O-CB 3.46Å; L207-L211 WeakPolarHBondContact O-CG 3.43Å; L207-L211 PolarHBondContact O-N 3.41Å; A208-L211 PolarHBondContact O-N 2.89Å; L211-G213 VanDerWaalsContact C-N 3.35Å; L211-F214 PolarHBondContact O-N 3.46Å; L211-I215 VanDerWaalsContact O-CG1 3.27Å; L211-I215 WeakPolarHBondContact O-CG1 3.42Å; L211-I215 PolarHBondContact O-N 3.47Å
212Y78.1Confident79.8Confident25 Ų2566 Ų6610%0.09835%0.35CS..Hα-helixtrans-69.7-32.1174-73.8-64.4000112.7T120 A208 F214 I215 A216 L266 V270T120-Y212 HydrophobicContact CG2-CD2 4.22Å; T120-Y212 HydrophobicContact CG2-CE2 3.39Å; T120-Y212 PolarHBondContact OG1-OH 3.42Å; A208-Y212 HydrophobicContact CB-CD2 4.34Å; A208-Y212 HydrophobicContact CB-CE2 4.31Å; A208-Y212 WeakPolarHBondContact O-CB 3.33Å; A208-Y212 WeakPolarHBondContact O-CD2 3.49Å; A208-Y212 PolarHBondContact O-N 3.24Å; Y212-F214 VanDerWaalsContact C-N 3.33Å; Y212-I215 HydrophobicContact CD1-CD1 3.76Å; Y212-I215 HydrophobicContact CE1-CD1 3.98Å; Y212-I215 PolarHBondContact O-N 3.03Å; Y212-A216 VanDerWaalsContact O-CB 3.26Å; Y212-A216 WeakPolarHBondContact O-CB 3.31Å; Y212-A216 PolarHBondContact O-N 3.42Å; Y212-L266 HydrophobicContact CE1-CB 3.54Å; Y212-L266 HydrophobicContact CE1-CD1 4.44Å; Y212-L266 WeakPolarHBondContact OH-CB 3.4Å; Y212-V270 HydrophobicContact CD2-CB 4.39Å; Y212-V270 HydrophobicContact CD2-CG1 4.49Å; Y212-V270 HydrophobicContact CD2-CG2 3.93Å; Y212-V270 HydrophobicContact CE2-CB 4.14Å; Y212-V270 HydrophobicContact CE2-CG2 3.24Å
213G79.5Confident77.7Confident39 Ų3968.3 Ų68.340%0.40237%0.365SS..Hα-helixtrans-58.6-44.7169.900000111.6T209 V210 L211 A216 R217T209-G213 PolarHBondContact O-N 3.32Å; V210-G213 PolarHBondContact O-N 3Å; L211-G213 VanDerWaalsContact C-N 3.35Å; G213-A216 PolarHBondContact O-N 3.13Å; G213-R217 VanDerWaalsContact O-CB 3.29Å; G213-R217 WeakPolarHBondContact O-CB 3.41Å; G213-R217 PolarHBondContact O-N 3.18Å
214F80.8Confident75.7Confident89 Ų8968 Ų6839%0.3936%0.36SS..Hα-helixtrans-66.2-41.4174-67.4-43.5000113Y124 V210 L211 Y212 R217 I218Y124-F214 HydrophobicContact CE2-CB 3.87Å; Y124-F214 HydrophobicContact CE2-CD2 4.37Å; V210-F214 HydrophobicContact CG1-CD2 3.92Å; V210-F214 HydrophobicContact CG1-CE2 3.37Å; V210-F214 HydrophobicContact CG1-CZ 3.97Å; V210-F214 WeakPolarHBondContact O-CD2 3.26Å; V210-F214 PolarHBondContact O-N 2.89Å; L211-F214 PolarHBondContact O-N 3.46Å; Y212-F214 VanDerWaalsContact C-N 3.33Å; F214-R217 PolarHBondContact O-N 3.22Å; F214-I218 WeakPolarHBondContact O-CG1 3.28Å; F214-I218 PolarHBondContact O-N 3.17Å
215I75.5Confident73.3Confident3 Ų373.4 Ų73.42%0.01540%0.395CS..Hα-helixtrans-61.3-46.4175.7-66.2161.8000110.4Y124 I127 L211 Y212 I218 L219 T263Y124-I215 HydrophobicContact CD2-CD1 4.33Å; Y124-I215 HydrophobicContact CD2-CG1 3.98Å; I127-I215 HydrophobicContact CG2-CG2 4.29Å; L211-I215 VanDerWaalsContact O-CG1 3.27Å; L211-I215 WeakPolarHBondContact O-CG1 3.42Å; L211-I215 PolarHBondContact O-N 3.47Å; Y212-I215 HydrophobicContact CD1-CD1 3.76Å; Y212-I215 HydrophobicContact CE1-CD1 3.98Å; Y212-I215 PolarHBondContact O-N 3.03Å; I215-I218 PolarHBondContact O-N 2.89Å; I215-L219 WeakPolarHBondContact O-CB 3.36Å; I215-L219 PolarHBondContact O-N 2.97Å; I215-T263 HydrophobicContact CG2-CG2 3.56Å
216A72.6Confident71Confident34 Ų3475.9 Ų75.928%0.28142%0.422SS..Hα-helixtrans-60.8-48.6176.900000110.3Y212 G213 I218 L219 F220Y212-A216 VanDerWaalsContact O-CB 3.26Å; Y212-A216 WeakPolarHBondContact O-CB 3.31Å; Y212-A216 PolarHBondContact O-N 3.42Å; G213-A216 PolarHBondContact O-N 3.13Å; A216-I218 VanDerWaalsContact C-N 3.34Å; A216-I218 PolarHBondContact O-N 3.36Å; A216-L219 CarbonylContact O-C 3.55Å; A216-L219 WeakPolarHBondContact O-CB 3.44Å; A216-L219 PolarHBondContact O-N 3.38Å; A216-L219 VanDerWaalsContact O-N 3.09Å; A216-F220 HydrophobicContact CB-CD2 4.17Å; A216-F220 HydrophobicContact CB-CE2 4.22Å; A216-F220 WeakPolarHBondContact O-CB 3.46Å; A216-F220 WeakPolarHBondContact O-CD2 3.18Å; A216-F220 PolarHBondContact O-N 3.38Å
217R76.5Confident68.4Low160 Ų16077.5 Ų77.560%0.60443%0.432SS*.Hα-helixtrans-57.1-44.8177.7-179.1176.2178-162.6-1.4112.1G213 F214 L219 F220 L221G213-R217 VanDerWaalsContact O-CB 3.29Å; G213-R217 WeakPolarHBondContact O-CB 3.41Å; G213-R217 PolarHBondContact O-N 3.18Å; F214-R217 PolarHBondContact O-N 3.22Å; R217-L219 VanDerWaalsContact C-N 3.32Å; R217-L219 PolarHBondContact O-N 3.36Å; R217-F220 PolarHBondContact O-N 3.16Å; R217-L221 HydrophobicContact CG-CD1 3.45Å; R217-L221 VanDerWaalsContact CG-CD1 3.45Å; R217-L221 HydrophobicContact CG-CG 4.06Å; R217-L221 WeakPolarHBondContact O-CB 3.33Å; R217-L221 VanDerWaalsContact O-CG 3.32Å; R217-L221 WeakPolarHBondContact O-CG 3.16Å; R217-L221 PolarHBondContact O-N 3.49Å
218I70.4Confident66.3Low68 Ų6880.1 Ų80.135%0.34945%0.453SS..Hα-helixtrans-65.4-37.6177.2-72.5163.3000111.5C128 F214 I215 A216 N222C128-I218 HydrophobicContact CB-CD1 3.83Å; C128-I218 VanDerWaalsContact SG-CD1 3.51Å; F214-I218 WeakPolarHBondContact O-CG1 3.28Å; F214-I218 PolarHBondContact O-N 3.17Å; I215-I218 PolarHBondContact O-N 2.89Å; A216-I218 VanDerWaalsContact C-N 3.34Å; A216-I218 PolarHBondContact O-N 3.36Å; I218-N222 WeakPolarHBondContact O-CB 3.43Å; I218-N222 PolarHBondContact O-N 2.64Å; I218-N222 PolarHBondContact O-ND2 3.09Å
219L67.3Low64.1Low53 Ų5388.8 Ų88.828%0.27749%0.49SS..Hα-helixtrans-71.2-31.5177.4-174.465.3000112.9I215 A216 R217 R260I215-L219 WeakPolarHBondContact O-CB 3.36Å; I215-L219 PolarHBondContact O-N 2.97Å; A216-L219 CarbonylContact O-C 3.55Å; A216-L219 WeakPolarHBondContact O-CB 3.44Å; A216-L219 PolarHBondContact O-N 3.38Å; A216-L219 VanDerWaalsContact O-N 3.09Å; R217-L219 VanDerWaalsContact C-N 3.32Å; R217-L219 PolarHBondContact O-N 3.36Å; L219-R260 HydrophobicContact CD1-CG 4.16Å; L219-R260 HydrophobicContact CD2-CG 3.9Å
220F67.1Low61.7Low153 Ų15393.3 Ų93.367%0.67151%0.505SS*.Hα-helixtrans-88-33.8178.7-77.4-68.5000113.4A216 R217 P223A216-F220 HydrophobicContact CB-CD2 4.17Å; A216-F220 HydrophobicContact CB-CE2 4.22Å; A216-F220 WeakPolarHBondContact O-CB 3.46Å; A216-F220 WeakPolarHBondContact O-CD2 3.18Å; A216-F220 PolarHBondContact O-N 3.38Å; R217-F220 PolarHBondContact O-N 3.16Å; F220-P223 WeakPolarHBondContact O-CD 3.12Å
221L65.2Low59.1Low112 Ų11296.1 Ų96.159%0.58652%0.518SS*.Hα-helixtrans-78.4-21.8176.7-74.7174.9000113.3R217 P223R217-L221 HydrophobicContact CG-CD1 3.45Å; R217-L221 VanDerWaalsContact CG-CD1 3.45Å; R217-L221 HydrophobicContact CG-CG 4.06Å; R217-L221 WeakPolarHBondContact O-CB 3.33Å; R217-L221 VanDerWaalsContact O-CG 3.32Å; R217-L221 WeakPolarHBondContact O-CG 3.16Å; R217-L221 PolarHBondContact O-N 3.49Å; L221-P223 WeakPolarHBondContact O-CD 3.29Å
222N59.7Low56.6Low102 Ų102102.5 Ų102.555%0.54556%0.558SS.*SBendtrans-106.869.4164.7-58.9-71.9000108.8I218 L224I218-N222 WeakPolarHBondContact O-CB 3.43Å; I218-N222 PolarHBondContact O-N 2.64Å; I218-N222 PolarHBondContact O-ND2 3.09Å; N222-L224 PolarHBondContact O-N 3.06Å
223P47.8Very low54.7Low101 Ų101109.6 Ų109.666%0.65659%0.589SS**  trans-66.593.9169.930-29000106.3F220 L221F220-P223 WeakPolarHBondContact O-CD 3.12Å; L221-P223 WeakPolarHBondContact O-CD 3.29Å
224L47.8Very low52.4Low86 Ų86118.8 Ų118.845%0.4561%0.612SS.*PPolyproline II helixtrans-55.6140.4165.3-81.7144.4000107.8N222 A226 I256N222-L224 PolarHBondContact O-N 3.06Å; L224-A226 PolarHBondContact O-N 2.71Å; L224-I256 HydrophobicContact CB-CD1 3.9Å; L224-I256 HydrophobicContact CB-CG2 4.39Å; L224-I256 HydrophobicContact CD1-CB 4.27Å; L224-I256 HydrophobicContact CD1-CD1 3.3Å; L224-I256 HydrophobicContact CD1-CG1 3.49Å; L224-I256 VanDerWaalsContact CD1-CG1 3.49Å; L224-I256 HydrophobicContact CD1-CG2 3.77Å; L224-I256 HydrophobicContact CD2-CD1 3.48Å; L224-I256 VanDerWaalsContact CD2-CD1 3.48Å; L224-I256 HydrophobicContact CG-CD1 3.69Å; L224-I256 HydrophobicContact CG-CG1 4.42Å
225P40.6Very low49.9Very low121 Ų121123.7 Ų123.779%0.78663%0.633SS**PPolyproline II helixtrans-53.4117.1-162.620.4-31.2000109D227P225-D227 PolarHBondContact O-N 3.34Å
226A39.9Very low48.1Very low92 Ų92133.2 Ų133.276%0.7667%0.674SS**PPolyproline II helixtrans-56.7135.8176.100000108.6L224L224-A226 PolarHBondContact O-N 2.71Å
227D36.3Very low46.1Very low149 Ų149139.8 Ų139.880%0.79770%0.699SS**  trans-43.5121.7174.1-118-44000110.5P225 K229P225-D227 PolarHBondContact O-N 3.34Å; D227-K229 VanDerWaalsContact C-N 3.3Å; D227-K229 PolarHBondContact O-N 3.27Å; D227-K229 VanDerWaalsContact O-N 3.08Å
228P44.6Very low44.1Very low121 Ų121137.2 Ų137.279%0.78671%0.706SS**  trans-85.775.7175.133.6-30.7000108.7
229K39.6Very low42.2Very low189 Ų189139.8 Ų139.882%0.82273%0.729SS**  trans-147.999.3164.3-71.7-166178.7-1800110.9D227D227-K229 VanDerWaalsContact C-N 3.3Å; D227-K229 PolarHBondContact O-N 3.27Å; D227-K229 VanDerWaalsContact O-N 3.08Å
230E34.8Very low40.7Very low175 Ų175146.9 Ų146.982%0.81876%0.76SS**SBend-165.6119.3108.4-155.5166.8165.800112.6
231N32.5Very low39.1Very low130 Ų130143 Ų14370%0.69576%0.763SS**  trans54.997.2153.1-69.1-31.3000120.9
232T32.3Very low37.4Very low151 Ų151145.8 Ų145.893%0.92678%0.779SS**  -132.4120.6129-39.30000110.5
233K37.4Very low36.7Very low174 Ų174152.6 Ų152.676%0.75780%0.797SS**  trans-59.7142.8178.9-103.9177.3177.9175.60111.7
234W31.3Very low35.8Very low232 Ų232156.6 Ų156.688%0.87981%0.809SS**  trans76.8103.6154-69.451.6000118.9
235K29Very low35.6Very low191 Ų191160.6 Ų160.683%0.8383%0.827SS**  -156.4117115.2-117.3-177.1178.4-168.10110.4
236K37.5Very low35.3Very low203 Ų203160 Ų16088%0.88383%0.826SS**  trans-87.6112.7167.8-174.5-176.9-171.3-178.30105.3
237E31.3Very low35.5Very low172 Ų172161 Ų16180%0.80482%0.823SS**  trans-155.1131.3157.6-113.3157.1-153.100110.8
238S34.3Very low35.6Very low106 Ų106160.1 Ų160.174%0.74182%0.818SS**  trans-34.9137.1177174.10000115.5
