A0A096NBJ8_PAPAN Loading...

Sphingosine-1-phosphate receptor 3

AlphaFold DB (A0A0D9SB07), UniProt , Accession A0A096NBJ8, Species PAPAN (Papio anubis, Olive baboon), Gene S1PR3, Length 378 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
1M38.4Very low38.6Very low247 Ų247149.9 Ų149.9100%1.21784%0.84SS**  091.30-88.1173.517300108.4
2A36Very low39Very low104 Ų104143.2 Ų143.286%0.8682%0.817SS**  trans-93.2112.8172.400000107.7A4A2-A4 PolarHBondContact O-N 3.21Å
3T38.5Very low39.8Very low135 Ų135149.8 Ų149.883%0.82882%0.821SS**  trans-66109.2176.539.90000109.8L5T3-L5 PolarHBondContact O-N 3.36Å
4A36.2Very low40.7Very low98 Ų98140.7 Ų140.781%0.8178%0.779SS**PPolyproline II helixtrans-65.2120.4170.700000109.7A2A2-A4 PolarHBondContact O-N 3.21Å
5L40.5Very low42.5Very low159 Ų159135.3 Ų135.383%0.83275%0.748SS**PPolyproline II helixtrans-62.5137.1167.5-115.190.7000109.1T3T3-L5 PolarHBondContact O-N 3.36Å
6P41.4Very low45.1Very low105 Ų105133.5 Ų133.568%0.68273%0.733SS**PPolyproline II helixtrans-66.4148.4174.427.4-31.9000110.5R8P6-R8 PolarHBondContact O-N 3.48Å
7P40.4Very low47.7Very low126 Ų126127.9 Ų127.982%0.81870%0.704SS**PPolyproline II helixtrans-64.8128-177.125.8-31.6000110.1L9P7-L9 PolarHBondContact O-N 3.45Å
8R37.2Very low50.1Low237 Ų237120.8 Ų120.889%0.89467%0.665SS**  trans-54.2114.8167.8-82-175.6178.6179.30.4108.4P6 Q10P6-R8 PolarHBondContact O-N 3.48Å; R8-Q10 PolarHBondContact O-N 3Å
9L39.9Very low52.2Low168 Ų168121.2 Ų121.288%0.8866%0.655SS**  trans-54.3106.6166-141.985.3000107.4P7 P11P7-L9 PolarHBondContact O-N 3.45Å; L9-P11 VanDerWaalsContact O-CD 3.3Å; L9-P11 WeakPolarHBondContact O-CD 3.42Å
10Q35.9Very low54.2Low184 Ų184120.3 Ų120.386%0.8665%0.646SS**PPolyproline II helixtrans-64.5119.5174.6-74.6-178.5-3.200108.3R8R8-Q10 PolarHBondContact O-N 3Å
11P39.9Very low56.1Low86 Ų86114.6 Ų114.656%0.55862%0.616SS**PPolyproline II helixtrans-71143.5170.628.8-28.6000109L9 R13 E16L9-P11 VanDerWaalsContact O-CD 3.3Å; L9-P11 WeakPolarHBondContact O-CD 3.42Å; P11-R13 PolarHBondContact O-N 3.13Å; P11-R13 VanDerWaalsContact O-N 3.1Å; P11-E16 WeakPolarHBondContact CG-OE1 3.19Å
12A43.1Very low58.7Low69 Ų69103 Ų10357%0.5756%0.559SS**PPolyproline II helixtrans-51.6117.6-179.200000111.7G14 N15A12-G14 PolarHBondContact O-N 3.4Å; A12-N15 PolarHBondContact O-N 2.92Å; A12-N15 VanDerWaalsContact O-N 3.15Å
13R49.8Very low61.4Low229 Ų229104 Ų10486%0.86455%0.546SS*.THydrogen-bonded Turntrans-52.4-12.7-170.6-148.4174.6-171.6171.92116.4P11P11-R13 PolarHBondContact O-N 3.13Å; P11-R13 VanDerWaalsContact O-N 3.1Å
14G53Low64Low23 Ų23101.6 Ų101.624%0.23752%0.522CS..Hα-helixtrans-85.8-23.8179.200000115.3A12A12-G14 PolarHBondContact O-N 3.4Å
15N67.6Low66.6Low59 Ų5997 Ų9732%0.31648%0.483SS..Hα-helixtrans-79.8-26.2-174-66-9.4000112.7A12 R19 F104A12-N15 PolarHBondContact O-N 2.92Å; A12-N15 VanDerWaalsContact O-N 3.15Å; N15-R19 PolarHBondContact O-N 2.88Å; N15-F104 WeakPolarHBondContact CB-O 3.22Å; N15-F104 VanDerWaalsContact CG-O 3.25Å; N15-F104 PolarHBondContact OD1-O 3.21Å
16E83.4Confident68.9Low107 Ų10790.9 Ų90.950%0.546%0.459SS..Hα-helixtrans-72.9-42.1-178.5-69.8-177.7165.800111.7P11 L18 R19 E20P11-E16 WeakPolarHBondContact CG-OE1 3.19Å; E16-L18 PolarHBondContact O-N 3.01Å; E16-R19 PolarHBondContact O-N 3.29Å; E16-R19 VanDerWaalsContact O-N 3.1Å; E16-E20 WeakPolarHBondContact O-CB 3.3Å; E16-E20 PolarHBondContact O-N 3.3Å
17T89.4Confident71.1Confident39 Ų3986.7 Ų86.724%0.23943%0.43CS..Hα-helixtrans-59.1-46180-490000111.9R19 E20 H21 L179T17-R19 VanDerWaalsContact C-N 3.33Å; T17-R19 PolarHBondContact O-N 3.46Å; T17-E20 PolarHBondContact O-N 3.48Å; T17-H21 PolarHBondContact O-N 3.06Å; T17-H21 PolarHBondContact O-ND1 3.31Å; T17-L179 HydrophobicContact CG2-CD2 3.83Å
18L90.6Very high73.3Confident0 Ų082 Ų820%040%0.398CS..Hα-helixtrans-62.9-41.8177-90.471.1000111.2E16 H21 Y22 T103 F104 L106 P108 W111 L191E16-L18 PolarHBondContact O-N 3.01Å; L18-H21 PolarHBondContact O-N 3.42Å; L18-Y22 WeakPolarHBondContact O-CB 3.4Å; L18-Y22 WeakPolarHBondContact O-CD2 3.15Å; L18-Y22 PolarHBondContact O-N 2.88Å; L18-T103 HydrophobicContact CD2-CG2 4.42Å; L18-T103 WeakPolarHBondContact CD2-O 3.41Å; L18-F104 HydrophobicContact CB-CD1 4.49Å; L18-L106 HydrophobicContact CD2-CB 4.36Å; L18-P108 HydrophobicContact CD1-CB 4.31Å; L18-P108 HydrophobicContact CD1-CG 3.82Å; L18-W111 HydrophobicContact CD2-CB 4.29Å; L18-W111 HydrophobicContact CD2-CG 4.18Å; L18-L191 HydrophobicContact CD1-CD2 4.02Å; L18-L191 HydrophobicContact CG-CD1 4.4Å; L18-L191 HydrophobicContact CG-CD2 4.36Å
19R90.5Very high75.4Confident128 Ų12874.3 Ų74.348%0.48339%0.385SS..Hα-helixtrans-63.9-43.8179.5-174176.4-74.8146.8-4.3111.3N15 E16 T17 Y22 Q23 L28N15-R19 PolarHBondContact O-N 2.88Å; E16-R19 PolarHBondContact O-N 3.29Å; E16-R19 VanDerWaalsContact O-N 3.1Å; T17-R19 VanDerWaalsContact C-N 3.33Å; T17-R19 PolarHBondContact O-N 3.46Å; R19-Y22 PolarHBondContact O-N 2.92Å; R19-Q23 VanDerWaalsContact O-CB 3.22Å; R19-Q23 WeakPolarHBondContact O-CB 3.49Å; R19-Q23 PolarHBondContact O-N 3.45Å; R19-L28 HydrophobicContact CG-CD1 4.11Å; R19-L28 HydrophobicContact CG-CD2 3.88Å
20E93.1Very high77.3Confident102 Ų10268.2 Ų68.248%0.47736%0.363SS..Hα-helixtrans-58.2-50.7176.8-177.7-177.9-165.600111.7E16 T17 Y22 Q23 Y24 L182E16-E20 WeakPolarHBondContact O-CB 3.3Å; E16-E20 PolarHBondContact O-N 3.3Å; T17-E20 PolarHBondContact O-N 3.48Å; E20-Y22 PolarHBondContact O-N 2.93Å; E20-Q23 WeakPolarHBondContact O-CB 3.41Å; E20-Q23 PolarHBondContact O-N 3.33Å; E20-Y24 WeakPolarHBondContact O-CB 3.44Å; E20-Y24 PolarHBondContact O-N 3.49Å; E20-L182 HydrophobicContact CG-CD2 4.26Å
21H93.4Very high79.5Confident1 Ų162 Ų621%0.00533%0.332CS..Hα-helixtrans-64.9-42.3-179.4-72.565.9000111.7T17 L18 Q23 Y24 V25 P190 L191T17-H21 PolarHBondContact O-N 3.06Å; T17-H21 PolarHBondContact O-ND1 3.31Å; L18-H21 PolarHBondContact O-N 3.42Å; H21-Q23 VanDerWaalsContact C-N 3.32Å; H21-Q23 PolarHBondContact O-N 3.06Å; H21-Y24 PolarHBondContact O-N 2.91Å; H21-V25 WeakPolarHBondContact O-CG2 3.29Å; H21-V25 PolarHBondContact O-N 3Å; H21-V25 VanDerWaalsContact O-N 3.11Å; H21-P190 HydrophobicContact CB-CB 4.28Å; H21-P190 PolarHBondContact CD2-O 3.09Å; H21-L191 HydrophobicContact CB-CD1 3.89Å
22Y92.4Very high81.3Confident5 Ų561.6 Ų61.62%0.0232%0.324CS..Hα-helixtrans-68.4-30.2176.7-87.1-106.7000113L18 R19 E20 G26 K27 L28 R31 T103 F104 W111 P190 L191L18-Y22 WeakPolarHBondContact O-CB 3.4Å; L18-Y22 WeakPolarHBondContact O-CD2 3.15Å; L18-Y22 PolarHBondContact O-N 2.88Å; R19-Y22 PolarHBondContact O-N 2.92Å; E20-Y22 PolarHBondContact O-N 2.93Å; Y22-G26 PolarHBondContact O-N 3.14Å; Y22-K27 HydrophobicContact CD1-CB 4.08Å; Y22-K27 PolarHBondContact O-N 3.36Å; Y22-L28 PolarHBondContact O-N 3.02Å; Y22-R31 HydrophobicContact CD1-CG 4.13Å; Y22-R31 HydrophobicContact CE1-CG 4.06Å; Y22-T103 HydrophobicContact CE2-CG2 4.3Å; Y22-F104 HydrophobicContact CD1-CE1 4.18Å; Y22-F104 HydrophobicContact CD1-CZ 4.21Å; Y22-F104 HydrophobicContact CD2-CE1 4.27Å; Y22-F104 AromaticContact CG-CE1 3.86Å; Y22-F104 HydrophobicContact CG-CE1 3.86Å; Y22-F104 HydrophobicContact CG-CZ 4.33Å; Y22-W111 AromaticContact CE2-NE1 3.83Å; Y22-W111 AromaticContact CZ-NE1 3.89Å; Y22-W111 PolarHBondContact OH-NE1 3.01Å; Y22-P190 HydrophobicContact CD1-CG 4.21Å; Y22-P190 HydrophobicContact CD2-CB 3.86Å; Y22-P190 HydrophobicContact CD2-CG 3.96Å; Y22-P190 HydrophobicContact CE1-CG 4.02Å; Y22-P190 HydrophobicContact CE2-CB 3.94Å; Y22-P190 HydrophobicContact CE2-CG 3.79Å; Y22-P190 HydrophobicContact CG-CB 4.38Å; Y22-P190 HydrophobicContact CG-CG 4.19Å; Y22-L191 HydrophobicContact CE2-CD1 4.29Å
23Q93.1Very high82.8Confident125 Ų12566.4 Ų66.458%0.58433%0.332SS*.Hα-helixtrans-70.4-47.4173.6-177.5172.9-15.300110.6R19 E20 H21 V25 G26 L28R19-Q23 VanDerWaalsContact O-CB 3.22Å; R19-Q23 WeakPolarHBondContact O-CB 3.49Å; R19-Q23 PolarHBondContact O-N 3.45Å; E20-Q23 WeakPolarHBondContact O-CB 3.41Å; E20-Q23 PolarHBondContact O-N 3.33Å; H21-Q23 VanDerWaalsContact C-N 3.32Å; H21-Q23 PolarHBondContact O-N 3.06Å; Q23-V25 VanDerWaalsContact C-N 3.32Å; Q23-V25 PolarHBondContact O-N 3.4Å; Q23-G26 PolarHBondContact O-N 3.45Å; Q23-L28 HydrophobicContact CB-CB 4.45Å; Q23-L28 HydrophobicContact CB-CD2 3.99Å; Q23-L28 HydrophobicContact CG-CD2 4.42Å
24Y92.3Very high83.6Confident84 Ų8459.1 Ų59.133%0.32931%0.308SS..Hα-helixtrans-55.6-45.7177.9-179.6-104.1000111.9E20 H21 G26 L182 P183 V271 Q272E20-Y24 WeakPolarHBondContact O-CB 3.44Å; E20-Y24 PolarHBondContact O-N 3.49Å; H21-Y24 PolarHBondContact O-N 2.91Å; Y24-G26 PolarHBondContact O-N 3.05Å; Y24-L182 HydrophobicContact CD1-CB 4.15Å; Y24-L182 HydrophobicContact CD2-CB 4.36Å; Y24-L182 HydrophobicContact CD2-CD2 4.02Å; Y24-L182 HydrophobicContact CE1-CB 4.13Å; Y24-L182 WeakPolarHBondContact CE1-O 3.33Å; Y24-L182 HydrophobicContact CE2-CB 4.35Å; Y24-L182 HydrophobicContact CG-CB 4.27Å; Y24-L182 HydrophobicContact CG-CD2 4Å; Y24-P183 WeakPolarHBondContact OH-CA 3.33Å; Y24-V271 HydrophobicContact CD1-CG1 4.17Å; Y24-V271 HydrophobicContact CE1-CB 4.22Å; Y24-V271 HydrophobicContact CE1-CG1 3.98Å; Y24-V271 HydrophobicContact CE1-CG2 3.95Å; Y24-Q272 PolarHBondContact O-NE2 3.47Å
25V91.8Very high83.9Confident0 Ų060.1 Ų60.10%031%0.314CS..THydrogen-bonded Turntrans-78.9-0.6178.2-53.60000114.7H21 Q23 K27 T187 P190 V271H21-V25 WeakPolarHBondContact O-CG2 3.29Å; H21-V25 PolarHBondContact O-N 3Å; H21-V25 VanDerWaalsContact O-N 3.11Å; Q23-V25 VanDerWaalsContact C-N 3.32Å; Q23-V25 PolarHBondContact O-N 3.4Å; V25-K27 VanDerWaalsContact C-N 3.33Å; V25-K27 HydrophobicContact CG2-CB 3.99Å; V25-K27 HydrophobicContact CG2-CD 4.47Å; V25-K27 HydrophobicContact CG2-CG 4.15Å; V25-K27 PolarHBondContact O-N 2.83Å; V25-T187 HydrophobicContact CB-CG2 4.47Å; V25-P190 HydrophobicContact CG1-CB 4.31Å; V25-P190 HydrophobicContact CG2-CB 3.97Å; V25-P190 HydrophobicContact CG2-CG 3.82Å; V25-V271 HydrophobicContact CB-CG1 4.11Å; V25-V271 HydrophobicContact CG1-CG1 4.08Å
26G88.8Confident83.4Confident32 Ų3261.2 Ų61.233%0.3333%0.326SS..THydrogen-bonded Turntrans7415.9178.300000115.1Y22 Q23 Y24Y22-G26 PolarHBondContact O-N 3.14Å; Q23-G26 PolarHBondContact O-N 3.45Å; Y24-G26 PolarHBondContact O-N 3.05Å
27K88.3Confident81.9Confident16 Ų1664.3 Ų64.37%0.0734%0.341CS..  trans-94.6-12-179.1-78-171.4169.1172.30114.6Y22 V25 A29 G30 R31 T187 L277 F278Y22-K27 HydrophobicContact CD1-CB 4.08Å; Y22-K27 PolarHBondContact O-N 3.36Å; V25-K27 VanDerWaalsContact C-N 3.33Å; V25-K27 HydrophobicContact CG2-CB 3.99Å; V25-K27 HydrophobicContact CG2-CD 4.47Å; V25-K27 HydrophobicContact CG2-CG 4.15Å; V25-K27 PolarHBondContact O-N 2.83Å; K27-A29 PolarHBondContact O-N 3.3Å; K27-G30 PolarHBondContact O-N 2.93Å; K27-R31 WeakPolarHBondContact O-CG 3.32Å; K27-R31 PolarHBondContact O-N 3.45Å; K27-T187 WeakPolarHBondContact CD-O 3.37Å; K27-T187 WeakPolarHBondContact CE-O 3.36Å; K27-T187 PolarHBondContact NZ-O 2.98Å; K27-L277 PolarHBondContact NZ-O 2.9Å; K27-F278 HydrophobicContact CG-CD1 3.8Å; K27-F278 HydrophobicContact CG-CE1 3.72Å
28L86.8Confident80Confident28 Ų2866.8 Ų66.815%0.14737%0.366CS..Hα-helixtrans-55.9-52.9-175-178.361.1000113R19 Y22 Q23 G30 R31 L32 F104R19-L28 HydrophobicContact CG-CD1 4.11Å; R19-L28 HydrophobicContact CG-CD2 3.88Å; Y22-L28 PolarHBondContact O-N 3.02Å; Q23-L28 HydrophobicContact CB-CB 4.45Å; Q23-L28 HydrophobicContact CB-CD2 3.99Å; Q23-L28 HydrophobicContact CG-CD2 4.42Å; L28-G30 PolarHBondContact O-N 3.49Å; L28-R31 PolarHBondContact O-N 3.42Å; L28-L32 HydrophobicContact CD1-CD1 3.94Å; L28-L32 HydrophobicContact CG-CD1 4.02Å; L28-L32 PolarHBondContact O-N 3.2Å; L28-L32 VanDerWaalsContact O-N 3.14Å; L28-F104 HydrophobicContact CD1-CD1 4.41Å; L28-F104 HydrophobicContact CD1-CE1 3.61Å; L28-F104 HydrophobicContact CD1-CE2 4.05Å; L28-F104 HydrophobicContact CD1-CZ 3.39Å
29A81.4Confident78.5Confident75 Ų7567.3 Ų67.362%0.6237%0.371SS*.Hα-helixtrans-63.5-42.3-177.700000112.5K27 R31 L32 K33K27-A29 PolarHBondContact O-N 3.3Å; A29-R31 PolarHBondContact O-N 3.26Å; A29-L32 PolarHBondContact O-N 2.94Å; A29-K33 WeakPolarHBondContact O-CB 3.27Å; A29-K33 PolarHBondContact O-N 2.91Å
30G79.1Confident77.6Confident40 Ų4065.8 Ų65.841%0.41238%0.376SS..Hα-helixtrans-60.7-44176.700000112.5K27 L28 L32 K33 E34K27-G30 PolarHBondContact O-N 2.93Å; L28-G30 PolarHBondContact O-N 3.49Å; G30-L32 PolarHBondContact O-N 3.14Å; G30-K33 PolarHBondContact O-N 3.34Å; G30-E34 WeakPolarHBondContact O-CG 3.49Å; G30-E34 PolarHBondContact O-N 3.28Å
31R81.1Confident77.1Confident54 Ų5467.9 Ų67.920%0.20439%0.39CS..Hα-helixtrans-66.9-33.1179.1-70.5-61.4-170.5-167.95.4113.8Y22 K27 L28 A29 E34 F104Y22-R31 HydrophobicContact CD1-CG 4.13Å; Y22-R31 HydrophobicContact CE1-CG 4.06Å; K27-R31 WeakPolarHBondContact O-CG 3.32Å; K27-R31 PolarHBondContact O-N 3.45Å; L28-R31 PolarHBondContact O-N 3.42Å; A29-R31 PolarHBondContact O-N 3.26Å; R31-E34 IonicContact CZ-OE2 2.98Å; R31-E34 IonicContact NH1-OE2 2.91Å; R31-E34 PolarHBondContact NH1-OE2 3.03Å; R31-F104 HydrophobicContact CB-CE2 4.27Å; R31-F104 HydrophobicContact CB-CZ 4.18Å
32L79.3Confident76.7Confident78 Ų7870.1 Ų70.141%0.40840%0.404SS..Hα-helixtrans-73.7-37.6175.1-73.5161.2000111.6L28 A29 G30 A35 K101 F104L28-L32 HydrophobicContact CD1-CD1 3.94Å; L28-L32 HydrophobicContact CG-CD1 4.02Å; L28-L32 PolarHBondContact O-N 3.2Å; L28-L32 VanDerWaalsContact O-N 3.14Å; A29-L32 PolarHBondContact O-N 2.94Å; G30-L32 PolarHBondContact O-N 3.14Å; L32-A35 WeakPolarHBondContact O-CB 3.27Å; L32-A35 PolarHBondContact O-N 3.13Å; L32-K101 HydrophobicContact CD2-CG 4.33Å; L32-F104 HydrophobicContact CD2-CE2 4.4Å; L32-F104 HydrophobicContact CG-CE2 4.37Å
33K74Confident76.3Confident169 Ų16972.7 Ų72.774%0.73542%0.42SS*.Hα-helixtrans-71.6-37.9178.2-168.9176.4-177.8177.70113A29 G30 A35 S36A29-K33 WeakPolarHBondContact O-CB 3.27Å; A29-K33 PolarHBondContact O-N 2.91Å; G30-K33 PolarHBondContact O-N 3.34Å; K33-A35 PolarHBondContact O-N 3.3Å; K33-A35 VanDerWaalsContact O-N 3.13Å; K33-S36 PolarHBondContact O-N 3.12Å
34E66.7Low76.1Confident76 Ų7670.4 Ų70.436%0.35541%0.414SS..Hα-helixtrans-55.7-27.1173.2-82.2179.3168.100112.5G30 R31 S36G30-E34 WeakPolarHBondContact O-CG 3.49Å; G30-E34 PolarHBondContact O-N 3.28Å; R31-E34 IonicContact CZ-OE2 2.98Å; R31-E34 IonicContact NH1-OE2 2.91Å; R31-E34 PolarHBondContact NH1-OE2 3.03Å; E34-S36 VanDerWaalsContact C-N 3.3Å; E34-S36 PolarHBondContact O-N 3.23Å
35A59.4Low76.1Confident45 Ų4570.8 Ų70.837%0.37242%0.421SS..THydrogen-bonded Turntrans-80.9-2.2178.400000114.6L32 K33 K101L32-A35 WeakPolarHBondContact O-CB 3.27Å; L32-A35 PolarHBondContact O-N 3.13Å; K33-A35 PolarHBondContact O-N 3.3Å; K33-A35 VanDerWaalsContact O-N 3.13Å; A35-K101 HydrophobicContact CB-CD 4.02Å; A35-K101 HydrophobicContact CB-CG 3.73Å
36S56.3Low76Confident81 Ų8171.5 Ų71.557%0.56643%0.425SS*.THydrogen-bonded Turntrans-102.5-56.6-173-153.20000113.8K33 E34K33-S36 PolarHBondContact O-N 3.12Å; E34-S36 VanDerWaalsContact C-N 3.3Å; E34-S36 PolarHBondContact O-N 3.23Å
37E52.5Low76.2Confident172 Ų17271.7 Ų71.780%0.80442%0.418SS*.THydrogen-bonded Turntrans-147.2-31.6-165.9-71.8179157.300116.7
38A48.5Very low76.4Confident92 Ų9275.2 Ų75.276%0.7644%0.441SS*.THydrogen-bonded Turntrans-102.7-5.5-175.600000114.9
39G59.7Low76.6Confident11 Ų1175.8 Ų75.811%0.11344%0.443CS..SBendtrans-83-22.6-176.300000114.7L41 T43G39-L41 PolarHBondContact O-N 3.39Å; G39-T43 WeakPolarHBondContact O-CB 3.46Å; G39-T43 PolarHBondContact O-N 2.94Å; G39-T43 PolarHBondContact O-OG1 3.26Å
40T71.8Confident77.2Confident96 Ų9672.2 Ų72.259%0.58941%0.414SS*.Hα-helixtrans-65.4-48.6-164-48.10000113.5T43 V44T40-T43 PolarHBondContact O-N 3.2Å; T40-V44 HydrophobicContact CG2-CG2 4.44Å; T40-V44 WeakPolarHBondContact O-CB 3.5Å; T40-V44 WeakPolarHBondContact O-CG2 3.29Å; T40-V44 PolarHBondContact O-N 3Å
41L83.3Confident77.9Confident145 Ų14572.1 Ų72.176%0.75941%0.407SS*.Hα-helixtrans-66.1-46.6-177.6-177.564.5000112G39 T43 V44 L45G39-L41 PolarHBondContact O-N 3.39Å; L41-T43 PolarHBondContact O-N 3.37Å; L41-V44 PolarHBondContact O-N 3.32Å; L41-L45 WeakPolarHBondContact O-CB 3.48Å; L41-L45 PolarHBondContact O-N 3.45Å
42T83.4Confident78.5Confident49 Ų4974.8 Ų74.830%0.30142%0.42SS..Hα-helixtrans-63.3-41.8178.2-540000111.3L45 F46 W282T42-L45 PolarHBondContact O-N 3.22Å; T42-F46 HydrophobicContact CG2-CD2 4.15Å; T42-F46 HydrophobicContact CG2-CE1 4.07Å; T42-F46 HydrophobicContact CG2-CE2 3.49Å; T42-F46 VanDerWaalsContact CG2-CE2 3.49Å; T42-F46 HydrophobicContact CG2-CZ 3.43Å; T42-F46 VanDerWaalsContact CG2-CZ 3.43Å; T42-F46 VanDerWaalsContact O-CG 3.29Å; T42-F46 WeakPolarHBondContact O-CG 3.47Å; T42-F46 PolarHBondContact O-N 3.43Å; T42-W282 HydrophobicContact CG2-CH2 4.13Å; T42-W282 HydrophobicContact CG2-CZ2 4.39Å
43T85.3Confident79.1Confident59 Ų5971.1 Ų71.136%0.36240%0.401SS..Hα-helixtrans-62.1-45.9174.1-69.20000111.6G39 T40 L41 F46 L47 I96G39-T43 WeakPolarHBondContact O-CB 3.46Å; G39-T43 PolarHBondContact O-N 2.94Å; G39-T43 PolarHBondContact O-OG1 3.26Å; T40-T43 PolarHBondContact O-N 3.2Å; L41-T43 PolarHBondContact O-N 3.37Å; T43-F46 PolarHBondContact O-N 3.28Å; T43-L47 HydrophobicContact CG2-CD1 4.03Å; T43-L47 HydrophobicContact CG2-CG 4.45Å; T43-L47 WeakPolarHBondContact O-CB 3.47Å; T43-L47 VanDerWaalsContact O-CG 3.27Å; T43-L47 WeakPolarHBondContact O-CG 3.22Å; T43-L47 PolarHBondContact O-N 3.4Å; T43-I96 HydrophobicContact CG2-CG2 3.66Å
44V89.5Confident80.1Confident76 Ų7664.5 Ų64.546%0.46137%0.374SS..Hα-helixtrans-60.9-46176.7169.10000110.7T40 L41 F46 L47 V48T40-V44 HydrophobicContact CG2-CG2 4.44Å; T40-V44 WeakPolarHBondContact O-CB 3.5Å; T40-V44 WeakPolarHBondContact O-CG2 3.29Å; T40-V44 PolarHBondContact O-N 3Å; L41-V44 PolarHBondContact O-N 3.32Å; V44-F46 PolarHBondContact O-N 3.2Å; V44-L47 PolarHBondContact O-N 3.25Å; V44-V48 HydrophobicContact CG1-CG2 4.48Å; V44-V48 WeakPolarHBondContact O-CG2 3.5Å; V44-V48 PolarHBondContact O-N 3.39Å
45L90.6Very high81.4Confident92 Ų9266.2 Ų66.248%0.48239%0.386SS..Hα-helixtrans-56.1-49.1176.5177.163.9000111.5L41 T42 L47 V48 I49L41-L45 WeakPolarHBondContact O-CB 3.48Å; L41-L45 PolarHBondContact O-N 3.45Å; T42-L45 PolarHBondContact O-N 3.22Å; L45-L47 VanDerWaalsContact C-N 3.34Å; L45-L47 PolarHBondContact O-N 3.1Å; L45-V48 PolarHBondContact O-N 2.88Å; L45-I49 HydrophobicContact CD1-CD1 4.32Å; L45-I49 HydrophobicContact CG-CD1 4.15Å; L45-I49 WeakPolarHBondContact O-CG1 3.5Å; L45-I49 PolarHBondContact O-N 3.36Å
46F90.3Very high82.9Confident15 Ų1565.1 Ų65.17%0.06637%0.373CS..Hα-helixtrans-65.7-36.6179.1-62.5-15.2000112.2T42 T43 V44 V48 I49 C50 I96 Q281 W282 V285T42-F46 HydrophobicContact CG2-CD2 4.15Å; T42-F46 HydrophobicContact CG2-CE1 4.07Å; T42-F46 HydrophobicContact CG2-CE2 3.49Å; T42-F46 VanDerWaalsContact CG2-CE2 3.49Å; T42-F46 HydrophobicContact CG2-CZ 3.43Å; T42-F46 VanDerWaalsContact CG2-CZ 3.43Å; T42-F46 VanDerWaalsContact O-CG 3.29Å; T42-F46 WeakPolarHBondContact O-CG 3.47Å; T42-F46 PolarHBondContact O-N 3.43Å; T43-F46 PolarHBondContact O-N 3.28Å; V44-F46 PolarHBondContact O-N 3.2Å; F46-V48 VanDerWaalsContact C-N 3.35Å; F46-V48 PolarHBondContact O-N 3.2Å; F46-I49 HydrophobicContact CD1-CD1 4.32Å; F46-I49 PolarHBondContact O-N 3.09Å; F46-C50 PolarHBondContact O-N 3.45Å; F46-C50 PolarHBondContact O-SG 3.1Å; F46-I96 HydrophobicContact CB-CD1 3.65Å; F46-Q281 HydrophobicContact CE2-CB 4.41Å; F46-W282 HydrophobicContact CE1-CE3 4.42Å; F46-W282 AromaticContact CE1-CZ3 3.99Å; F46-W282 HydrophobicContact CE1-CZ3 3.99Å; F46-W282 AromaticContact CZ-CE3 3.98Å; F46-W282 HydrophobicContact CZ-CE3 3.98Å; F46-W282 HydrophobicContact CZ-CH2 4.21Å; F46-W282 AromaticContact CZ-CZ3 3.77Å; F46-W282 HydrophobicContact CZ-CZ3 3.77Å; F46-V285 HydrophobicContact CD1-CG1 4.11Å; F46-V285 HydrophobicContact CD1-CG2 3.72Å; F46-V285 HydrophobicContact CD2-CG2 3.74Å; F46-V285 HydrophobicContact CE1-CB 4.25Å; F46-V285 HydrophobicContact CE1-CG1 3.96Å; F46-V285 HydrophobicContact CE1-CG2 3.62Å; F46-V285 HydrophobicContact CE2-CG2 3.62Å; F46-V285 HydrophobicContact CG-CG2 3.8Å; F46-V285 HydrophobicContact CZ-CB 4.4Å; F46-V285 HydrophobicContact CZ-CG2 3.57Å
47L92.6Very high84.6Confident37 Ų3761.2 Ų61.219%0.19435%0.346CS..Hα-helixtrans-64.7-37174.6-72.5173.5000112.9T43 V44 L45 S51 K93 I96 L97T43-L47 HydrophobicContact CG2-CD1 4.03Å; T43-L47 HydrophobicContact CG2-CG 4.45Å; T43-L47 WeakPolarHBondContact O-CB 3.47Å; T43-L47 VanDerWaalsContact O-CG 3.27Å; T43-L47 WeakPolarHBondContact O-CG 3.22Å; T43-L47 PolarHBondContact O-N 3.4Å; V44-L47 PolarHBondContact O-N 3.25Å; L45-L47 VanDerWaalsContact C-N 3.34Å; L45-L47 PolarHBondContact O-N 3.1Å; L47-S51 WeakPolarHBondContact O-CB 3.32Å; L47-S51 PolarHBondContact O-N 3.37Å; L47-S51 PolarHBondContact O-OG 3.08Å; L47-K93 HydrophobicContact CD2-CG 3.97Å; L47-I96 HydrophobicContact CD1-CG2 4.47Å; L47-I96 HydrophobicContact CD2-CB 4.04Å; L47-I96 HydrophobicContact CD2-CD1 4.44Å; L47-I96 HydrophobicContact CD2-CG2 3.77Å; L47-I96 HydrophobicContact CG-CG2 3.92Å; L47-L97 HydrophobicContact CD1-CD2 4.04Å; L47-L97 HydrophobicContact CD2-CD2 3.99Å; L47-L97 HydrophobicContact CD2-CG 4Å
48V93Very high86.5Confident90 Ų9056.5 Ų56.555%0.54533%0.326SS..Hα-helixtrans-63.7-47.5173.4170.70000110V44 L45 F46 C50 S51 F52V44-V48 HydrophobicContact CG1-CG2 4.48Å; V44-V48 WeakPolarHBondContact O-CG2 3.5Å; V44-V48 PolarHBondContact O-N 3.39Å; L45-V48 PolarHBondContact O-N 2.88Å; F46-V48 VanDerWaalsContact C-N 3.35Å; F46-V48 PolarHBondContact O-N 3.2Å; V48-C50 PolarHBondContact O-N 3.47Å; V48-S51 PolarHBondContact O-N 2.91Å; V48-S51 VanDerWaalsContact O-N 3.17Å; V48-F52 PolarHBondContact O-N 3.18Å
49I91.9Very high88.4Confident40 Ų4054 Ų5421%0.20530%0.299CS..Hα-helixtrans-57.7-47.6176.4-67.2167.3000111L45 F46 S51 F52 I53 L289L45-I49 HydrophobicContact CD1-CD1 4.32Å; L45-I49 HydrophobicContact CG-CD1 4.15Å; L45-I49 WeakPolarHBondContact O-CG1 3.5Å; L45-I49 PolarHBondContact O-N 3.36Å; F46-I49 HydrophobicContact CD1-CD1 4.32Å; F46-I49 PolarHBondContact O-N 3.09Å; I49-S51 VanDerWaalsContact C-N 3.32Å; I49-S51 PolarHBondContact O-N 3.43Å; I49-F52 WeakPolarHBondContact O-CB 3.44Å; I49-F52 PolarHBondContact O-N 3.22Å; I49-I53 HydrophobicContact CG2-CD1 3.96Å; I49-I53 WeakPolarHBondContact O-CG1 3.46Å; I49-I53 PolarHBondContact O-N 2.86Å; I49-L289 HydrophobicContact CG2-CD2 3.64Å
50C92.9Very high89.8Confident0 Ų053.7 Ų53.70%030%0.295CS..Hα-helixtrans-60.6-41.8177-62.60000112.4F46 V48 F52 I53 V54 Y92 K93F46-C50 PolarHBondContact O-N 3.45Å; F46-C50 PolarHBondContact O-SG 3.1Å; V48-C50 PolarHBondContact O-N 3.47Å; C50-F52 VanDerWaalsContact C-N 3.29Å; C50-F52 PolarHBondContact O-N 3.06Å; C50-I53 PolarHBondContact O-N 3.22Å; C50-V54 VanDerWaalsContact O-CG2 3.31Å; C50-V54 WeakPolarHBondContact O-CG2 3.25Å; C50-V54 PolarHBondContact O-N 2.97Å; C50-Y92 WeakPolarHBondContact SG-CD1 3.15Å; C50-K93 HydrophobicContact CB-CB 3.91Å; C50-K93 HydrophobicContact CB-CG 4.46Å
51S94.1Very high90.6Very high38 Ų3851.2 Ų51.227%0.26628%0.277SS..Hα-helixtrans-65.2-38.2-179.7-58.80000110.8L47 V48 I49 V54 L55L47-S51 WeakPolarHBondContact O-CB 3.32Å; L47-S51 PolarHBondContact O-N 3.37Å; L47-S51 PolarHBondContact O-OG 3.08Å; V48-S51 PolarHBondContact O-N 2.91Å; V48-S51 VanDerWaalsContact O-N 3.17Å; I49-S51 VanDerWaalsContact C-N 3.32Å; I49-S51 PolarHBondContact O-N 3.43Å; S51-V54 PolarHBondContact O-N 3.46Å; S51-L55 WeakPolarHBondContact O-CB 3.49Å; S51-L55 WeakPolarHBondContact O-CG 3.28Å; S51-L55 PolarHBondContact O-N 2.87Å
52F93Very high90.9Very high110 Ų11047.6 Ų47.648%0.48226%0.258SS..Hα-helixtrans-62.1-50172.8-173.7-108.2000112.1V48 I49 C50 V54 L55 E56V48-F52 PolarHBondContact O-N 3.18Å; I49-F52 WeakPolarHBondContact O-CB 3.44Å; I49-F52 PolarHBondContact O-N 3.22Å; C50-F52 VanDerWaalsContact C-N 3.29Å; C50-F52 PolarHBondContact O-N 3.06Å; F52-V54 VanDerWaalsContact C-N 3.27Å; F52-V54 PolarHBondContact O-N 3.44Å; F52-L55 PolarHBondContact O-N 3.02Å; F52-L55 VanDerWaalsContact O-N 3.1Å; F52-E56 HydrophobicContact CD1-CG 4.19Å; F52-E56 WeakPolarHBondContact CD1-OE2 3.35Å; F52-E56 HydrophobicContact CD2-CG 4.3Å; F52-E56 HydrophobicContact CE1-CG 3.94Å; F52-E56 WeakPolarHBondContact CE1-OE1 3.42Å; F52-E56 WeakPolarHBondContact CE1-OE2 3.23Å; F52-E56 HydrophobicContact CE2-CG 4.02Å; F52-E56 HydrophobicContact CG-CG 4.39Å; F52-E56 HydrophobicContact CZ-CG 3.85Å; F52-E56 WeakPolarHBondContact CZ-OE1 3.22Å; F52-E56 WeakPolarHBondContact O-CG 3.41Å; F52-E56 PolarHBondContact O-N 3.2Å
53I93.4Very high90.9Very high0 Ų045.6 Ų45.60%025%0.246CC..Hα-helixtrans-53.7-45.5176.4-69.8165.2000111.5I49 C50 N57 V288 A292I49-I53 HydrophobicContact CG2-CD1 3.96Å; I49-I53 WeakPolarHBondContact O-CG1 3.46Å; I49-I53 PolarHBondContact O-N 2.86Å; C50-I53 PolarHBondContact O-N 3.22Å; I53-N57 WeakPolarHBondContact O-CB 3.48Å; I53-N57 PolarHBondContact O-N 3.2Å; I53-N57 VanDerWaalsContact O-N 3.12Å; I53-N57 PolarHBondContact O-ND2 3.28Å; I53-V288 HydrophobicContact CD1-CG1 3.48Å; I53-V288 VanDerWaalsContact CD1-CG1 3.48Å; I53-A292 HydrophobicContact CD1-CB 4.48Å; I53-A292 HydrophobicContact CG1-CB 3.81Å
54V94.6Very high90.8Very high30 Ų3043.7 Ų43.718%0.18223%0.234CC..Hα-helixtrans-62.5-47.5178.81670000110.9C50 S51 F52 L58 L86 I90C50-V54 VanDerWaalsContact O-CG2 3.31Å; C50-V54 WeakPolarHBondContact O-CG2 3.25Å; C50-V54 PolarHBondContact O-N 2.97Å; S51-V54 PolarHBondContact O-N 3.46Å; F52-V54 VanDerWaalsContact C-N 3.27Å; F52-V54 PolarHBondContact O-N 3.44Å; V54-L58 WeakPolarHBondContact O-CB 3.42Å; V54-L58 PolarHBondContact O-N 3.36Å; V54-L86 HydrophobicContact CB-CD1 4.1Å; V54-L86 HydrophobicContact CG1-CD1 3.66Å; V54-L86 HydrophobicContact CG2-CD1 4.35Å; V54-L86 VanDerWaalsContact O-CD1 3.25Å; V54-L86 WeakPolarHBondContact O-CD1 3.4Å; V54-I90 HydrophobicContact CG2-CG1 3.86Å
55L92.6Very high90.5Very high113 Ų11349.8 Ų49.859%0.59225%0.249SC*.Hα-helixtrans-64.9-44.5-178.7-71.4170.2000112.4S51 F52 M59S51-L55 WeakPolarHBondContact O-CB 3.49Å; S51-L55 WeakPolarHBondContact O-CG 3.28Å; S51-L55 PolarHBondContact O-N 2.87Å; F52-L55 PolarHBondContact O-N 3.02Å; F52-L55 VanDerWaalsContact O-N 3.1Å; L55-M59 WeakPolarHBondContact O-CB 3.48Å; L55-M59 PolarHBondContact O-N 3.17Å
56E91.3Very high90.1Very high21 Ų2152 Ų5210%0.09826%0.255CS..Hα-helixtrans-64.9-47.5-179.4-68.9-171.1126.400112.1F52 M59 V60 P295F52-E56 HydrophobicContact CD1-CG 4.19Å; F52-E56 WeakPolarHBondContact CD1-OE2 3.35Å; F52-E56 HydrophobicContact CD2-CG 4.3Å; F52-E56 HydrophobicContact CE1-CG 3.94Å; F52-E56 WeakPolarHBondContact CE1-OE1 3.42Å; F52-E56 WeakPolarHBondContact CE1-OE2 3.23Å; F52-E56 HydrophobicContact CE2-CG 4.02Å; F52-E56 HydrophobicContact CG-CG 4.39Å; F52-E56 HydrophobicContact CZ-CG 3.85Å; F52-E56 WeakPolarHBondContact CZ-OE1 3.22Å; F52-E56 WeakPolarHBondContact O-CG 3.41Å; F52-E56 PolarHBondContact O-N 3.2Å; E56-M59 WeakPolarHBondContact O-CB 3.44Å; E56-M59 PolarHBondContact O-N 3.35Å; E56-V60 WeakPolarHBondContact O-CG2 3.37Å; E56-V60 PolarHBondContact O-N 2.87Å; E56-P295 HydrophobicContact CB-CB 4.42Å; E56-P295 HydrophobicContact CB-CG 4.02Å
57N92.6Very high89.5Confident0 Ų053.1 Ų53.10%026%0.261CS..Hα-helixtrans-70.3-33.9-179.8-75.5-71.8000112.1I53 M59 V60 L61 A82 D85 L86 S291I53-N57 WeakPolarHBondContact O-CB 3.48Å; I53-N57 PolarHBondContact O-N 3.2Å; I53-N57 VanDerWaalsContact O-N 3.12Å; I53-N57 PolarHBondContact O-ND2 3.28Å; N57-M59 VanDerWaalsContact C-N 3.34Å; N57-V60 PolarHBondContact O-N 3.47Å; N57-L61 WeakPolarHBondContact O-CG 3.07Å; N57-L61 PolarHBondContact O-N 3.04Å; N57-L61 VanDerWaalsContact O-N 3.07Å; N57-A82 WeakPolarHBondContact CB-O 2.85Å; N57-D85 HydrophobicContact CB-CB 4.41Å; N57-D85 WeakPolarHBondContact OD1-CB 3.05Å; N57-L86 HydrophobicContact CB-CB 4.09Å; N57-S291 PolarHBondContact ND2-O 3.18Å
58L92.6Very high88.3Confident73 Ų7357.6 Ų57.638%0.38229%0.285SS..Hα-helixtrans-61.2-43.6170.3179.461.8000111.4V54 V60 L61 I62 L86V54-L58 WeakPolarHBondContact O-CB 3.42Å; V54-L58 PolarHBondContact O-N 3.36Å; L58-V60 VanDerWaalsContact C-N 3.33Å; L58-V60 PolarHBondContact O-N 3.23Å; L58-L61 PolarHBondContact O-N 3Å; L58-I62 HydrophobicContact CD1-CD1 4.24Å; L58-I62 HydrophobicContact CD1-CG1 4.47Å; L58-I62 HydrophobicContact CG-CD1 3.96Å; L58-I62 WeakPolarHBondContact O-CG1 3.42Å; L58-I62 PolarHBondContact O-N 3.37Å; L58-L86 HydrophobicContact CB-CD1 4.14Å
59M88.6Confident87Confident40 Ų4062.3 Ų62.320%0.19730%0.299CS..Hα-helixtrans-63.4-38.4176.8176.6170.63600112.2L55 E56 N57 I62 A63 F309 L312 V313L55-M59 WeakPolarHBondContact O-CB 3.48Å; L55-M59 PolarHBondContact O-N 3.17Å; E56-M59 WeakPolarHBondContact O-CB 3.44Å; E56-M59 PolarHBondContact O-N 3.35Å; N57-M59 VanDerWaalsContact C-N 3.34Å; M59-I62 PolarHBondContact O-N 2.78Å; M59-A63 WeakPolarHBondContact O-CB 3.39Å; M59-A63 PolarHBondContact O-N 3.33Å; M59-F309 HydrophobicContact CE-CD1 4.38Å; M59-F309 HydrophobicContact CE-CD2 4.05Å; M59-F309 HydrophobicContact CE-CE1 3.61Å; M59-F309 HydrophobicContact CE-CE2 3.22Å; M59-F309 HydrophobicContact CE-CZ 2.98Å; M59-F309 HydrophobicContact CG-CD2 4.23Å; M59-F309 HydrophobicContact CG-CE2 4.13Å; M59-F309 HydrophobicContact SD-CD1 4.32Å; M59-F309 HydrophobicContact SD-CD2 4.02Å; M59-F309 HydrophobicContact SD-CE1 4.1Å; M59-F309 HydrophobicContact SD-CE2 3.81Å; M59-F309 HydrophobicContact SD-CG 4.31Å; M59-F309 HydrophobicContact SD-CZ 3.88Å; M59-L312 HydrophobicContact SD-CB 4.46Å; M59-V313 HydrophobicContact CE-CG2 4.26Å; M59-V313 HydrophobicContact SD-CG2 3.6Å; M59-V313 VanDerWaalsContact SD-CG2 3.6Å
60V87.9Confident85.6Confident4 Ų460.9 Ų60.92%0.02429%0.291CS..Hα-helixtrans-60.1-45.9173.6172.50000111E56 N57 L58 I62 A63 I64 I78 A82 P295E56-V60 WeakPolarHBondContact O-CG2 3.37Å; E56-V60 PolarHBondContact O-N 2.87Å; N57-V60 PolarHBondContact O-N 3.47Å; L58-V60 VanDerWaalsContact C-N 3.33Å; L58-V60 PolarHBondContact O-N 3.23Å; V60-I62 PolarHBondContact O-N 2.93Å; V60-A63 WeakPolarHBondContact O-CB 3.29Å; V60-A63 PolarHBondContact O-N 3.02Å; V60-I64 HydrophobicContact CG1-CD1 3.96Å; V60-I64 WeakPolarHBondContact O-CG1 3.33Å; V60-I64 PolarHBondContact O-N 2.99Å; V60-I78 HydrophobicContact CG1-CG2 4.4Å; V60-A82 HydrophobicContact CB-CB 4.16Å; V60-A82 HydrophobicContact CG1-CB 3.8Å; V60-P295 HydrophobicContact CG2-CB 3.99Å; V60-P295 HydrophobicContact CG2-CG 4.09Å
61L89.8Confident84.3Confident43 Ų4364.9 Ų64.923%0.22531%0.309CS..Hα-helixtrans-60.4-46.3176.7-71.2173.1000112.1N57 L58 A63 I64 W65 G79 A82 L83 L86N57-L61 WeakPolarHBondContact O-CG 3.07Å; N57-L61 PolarHBondContact O-N 3.04Å; N57-L61 VanDerWaalsContact O-N 3.07Å; L58-L61 PolarHBondContact O-N 3Å; L61-A63 VanDerWaalsContact C-N 3.31Å; L61-A63 PolarHBondContact O-N 3.39Å; L61-I64 PolarHBondContact O-N 3.34Å; L61-W65 WeakPolarHBondContact O-CB 3.38Å; L61-W65 PolarHBondContact O-N 3.24Å; L61-G79 VanDerWaalsContact CD2-O 3.27Å; L61-G79 WeakPolarHBondContact CD2-O 3.17Å; L61-A82 HydrophobicContact CD2-CB 4.14Å; L61-A82 HydrophobicContact CG-CB 4.13Å; L61-L83 HydrophobicContact CD1-CB 4.48Å; L61-L83 HydrophobicContact CD1-CD1 4.4Å; L61-L83 HydrophobicContact CD2-CB 4.42Å; L61-L86 HydrophobicContact CD1-CD2 3.8Å
62I88.2Confident82.9Confident69 Ų6966.7 Ų66.735%0.35432%0.316SS..Hα-helixtrans-61.5-40.3176.9-66.9167.6000110.9L58 M59 V60 I64 W65 K66 L312L58-I62 HydrophobicContact CD1-CD1 4.24Å; L58-I62 HydrophobicContact CD1-CG1 4.47Å; L58-I62 HydrophobicContact CG-CD1 3.96Å; L58-I62 WeakPolarHBondContact O-CG1 3.42Å; L58-I62 PolarHBondContact O-N 3.37Å; M59-I62 PolarHBondContact O-N 2.78Å; V60-I62 PolarHBondContact O-N 2.93Å; I62-I64 PolarHBondContact O-N 3.44Å; I62-W65 PolarHBondContact O-N 2.78Å; I62-K66 WeakPolarHBondContact O-CB 3.45Å; I62-K66 PolarHBondContact O-N 3.46Å; I62-L312 HydrophobicContact CG2-CD2 3.81Å
63A84Confident81.7Confident7 Ų763.9 Ų63.96%0.05830%0.302CS..Hα-helixtrans-63.5-39.8178.600000112.9M59 V60 L61 N67 L312M59-A63 WeakPolarHBondContact O-CB 3.39Å; M59-A63 PolarHBondContact O-N 3.33Å; V60-A63 WeakPolarHBondContact O-CB 3.29Å; V60-A63 PolarHBondContact O-N 3.02Å; L61-A63 VanDerWaalsContact C-N 3.31Å; L61-A63 PolarHBondContact O-N 3.39Å; A63-N67 WeakPolarHBondContact O-CB 3.34Å; A63-N67 PolarHBondContact O-N 3.17Å; A63-L312 HydrophobicContact CB-CD1 3.41Å; A63-L312 VanDerWaalsContact CB-CD1 3.41Å
64I83.9Confident80.5Confident19 Ų1966.5 Ų66.510%0.09732%0.315CS..Hα-helixtrans-68.8-46.6176.1-66167.4000109.9V60 L61 I62 K66 N67 I78V60-I64 HydrophobicContact CG1-CD1 3.96Å; V60-I64 WeakPolarHBondContact O-CG1 3.33Å; V60-I64 PolarHBondContact O-N 2.99Å; L61-I64 PolarHBondContact O-N 3.34Å; I62-I64 PolarHBondContact O-N 3.44Å; I64-K66 PolarHBondContact O-N 2.96Å; I64-N67 PolarHBondContact O-N 3.41Å; I64-I78 HydrophobicContact CD1-CG2 4.21Å
65W83.2Confident79.7Confident205 Ų20566.1 Ų66.178%0.77731%0.311SS*.Hα-helixtrans-63-43.1-177.9-176.661.5000112.9L61 I62 N67L61-W65 WeakPolarHBondContact O-CB 3.38Å; L61-W65 PolarHBondContact O-N 3.24Å; I62-W65 PolarHBondContact O-N 2.78Å; W65-N67 VanDerWaalsContact C-N 3.33Å; W65-N67 PolarHBondContact O-N 2.99Å
66K81.1Confident79.1Confident139 Ų13963.3 Ų63.360%0.60429%0.294SS*.Hα-helixtrans-74.5-20.6-177-170.2170.3-179.4174.60113.8I62 I64I62-K66 WeakPolarHBondContact O-CB 3.45Å; I62-K66 PolarHBondContact O-N 3.46Å; I64-K66 PolarHBondContact O-N 2.96Å
67N77.4Confident78.4Confident37 Ų3762.5 Ų62.520%0.19829%0.29CS..  trans-107.1102.5-175-1704.1000111.6A63 I64 W65 K69 F70 H71A63-N67 WeakPolarHBondContact O-CB 3.34Å; A63-N67 PolarHBondContact O-N 3.17Å; I64-N67 PolarHBondContact O-N 3.41Å; W65-N67 VanDerWaalsContact C-N 3.33Å; W65-N67 PolarHBondContact O-N 2.99Å; N67-K69 PolarHBondContact O-N 3.33Å; N67-K69 WeakPolarHBondContact OD1-CB 3.31Å; N67-K69 PolarHBondContact OD1-N 3.2Å; N67-K69 VanDerWaalsContact OD1-N 3.16Å; N67-F70 HydrophobicContact CB-CB 4.47Å; N67-F70 HydrophobicContact CB-CD2 3.52Å; N67-F70 HydrophobicContact CB-CE2 3.93Å; N67-F70 HydrophobicContact CB-CG 4.05Å; N67-F70 VanDerWaalsContact ND2-CD2 3.3Å; N67-F70 WeakPolarHBondContact ND2-CD2 3.14Å; N67-F70 WeakPolarHBondContact ND2-CE1 3.17Å; N67-F70 WeakPolarHBondContact ND2-CE2 3.38Å; N67-F70 WeakPolarHBondContact ND2-CZ 3.36Å; N67-F70 WeakPolarHBondContact O-CB 3.13Å; N67-F70 PolarHBondContact O-N 2.96Å; N67-H71 PolarHBondContact O-ND1 3.47Å
68N67.7Low77.9Confident132 Ų13263.5 Ų63.571%0.70630%0.295SS*.G310 helixtrans-57.9-25.2177-71.7-6.6000113.2F70 H71N68-F70 PolarHBondContact O-N 3.31Å; N68-H71 WeakPolarHBondContact CA-ND1 3.46Å; N68-H71 PolarHBondContact O-N 2.84Å; N68-H71 PolarHBondContact O-ND1 3.36Å
69K65.6Low77.6Confident189 Ų18960.5 Ų60.582%0.82228%0.282SS*.G310 helixtrans-68.9-14.3174.8-61.5-172.9177.7-176.50113.9N67N67-K69 PolarHBondContact O-N 3.33Å; N67-K69 WeakPolarHBondContact OD1-CB 3.31Å; N67-K69 PolarHBondContact OD1-N 3.2Å; N67-K69 VanDerWaalsContact OD1-N 3.16Å
70F62.8Low77.5Confident9 Ų959.1 Ų59.14%0.03928%0.275CS..G310 helixtrans-94.28.9176.8-62.6-26.3000113.5N67 N68 N72 Y75 E304 A308N67-F70 HydrophobicContact CB-CB 4.47Å; N67-F70 HydrophobicContact CB-CD2 3.52Å; N67-F70 HydrophobicContact CB-CE2 3.93Å; N67-F70 HydrophobicContact CB-CG 4.05Å; N67-F70 VanDerWaalsContact ND2-CD2 3.3Å; N67-F70 WeakPolarHBondContact ND2-CD2 3.14Å; N67-F70 WeakPolarHBondContact ND2-CE1 3.17Å; N67-F70 WeakPolarHBondContact ND2-CE2 3.38Å; N67-F70 WeakPolarHBondContact ND2-CZ 3.36Å; N67-F70 WeakPolarHBondContact O-CB 3.13Å; N67-F70 PolarHBondContact O-N 2.96Å; N68-F70 PolarHBondContact O-N 3.31Å; F70-N72 PolarHBondContact O-N 2.98Å; F70-Y75 HydrophobicContact CB-CD1 4.12Å; F70-Y75 HydrophobicContact CB-CD2 3.99Å; F70-Y75 HydrophobicContact CB-CE1 4.39Å; F70-Y75 HydrophobicContact CB-CE2 4.27Å; F70-Y75 HydrophobicContact CB-CG 3.92Å; F70-Y75 HydrophobicContact CD1-CD1 4.34Å; F70-Y75 HydrophobicContact CD1-CD2 4.37Å; F70-Y75 AromaticContact CD1-CE1 3.75Å; F70-Y75 HydrophobicContact CD1-CE1 3.75Å; F70-Y75 AromaticContact CD1-CE2 3.78Å; F70-Y75 HydrophobicContact CD1-CE2 3.78Å; F70-Y75 AromaticContact CD1-CZ 3.43Å; F70-Y75 VanDerWaalsContact CD1-CZ 3.43Å; F70-Y75 HydrophobicContact CE1-CE1 4.16Å; F70-Y75 AromaticContact CE1-CZ 3.9Å; F70-Y75 HydrophobicContact CG-CD1 4.25Å; F70-Y75 HydrophobicContact CG-CE1 4.07Å; F70-Y75 HydrophobicContact CG-CE2 4.38Å; F70-Y75 HydrophobicContact CG-CG 4.48Å; F70-Y75 WeakPolarHBondContact O-CB 3.36Å; F70-Y75 WeakPolarHBondContact O-CD2 3.4Å; F70-Y75 VanDerWaalsContact O-CG 3.25Å; F70-E304 HydrophobicContact CE1-CB 3.87Å; F70-E304 HydrophobicContact CZ-CB 4.13Å; F70-A308 HydrophobicContact CE2-CB 3.61Å; F70-A308 HydrophobicContact CZ-CB 3.94Å
71H65.2Low77.4Confident84 Ų8459.1 Ų59.139%0.38928%0.275SS..  trans-82.749.9176.5-70.373.5000112.9N67 N68N67-H71 PolarHBondContact O-ND1 3.47Å; N68-H71 WeakPolarHBondContact CA-ND1 3.46Å; N68-H71 PolarHBondContact O-N 2.84Å; N68-H71 PolarHBondContact O-ND1 3.36Å
72N66.4Low77.5Confident76 Ų7657.1 Ų57.141%0.40626%0.264SS..SBendtrans-108.8154.5172.3-165.9-5.8000109.9F70 M74 Y75 F76F70-N72 PolarHBondContact O-N 2.98Å; N72-M74 VanDerWaalsContact C-N 3.29Å; N72-M74 PolarHBondContact O-N 3.34Å; N72-M74 VanDerWaalsContact O-N 3.15Å; N72-Y75 HydrophobicContact CB-CD2 3.95Å; N72-Y75 HydrophobicContact CB-CE2 4.39Å; N72-Y75 WeakPolarHBondContact O-CB 3.33Å; N72-Y75 PolarHBondContact O-N 3.15Å; N72-F76 PolarHBondContact O-N 2.85Å