239C28.9Very low35.4Very low123 Ų123161.2 Ų161.283%0.83182%0.817SS**  -175142.1109-95.20000113.2
240Q37.8Very low35.4Very low202 Ų202156.5 Ų156.594%0.94481%0.808SS**  trans-65.3140.9175.1-136.6167.714.600110.9
241G32.1Very low35.7Very low71 Ų71152 Ų15273%0.73280%0.797SS**  trans154.8109.5162.700000117.1
242N30.3Very low36Very low171 Ų171149.1 Ų149.191%0.91479%0.786SS**  trans72129.4154.3-72.65.1000122.5
243R45.6Very low36.4Very low245 Ų245145.2 Ų145.293%0.92576%0.764SS**  trans-56.9132.9166.7-61172-176.4-178.40.3110.6
244M28.9Very low36.9Very low184 Ų184141 Ų14191%0.90675%0.754SS**  trans-155.8135.9141.7-161.681.690.500109.5
245M43.4Very low37.8Very low170 Ų170133.3 Ų133.384%0.83773%0.732SS**  trans-56.9133.1179.5-158.914565.400112.1
246S33.8Very low38.9Very low110 Ų110126 Ų12677%0.76970%0.701SS**  trans-146.175.1161.2-179.90000110.4
247T43.1Very low39.5Very low112 Ų112125.8 Ų125.869%0.68770%0.695SS**  trans-86.9139164.2-35.70000108
248N39.3Very low40.6Very low131 Ų131120.4 Ų120.470%0.70168%0.677SS**  trans112.827.8162.9-63.5-12.2000122
249N40.2Very low41.6Very low143 Ų143122.3 Ų122.377%0.76567%0.667SS**SBendtrans-89.3-3168.7-86.1-0.1000116.2
250S40.7Very low43Very low90 Ų90123.9 Ų123.963%0.62966%0.656SS**Hα-helixtrans-87.5-17.3-175.656.40000115.6S253 T254S250-S253 PolarHBondContact O-OG 2.89Å; S250-T254 PolarHBondContact O-OG1 3.22Å
251S41.1Very low44Very low82 Ų82118.7 Ų118.757%0.57363%0.632SS**Hα-helixtrans-81.5-30.6-178.8-169.90000113T254 T255S251-T254 PolarHBondContact O-OG1 3Å; S251-T255 PolarHBondContact O-N 2.79Å; S251-T255 PolarHBondContact O-OG1 2.98Å
252C38.8Very low45.2Very low69 Ų69118 Ų11847%0.46661%0.613SS.*Hα-helixtrans-72.8-41.7179-166.80000111.7T254 T255 I256C252-T254 VanDerWaalsContact C-N 3.34Å; C252-T254 PolarHBondContact O-N 3.43Å; C252-T255 PolarHBondContact O-N 2.72Å; C252-T255 PolarHBondContact O-OG1 3.45Å; C252-I256 WeakPolarHBondContact O-CD1 3.27Å; C252-I256 WeakPolarHBondContact O-CG1 3.24Å; C252-I256 PolarHBondContact O-N 3.3Å; C252-I256 VanDerWaalsContact O-N 3.14Å
253S40.4Very low46.7Very low68 Ų68110.8 Ų110.848%0.47658%0.575SS.*Hα-helixtrans-65.5-33.3-179.365.10000113.6S250 R257S250-S253 PolarHBondContact O-OG 2.89Å; S253-R257 VanDerWaalsContact O-CB 3.31Å; S253-R257 WeakPolarHBondContact O-CB 3.4Å; S253-R257 PolarHBondContact O-N 3.3Å
254T47.5Very low47.7Very low87 Ų87106.3 Ų106.353%0.53456%0.563SS.*Hα-helixtrans-74.4-37.2178.549.60000113S250 S251 C252 S258S250-T254 PolarHBondContact O-OG1 3.22Å; S251-T254 PolarHBondContact O-OG1 3Å; C252-T254 VanDerWaalsContact C-N 3.34Å; C252-T254 PolarHBondContact O-N 3.43Å; T254-S258 PolarHBondContact O-N 2.85Å; T254-S258 VanDerWaalsContact O-N 3.15Å; T254-S258 PolarHBondContact O-OG 3.37Å; T254-S258 VanDerWaalsContact O-OG 3.13Å
255T50.9Low49.5Very low69 Ų6998.3 Ų98.342%0.42352%0.523SS..Hα-helixtrans-69.4-31.4174.441.90000112.5S251 C252 S258 R259S251-T255 PolarHBondContact O-N 2.79Å; S251-T255 PolarHBondContact O-OG1 2.98Å; C252-T255 PolarHBondContact O-N 2.72Å; C252-T255 PolarHBondContact O-OG1 3.45Å; T255-S258 PolarHBondContact O-OG 2.91Å; T255-R259 WeakPolarHBondContact O-CG 3.14Å; T255-R259 PolarHBondContact O-N 3.45Å
256I52.1Low50.5Low37 Ų3790.2 Ų90.219%0.1948%0.483CS..Hα-helixtrans-75-43.4174.8-64.8160000111.5L224 C252 S258 R259 R260L224-I256 HydrophobicContact CB-CD1 3.9Å; L224-I256 HydrophobicContact CB-CG2 4.39Å; L224-I256 HydrophobicContact CD1-CB 4.27Å; L224-I256 HydrophobicContact CD1-CD1 3.3Å; L224-I256 HydrophobicContact CD1-CG1 3.49Å; L224-I256 VanDerWaalsContact CD1-CG1 3.49Å; L224-I256 HydrophobicContact CD1-CG2 3.77Å; L224-I256 HydrophobicContact CD2-CD1 3.48Å; L224-I256 VanDerWaalsContact CD2-CD1 3.48Å; L224-I256 HydrophobicContact CG-CD1 3.69Å; L224-I256 HydrophobicContact CG-CG1 4.42Å; C252-I256 WeakPolarHBondContact O-CD1 3.27Å; C252-I256 WeakPolarHBondContact O-CG1 3.24Å; C252-I256 PolarHBondContact O-N 3.3Å; C252-I256 VanDerWaalsContact O-N 3.14Å; I256-S258 VanDerWaalsContact C-N 3.31Å; I256-S258 PolarHBondContact O-N 2.85Å; I256-R259 PolarHBondContact O-N 3.46Å; I256-R260 PolarHBondContact O-N 3.23Å; I256-R260 VanDerWaalsContact O-N 3.07Å
257R49.9Very low52.2Low199 Ų19986.9 Ų86.975%0.75146%0.463SS*.Hα-helixtrans-61.3-38.6178.4-169.6174-178.4-176.21.3112.3S253 R260 Q261S253-R257 VanDerWaalsContact O-CB 3.31Å; S253-R257 WeakPolarHBondContact O-CB 3.4Å; S253-R257 PolarHBondContact O-N 3.3Å; R257-R260 PolarHBondContact O-N 2.58Å; R257-Q261 PolarHBondContact O-N 3.45Å
258S52.8Low53.8Low59 Ų5984.3 Ų84.341%0.41345%0.446SS..Hα-helixtrans-67.9-38.8175.157.40000113.1T254 T255 I256 R260 Q261 V262T254-S258 PolarHBondContact O-N 2.85Å; T254-S258 VanDerWaalsContact O-N 3.15Å; T254-S258 PolarHBondContact O-OG 3.37Å; T254-S258 VanDerWaalsContact O-OG 3.13Å; T255-S258 PolarHBondContact O-OG 2.91Å; I256-S258 VanDerWaalsContact C-N 3.31Å; I256-S258 PolarHBondContact O-N 2.85Å; S258-R260 PolarHBondContact O-N 3.41Å; S258-Q261 PolarHBondContact O-N 2.95Å; S258-V262 WeakPolarHBondContact O-CG2 3.36Å; S258-V262 PolarHBondContact O-N 3.05Å; S258-V262 VanDerWaalsContact O-N 3.12Å
259R56.1Low55.4Low146 Ų14678.3 Ų78.355%0.55142%0.415SS*.Hα-helixtrans-63.5-37.9174-71.8176.5-173.7-155.54.3112.7T255 I256 V262 T263T255-R259 WeakPolarHBondContact O-CG 3.14Å; T255-R259 PolarHBondContact O-N 3.45Å; I256-R259 PolarHBondContact O-N 3.46Å; R259-V262 PolarHBondContact O-N 3.28Å; R259-T263 PolarHBondContact O-N 2.92Å; R259-T263 PolarHBondContact O-OG1 3.35Å
260R59.2Low57.1Low157 Ų15772.1 Ų72.159%0.59238%0.382SS*.Hα-helixtrans-63.6-42.8174.7-115.8177.1165-162.9-4.5112.5L219 I256 R257 S258 T263 K264L219-R260 HydrophobicContact CD1-CG 4.16Å; L219-R260 HydrophobicContact CD2-CG 3.9Å; I256-R260 PolarHBondContact O-N 3.23Å; I256-R260 VanDerWaalsContact O-N 3.07Å; R257-R260 PolarHBondContact O-N 2.58Å; S258-R260 PolarHBondContact O-N 3.41Å; R260-T263 PolarHBondContact O-N 3.44Å; R260-K264 PolarHBondContact O-N 3.5Å
261Q56.9Low59.1Low93 Ų9371.7 Ų71.744%0.43538%0.375SS..Hα-helixtrans-64.8-42.3177.9-175.1177.8-2.500112R257 S258 K264 M265 M321R257-Q261 PolarHBondContact O-N 3.45Å; S258-Q261 PolarHBondContact O-N 2.95Å; Q261-K264 PolarHBondContact O-N 3.11Å; Q261-M265 PolarHBondContact O-N 3.06Å; Q261-M321 PolarHBondContact NE2-O 3.26Å
262V58.3Low61.2Low56 Ų5670.1 Ų70.134%0.33936%0.36SS..Hα-helixtrans-63.9-42.9176175.60000110.7S258 R259 K264 M265 L266S258-V262 WeakPolarHBondContact O-CG2 3.36Å; S258-V262 PolarHBondContact O-N 3.05Å; S258-V262 VanDerWaalsContact O-N 3.12Å; R259-V262 PolarHBondContact O-N 3.28Å; V262-K264 PolarHBondContact O-N 2.91Å; V262-M265 WeakPolarHBondContact O-CB 3.4Å; V262-M265 PolarHBondContact O-N 2.91Å; V262-L266 HydrophobicContact CG1-CD1 3.88Å; V262-L266 HydrophobicContact CG1-CG 4.35Å; V262-L266 WeakPolarHBondContact O-CB 3.32Å; V262-L266 WeakPolarHBondContact O-CG 3.12Å; V262-L266 PolarHBondContact O-N 2.96Å
263T61.7Low63.3Low20 Ų2067.1 Ų67.112%0.12334%0.339CS..Hα-helixtrans-62.9-42.2177-54.30000112.3I215 R259 R260 L266 A267I215-T263 HydrophobicContact CG2-CG2 3.56Å; R259-T263 PolarHBondContact O-N 2.92Å; R259-T263 PolarHBondContact O-OG1 3.35Å; R260-T263 PolarHBondContact O-N 3.44Å; T263-L266 PolarHBondContact O-N 3.31Å; T263-A267 PolarHBondContact O-N 3.44Å
264K67Low65.4Low150 Ų15064.8 Ų64.865%0.65232%0.324SS*.Hα-helixtrans-63.5-42.3175.8-173.5178.2178.4178.60111.9R260 Q261 V262 L266 A267 V268R260-K264 PolarHBondContact O-N 3.5Å; Q261-K264 PolarHBondContact O-N 3.11Å; V262-K264 PolarHBondContact O-N 2.91Å; K264-L266 VanDerWaalsContact C-N 3.31Å; K264-L266 PolarHBondContact O-N 2.9Å; K264-A267 PolarHBondContact O-N 3.2Å; K264-V268 WeakPolarHBondContact O-CG2 3.28Å; K264-V268 PolarHBondContact O-N 3.44Å
265M65.4Low67.3Low17 Ų1766.1 Ų66.18%0.08433%0.327CS..Hα-helixtrans-59.6-44.3175.4-179.8-171.689.200111.3Q261 V262 V268 V269 I317 M321Q261-M265 PolarHBondContact O-N 3.06Å; V262-M265 WeakPolarHBondContact O-CB 3.4Å; V262-M265 PolarHBondContact O-N 2.91Å; M265-V268 PolarHBondContact O-N 3.38Å; M265-V269 WeakPolarHBondContact O-CG2 3.48Å; M265-V269 PolarHBondContact O-N 3.42Å; M265-I317 HydrophobicContact CG-CG2 3.74Å; M265-M321 HydrophobicContact CB-CB 4.14Å; M265-M321 HydrophobicContact CB-CG 4.18Å; M265-M321 HydrophobicContact CG-CB 3.65Å; M265-M321 HydrophobicContact CG-CG 3.82Å; M265-M321 HydrophobicContact SD-CB 3.4Å; M265-M321 WeakPolarHBondContact SD-CB 3.18Å; M265-M321 HydrophobicContact SD-CG 4.24Å
266L64.6Low69.1Low0 Ų064 Ų640%031%0.314CS..Hα-helixtrans-68.7-39.3-177.7-71.4174.9000112.9F119 R123 I127 Y212 V262 T263 K264 V268 V269 V270F119-L266 HydrophobicContact CD1-CD2 4.16Å; F119-L266 HydrophobicContact CE1-CD2 3.18Å; F119-L266 HydrophobicContact CZ-CD2 3.61Å; R123-L266 HydrophobicContact CB-CD1 3.75Å; R123-L266 HydrophobicContact CG-CD1 3.64Å; R123-L266 HydrophobicContact CG-CD2 3.95Å; R123-L266 HydrophobicContact CG-CG 4.47Å; I127-L266 HydrophobicContact CD1-CD1 4.3Å; Y212-L266 HydrophobicContact CE1-CB 3.54Å; Y212-L266 HydrophobicContact CE1-CD1 4.44Å; Y212-L266 WeakPolarHBondContact OH-CB 3.4Å; V262-L266 HydrophobicContact CG1-CD1 3.88Å; V262-L266 HydrophobicContact CG1-CG 4.35Å; V262-L266 WeakPolarHBondContact O-CB 3.32Å; V262-L266 WeakPolarHBondContact O-CG 3.12Å; V262-L266 PolarHBondContact O-N 2.96Å; T263-L266 PolarHBondContact O-N 3.31Å; K264-L266 VanDerWaalsContact C-N 3.31Å; K264-L266 PolarHBondContact O-N 2.9Å; L266-V268 VanDerWaalsContact C-N 3.32Å; L266-V268 PolarHBondContact O-N 3.03Å; L266-V269 PolarHBondContact O-N 3.33Å; L266-V270 PolarHBondContact O-N 2.92Å