73R66.3Low77.6Confident52 Ų5256.9 Ų56.920%0.19626%0.264CS..Hα-helixtrans-48.4-45.4-173.6-68.3-177.8-76.3167.7-3.3114Y75 F76 F77 E135 V154R73-Y75 VanDerWaalsContact C-N 3.27Å; R73-Y75 PolarHBondContact O-N 3.05Å; R73-F76 PolarHBondContact O-N 2.76Å; R73-F76 VanDerWaalsContact O-N 3.13Å; R73-F77 WeakPolarHBondContact O-CD2 3.47Å; R73-F77 PolarHBondContact O-N 3.39Å; R73-E135 IonicContact CZ-OE1 2.93Å; R73-E135 IonicContact NE-OE1 3.6Å; R73-E135 IonicContact NH1-OE1 2.77Å; R73-V154 HydrophobicContact CB-CG2 4.35Å; R73-V154 HydrophobicContact CG-CG2 4.04Å
74M69.2Low77.9Confident54 Ų5456.6 Ų56.627%0.26626%0.261SS..Hα-helixtrans-55.5-39.2177.3-178.7-173.181.500113N72 F77 I78 R136N72-M74 VanDerWaalsContact C-N 3.29Å; N72-M74 PolarHBondContact O-N 3.34Å; N72-M74 VanDerWaalsContact O-N 3.15Å; M74-F77 PolarHBondContact O-N 3.32Å; M74-I78 HydrophobicContact CE-CD1 4.25Å; M74-I78 HydrophobicContact CG-CD1 4.01Å; M74-I78 VanDerWaalsContact O-CG1 3.31Å; M74-I78 WeakPolarHBondContact O-CG1 3.16Å; M74-I78 PolarHBondContact O-N 3.44Å; M74-I78 VanDerWaalsContact O-N 3.09Å; M74-R136 VanDerWaalsContact CG-NH2 3.34Å; M74-R136 PolarHBondContact SD-NH2 3.45Å
75Y77Confident78.3Confident23 Ų2355.8 Ų55.89%0.0926%0.257CS..Hα-helixtrans-77.8-24.3-178.5-66.5-73.4000112.7F70 N72 R73 F77 I78 G79 M305F70-Y75 HydrophobicContact CB-CD1 4.12Å; F70-Y75 HydrophobicContact CB-CD2 3.99Å; F70-Y75 HydrophobicContact CB-CE1 4.39Å; F70-Y75 HydrophobicContact CB-CE2 4.27Å; F70-Y75 HydrophobicContact CB-CG 3.92Å; F70-Y75 HydrophobicContact CD1-CD1 4.34Å; F70-Y75 HydrophobicContact CD1-CD2 4.37Å; F70-Y75 AromaticContact CD1-CE1 3.75Å; F70-Y75 HydrophobicContact CD1-CE1 3.75Å; F70-Y75 AromaticContact CD1-CE2 3.78Å; F70-Y75 HydrophobicContact CD1-CE2 3.78Å; F70-Y75 AromaticContact CD1-CZ 3.43Å; F70-Y75 VanDerWaalsContact CD1-CZ 3.43Å; F70-Y75 HydrophobicContact CE1-CE1 4.16Å; F70-Y75 AromaticContact CE1-CZ 3.9Å; F70-Y75 HydrophobicContact CG-CD1 4.25Å; F70-Y75 HydrophobicContact CG-CE1 4.07Å; F70-Y75 HydrophobicContact CG-CE2 4.38Å; F70-Y75 HydrophobicContact CG-CG 4.48Å; F70-Y75 WeakPolarHBondContact O-CB 3.36Å; F70-Y75 WeakPolarHBondContact O-CD2 3.4Å; F70-Y75 VanDerWaalsContact O-CG 3.25Å; N72-Y75 HydrophobicContact CB-CD2 3.95Å; N72-Y75 HydrophobicContact CB-CE2 4.39Å; N72-Y75 WeakPolarHBondContact O-CB 3.33Å; N72-Y75 PolarHBondContact O-N 3.15Å; R73-Y75 VanDerWaalsContact C-N 3.27Å; R73-Y75 PolarHBondContact O-N 3.05Å; Y75-F77 VanDerWaalsContact C-N 3.35Å; Y75-I78 HydrophobicContact CD1-CD1 4.22Å; Y75-I78 PolarHBondContact O-N 2.99Å; Y75-G79 PolarHBondContact O-N 3.48Å; Y75-M305 HydrophobicContact CD1-CE 4.13Å; Y75-M305 HydrophobicContact CE1-CE 4.01Å
76F79.8Confident78.8Confident54 Ų5447 Ų4724%0.23723%0.225CC..Hα-helixtrans-66.3-39.2170-72.9-65.4000111.4N72 R73 G79 N80 V154 F155N72-F76 PolarHBondContact O-N 2.85Å; R73-F76 PolarHBondContact O-N 2.76Å; R73-F76 VanDerWaalsContact O-N 3.13Å; F76-G79 PolarHBondContact O-N 3.16Å; F76-N80 WeakPolarHBondContact O-CB 3.1Å; F76-N80 PolarHBondContact O-N 3.06Å; F76-V154 HydrophobicContact CB-CG1 4.29Å; F76-F155 HydrophobicContact CD1-CE1 4.28Å; F76-F155 AromaticContact CD1-CZ 3.94Å; F76-F155 HydrophobicContact CD1-CZ 3.94Å; F76-F155 HydrophobicContact CE1-CE1 4.42Å; F76-F155 AromaticContact CE1-CZ 3.75Å; F76-F155 HydrophobicContact CE1-CZ 3.75Å; F76-F155 HydrophobicContact CG-CZ 4.44Å; F76-F155 HydrophobicContact CZ-CZ 4.08Å
77F77.9Confident79.3Confident3 Ų343.9 Ų43.91%0.01322%0.215CC..Hα-helixtrans-67-41.9173.3-76.6-69.3000112.7R73 M74 Y75 G79 N80 L81 A131 I132 E135 V154 I158R73-F77 WeakPolarHBondContact O-CD2 3.47Å; R73-F77 PolarHBondContact O-N 3.39Å; M74-F77 PolarHBondContact O-N 3.32Å; Y75-F77 VanDerWaalsContact C-N 3.35Å; F77-G79 VanDerWaalsContact C-N 3.31Å; F77-G79 PolarHBondContact O-N 2.91Å; F77-N80 PolarHBondContact O-N 3.48Å; F77-L81 WeakPolarHBondContact O-CB 3.46Å; F77-L81 PolarHBondContact O-N 3.16Å; F77-A131 HydrophobicContact CE1-CB 3.78Å; F77-A131 HydrophobicContact CZ-CB 4.44Å; F77-I132 HydrophobicContact CB-CD1 3.85Å; F77-I132 HydrophobicContact CB-CG1 3.54Å; F77-I132 HydrophobicContact CD1-CG1 3.72Å; F77-I132 HydrophobicContact CD2-CG1 4.44Å; F77-I132 HydrophobicContact CG-CD1 4.44Å; F77-I132 HydrophobicContact CG-CG1 3.65Å; F77-E135 VanDerWaalsContact CD2-OE2 3.22Å; F77-E135 WeakPolarHBondContact CD2-OE2 3.04Å; F77-E135 WeakPolarHBondContact CE2-OE2 3.23Å; F77-V154 HydrophobicContact CD2-CG1 4.23Å; F77-V154 HydrophobicContact CE1-CG1 4.39Å; F77-V154 HydrophobicContact CE2-CB 4.47Å; F77-V154 HydrophobicContact CE2-CG1 3.64Å; F77-V154 HydrophobicContact CE2-CG2 4.12Å; F77-V154 HydrophobicContact CZ-CG1 3.75Å; F77-V154 HydrophobicContact CZ-CG2 4.43Å; F77-I158 HydrophobicContact CD1-CG1 4.46Å; F77-I158 HydrophobicContact CE1-CG1 4.24Å
78I80.8Confident80Confident21 Ų2142.7 Ų42.711%0.10821%0.21CC..Hα-helixtrans-63.2-40.8174.4-65.4164.6000110.7V60 I64 M74 Y75 L81 A82 Y298 M305V60-I78 HydrophobicContact CG1-CG2 4.4Å; I64-I78 HydrophobicContact CD1-CG2 4.21Å; M74-I78 HydrophobicContact CE-CD1 4.25Å; M74-I78 HydrophobicContact CG-CD1 4.01Å; M74-I78 VanDerWaalsContact O-CG1 3.31Å; M74-I78 WeakPolarHBondContact O-CG1 3.16Å; M74-I78 PolarHBondContact O-N 3.44Å; M74-I78 VanDerWaalsContact O-N 3.09Å; Y75-I78 HydrophobicContact CD1-CD1 4.22Å; Y75-I78 PolarHBondContact O-N 2.99Å; I78-L81 PolarHBondContact O-N 3.03Å; I78-A82 WeakPolarHBondContact O-CB 3.19Å; I78-A82 PolarHBondContact O-N 3.4Å; I78-Y298 HydrophobicContact CG1-CE1 4.48Å; I78-Y298 HydrophobicContact CG2-CD2 3.89Å; I78-Y298 HydrophobicContact CG2-CE1 4.28Å; I78-Y298 HydrophobicContact CG2-CE2 3.66Å; I78-Y298 HydrophobicContact CG2-CG 4.33Å; I78-M305 HydrophobicContact CD1-CE 4.15Å; I78-M305 HydrophobicContact CG2-CE 4.02Å
79G86.3Confident81.2Confident11 Ų1136.4 Ų36.411%0.11318%0.177CC..Hα-helixtrans-62.6-43.6174.500000112.2L61 Y75 F76 F77 L81 A82 L83L61-G79 VanDerWaalsContact CD2-O 3.27Å; L61-G79 WeakPolarHBondContact CD2-O 3.17Å; Y75-G79 PolarHBondContact O-N 3.48Å; F76-G79 PolarHBondContact O-N 3.16Å; F77-G79 VanDerWaalsContact C-N 3.31Å; F77-G79 PolarHBondContact O-N 2.91Å; G79-L81 VanDerWaalsContact C-N 3.34Å; G79-L81 PolarHBondContact O-N 3.33Å; G79-A82 PolarHBondContact O-N 3.04Å; G79-L83 WeakPolarHBondContact O-CB 3.4Å; G79-L83 PolarHBondContact O-N 3.04Å
80N87.9Confident82.6Confident11 Ų1131.1 Ų31.16%0.05916%0.156CC..Hα-helixtrans-62.9-41.3175.2-168.263.7000111.9F76 F77 L83 C84 S128 I158 W162F76-N80 WeakPolarHBondContact O-CB 3.1Å; F76-N80 PolarHBondContact O-N 3.06Å; F77-N80 PolarHBondContact O-N 3.48Å; N80-L83 WeakPolarHBondContact O-CB 3.17Å; N80-L83 PolarHBondContact O-N 3.05Å; N80-C84 PolarHBondContact O-N 2.76Å; N80-C84 PolarHBondContact O-SG 3.49Å; N80-S128 PolarHBondContact ND2-OG 3.11Å; N80-I158 HydrophobicContact CB-CD1 4.15Å; N80-I158 HydrophobicContact CB-CG1 4.44Å; N80-I158 HydrophobicContact CB-CG2 4.46Å; N80-I158 VanDerWaalsContact OD1-CG2 3.31Å; N80-I158 WeakPolarHBondContact OD1-CG2 2.97Å; N80-W162 PolarHBondContact OD1-NE1 3.41Å
81L86Confident84Confident4 Ų431.2 Ų31.22%0.02116%0.159CC..Hα-helixtrans-63.4-45.4176.5-174.449.1000111.3F77 I78 G79 L83 C84 D85 S125 L129 Y298F77-L81 WeakPolarHBondContact O-CB 3.46Å; F77-L81 PolarHBondContact O-N 3.16Å; I78-L81 PolarHBondContact O-N 3.03Å; G79-L81 VanDerWaalsContact C-N 3.34Å; G79-L81 PolarHBondContact O-N 3.33Å; L81-L83 VanDerWaalsContact C-N 3.29Å; L81-L83 PolarHBondContact O-N 3.19Å; L81-C84 WeakPolarHBondContact O-CB 3.13Å; L81-C84 PolarHBondContact O-N 2.84Å; L81-D85 PolarHBondContact O-N 3.15Å; L81-S125 WeakPolarHBondContact CD1-OG 3.23Å; L81-L129 HydrophobicContact CD2-CD2 3.81Å; L81-Y298 WeakPolarHBondContact CD2-OH 3.33Å; L81-Y298 VanDerWaalsContact CG-OH 3.3Å; L81-Y298 WeakPolarHBondContact CG-OH 3.31Å
82A90Very high85.2Confident0 Ų027.8 Ų27.80%014%0.143CC..Hα-helixtrans-61-35.7173.300000112.7N57 V60 L61 I78 G79 L86N57-A82 WeakPolarHBondContact CB-O 2.85Å; V60-A82 HydrophobicContact CB-CB 4.16Å; V60-A82 HydrophobicContact CG1-CB 3.8Å; L61-A82 HydrophobicContact CD2-CB 4.14Å; L61-A82 HydrophobicContact CG-CB 4.13Å; I78-A82 WeakPolarHBondContact O-CB 3.19Å; I78-A82 PolarHBondContact O-N 3.4Å; G79-A82 PolarHBondContact O-N 3.04Å; A82-L86 VanDerWaalsContact O-CB 3.23Å; A82-L86 WeakPolarHBondContact O-CB 3.44Å; A82-L86 PolarHBondContact O-N 3.31Å
83L91.2Very high86.5Confident64 Ų6428 Ų2834%0.33514%0.14SC..Hα-helixtrans-66.1-44.3173.7178.862.8000111.8L61 G79 N80 L81 D85 L86 L87 W162L61-L83 HydrophobicContact CD1-CB 4.48Å; L61-L83 HydrophobicContact CD1-CD1 4.4Å; L61-L83 HydrophobicContact CD2-CB 4.42Å; G79-L83 WeakPolarHBondContact O-CB 3.4Å; G79-L83 PolarHBondContact O-N 3.04Å; N80-L83 WeakPolarHBondContact O-CB 3.17Å; N80-L83 PolarHBondContact O-N 3.05Å; L81-L83 VanDerWaalsContact C-N 3.29Å; L81-L83 PolarHBondContact O-N 3.19Å; L83-D85 VanDerWaalsContact C-N 3.34Å; L83-D85 PolarHBondContact O-N 2.95Å; L83-L86 PolarHBondContact O-N 2.97Å; L83-L87 HydrophobicContact CD1-CD1 4.05Å; L83-L87 HydrophobicContact CD1-CG 4.29Å; L83-L87 HydrophobicContact CG-CD1 4.06Å; L83-L87 WeakPolarHBondContact O-CB 3.42Å; L83-L87 VanDerWaalsContact O-CG 3.31Å; L83-L87 WeakPolarHBondContact O-CG 3.41Å; L83-L87 PolarHBondContact O-N 3.22Å; L83-W162 HydrophobicContact CD2-CZ2 4.19Å; L83-W162 HydrophobicContact CG-CZ2 4.37Å
84C90.9Very high87.7Confident1 Ų128.8 Ų28.81%0.00715%0.151CC..Hα-helixtrans-59.2-45.4175-65.60000111.3N80 L81 L87 A88 A124N80-C84 PolarHBondContact O-N 2.76Å; N80-C84 PolarHBondContact O-SG 3.49Å; L81-C84 WeakPolarHBondContact O-CB 3.13Å; L81-C84 PolarHBondContact O-N 2.84Å; C84-L87 PolarHBondContact O-N 2.86Å; C84-A88 WeakPolarHBondContact O-CB 3.31Å; C84-A88 PolarHBondContact O-N 2.92Å; C84-A124 VanDerWaalsContact SG-CB 3.55Å
85D91.7Very high88.7Confident2 Ų227 Ų271%0.01114%0.142CC..Hα-helixtrans-67.5-39.4179.5-72.4-35.8000112.7N57 L81 L83 A88 G89 S291 N294N57-D85 HydrophobicContact CB-CB 4.41Å; N57-D85 WeakPolarHBondContact OD1-CB 3.05Å; L81-D85 PolarHBondContact O-N 3.15Å; L83-D85 VanDerWaalsContact C-N 3.34Å; L83-D85 PolarHBondContact O-N 2.95Å; D85-A88 PolarHBondContact O-N 2.04Å; D85-G89 PolarHBondContact O-N 3.24Å; D85-S291 VanDerWaalsContact OD1-CB 3.3Å; D85-S291 WeakPolarHBondContact OD1-CB 3.31Å; D85-S291 PolarHBondContact OD1-OG 2.86Å; D85-N294 PolarHBondContact OD2-ND2 3.43Å
86L93.6Very high89.3Confident21 Ų2127 Ų2711%0.1114%0.144CC..Hα-helixtrans-58.3-49.2172.4176.768.7000110.7V54 N57 L58 L61 A82 L83 G89 I90V54-L86 HydrophobicContact CB-CD1 4.1Å; V54-L86 HydrophobicContact CG1-CD1 3.66Å; V54-L86 HydrophobicContact CG2-CD1 4.35Å; V54-L86 VanDerWaalsContact O-CD1 3.25Å; V54-L86 WeakPolarHBondContact O-CD1 3.4Å; N57-L86 HydrophobicContact CB-CB 4.09Å; L58-L86 HydrophobicContact CB-CD1 4.14Å; L61-L86 HydrophobicContact CD1-CD2 3.8Å; A82-L86 VanDerWaalsContact O-CB 3.23Å; A82-L86 WeakPolarHBondContact O-CB 3.44Å; A82-L86 PolarHBondContact O-N 3.31Å; L83-L86 PolarHBondContact O-N 2.97Å; L86-G89 PolarHBondContact O-N 2.96Å; L86-I90 HydrophobicContact CD1-CD1 4.42Å; L86-I90 HydrophobicContact CG-CD1 4.2Å; L86-I90 WeakPolarHBondContact O-CG1 3.25Å; L86-I90 PolarHBondContact O-N 3.47Å
87L92.5Very high89.7Confident74 Ų7428.7 Ų28.739%0.38715%0.154SC..Hα-helixtrans-67-37.2179.4-70.1169.4000111.7L83 C84 I90 A91 W162L83-L87 HydrophobicContact CD1-CD1 4.05Å; L83-L87 HydrophobicContact CD1-CG 4.29Å; L83-L87 HydrophobicContact CG-CD1 4.06Å; L83-L87 WeakPolarHBondContact O-CB 3.42Å; L83-L87 VanDerWaalsContact O-CG 3.31Å; L83-L87 WeakPolarHBondContact O-CG 3.41Å; L83-L87 PolarHBondContact O-N 3.22Å; C84-L87 PolarHBondContact O-N 2.86Å; L87-I90 PolarHBondContact O-N 3.2Å; L87-A91 VanDerWaalsContact O-CB 3.22Å; L87-A91 WeakPolarHBondContact O-CB 3.36Å; L87-A91 PolarHBondContact O-N 2.93Å; L87-W162 HydrophobicContact CD1-CH2 3.59Å; L87-W162 HydrophobicContact CD1-CZ2 4.43Å; L87-W162 HydrophobicContact CD1-CZ3 4.33Å
88A91.9Very high90.1Very high12 Ų1231.3 Ų31.310%0.09917%0.167CC..Hα-helixtrans-60.3-45.2172.200000111.6C84 D85 A91 Y92 A121C84-A88 WeakPolarHBondContact O-CB 3.31Å; C84-A88 PolarHBondContact O-N 2.92Å; D85-A88 PolarHBondContact O-N 2.04Å; A88-A91 PolarHBondContact O-N 3.46Å; A88-Y92 VanDerWaalsContact O-CB 3.31Å; A88-Y92 WeakPolarHBondContact O-CB 3.36Å; A88-Y92 PolarHBondContact O-N 3.35Å; A88-A121 HydrophobicContact CB-CB 3.82Å
89G93.1Very high90.3Very high0 Ų032 Ų320%017%0.174CC..Hα-helixtrans-62-42.4176.500000112.7D85 L86 K93D85-G89 PolarHBondContact O-N 3.24Å; L86-G89 PolarHBondContact O-N 2.96Å; G89-K93 VanDerWaalsContact O-CB 3.25Å; G89-K93 WeakPolarHBondContact O-CB 3.31Å; G89-K93 PolarHBondContact O-N 2.97Å
90I93.4Very high90.2Very high77 Ų7731.9 Ų31.940%0.39517%0.173SC..Hα-helixtrans-64.4-49.9174.6-67.3168.1000110.7V54 L86 L87 Y92 K93 V94V54-I90 HydrophobicContact CG2-CG1 3.86Å; L86-I90 HydrophobicContact CD1-CD1 4.42Å; L86-I90 HydrophobicContact CG-CD1 4.2Å; L86-I90 WeakPolarHBondContact O-CG1 3.25Å; L86-I90 PolarHBondContact O-N 3.47Å; L87-I90 PolarHBondContact O-N 3.2Å; I90-Y92 VanDerWaalsContact C-N 3.32Å; I90-Y92 PolarHBondContact O-N 3.4Å; I90-K93 WeakPolarHBondContact O-CB 3.41Å; I90-K93 PolarHBondContact O-N 2.79Å; I90-V94 HydrophobicContact CG2-CG2 4.48Å; I90-V94 WeakPolarHBondContact O-CG2 3.42Å; I90-V94 PolarHBondContact O-N 3.45Å
91A92.6Very high89.8Confident12 Ų1237.6 Ų37.610%0.09920%0.198CC..Hα-helixtrans-58-45179.500000111.4L87 A88 V94 N95 S117 M118L87-A91 VanDerWaalsContact O-CB 3.22Å; L87-A91 WeakPolarHBondContact O-CB 3.36Å; L87-A91 PolarHBondContact O-N 2.93Å; A88-A91 PolarHBondContact O-N 3.46Å; A91-V94 PolarHBondContact O-N 3.1Å; A91-N95 WeakPolarHBondContact O-CB 3.41Å; A91-N95 PolarHBondContact O-N 3.26Å; A91-S117 WeakPolarHBondContact CB-OG 3.37Å; A91-M118 HydrophobicContact CB-SD 3.6Å
92Y91.8Very high89.8Confident12 Ų1243.2 Ų43.25%0.04722%0.222CC..Hα-helixtrans-69.2-38.7179-165.4-126.1000112.4C50 A88 I90 N95 I96 M118 I284 V285 V288C50-Y92 WeakPolarHBondContact SG-CD1 3.15Å; A88-Y92 VanDerWaalsContact O-CB 3.31Å; A88-Y92 WeakPolarHBondContact O-CB 3.36Å; A88-Y92 PolarHBondContact O-N 3.35Å; I90-Y92 VanDerWaalsContact C-N 3.32Å; I90-Y92 PolarHBondContact O-N 3.4Å; Y92-N95 HydrophobicContact CD2-CB 4.46Å; Y92-N95 WeakPolarHBondContact O-CB 3.43Å; Y92-N95 PolarHBondContact O-N 2.96Å; Y92-I96 HydrophobicContact CD1-CD1 3.93Å; Y92-I96 HydrophobicContact CE1-CD1 3.69Å; Y92-I96 HydrophobicContact CE1-CG1 4.39Å; Y92-I96 WeakPolarHBondContact O-CG1 3.44Å; Y92-I96 PolarHBondContact O-N 3.41Å; Y92-M118 HydrophobicContact CD2-CE 3.78Å; Y92-M118 HydrophobicContact CD2-SD 4.3Å; Y92-M118 HydrophobicContact CG-CE 4.07Å; Y92-M118 PolarHBondContact N-SD 2.91Å; Y92-I284 HydrophobicContact CD2-CG2 4.17Å; Y92-I284 HydrophobicContact CE2-CG2 3.39Å; Y92-V285 HydrophobicContact CE1-CG2 4.08Å; Y92-V285 WeakPolarHBondContact OH-CG2 3.41Å; Y92-V288 HydrophobicContact CD1-CB 4.17Å; Y92-V288 HydrophobicContact CD1-CG1 3.76Å; Y92-V288 HydrophobicContact CD1-CG2 3.76Å; Y92-V288 HydrophobicContact CD2-CG2 4.13Å; Y92-V288 HydrophobicContact CE1-CB 4.38Å; Y92-V288 HydrophobicContact CE1-CG1 4.32Å; Y92-V288 HydrophobicContact CE1-CG2 4.08Å; Y92-V288 HydrophobicContact CE2-CG2 4.43Å; Y92-V288 HydrophobicContact CG-CG1 4.37Å; Y92-V288 HydrophobicContact CG-CG2 3.82Å
93K91.9Very high89.6Confident80 Ų8043.2 Ų43.235%0.34822%0.222SC..Hα-helixtrans-58.9-47.7172.1-175.5175.1177.4171.10111.5L47 C50 G89 I90 N95 I96 L97L47-K93 HydrophobicContact CD2-CG 3.97Å; C50-K93 HydrophobicContact CB-CB 3.91Å; C50-K93 HydrophobicContact CB-CG 4.46Å; G89-K93 VanDerWaalsContact O-CB 3.25Å; G89-K93 WeakPolarHBondContact O-CB 3.31Å; G89-K93 PolarHBondContact O-N 2.97Å; I90-K93 WeakPolarHBondContact O-CB 3.41Å; I90-K93 PolarHBondContact O-N 2.79Å; K93-N95 VanDerWaalsContact C-N 3.3Å; K93-N95 PolarHBondContact O-N 3Å; K93-I96 PolarHBondContact O-N 2.89Å; K93-L97 HydrophobicContact CG-CD1 4.16Å; K93-L97 WeakPolarHBondContact O-CG 3.42Å; K93-L97 PolarHBondContact O-N 3.36Å
94V91.8Very high89.4Confident69 Ų6940.9 Ų40.942%0.41821%0.209SC..Hα-helixtrans-61.3-41.4175.2171.80000110.5I90 A91 I96 L97 M98I90-V94 HydrophobicContact CG2-CG2 4.48Å; I90-V94 WeakPolarHBondContact O-CG2 3.42Å; I90-V94 PolarHBondContact O-N 3.45Å; A91-V94 PolarHBondContact O-N 3.1Å; V94-I96 VanDerWaalsContact C-N 3.34Å; V94-I96 PolarHBondContact O-N 3.26Å; V94-L97 PolarHBondContact O-N 2.91Å; V94-M98 HydrophobicContact CG1-CG 4.08Å; V94-M98 VanDerWaalsContact O-CB 3.29Å; V94-M98 WeakPolarHBondContact O-CB 3.22Å; V94-M98 VanDerWaalsContact O-CG 3.28Å; V94-M98 WeakPolarHBondContact O-CG 3.39Å; V94-M98 PolarHBondContact O-N 2.85Å
95N90.5Very high89.2Confident17 Ų1744.6 Ų44.69%0.09124%0.235CC..Hα-helixtrans-57.6-46.5177.3-168.415.5000111.9A91 Y92 K93 M98 S99 R114 E115A91-N95 WeakPolarHBondContact O-CB 3.41Å; A91-N95 PolarHBondContact O-N 3.26Å; Y92-N95 HydrophobicContact CD2-CB 4.46Å; Y92-N95 WeakPolarHBondContact O-CB 3.43Å; Y92-N95 PolarHBondContact O-N 2.96Å; K93-N95 VanDerWaalsContact C-N 3.3Å; K93-N95 PolarHBondContact O-N 3Å; N95-M98 PolarHBondContact O-N 3.38Å; N95-S99 WeakPolarHBondContact O-CB 3.1Å; N95-S99 PolarHBondContact O-N 3.27Å; N95-S99 VanDerWaalsContact O-N 3.12Å; N95-R114 HydrophobicContact CB-CG 4.24Å; N95-R114 WeakPolarHBondContact OD1-CD 2.99Å; N95-R114 PolarHBondContact OD1-NE 2.96Å; N95-E115 PolarHBondContact OD1-OE1 3.36Å
96I88.9Confident89Confident23 Ų2345.1 Ų45.112%0.11824%0.238CC..Hα-helixtrans-63.2-47.9177.3-66164000111.2T43 F46 L47 Y92 K93 V94 M98 S99T43-I96 HydrophobicContact CG2-CG2 3.66Å; F46-I96 HydrophobicContact CB-CD1 3.65Å; L47-I96 HydrophobicContact CD1-CG2 4.47Å; L47-I96 HydrophobicContact CD2-CB 4.04Å; L47-I96 HydrophobicContact CD2-CD1 4.44Å; L47-I96 HydrophobicContact CD2-CG2 3.77Å; L47-I96 HydrophobicContact CG-CG2 3.92Å; Y92-I96 HydrophobicContact CD1-CD1 3.93Å; Y92-I96 HydrophobicContact CE1-CD1 3.69Å; Y92-I96 HydrophobicContact CE1-CG1 4.39Å; Y92-I96 WeakPolarHBondContact O-CG1 3.44Å; Y92-I96 PolarHBondContact O-N 3.41Å; K93-I96 PolarHBondContact O-N 2.89Å; V94-I96 VanDerWaalsContact C-N 3.34Å; V94-I96 PolarHBondContact O-N 3.26Å; I96-M98 PolarHBondContact O-N 3.37Å; I96-S99 VanDerWaalsContact O-CB 3.27Å; I96-S99 WeakPolarHBondContact O-CB 3.06Å; I96-S99 PolarHBondContact O-N 2.9Å; I96-S99 VanDerWaalsContact O-N 3.13Å
97L88.8Confident88.9Confident88 Ų8846.6 Ų46.646%0.46125%0.25SS..Hα-helixtrans-65.4-27.4-178.2-69.3173.7000113.5L47 K93 V94L47-L97 HydrophobicContact CD1-CD2 4.04Å; L47-L97 HydrophobicContact CD2-CD2 3.99Å; L47-L97 HydrophobicContact CD2-CG 4Å; K93-L97 HydrophobicContact CG-CD1 4.16Å; K93-L97 WeakPolarHBondContact O-CG 3.42Å; K93-L97 PolarHBondContact O-N 3.36Å; V94-L97 PolarHBondContact O-N 2.91Å
98M86.9Confident88.8Confident58 Ų5844.4 Ų44.429%0.28624%0.24SC..THydrogen-bonded Turntrans-96.66.9178.3-64.2-63.6-71.300113V94 N95 I96 T103 L106 R114V94-M98 HydrophobicContact CG1-CG 4.08Å; V94-M98 VanDerWaalsContact O-CB 3.29Å; V94-M98 WeakPolarHBondContact O-CB 3.22Å; V94-M98 VanDerWaalsContact O-CG 3.28Å; V94-M98 WeakPolarHBondContact O-CG 3.39Å; V94-M98 PolarHBondContact O-N 2.85Å; N95-M98 PolarHBondContact O-N 3.38Å; I96-M98 PolarHBondContact O-N 3.37Å; M98-T103 PolarHBondContact O-N 3.46Å; M98-T103 PolarHBondContact O-OG1 2.82Å; M98-L106 HydrophobicContact CE-CD1 4.27Å; M98-L106 HydrophobicContact CE-CD2 3.22Å; M98-L106 HydrophobicContact CE-CG 4.15Å; M98-R114 PolarHBondContact O-NH1 2.73Å
99S85.1Confident88.8Confident35 Ų3548.1 Ų48.125%0.24526%0.262CS..  trans-81-178.6178.8-153.80000112.5N95 I96 T103N95-S99 WeakPolarHBondContact O-CB 3.1Å; N95-S99 PolarHBondContact O-N 3.27Å; N95-S99 VanDerWaalsContact O-N 3.12Å; I96-S99 VanDerWaalsContact O-CB 3.27Å; I96-S99 WeakPolarHBondContact O-CB 3.06Å; I96-S99 PolarHBondContact O-N 2.9Å; I96-S99 VanDerWaalsContact O-N 3.13Å; S99-T103 WeakPolarHBondContact CA-OG1 3.31Å
100G83.6Confident88.7Confident10 Ų1051.3 Ų51.310%0.10328%0.281CS..G310 helixtrans64.3-137.6-179.900000112.9K102 T103G100-K102 PolarHBondContact O-N 3.34Å; G100-T103 VanDerWaalsContact O-CB 3.29Å; G100-T103 WeakPolarHBondContact O-CB 3.44Å; G100-T103 PolarHBondContact O-N 3.48Å; G100-T103 PolarHBondContact O-OG1 2.93Å
101K80.8Confident88.7Confident131 Ų13147.7 Ų47.757%0.5726%0.262SS*.G310 helixtrans-56.2-34.8-177.6-69.1176.2-176.7175.70113.1L32 A35 T103 F104L32-K101 HydrophobicContact CD2-CG 4.33Å; A35-K101 HydrophobicContact CB-CD 4.02Å; A35-K101 HydrophobicContact CB-CG 3.73Å; K101-T103 PolarHBondContact O-N 3.26Å; K101-F104 PolarHBondContact O-N 3.37Å
102K85.1Confident88.8Confident121 Ų12147.4 Ų47.453%0.52626%0.259SS..G310 helixtrans-66.5-19.1178.8-65.9-175.6-176.9177.10113.4G100 F104 S105 L106G100-K102 PolarHBondContact O-N 3.34Å; K102-F104 PolarHBondContact O-N 3.12Å; K102-S105 PolarHBondContact O-N 2.88Å; K102-S105 PolarHBondContact O-OG 3.04Å; K102-L106 WeakPolarHBondContact O-CG 3.47Å
103T86.4Confident88.9Confident1 Ų152.3 Ų52.31%0.00629%0.285CS..G310 helixtrans-62.6-36.4176.6-59.80000110.9L18 Y22 M98 S99 G100 K101 S105 L106 R114L18-T103 HydrophobicContact CD2-CG2 4.42Å; L18-T103 WeakPolarHBondContact CD2-O 3.41Å; Y22-T103 HydrophobicContact CE2-CG2 4.3Å; M98-T103 PolarHBondContact O-N 3.46Å; M98-T103 PolarHBondContact O-OG1 2.82Å; S99-T103 WeakPolarHBondContact CA-OG1 3.31Å; G100-T103 VanDerWaalsContact O-CB 3.29Å; G100-T103 WeakPolarHBondContact O-CB 3.44Å; G100-T103 PolarHBondContact O-N 3.48Å; G100-T103 PolarHBondContact O-OG1 2.93Å; K101-T103 PolarHBondContact O-N 3.26Å; T103-S105 VanDerWaalsContact C-N 3.31Å; T103-S105 PolarHBondContact O-N 3.28Å; T103-L106 WeakPolarHBondContact O-CB 3.3Å; T103-L106 PolarHBondContact O-N 2.99Å; T103-R114 PolarHBondContact OG1-NH1 3.22Å
104F86.6Confident88.9Confident14 Ų1449.2 Ų49.26%0.06127%0.271CS..G310 helixtrans-83.7-4.6-176.1-53.9-69.2000113.9N15 L18 Y22 L28 R31 L32 K101 K102N15-F104 WeakPolarHBondContact CB-O 3.22Å; N15-F104 VanDerWaalsContact CG-O 3.25Å; N15-F104 PolarHBondContact OD1-O 3.21Å; L18-F104 HydrophobicContact CB-CD1 4.49Å; Y22-F104 HydrophobicContact CD1-CE1 4.18Å; Y22-F104 HydrophobicContact CD1-CZ 4.21Å; Y22-F104 HydrophobicContact CD2-CE1 4.27Å; Y22-F104 AromaticContact CG-CE1 3.86Å; Y22-F104 HydrophobicContact CG-CE1 3.86Å; Y22-F104 HydrophobicContact CG-CZ 4.33Å; L28-F104 HydrophobicContact CD1-CD1 4.41Å; L28-F104 HydrophobicContact CD1-CE1 3.61Å; L28-F104 HydrophobicContact CD1-CE2 4.05Å; L28-F104 HydrophobicContact CD1-CZ 3.39Å; R31-F104 HydrophobicContact CB-CE2 4.27Å; R31-F104 HydrophobicContact CB-CZ 4.18Å; L32-F104 HydrophobicContact CD2-CE2 4.4Å; L32-F104 HydrophobicContact CG-CE2 4.37Å; K101-F104 PolarHBondContact O-N 3.37Å; K102-F104 PolarHBondContact O-N 3.12Å
105S87.1Confident88.9Confident80 Ų8047.2 Ų47.256%0.55926%0.258SS*.G310 helixtrans-94.70.9169.656.50000112.8K102 T103K102-S105 PolarHBondContact O-N 2.88Å; K102-S105 PolarHBondContact O-OG 3.04Å; T103-S105 VanDerWaalsContact C-N 3.31Å; T103-S105 PolarHBondContact O-N 3.28Å
106L87.8Confident89Confident13 Ų1346.7 Ų46.77%0.06826%0.256CS..SBendtrans-86.9144.6179.6-65.5174.6000111.3L18 M98 K102 T103 V110L18-L106 HydrophobicContact CD2-CB 4.36Å; M98-L106 HydrophobicContact CE-CD1 4.27Å; M98-L106 HydrophobicContact CE-CD2 3.22Å; M98-L106 HydrophobicContact CE-CG 4.15Å; K102-L106 WeakPolarHBondContact O-CG 3.47Å; T103-L106 WeakPolarHBondContact O-CB 3.3Å; T103-L106 PolarHBondContact O-N 2.99Å; L106-V110 HydrophobicContact CD2-CB 4.33Å; L106-V110 HydrophobicContact CD2-CG1 3.58Å; L106-V110 HydrophobicContact CG-CG1 4.45Å
107S90.6Very high89.2Confident52 Ų5247.3 Ų47.336%0.36426%0.262SS..  trans-70.2153163.669.20000110.5T109 V110 W111S107-T109 PolarHBondContact O-N 3.06Å; S107-V110 PolarHBondContact O-N 3.29Å; S107-V110 VanDerWaalsContact O-N 3.12Å; S107-V110 WeakPolarHBondContact OG-CG2 3.21Å; S107-V110 PolarHBondContact OG-N 3.5Å; S107-W111 PolarHBondContact O-N 3.45Å
108P90.8Very high89.2Confident27 Ų2744.6 Ų44.618%0.17525%0.247CC..Hα-helixtrans-52.6-39.1175.3-27.934.5000113.2L18 W111 F112 L191L18-P108 HydrophobicContact CD1-CB 4.31Å; L18-P108 HydrophobicContact CD1-CG 3.82Å; P108-W111 WeakPolarHBondContact O-CB 3.27Å; P108-W111 PolarHBondContact O-N 3.45Å; P108-F112 HydrophobicContact CB-CE2 4.42Å; P108-F112 WeakPolarHBondContact O-CD2 3.33Å; P108-F112 PolarHBondContact O-N 3.12Å; P108-L191 HydrophobicContact CB-CD2 4.35Å
109T91.1Very high89.4Confident90 Ų9043 Ų4355%0.55224%0.239SC*.Hα-helixtrans-62.6-45.2178-46.20000112.4S107 W111 F112 L113S107-T109 PolarHBondContact O-N 3.06Å; T109-W111 VanDerWaalsContact C-N 3.3Å; T109-W111 PolarHBondContact O-N 2.86Å; T109-F112 PolarHBondContact O-N 3.06Å; T109-L113 WeakPolarHBondContact O-CB 3.47Å; T109-L113 PolarHBondContact O-N 3.28Å
110V92.2Very high89.8Confident67 Ų6742 Ų4241%0.40623%0.232SC..Hα-helixtrans-67.1-36177.3174.70000110.5L106 S107 L113 R114L106-V110 HydrophobicContact CD2-CB 4.33Å; L106-V110 HydrophobicContact CD2-CG1 3.58Å; L106-V110 HydrophobicContact CG-CG1 4.45Å; S107-V110 PolarHBondContact O-N 3.29Å; S107-V110 VanDerWaalsContact O-N 3.12Å; S107-V110 WeakPolarHBondContact OG-CG2 3.21Å; S107-V110 PolarHBondContact OG-N 3.5Å; V110-L113 PolarHBondContact O-N 3.28Å; V110-R114 WeakPolarHBondContact O-CB 3.32Å; V110-R114 PolarHBondContact O-N 3.22Å
111W93.3Very high90.1Very high1 Ų142 Ų420%0.00423%0.23CC..Hα-helixtrans-62.5-46.2174.1-171.9101.3000111.8L18 Y22 S107 P108 T109 L113 R114 E115 L189 L191 Y192L18-W111 HydrophobicContact CD2-CB 4.29Å; L18-W111 HydrophobicContact CD2-CG 4.18Å; Y22-W111 AromaticContact CE2-NE1 3.83Å; Y22-W111 AromaticContact CZ-NE1 3.89Å; Y22-W111 PolarHBondContact OH-NE1 3.01Å; S107-W111 PolarHBondContact O-N 3.45Å; P108-W111 WeakPolarHBondContact O-CB 3.27Å; P108-W111 PolarHBondContact O-N 3.45Å; T109-W111 VanDerWaalsContact C-N 3.3Å; T109-W111 PolarHBondContact O-N 2.86Å; W111-L113 VanDerWaalsContact C-N 3.35Å; W111-L113 PolarHBondContact O-N 3.17Å; W111-R114 WeakPolarHBondContact O-CB 3.3Å; W111-R114 PolarHBondContact O-N 2.91Å; W111-E115 HydrophobicContact CD2-CG 4.21Å; W111-E115 HydrophobicContact CE3-CG 4.21Å; W111-E115 HydrophobicContact CH2-CB 4.46Å; W111-E115 HydrophobicContact CH2-CG 3.74Å; W111-E115 HydrophobicContact CZ2-CG 3.75Å; W111-E115 HydrophobicContact CZ3-CB 4.4Å; W111-E115 HydrophobicContact CZ3-CG 3.98Å; W111-E115 PolarHBondContact O-N 3.42Å; W111-L189 HydrophobicContact CH2-CB 4.17Å; W111-L189 HydrophobicContact CH2-CD2 4.32Å; W111-L191 HydrophobicContact CD2-CD1 4.44Å; W111-L191 HydrophobicContact CD2-CD2 3.97Å; W111-L191 HydrophobicContact CE3-CB 3.89Å; W111-L191 HydrophobicContact CE3-CD2 3.73Å; W111-L191 HydrophobicContact CE3-CG 4.27Å; W111-L191 HydrophobicContact CG-CD2 4.35Å; W111-L191 HydrophobicContact CH2-CB 3.93Å; W111-L191 HydrophobicContact CZ2-CD1 4.39Å; W111-L191 HydrophobicContact CZ3-CB 3.52Å; W111-L191 HydrophobicContact CZ3-CD2 4.26Å; W111-L191 HydrophobicContact CZ3-CG 4.33Å; W111-Y192 HydrophobicContact CE3-CE2 4.46Å; W111-Y192 AromaticContact CH2-CD2 3.66Å; W111-Y192 HydrophobicContact CH2-CD2 3.66Å; W111-Y192 AromaticContact CH2-CE2 3.93Å; W111-Y192 HydrophobicContact CH2-CE2 3.93Å; W111-Y192 AromaticContact CZ3-CD2 3.46Å; W111-Y192 HydrophobicContact CZ3-CD2 3.46Å; W111-Y192 VanDerWaalsContact CZ3-CD2 3.46Å; W111-Y192 AromaticContact CZ3-CE2 3.43Å; W111-Y192 HydrophobicContact CZ3-CE2 3.43Å; W111-Y192 VanDerWaalsContact CZ3-CE2 3.43Å
112F94.5Very high90.5Very high7 Ų736.3 Ų36.33%0.03121%0.206CC..Hα-helixtrans-65-37.4175.2-74.6-62.3000112.4P108 T109 R114 G116 P172 I173 N177 L179 L191 Y192P108-F112 HydrophobicContact CB-CE2 4.42Å; P108-F112 WeakPolarHBondContact O-CD2 3.33Å; P108-F112 PolarHBondContact O-N 3.12Å; T109-F112 PolarHBondContact O-N 3.06Å; F112-R114 VanDerWaalsContact C-N 3.33Å; F112-G116 VanDerWaalsContact O-CA 3.24Å; F112-G116 WeakPolarHBondContact O-CA 3.17Å; F112-G116 PolarHBondContact O-N 3.49Å; F112-P172 HydrophobicContact CD1-CB 3.97Å; F112-P172 HydrophobicContact CE1-CB 4.03Å; F112-I173 HydrophobicContact CB-CD1 4.11Å; F112-I173 HydrophobicContact CB-CG1 3.54Å; F112-I173 HydrophobicContact CG-CG1 4.16Å; F112-N177 HydrophobicContact CE1-CB 4Å; F112-N177 HydrophobicContact CZ-CB 3.6Å; F112-L179 HydrophobicContact CE2-CD1 4.2Å; F112-L179 HydrophobicContact CZ-CD1 4.5Å; F112-L179 HydrophobicContact CZ-CG 4.45Å; F112-L191 HydrophobicContact CE1-CB 3.85Å; F112-L191 HydrophobicContact CE2-CD2 4.28Å; F112-L191 HydrophobicContact CZ-CB 3.76Å; F112-L191 HydrophobicContact CZ-CD2 4.15Å; F112-Y192 HydrophobicContact CD1-CD2 4.3Å; F112-Y192 AromaticContact CD1-CE2 3.75Å; F112-Y192 HydrophobicContact CD1-CE2 3.75Å; F112-Y192 HydrophobicContact CE1-CD2 4.16Å; F112-Y192 HydrophobicContact CE1-CE2 4.08Å
113L93.7Very high90.8Very high114 Ų11430.6 Ų30.660%0.59718%0.182SC*.Hα-helixtrans-64.1-40.9175.6-173.964.3000111.2T109 V110 W111 S117T109-L113 WeakPolarHBondContact O-CB 3.47Å; T109-L113 PolarHBondContact O-N 3.28Å; V110-L113 PolarHBondContact O-N 3.28Å; W111-L113 VanDerWaalsContact C-N 3.35Å; W111-L113 PolarHBondContact O-N 3.17Å; L113-S117 VanDerWaalsContact O-CB 3.25Å; L113-S117 WeakPolarHBondContact O-CB 3.42Å; L113-S117 PolarHBondContact O-N 3.4Å; L113-S117 PolarHBondContact O-OG 3.19Å
114R92.2Very high91Very high16 Ų1630.6 Ų30.66%0.0618%0.181CC..Hα-helixtrans-59.7-56.2176.8-175-172.982.5-177.64.5111.3N95 M98 T103 V110 W111 F112 S117N95-R114 HydrophobicContact CB-CG 4.24Å; N95-R114 WeakPolarHBondContact OD1-CD 2.99Å; N95-R114 PolarHBondContact OD1-NE 2.96Å; M98-R114 PolarHBondContact O-NH1 2.73Å; T103-R114 PolarHBondContact OG1-NH1 3.22Å; V110-R114 WeakPolarHBondContact O-CB 3.32Å; V110-R114 PolarHBondContact O-N 3.22Å; W111-R114 WeakPolarHBondContact O-CB 3.3Å; W111-R114 PolarHBondContact O-N 2.91Å; F112-R114 VanDerWaalsContact C-N 3.33Å; R114-S117 PolarHBondContact O-OG 2.92Å
115E91.6Very high91Very high27 Ų2730.2 Ų30.213%0.12618%0.181CC..Hα-helixtrans-72.4-40.2-178.9-59.6-56.1150.300112N95 W111 S117 M118 F119 L189 Y192N95-E115 PolarHBondContact OD1-OE1 3.36Å; W111-E115 HydrophobicContact CD2-CG 4.21Å; W111-E115 HydrophobicContact CE3-CG 4.21Å; W111-E115 HydrophobicContact CH2-CB 4.46Å; W111-E115 HydrophobicContact CH2-CG 3.74Å; W111-E115 HydrophobicContact CZ2-CG 3.75Å; W111-E115 HydrophobicContact CZ3-CB 4.4Å; W111-E115 HydrophobicContact CZ3-CG 3.98Å; W111-E115 PolarHBondContact O-N 3.42Å; E115-S117 VanDerWaalsContact C-N 3.29Å; E115-S117 PolarHBondContact O-N 3.34Å; E115-M118 WeakPolarHBondContact O-CB 3.08Å; E115-M118 PolarHBondContact O-N 3.11Å; E115-M118 VanDerWaalsContact O-N 3.12Å; E115-F119 PolarHBondContact O-N 2.48Å; E115-L189 HydrophobicContact CB-CD2 3.79Å; E115-L189 HydrophobicContact CG-CD2 3.95Å; E115-Y192 HydrophobicContact CB-CE2 3.97Å
116G92.8Very high91.1Very high5 Ų526.4 Ų26.45%0.05215%0.154CC..Hα-helixtrans-61.7-34.3178.400000112.9F112 M118 F119 V120 Y192F112-G116 VanDerWaalsContact O-CA 3.24Å; F112-G116 WeakPolarHBondContact O-CA 3.17Å; F112-G116 PolarHBondContact O-N 3.49Å; G116-M118 PolarHBondContact O-N 3.28Å; G116-F119 WeakPolarHBondContact O-CB 3.38Å; G116-F119 PolarHBondContact O-N 2.96Å; G116-V120 WeakPolarHBondContact O-CG2 3.06Å; G116-V120 PolarHBondContact O-N 3.09Å; G116-Y192 WeakPolarHBondContact CA-OH 3.24Å; G116-Y192 PolarHBondContact N-OH 3.05Å
117S92.4Very high91.1Very high37 Ų3726.4 Ų26.426%0.25916%0.155SC..Hα-helixtrans-59.2-34175.169.90000113.1A91 L113 R114 E115 V120 A121A91-S117 WeakPolarHBondContact CB-OG 3.37Å; L113-S117 VanDerWaalsContact O-CB 3.25Å; L113-S117 WeakPolarHBondContact O-CB 3.42Å; L113-S117 PolarHBondContact O-N 3.4Å; L113-S117 PolarHBondContact O-OG 3.19Å; R114-S117 PolarHBondContact O-OG 2.92Å; E115-S117 VanDerWaalsContact C-N 3.29Å; E115-S117 PolarHBondContact O-N 3.34Å; S117-V120 PolarHBondContact O-N 3Å; S117-A121 WeakPolarHBondContact O-CB 3.42Å; S117-A121 PolarHBondContact O-N 3.03Å
118M88.8Confident90.8Very high30 Ų3024 Ų2415%0.14814%0.138CC..Hα-helixtrans-69-39.2174.4-62.6-63.4-63.800111.6A91 Y92 E115 G116 A121 L122 V288A91-M118 HydrophobicContact CB-SD 3.6Å; Y92-M118 HydrophobicContact CD2-CE 3.78Å; Y92-M118 HydrophobicContact CD2-SD 4.3Å; Y92-M118 HydrophobicContact CG-CE 4.07Å; Y92-M118 PolarHBondContact N-SD 2.91Å; E115-M118 WeakPolarHBondContact O-CB 3.08Å; E115-M118 PolarHBondContact O-N 3.11Å; E115-M118 VanDerWaalsContact O-N 3.12Å; G116-M118 PolarHBondContact O-N 3.28Å; M118-A121 PolarHBondContact O-N 2.94Å; M118-L122 WeakPolarHBondContact O-CB 3.28Å; M118-L122 PolarHBondContact O-N 3.25Å; M118-V288 HydrophobicContact CE-CG2 3.95Å
119F90.4Very high90.4Very high25 Ų2523.4 Ų23.411%0.1113%0.133CC..Hα-helixtrans-65.9-40.6174.3-82.8-93.2000112.2E115 G116 L122 G123 L189 Y192 C200 F204E115-F119 PolarHBondContact O-N 2.48Å; G116-F119 WeakPolarHBondContact O-CB 3.38Å; G116-F119 PolarHBondContact O-N 2.96Å; F119-L122 PolarHBondContact O-N 2.96Å; F119-G123 PolarHBondContact O-N 2.04Å; F119-L189 HydrophobicContact CE2-CD1 4.3Å; F119-L189 HydrophobicContact CE2-CD2 4.07Å; F119-L189 HydrophobicContact CZ-CD1 4.29Å; F119-Y192 HydrophobicContact CD2-CE1 4.48Å; F119-Y192 HydrophobicContact CE2-CE1 4.2Å; F119-C200 HydrophobicContact CE1-CB 4.31Å; F119-F204 HydrophobicContact CD1-CE2 4.43Å
120V93.3Very high90.2Very high15 Ų1520.7 Ų20.79%0.09112%0.115CC..Hα-helixtrans-61.8-46.5174.8175.10000110.2G116 S117 L122 G123 A124 W162 A165 F166G116-V120 WeakPolarHBondContact O-CG2 3.06Å; G116-V120 PolarHBondContact O-N 3.09Å; S117-V120 PolarHBondContact O-N 3Å; V120-L122 PolarHBondContact O-N 3.45Å; V120-G123 PolarHBondContact O-N 2.98Å; V120-A124 WeakPolarHBondContact O-CB 3.32Å; V120-A124 PolarHBondContact O-N 2.93Å; V120-W162 HydrophobicContact CG1-CZ3 4.3Å; V120-A165 HydrophobicContact CG1-CB 4.22Å; V120-F166 HydrophobicContact CG1-CD1 3.9Å; V120-F166 HydrophobicContact CG1-CE1 3.89Å; V120-F166 HydrophobicContact CG1-CG 4.23Å; V120-F166 HydrophobicContact CG1-CZ 4.2Å; V120-F166 HydrophobicContact CG2-CD1 4.1Å
121A90.6Very high89.8Confident9 Ų917.9 Ų17.97%0.07410%0.099CC..Hα-helixtrans-62.4-44.8179.300000112.2A88 S117 M118 S125A88-A121 HydrophobicContact CB-CB 3.82Å; S117-A121 WeakPolarHBondContact O-CB 3.42Å; S117-A121 PolarHBondContact O-N 3.03Å; M118-A121 PolarHBondContact O-N 2.94Å; A121-S125 WeakPolarHBondContact O-CB 3.42Å; A121-S125 PolarHBondContact O-N 2.89Å
122L89.5Confident89.1Confident12 Ų1219 Ų196%0.06311%0.105CC..Hα-helixtrans-58.6-47.7172.9168.260.6000111.5M118 F119 V120 S125 T126 F204 F252 W256 F260M118-L122 WeakPolarHBondContact O-CB 3.28Å; M118-L122 PolarHBondContact O-N 3.25Å; F119-L122 PolarHBondContact O-N 2.96Å; V120-L122 PolarHBondContact O-N 3.45Å; L122-S125 PolarHBondContact O-N 3Å; L122-T126 WeakPolarHBondContact CD1-OG1 3.47Å; L122-T126 WeakPolarHBondContact O-CB 3.44Å; L122-T126 PolarHBondContact O-N 3.37Å; L122-T126 PolarHBondContact O-OG1 2.96Å; L122-F204 HydrophobicContact CD2-CD2 3.74Å; L122-F204 HydrophobicContact CD2-CE2 3.48Å; L122-F204 VanDerWaalsContact CD2-CE2 3.48Å; L122-F204 HydrophobicContact CD2-CG 4.49Å; L122-F204 HydrophobicContact CD2-CZ 4.07Å; L122-F204 HydrophobicContact CG-CD2 4.31Å; L122-F204 HydrophobicContact CG-CE1 4.43Å; L122-F204 HydrophobicContact CG-CE2 3.95Å; L122-F204 HydrophobicContact CG-CZ 4.02Å; L122-F252 HydrophobicContact CD1-CZ 3.99Å; L122-W256 HydrophobicContact CB-CH2 3.93Å; L122-W256 HydrophobicContact CB-CZ2 4.46Å; L122-W256 HydrophobicContact CB-CZ3 4.34Å; L122-W256 HydrophobicContact CD1-CD2 3.86Å; L122-W256 HydrophobicContact CD1-CE3 3.79Å; L122-W256 HydrophobicContact CD1-CH2 3.65Å; L122-W256 HydrophobicContact CD1-CZ2 3.71Å; L122-W256 HydrophobicContact CD1-CZ3 3.69Å; L122-W256 HydrophobicContact CD2-CE3 4.15Å; L122-W256 HydrophobicContact CD2-CH2 4.14Å; L122-W256 HydrophobicContact CD2-CZ3 3.68Å; L122-W256 HydrophobicContact CG-CH2 4.1Å; L122-W256 HydrophobicContact CG-CZ3 4.09Å; L122-F260 HydrophobicContact CD2-CE1 4.06Å; L122-F260 HydrophobicContact CD2-CZ 4.31Å
123G91.2Very high88.4Confident1 Ų118.7 Ų18.71%0.0110%0.104CC..Hα-helixtrans-63-46.9-178.900000112.2F119 V120 S125 T126 C127F119-G123 PolarHBondContact O-N 2.04Å; V120-G123 PolarHBondContact O-N 2.98Å; G123-S125 PolarHBondContact O-N 3.17Å; G123-T126 PolarHBondContact O-N 2.86Å; G123-C127 VanDerWaalsContact O-CB 3.28Å; G123-C127 WeakPolarHBondContact O-CB 3.39Å; G123-C127 PolarHBondContact O-N 3.14Å; G123-C127 PolarHBondContact O-SG 3.06Å
124A90.3Very high87.8Confident0 Ų016.6 Ų16.60%09%0.092CC..Hα-helixtrans-62.4-42.6178.100000111.4C84 V120 S128 W162 A165C84-A124 VanDerWaalsContact SG-CB 3.55Å; V120-A124 WeakPolarHBondContact O-CB 3.32Å; V120-A124 PolarHBondContact O-N 2.93Å; A124-S128 VanDerWaalsContact O-CB 3.24Å; A124-S128 WeakPolarHBondContact O-CB 3.13Å; A124-S128 PolarHBondContact O-N 2.92Å; A124-S128 PolarHBondContact O-OG 3.46Å; A124-W162 HydrophobicContact CB-CD2 4.2Å; A124-W162 HydrophobicContact CB-CE3 4.11Å; A124-W162 HydrophobicContact CB-CH2 4.2Å; A124-W162 HydrophobicContact CB-CZ2 4.3Å; A124-W162 HydrophobicContact CB-CZ3 4.12Å; A124-A165 HydrophobicContact CB-CB 4Å
125S87.9Confident87.1Confident6 Ų617.3 Ų17.34%0.04210%0.096CC..Hα-helixtrans-63.4-49.3176.1-176.70000112L81 A121 L122 G123 C127 S128 L129L81-S125 WeakPolarHBondContact CD1-OG 3.23Å; A121-S125 WeakPolarHBondContact O-CB 3.42Å; A121-S125 PolarHBondContact O-N 2.89Å; L122-S125 PolarHBondContact O-N 3Å; G123-S125 PolarHBondContact O-N 3.17Å; S125-C127 PolarHBondContact O-N 2.94Å; S125-S128 WeakPolarHBondContact O-CB 3.37Å; S125-S128 PolarHBondContact O-N 3.39Å; S125-S128 VanDerWaalsContact O-N 3.17Å; S125-L129 WeakPolarHBondContact O-CG 3.35Å; S125-L129 PolarHBondContact O-N 3.27Å