267A69.6Low70.8Confident40 Ų4062.5 Ų62.533%0.33131%0.305SS..Hα-helixtrans-62.3-39.1173.300000112.1T263 K264 V269 V270 V271T263-A267 PolarHBondContact O-N 3.44Å; K264-A267 PolarHBondContact O-N 3.2Å; A267-V269 PolarHBondContact O-N 3Å; A267-V270 PolarHBondContact O-N 3.26Å; A267-V271 WeakPolarHBondContact O-CG2 3.32Å; A267-V271 PolarHBondContact O-N 2.92Å
268V76.5Confident72.6Confident57 Ų5757.4 Ų57.435%0.34529%0.291SS..Hα-helixtrans-61.9-42.8176.31690000111.5K264 M265 L266 V270 V271 L272K264-V268 WeakPolarHBondContact O-CG2 3.28Å; K264-V268 PolarHBondContact O-N 3.44Å; M265-V268 PolarHBondContact O-N 3.38Å; L266-V268 VanDerWaalsContact C-N 3.32Å; L266-V268 PolarHBondContact O-N 3.03Å; V268-V270 VanDerWaalsContact C-N 3.29Å; V268-V270 PolarHBondContact O-N 3.44Å; V268-V271 PolarHBondContact O-N 3.17Å; V268-L272 HydrophobicContact CG1-CD1 3.6Å; V268-L272 HydrophobicContact CG1-CG 4.28Å; V268-L272 WeakPolarHBondContact O-CB 3.49Å; V268-L272 WeakPolarHBondContact O-CD1 3.24Å; V268-L272 VanDerWaalsContact O-CG 3.25Å; V268-L272 WeakPolarHBondContact O-CG 3.26Å; V268-L272 PolarHBondContact O-N 3.39Å
269V73.3Confident74.3Confident6 Ų655.4 Ų55.44%0.03628%0.277CS..Hα-helixtrans-59.2-40.9177.3174.10000111.3M265 L266 A267 L272 F273 I317M265-V269 WeakPolarHBondContact O-CG2 3.48Å; M265-V269 PolarHBondContact O-N 3.42Å; L266-V269 PolarHBondContact O-N 3.33Å; A267-V269 PolarHBondContact O-N 3Å; V269-L272 PolarHBondContact O-N 3.33Å; V269-F273 WeakPolarHBondContact O-CB 3.25Å; V269-F273 PolarHBondContact O-N 3.24Å; V269-I317 HydrophobicContact CG2-CD1 3.84Å; V269-I317 HydrophobicContact CG2-CG2 3.95Å
270V76.4Confident75.7Confident13 Ų1350.4 Ų50.48%0.07926%0.258CS..Hα-helixtrans-74.1-38.9-179.4174.70000112.9L205 A208 Y212 L266 A267 V268 L272 F273 A274L205-V270 HydrophobicContact CD1-CG1 4.35Å; A208-V270 HydrophobicContact CB-CG1 3.73Å; A208-V270 HydrophobicContact CB-CG2 4.13Å; Y212-V270 HydrophobicContact CD2-CB 4.39Å; Y212-V270 HydrophobicContact CD2-CG1 4.49Å; Y212-V270 HydrophobicContact CD2-CG2 3.93Å; Y212-V270 HydrophobicContact CE2-CB 4.14Å; Y212-V270 HydrophobicContact CE2-CG2 3.24Å; L266-V270 PolarHBondContact O-N 2.92Å; A267-V270 PolarHBondContact O-N 3.26Å; V268-V270 VanDerWaalsContact C-N 3.29Å; V268-V270 PolarHBondContact O-N 3.44Å; V270-L272 VanDerWaalsContact C-N 3.3Å; V270-L272 PolarHBondContact O-N 2.84Å; V270-F273 PolarHBondContact O-N 2.97Å; V270-A274 WeakPolarHBondContact O-CB 3.16Å; V270-A274 PolarHBondContact O-N 3.1Å
271V82.4Confident77Confident81 Ų8143.5 Ų43.549%0.49123%0.232SC..Hα-helixtrans-62.1-42.9173.4170.90000110.3A267 V268 A274 L275A267-V271 WeakPolarHBondContact O-CG2 3.32Å; A267-V271 PolarHBondContact O-N 2.92Å; V268-V271 PolarHBondContact O-N 3.17Å; V271-A274 PolarHBondContact O-N 3.09Å; V271-L275 HydrophobicContact CG1-CD1 3.67Å; V271-L275 HydrophobicContact CG1-CG 4.25Å; V271-L275 WeakPolarHBondContact O-CB 3.24Å; V271-L275 VanDerWaalsContact O-CG 3.27Å; V271-L275 WeakPolarHBondContact O-CG 3.1Å; V271-L275 PolarHBondContact O-N 3.23Å
272L85Confident78.3Confident49 Ų4941.4 Ų41.426%0.25723%0.226SC..Hα-helixtrans-66-42.7177.3-71.7167.8000111.9V268 V269 V270 A274 L275 L276 V313 I317V268-L272 HydrophobicContact CG1-CD1 3.6Å; V268-L272 HydrophobicContact CG1-CG 4.28Å; V268-L272 WeakPolarHBondContact O-CB 3.49Å; V268-L272 WeakPolarHBondContact O-CD1 3.24Å; V268-L272 VanDerWaalsContact O-CG 3.25Å; V268-L272 WeakPolarHBondContact O-CG 3.26Å; V268-L272 PolarHBondContact O-N 3.39Å; V269-L272 PolarHBondContact O-N 3.33Å; V270-L272 VanDerWaalsContact C-N 3.3Å; V270-L272 PolarHBondContact O-N 2.84Å; L272-A274 VanDerWaalsContact C-N 3.32Å; L272-A274 PolarHBondContact O-N 3.46Å; L272-L275 PolarHBondContact O-N 2.99Å; L272-L276 HydrophobicContact CB-CD1 4.25Å; L272-L276 HydrophobicContact CD2-CD1 4.33Å; L272-L276 WeakPolarHBondContact O-CB 3.29Å; L272-L276 VanDerWaalsContact O-CG 3.27Å; L272-L276 WeakPolarHBondContact O-CG 3.47Å; L272-L276 PolarHBondContact O-N 3.5Å; L272-V313 HydrophobicContact CD1-CG1 3.9Å; L272-I317 HydrophobicContact CD1-CD1 3.54Å; L272-I317 HydrophobicContact CD1-CG1 4.46Å
273F83Confident79.5Confident6 Ų639.2 Ų39.23%0.02621%0.212CC..Hα-helixtrans-56.4-47.4171.8175.5-97000111.2S113 I116 Y201 P204 V269 V270 L275 W277S113-F273 WeakPolarHBondContact OG-CZ 3.33Å; I116-F273 HydrophobicContact CD1-CD2 3.64Å; I116-F273 HydrophobicContact CD1-CE2 4.18Å; I116-F273 HydrophobicContact CD1-CG 4.35Å; Y201-F273 HydrophobicContact CD2-CE1 4.14Å; Y201-F273 HydrophobicContact CD2-CZ 4.36Å; P204-F273 HydrophobicContact CB-CE1 4.41Å; V269-F273 WeakPolarHBondContact O-CB 3.25Å; V269-F273 PolarHBondContact O-N 3.24Å; V270-F273 PolarHBondContact O-N 2.97Å; F273-L275 PolarHBondContact O-N 3.06Å; F273-W277 AromaticContact CD2-CD1 3.34Å; F273-W277 HydrophobicContact CD2-CG 4.29Å; F273-W277 AromaticContact CD2-NE1 3.64Å; F273-W277 AromaticContact CE2-CD1 3.49Å; F273-W277 VanDerWaalsContact CE2-CD1 3.49Å; F273-W277 HydrophobicContact CE2-CG 4.1Å; F273-W277 AromaticContact CE2-NE1 3.65Å; F273-W277 VanDerWaalsContact O-CB 3.29Å; F273-W277 WeakPolarHBondContact O-CB 3.41Å; F273-W277 VanDerWaalsContact O-CD1 3.28Å; F273-W277 PolarHBondContact O-N 3.18Å
274A84.4Confident80.3Confident19 Ų1939.5 Ų39.516%0.15721%0.214CC..Hα-helixtrans-60.2-49.7179.600000111.9Y201 L205 V270 V271 L272 M278Y201-A274 PolarHBondContact OH-O 3.38Å; L205-A274 HydrophobicContact CD1-CB 3.62Å; L205-A274 HydrophobicContact CD2-CB 4.37Å; V270-A274 WeakPolarHBondContact O-CB 3.16Å; V270-A274 PolarHBondContact O-N 3.1Å; V271-A274 PolarHBondContact O-N 3.09Å; L272-A274 VanDerWaalsContact C-N 3.32Å; L272-A274 PolarHBondContact O-N 3.46Å; A274-M278 VanDerWaalsContact O-CB 3.27Å; A274-M278 WeakPolarHBondContact O-CB 3.36Å; A274-M278 PolarHBondContact O-N 2.96Å
275L88.3Confident81Confident115 Ų11533.5 Ų33.560%0.60219%0.19SC*.Hα-helixtrans-74.5-39-173.5-67.7175.9000113.2V271 L272 F273 P279V271-L275 HydrophobicContact CG1-CD1 3.67Å; V271-L275 HydrophobicContact CG1-CG 4.25Å; V271-L275 WeakPolarHBondContact O-CB 3.24Å; V271-L275 VanDerWaalsContact O-CG 3.27Å; V271-L275 WeakPolarHBondContact O-CG 3.1Å; V271-L275 PolarHBondContact O-N 3.23Å; L272-L275 PolarHBondContact O-N 2.99Å; F273-L275 PolarHBondContact O-N 3.06Å; L275-P279 VanDerWaalsContact O-CD 3.25Å; L275-P279 WeakPolarHBondContact O-CD 3.44Å
276L89.1Confident81.8Confident25 Ų2535.8 Ų35.813%0.13121%0.205CC..Hα-helixtrans-80.5-25.7-175.9-65.2172.1000112.4L272 C306 L309 N310L272-L276 HydrophobicContact CB-CD1 4.25Å; L272-L276 HydrophobicContact CD2-CD1 4.33Å; L272-L276 WeakPolarHBondContact O-CB 3.29Å; L272-L276 VanDerWaalsContact O-CG 3.27Å; L272-L276 WeakPolarHBondContact O-CG 3.47Å; L272-L276 PolarHBondContact O-N 3.5Å; L276-C306 HydrophobicContact CB-CB 4.46Å; L276-C306 HydrophobicContact CD2-CB 4.23Å; L276-C306 WeakPolarHBondContact O-CB 3.06Å; L276-L309 HydrophobicContact CD1-CB 4.37Å; L276-L309 HydrophobicContact CD2-CB 4.3Å; L276-N310 HydrophobicContact CB-CB 3.93Å; L276-N310 HydrophobicContact CD1-CB 4.01Å
277W86.3Confident82.5Confident4 Ų436.9 Ų36.92%0.01521%0.21CC..Hα-helixtrans-87-27.3175.4-79.493.8000114I109 Y201 F273 Y280 R281 I307 N310I109-W277 HydrophobicContact CB-CH2 3.78Å; I109-W277 HydrophobicContact CB-CZ2 4.41Å; I109-W277 HydrophobicContact CB-CZ3 4.36Å; I109-W277 HydrophobicContact CD1-CH2 3.67Å; I109-W277 HydrophobicContact CD1-CZ3 4.06Å; I109-W277 HydrophobicContact CG1-CH2 3.43Å; I109-W277 VanDerWaalsContact CG1-CH2 3.43Å; I109-W277 HydrophobicContact CG1-CZ2 4.22Å; I109-W277 HydrophobicContact CG1-CZ3 4.21Å; I109-W277 HydrophobicContact CG2-CE3 4.27Å; I109-W277 HydrophobicContact CG2-CH2 3.17Å; I109-W277 HydrophobicContact CG2-CZ2 3.87Å; I109-W277 HydrophobicContact CG2-CZ3 3.35Å; Y201-W277 HydrophobicContact CD2-CB 3.81Å; Y201-W277 HydrophobicContact CE2-CB 3.66Å; F273-W277 AromaticContact CD2-CD1 3.34Å; F273-W277 HydrophobicContact CD2-CG 4.29Å; F273-W277 AromaticContact CD2-NE1 3.64Å; F273-W277 AromaticContact CE2-CD1 3.49Å; F273-W277 VanDerWaalsContact CE2-CD1 3.49Å; F273-W277 HydrophobicContact CE2-CG 4.1Å; F273-W277 AromaticContact CE2-NE1 3.65Å; F273-W277 VanDerWaalsContact O-CB 3.29Å; F273-W277 WeakPolarHBondContact O-CB 3.41Å; F273-W277 VanDerWaalsContact O-CD1 3.28Å; F273-W277 PolarHBondContact O-N 3.18Å; W277-Y280 HydrophobicContact CZ3-CD1 4.33Å; W277-R281 HydrophobicContact CB-CG 4.37Å; W277-R281 HydrophobicContact CE3-CG 4.07Å; W277-R281 VanDerWaalsContact O-CB 3.3Å; W277-R281 WeakPolarHBondContact O-CB 3.36Å; W277-R281 VanDerWaalsContact O-CG 3.25Å; W277-R281 WeakPolarHBondContact O-CG 3.34Å; W277-R281 PolarHBondContact O-N 2.91Å; W277-R281 VanDerWaalsContact O-N 3.1Å; W277-I307 HydrophobicContact CE3-CG1 4.42Å; W277-I307 HydrophobicContact CH2-CB 4.32Å; W277-I307 HydrophobicContact CH2-CG1 4Å; W277-I307 HydrophobicContact CH2-CG2 3.59Å; W277-I307 HydrophobicContact CZ2-CG2 4.11Å; W277-I307 HydrophobicContact CZ3-CD1 4.32Å; W277-I307 HydrophobicContact CZ3-CG1 3.9Å; W277-I307 HydrophobicContact CZ3-CG2 4.32Å; W277-N310 PolarHBondContact NE1-ND2 2.76Å
278M87.8Confident82.7Confident92 Ų9236 Ų3645%0.45320%0.202SC..Hα-helixtrans-54.2-46.9-174.2-170.2-88.9178.400114Y201 A274 Y280 R281 T282Y201-M278 WeakPolarHBondContact OH-CB 2.86Å; A274-M278 VanDerWaalsContact O-CB 3.27Å; A274-M278 WeakPolarHBondContact O-CB 3.36Å; A274-M278 PolarHBondContact O-N 2.96Å; M278-Y280 PolarHBondContact O-N 3.44Å; M278-R281 PolarHBondContact O-N 2.96Å; M278-T282 HydrophobicContact CE-CG2 4.31Å; M278-T282 WeakPolarHBondContact CE-OG1 3.39Å; M278-T282 VanDerWaalsContact O-CB 3.24Å; M278-T282 WeakPolarHBondContact O-CB 3.19Å; M278-T282 PolarHBondContact O-N 2.84Å; M278-T282 PolarHBondContact O-OG1 2.96Å