126T87.8Confident86.3Confident0 Ų018.5 Ų18.50%010%0.1CC..Hα-helixtrans-63.8-45.2-178.9-54.50000112L122 G123 S128 L129 L130 F204 I207 F252L122-T126 WeakPolarHBondContact CD1-OG1 3.47Å; L122-T126 WeakPolarHBondContact O-CB 3.44Å; L122-T126 PolarHBondContact O-N 3.37Å; L122-T126 PolarHBondContact O-OG1 2.96Å; G123-T126 PolarHBondContact O-N 2.86Å; T126-S128 VanDerWaalsContact C-N 3.31Å; T126-S128 PolarHBondContact O-N 2.93Å; T126-L129 PolarHBondContact O-N 3.44Å; T126-L130 PolarHBondContact O-N 3.24Å; T126-F204 HydrophobicContact CG2-CD1 4.23Å; T126-I207 HydrophobicContact CG2-CB 4.04Å; T126-I207 HydrophobicContact CG2-CD1 4.37Å; T126-I207 HydrophobicContact CG2-CG2 3.57Å; T126-F252 WeakPolarHBondContact OG1-CZ 3.24Å
127C88.1Confident85.5Confident14 Ų1419.2 Ų19.210%0.09510%0.102CC..Hα-helixtrans-64.5-36.5175.1-69.80000111.8G123 S125 L130 A131 C161G123-C127 VanDerWaalsContact O-CB 3.28Å; G123-C127 WeakPolarHBondContact O-CB 3.39Å; G123-C127 PolarHBondContact O-N 3.14Å; G123-C127 PolarHBondContact O-SG 3.06Å; S125-C127 PolarHBondContact O-N 2.94Å; C127-L130 PolarHBondContact O-N 2.98Å; C127-A131 PolarHBondContact O-N 3.47Å; C127-C161 HydrophobicContact CB-CB 3.66Å
128S84.6Confident84.7Confident1 Ų120.5 Ų20.51%0.00711%0.105CC..Hα-helixtrans-65.2-41.9175-61.90000112.3N80 A124 S125 T126 L130 A131 I132N80-S128 PolarHBondContact ND2-OG 3.11Å; A124-S128 VanDerWaalsContact O-CB 3.24Å; A124-S128 WeakPolarHBondContact O-CB 3.13Å; A124-S128 PolarHBondContact O-N 2.92Å; A124-S128 PolarHBondContact O-OG 3.46Å; S125-S128 WeakPolarHBondContact O-CB 3.37Å; S125-S128 PolarHBondContact O-N 3.39Å; S125-S128 VanDerWaalsContact O-N 3.17Å; T126-S128 VanDerWaalsContact C-N 3.31Å; T126-S128 PolarHBondContact O-N 2.93Å; S128-L130 VanDerWaalsContact C-N 3.31Å; S128-L130 PolarHBondContact O-N 3.41Å; S128-A131 PolarHBondContact O-N 3.35Å; S128-I132 WeakPolarHBondContact O-CD1 3.12Å; S128-I132 VanDerWaalsContact O-CG1 3.23Å; S128-I132 WeakPolarHBondContact O-CG1 3.33Å; S128-I132 PolarHBondContact O-N 3.14Å
129L82.9Confident83.8Confident14 Ų1421.5 Ų21.57%0.07311%0.113CC..Hα-helixtrans-61.8-39.5174.5-71.5174.1000111.8L81 S125 T126 I132 A133 I211 V248 F252L81-L129 HydrophobicContact CD2-CD2 3.81Å; S125-L129 WeakPolarHBondContact O-CG 3.35Å; S125-L129 PolarHBondContact O-N 3.27Å; T126-L129 PolarHBondContact O-N 3.44Å; L129-I132 HydrophobicContact CD2-CD1 4.45Å; L129-I132 PolarHBondContact O-N 3.25Å; L129-A133 WeakPolarHBondContact O-CB 3.49Å; L129-A133 PolarHBondContact O-N 2.69Å; L129-I211 HydrophobicContact CB-CD1 3.96Å; L129-V248 HydrophobicContact CD2-CG1 4.05Å; L129-F252 HydrophobicContact CD1-CB 4.47Å; L129-F252 HydrophobicContact CD1-CD2 3.48Å; L129-F252 VanDerWaalsContact CD1-CD2 3.48Å; L129-F252 HydrophobicContact CD1-CE2 3.75Å; L129-F252 HydrophobicContact CD1-CG 3.91Å; L129-F252 HydrophobicContact CD1-CZ 4.4Å
130L87.3Confident82.6Confident34 Ų3422.8 Ų22.818%0.17812%0.12CC..Hα-helixtrans-63.6-45173.3-18064000111.6T126 C127 S128 I132 A133 I134 I207 T210 I211 L214T126-L130 PolarHBondContact O-N 3.24Å; C127-L130 PolarHBondContact O-N 2.98Å; S128-L130 VanDerWaalsContact C-N 3.31Å; S128-L130 PolarHBondContact O-N 3.41Å; L130-I132 VanDerWaalsContact C-N 3.33Å; L130-I132 PolarHBondContact O-N 3.34Å; L130-A133 WeakPolarHBondContact O-CB 3.25Å; L130-A133 PolarHBondContact O-N 3.32Å; L130-A133 VanDerWaalsContact O-N 3.15Å; L130-I134 HydrophobicContact CD1-CD1 4.12Å; L130-I134 HydrophobicContact CD1-CG1 4.31Å; L130-I134 HydrophobicContact CG-CD1 3.91Å; L130-I134 HydrophobicContact CG-CG1 4.49Å; L130-I134 WeakPolarHBondContact O-CG1 3.35Å; L130-I134 PolarHBondContact O-N 2.89Å; L130-I207 HydrophobicContact CB-CG2 3.86Å; L130-I207 HydrophobicContact CD2-CG1 4.44Å; L130-I207 HydrophobicContact CD2-CG2 3.94Å; L130-I207 HydrophobicContact CG-CG2 4.31Å; L130-T210 HydrophobicContact CD1-CG2 3.81Å; L130-I211 HydrophobicContact CB-CD1 4.09Å; L130-I211 HydrophobicContact CB-CG1 4.09Å; L130-I211 HydrophobicContact CD1-CG1 3.81Å; L130-L214 HydrophobicContact CD1-CD1 4.12Å
131A82.4Confident81.4Confident8 Ų825.8 Ų25.87%0.06614%0.135CC..Hα-helixtrans-61.1-42.1177.500000111.8F77 C127 S128 I134 E135F77-A131 HydrophobicContact CE1-CB 3.78Å; F77-A131 HydrophobicContact CZ-CB 4.44Å; C127-A131 PolarHBondContact O-N 3.47Å; S128-A131 PolarHBondContact O-N 3.35Å; A131-I134 PolarHBondContact O-N 3.38Å; A131-E135 WeakPolarHBondContact O-CB 3.48Å; A131-E135 PolarHBondContact O-N 2.78Å
132I79.5Confident79.7Confident24 Ų2431.6 Ų31.612%0.12316%0.159CC..Hα-helixtrans-59.7-47.2172.7-66.8162000110.2F77 S128 L129 L130 I134 E135 R136F77-I132 HydrophobicContact CB-CD1 3.85Å; F77-I132 HydrophobicContact CB-CG1 3.54Å; F77-I132 HydrophobicContact CD1-CG1 3.72Å; F77-I132 HydrophobicContact CD2-CG1 4.44Å; F77-I132 HydrophobicContact CG-CD1 4.44Å; F77-I132 HydrophobicContact CG-CG1 3.65Å; S128-I132 WeakPolarHBondContact O-CD1 3.12Å; S128-I132 VanDerWaalsContact O-CG1 3.23Å; S128-I132 WeakPolarHBondContact O-CG1 3.33Å; S128-I132 PolarHBondContact O-N 3.14Å; L129-I132 HydrophobicContact CD2-CD1 4.45Å; L129-I132 PolarHBondContact O-N 3.25Å; L130-I132 VanDerWaalsContact C-N 3.33Å; L130-I132 PolarHBondContact O-N 3.34Å; I132-I134 PolarHBondContact O-N 2.97Å; I132-E135 PolarHBondContact O-N 3.05Å; I132-R136 HydrophobicContact CG2-CG 4.3Å; I132-R136 WeakPolarHBondContact O-CB 3.31Å; I132-R136 VanDerWaalsContact O-CG 3.24Å; I132-R136 WeakPolarHBondContact O-CG 3.49Å; I132-R136 PolarHBondContact O-N 3.35Å
133A80.1Confident78Confident0 Ų038.6 Ų38.60%019%0.193CC..Hα-helixtrans-60.5-44.1179.600000112.1L129 L130 R136 H137 I211 L214 Y215L129-A133 WeakPolarHBondContact O-CB 3.49Å; L129-A133 PolarHBondContact O-N 2.69Å; L130-A133 WeakPolarHBondContact O-CB 3.25Å; L130-A133 PolarHBondContact O-N 3.32Å; L130-A133 VanDerWaalsContact O-N 3.15Å; A133-R136 PolarHBondContact O-N 3.09Å; A133-H137 WeakPolarHBondContact O-CB 3.43Å; A133-H137 PolarHBondContact O-N 3.05Å; A133-I211 HydrophobicContact CB-CG2 4.48Å; A133-L214 HydrophobicContact CB-CD1 4.06Å; A133-Y215 VanDerWaalsContact CA-OH 3.24Å; A133-Y215 WeakPolarHBondContact CA-OH 3.48Å; A133-Y215 HydrophobicContact CB-CE2 3.66Å; A133-Y215 WeakPolarHBondContact CB-OH 3.35Å
134I81.3Confident75.9Confident71 Ų7147.3 Ų47.336%0.36423%0.225SC..Hα-helixtrans-64.1-47176.6-68168.5000110.7L130 A131 I132 R136 H137 L138 L214L130-I134 HydrophobicContact CD1-CD1 4.12Å; L130-I134 HydrophobicContact CD1-CG1 4.31Å; L130-I134 HydrophobicContact CG-CD1 3.91Å; L130-I134 HydrophobicContact CG-CG1 4.49Å; L130-I134 WeakPolarHBondContact O-CG1 3.35Å; L130-I134 PolarHBondContact O-N 2.89Å; A131-I134 PolarHBondContact O-N 3.38Å; I132-I134 PolarHBondContact O-N 2.97Å; I134-R136 VanDerWaalsContact C-N 3.3Å; I134-R136 PolarHBondContact O-N 3.25Å; I134-H137 PolarHBondContact O-N 3.45Å; I134-L138 HydrophobicContact CG2-CD1 3.82Å; I134-L138 HydrophobicContact CG2-CG 4.3Å; I134-L138 WeakPolarHBondContact O-CB 3.45Å; I134-L138 VanDerWaalsContact O-CG 3.26Å; I134-L138 WeakPolarHBondContact O-CG 3.49Å; I134-L138 PolarHBondContact O-N 3.32Å; I134-L214 HydrophobicContact CG1-CD1 3.81Å
135E77.4Confident73.9Confident30 Ų3052.9 Ų52.914%0.1426%0.261CS..Hα-helixtrans-58.5-45.4177.7-172.3-170.6-161.700111R73 F77 A131 I132 L138 T139R73-E135 IonicContact CZ-OE1 2.93Å; R73-E135 IonicContact NE-OE1 3.6Å; R73-E135 IonicContact NH1-OE1 2.77Å; F77-E135 VanDerWaalsContact CD2-OE2 3.22Å; F77-E135 WeakPolarHBondContact CD2-OE2 3.04Å; F77-E135 WeakPolarHBondContact CE2-OE2 3.23Å; A131-E135 WeakPolarHBondContact O-CB 3.48Å; A131-E135 PolarHBondContact O-N 2.78Å; I132-E135 PolarHBondContact O-N 3.05Å; E135-L138 PolarHBondContact O-N 2.86Å; E135-T139 HydrophobicContact CG-CG2 4.35Å; E135-T139 WeakPolarHBondContact O-CB 3.39Å; E135-T139 WeakPolarHBondContact O-CG2 3.46Å; E135-T139 PolarHBondContact O-N 3.31Å; E135-T139 PolarHBondContact O-OG1 3.07Å
136R74.3Confident72.2Confident52 Ų5258.5 Ų58.520%0.19628%0.283CS..Hα-helixtrans-62.9-44178.1-72.7-59.2-171.1-177.24.4112.5M74 I132 A133 I134 T139 M140 I218M74-R136 VanDerWaalsContact CG-NH2 3.34Å; M74-R136 PolarHBondContact SD-NH2 3.45Å; I132-R136 HydrophobicContact CG2-CG 4.3Å; I132-R136 WeakPolarHBondContact O-CB 3.31Å; I132-R136 VanDerWaalsContact O-CG 3.24Å; I132-R136 WeakPolarHBondContact O-CG 3.49Å; I132-R136 PolarHBondContact O-N 3.35Å; A133-R136 PolarHBondContact O-N 3.09Å; I134-R136 VanDerWaalsContact C-N 3.3Å; I134-R136 PolarHBondContact O-N 3.25Å; R136-T139 WeakPolarHBondContact CA-OG1 3.48Å; R136-T139 PolarHBondContact O-N 3.02Å; R136-T139 PolarHBondContact O-OG1 3.12Å; R136-T139 VanDerWaalsContact O-OG1 3.08Å; R136-M140 HydrophobicContact CB-CE 3.98Å; R136-M140 WeakPolarHBondContact O-CB 3.36Å; R136-M140 VanDerWaalsContact O-CE 3.32Å; R136-M140 WeakPolarHBondContact O-CE 3.25Å; R136-M140 PolarHBondContact O-N 2.99Å; R136-I218 HydrophobicContact CB-CD1 4.35Å
137H76.5Confident70.6Confident20 Ų2062.3 Ų62.39%0.09330%0.303CS..Hα-helixtrans-60.2-47.9176.4-171.866.6000111.5A133 I134 T139 M140 I141 L214 I218A133-H137 WeakPolarHBondContact O-CB 3.43Å; A133-H137 PolarHBondContact O-N 3.05Å; I134-H137 PolarHBondContact O-N 3.45Å; H137-T139 PolarHBondContact O-N 3.24Å; H137-M140 PolarHBondContact O-N 3.3Å; H137-I141 WeakPolarHBondContact CE1-CD1 3.47Å; H137-I141 WeakPolarHBondContact NE2-CD1 3.49Å; H137-I141 WeakPolarHBondContact O-CG1 3.39Å; H137-I141 PolarHBondContact O-N 2.95Å; H137-L214 HydrophobicContact CB-CD2 4.47Å; H137-I218 HydrophobicContact CB-CD1 4.04Å; H137-I218 HydrophobicContact CB-CG1 4.25Å
138L74.5Confident68.9Low64 Ų6464.2 Ų64.234%0.33532%0.32SS..Hα-helixtrans-65.8-39.5-179.3-69.6174.8000112.9I134 E135 K142I134-L138 HydrophobicContact CG2-CD1 3.82Å; I134-L138 HydrophobicContact CG2-CG 4.3Å; I134-L138 WeakPolarHBondContact O-CB 3.45Å; I134-L138 VanDerWaalsContact O-CG 3.26Å; I134-L138 WeakPolarHBondContact O-CG 3.49Å; I134-L138 PolarHBondContact O-N 3.32Å; E135-L138 PolarHBondContact O-N 2.86Å; L138-K142 WeakPolarHBondContact O-CB 3.48Å; L138-K142 PolarHBondContact O-N 2.95Å; L138-K142 VanDerWaalsContact O-N 3.15Å
139T70.4Confident67.6Low52 Ų5271.9 Ų71.932%0.31936%0.361SS..Hα-helixtrans-70.9-36.9179.8480000112.4E135 R136 H137E135-T139 HydrophobicContact CG-CG2 4.35Å; E135-T139 WeakPolarHBondContact O-CB 3.39Å; E135-T139 WeakPolarHBondContact O-CG2 3.46Å; E135-T139 PolarHBondContact O-N 3.31Å; E135-T139 PolarHBondContact O-OG1 3.07Å; R136-T139 WeakPolarHBondContact CA-OG1 3.48Å; R136-T139 PolarHBondContact O-N 3.02Å; R136-T139 PolarHBondContact O-OG1 3.12Å; R136-T139 VanDerWaalsContact O-OG1 3.08Å; H137-T139 PolarHBondContact O-N 3.24Å
140M65.8Low66.7Low51 Ų5175.1 Ų75.125%0.25137%0.374SS..Hα-helixtrans-75.8-34176.8-76.5-173.8-80.700113.6R136 H137 I218 L221 V222R136-M140 HydrophobicContact CB-CE 3.98Å; R136-M140 WeakPolarHBondContact O-CB 3.36Å; R136-M140 VanDerWaalsContact O-CE 3.32Å; R136-M140 WeakPolarHBondContact O-CE 3.25Å; R136-M140 PolarHBondContact O-N 2.99Å; H137-M140 PolarHBondContact O-N 3.3Å; M140-I218 HydrophobicContact CE-CB 4.21Å; M140-I218 HydrophobicContact CE-CD1 3.76Å; M140-I218 HydrophobicContact CE-CG1 3.91Å; M140-I218 HydrophobicContact CE-CG2 3.23Å; M140-I218 HydrophobicContact SD-CG2 3.75Å; M140-L221 HydrophobicContact CB-CD2 4.29Å; M140-V222 HydrophobicContact SD-CG2 4.25Å
141I66.4Low65.8Low78 Ų7878.5 Ų78.540%0.439%0.388SS..Hα-helixtrans-68.8-45.2174.9-73173.3000111.5H137 M143 L221H137-I141 WeakPolarHBondContact CE1-CD1 3.47Å; H137-I141 WeakPolarHBondContact NE2-CD1 3.49Å; H137-I141 WeakPolarHBondContact O-CG1 3.39Å; H137-I141 PolarHBondContact O-N 2.95Å; I141-M143 VanDerWaalsContact C-N 3.33Å; I141-M143 PolarHBondContact O-N 3.09Å; I141-L221 HydrophobicContact CG1-CD1 4.32Å; I141-L221 HydrophobicContact CG1-CD2 4.18Å
142K55.7Low65.4Low132 Ų13284.9 Ų84.957%0.57442%0.416SS*.Hα-helixtrans-83.2-3.5-168.1-70-169.7174.9-173.70114.6L138 R144L138-K142 WeakPolarHBondContact O-CB 3.48Å; L138-K142 PolarHBondContact O-N 2.95Å; L138-K142 VanDerWaalsContact O-N 3.15Å; K142-R144 HydrophobicContact CB-CB 4.16Å; K142-R144 WeakPolarHBondContact O-CA 3.29Å; K142-R144 WeakPolarHBondContact O-CB 3.49Å; K142-R144 PolarHBondContact O-N 3.34Å
143M53.3Low65.4Low158 Ų15890.5 Ų90.578%0.77844%0.436SS*.  trans35.932.8-172.8-67.9-164.2-176.700113.2I141I141-M143 VanDerWaalsContact C-N 3.33Å; I141-M143 PolarHBondContact O-N 3.09Å
144R47.8Very low65.2Low184 Ų18490.9 Ų90.969%0.69444%0.438SS*.PPolyproline II helixtrans-96.3133.1-164.5-114.4-174.7-175.3-174.62.8109.7K142K142-R144 HydrophobicContact CB-CB 4.16Å; K142-R144 WeakPolarHBondContact O-CA 3.29Å; K142-R144 WeakPolarHBondContact O-CB 3.49Å; K142-R144 PolarHBondContact O-N 3.34Å
145P48.5Very low65.3Low117 Ų11792.6 Ų92.676%0.7644%0.443SS*.PPolyproline II helixtrans-62.1151.7172.2-821.1000110.4D147P145-D147 PolarHBondContact O-N 3Å
146Y52.2Low65.6Low124 Ų12495.7 Ų95.749%0.48646%0.46SS..PPolyproline II helixtrans-49.3122.9177.7165.7-96.5000113.7A148Y146-A148 HydrophobicContact CE1-CB 3.78Å
147D54.2Low66Low80 Ų8096.2 Ų96.243%0.42847%0.466SS..  trans-98.8113.3163.4-84.8-39.4000109.5P145 N149 K150P145-D147 PolarHBondContact O-N 3Å; D147-N149 PolarHBondContact O-N 3Å; D147-N149 VanDerWaalsContact O-N 3.16Å; D147-K150 HydrophobicContact CB-CD 4.1Å; D147-K150 HydrophobicContact CB-CG 4.33Å; D147-K150 PolarHBondContact O-N 2.88Å; D147-K150 IonicContact OD2-NZ 2.74Å; D147-K150 PolarHBondContact OD2-NZ 3.33Å
148A52.7Low66.5Low55 Ų5596.2 Ų96.246%0.45547%0.467SS..G310 helixtrans-60.2-21.9175.200000113Y146 K150Y146-A148 HydrophobicContact CE1-CB 3.78Å; A148-K150 PolarHBondContact O-N 3.42Å
149N55.9Low67.2Low162 Ų16295 Ų9587%0.86647%0.47SS*.G310 helixtrans-77.25.1-176.6-135.810.7000114.5D147D147-N149 PolarHBondContact O-N 3Å; D147-N149 VanDerWaalsContact O-N 3.16Å
150K63.6Low68.1Low81 Ų8196.9 Ų96.935%0.35248%0.476SS..G310 helixtrans-108.312.7-178.1-70.4175-179.5140.10114.7D147 A148 H152 R153D147-K150 HydrophobicContact CB-CD 4.1Å; D147-K150 HydrophobicContact CB-CG 4.33Å; D147-K150 PolarHBondContact O-N 2.88Å; D147-K150 IonicContact OD2-NZ 2.74Å; D147-K150 PolarHBondContact OD2-NZ 3.33Å; A148-K150 PolarHBondContact O-N 3.42Å; K150-H152 VanDerWaalsContact C-N 3.31Å; K150-H152 PolarHBondContact O-N 3.37Å; K150-R153 WeakPolarHBondContact O-CB 3.44Å; K150-R153 PolarHBondContact O-N 3.37Å
151K68.9Low69.2Low105 Ų10595 Ų9546%0.45747%0.468SS..Hα-helixtrans-58.7-41.3176.5-69.9178.8-177.11780112.1R153 V154 F155K151-R153 VanDerWaalsContact C-N 3.28Å; K151-R153 PolarHBondContact O-N 2.95Å; K151-V154 PolarHBondContact O-N 3.48Å; K151-V154 VanDerWaalsContact O-N 3.13Å; K151-F155 VanDerWaalsContact O-CD2 3.31Å; K151-F155 WeakPolarHBondContact O-CD2 3.45Å; K151-F155 PolarHBondContact O-N 2.84Å
152H74.5Confident70.5Confident143 Ų14393.3 Ų93.366%0.66246%0.456SS*.Hα-helixtrans-58.1-38178.5-175.28.4000112.8K150 V154 F155 L156K150-H152 VanDerWaalsContact C-N 3.31Å; K150-H152 PolarHBondContact O-N 3.37Å; H152-V154 VanDerWaalsContact C-N 3.28Å; H152-V154 PolarHBondContact O-N 3.01Å; H152-F155 PolarHBondContact O-N 3.34Å; H152-L156 WeakPolarHBondContact O-CB 3.25Å; H152-L156 PolarHBondContact O-N 2.99Å
153R79.6Confident72.4Confident142 Ų14291.7 Ų91.754%0.53645%0.454SS..Hα-helixtrans-60.5-36178.5-178177.5173.4174.1-0.2112.7K150 K151 L157K150-R153 WeakPolarHBondContact O-CB 3.44Å; K150-R153 PolarHBondContact O-N 3.37Å; K151-R153 VanDerWaalsContact C-N 3.28Å; K151-R153 PolarHBondContact O-N 2.95Å; R153-L157 HydrophobicContact CG-CD1 4.31Å; R153-L157 WeakPolarHBondContact O-CB 3.49Å; R153-L157 WeakPolarHBondContact O-CG 3.3Å; R153-L157 PolarHBondContact O-N 3.39Å
154V76.5Confident74.2Confident8 Ų888.1 Ų88.15%0.04844%0.436CS..Hα-helixtrans-68.8-46.5178.3174.50000110.4R73 F76 F77 K151 H152 L156 L157 I158R73-V154 HydrophobicContact CB-CG2 4.35Å; R73-V154 HydrophobicContact CG-CG2 4.04Å; F76-V154 HydrophobicContact CB-CG1 4.29Å; F77-V154 HydrophobicContact CD2-CG1 4.23Å; F77-V154 HydrophobicContact CE1-CG1 4.39Å; F77-V154 HydrophobicContact CE2-CB 4.47Å; F77-V154 HydrophobicContact CE2-CG1 3.64Å; F77-V154 HydrophobicContact CE2-CG2 4.12Å; F77-V154 HydrophobicContact CZ-CG1 3.75Å; F77-V154 HydrophobicContact CZ-CG2 4.43Å; K151-V154 PolarHBondContact O-N 3.48Å; K151-V154 VanDerWaalsContact O-N 3.13Å; H152-V154 VanDerWaalsContact C-N 3.28Å; H152-V154 PolarHBondContact O-N 3.01Å; V154-L156 VanDerWaalsContact C-N 3.32Å; V154-L156 PolarHBondContact O-N 3.47Å; V154-L157 PolarHBondContact O-N 2.93Å; V154-I158 HydrophobicContact CG1-CD1 4Å; V154-I158 WeakPolarHBondContact O-CG1 3.4Å; V154-I158 PolarHBondContact O-N 2.92Å
155F82.3Confident76.5Confident107 Ų10779.4 Ų79.447%0.46940%0.404SS..Hα-helixtrans-63-38175.8-71.4-72.3000112.6F76 K151 H152 I158 G159F76-F155 HydrophobicContact CD1-CE1 4.28Å; F76-F155 AromaticContact CD1-CZ 3.94Å; F76-F155 HydrophobicContact CD1-CZ 3.94Å; F76-F155 HydrophobicContact CE1-CE1 4.42Å; F76-F155 AromaticContact CE1-CZ 3.75Å; F76-F155 HydrophobicContact CE1-CZ 3.75Å; F76-F155 HydrophobicContact CG-CZ 4.44Å; F76-F155 HydrophobicContact CZ-CZ 4.08Å; K151-F155 VanDerWaalsContact O-CD2 3.31Å; K151-F155 WeakPolarHBondContact O-CD2 3.45Å; K151-F155 PolarHBondContact O-N 2.84Å; H152-F155 PolarHBondContact O-N 3.34Å; F155-I158 PolarHBondContact O-N 3.48Å; F155-G159 PolarHBondContact O-N 3.19Å
156L84.7Confident78.7Confident94 Ų9479.4 Ų79.449%0.49239%0.392SS..Hα-helixtrans-62.8-47.4174.4-168.8161.4000110.9H152 V154 I158 G159 M160H152-L156 WeakPolarHBondContact O-CB 3.25Å; H152-L156 PolarHBondContact O-N 2.99Å; V154-L156 VanDerWaalsContact C-N 3.32Å; V154-L156 PolarHBondContact O-N 3.47Å; L156-I158 VanDerWaalsContact C-N 3.34Å; L156-I158 PolarHBondContact O-N 3.03Å; L156-G159 PolarHBondContact O-N 2.93Å; L156-M160 HydrophobicContact CD2-CG 3.76Å; L156-M160 WeakPolarHBondContact O-CG 3.39Å; L156-M160 PolarHBondContact O-N 3.34Å
157L82.9Confident80.7Confident64 Ų6477 Ų7734%0.33539%0.391SS..Hα-helixtrans-58.8-44.9176.7-77.8168000112R153 V154 M160 C161R153-L157 HydrophobicContact CG-CD1 4.31Å; R153-L157 WeakPolarHBondContact O-CB 3.49Å; R153-L157 WeakPolarHBondContact O-CG 3.3Å; R153-L157 PolarHBondContact O-N 3.39Å; V154-L157 PolarHBondContact O-N 2.93Å; L157-M160 PolarHBondContact O-N 3.22Å; L157-C161 PolarHBondContact O-N 3.03Å; L157-C161 PolarHBondContact O-SG 3.44Å
158I86.3Confident82.5Confident20 Ų2074.3 Ų74.310%0.10338%0.376CS..Hα-helixtrans-60.2-50.1175.6-70168000110F77 N80 V154 F155 L156 M160 C161 W162F77-I158 HydrophobicContact CD1-CG1 4.46Å; F77-I158 HydrophobicContact CE1-CG1 4.24Å; N80-I158 HydrophobicContact CB-CD1 4.15Å; N80-I158 HydrophobicContact CB-CG1 4.44Å; N80-I158 HydrophobicContact CB-CG2 4.46Å; N80-I158 VanDerWaalsContact OD1-CG2 3.31Å; N80-I158 WeakPolarHBondContact OD1-CG2 2.97Å; V154-I158 HydrophobicContact CG1-CD1 4Å; V154-I158 WeakPolarHBondContact O-CG1 3.4Å; V154-I158 PolarHBondContact O-N 2.92Å; F155-I158 PolarHBondContact O-N 3.48Å; L156-I158 VanDerWaalsContact C-N 3.34Å; L156-I158 PolarHBondContact O-N 3.03Å; I158-M160 VanDerWaalsContact C-N 3.31Å; I158-M160 PolarHBondContact O-N 3.41Å; I158-C161 WeakPolarHBondContact O-CB 3.43Å; I158-C161 PolarHBondContact O-N 3.36Å; I158-C161 VanDerWaalsContact O-N 3.08Å; I158-W162 PolarHBondContact O-N 2.68Å
159G88.8Confident84.5Confident39 Ų3971.9 Ų71.940%0.40236%0.356SS..Hα-helixtrans-56.7-42178.100000113.1F155 L156 W162 L163F155-G159 PolarHBondContact O-N 3.19Å; L156-G159 PolarHBondContact O-N 2.93Å; G159-W162 PolarHBondContact O-N 3.05Å; G159-L163 WeakPolarHBondContact O-CB 3.24Å; G159-L163 PolarHBondContact O-N 3.12Å
160M89.1Confident86.3Confident90 Ų9065.7 Ų65.744%0.44333%0.328SS..Hα-helixtrans-65.5-39.5175.1-69.4-57.5-61.400112.5L156 L157 I158 W162 L163 I164L156-M160 HydrophobicContact CD2-CG 3.76Å; L156-M160 WeakPolarHBondContact O-CG 3.39Å; L156-M160 PolarHBondContact O-N 3.34Å; L157-M160 PolarHBondContact O-N 3.22Å; I158-M160 VanDerWaalsContact C-N 3.31Å; I158-M160 PolarHBondContact O-N 3.41Å; M160-W162 VanDerWaalsContact C-N 3.33Å; M160-W162 PolarHBondContact O-N 3.46Å; M160-L163 HydrophobicContact CE-CD2 4.42Å; M160-L163 PolarHBondContact O-N 2.87Å; M160-L163 HydrophobicContact SD-CD2 4.34Å; M160-I164 VanDerWaalsContact O-CG1 3.26Å; M160-I164 WeakPolarHBondContact O-CG1 3.46Å; M160-I164 PolarHBondContact O-N 2.73Å
161C90.2Very high87.8Confident12 Ų1264 Ų648%0.08132%0.322CS..Hα-helixtrans-60.8-43.9175.3-66.20000111.2C127 L157 I158 I164 A165C127-C161 HydrophobicContact CB-CB 3.66Å; L157-C161 PolarHBondContact O-N 3.03Å; L157-C161 PolarHBondContact O-SG 3.44Å; I158-C161 WeakPolarHBondContact O-CB 3.43Å; I158-C161 PolarHBondContact O-N 3.36Å; I158-C161 VanDerWaalsContact O-N 3.08Å; C161-I164 PolarHBondContact O-N 2.72Å; C161-A165 WeakPolarHBondContact O-CB 3.33Å; C161-A165 PolarHBondContact O-N 2.85Å
162W93.9Very high89Confident43 Ų4359 Ų5916%0.16330%0.3CS..Hα-helixtrans-64.2-45.4175.7-80.5101.5000112.1N80 L83 L87 V120 A124 I158 G159 M160 I164 A165 F166N80-W162 PolarHBondContact OD1-NE1 3.41Å; L83-W162 HydrophobicContact CD2-CZ2 4.19Å; L83-W162 HydrophobicContact CG-CZ2 4.37Å; L87-W162 HydrophobicContact CD1-CH2 3.59Å; L87-W162 HydrophobicContact CD1-CZ2 4.43Å; L87-W162 HydrophobicContact CD1-CZ3 4.33Å; V120-W162 HydrophobicContact CG1-CZ3 4.3Å; A124-W162 HydrophobicContact CB-CD2 4.2Å; A124-W162 HydrophobicContact CB-CE3 4.11Å; A124-W162 HydrophobicContact CB-CH2 4.2Å; A124-W162 HydrophobicContact CB-CZ2 4.3Å; A124-W162 HydrophobicContact CB-CZ3 4.12Å; I158-W162 PolarHBondContact O-N 2.68Å; G159-W162 PolarHBondContact O-N 3.05Å; M160-W162 VanDerWaalsContact C-N 3.33Å; M160-W162 PolarHBondContact O-N 3.46Å; W162-I164 VanDerWaalsContact C-N 3.32Å; W162-I164 PolarHBondContact O-N 3.44Å; W162-A165 PolarHBondContact O-N 3Å; W162-F166 HydrophobicContact CB-CD2 4.46Å; W162-F166 HydrophobicContact CD2-CE2 4.47Å; W162-F166 HydrophobicContact CE3-CD2 4.14Å; W162-F166 AromaticContact CE3-CE2 3.5Å; W162-F166 HydrophobicContact CE3-CE2 3.5Å; W162-F166 HydrophobicContact CE3-CZ 4.14Å; W162-F166 HydrophobicContact CZ3-CE2 4.1Å; W162-F166 HydrophobicContact CZ3-CZ 4.28Å; W162-F166 WeakPolarHBondContact O-CB 3.46Å; W162-F166 VanDerWaalsContact O-CD2 3.23Å; W162-F166 WeakPolarHBondContact O-CD2 3.43Å; W162-F166 PolarHBondContact O-N 3.27Å
163L94.3Very high89.9Confident98 Ų9855.6 Ų55.651%0.51329%0.287SS..Hα-helixtrans-59-44.2178.1-179.563.5000111.7G159 M160 T167G159-L163 WeakPolarHBondContact O-CB 3.24Å; G159-L163 PolarHBondContact O-N 3.12Å; M160-L163 HydrophobicContact CE-CD2 4.42Å; M160-L163 PolarHBondContact O-N 2.87Å; M160-L163 HydrophobicContact SD-CD2 4.34Å; L163-T167 WeakPolarHBondContact O-CB 3.31Å; L163-T167 PolarHBondContact O-N 3.34Å; L163-T167 PolarHBondContact O-OG1 3.4Å
164I92.3Very high90.6Very high82 Ų8255.5 Ų55.542%0.42130%0.296SS..Hα-helixtrans-63.3-46.5176.2-68.4165.7000110.1M160 C161 W162 F166 T167 L168M160-I164 VanDerWaalsContact O-CG1 3.26Å; M160-I164 WeakPolarHBondContact O-CG1 3.46Å; M160-I164 PolarHBondContact O-N 2.73Å; C161-I164 PolarHBondContact O-N 2.72Å; W162-I164 VanDerWaalsContact C-N 3.32Å; W162-I164 PolarHBondContact O-N 3.44Å; I164-F166 PolarHBondContact O-N 2.91Å; I164-T167 PolarHBondContact O-N 3.42Å; I164-L168 HydrophobicContact CG2-CD1 4.01Å; I164-L168 HydrophobicContact CG2-CG 4.43Å; I164-L168 WeakPolarHBondContact O-CB 3.28Å; I164-L168 WeakPolarHBondContact O-CG 3.29Å; I164-L168 PolarHBondContact O-N 2.92Å
165A94.4Very high91.3Very high1 Ų157.5 Ų57.51%0.00832%0.318CS..Hα-helixtrans-61.8-45.5-179.800000112.5V120 A124 C161 W162 L168 G169V120-A165 HydrophobicContact CG1-CB 4.22Å; A124-A165 HydrophobicContact CB-CB 4Å; C161-A165 WeakPolarHBondContact O-CB 3.33Å; C161-A165 PolarHBondContact O-N 2.85Å; W162-A165 PolarHBondContact O-N 3Å; A165-L168 PolarHBondContact O-N 3.36Å; A165-G169 PolarHBondContact O-N 2.91Å
166F94.9Very high91.9Very high117 Ų11757.2 Ų57.251%0.51331%0.314SS..Hα-helixtrans-63.3-45175.6-84.5-64.4000112V120 W162 I164 L168 G169 A170V120-F166 HydrophobicContact CG1-CD1 3.9Å; V120-F166 HydrophobicContact CG1-CE1 3.89Å; V120-F166 HydrophobicContact CG1-CG 4.23Å; V120-F166 HydrophobicContact CG1-CZ 4.2Å; V120-F166 HydrophobicContact CG2-CD1 4.1Å; W162-F166 HydrophobicContact CB-CD2 4.46Å; W162-F166 HydrophobicContact CD2-CE2 4.47Å; W162-F166 HydrophobicContact CE3-CD2 4.14Å; W162-F166 AromaticContact CE3-CE2 3.5Å; W162-F166 HydrophobicContact CE3-CE2 3.5Å; W162-F166 HydrophobicContact CE3-CZ 4.14Å; W162-F166 HydrophobicContact CZ3-CE2 4.1Å; W162-F166 HydrophobicContact CZ3-CZ 4.28Å; W162-F166 WeakPolarHBondContact O-CB 3.46Å; W162-F166 VanDerWaalsContact O-CD2 3.23Å; W162-F166 WeakPolarHBondContact O-CD2 3.43Å; W162-F166 PolarHBondContact O-N 3.27Å; I164-F166 PolarHBondContact O-N 2.91Å; F166-L168 PolarHBondContact O-N 3.39Å; F166-G169 PolarHBondContact O-N 3.43Å; F166-A170 VanDerWaalsContact O-CB 3.25Å; F166-A170 WeakPolarHBondContact O-CB 3.44Å; F166-A170 PolarHBondContact O-N 3.41Å
167T94.1Very high92.4Very high75 Ų7554.4 Ų54.446%0.4630%0.299SS..Hα-helixtrans-57.3-50.5176.7-56.70000110.5L163 I164 G169 A170 L171L163-T167 WeakPolarHBondContact O-CB 3.31Å; L163-T167 PolarHBondContact O-N 3.34Å; L163-T167 PolarHBondContact O-OG1 3.4Å; I164-T167 PolarHBondContact O-N 3.42Å; T167-G169 VanDerWaalsContact C-N 3.34Å; T167-G169 PolarHBondContact O-N 3.28Å; T167-A170 PolarHBondContact O-N 2.89Å; T167-L171 WeakPolarHBondContact O-CG 3.18Å; T167-L171 PolarHBondContact O-N 2.6Å
168L93.3Very high93Very high22 Ų2251.4 Ų51.412%0.11528%0.284CS..Hα-helixtrans-61-40.4178.3-72.4176.2000112.7I164 A165 F166 L171 Y196 F199 I203I164-L168 HydrophobicContact CG2-CD1 4.01Å; I164-L168 HydrophobicContact CG2-CG 4.43Å; I164-L168 WeakPolarHBondContact O-CB 3.28Å; I164-L168 WeakPolarHBondContact O-CG 3.29Å; I164-L168 PolarHBondContact O-N 2.92Å; A165-L168 PolarHBondContact O-N 3.36Å; F166-L168 PolarHBondContact O-N 3.39Å; L168-L171 HydrophobicContact CD2-CD1 4.19Å; L168-Y196 PolarHBondContact O-OH 2.96Å; L168-F199 HydrophobicContact CD2-CE1 3.87Å; L168-I203 HydrophobicContact CD1-CG2 4.48Å; L168-I203 HydrophobicContact CD2-CD1 4.06Å
169G93.4Very high93.3Very high4 Ų452.5 Ų52.54%0.04129%0.29CS..Hα-helixtrans-71.1-26.5177.600000114.2A165 F166 T167 P172A165-G169 PolarHBondContact O-N 2.91Å; F166-G169 PolarHBondContact O-N 3.43Å; T167-G169 VanDerWaalsContact C-N 3.34Å; T167-G169 PolarHBondContact O-N 3.28Å; G169-P172 WeakPolarHBondContact O-CD 3.39Å
170A94.3Very high93.4Very high33 Ų3359.4 Ų59.427%0.27331%0.311SS..Hα-helixtrans-85.5-21.9-178.900000113.8F166 T167 P172 I173 L174F166-A170 VanDerWaalsContact O-CB 3.25Å; F166-A170 WeakPolarHBondContact O-CB 3.44Å; F166-A170 PolarHBondContact O-N 3.41Å; T167-A170 PolarHBondContact O-N 2.89Å; A170-P172 VanDerWaalsContact C-CD 3.45Å; A170-P172 VanDerWaalsContact C-N 3.35Å; A170-I173 WeakPolarHBondContact O-CA 3.28Å; A170-I173 WeakPolarHBondContact O-CB 3.35Å; A170-I173 PolarHBondContact O-N 3.43Å; A170-L174 HydrophobicContact CB-CD1 4.41Å; A170-L174 WeakPolarHBondContact O-CG 3.35Å; A170-L174 PolarHBondContact O-N 3.01Å
171L94.7Very high93.6Very high44 Ų4458.6 Ų58.623%0.2331%0.308CS..THydrogen-bonded Turntrans-49.5-42-178.6-77.9172.6000115T167 L168 I173 L174 G175 W176 Y196 F199T167-L171 WeakPolarHBondContact O-CG 3.18Å; T167-L171 PolarHBondContact O-N 2.6Å; L168-L171 HydrophobicContact CD2-CD1 4.19Å; L171-I173 VanDerWaalsContact C-N 3.32Å; L171-I173 PolarHBondContact O-N 3.27Å; L171-L174 PolarHBondContact O-N 3.42Å; L171-G175 PolarHBondContact O-N 3.09Å; L171-W176 HydrophobicContact CD1-CE3 4.22Å; L171-W176 HydrophobicContact CD1-CZ3 4.4Å; L171-W176 PolarHBondContact O-N 2.93Å; L171-Y196 HydrophobicContact CB-CD2 4.33Å; L171-Y196 HydrophobicContact CB-CE2 3.82Å; L171-Y196 HydrophobicContact CD1-CE2 4.3Å; L171-F199 HydrophobicContact CD1-CE1 4.24Å
172P94.4Very high93.7Very high0 Ų060 Ų600%032%0.315CS..THydrogen-bonded Turntrans-64.6-35.4176.1-22.134.3000113.2F112 G169 A170 L174 G175 N177 Y192 Y196F112-P172 HydrophobicContact CD1-CB 3.97Å; F112-P172 HydrophobicContact CE1-CB 4.03Å; G169-P172 WeakPolarHBondContact O-CD 3.39Å; A170-P172 VanDerWaalsContact C-CD 3.45Å; A170-P172 VanDerWaalsContact C-N 3.35Å; P172-L174 VanDerWaalsContact C-N 3.33Å; P172-G175 PolarHBondContact O-N 3Å; P172-N177 PolarHBondContact O-ND2 3.24Å; P172-Y192 HydrophobicContact CB-CD1 4.48Å; P172-Y192 HydrophobicContact CB-CE1 4.04Å; P172-Y192 HydrophobicContact CG-CD1 4.05Å; P172-Y192 HydrophobicContact CG-CE1 3.41Å; P172-Y192 VanDerWaalsContact CG-CE1 3.41Å; P172-Y196 HydrophobicContact CG-CD1 4.22Å; P172-Y196 HydrophobicContact CG-CD2 4.11Å; P172-Y196 HydrophobicContact CG-CE1 3.77Å; P172-Y196 HydrophobicContact CG-CE2 3.63Å; P172-Y196 HydrophobicContact CG-CG 4.36Å
173I93.6Very high93.6Very high73 Ų7361.9 Ų61.937%0.37433%0.332SS..THydrogen-bonded Turntrans-68.9-37.1176.8-57.7171000110F112 A170 L171 G175F112-I173 HydrophobicContact CB-CD1 4.11Å; F112-I173 HydrophobicContact CB-CG1 3.54Å; F112-I173 HydrophobicContact CG-CG1 4.16Å; A170-I173 WeakPolarHBondContact O-CA 3.28Å; A170-I173 WeakPolarHBondContact O-CB 3.35Å; A170-I173 PolarHBondContact O-N 3.43Å; L171-I173 VanDerWaalsContact C-N 3.32Å; L171-I173 PolarHBondContact O-N 3.27Å; I173-G175 PolarHBondContact O-N 3.32Å
174L93.3Very high93.6Very high140 Ų14059.1 Ų59.173%0.73332%0.318SS*.THydrogen-bonded Turntrans-76.1-4178.6-64.5174.8000114A170 L171 P172A170-L174 HydrophobicContact CB-CD1 4.41Å; A170-L174 WeakPolarHBondContact O-CG 3.35Å; A170-L174 PolarHBondContact O-N 3.01Å; L171-L174 PolarHBondContact O-N 3.42Å; P172-L174 VanDerWaalsContact C-N 3.33Å
175G92.4Very high93.7Very high49 Ų4955.2 Ų55.251%0.50530%0.299SS..THydrogen-bonded Turntrans131.3-9.4170.700000115.6L171 P172 I173 N177L171-G175 PolarHBondContact O-N 3.09Å; P172-G175 PolarHBondContact O-N 3Å; I173-G175 PolarHBondContact O-N 3.32Å; G175-N177 PolarHBondContact O-N 3.14Å
176W95.1Very high93.7Very high101 Ų10155.2 Ų55.238%0.38330%0.298SS..  trans-82.659178-157.4-10.1000112.2L171 Y196 F199L171-W176 HydrophobicContact CD1-CE3 4.22Å; L171-W176 HydrophobicContact CD1-CZ3 4.4Å; L171-W176 PolarHBondContact O-N 2.93Å; W176-Y196 HydrophobicContact CB-CD2 4.47Å; W176-Y196 HydrophobicContact CD2-CD2 4.11Å; W176-Y196 HydrophobicContact CE3-CD2 4.19Å; W176-Y196 HydrophobicContact CG-CD2 4.23Å; W176-F199 HydrophobicContact CH2-CB 4.23Å; W176-F199 HydrophobicContact CH2-CD1 4.05Å; W176-F199 HydrophobicContact CH2-CD2 4.32Å; W176-F199 HydrophobicContact CH2-CE1 4.48Å; W176-F199 AromaticContact CH2-CG 3.94Å; W176-F199 HydrophobicContact CH2-CG 3.94Å; W176-F199 HydrophobicContact CZ3-CD1 4.03Å; W176-F199 HydrophobicContact CZ3-CE1 4.15Å; W176-F199 HydrophobicContact CZ3-CG 4.38Å
177N95Very high93.7Very high35 Ų3549.6 Ų49.619%0.18727%0.274CS..BIsolated β-bridgetrans-125.4-179.5-179.361.662.9000111F112 P172 G175 L179F112-N177 HydrophobicContact CE1-CB 4Å; F112-N177 HydrophobicContact CZ-CB 3.6Å; P172-N177 PolarHBondContact O-ND2 3.24Å; G175-N177 PolarHBondContact O-N 3.14Å; N177-L179 VanDerWaalsContact OD1-CB 3.3Å; N177-L179 WeakPolarHBondContact OD1-CB 3.49Å; N177-L179 VanDerWaalsContact OD1-CG 3.22Å; N177-L179 WeakPolarHBondContact OD1-CG 3.42Å; N177-L179 PolarHBondContact OD1-N 3.33Å; N177-L179 VanDerWaalsContact OD1-N 3.09Å
178C94.8Very high93.6Very high1 Ų146.8 Ų46.81%0.00726%0.256CS..  trans-108.417.3-179.472.60000113.8H180 N181 C185 L191C178-H180 PolarHBondContact O-N 3.49Å; C178-N181 CarbonylContact O-C 3.37Å; C178-N181 PolarHBondContact O-N 2.93Å; C178-C185 HydrophobicContact CB-CB 4.01Å; C178-C185 WeakPolarHBondContact CB-SG 3.46Å; C178-C185 WeakPolarHBondContact SG-CA 3.42Å; C178-C185 WeakPolarHBondContact SG-CB 3.25Å; C178-C185 CovalentContact SG-SG 2.04Å; C178-C185 PolarHBondContact SG-SG 3.46Å; C178-L191 PolarHBondContact N-O 3.35Å; C178-L191 PolarHBondContact SG-O 3.11Å; C178-L191 VanDerWaalsContact SG-O 3.42Å
179L92.3Very high93.7Very high44 Ų4446.1 Ų46.123%0.2325%0.252CS..THydrogen-bonded Turntrans-56.2-30.6-172.7-70.2174.1000114.1T17 F112 N177 L191T17-L179 HydrophobicContact CG2-CD2 3.83Å; F112-L179 HydrophobicContact CE2-CD1 4.2Å; F112-L179 HydrophobicContact CZ-CD1 4.5Å; F112-L179 HydrophobicContact CZ-CG 4.45Å; N177-L179 VanDerWaalsContact OD1-CB 3.3Å; N177-L179 WeakPolarHBondContact OD1-CB 3.49Å; N177-L179 VanDerWaalsContact OD1-CG 3.22Å; N177-L179 WeakPolarHBondContact OD1-CG 3.42Å; N177-L179 PolarHBondContact OD1-N 3.33Å; N177-L179 VanDerWaalsContact OD1-N 3.09Å; L179-L191 HydrophobicContact CD2-CD2 4.13Å; L179-L191 HydrophobicContact CD2-CG 4.12Å
180H91.6Very high93.6Very high184 Ų18446 Ų4685%0.85225%0.251SS*.THydrogen-bonded Turntrans-106.11.9179.3-59.5-65.2000113.4C178C178-H180 PolarHBondContact O-N 3.49Å
181N92.7Very high93.6Very high72 Ų7244.4 Ų44.439%0.38524%0.238SC..  trans-14379.1-176.4-167.422.6000111.4C178 P183 D184C178-N181 CarbonylContact O-C 3.37Å; C178-N181 PolarHBondContact O-N 2.93Å; N181-P183 VanDerWaalsContact C-CD 3.44Å; N181-P183 WeakPolarHBondContact OD1-CD 3.43Å; N181-D184 HydrophobicContact CB-CB 4.45Å; N181-D184 PolarHBondContact ND2-OD2 3.49Å; N181-D184 PolarHBondContact O-N 2.85Å
182L92Very high93.7Very high43 Ų4342.3 Ų42.323%0.22523%0.227CC..G310 helixtrans-52-42.3-177.4-78.172.4000114.1E20 Y24 D184 C185E20-L182 HydrophobicContact CG-CD2 4.26Å; Y24-L182 HydrophobicContact CD1-CB 4.15Å; Y24-L182 HydrophobicContact CD2-CB 4.36Å; Y24-L182 HydrophobicContact CD2-CD2 4.02Å; Y24-L182 HydrophobicContact CE1-CB 4.13Å; Y24-L182 WeakPolarHBondContact CE1-O 3.33Å; Y24-L182 HydrophobicContact CE2-CB 4.35Å; Y24-L182 HydrophobicContact CG-CB 4.27Å; Y24-L182 HydrophobicContact CG-CD2 4Å; L182-D184 PolarHBondContact O-N 2.77Å; L182-D184 VanDerWaalsContact O-N 3.14Å; L182-C185 VanDerWaalsContact O-CB 3.24Å; L182-C185 WeakPolarHBondContact O-CB 3.42Å; L182-C185 PolarHBondContact O-N 3.29Å; L182-C185 PolarHBondContact O-SG 3.24Å
183P92.4Very high93.8Very high81 Ų8142.5 Ų42.553%0.52623%0.228SC..G310 helixtrans-57.8-27.1178.1-2735.2000115.2Y24 N181 C185Y24-P183 WeakPolarHBondContact OH-CA 3.33Å; N181-P183 VanDerWaalsContact C-CD 3.44Å; N181-P183 WeakPolarHBondContact OD1-CD 3.43Å; P183-C185 VanDerWaalsContact C-N 3.3Å
184D93.6Very high93.8Very high40 Ų4040.3 Ų40.321%0.21422%0.216CC..G310 helixtrans-83.8-2.8178.5-86.7-6.3000112.8N181 L182 S193 K194 K195N181-D184 HydrophobicContact CB-CB 4.45Å; N181-D184 PolarHBondContact ND2-OD2 3.49Å; N181-D184 PolarHBondContact O-N 2.85Å; L182-D184 PolarHBondContact O-N 2.77Å; L182-D184 VanDerWaalsContact O-N 3.14Å; D184-S193 CarbonylContact O-C 3.59Å; D184-S193 WeakPolarHBondContact O-CA 3.48Å; D184-K194 PolarHBondContact O-N 3.28Å; D184-K195 IonicContact OD1-NZ 2.92Å; D184-K195 IonicContact OD2-NZ 4Å; D184-K195 PolarHBondContact OD2-NZ 3.04Å
185C95.3Very high94Very high1 Ų139.5 Ų39.51%0.00721%0.206CC..BIsolated β-bridgetrans-74.7141.2-176.5-66.80000113.7C178 L182 P183 P190 K194C178-C185 HydrophobicContact CB-CB 4.01Å; C178-C185 WeakPolarHBondContact CB-SG 3.46Å; C178-C185 WeakPolarHBondContact SG-CA 3.42Å; C178-C185 WeakPolarHBondContact SG-CB 3.25Å; C178-C185 CovalentContact SG-SG 2.04Å; C178-C185 PolarHBondContact SG-SG 3.46Å; L182-C185 VanDerWaalsContact O-CB 3.24Å; L182-C185 WeakPolarHBondContact O-CB 3.42Å; L182-C185 PolarHBondContact O-N 3.29Å; L182-C185 PolarHBondContact O-SG 3.24Å; P183-C185 VanDerWaalsContact C-N 3.3Å; C185-P190 PolarHBondContact SG-O 3.37Å; C185-K194 WeakPolarHBondContact O-CE 3.38Å
186S95.3Very high94.1Very high0 Ų037.1 Ų37.10%018%0.182CC..  trans-74.3141.9174.2156.20000112.3I188 L189 P190 Y192 I197 D266S186-I188 PolarHBondContact OG-N 3.38Å; S186-L189 WeakPolarHBondContact CB-O 3.21Å; S186-L189 CarbonylContact O-C 3.6Å; S186-L189 PolarHBondContact OG-N 2.94Å; S186-P190 WeakPolarHBondContact O-CA 3.15Å; S186-Y192 PolarHBondContact N-O 3.14Å; S186-I197 VanDerWaalsContact OG-CD1 3.3Å; S186-I197 WeakPolarHBondContact OG-CD1 3.17Å; S186-D266 WeakPolarHBondContact CB-OD2 3.37Å; S186-D266 PolarHBondContact OG-OD2 3.15Å
187T93.5Very high94.2Very high0 Ų032.4 Ų32.40%016%0.164CC..SBendtrans-72.9-33.7174.3-45.30000110.7V25 K27 D266 L277 F278V25-T187 HydrophobicContact CB-CG2 4.47Å; K27-T187 WeakPolarHBondContact CD-O 3.37Å; K27-T187 WeakPolarHBondContact CE-O 3.36Å; K27-T187 PolarHBondContact NZ-O 2.98Å; T187-D266 WeakPolarHBondContact CA-OD1 3.45Å; T187-D266 WeakPolarHBondContact CB-OD1 3.27Å; T187-D266 PolarHBondContact N-OD1 3.41Å; T187-D266 PolarHBondContact N-OD2 2.94Å; T187-D266 VanDerWaalsContact N-OD2 3.15Å; T187-D266 PolarHBondContact OG1-OD1 2.9Å; T187-L277 HydrophobicContact CG2-CB 3.93Å; T187-L277 HydrophobicContact CG2-CD1 4.17Å; T187-F278 HydrophobicContact CG2-CZ 4.28Å
188I92.9Very high94.2Very high16 Ų1632.2 Ų32.28%0.08217%0.168CC..SBendtrans-73.9-46.2-179.6-61170.4000111S186 L262 F263 D266 L277 A280S186-I188 PolarHBondContact OG-N 3.38Å; I188-L262 HydrophobicContact CD1-CD2 3.81Å; I188-L262 HydrophobicContact CD1-CG 3.76Å; I188-F263 HydrophobicContact CB-CD1 4.34Å; I188-F263 HydrophobicContact CB-CE1 3.99Å; I188-F263 HydrophobicContact CD1-CD1 3.6Å; I188-F263 HydrophobicContact CD1-CE1 3.89Å; I188-F263 HydrophobicContact CD1-CG 4.43Å; I188-F263 HydrophobicContact CG2-CD1 4.38Å; I188-F263 HydrophobicContact CG2-CE1 3.62Å; I188-F263 HydrophobicContact CG2-CZ 4.39Å; I188-D266 HydrophobicContact CD1-CB 3.84Å; I188-D266 HydrophobicContact CG1-CB 4.19Å; I188-D266 PolarHBondContact N-OD2 3.5Å; I188-L277 HydrophobicContact CD1-CD2 3.93Å; I188-L277 HydrophobicContact CG1-CD2 4.09Å; I188-A280 HydrophobicContact CG1-CB 4.4Å; I188-A280 HydrophobicContact CG2-CB 4.16Å