279P89.1Confident82.7Confident18 Ų1840 Ų4012%0.11722%0.215CC..Hα-helixtrans-61.8-50-174.7-2434.9000112.5L275 L283 F302 C303L275-P279 VanDerWaalsContact O-CD 3.25Å; L275-P279 WeakPolarHBondContact O-CD 3.44Å; P279-L283 VanDerWaalsContact O-CB 3.28Å; P279-L283 WeakPolarHBondContact O-CB 3.15Å; P279-L283 PolarHBondContact O-N 2.76Å; P279-F302 HydrophobicContact CB-CD1 4.33Å; P279-F302 HydrophobicContact CB-CE1 3.9Å; P279-F302 HydrophobicContact CG-CE1 3.82Å; P279-F302 HydrophobicContact CG-CZ 4.44Å; P279-C303 VanDerWaalsContact C-SG 3.54Å; P279-C303 VanDerWaalsContact CB-SG 3.58Å
280Y85.8Confident82.9Confident40 Ų4043.5 Ų43.516%0.15723%0.233CC..Hα-helixtrans-65.5-47.4-179.5178.4-104.3000111.9Y106 W277 M278 T282 L283 V284 C303 I307Y106-Y280 PolarHBondContact OH-OH 3.43Å; W277-Y280 HydrophobicContact CZ3-CD1 4.33Å; M278-Y280 PolarHBondContact O-N 3.44Å; Y280-T282 VanDerWaalsContact C-N 3.32Å; Y280-T282 PolarHBondContact O-N 3.41Å; Y280-L283 PolarHBondContact O-N 3.23Å; Y280-V284 HydrophobicContact CD1-CG2 4.37Å; Y280-V284 HydrophobicContact CD2-CG2 4.31Å; Y280-V284 HydrophobicContact CE1-CG2 4Å; Y280-V284 HydrophobicContact CE2-CG2 3.93Å; Y280-V284 WeakPolarHBondContact O-CG2 3.28Å; Y280-V284 PolarHBondContact O-N 2.83Å; Y280-C303 HydrophobicContact CD2-CB 4.3Å; Y280-I307 HydrophobicContact CD1-CD1 3.54Å; Y280-I307 HydrophobicContact CD1-CG1 4.36Å; Y280-I307 HydrophobicContact CD2-CD1 3.5Å; Y280-I307 HydrophobicContact CE1-CD1 4Å; Y280-I307 HydrophobicContact CE2-CD1 3.96Å; Y280-I307 HydrophobicContact CG-CD1 3.25Å; Y280-I307 HydrophobicContact CG-CG1 4.11Å
281R85.4Confident82.5Confident13 Ų1350.7 Ų50.75%0.04927%0.271CS..Hα-helixtrans-61.9-40.9-178.8-73.1-59.5-171-173.112.5111.9I109 N110 D196 F197 Y201 W277 M278 V285I109-R281 VanDerWaalsContact CG2-NH2 3.27Å; N110-R281 PolarHBondContact OD1-NH2 2.93Å; D196-R281 IonicContact OD2-CZ 2.83Å; D196-R281 VanDerWaalsContact OD2-CZ 3.32Å; D196-R281 IonicContact OD2-NH1 3.32Å; D196-R281 PolarHBondContact OD2-NH1 3.23Å; D196-R281 IonicContact OD2-NH2 2.65Å; D196-R281 PolarHBondContact OD2-NH2 3.37Å; F197-R281 HydrophobicContact CD2-CB 3.76Å; F197-R281 HydrophobicContact CD2-CG 4.45Å; F197-R281 HydrophobicContact CE2-CB 3.86Å; Y201-R281 HydrophobicContact CD2-CG 4.33Å; Y201-R281 HydrophobicContact CG-CG 4.28Å; W277-R281 HydrophobicContact CB-CG 4.37Å; W277-R281 HydrophobicContact CE3-CG 4.07Å; W277-R281 VanDerWaalsContact O-CB 3.3Å; W277-R281 WeakPolarHBondContact O-CB 3.36Å; W277-R281 VanDerWaalsContact O-CG 3.25Å; W277-R281 WeakPolarHBondContact O-CG 3.34Å; W277-R281 PolarHBondContact O-N 2.91Å; W277-R281 VanDerWaalsContact O-N 3.1Å; M278-R281 PolarHBondContact O-N 2.96Å; R281-V285 WeakPolarHBondContact O-CG2 3.23Å; R281-V285 PolarHBondContact O-N 3.49Å
282T84.9Confident82Confident48 Ų4855.4 Ų55.429%0.29429%0.285SS..Hα-helixtrans-67.8-44.9176.2-54.30000111.2M278 Y280 V284 V285 V286M278-T282 HydrophobicContact CE-CG2 4.31Å; M278-T282 WeakPolarHBondContact CE-OG1 3.39Å; M278-T282 VanDerWaalsContact O-CB 3.24Å; M278-T282 WeakPolarHBondContact O-CB 3.19Å; M278-T282 PolarHBondContact O-N 2.84Å; M278-T282 PolarHBondContact O-OG1 2.96Å; Y280-T282 VanDerWaalsContact C-N 3.32Å; Y280-T282 PolarHBondContact O-N 3.41Å; T282-V284 VanDerWaalsContact C-N 3.34Å; T282-V284 PolarHBondContact O-N 3.44Å; T282-V285 PolarHBondContact O-N 2.92Å; T282-V286 HydrophobicContact CG2-CG2 4.1Å; T282-V286 WeakPolarHBondContact O-CB 3.32Å; T282-V286 VanDerWaalsContact O-CG2 3.31Å; T282-V286 WeakPolarHBondContact O-CG2 3.12Å; T282-V286 PolarHBondContact O-N 2.89Å
283L84Confident81.3Confident10 Ų1055 Ų555%0.05229%0.285CS..Hα-helixtrans-58.4-45.3-179.9178.660.3000112.2P279 Y280 V285 V286 N287 Y294 F299 L300P279-L283 VanDerWaalsContact O-CB 3.28Å; P279-L283 WeakPolarHBondContact O-CB 3.15Å; P279-L283 PolarHBondContact O-N 2.76Å; Y280-L283 PolarHBondContact O-N 3.23Å; L283-V285 VanDerWaalsContact C-N 3.35Å; L283-V285 PolarHBondContact O-N 3.39Å; L283-V286 PolarHBondContact O-N 2.79Å; L283-N287 WeakPolarHBondContact CD1-ND2 3.34Å; L283-N287 VanDerWaalsContact O-CB 3.24Å; L283-N287 WeakPolarHBondContact O-CB 3.13Å; L283-N287 PolarHBondContact O-N 3.01Å; L283-Y294 HydrophobicContact CD1-CD1 4.01Å; L283-F299 HydrophobicContact CB-CE1 4.17Å; L283-F299 HydrophobicContact CD1-CD1 4.14Å; L283-F299 HydrophobicContact CD1-CE1 3.92Å; L283-F299 HydrophobicContact CD2-CD1 3.91Å; L283-F299 HydrophobicContact CD2-CE1 3.91Å; L283-F299 HydrophobicContact CG-CE1 4.22Å; L283-L300 HydrophobicContact CD2-CD2 3.5Å; L283-L300 VanDerWaalsContact CD2-CD2 3.5Å; L283-L300 HydrophobicContact CD2-CG 4.33Å
284V78.6Confident81Confident26 Ų2660.3 Ų60.316%0.15831%0.306CS..Hα-helixtrans-63.5-41.1-180172.10000111.5Y193 Y280 T282 S288Y193-V284 HydrophobicContact CD1-CG1 3.11Å; Y193-V284 HydrophobicContact CD2-CG1 4.04Å; Y193-V284 HydrophobicContact CE1-CG1 3.4Å; Y193-V284 VanDerWaalsContact CE1-CG1 3.4Å; Y193-V284 HydrophobicContact CE2-CG1 4.3Å; Y193-V284 HydrophobicContact CG-CG1 3.45Å; Y193-V284 VanDerWaalsContact CG-CG1 3.45Å; Y280-V284 HydrophobicContact CD1-CG2 4.37Å; Y280-V284 HydrophobicContact CD2-CG2 4.31Å; Y280-V284 HydrophobicContact CE1-CG2 4Å; Y280-V284 HydrophobicContact CE2-CG2 3.93Å; Y280-V284 WeakPolarHBondContact O-CG2 3.28Å; Y280-V284 PolarHBondContact O-N 2.83Å; T282-V284 VanDerWaalsContact C-N 3.34Å; T282-V284 PolarHBondContact O-N 3.44Å; V284-S288 PolarHBondContact O-N 3.35Å; V284-S288 PolarHBondContact O-OG 3Å
285V80.8Confident80.6Confident24 Ų2464.7 Ų64.715%0.14533%0.326CS..Hα-helixtrans-66.7-48.7176.5174.20000110.7F197 R281 T282 L283 N287 S288 F289F197-V285 HydrophobicContact CB-CG2 3.85Å; F197-V285 HydrophobicContact CD1-CG2 4.33Å; F197-V285 HydrophobicContact CD2-CG2 4.23Å; F197-V285 HydrophobicContact CG-CG2 3.89Å; R281-V285 WeakPolarHBondContact O-CG2 3.23Å; R281-V285 PolarHBondContact O-N 3.49Å; T282-V285 PolarHBondContact O-N 2.92Å; L283-V285 VanDerWaalsContact C-N 3.35Å; L283-V285 PolarHBondContact O-N 3.39Å; V285-N287 PolarHBondContact O-N 3.39Å; V285-S288 VanDerWaalsContact O-CB 3.29Å; V285-S288 WeakPolarHBondContact O-CB 3.36Å; V285-S288 PolarHBondContact O-N 3.16Å; V285-F289 HydrophobicContact CG1-CD2 4.19Å; V285-F289 HydrophobicContact CG1-CE2 3.78Å; V285-F289 WeakPolarHBondContact O-CD2 3.24Å
286V82Confident80.5Confident66 Ų6662.3 Ų62.340%0.431%0.314SS..Hα-helixtrans-60.9-45.2179.7170.90000111.2T282 L283 S288 F289 L290T282-V286 HydrophobicContact CG2-CG2 4.1Å; T282-V286 WeakPolarHBondContact O-CB 3.32Å; T282-V286 VanDerWaalsContact O-CG2 3.31Å; T282-V286 WeakPolarHBondContact O-CG2 3.12Å; T282-V286 PolarHBondContact O-N 2.89Å; L283-V286 PolarHBondContact O-N 2.79Å; V286-S288 PolarHBondContact O-N 2.95Å; V286-S288 VanDerWaalsContact O-N 3.11Å; V286-F289 PolarHBondContact O-N 3.04Å; V286-L290 HydrophobicContact CG1-CD1 3.68Å; V286-L290 HydrophobicContact CG1-CG 4.14Å; V286-L290 WeakPolarHBondContact O-CG 3.29Å; V286-L290 PolarHBondContact O-N 2.95Å
287N79.8Confident80.2Confident22 Ų2263 Ų6312%0.11832%0.318CS..Hα-helixtrans-64.6-13.9176.9-81.4-12.8000114L283 V285 Y294L283-N287 WeakPolarHBondContact CD1-ND2 3.34Å; L283-N287 VanDerWaalsContact O-CB 3.24Å; L283-N287 WeakPolarHBondContact O-CB 3.13Å; L283-N287 PolarHBondContact O-N 3.01Å; V285-N287 PolarHBondContact O-N 3.39Å; N287-Y294 PolarHBondContact ND2-O 2.95Å; N287-Y294 WeakPolarHBondContact OD1-CB 3.38Å; N287-Y294 PolarHBondContact OD1-N 2.9Å; N287-Y294 PolarHBondContact OD1-O 3.46Å
288S74.8Confident80.3Confident23 Ų2368.3 Ų68.316%0.16134%0.338CS..Hα-helixtrans-84-19.4173.7-57.20000113.1Y193 V284 V285 V286Y193-S288 VanDerWaalsContact CD2-OG 3.29Å; Y193-S288 WeakPolarHBondContact CD2-OG 3.26Å; V284-S288 PolarHBondContact O-N 3.35Å; V284-S288 PolarHBondContact O-OG 3Å; V285-S288 VanDerWaalsContact O-CB 3.29Å; V285-S288 WeakPolarHBondContact O-CB 3.36Å; V285-S288 PolarHBondContact O-N 3.16Å; V286-S288 PolarHBondContact O-N 2.95Å; V286-S288 VanDerWaalsContact O-N 3.11Å
289F75.9Confident80.3Confident139 Ų13967.3 Ų67.361%0.6133%0.331SS*.Hα-helixtrans-103.7-12.4179.2-68.4-72.9000113.7V285 V286V285-F289 HydrophobicContact CG1-CD2 4.19Å; V285-F289 HydrophobicContact CG1-CE2 3.78Å; V285-F289 WeakPolarHBondContact O-CD2 3.24Å; V286-F289 PolarHBondContact O-N 3.04Å
290L77.4Confident80.2Confident81 Ų8168.2 Ų68.242%0.42433%0.334SS..  trans-89.6131.7178.8-67175.3000111.5V286 K292V286-L290 HydrophobicContact CG1-CD1 3.68Å; V286-L290 HydrophobicContact CG1-CG 4.14Å; V286-L290 WeakPolarHBondContact O-CG 3.29Å; V286-L290 PolarHBondContact O-N 2.95Å; L290-K292 WeakPolarHBondContact CB-O 3.19Å; L290-K292 PolarHBondContact O-N 3.42Å
291D68.9Low80.3Confident164 Ų16466.5 Ų66.588%0.87733%0.328SS*.SBendtrans-62.1-33.7174.1-63.2-44.4000112.3
292K72.1Confident80.7Confident180 Ų18070.8 Ų70.878%0.78335%0.347SS*.SBendtrans-113.9117171.1-68-177-178.3179.40109L290L290-K292 WeakPolarHBondContact CB-O 3.19Å; L290-K292 PolarHBondContact O-N 3.42Å
293P70.2Confident81Confident39 Ų3968.5 Ų68.525%0.25333%0.333SS..  trans-66.8140-177.627-34.1000111.6L295P293-L295 HydrophobicContact CB-CD1 4.28Å; P293-L295 HydrophobicContact CB-CD2 4.33Å; P293-L295 HydrophobicContact CB-CG 3.98Å; P293-L295 HydrophobicContact CG-CD1 3.79Å; P293-L295 HydrophobicContact CG-CG 4.03Å; P293-L295 PolarHBondContact O-N 3.24Å
294Y75Confident81.3Confident118 Ų11870.6 Ų70.646%0.46334%0.341SS..  trans-75.3105.2169.1-172.5-96.1000108.9L283 N287 D296 F299L283-Y294 HydrophobicContact CD1-CD1 4.01Å; N287-Y294 PolarHBondContact ND2-O 2.95Å; N287-Y294 WeakPolarHBondContact OD1-CB 3.38Å; N287-Y294 PolarHBondContact OD1-N 2.9Å; N287-Y294 PolarHBondContact OD1-O 3.46Å; Y294-D296 HydrophobicContact CD1-CB 4.31Å; Y294-D296 HydrophobicContact CE1-CB 3.51Å; Y294-D296 HydrophobicContact CE2-CB 4.3Å; Y294-D296 WeakPolarHBondContact OH-CB 3.15Å; Y294-F299 HydrophobicContact CD1-CD1 4.19Å; Y294-F299 HydrophobicContact CE1-CB 4.03Å; Y294-F299 AromaticContact CE1-CD1 3.77Å; Y294-F299 HydrophobicContact CE1-CD1 3.77Å; Y294-F299 HydrophobicContact CE1-CG 4.06Å
295L77.1Confident81.9Confident112 Ų11270.6 Ų70.659%0.58634%0.339SS*.  trans-118.539.3-176-64.2174000111.6P293 L297 L300P293-L295 HydrophobicContact CB-CD1 4.28Å; P293-L295 HydrophobicContact CB-CD2 4.33Å; P293-L295 HydrophobicContact CB-CG 3.98Å; P293-L295 HydrophobicContact CG-CD1 3.79Å; P293-L295 HydrophobicContact CG-CG 4.03Å; P293-L295 PolarHBondContact O-N 3.24Å; L295-L297 PolarHBondContact O-N 2.95Å; L295-L297 VanDerWaalsContact O-N 3.17Å; L295-L300 HydrophobicContact CD2-CD1 4.26Å
296D85.2Confident82.6Confident64 Ų6469.9 Ų69.934%0.34234%0.335SS..  trans-64.4118.6171.7-179-99.8000110.1Y294 W298 F299 L300Y294-D296 HydrophobicContact CD1-CB 4.31Å; Y294-D296 HydrophobicContact CE1-CB 3.51Å; Y294-D296 HydrophobicContact CE2-CB 4.3Å; Y294-D296 WeakPolarHBondContact OH-CB 3.15Å; D296-W298 VanDerWaalsContact C-N 3.32Å; D296-W298 PolarHBondContact O-N 3.48Å; D296-W298 PolarHBondContact OD1-N 2.99Å; D296-F299 HydrophobicContact CB-CB 4.09Å; D296-F299 PolarHBondContact O-N 3.01Å; D296-F299 WeakPolarHBondContact OD1-CB 3.35Å; D296-F299 PolarHBondContact OD1-N 3.04Å; D296-L300 WeakPolarHBondContact O-CB 3.4Å; D296-L300 WeakPolarHBondContact O-CG 3.32Å; D296-L300 PolarHBondContact O-N 3.36Å
297L83.4Confident83Confident41 Ų4167.1 Ų67.122%0.21532%0.318CS..Hα-helixtrans-64.5-37.7-170.6-173.767.3000111.9Y19 Y23 L295 L301Y19-L297 HydrophobicContact CD1-CD1 4.08Å; Y19-L297 HydrophobicContact CD1-CD2 3.38Å; Y19-L297 HydrophobicContact CD1-CG 4.38Å; Y19-L297 HydrophobicContact CE1-CD1 3.55Å; Y19-L297 HydrophobicContact CE1-CD2 3.75Å; Y19-L297 HydrophobicContact CE1-CG 4.3Å; Y19-L297 HydrophobicContact CG-CD2 3.99Å; Y23-L297 HydrophobicContact CD1-CD2 3.85Å; Y23-L297 HydrophobicContact CD1-CG 4.44Å; Y23-L297 HydrophobicContact CD2-CD2 3.65Å; Y23-L297 HydrophobicContact CD2-CG 3.74Å; Y23-L297 HydrophobicContact CE1-CD1 4.16Å; Y23-L297 HydrophobicContact CE1-CD2 3.97Å; Y23-L297 HydrophobicContact CE1-CG 4.14Å; Y23-L297 HydrophobicContact CE2-CB 4.49Å; Y23-L297 HydrophobicContact CE2-CD1 3.98Å; Y23-L297 HydrophobicContact CE2-CD2 3.78Å; Y23-L297 HydrophobicContact CE2-CG 3.39Å; Y23-L297 HydrophobicContact CG-CD2 3.68Å; Y23-L297 HydrophobicContact CG-CG 4.25Å; L295-L297 PolarHBondContact O-N 2.95Å; L295-L297 VanDerWaalsContact O-N 3.17Å; L297-L301 WeakPolarHBondContact O-CB 3.34Å; L297-L301 PolarHBondContact O-N 2.84Å
298W87.9Confident83.7Confident114 Ų11466.4 Ų66.443%0.43231%0.314SS..Hα-helixtrans-70.7-40.4179.1-65.6109000112E22 Y23 V26 D296 L301 F302E22-W298 HydrophobicContact CB-CH2 4.33Å; Y23-W298 VanDerWaalsContact CA-CH2 3.45Å; Y23-W298 HydrophobicContact CD2-CD2 4.21Å; Y23-W298 AromaticContact CD2-CE3 3.91Å; Y23-W298 HydrophobicContact CD2-CE3 3.91Å; Y23-W298 HydrophobicContact CD2-CH2 4.23Å; Y23-W298 HydrophobicContact CD2-CZ2 4.49Å; Y23-W298 AromaticContact CD2-CZ3 3.91Å; Y23-W298 HydrophobicContact CD2-CZ3 3.91Å; V26-W298 HydrophobicContact CB-CZ3 4.38Å; V26-W298 HydrophobicContact CG1-CZ3 4.32Å; D296-W298 VanDerWaalsContact C-N 3.32Å; D296-W298 PolarHBondContact O-N 3.48Å; D296-W298 PolarHBondContact OD1-N 2.99Å; W298-L301 HydrophobicContact CE3-CD2 4.29Å; W298-L301 HydrophobicContact CZ3-CD2 4.41Å; W298-L301 PolarHBondContact O-N 3.13Å; W298-F302 PolarHBondContact O-N 2.97Å
299F88.4Confident84.6Confident71 Ų7168.1 Ų68.131%0.31132%0.321SS..Hα-helixtrans-67.3-39.6174.6-171.2-108.7000112.2L283 Y294 D296 L301 F302 C303L283-F299 HydrophobicContact CB-CE1 4.17Å; L283-F299 HydrophobicContact CD1-CD1 4.14Å; L283-F299 HydrophobicContact CD1-CE1 3.92Å; L283-F299 HydrophobicContact CD2-CD1 3.91Å; L283-F299 HydrophobicContact CD2-CE1 3.91Å; L283-F299 HydrophobicContact CG-CE1 4.22Å; Y294-F299 HydrophobicContact CD1-CD1 4.19Å; Y294-F299 HydrophobicContact CE1-CB 4.03Å; Y294-F299 AromaticContact CE1-CD1 3.77Å; Y294-F299 HydrophobicContact CE1-CD1 3.77Å; Y294-F299 HydrophobicContact CE1-CG 4.06Å; D296-F299 HydrophobicContact CB-CB 4.09Å; D296-F299 PolarHBondContact O-N 3.01Å; D296-F299 WeakPolarHBondContact OD1-CB 3.35Å; D296-F299 PolarHBondContact OD1-N 3.04Å; F299-L301 VanDerWaalsContact C-N 3.32Å; F299-L301 PolarHBondContact O-N 2.96Å; F299-F302 HydrophobicContact CD2-CD1 4.28Å; F299-F302 HydrophobicContact CE2-CD1 4.12Å; F299-F302 WeakPolarHBondContact O-CB 3.39Å; F299-F302 PolarHBondContact O-N 3.12Å; F299-C303 PolarHBondContact O-N 3.33Å; F299-C303 PolarHBondContact O-SG 3.1Å; F299-C303 VanDerWaalsContact O-SG 3.38Å
300L86.8Confident85.3Confident37 Ų3761.7 Ų61.719%0.19429%0.293CS..Hα-helixtrans-61.1-41.7173.2-77167.9000111.7L283 L295 D296 C303 R304L283-L300 HydrophobicContact CD2-CD2 3.5Å; L283-L300 VanDerWaalsContact CD2-CD2 3.5Å; L283-L300 HydrophobicContact CD2-CG 4.33Å; L295-L300 HydrophobicContact CD2-CD1 4.26Å; D296-L300 WeakPolarHBondContact O-CB 3.4Å; D296-L300 WeakPolarHBondContact O-CG 3.32Å; D296-L300 PolarHBondContact O-N 3.36Å; L300-C303 PolarHBondContact O-N 3.47Å; L300-R304 WeakPolarHBondContact O-CG 3.4Å; L300-R304 PolarHBondContact O-N 3.31Å
301L88.9Confident86Confident5 Ų557.9 Ų57.93%0.02627%0.273CS..Hα-helixtrans-62.6-44.7173.7176.263.1000111.6Y23 V26 S27 L297 W298 F299 C303 R304 I305Y23-L301 HydrophobicContact CD2-CD2 4.06Å; Y23-L301 HydrophobicContact CE2-CB 3.73Å; Y23-L301 HydrophobicContact CE2-CD2 3.66Å; Y23-L301 HydrophobicContact CE2-CG 4.19Å; V26-L301 HydrophobicContact CG1-CD2 4.27Å; S27-L301 WeakPolarHBondContact OG-CD1 3.21Å; L297-L301 WeakPolarHBondContact O-CB 3.34Å; L297-L301 PolarHBondContact O-N 2.84Å; W298-L301 HydrophobicContact CE3-CD2 4.29Å; W298-L301 HydrophobicContact CZ3-CD2 4.41Å; W298-L301 PolarHBondContact O-N 3.13Å; F299-L301 VanDerWaalsContact C-N 3.32Å; F299-L301 PolarHBondContact O-N 2.96Å; L301-C303 PolarHBondContact O-N 3.41Å; L301-R304 PolarHBondContact O-N 2.92Å; L301-I305 HydrophobicContact CD1-CD1 3.9Å; L301-I305 HydrophobicContact CD1-CG1 4.08Å; L301-I305 HydrophobicContact CD2-CD1 4.42Å; L301-I305 HydrophobicContact CG-CD1 3.79Å; L301-I305 HydrophobicContact CG-CG1 4.38Å; L301-I305 WeakPolarHBondContact O-CB 3.34Å; L301-I305 VanDerWaalsContact O-CG1 3.31Å; L301-I305 WeakPolarHBondContact O-CG1 3.18Å; L301-I305 PolarHBondContact O-N 2.65Å
302F92.1Very high87.1Confident103 Ų10350.3 Ų50.345%0.45223%0.233SC..Hα-helixtrans-56.3-49.5174.8171.3-104.2000111.7P279 W298 F299 R304 I305 C306P279-F302 HydrophobicContact CB-CD1 4.33Å; P279-F302 HydrophobicContact CB-CE1 3.9Å; P279-F302 HydrophobicContact CG-CE1 3.82Å; P279-F302 HydrophobicContact CG-CZ 4.44Å; W298-F302 PolarHBondContact O-N 2.97Å; F299-F302 HydrophobicContact CD2-CD1 4.28Å; F299-F302 HydrophobicContact CE2-CD1 4.12Å; F299-F302 WeakPolarHBondContact O-CB 3.39Å; F299-F302 PolarHBondContact O-N 3.12Å; F302-R304 VanDerWaalsContact C-N 3.34Å; F302-R304 PolarHBondContact O-N 2.97Å; F302-I305 PolarHBondContact O-N 2.8Å; F302-C306 PolarHBondContact O-N 3.34Å; F302-C306 PolarHBondContact O-SG 2.89Å
303C91.1Very high87.9Confident0 Ų043.5 Ų43.50%021%0.207CC..Hα-helixtrans-57.6-44176.7-72.90000112.6P279 Y280 F299 L300 L301 C306 I307P279-C303 VanDerWaalsContact C-SG 3.54Å; P279-C303 VanDerWaalsContact CB-SG 3.58Å; Y280-C303 HydrophobicContact CD2-CB 4.3Å; F299-C303 PolarHBondContact O-N 3.33Å; F299-C303 PolarHBondContact O-SG 3.1Å; F299-C303 VanDerWaalsContact O-SG 3.38Å; L300-C303 PolarHBondContact O-N 3.47Å; L301-C303 PolarHBondContact O-N 3.41Å; C303-C306 PolarHBondContact O-N 3.48Å; C303-I307 WeakPolarHBondContact O-CG1 3.43Å; C303-I307 PolarHBondContact O-N 3.32Å
304R90.4Very high88.6Confident54 Ų5441.9 Ų41.920%0.20420%0.196CC..Hα-helixtrans-64-45.7176.9-73.9171.2176.3166.9-5.3111.8N81 L300 L301 F302 C306 I307 Y308N81-R304 WeakPolarHBondContact ND2-CD 3.37Å; N81-R304 PolarHBondContact ND2-NE 3.48Å; N81-R304 PolarHBondContact ND2-NH1 2.9Å; N81-R304 VanDerWaalsContact ND2-NH1 3.12Å; L300-R304 WeakPolarHBondContact O-CG 3.4Å; L300-R304 PolarHBondContact O-N 3.31Å; L301-R304 PolarHBondContact O-N 2.92Å; F302-R304 VanDerWaalsContact C-N 3.34Å; F302-R304 PolarHBondContact O-N 2.97Å; R304-C306 VanDerWaalsContact C-N 3.29Å; R304-C306 PolarHBondContact O-N 3.48Å; R304-I307 WeakPolarHBondContact O-CB 3.44Å; R304-I307 PolarHBondContact O-N 3.5Å; R304-I307 VanDerWaalsContact O-N 3.15Å; R304-Y308 HydrophobicContact CB-CE2 3.86Å; R304-Y308 WeakPolarHBondContact O-CD2 3.36Å; R304-Y308 PolarHBondContact O-N 3.02Å
305I92.8Very high89Confident25 Ų2536.6 Ų36.613%0.12818%0.176CC..Hα-helixtrans-57.6-43.2175.9-73.7171.3000110.5F30 I34 L301 F302 I307 Y308 L309F30-I305 HydrophobicContact CB-CD1 3.98Å; F30-I305 HydrophobicContact CB-CG1 4.43Å; F30-I305 HydrophobicContact CD2-CD1 4.36Å; F30-I305 HydrophobicContact CG-CD1 4.28Å; I34-I305 HydrophobicContact CD1-CG2 3.77Å; L301-I305 HydrophobicContact CD1-CD1 3.9Å; L301-I305 HydrophobicContact CD1-CG1 4.08Å; L301-I305 HydrophobicContact CD2-CD1 4.42Å; L301-I305 HydrophobicContact CG-CD1 3.79Å; L301-I305 HydrophobicContact CG-CG1 4.38Å; L301-I305 WeakPolarHBondContact O-CB 3.34Å; L301-I305 VanDerWaalsContact O-CG1 3.31Å; L301-I305 WeakPolarHBondContact O-CG1 3.18Å; L301-I305 PolarHBondContact O-N 2.65Å; F302-I305 PolarHBondContact O-N 2.8Å; I305-I307 PolarHBondContact O-N 3.3Å; I305-Y308 PolarHBondContact O-N 3.47Å; I305-L309 HydrophobicContact CG2-CD1 3.77Å; I305-L309 HydrophobicContact CG2-CG 4.2Å; I305-L309 WeakPolarHBondContact O-CB 3.38Å; I305-L309 VanDerWaalsContact O-CG 3.3Å; I305-L309 WeakPolarHBondContact O-CG 3.06Å; I305-L309 PolarHBondContact O-N 2.94Å