189L94.1Very high94.3Very high7 Ų735.8 Ų35.84%0.03718%0.183CC..SBendtrans-119.792.1-179.8-69.3121.3000109.6W111 E115 F119 S186 L191 Y192 I197 F263W111-L189 HydrophobicContact CH2-CB 4.17Å; W111-L189 HydrophobicContact CH2-CD2 4.32Å; E115-L189 HydrophobicContact CB-CD2 3.79Å; E115-L189 HydrophobicContact CG-CD2 3.95Å; F119-L189 HydrophobicContact CE2-CD1 4.3Å; F119-L189 HydrophobicContact CE2-CD2 4.07Å; F119-L189 HydrophobicContact CZ-CD1 4.29Å; S186-L189 WeakPolarHBondContact CB-O 3.21Å; S186-L189 CarbonylContact O-C 3.6Å; S186-L189 PolarHBondContact OG-N 2.94Å; L189-L191 PolarHBondContact O-N 3.19Å; L189-Y192 HydrophobicContact CB-CD2 3.8Å; L189-Y192 HydrophobicContact CB-CG 3.92Å; L189-Y192 HydrophobicContact CD2-CD2 3.82Å; L189-Y192 HydrophobicContact CD2-CE2 3.91Å; L189-Y192 HydrophobicContact CD2-CG 4.28Å; L189-Y192 HydrophobicContact CG-CD2 4.4Å; L189-Y192 PolarHBondContact O-N 3.01Å; L189-I197 HydrophobicContact CB-CD1 4.39Å; L189-I197 HydrophobicContact CD1-CD1 3.8Å; L189-F263 HydrophobicContact CD1-CD1 4.33Å; L189-F263 HydrophobicContact CD1-CE1 3.37Å; L189-F263 HydrophobicContact CD1-CZ 3.88Å
190P93.2Very high94.4Very high2 Ų233.8 Ų33.81%0.01317%0.173CC..THydrogen-bonded Turntrans-62.8-15.5-165-27.538.3000116.9H21 Y22 V25 C185 S186H21-P190 HydrophobicContact CB-CB 4.28Å; H21-P190 PolarHBondContact CD2-O 3.09Å; Y22-P190 HydrophobicContact CD1-CG 4.21Å; Y22-P190 HydrophobicContact CD2-CB 3.86Å; Y22-P190 HydrophobicContact CD2-CG 3.96Å; Y22-P190 HydrophobicContact CE1-CG 4.02Å; Y22-P190 HydrophobicContact CE2-CB 3.94Å; Y22-P190 HydrophobicContact CE2-CG 3.79Å; Y22-P190 HydrophobicContact CG-CB 4.38Å; Y22-P190 HydrophobicContact CG-CG 4.19Å; V25-P190 HydrophobicContact CG1-CB 4.31Å; V25-P190 HydrophobicContact CG2-CB 3.97Å; V25-P190 HydrophobicContact CG2-CG 3.82Å; C185-P190 PolarHBondContact SG-O 3.37Å; S186-P190 WeakPolarHBondContact O-CA 3.15Å
191L94.3Very high94.5Very high0 Ų025.4 Ų25.40%013%0.134CC..THydrogen-bonded Turntrans-104.9-5.8176.5-76.962.6000112.9L18 H21 Y22 P108 W111 F112 C178 L179 L189L18-L191 HydrophobicContact CD1-CD2 4.02Å; L18-L191 HydrophobicContact CG-CD1 4.4Å; L18-L191 HydrophobicContact CG-CD2 4.36Å; H21-L191 HydrophobicContact CB-CD1 3.89Å; Y22-L191 HydrophobicContact CE2-CD1 4.29Å; P108-L191 HydrophobicContact CB-CD2 4.35Å; W111-L191 HydrophobicContact CD2-CD1 4.44Å; W111-L191 HydrophobicContact CD2-CD2 3.97Å; W111-L191 HydrophobicContact CE3-CB 3.89Å; W111-L191 HydrophobicContact CE3-CD2 3.73Å; W111-L191 HydrophobicContact CE3-CG 4.27Å; W111-L191 HydrophobicContact CG-CD2 4.35Å; W111-L191 HydrophobicContact CH2-CB 3.93Å; W111-L191 HydrophobicContact CZ2-CD1 4.39Å; W111-L191 HydrophobicContact CZ3-CB 3.52Å; W111-L191 HydrophobicContact CZ3-CD2 4.26Å; W111-L191 HydrophobicContact CZ3-CG 4.33Å; F112-L191 HydrophobicContact CE1-CB 3.85Å; F112-L191 HydrophobicContact CE2-CD2 4.28Å; F112-L191 HydrophobicContact CZ-CB 3.76Å; F112-L191 HydrophobicContact CZ-CD2 4.15Å; C178-L191 PolarHBondContact N-O 3.35Å; C178-L191 PolarHBondContact SG-O 3.11Å; C178-L191 VanDerWaalsContact SG-O 3.42Å; L179-L191 HydrophobicContact CD2-CD2 4.13Å; L179-L191 HydrophobicContact CD2-CG 4.12Å; L189-L191 PolarHBondContact O-N 3.19Å
192Y95.8Very high94.6Very high0 Ų025.2 Ų25.20%014%0.138CC..BIsolated β-bridgetrans-87.6140.5177.9-83.4-114.3000110.7W111 F112 E115 G116 F119 P172 S186 L189 Y196 I197W111-Y192 HydrophobicContact CE3-CE2 4.46Å; W111-Y192 AromaticContact CH2-CD2 3.66Å; W111-Y192 HydrophobicContact CH2-CD2 3.66Å; W111-Y192 AromaticContact CH2-CE2 3.93Å; W111-Y192 HydrophobicContact CH2-CE2 3.93Å; W111-Y192 AromaticContact CZ3-CD2 3.46Å; W111-Y192 HydrophobicContact CZ3-CD2 3.46Å; W111-Y192 VanDerWaalsContact CZ3-CD2 3.46Å; W111-Y192 AromaticContact CZ3-CE2 3.43Å; W111-Y192 HydrophobicContact CZ3-CE2 3.43Å; W111-Y192 VanDerWaalsContact CZ3-CE2 3.43Å; F112-Y192 HydrophobicContact CD1-CD2 4.3Å; F112-Y192 AromaticContact CD1-CE2 3.75Å; F112-Y192 HydrophobicContact CD1-CE2 3.75Å; F112-Y192 HydrophobicContact CE1-CD2 4.16Å; F112-Y192 HydrophobicContact CE1-CE2 4.08Å; E115-Y192 HydrophobicContact CB-CE2 3.97Å; G116-Y192 WeakPolarHBondContact CA-OH 3.24Å; G116-Y192 PolarHBondContact N-OH 3.05Å; F119-Y192 HydrophobicContact CD2-CE1 4.48Å; F119-Y192 HydrophobicContact CE2-CE1 4.2Å; P172-Y192 HydrophobicContact CB-CD1 4.48Å; P172-Y192 HydrophobicContact CB-CE1 4.04Å; P172-Y192 HydrophobicContact CG-CD1 4.05Å; P172-Y192 HydrophobicContact CG-CE1 3.41Å; P172-Y192 VanDerWaalsContact CG-CE1 3.41Å; S186-Y192 PolarHBondContact N-O 3.14Å; L189-Y192 HydrophobicContact CB-CD2 3.8Å; L189-Y192 HydrophobicContact CB-CG 3.92Å; L189-Y192 HydrophobicContact CD2-CD2 3.82Å; L189-Y192 HydrophobicContact CD2-CE2 3.91Å; L189-Y192 HydrophobicContact CD2-CG 4.28Å; L189-Y192 HydrophobicContact CG-CD2 4.4Å; L189-Y192 PolarHBondContact O-N 3.01Å; Y192-Y196 AromaticContact CD1-CD1 3.43Å; Y192-Y196 HydrophobicContact CD1-CD1 3.43Å; Y192-Y196 VanDerWaalsContact CD1-CD1 3.43Å; Y192-Y196 AromaticContact CD1-CE1 3.37Å; Y192-Y196 HydrophobicContact CD1-CE1 3.37Å; Y192-Y196 AromaticContact CE1-CD1 3.87Å; Y192-Y196 HydrophobicContact CE1-CD1 3.87Å; Y192-Y196 AromaticContact CE1-CE1 3.29Å; Y192-Y196 HydrophobicContact CE1-CE1 3.29Å; Y192-Y196 AromaticContact CE1-CZ 4Å; Y192-I197 HydrophobicContact CD1-CG1 4.37Å
193S96Very high94.7Very high4 Ų425.4 Ų25.43%0.02814%0.139CC..BIsolated β-bridgetrans-73.8136.4170.6178.10000110.7D184 K195 Y196 I197D184-S193 CarbonylContact O-C 3.59Å; D184-S193 WeakPolarHBondContact O-CA 3.48Å; S193-K195 PolarHBondContact O-N 3.32Å; S193-K195 PolarHBondContact OG-N 3.35Å; S193-Y196 PolarHBondContact O-N 2.88Å; S193-Y196 VanDerWaalsContact O-N 3.14Å; S193-I197 PolarHBondContact O-N 2.99Å; S193-I197 VanDerWaalsContact O-N 3.09Å
194K95.1Very high94.7Very high26 Ų2621.7 Ų21.711%0.11312%0.115CC..Hα-helixtrans-54.9-36.2172-71.2179.7178.8-176.20112.4D184 C185 I197 A198 D266 V267 C269D184-K194 PolarHBondContact O-N 3.28Å; C185-K194 WeakPolarHBondContact O-CE 3.38Å; K194-I197 PolarHBondContact O-N 3.29Å; K194-A198 WeakPolarHBondContact O-CB 3.43Å; K194-A198 PolarHBondContact O-N 2.92Å; K194-D266 VanDerWaalsContact CE-O 3.23Å; K194-D266 WeakPolarHBondContact CE-O 3.13Å; K194-D266 PolarHBondContact NZ-O 3.38Å; K194-V267 HydrophobicContact CB-CG2 4.32Å; K194-V267 WeakPolarHBondContact O-CG2 3.22Å; K194-C269 PolarHBondContact NZ-O 3.48Å
195K95.9Very high94.6Very high123 Ų12322.6 Ų22.654%0.53512%0.122SC..Hα-helixtrans-63.1-44178.5-65.2168.4-177.9154.70111.5D184 S193 A198 F199D184-K195 IonicContact OD1-NZ 2.92Å; D184-K195 IonicContact OD2-NZ 4Å; D184-K195 PolarHBondContact OD2-NZ 3.04Å; S193-K195 PolarHBondContact O-N 3.32Å; S193-K195 PolarHBondContact OG-N 3.35Å; K195-A198 PolarHBondContact O-N 3.36Å; K195-F199 WeakPolarHBondContact O-CB 3.35Å; K195-F199 PolarHBondContact O-N 2.91Å
196Y96.1Very high94.5Very high0 Ų025.1 Ų25.10%014%0.143CC..Hα-helixtrans-64-45.3175.3167.2-86.1000111.3L168 L171 P172 W176 Y192 S193 A198 F199 C200L168-Y196 PolarHBondContact O-OH 2.96Å; L171-Y196 HydrophobicContact CB-CD2 4.33Å; L171-Y196 HydrophobicContact CB-CE2 3.82Å; L171-Y196 HydrophobicContact CD1-CE2 4.3Å; P172-Y196 HydrophobicContact CG-CD1 4.22Å; P172-Y196 HydrophobicContact CG-CD2 4.11Å; P172-Y196 HydrophobicContact CG-CE1 3.77Å; P172-Y196 HydrophobicContact CG-CE2 3.63Å; P172-Y196 HydrophobicContact CG-CG 4.36Å; W176-Y196 HydrophobicContact CB-CD2 4.47Å; W176-Y196 HydrophobicContact CD2-CD2 4.11Å; W176-Y196 HydrophobicContact CE3-CD2 4.19Å; W176-Y196 HydrophobicContact CG-CD2 4.23Å; Y192-Y196 AromaticContact CD1-CD1 3.43Å; Y192-Y196 HydrophobicContact CD1-CD1 3.43Å; Y192-Y196 VanDerWaalsContact CD1-CD1 3.43Å; Y192-Y196 AromaticContact CD1-CE1 3.37Å; Y192-Y196 HydrophobicContact CD1-CE1 3.37Å; Y192-Y196 AromaticContact CE1-CD1 3.87Å; Y192-Y196 HydrophobicContact CE1-CD1 3.87Å; Y192-Y196 AromaticContact CE1-CE1 3.29Å; Y192-Y196 HydrophobicContact CE1-CE1 3.29Å; Y192-Y196 AromaticContact CE1-CZ 4Å; S193-Y196 PolarHBondContact O-N 2.88Å; S193-Y196 VanDerWaalsContact O-N 3.14Å; Y196-A198 VanDerWaalsContact C-N 3.33Å; Y196-A198 PolarHBondContact O-N 3.31Å; Y196-F199 WeakPolarHBondContact O-CB 3.44Å; Y196-F199 PolarHBondContact O-N 3.26Å; Y196-F199 VanDerWaalsContact O-N 3.16Å; Y196-C200 VanDerWaalsContact CE1-SG 3.56Å; Y196-C200 PolarHBondContact O-N 3.45Å
197I95.6Very high94.4Very high1 Ų126.2 Ų26.21%0.00515%0.148CC..Hα-helixtrans-60.3-45179.4-67.7179.9000110.6S186 L189 Y192 S193 K194 F199 C200 I201 F263 V267S186-I197 VanDerWaalsContact OG-CD1 3.3Å; S186-I197 WeakPolarHBondContact OG-CD1 3.17Å; L189-I197 HydrophobicContact CB-CD1 4.39Å; L189-I197 HydrophobicContact CD1-CD1 3.8Å; Y192-I197 HydrophobicContact CD1-CG1 4.37Å; S193-I197 PolarHBondContact O-N 2.99Å; S193-I197 VanDerWaalsContact O-N 3.09Å; K194-I197 PolarHBondContact O-N 3.29Å; I197-F199 VanDerWaalsContact C-N 3.32Å; I197-F199 PolarHBondContact O-N 2.89Å; I197-C200 PolarHBondContact O-N 3.34Å; I197-I201 HydrophobicContact CG2-CD1 3.59Å; I197-I201 HydrophobicContact CG2-CG1 4.46Å; I197-I201 WeakPolarHBondContact O-CD1 3.45Å; I197-I201 VanDerWaalsContact O-CG1 3.28Å; I197-I201 WeakPolarHBondContact O-CG1 3.3Å; I197-I201 PolarHBondContact O-N 3.18Å; I197-F263 HydrophobicContact CG2-CB 3.94Å; I197-F263 HydrophobicContact CG2-CD1 3.99Å; I197-F263 HydrophobicContact CG2-CG 4.08Å; I197-V267 HydrophobicContact CB-CG2 4.39Å; I197-V267 HydrophobicContact CG2-CG2 4.13Å
198A96.1Very high94.2Very high32 Ų3227 Ų2726%0.26415%0.152SC..Hα-helixtrans-59-42.5175.800000112.3K194 K195 Y196 I201 S202 V267K194-A198 WeakPolarHBondContact O-CB 3.43Å; K194-A198 PolarHBondContact O-N 2.92Å; K195-A198 PolarHBondContact O-N 3.36Å; Y196-A198 VanDerWaalsContact C-N 3.33Å; Y196-A198 PolarHBondContact O-N 3.31Å; A198-I201 PolarHBondContact O-N 2.83Å; A198-S202 PolarHBondContact O-N 3.48Å; A198-S202 PolarHBondContact O-OG 3.23Å; A198-V267 HydrophobicContact CB-CG1 4.06Å; A198-V267 HydrophobicContact CB-CG2 4.13Å
199F96.4Very high94.1Very high75 Ų7529.9 Ų29.933%0.32917%0.171SC..Hα-helixtrans-61.8-44.6175.5170.5-102.9000112.7L168 L171 W176 K195 Y196 I197 I201 S202 I203L168-F199 HydrophobicContact CD2-CE1 3.87Å; L171-F199 HydrophobicContact CD1-CE1 4.24Å; W176-F199 HydrophobicContact CH2-CB 4.23Å; W176-F199 HydrophobicContact CH2-CD1 4.05Å; W176-F199 HydrophobicContact CH2-CD2 4.32Å; W176-F199 HydrophobicContact CH2-CE1 4.48Å; W176-F199 AromaticContact CH2-CG 3.94Å; W176-F199 HydrophobicContact CH2-CG 3.94Å; W176-F199 HydrophobicContact CZ3-CD1 4.03Å; W176-F199 HydrophobicContact CZ3-CE1 4.15Å; W176-F199 HydrophobicContact CZ3-CG 4.38Å; K195-F199 WeakPolarHBondContact O-CB 3.35Å; K195-F199 PolarHBondContact O-N 2.91Å; Y196-F199 WeakPolarHBondContact O-CB 3.44Å; Y196-F199 PolarHBondContact O-N 3.26Å; Y196-F199 VanDerWaalsContact O-N 3.16Å; I197-F199 VanDerWaalsContact C-N 3.32Å; I197-F199 PolarHBondContact O-N 2.89Å; F199-I201 PolarHBondContact O-N 3.5Å; F199-S202 PolarHBondContact O-N 3.23Å; F199-S202 PolarHBondContact O-OG 2.91Å; F199-I203 HydrophobicContact CD1-CD1 4.16Å; F199-I203 HydrophobicContact CD2-CD1 4.27Å; F199-I203 HydrophobicContact CE1-CD1 3.57Å; F199-I203 HydrophobicContact CE2-CD1 3.7Å; F199-I203 HydrophobicContact CE2-CG1 4.44Å; F199-I203 HydrophobicContact CG-CD1 4.49Å; F199-I203 HydrophobicContact CZ-CD1 3.33Å; F199-I203 HydrophobicContact CZ-CG1 4.48Å; F199-I203 WeakPolarHBondContact O-CG1 3Å; F199-I203 PolarHBondContact O-N 2.99Å
200C94.8Very high94Very high2 Ų232.6 Ų32.61%0.01419%0.188CC..Hα-helixtrans-64.3-41.8176.6-70.20000112.4F119 Y196 I197 I203 F204F119-C200 HydrophobicContact CE1-CB 4.31Å; Y196-C200 VanDerWaalsContact CE1-SG 3.56Å; Y196-C200 PolarHBondContact O-N 3.45Å; I197-C200 PolarHBondContact O-N 3.34Å; C200-I203 PolarHBondContact O-N 3.41Å; C200-F204 HydrophobicContact CB-CE2 4.27Å; C200-F204 WeakPolarHBondContact O-CD2 3.34Å; C200-F204 WeakPolarHBondContact O-CG 3.21Å; C200-F204 PolarHBondContact O-N 2.94Å
201I94.1Very high93.7Very high8 Ų832.6 Ų32.64%0.04119%0.188CC..Hα-helixtrans-65.4-41.1179.7-67.9159.2000111.2I197 A198 F199 I203 F204 T205 F263 L264I197-I201 HydrophobicContact CG2-CD1 3.59Å; I197-I201 HydrophobicContact CG2-CG1 4.46Å; I197-I201 WeakPolarHBondContact O-CD1 3.45Å; I197-I201 VanDerWaalsContact O-CG1 3.28Å; I197-I201 WeakPolarHBondContact O-CG1 3.3Å; I197-I201 PolarHBondContact O-N 3.18Å; A198-I201 PolarHBondContact O-N 2.83Å; F199-I201 PolarHBondContact O-N 3.5Å; I201-I203 VanDerWaalsContact C-N 3.32Å; I201-I203 PolarHBondContact O-N 3.25Å; I201-F204 PolarHBondContact O-N 3.25Å; I201-T205 WeakPolarHBondContact O-CB 3.33Å; I201-T205 PolarHBondContact O-N 3.21Å; I201-T205 PolarHBondContact O-OG1 2.94Å; I201-F263 HydrophobicContact CD1-CB 3.22Å; I201-F263 HydrophobicContact CD1-CD2 4.34Å; I201-F263 HydrophobicContact CD1-CG 4.07Å; I201-F263 HydrophobicContact CG1-CB 4.3Å; I201-L264 HydrophobicContact CG2-CD2 4.01Å; I201-L264 HydrophobicContact CG2-CG 4.2Å
202S94.9Very high93.4Very high68 Ų6835.8 Ų35.848%0.47621%0.207SC..Hα-helixtrans-62.3-41.9178.1700000111.1A198 F199 A206A198-S202 PolarHBondContact O-N 3.48Å; A198-S202 PolarHBondContact O-OG 3.23Å; F199-S202 PolarHBondContact O-N 3.23Å; F199-S202 PolarHBondContact O-OG 2.91Å; S202-A206 VanDerWaalsContact O-CB 3.3Å; S202-A206 WeakPolarHBondContact O-CB 3.48Å; S202-A206 PolarHBondContact O-N 3.21Å
203I94.1Very high93.1Very high47 Ų4740.2 Ų40.224%0.24123%0.23CC..Hα-helixtrans-61.4-52.8174.3-70.1174.2000111.3L168 F199 C200 I201 T205 A206 I207L168-I203 HydrophobicContact CD1-CG2 4.48Å; L168-I203 HydrophobicContact CD2-CD1 4.06Å; F199-I203 HydrophobicContact CD1-CD1 4.16Å; F199-I203 HydrophobicContact CD2-CD1 4.27Å; F199-I203 HydrophobicContact CE1-CD1 3.57Å; F199-I203 HydrophobicContact CE2-CD1 3.7Å; F199-I203 HydrophobicContact CE2-CG1 4.44Å; F199-I203 HydrophobicContact CG-CD1 4.49Å; F199-I203 HydrophobicContact CZ-CD1 3.33Å; F199-I203 HydrophobicContact CZ-CG1 4.48Å; F199-I203 WeakPolarHBondContact O-CG1 3Å; F199-I203 PolarHBondContact O-N 2.99Å; C200-I203 PolarHBondContact O-N 3.41Å; I201-I203 VanDerWaalsContact C-N 3.32Å; I201-I203 PolarHBondContact O-N 3.25Å; I203-T205 VanDerWaalsContact C-N 3.31Å; I203-T205 PolarHBondContact O-N 3.01Å; I203-A206 PolarHBondContact O-N 2.85Å; I203-I207 HydrophobicContact CG2-CD1 3.91Å; I203-I207 WeakPolarHBondContact O-CG1 3.35Å; I203-I207 PolarHBondContact O-N 3.34Å
204F91.9Very high92.7Very high4 Ų441.1 Ų41.12%0.01823%0.234CC..Hα-helixtrans-63.6-38.9-178.4-67.1-41.6000112.1F119 L122 T126 C200 I201 I207 L208 F260F119-F204 HydrophobicContact CD1-CE2 4.43Å; L122-F204 HydrophobicContact CD2-CD2 3.74Å; L122-F204 HydrophobicContact CD2-CE2 3.48Å; L122-F204 VanDerWaalsContact CD2-CE2 3.48Å; L122-F204 HydrophobicContact CD2-CG 4.49Å; L122-F204 HydrophobicContact CD2-CZ 4.07Å; L122-F204 HydrophobicContact CG-CD2 4.31Å; L122-F204 HydrophobicContact CG-CE1 4.43Å; L122-F204 HydrophobicContact CG-CE2 3.95Å; L122-F204 HydrophobicContact CG-CZ 4.02Å; T126-F204 HydrophobicContact CG2-CD1 4.23Å; C200-F204 HydrophobicContact CB-CE2 4.27Å; C200-F204 WeakPolarHBondContact O-CD2 3.34Å; C200-F204 WeakPolarHBondContact O-CG 3.21Å; C200-F204 PolarHBondContact O-N 2.94Å; I201-F204 PolarHBondContact O-N 3.25Å; F204-I207 PolarHBondContact O-N 3.4Å; F204-L208 WeakPolarHBondContact O-CG 3.46Å; F204-L208 PolarHBondContact O-N 3.44Å; F204-F260 HydrophobicContact CB-CE2 3.82Å; F204-F260 HydrophobicContact CB-CZ 3.65Å; F204-F260 HydrophobicContact CD2-CZ 4.16Å; F204-F260 HydrophobicContact CG-CZ 4.21Å
205T91.4Very high92Very high58 Ų5840.6 Ų40.636%0.35623%0.232SC..Hα-helixtrans-63.7-44.6175.5-56.10000111.1I201 I203 I207 L208 V209I201-T205 WeakPolarHBondContact O-CB 3.33Å; I201-T205 PolarHBondContact O-N 3.21Å; I201-T205 PolarHBondContact O-OG1 2.94Å; I203-T205 VanDerWaalsContact C-N 3.31Å; I203-T205 PolarHBondContact O-N 3.01Å; T205-I207 VanDerWaalsContact C-N 3.32Å; T205-I207 PolarHBondContact O-N 3.24Å; T205-L208 PolarHBondContact O-N 3.03Å; T205-V209 HydrophobicContact CG2-CG2 4.44Å; T205-V209 WeakPolarHBondContact O-CG2 3.43Å; T205-V209 PolarHBondContact O-N 3.28Å
206A93.8Very high91.4Very high55 Ų5536.7 Ų36.746%0.45522%0.222SC..Hα-helixtrans-61.3-40176.500000112.2S202 I203 T210S202-A206 VanDerWaalsContact O-CB 3.3Å; S202-A206 WeakPolarHBondContact O-CB 3.48Å; S202-A206 PolarHBondContact O-N 3.21Å; I203-A206 PolarHBondContact O-N 2.85Å; A206-T210 WeakPolarHBondContact O-CB 3.43Å; A206-T210 PolarHBondContact O-N 3.26Å; A206-T210 PolarHBondContact O-OG1 2.87Å
207I91.9Very high90.9Very high22 Ų2243.6 Ų43.611%0.11325%0.248CC..Hα-helixtrans-63.3-46.8174-66166000110.5T126 L130 I203 F204 T205 V209 T210 I211T126-I207 HydrophobicContact CG2-CB 4.04Å; T126-I207 HydrophobicContact CG2-CD1 4.37Å; T126-I207 HydrophobicContact CG2-CG2 3.57Å; L130-I207 HydrophobicContact CB-CG2 3.86Å; L130-I207 HydrophobicContact CD2-CG1 4.44Å; L130-I207 HydrophobicContact CD2-CG2 3.94Å; L130-I207 HydrophobicContact CG-CG2 4.31Å; I203-I207 HydrophobicContact CG2-CD1 3.91Å; I203-I207 WeakPolarHBondContact O-CG1 3.35Å; I203-I207 PolarHBondContact O-N 3.34Å; F204-I207 PolarHBondContact O-N 3.4Å; T205-I207 VanDerWaalsContact C-N 3.32Å; T205-I207 PolarHBondContact O-N 3.24Å; I207-V209 PolarHBondContact O-N 3.26Å; I207-T210 WeakPolarHBondContact O-CB 3.49Å; I207-T210 PolarHBondContact O-N 3.45Å; I207-I211 HydrophobicContact CG2-CD1 3.9Å; I207-I211 HydrophobicContact CG2-CG1 4.35Å; I207-I211 VanDerWaalsContact O-CG1 3.31Å; I207-I211 WeakPolarHBondContact O-CG1 3.46Å; I207-I211 PolarHBondContact O-N 3.26Å
208L89.6Confident90.1Very high16 Ų1643.5 Ų43.58%0.08425%0.248CC..Hα-helixtrans-61.5-43.9178.8-71.3176.3000112.5F204 T205 T210 I211 V212 F252 I253 F260F204-L208 WeakPolarHBondContact O-CG 3.46Å; F204-L208 PolarHBondContact O-N 3.44Å; T205-L208 PolarHBondContact O-N 3.03Å; L208-T210 VanDerWaalsContact C-N 3.31Å; L208-T210 PolarHBondContact O-N 3.38Å; L208-I211 HydrophobicContact CD2-CD1 4.5Å; L208-I211 WeakPolarHBondContact O-CB 3.38Å; L208-I211 PolarHBondContact O-N 3.01Å; L208-V212 WeakPolarHBondContact O-CG2 3.48Å; L208-V212 PolarHBondContact O-N 2.95Å; L208-F252 HydrophobicContact CD1-CE1 4.29Å; L208-F252 HydrophobicContact CD2-CD1 3.62Å; L208-F252 HydrophobicContact CD2-CE1 3.61Å; L208-F252 HydrophobicContact CG-CE1 4.46Å; L208-I253 HydrophobicContact CD2-CG1 4.46Å; L208-F260 HydrophobicContact CD1-CD2 4.44Å; L208-F260 HydrophobicContact CD1-CE2 3.77Å