306C93.5Very high89.1Confident9 Ų935.2 Ų35.26%0.06117%0.172CC..Hα-helixtrans-60.8-42.7176.9-66.10000112.5L276 F302 C303 R304 L309 N310L276-C306 HydrophobicContact CB-CB 4.46Å; L276-C306 HydrophobicContact CD2-CB 4.23Å; L276-C306 WeakPolarHBondContact O-CB 3.06Å; F302-C306 PolarHBondContact O-N 3.34Å; F302-C306 PolarHBondContact O-SG 2.89Å; C303-C306 PolarHBondContact O-N 3.48Å; R304-C306 VanDerWaalsContact C-N 3.29Å; R304-C306 PolarHBondContact O-N 3.48Å; C306-L309 PolarHBondContact O-N 3.12Å; C306-N310 PolarHBondContact O-N 2.86Å
307I91.8Very high88.7Confident8 Ų832.8 Ų32.84%0.04116%0.159CC..Hα-helixtrans-60.2-49.3175.2-66.9165000110.9V73 I109 W277 Y280 C303 R304 I305 L309 N310 S311V73-I307 HydrophobicContact CG1-CG2 3.88Å; I109-I307 HydrophobicContact CD1-CG2 4.47Å; W277-I307 HydrophobicContact CE3-CG1 4.42Å; W277-I307 HydrophobicContact CH2-CB 4.32Å; W277-I307 HydrophobicContact CH2-CG1 4Å; W277-I307 HydrophobicContact CH2-CG2 3.59Å; W277-I307 HydrophobicContact CZ2-CG2 4.11Å; W277-I307 HydrophobicContact CZ3-CD1 4.32Å; W277-I307 HydrophobicContact CZ3-CG1 3.9Å; W277-I307 HydrophobicContact CZ3-CG2 4.32Å; Y280-I307 HydrophobicContact CD1-CD1 3.54Å; Y280-I307 HydrophobicContact CD1-CG1 4.36Å; Y280-I307 HydrophobicContact CD2-CD1 3.5Å; Y280-I307 HydrophobicContact CE1-CD1 4Å; Y280-I307 HydrophobicContact CE2-CD1 3.96Å; Y280-I307 HydrophobicContact CG-CD1 3.25Å; Y280-I307 HydrophobicContact CG-CG1 4.11Å; C303-I307 WeakPolarHBondContact O-CG1 3.43Å; C303-I307 PolarHBondContact O-N 3.32Å; R304-I307 WeakPolarHBondContact O-CB 3.44Å; R304-I307 PolarHBondContact O-N 3.5Å; R304-I307 VanDerWaalsContact O-N 3.15Å; I305-I307 PolarHBondContact O-N 3.3Å; I307-L309 VanDerWaalsContact C-N 3.32Å; I307-L309 PolarHBondContact O-N 3.21Å; I307-N310 WeakPolarHBondContact O-CB 3.4Å; I307-N310 PolarHBondContact O-N 2.94Å; I307-S311 PolarHBondContact O-N 3.32Å
308Y93.8Very high88.2Confident8 Ų831.2 Ų31.23%0.03115%0.15CC..Hα-helixtrans-64.9-38.9-178.9-53.4-31.7000111.6V31 A77 N81 R304 I305 N310 S311 A312V31-Y308 HydrophobicContact CG1-CE2 4.41Å; V31-Y308 HydrophobicContact CG2-CD2 4.21Å; V31-Y308 HydrophobicContact CG2-CE2 3.95Å; A77-Y308 HydrophobicContact CB-CE1 3.84Å; A77-Y308 PolarHBondContact O-OH 2.92Å; N81-Y308 WeakPolarHBondContact CB-OH 3.17Å; R304-Y308 HydrophobicContact CB-CE2 3.86Å; R304-Y308 WeakPolarHBondContact O-CD2 3.36Å; R304-Y308 PolarHBondContact O-N 3.02Å; I305-Y308 PolarHBondContact O-N 3.47Å; Y308-N310 VanDerWaalsContact C-N 3.32Å; Y308-N310 PolarHBondContact O-N 3.14Å; Y308-S311 PolarHBondContact O-N 2.81Å; Y308-A312 WeakPolarHBondContact O-CB 3.27Å; Y308-A312 PolarHBondContact O-N 3.24Å
309L93.1Very high87.4Confident59 Ų5927.8 Ų27.831%0.30914%0.14SC..Hα-helixtrans-61.2-40.7174.1-79.5173.3000111.6I34 L276 I305 C306 I307 S311 A312 V313I34-L309 HydrophobicContact CD1-CD2 3.9Å; I34-L309 HydrophobicContact CD1-CG 3.88Å; I34-L309 HydrophobicContact CG1-CD2 3.86Å; I34-L309 HydrophobicContact CG1-CG 4.35Å; I34-L309 HydrophobicContact CG2-CD2 4.13Å; I34-L309 HydrophobicContact CG2-CG 4.37Å; L276-L309 HydrophobicContact CD1-CB 4.37Å; L276-L309 HydrophobicContact CD2-CB 4.3Å; I305-L309 HydrophobicContact CG2-CD1 3.77Å; I305-L309 HydrophobicContact CG2-CG 4.2Å; I305-L309 WeakPolarHBondContact O-CB 3.38Å; I305-L309 VanDerWaalsContact O-CG 3.3Å; I305-L309 WeakPolarHBondContact O-CG 3.06Å; I305-L309 PolarHBondContact O-N 2.94Å; C306-L309 PolarHBondContact O-N 3.12Å; I307-L309 VanDerWaalsContact C-N 3.32Å; I307-L309 PolarHBondContact O-N 3.21Å; L309-S311 VanDerWaalsContact C-N 3.26Å; L309-S311 PolarHBondContact O-N 3.11Å; L309-A312 PolarHBondContact O-N 3.17Å; L309-A312 VanDerWaalsContact O-N 3.16Å; L309-V313 VanDerWaalsContact O-CB 3.23Å; L309-V313 WeakPolarHBondContact O-CB 3.17Å; L309-V313 VanDerWaalsContact O-CG2 3.26Å; L309-V313 WeakPolarHBondContact O-CG2 3.08Å; L309-V313 PolarHBondContact O-N 2.89Å
310N91.6Very high86.3Confident4 Ų427.4 Ų27.42%0.02115%0.15CC..Hα-helixtrans-57.7-42.1177.5-178.480.5000111.5L276 W277 C306 I307 Y308 N314L276-N310 HydrophobicContact CB-CB 3.93Å; L276-N310 HydrophobicContact CD1-CB 4.01Å; W277-N310 PolarHBondContact NE1-ND2 2.76Å; C306-N310 PolarHBondContact O-N 2.86Å; I307-N310 WeakPolarHBondContact O-CB 3.4Å; I307-N310 PolarHBondContact O-N 2.94Å; Y308-N310 VanDerWaalsContact C-N 3.32Å; Y308-N310 PolarHBondContact O-N 3.14Å; N310-N314 PolarHBondContact O-ND2 3.45Å
311S92.5Very high84.9Confident0 Ų029.1 Ų29.10%016%0.158CC..Hα-helixtrans-76.6-27.8177.6-70.30000113.7N42 D70 I307 Y308 L309N42-S311 PolarHBondContact ND2-O 3.33Å; D70-S311 WeakPolarHBondContact OD1-CA 3.27Å; D70-S311 WeakPolarHBondContact OD1-CB 3.2Å; D70-S311 PolarHBondContact OD1-OG 2.99Å; I307-S311 PolarHBondContact O-N 3.32Å; Y308-S311 PolarHBondContact O-N 2.81Å; L309-S311 VanDerWaalsContact C-N 3.26Å; L309-S311 PolarHBondContact O-N 3.11Å
312A92Very high83.7Confident6 Ų630.8 Ų30.85%0.0517%0.17CC..Hα-helixtrans-84.6-28.2-179.600000114.2I34 Y308 L309I34-A312 HydrophobicContact CG2-CB 3.7Å; Y308-A312 WeakPolarHBondContact O-CB 3.27Å; Y308-A312 PolarHBondContact O-N 3.24Å; L309-A312 PolarHBondContact O-N 3.17Å; L309-A312 VanDerWaalsContact O-N 3.16Å
313V88.5Confident82.1Confident37 Ų3733 Ų3322%0.22418%0.182CC..Hα-helixtrans-75.4-27.5-175.1159.50000112.5L272 L309 V316 I317L272-V313 HydrophobicContact CD1-CG1 3.9Å; L309-V313 VanDerWaalsContact O-CB 3.23Å; L309-V313 WeakPolarHBondContact O-CB 3.17Å; L309-V313 VanDerWaalsContact O-CG2 3.26Å; L309-V313 WeakPolarHBondContact O-CG2 3.08Å; L309-V313 PolarHBondContact O-N 2.89Å; V313-V316 WeakPolarHBondContact O-CA 3.21Å; V313-V316 WeakPolarHBondContact O-CB 3.11Å; V313-V316 PolarHBondContact O-N 2.79Å; V313-I317 HydrophobicContact CG1-CD1 3.52Å; V313-I317 HydrophobicContact CG1-CG1 3.73Å; V313-I317 PolarHBondContact O-N 3.22Å
314N84.3Confident80.7Confident5 Ų539.9 Ų39.93%0.02721%0.212CC..Hα-helixtrans-53-53.7-175.5-71-27.7000113.2D70 N310 V316 I317 Y318D70-N314 PolarHBondContact OD2-ND2 3.08Å; N310-N314 PolarHBondContact O-ND2 3.45Å; N314-V316 VanDerWaalsContact C-N 3.3Å; N314-V316 PolarHBondContact O-N 3.01Å; N314-I317 PolarHBondContact O-N 3.12Å; N314-Y318 HydrophobicContact CB-CE2 3.92Å; N314-Y318 WeakPolarHBondContact O-CD2 3.3Å; N314-Y318 VanDerWaalsContact O-CE2 3.26Å; N314-Y318 WeakPolarHBondContact O-CE2 3.42Å; N314-Y318 VanDerWaalsContact O-CG 3.31Å; N314-Y318 PolarHBondContact O-N 3.2Å; N314-Y318 VanDerWaalsContact O-N 3.14Å
315P83.3Confident79.5Confident7 Ų737.7 Ų37.75%0.04520%0.204CC..Hα-helixtrans-56.8-37.8173.5-25.933.5000114.7N42 V45 Y318 N319N42-P315 HydrophobicContact CB-CG 4.33Å; N42-P315 VanDerWaalsContact OD1-CG 3.3Å; N42-P315 WeakPolarHBondContact OD1-CG 3.29Å; V45-P315 HydrophobicContact CG2-CB 4.07Å; V45-P315 HydrophobicContact CG2-CG 4.18Å; P315-Y318 PolarHBondContact O-N 3.44Å; P315-N319 WeakPolarHBondContact O-CB 3.34Å; P315-N319 PolarHBondContact O-N 2.74Å
316V79.7Confident78.5Confident82 Ų8242.6 Ų42.650%0.49722%0.221SC..Hα-helixtrans-64.7-43-180-178.60000110.2V313 N314 N319 A320V313-V316 WeakPolarHBondContact O-CA 3.21Å; V313-V316 WeakPolarHBondContact O-CB 3.11Å; V313-V316 PolarHBondContact O-N 2.79Å; N314-V316 VanDerWaalsContact C-N 3.3Å; N314-V316 PolarHBondContact O-N 3.01Å; V316-N319 PolarHBondContact O-N 3.13Å; V316-A320 VanDerWaalsContact O-CB 3.23Å; V316-A320 WeakPolarHBondContact O-CB 3.19Å; V316-A320 PolarHBondContact O-N 3.43Å
317I77.6Confident77.2Confident14 Ų1445.9 Ų45.97%0.07224%0.241CC..Hα-helixtrans-60.6-48.3175.4-63.5172.2000110.3M265 V269 L272 V313 N314 N319 A320 M321M265-I317 HydrophobicContact CG-CG2 3.74Å; V269-I317 HydrophobicContact CG2-CD1 3.84Å; V269-I317 HydrophobicContact CG2-CG2 3.95Å; L272-I317 HydrophobicContact CD1-CD1 3.54Å; L272-I317 HydrophobicContact CD1-CG1 4.46Å; V313-I317 HydrophobicContact CG1-CD1 3.52Å; V313-I317 HydrophobicContact CG1-CG1 3.73Å; V313-I317 PolarHBondContact O-N 3.22Å; N314-I317 PolarHBondContact O-N 3.12Å; I317-N319 VanDerWaalsContact C-N 3.33Å; I317-N319 PolarHBondContact O-N 2.99Å; I317-A320 PolarHBondContact O-N 3.21Å; I317-M321 HydrophobicContact CG2-CG 4.44Å; I317-M321 VanDerWaalsContact O-CB 3.28Å; I317-M321 WeakPolarHBondContact O-CB 3.24Å; I317-M321 WeakPolarHBondContact O-CG 3.47Å; I317-M321 PolarHBondContact O-N 3.15Å
318Y72.8Confident76Confident8 Ų846.4 Ų46.43%0.03125%0.245CC..Hα-helixtrans-62.5-41.3-179-55.6-41.9000111.9V45 L63 L66 N314 P315 S322V45-Y318 HydrophobicContact CG2-CD2 4.38Å; L63-Y318 HydrophobicContact CD2-CD1 4.29Å; L63-Y318 HydrophobicContact CD2-CD2 4.48Å; L63-Y318 HydrophobicContact CD2-CE1 3.63Å; L63-Y318 HydrophobicContact CD2-CE2 3.86Å; L63-Y318 VanDerWaalsContact CD2-CZ 3.41Å; L66-Y318 VanDerWaalsContact CD2-OH 3.25Å; L66-Y318 WeakPolarHBondContact CD2-OH 3.5Å; N314-Y318 HydrophobicContact CB-CE2 3.92Å; N314-Y318 WeakPolarHBondContact O-CD2 3.3Å; N314-Y318 VanDerWaalsContact O-CE2 3.26Å; N314-Y318 WeakPolarHBondContact O-CE2 3.42Å; N314-Y318 VanDerWaalsContact O-CG 3.31Å; N314-Y318 PolarHBondContact O-N 3.2Å; N314-Y318 VanDerWaalsContact O-N 3.14Å; P315-Y318 PolarHBondContact O-N 3.44Å; Y318-S322 WeakPolarHBondContact O-CB 3.16Å; Y318-S322 PolarHBondContact O-N 3.27Å
319N70.7Confident74.9Confident42 Ų4248.8 Ų48.823%0.22526%0.256CS..Hα-helixtrans-73.6-35.4179.8-143.1-6.2000112P315 V316 I317 F325 R326P315-N319 WeakPolarHBondContact O-CB 3.34Å; P315-N319 PolarHBondContact O-N 2.74Å; V316-N319 PolarHBondContact O-N 3.13Å; I317-N319 VanDerWaalsContact C-N 3.33Å; I317-N319 PolarHBondContact O-N 2.99Å; N319-F325 HydrophobicContact CB-CD1 4.08Å; N319-F325 HydrophobicContact CB-CE1 4.35Å; N319-R326 WeakPolarHBondContact O-CD 3.25Å; N319-R326 WeakPolarHBondContact O-CG 3.07Å; N319-R326 WeakPolarHBondContact OD1-CG 3.45Å
320A64.2Low73.9Confident63 Ų6352 Ų5252%0.52127%0.267SS..Hα-helixtrans-68.8-37.3175.700000112.3V316 I317V316-A320 VanDerWaalsContact O-CB 3.23Å; V316-A320 WeakPolarHBondContact O-CB 3.19Å; V316-A320 PolarHBondContact O-N 3.43Å; I317-A320 PolarHBondContact O-N 3.21Å
321M58.6Low72.9Confident72 Ų7257.4 Ų57.436%0.35529%0.291SS..Hα-helixtrans-104-21-166.9-64.7-72.2-17900114.5Q261 M265 I317Q261-M321 PolarHBondContact NE2-O 3.26Å; M265-M321 HydrophobicContact CB-CB 4.14Å; M265-M321 HydrophobicContact CB-CG 4.18Å; M265-M321 HydrophobicContact CG-CB 3.65Å; M265-M321 HydrophobicContact CG-CG 3.82Å; M265-M321 HydrophobicContact SD-CB 3.4Å; M265-M321 WeakPolarHBondContact SD-CB 3.18Å; M265-M321 HydrophobicContact SD-CG 4.24Å; I317-M321 HydrophobicContact CG2-CG 4.44Å; I317-M321 VanDerWaalsContact O-CB 3.28Å; I317-M321 WeakPolarHBondContact O-CB 3.24Å; I317-M321 WeakPolarHBondContact O-CG 3.47Å; I317-M321 PolarHBondContact O-N 3.15Å
322S63.8Low71.9Confident41 Ų4160.4 Ų60.429%0.28731%0.306SS..  trans-106.3105.5179.4-177.50000112.4Y318 K324 F325 R326Y318-S322 WeakPolarHBondContact O-CB 3.16Å; Y318-S322 PolarHBondContact O-N 3.27Å; S322-K324 PolarHBondContact O-N 2.03Å; S322-F325 WeakPolarHBondContact O-CB 3.46Å; S322-F325 PolarHBondContact O-N 2.9Å; S322-F325 PolarHBondContact OG-N 2.96Å; S322-R326 PolarHBondContact O-N 2.9Å
323Q58.5Low70.9Confident149 Ų14963.3 Ų63.370%0.69633%0.325SS*.Hα-helixtrans-56.6-36.5173.5-70.5-178.7-11.200112.4F325 R326 T327Q323-F325 VanDerWaalsContact C-N 3.34Å; Q323-F325 PolarHBondContact O-N 3.48Å; Q323-R326 PolarHBondContact O-N 3.49Å; Q323-T327 PolarHBondContact O-N 2.97Å; Q323-T327 PolarHBondContact O-OG1 2.92Å
324K62.3Low70Confident145 Ų14568.2 Ų68.263%0.6335%0.345SS*.Hα-helixtrans-63.2-41.1176.2-67.2-178.5-180178.80111.6S322 T327 S328S322-K324 PolarHBondContact O-N 2.03Å; K324-T327 PolarHBondContact O-N 2.7Å; K324-S328 PolarHBondContact O-N 3.28Å; K324-S328 VanDerWaalsContact O-N 3.1Å; K324-S328 PolarHBondContact O-OG 3.39Å
325F64.7Low68.3Low8 Ų874.3 Ų74.34%0.03539%0.387CS..Hα-helixtrans-67.8-43.1177.9-161.8-92.2000111.3V45 V48 M55 N319 S322 Q323 T327 S328 F329V45-F325 HydrophobicContact CB-CE2 4.49Å; V45-F325 HydrophobicContact CB-CZ 4.14Å; V45-F325 HydrophobicContact CG1-CE2 4.48Å; V45-F325 HydrophobicContact CG2-CE1 4.38Å; V45-F325 HydrophobicContact CG2-CE2 4.16Å; V45-F325 HydrophobicContact CG2-CZ 3.52Å; V48-F325 HydrophobicContact CB-CE2 4.3Å; V48-F325 HydrophobicContact CG1-CD2 4.29Å; V48-F325 HydrophobicContact CG1-CE2 4.06Å; M55-F325 HydrophobicContact CE-CD2 4.39Å; N319-F325 HydrophobicContact CB-CD1 4.08Å; N319-F325 HydrophobicContact CB-CE1 4.35Å; S322-F325 WeakPolarHBondContact O-CB 3.46Å; S322-F325 PolarHBondContact O-N 2.9Å; S322-F325 PolarHBondContact OG-N 2.96Å; Q323-F325 VanDerWaalsContact C-N 3.34Å; Q323-F325 PolarHBondContact O-N 3.48Å; F325-T327 VanDerWaalsContact C-N 3.34Å; F325-T327 PolarHBondContact O-N 3.11Å; F325-S328 PolarHBondContact O-N 3.3Å; F325-F329 VanDerWaalsContact O-CB 3.22Å; F325-F329 WeakPolarHBondContact O-CB 3.42Å; F325-F329 PolarHBondContact O-N 3.43Å
326R70.8Confident66.9Low128 Ų12876.2 Ų76.248%0.48341%0.408SS..Hα-helixtrans-57.7-43.9174.5-66.1179.385.6-179.72.2112.6N319 S322 Q323 F329 K330N319-R326 WeakPolarHBondContact O-CD 3.25Å; N319-R326 WeakPolarHBondContact O-CG 3.07Å; N319-R326 WeakPolarHBondContact OD1-CG 3.45Å; S322-R326 PolarHBondContact O-N 2.9Å; Q323-R326 PolarHBondContact O-N 3.49Å; R326-F329 PolarHBondContact O-N 2.82Å; R326-K330 WeakPolarHBondContact O-CB 3.19Å; R326-K330 WeakPolarHBondContact O-CG 3.45Å; R326-K330 PolarHBondContact O-N 3.28Å
327T66.6Low65.3Low77 Ų7778.7 Ų78.747%0.47243%0.426SS..Hα-helixtrans-67.9-44.6-179.1-56.50000111.3Q323 K324 F325 K330 K331Q323-T327 PolarHBondContact O-N 2.97Å; Q323-T327 PolarHBondContact O-OG1 2.92Å; K324-T327 PolarHBondContact O-N 2.7Å; F325-T327 VanDerWaalsContact C-N 3.34Å; F325-T327 PolarHBondContact O-N 3.11Å; T327-K330 PolarHBondContact O-N 2.79Å; T327-K331 WeakPolarHBondContact O-CG 3.39Å; T327-K331 PolarHBondContact O-N 2.97Å
328S66.9Low63.9Low19 Ų1986.9 Ų86.913%0.13346%0.464CS..Hα-helixtrans-65-38.3174.6-69.50000112.5K324 F325 K331 L332K324-S328 PolarHBondContact O-N 3.28Å; K324-S328 VanDerWaalsContact O-N 3.1Å; K324-S328 PolarHBondContact O-OG 3.39Å; F325-S328 PolarHBondContact O-N 3.3Å; S328-K331 PolarHBondContact O-N 2.87Å; S328-L332 PolarHBondContact O-N 3.47Å
329F70Confident62.5Low58 Ų5897.6 Ų97.625%0.25450%0.504SS..Hα-helixtrans-61.4-48.8175-176.2-93.7000111.4M44 F325 R326 K331 L332 C333M44-F329 HydrophobicContact CB-CD2 4.32Å; M44-F329 HydrophobicContact CB-CE2 3.98Å; M44-F329 HydrophobicContact CE-CE2 4.2Å; M44-F329 HydrophobicContact CG-CE2 3.83Å; M44-F329 HydrophobicContact SD-CE2 4.04Å; F325-F329 VanDerWaalsContact O-CB 3.22Å; F325-F329 WeakPolarHBondContact O-CB 3.42Å; F325-F329 PolarHBondContact O-N 3.43Å; R326-F329 PolarHBondContact O-N 2.82Å; F329-K331 VanDerWaalsContact C-N 3.28Å; F329-K331 PolarHBondContact O-N 3.36Å; F329-L332 PolarHBondContact O-N 3.46Å; F329-C333 VanDerWaalsContact CE1-SG 3.58Å; F329-C333 PolarHBondContact O-N 2.65Å; F329-C333 PolarHBondContact O-SG 2.87Å; F329-C333 VanDerWaalsContact O-SG 3.38Å
330K72.8Confident61.1Low126 Ų126103.9 Ų103.955%0.54854%0.537SS..Hα-helixtrans-60.7-35.5176-76.9-176178.1-171.20113.1R326 T327 L332 H334R326-K330 WeakPolarHBondContact O-CB 3.19Å; R326-K330 WeakPolarHBondContact O-CG 3.45Å; R326-K330 PolarHBondContact O-N 3.28Å; T327-K330 PolarHBondContact O-N 2.79Å; K330-L332 VanDerWaalsContact C-N 3.33Å; K330-H334 WeakPolarHBondContact O-CB 3.25Å; K330-H334 PolarHBondContact O-N 3.01Å; K330-H334 PolarHBondContact O-ND1 3.14Å
331K71.4Confident60.2Low119 Ų119108 Ų10852%0.51755%0.545SS..Hα-helixtrans-70.1-27.1175.4-75.2-179.6178.2-174.60112.8T327 S328 F329 E341T327-K331 WeakPolarHBondContact O-CG 3.39Å; T327-K331 PolarHBondContact O-N 2.97Å; S328-K331 PolarHBondContact O-N 2.87Å; F329-K331 VanDerWaalsContact C-N 3.28Å; F329-K331 PolarHBondContact O-N 3.36Å; K331-E341 IonicContact NZ-OE2 3.41Å; K331-E341 PolarHBondContact NZ-OE2 3.1Å
332L70.7Confident59.1Low63 Ų63113.7 Ų113.733%0.3357%0.568SS.*Hα-helixtrans-82.6-35175.5-168.665.1000111.6M44 L47 V48 S328 F329 K330M44-L332 HydrophobicContact SD-CD2 4Å; L47-L332 HydrophobicContact CB-CD2 3.89Å; L47-L332 HydrophobicContact CD1-CD2 4.48Å; V48-L332 HydrophobicContact CG2-CD2 4.08Å; S328-L332 PolarHBondContact O-N 3.47Å; F329-L332 PolarHBondContact O-N 3.46Å; K330-L332 VanDerWaalsContact C-N 3.33Å
333C71.1Confident57.7Low66 Ų66117.4 Ų117.445%0.44659%0.591SS.*Hα-helixtrans-76.7-29.4176.3-630000113.6F329F329-C333 VanDerWaalsContact CE1-SG 3.58Å; F329-C333 PolarHBondContact O-N 2.65Å; F329-C333 PolarHBondContact O-SG 2.87Å; F329-C333 VanDerWaalsContact O-SG 3.38Å
334H69.1Low57Low140 Ų140113.6 Ų113.665%0.64859%0.585SS**THydrogen-bonded Turntrans-98.3100.7169-6594.8000108.1K330 G336K330-H334 WeakPolarHBondContact O-CB 3.25Å; K330-H334 PolarHBondContact O-N 3.01Å; K330-H334 PolarHBondContact O-ND1 3.14Å; H334-G336 PolarHBondContact O-N 3.14Å
335C48.8Very low56Low134 Ų134111.5 Ų111.591%0.90559%0.589SS**THydrogen-bonded Turntrans-60.378173.2-64.10000111.2
336G55.1Low54.9Low47 Ų47120.3 Ų120.349%0.48562%0.623SS.*  trans-110.8147.7173.300000110.7H334 Q338H334-G336 PolarHBondContact O-N 3.14Å; G336-Q338 PolarHBondContact O-N 2.76Å
337P45.8Very low53.4Low134 Ų134118.6 Ų118.687%0.8763%0.631SS**  trans-56.6132.4-177.820.4-30.2000111.1R339P337-R339 PolarHBondContact O-N 3.06Å
338Q47.2Very low52.4Low186 Ų186121.4 Ų121.487%0.86964%0.642SS**  trans-62.495.9177.6-72.2-177.52.800109.6G336 L340G336-Q338 PolarHBondContact O-N 2.76Å; Q338-L340 PolarHBondContact O-N 2.83Å
339R42.8Very low51.4Low233 Ų233123.1 Ų123.188%0.87966%0.657SS**  trans-68.4116.2166.6-137.3179.3-169.4-167.93.7107.2P337 E341P337-R339 PolarHBondContact O-N 3.06Å; R339-E341 VanDerWaalsContact C-N 3.27Å; R339-E341 PolarHBondContact O-N 3.32Å
340L41.7Very low50.3Low173 Ų173126.4 Ų126.491%0.90668%0.677SS**  trans-60.887.6172.8-166.975.3000108.7Q338 K342Q338-L340 PolarHBondContact O-N 2.83Å; L340-K342 PolarHBondContact O-N 2.9Å
341E46.1Very low49.1Very low149 Ų149124 Ų12470%0.69667%0.673SS**PPolyproline II helixtrans-68.9121173.7-88.6179.2117.800108.8K331 R339K331-E341 IonicContact NZ-OE2 3.41Å; K331-E341 PolarHBondContact NZ-OE2 3.1Å; R339-E341 VanDerWaalsContact C-N 3.27Å; R339-E341 PolarHBondContact O-N 3.32Å
342K35.9Very low47.8Very low193 Ų193126.8 Ų126.884%0.83968%0.681SS**PPolyproline II helixtrans-51.4142.6168.8-75.9179.9176.3178.60109.3L340 A344L340-K342 PolarHBondContact O-N 2.9Å; K342-A344 PolarHBondContact O-N 3.29Å
343P34.3Very low46.6Very low119 Ų119127 Ų12777%0.77369%0.689SS**PPolyproline II helixtrans-56.5131.1-179.222.8-31.6000110.2S345P343-S345 PolarHBondContact O-N 2.88Å
344A42.9Very low45.3Very low69 Ų69126.5 Ų126.557%0.5769%0.689SS**PPolyproline II helixtrans-58.5120.9177.500000109.9K342 Y346K342-A344 PolarHBondContact O-N 3.29Å; A344-Y346 PolarHBondContact O-N 3.49Å
345S41.6Very low44.4Very low101 Ų101124.4 Ų124.471%0.70668%0.682SS**THydrogen-bonded Turntrans-58.3-3.5-179.6-17.80000114.6P343 S347 A349P343-S345 PolarHBondContact O-N 2.88Å; S345-S347 PolarHBondContact O-N 3.1Å; S345-A349 PolarHBondContact O-N 3.11Å
346Y42.4Very low44.1Very low192 Ų192124.3 Ų124.375%0.75367%0.666SS**Hα-helixtrans-66.8-31.1-179.7-93.7-89.7000113.7A344 L350A344-Y346 PolarHBondContact O-N 3.49Å; Y346-L350 PolarHBondContact O-N 3.31Å
347S38.8Very low43.4Very low93 Ų93128 Ų12865%0.6567%0.674SS**Hα-helixtrans-77.6-25-176.3-1430000113.1S345 T351S345-S347 PolarHBondContact O-N 3.1Å; S347-T351 PolarHBondContact O-OG1 3.36Å; S347-T351 VanDerWaalsContact O-OG1 3.05Å
348L44.3Very low43.3Very low136 Ų136127 Ų12771%0.71267%0.666SS**Hα-helixtrans-78.8-37.8174.8-103.8133000111.8L350 T351 Y352L348-L350 VanDerWaalsContact C-N 3.29Å; L348-L350 PolarHBondContact O-N 2.95Å; L348-T351 PolarHBondContact O-N 3.31Å; L348-Y352 WeakPolarHBondContact O-CB 3.45Å; L348-Y352 PolarHBondContact O-N 3.19Å
349A47.3Very low42.9Very low54 Ų54122.7 Ų122.745%0.44665%0.653SS.*Hα-helixtrans-64.7-32.1177.800000113S345 S353S345-A349 PolarHBondContact O-N 3.11Å; A349-S353 WeakPolarHBondContact O-CB 3.48Å; A349-S353 PolarHBondContact O-N 3.1Å; A349-S353 PolarHBondContact O-OG 2.87Å
350L46.4Very low42.7Very low127 Ų127117.2 Ų117.267%0.66564%0.641SS**Hα-helixtrans-71.6-38.6176.1-114140.6000112.3Y346 L348 A354Y346-L350 PolarHBondContact O-N 3.31Å; L348-L350 VanDerWaalsContact C-N 3.29Å; L348-L350 PolarHBondContact O-N 2.95Å; L350-A354 WeakPolarHBondContact O-CB 3.45Å; L350-A354 PolarHBondContact O-N 3.46Å; L350-A354 VanDerWaalsContact O-N 3.12Å
351T46.7Very low42.4Very low76 Ų76112.3 Ų112.347%0.46663%0.632SS.*Hα-helixtrans-71.2-39.3174-44.80000111.1S347 L348 A354 I355S347-T351 PolarHBondContact O-OG1 3.36Å; S347-T351 VanDerWaalsContact O-OG1 3.05Å; L348-T351 PolarHBondContact O-N 3.31Å; T351-A354 PolarHBondContact O-N 2.82Å; T351-I355 HydrophobicContact CG2-CD1 4.01Å; T351-I355 WeakPolarHBondContact O-CD1 3.34Å; T351-I355 WeakPolarHBondContact O-CG1 3.47Å; T351-I355 PolarHBondContact O-N 2.96Å
352Y45.2Very low41.8Very low177 Ų177114 Ų11469%0.69464%0.64SS**Hα-helixtrans-68.3-37.2178.2-139.1-93.4000112.6L348 I355 K356L348-Y352 WeakPolarHBondContact O-CB 3.45Å; L348-Y352 PolarHBondContact O-N 3.19Å; Y352-I355 PolarHBondContact O-N 2.97Å; Y352-K356 WeakPolarHBondContact O-CB 3.46Å; Y352-K356 PolarHBondContact O-N 3.24Å
353S45.9Very low41.5Very low69 Ų69110.5 Ų110.548%0.48364%0.64SS.*Hα-helixtrans-70.3-38.7175.4-56.60000111.7A349 I355 K356 D357A349-S353 WeakPolarHBondContact O-CB 3.48Å; A349-S353 PolarHBondContact O-N 3.1Å; A349-S353 PolarHBondContact O-OG 2.87Å; S353-I355 VanDerWaalsContact C-N 3.33Å; S353-I355 PolarHBondContact O-N 2.86Å; S353-K356 PolarHBondContact O-N 2.77Å; S353-D357 PolarHBondContact O-N 2.94Å
354A43.4Very low41.6Very low55 Ų55110 Ų11046%0.45564%0.637SS.*Hα-helixtrans-66-33.1175.100000113L350 T351 T358L350-A354 WeakPolarHBondContact O-CB 3.45Å; L350-A354 PolarHBondContact O-N 3.46Å; L350-A354 VanDerWaalsContact O-N 3.12Å; T351-A354 PolarHBondContact O-N 2.82Å; A354-T358 PolarHBondContact O-N 3.1Å; A354-T358 PolarHBondContact O-OG1 2.82Å
355I50.9Low40.8Very low96 Ų96114.6 Ų114.649%0.49265%0.651SS.*Hα-helixtrans-73.8-36.5175.7-66.9163.3000111.3T351 Y352 S353 T358 T359T351-I355 HydrophobicContact CG2-CD1 4.01Å; T351-I355 WeakPolarHBondContact O-CD1 3.34Å; T351-I355 WeakPolarHBondContact O-CG1 3.47Å; T351-I355 PolarHBondContact O-N 2.96Å; Y352-I355 PolarHBondContact O-N 2.97Å; S353-I355 VanDerWaalsContact C-N 3.33Å; S353-I355 PolarHBondContact O-N 2.86Å; I355-T358 WeakPolarHBondContact CA-OG1 2.99Å; I355-T358 PolarHBondContact O-N 3.14Å; I355-T358 PolarHBondContact O-OG1 2.72Å; I355-T359 PolarHBondContact O-N 2.7Å; I355-T359 PolarHBondContact O-OG1 3.36Å
356K42.5Very low40.1Very low131 Ų131117.3 Ų117.357%0.5765%0.653SS**Hα-helixtrans-67.8-33.9176.9-166.5175.5-178.7179.60112.5Y352 S353 T358 T359 N360Y352-K356 WeakPolarHBondContact O-CB 3.46Å; Y352-K356 PolarHBondContact O-N 3.24Å; S353-K356 PolarHBondContact O-N 2.77Å; K356-T358 VanDerWaalsContact C-N 3.35Å; K356-T359 WeakPolarHBondContact CA-OG1 3.24Å; K356-T359 PolarHBondContact O-N 3.27Å; K356-T359 PolarHBondContact O-OG1 3.18Å; K356-N360 VanDerWaalsContact O-CG 3.31Å; K356-N360 PolarHBondContact O-N 2.96Å; K356-N360 PolarHBondContact O-ND2 2.93Å
357D40Very low39.2Very low124 Ų124116.7 Ų116.766%0.66365%0.654SS**Hα-helixtrans-74.1-24.6176.8-70.2-22.4000112.9S353S353-D357 PolarHBondContact O-N 2.94Å
358T43.9Very low38.7Very low113 Ų113117.4 Ų117.469%0.69366%0.655SS**Hα-helixtrans-77.6-17.7170.132.80000114.4A354 I355 K356A354-T358 PolarHBondContact O-N 3.1Å; A354-T358 PolarHBondContact O-OG1 2.82Å; I355-T358 WeakPolarHBondContact CA-OG1 2.99Å; I355-T358 PolarHBondContact O-N 3.14Å; I355-T358 PolarHBondContact O-OG1 2.72Å; K356-T358 VanDerWaalsContact C-N 3.35Å
359T38.5Very low37.9Very low97 Ų97116.6 Ų116.660%0.59566%0.655SS**Hα-helixtrans-97.2-14.4-17923.20000113.8I355 K356 G361I355-T359 PolarHBondContact O-N 2.7Å; I355-T359 PolarHBondContact O-OG1 3.36Å; K356-T359 WeakPolarHBondContact CA-OG1 3.24Å; K356-T359 PolarHBondContact O-N 3.27Å; K356-T359 PolarHBondContact O-OG1 3.18Å; T359-G361 PolarHBondContact O-N 3.45Å
360N37.6Very low36.9Very low118 Ų118123.6 Ų123.663%0.63168%0.679SS**THydrogen-bonded Turntrans-85.114.3178.5-67.2-26.1000113.9K356K356-N360 VanDerWaalsContact O-CG 3.31Å; K356-N360 PolarHBondContact O-N 2.96Å; K356-N360 PolarHBondContact O-ND2 2.93Å
361G35.8Very low35.9Very low70 Ų70124.6 Ų124.672%0.72268%0.682SS**THydrogen-bonded Turntrans-98.2-8.9-178.200000115.8T359T359-G361 PolarHBondContact O-N 3.45Å
362E33Very low34.9Very low184 Ų184127.4 Ų127.486%0.8669%0.694SS**SBendtrans-125.7116.8177.2-79.6175.9145.500109.9
363S29.2Very low34Very low120 Ų120128.5 Ų128.584%0.83971%0.706SS**  trans-75156.2175.2-143.20000110.5
364P37.9Very low33Very low108 Ų108133.1 Ų133.170%0.70172%0.724SS**  trans-94.6135.5-15835.3-29000112.5
365D26.4Very low32.2Very low165 Ų165135.3 Ų135.388%0.88274%0.742SS**  trans-132.5120.2157.3-82.4-38.1000109.9
366H25.7Very low30.9Very low158 Ų158137.2 Ų137.273%0.73176%0.758SS**  trans71.7105.6146.9-141.8-59.2000119.2
367F23.9Very low30.5Very low180 Ų180136 Ų13679%0.78976%0.764SS**  178.6148.5103.2-145-88.8000110.7
368T27.5Very low29.7Very low107 Ų107136.4 Ų136.466%0.65677%0.771SS**  trans-74.3154.3-160.241.40000117.1
369T27.7Very low29.4Very low119 Ų119136.3 Ų136.373%0.7377%0.773SS**  trans-50.1140159.7-34.10000113.5
370E26Very low28.8Very low202 Ų202137.1 Ų137.194%0.94478%0.782SS**  trans-142.4132.3135-80.2-159.813200109.4
371M26.5Very low28.1Very low147 Ų147138.5 Ų138.572%0.72479%0.79SS**  trans-107.2154177.2-98.2178.361.200109.4
372D25.9Very low27.6Very low135 Ų135142.4 Ų142.472%0.72279%0.789SS**  trans69.2123.7156.2-69.8-19.6000119.8
373E25.2Very low27.3Very low200 Ų200142.5 Ų142.594%0.93579%0.787SS**  -170.6159.2102-113.4-177.3139.700114.5
374L26.2Very low27.1Very low167 Ų167144.5 Ų144.587%0.87479%0.787SS**  trans-99.7135.8-160.3-167.295.4000111.1
375A26Very low27Very low101 Ų101144.3 Ų144.384%0.83579%0.786SS**  trans-162.7125.9156.800000114.1
376T23.5Very low27Very low135 Ų135141.9 Ų141.983%0.82878%0.782SS**  trans-124167.3157.442.50000106.9
377P34.5Very low27Very low106 Ų106140 Ų14069%0.68878%0.782SS**  cis-140.9160.2-3.637.8-17.8000117.6
378T23.8Very low27.2Very low133 Ų133140.5 Ų140.582%0.81678%0.783SS**  trans50.1173.8146.945.30000123
379P36.4Very low27Very low111 Ų111147 Ų14772%0.72180%0.796SS**  cis-134.3168.4-19.732.3-12.2000115.3
380S25.2Very low26.9Very low113 Ų113148.9 Ų148.979%0.7980%0.8SS**  trans162.8123.7131.741.20000114.2
381D24.4Very low26.7Very low148 Ų148143.1 Ų143.179%0.79178%0.782SS**  trans24.5143.1141.8-59.6-23000120.5
382Q25.3Very low26.6Very low152 Ų152144.4 Ų144.471%0.7178%0.784SS**  cis-177.6159.940.3-141.2165.433.100111.5
383F26Very low26.7Very low185 Ų185145.7 Ų145.781%0.81179%0.785SS**  trans91.5112.5159.6-72.1-76.3000123.1
384L25.3Very low26.7Very low162 Ų162143.6 Ų143.685%0.84878%0.78SS**  trans-72.9-171.9171-83.5121.5000114.3
385P36.6Very low26.8Very low105 Ų105142.1 Ų142.168%0.68278%0.779SS**  -138.8175.1-5239.3-21.9000114.4
386S24.4Very low26.8Very low113 Ų113142.1 Ų142.179%0.7977%0.772SS**  trans146.8136.7150.265.60000108
387T27.3Very low26.9Very low119 Ų119144.1 Ų144.173%0.7378%0.777SS**  cis-160.6135.131.4-56.40000110.1
388K26.9Very low26.6Very low190 Ų190144.1 Ų144.183%0.82678%0.78SS**  trans33.3111155.5-67.8178.1174.3176.60121.4
389R23.5Very low26.7Very low245 Ų245141.4 Ų141.493%0.92578%0.778SS**  trans-90.7130.3147.7-167.8-176.1-80-168.4-3.6107.7
390I26.3Very low26.4Very low158 Ų158147.2 Ų147.281%0.8179%0.786SS**  trans-100.1125.4172.8-64.9173.6000108.1
391S22Very low26.7Very low80 Ų80149 Ų14956%0.55979%0.791SS**  trans-133.9171.6166.963.50000109.3
392F24.6Very low27Very low175 Ų175145.6 Ų145.677%0.76878%0.784SS**  trans95146.3171.4-66.5-86.8000116.2
393E26.5Very low27.3Very low162 Ų162146 Ų14676%0.75779%0.791SS**  cis179.9157.1-27.6-168.7166.8-147.800104
394D26.8Very low27.3Very low155 Ų155143 Ų14383%0.82979%0.791SS**  trans-56.5147.2-179.3-80.3-50.3000114.7
395T26.8Very low27.8Very low136 Ų136141.8 Ų141.883%0.83479%0.79SS**  trans-153131.4140.4-260000112.7
396S25.8Very low27.9Very low101 Ų101145.2 Ų145.271%0.70683%0.828SS**  trans-59.3150.9168.157.10000114.4
397L27.6Very low28.1Very low178 Ų178146.9 Ų146.993%0.93283%0.83SS**  trans-147.1141140.7-14087.5000113
398S27.9Very low28.1Very low105 Ų105148.3 Ų148.373%0.73484%0.835SS**  trans-68.2152-174.8177.50000115.1
399G25.9Very low28.2Very low76 Ų76146 Ų14678%0.78484%0.835SS**  trans-164.693.6164.200000111.8
400R30.2Very low28.5Very low233 Ų233140.2 Ų140.288%0.87983%0.83SS**  trans-68144.3172.3-68.4173.9179.4-178.4-0.9111.5
401V29.8Very low28.6Very low150 Ų150139.1 Ų139.191%0.90983%0.831SS**  trans-148.8138130179.70000108.6
402A31.5Very low29Very low78 Ų78143 Ų14365%0.64585%0.85SS**  trans-108.7154.7-175.500000112.3
403L30.8Very low29.4Very low161 Ų161140.7 Ų140.784%0.84386%0.855SS**  trans45.9128.5152-84.490.1000121.3
404C27.5Very low29.6Very low122 Ų122139.1 Ų139.182%0.82486%0.863SS**  -172156.8103.3-105.40000113.6
405T34.8Very low29.8Very low135 Ų135137.8 Ų137.883%0.82887%0.866SS**  trans-55.7146.9-179.446.20000117.2
406A39.2Very low30.1Very low178 Ų178137.9 Ų137.9100%1.47187%0.869SS**  -165.70125.500000109.3

Retrieved 406 of 406 residues in 525.1 ms (Link to these results)

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