209V91.1Very high89.3Confident78 Ų7846.7 Ų46.747%0.47325%0.254SS..Hα-helixtrans-59.4-44.4174.2169.80000110.5T205 I207 I211 V212 I213T205-V209 HydrophobicContact CG2-CG2 4.44Å; T205-V209 WeakPolarHBondContact O-CG2 3.43Å; T205-V209 PolarHBondContact O-N 3.28Å; I207-V209 PolarHBondContact O-N 3.26Å; V209-I211 VanDerWaalsContact C-N 3.33Å; V209-I211 PolarHBondContact O-N 3.49Å; V209-V212 PolarHBondContact O-N 3.44Å; V209-I213 HydrophobicContact CG1-CD1 3.77Å; V209-I213 HydrophobicContact CG1-CG1 4.42Å; V209-I213 VanDerWaalsContact O-CG1 3.31Å; V209-I213 WeakPolarHBondContact O-CG1 3.25Å; V209-I213 PolarHBondContact O-N 3.49Å
210T91.1Very high88.6Confident63 Ų6349.5 Ų49.539%0.38727%0.266SS..Hα-helixtrans-59.3-44.1176.4-58.60000111.5L130 A206 I207 L208 V212 I213 L214L130-T210 HydrophobicContact CD1-CG2 3.81Å; A206-T210 WeakPolarHBondContact O-CB 3.43Å; A206-T210 PolarHBondContact O-N 3.26Å; A206-T210 PolarHBondContact O-OG1 2.87Å; I207-T210 WeakPolarHBondContact O-CB 3.49Å; I207-T210 PolarHBondContact O-N 3.45Å; L208-T210 VanDerWaalsContact C-N 3.31Å; L208-T210 PolarHBondContact O-N 3.38Å; T210-V212 PolarHBondContact O-N 2.77Å; T210-I213 PolarHBondContact O-N 3.48Å; T210-L214 HydrophobicContact CG2-CD1 4.21Å; T210-L214 HydrophobicContact CG2-CG 4.47Å; T210-L214 VanDerWaalsContact O-CG 3.31Å; T210-L214 WeakPolarHBondContact O-CG 3.44Å; T210-L214 PolarHBondContact O-N 3.05Å
211I88.5Confident87.8Confident2 Ų252.9 Ų52.91%0.0128%0.284CS..Hα-helixtrans-59.4-48.1176.5-70.4171.8000110.6L129 L130 A133 I207 L208 V209 I213 L214 Y215 V249L129-I211 HydrophobicContact CB-CD1 3.96Å; L130-I211 HydrophobicContact CB-CD1 4.09Å; L130-I211 HydrophobicContact CB-CG1 4.09Å; L130-I211 HydrophobicContact CD1-CG1 3.81Å; A133-I211 HydrophobicContact CB-CG2 4.48Å; I207-I211 HydrophobicContact CG2-CD1 3.9Å; I207-I211 HydrophobicContact CG2-CG1 4.35Å; I207-I211 VanDerWaalsContact O-CG1 3.31Å; I207-I211 WeakPolarHBondContact O-CG1 3.46Å; I207-I211 PolarHBondContact O-N 3.26Å; L208-I211 HydrophobicContact CD2-CD1 4.5Å; L208-I211 WeakPolarHBondContact O-CB 3.38Å; L208-I211 PolarHBondContact O-N 3.01Å; V209-I211 VanDerWaalsContact C-N 3.33Å; V209-I211 PolarHBondContact O-N 3.49Å; I211-I213 PolarHBondContact O-N 3.45Å; I211-L214 PolarHBondContact O-N 2.97Å; I211-Y215 HydrophobicContact CG2-CD2 3.6Å; I211-Y215 HydrophobicContact CG2-CE2 3.49Å; I211-Y215 VanDerWaalsContact CG2-CE2 3.49Å; I211-Y215 WeakPolarHBondContact O-CD2 3.23Å; I211-Y215 PolarHBondContact O-N 3.26Å; I211-V249 HydrophobicContact CG2-CG1 3.94Å; I211-V249 HydrophobicContact CG2-CG2 3.79Å
212V87.6Confident86.8Confident68 Ų6853.1 Ų53.141%0.41229%0.285SS..Hα-helixtrans-59.7-45.4178.5171.80000111.1L208 V209 T210 L214 Y215 A216 I253L208-V212 WeakPolarHBondContact O-CG2 3.48Å; L208-V212 PolarHBondContact O-N 2.95Å; V209-V212 PolarHBondContact O-N 3.44Å; T210-V212 PolarHBondContact O-N 2.77Å; V212-L214 PolarHBondContact O-N 2.89Å; V212-Y215 PolarHBondContact O-N 3.02Å; V212-A216 WeakPolarHBondContact O-CB 3.45Å; V212-A216 PolarHBondContact O-N 2.72Å; V212-I253 HydrophobicContact CG2-CD1 3.74Å
213I89.4Confident85.9Confident93 Ų9354.3 Ų54.348%0.47728%0.282SS..Hα-helixtrans-61.1-45.7177.6-67.5166.6000110.9V209 T210 I211 Y215 A216 R217V209-I213 HydrophobicContact CG1-CD1 3.77Å; V209-I213 HydrophobicContact CG1-CG1 4.42Å; V209-I213 VanDerWaalsContact O-CG1 3.31Å; V209-I213 WeakPolarHBondContact O-CG1 3.25Å; V209-I213 PolarHBondContact O-N 3.49Å; T210-I213 PolarHBondContact O-N 3.48Å; I211-I213 PolarHBondContact O-N 3.45Å; I213-Y215 VanDerWaalsContact C-N 3.33Å; I213-Y215 PolarHBondContact O-N 2.83Å; I213-A216 PolarHBondContact O-N 3.34Å; I213-R217 WeakPolarHBondContact O-CG 3.32Å; I213-R217 PolarHBondContact O-N 3.4Å
214L87Confident84.9Confident22 Ų2254.2 Ų54.212%0.11529%0.285CS..Hα-helixtrans-60-42.8178.1-71.8174.3000111.5L130 A133 I134 H137 T210 I211 V212 R217 I218L130-L214 HydrophobicContact CD1-CD1 4.12Å; A133-L214 HydrophobicContact CB-CD1 4.06Å; I134-L214 HydrophobicContact CG1-CD1 3.81Å; H137-L214 HydrophobicContact CB-CD2 4.47Å; T210-L214 HydrophobicContact CG2-CD1 4.21Å; T210-L214 HydrophobicContact CG2-CG 4.47Å; T210-L214 VanDerWaalsContact O-CG 3.31Å; T210-L214 WeakPolarHBondContact O-CG 3.44Å; T210-L214 PolarHBondContact O-N 3.05Å; I211-L214 PolarHBondContact O-N 2.97Å; V212-L214 PolarHBondContact O-N 2.89Å; L214-R217 PolarHBondContact O-N 2.83Å; L214-I218 VanDerWaalsContact O-CG1 3.24Å; L214-I218 WeakPolarHBondContact O-CG1 3.46Å; L214-I218 PolarHBondContact O-N 3.34Å
215Y81.1Confident83.7Confident16 Ų1656.1 Ų56.16%0.06330%0.299CS..Hα-helixtrans-71.6-36.4178.1-76.4-60.7000113.7A133 I211 V212 I213 R217 I218 Y219 L242 V245 V249A133-Y215 VanDerWaalsContact CA-OH 3.24Å; A133-Y215 WeakPolarHBondContact CA-OH 3.48Å; A133-Y215 HydrophobicContact CB-CE2 3.66Å; A133-Y215 WeakPolarHBondContact CB-OH 3.35Å; I211-Y215 HydrophobicContact CG2-CD2 3.6Å; I211-Y215 HydrophobicContact CG2-CE2 3.49Å; I211-Y215 VanDerWaalsContact CG2-CE2 3.49Å; I211-Y215 WeakPolarHBondContact O-CD2 3.23Å; I211-Y215 PolarHBondContact O-N 3.26Å; V212-Y215 PolarHBondContact O-N 3.02Å; I213-Y215 VanDerWaalsContact C-N 3.33Å; I213-Y215 PolarHBondContact O-N 2.83Å; Y215-R217 VanDerWaalsContact C-N 3.32Å; Y215-R217 PolarHBondContact O-N 2.93Å; Y215-I218 HydrophobicContact CD1-CD1 3.79Å; Y215-I218 HydrophobicContact CE1-CD1 3.94Å; Y215-I218 PolarHBondContact O-N 2.96Å; Y215-Y219 WeakPolarHBondContact O-CB 3.46Å; Y215-Y219 PolarHBondContact O-N 3.41Å; Y215-L242 HydrophobicContact CD1-CD1 4.16Å; Y215-V245 HydrophobicContact CD1-CG1 4.04Å; Y215-V245 HydrophobicContact CE1-CB 4.04Å; Y215-V245 HydrophobicContact CE1-CG1 3.17Å; Y215-V245 HydrophobicContact CE2-CG1 3.78Å; Y215-V245 WeakPolarHBondContact OH-CG1 3.24Å; Y215-V249 HydrophobicContact CD2-CG2 3.89Å; Y215-V249 HydrophobicContact CE2-CG2 3.57Å
216A83.3Confident82.4Confident41 Ų4156 Ų5634%0.33930%0.301SS..Hα-helixtrans-58.9-46.8171.100000110.5V212 I213 I218 Y219 F220V212-A216 WeakPolarHBondContact O-CB 3.45Å; V212-A216 PolarHBondContact O-N 2.72Å; I213-A216 PolarHBondContact O-N 3.34Å; A216-I218 VanDerWaalsContact C-N 3.35Å; A216-I218 PolarHBondContact O-N 3.38Å; A216-Y219 WeakPolarHBondContact O-CB 3.4Å; A216-Y219 PolarHBondContact O-N 2.95Å; A216-F220 WeakPolarHBondContact O-CD2 3.32Å; A216-F220 PolarHBondContact O-N 3.21Å
217R85.3Confident80.6Confident144 Ų14461.8 Ų61.854%0.54331%0.311SS..Hα-helixtrans-60.3-42.5176.1-71.2-177.372.4-175.23.4112.4I213 L214 Y215 F220 L221I213-R217 WeakPolarHBondContact O-CG 3.32Å; I213-R217 PolarHBondContact O-N 3.4Å; L214-R217 PolarHBondContact O-N 2.83Å; Y215-R217 VanDerWaalsContact C-N 3.32Å; Y215-R217 PolarHBondContact O-N 2.93Å; R217-F220 PolarHBondContact O-N 3.46Å; R217-L221 WeakPolarHBondContact O-CB 3.21Å; R217-L221 PolarHBondContact O-N 3.41Å
218I79.6Confident79Confident0 Ų069 Ų690%034%0.341CS..Hα-helixtrans-59.8-48175-71.3164.5000110.6R136 H137 M140 L214 Y215 A216 F220 L221 V222 L242R136-I218 HydrophobicContact CB-CD1 4.35Å; H137-I218 HydrophobicContact CB-CD1 4.04Å; H137-I218 HydrophobicContact CB-CG1 4.25Å; M140-I218 HydrophobicContact CE-CB 4.21Å; M140-I218 HydrophobicContact CE-CD1 3.76Å; M140-I218 HydrophobicContact CE-CG1 3.91Å; M140-I218 HydrophobicContact CE-CG2 3.23Å; M140-I218 HydrophobicContact SD-CG2 3.75Å; L214-I218 VanDerWaalsContact O-CG1 3.24Å; L214-I218 WeakPolarHBondContact O-CG1 3.46Å; L214-I218 PolarHBondContact O-N 3.34Å; Y215-I218 HydrophobicContact CD1-CD1 3.79Å; Y215-I218 HydrophobicContact CE1-CD1 3.94Å; Y215-I218 PolarHBondContact O-N 2.96Å; A216-I218 VanDerWaalsContact C-N 3.35Å; A216-I218 PolarHBondContact O-N 3.38Å; I218-F220 PolarHBondContact O-N 3.16Å; I218-L221 WeakPolarHBondContact O-CB 3.22Å; I218-L221 PolarHBondContact O-N 3.36Å; I218-V222 HydrophobicContact CG2-CG2 4.4Å; I218-V222 WeakPolarHBondContact O-CG2 3.39Å; I218-V222 PolarHBondContact O-N 3.49Å; I218-L242 HydrophobicContact CB-CD1 4.38Å; I218-L242 HydrophobicContact CG2-CD1 3.62Å; I218-L242 HydrophobicContact CG2-CD2 4.36Å
219Y78.2Confident77.4Confident99 Ų9972.1 Ų72.139%0.38836%0.361SS..Hα-helixtrans-57.9-47179.6175.3-102.1000112Y215 A216 V222 K223 M239 L242Y215-Y219 WeakPolarHBondContact O-CB 3.46Å; Y215-Y219 PolarHBondContact O-N 3.41Å; A216-Y219 WeakPolarHBondContact O-CB 3.4Å; A216-Y219 PolarHBondContact O-N 2.95Å; Y219-V222 PolarHBondContact O-N 2.87Å; Y219-K223 HydrophobicContact CE1-CD 4.4Å; Y219-K223 WeakPolarHBondContact O-CB 3.17Å; Y219-K223 PolarHBondContact O-N 2.71Å; Y219-M239 HydrophobicContact CE2-CE 4.38Å; Y219-L242 HydrophobicContact CD2-CD2 3.76Å; Y219-L242 HydrophobicContact CG-CD2 4.33Å
220F81.3Confident75.7Confident134 Ų13473.9 Ų73.959%0.58838%0.384SS*.Hα-helixtrans-66.2-37.9177.2-71.9-63.5000113A216 R217 I218 S224A216-F220 WeakPolarHBondContact O-CD2 3.32Å; A216-F220 PolarHBondContact O-N 3.21Å; R217-F220 PolarHBondContact O-N 3.46Å; I218-F220 PolarHBondContact O-N 3.16Å; F220-S224 VanDerWaalsContact O-CB 3.24Å; F220-S224 WeakPolarHBondContact O-CB 3.48Å; F220-S224 PolarHBondContact O-N 2.97Å
221L79.3Confident74.1Confident72 Ų7275.3 Ų75.338%0.37739%0.389SS..Hα-helixtrans-59.7-49.4175.2-172.697.5000111M140 I141 R217 I218 S224 S225M140-L221 HydrophobicContact CB-CD2 4.29Å; I141-L221 HydrophobicContact CG1-CD1 4.32Å; I141-L221 HydrophobicContact CG1-CD2 4.18Å; R217-L221 WeakPolarHBondContact O-CB 3.21Å; R217-L221 PolarHBondContact O-N 3.41Å; I218-L221 WeakPolarHBondContact O-CB 3.22Å; I218-L221 PolarHBondContact O-N 3.36Å; L221-S224 PolarHBondContact O-N 3.05Å; L221-S225 WeakPolarHBondContact O-CB 3.08Å; L221-S225 PolarHBondContact O-N 3.44Å
222V73.6Confident72.7Confident13 Ų1381.2 Ų81.28%0.07942%0.416CS..Hα-helixtrans-65.9-44.1-179.4178.50000110.9M140 I218 Y219 S224 S225 S226 M239M140-V222 HydrophobicContact SD-CG2 4.25Å; I218-V222 HydrophobicContact CG2-CG2 4.4Å; I218-V222 WeakPolarHBondContact O-CG2 3.39Å; I218-V222 PolarHBondContact O-N 3.49Å; Y219-V222 PolarHBondContact O-N 2.87Å; V222-S224 VanDerWaalsContact C-N 3.32Å; V222-S224 PolarHBondContact O-N 3.48Å; V222-S225 PolarHBondContact O-N 3.42Å; V222-S226 WeakPolarHBondContact O-CB 3.47Å; V222-S226 PolarHBondContact O-N 2.89Å; V222-M239 HydrophobicContact CB-SD 4.26Å; V222-M239 HydrophobicContact CG1-CG 3.89Å; V222-M239 HydrophobicContact CG1-SD 3.44Å; V222-M239 WeakPolarHBondContact CG1-SD 3.31Å
223K75.2Confident71.3Confident93 Ų9383.6 Ų83.640%0.40443%0.427SS..Hα-helixtrans-62.6-37.8176.4-173.4172.6-177.5174.50112.4Y219 R227Y219-K223 HydrophobicContact CE1-CD 4.4Å; Y219-K223 WeakPolarHBondContact O-CB 3.17Å; Y219-K223 PolarHBondContact O-N 2.71Å; K223-R227 WeakPolarHBondContact O-CG 3.3Å; K223-R227 PolarHBondContact O-N 3.06Å; K223-R227 PolarHBondContact O-NE 2.98Å
224S72.2Confident69.9Low45 Ų4584.3 Ų84.332%0.31543%0.431SS..Hα-helixtrans-67.8-42.3175.3-169.60000111.9F220 L221 V222 R227F220-S224 VanDerWaalsContact O-CB 3.24Å; F220-S224 WeakPolarHBondContact O-CB 3.48Å; F220-S224 PolarHBondContact O-N 2.97Å; L221-S224 PolarHBondContact O-N 3.05Å; V222-S224 VanDerWaalsContact C-N 3.32Å; V222-S224 PolarHBondContact O-N 3.48Å; S224-R227 PolarHBondContact O-N 3.41Å
225S67.9Low68.7Low44 Ų4484.2 Ų84.231%0.30843%0.433SS..Hα-helixtrans-69.9-36.3178.9-168.90000113L221 V222 R227 K228 V229L221-S225 WeakPolarHBondContact O-CB 3.08Å; L221-S225 PolarHBondContact O-N 3.44Å; V222-S225 PolarHBondContact O-N 3.42Å; S225-R227 VanDerWaalsContact C-N 3.28Å; S225-R227 PolarHBondContact O-N 3.48Å; S225-K228 PolarHBondContact O-N 3.16Å; S225-V229 PolarHBondContact O-N 3.35Å
226S62.8Low67.9Low55 Ų5588.6 Ų88.639%0.38545%0.454SS..Hα-helixtrans-67.8-25.7177-1660000113.2V222 K228 S235V222-S226 WeakPolarHBondContact O-CB 3.47Å; V222-S226 PolarHBondContact O-N 2.89Å; S226-K228 VanDerWaalsContact C-N 3.33Å; S226-S235 VanDerWaalsContact CB-OG 3.24Å; S226-S235 WeakPolarHBondContact CB-OG 3.49Å; S226-S235 PolarHBondContact OG-OG 3.31Å
227R57.3Low66.9Low177 Ų17795.4 Ų95.467%0.66847%0.471SS*.Hα-helixtrans-77.9-18.3174.6-74.5-178.1-66.7-1543.9113.2K223 S224 S225K223-R227 WeakPolarHBondContact O-CG 3.3Å; K223-R227 PolarHBondContact O-N 3.06Å; K223-R227 PolarHBondContact O-NE 2.98Å; S224-R227 PolarHBondContact O-N 3.41Å; S225-R227 VanDerWaalsContact C-N 3.28Å; S225-R227 PolarHBondContact O-N 3.48Å
228K58.5Low65.9Low173 Ų17390.6 Ų90.675%0.75246%0.459SS*.Hα-helixtrans-102.5-12.7-175-69.4-177.7178.8-172.40113.9S225 S226S225-K228 PolarHBondContact O-N 3.16Å; S226-K228 VanDerWaalsContact C-N 3.33Å
229V56.2Low65.2Low82 Ų8294.2 Ų94.250%0.49748%0.477SS..  trans-134.7119.7-172.2-1760000110.4S225 N231S225-V229 PolarHBondContact O-N 3.35Å; V229-N231 HydrophobicContact CG1-CB 3.68Å; V229-N231 PolarHBondContact O-N 2.8Å
230A54.5Low64.6Low115 Ų11592.2 Ų92.295%0.9548%0.481SS*.  trans-68.919.1177.400000114.7H232A230-H232 PolarHBondContact O-N 3.45Å
231N57.3Low63.7Low94 Ų9489.5 Ų89.550%0.50347%0.472SS..  trans-102.477-174.5-142.3-5000109.9V229 N233V229-N231 HydrophobicContact CG1-CB 3.68Å; V229-N231 PolarHBondContact O-N 2.8Å; N231-N233 VanDerWaalsContact C-N 3.3Å; N231-N233 PolarHBondContact O-N 3.5Å
232H58.8Low63.1Low126 Ų12686.6 Ų86.658%0.58346%0.457SS*.Hα-helixtrans-54.2-40-169.7-153.9-96.3000113.4A230 N234 S235 E236A230-H232 PolarHBondContact O-N 3.45Å; H232-N234 PolarHBondContact O-N 3.09Å; H232-S235 PolarHBondContact O-N 3.02Å; H232-E236 IonicContact CE1-OE1 3.89Å; H232-E236 PolarHBondContact CE1-OE1 2.76Å; H232-E236 IonicContact ND1-OE1 3.81Å; H232-E236 PolarHBondContact ND1-OE1 2.89Å; H232-E236 PolarHBondContact O-N 2.85Å
233N58.5Low62.9Low117 Ų11794.9 Ų94.963%0.62649%0.487SS*.Hα-helixtrans-66.5-36.9-170.6-64.9-6.7000114.3N231 R237N231-N233 VanDerWaalsContact C-N 3.3Å; N231-N233 PolarHBondContact O-N 3.5Å; N233-R237 PolarHBondContact O-N 3.41Å
234N60.2Low62.6Low108 Ų10892 Ų9258%0.57848%0.477SS*.Hα-helixtrans-77.9-30.6178.5-77.4-25.5000112.2H232 S238H232-N234 PolarHBondContact O-N 3.09Å; N234-S238 WeakPolarHBondContact O-CB 2.95Å; N234-S238 PolarHBondContact O-N 3.2Å; N234-S238 VanDerWaalsContact O-N 3.15Å; N234-S238 PolarHBondContact O-OG 3.48Å
235S62.3Low62.4Low21 Ų2190.9 Ų90.915%0.14747%0.468CS..Hα-helixtrans-67.2-46.2174.3-172.50000110.9S226 H232 R237 S238 M239S226-S235 VanDerWaalsContact CB-OG 3.24Å; S226-S235 WeakPolarHBondContact CB-OG 3.49Å; S226-S235 PolarHBondContact OG-OG 3.31Å; H232-S235 PolarHBondContact O-N 3.02Å; S235-R237 PolarHBondContact O-N 3.41Å; S235-S238 PolarHBondContact O-N 2.84Å; S235-M239 WeakPolarHBondContact O-CB 3.43Å; S235-M239 VanDerWaalsContact O-CG 3.28Å; S235-M239 WeakPolarHBondContact O-CG 3.48Å; S235-M239 PolarHBondContact O-N 3Å
236E64.1Low62.6Low108 Ų10891.8 Ų91.851%0.50547%0.472SS..Hα-helixtrans-58.7-46.5176.9-75.5-173.2169.400112.8H232 S238 M239 A240H232-E236 IonicContact CE1-OE1 3.89Å; H232-E236 PolarHBondContact CE1-OE1 2.76Å; H232-E236 IonicContact ND1-OE1 3.81Å; H232-E236 PolarHBondContact ND1-OE1 2.89Å; H232-E236 PolarHBondContact O-N 2.85Å; E236-S238 VanDerWaalsContact C-N 3.32Å; E236-S238 PolarHBondContact O-N 3.35Å; E236-M239 PolarHBondContact O-N 3.43Å; E236-A240 WeakPolarHBondContact O-CB 3.23Å; E236-A240 PolarHBondContact O-N 2.64Å
237R62.1Low63.3Low184 Ų18492.9 Ų92.969%0.69447%0.473SS*.Hα-helixtrans-62.4-39.1177.1-173176.8-179.3175.31.1112.1N233 S235 L241N233-R237 PolarHBondContact O-N 3.41Å; S235-R237 PolarHBondContact O-N 3.41Å; R237-L241 WeakPolarHBondContact O-CG 3.5Å; R237-L241 PolarHBondContact O-N 3.22Å
238S63.6Low64Low42 Ų4285 Ų8529%0.29444%0.444SS..Hα-helixtrans-68.6-40.5177.9-57.90000111.7N234 S235 E236 L241 L242N234-S238 WeakPolarHBondContact O-CB 2.95Å; N234-S238 PolarHBondContact O-N 3.2Å; N234-S238 VanDerWaalsContact O-N 3.15Å; N234-S238 PolarHBondContact O-OG 3.48Å; S235-S238 PolarHBondContact O-N 2.84Å; E236-S238 VanDerWaalsContact C-N 3.32Å; E236-S238 PolarHBondContact O-N 3.35Å; S238-L241 PolarHBondContact O-N 3.46Å; S238-L242 WeakPolarHBondContact O-CB 3.31Å; S238-L242 PolarHBondContact O-N 3.49Å
239M66.1Low64.9Low76 Ų7677.4 Ų77.437%0.37441%0.412SS..Hα-helixtrans-67.5-37.3176.2-71.3-64.7-77.200112.6Y219 V222 S235 E236 L242 R243Y219-M239 HydrophobicContact CE2-CE 4.38Å; V222-M239 HydrophobicContact CB-SD 4.26Å; V222-M239 HydrophobicContact CG1-CG 3.89Å; V222-M239 HydrophobicContact CG1-SD 3.44Å; V222-M239 WeakPolarHBondContact CG1-SD 3.31Å; S235-M239 WeakPolarHBondContact O-CB 3.43Å; S235-M239 VanDerWaalsContact O-CG 3.28Å; S235-M239 WeakPolarHBondContact O-CG 3.48Å; S235-M239 PolarHBondContact O-N 3Å; E236-M239 PolarHBondContact O-N 3.43Å; M239-L242 PolarHBondContact O-N 3.17Å; M239-L242 HydrophobicContact SD-CD2 4.39Å; M239-R243 WeakPolarHBondContact O-CB 3.23Å; M239-R243 PolarHBondContact O-N 3.46Å
240A63.8Low66.1Low57 Ų5776.7 Ų76.747%0.47141%0.411SS..Hα-helixtrans-65.4-41.8175.500000112.4E236 R243 T244E236-A240 WeakPolarHBondContact O-CB 3.23Å; E236-A240 PolarHBondContact O-N 2.64Å; A240-R243 PolarHBondContact O-N 2.9Å; A240-T244 PolarHBondContact O-N 3.39Å; A240-T244 PolarHBondContact O-OG1 2.92Å
241L62.8Low67.6Low77 Ų7772.7 Ų72.740%0.40338%0.375SS..Hα-helixtrans-64.5-41.3174-70.6173.3000111.4R237 S238 T244 V245R237-L241 WeakPolarHBondContact O-CG 3.5Å; R237-L241 PolarHBondContact O-N 3.22Å; S238-L241 PolarHBondContact O-N 3.46Å; L241-T244 PolarHBondContact O-N 2.97Å; L241-V245 WeakPolarHBondContact O-CG2 3.48Å; L241-V245 PolarHBondContact O-N 2.91Å
242L67.3Low68.8Low11 Ų1168.4 Ų68.46%0.05835%0.351CS..Hα-helixtrans-63.2-44176.1-177.660000112.3Y215 I218 Y219 S238 M239 T244 V245 V246Y215-L242 HydrophobicContact CD1-CD1 4.16Å; I218-L242 HydrophobicContact CB-CD1 4.38Å; I218-L242 HydrophobicContact CG2-CD1 3.62Å; I218-L242 HydrophobicContact CG2-CD2 4.36Å; Y219-L242 HydrophobicContact CD2-CD2 3.76Å; Y219-L242 HydrophobicContact CG-CD2 4.33Å; S238-L242 WeakPolarHBondContact O-CB 3.31Å; S238-L242 PolarHBondContact O-N 3.49Å; M239-L242 PolarHBondContact O-N 3.17Å; M239-L242 HydrophobicContact SD-CD2 4.39Å; L242-T244 VanDerWaalsContact C-N 3.33Å; L242-T244 PolarHBondContact O-N 3.5Å; L242-V245 PolarHBondContact O-N 3.34Å; L242-V245 VanDerWaalsContact O-N 3.16Å; L242-V246 HydrophobicContact CD1-CG2 4.16Å; L242-V246 HydrophobicContact CG-CG2 4.33Å; L242-V246 WeakPolarHBondContact O-CG2 3.48Å; L242-V246 PolarHBondContact O-N 2.96Å
243R70Confident70.2Confident187 Ų18764.9 Ų64.971%0.70634%0.336SS*.Hα-helixtrans-56.3-46.7178.2-178.5-177-77.1-174.9-3.3111.6M239 A240 V245 V246 I247M239-R243 WeakPolarHBondContact O-CB 3.23Å; M239-R243 PolarHBondContact O-N 3.46Å; A240-R243 PolarHBondContact O-N 2.9Å; R243-V245 VanDerWaalsContact C-N 3.29Å; R243-V245 PolarHBondContact O-N 2.93Å; R243-V246 PolarHBondContact O-N 3.3Å; R243-I247 HydrophobicContact CG-CD1 3.96Å; R243-I247 WeakPolarHBondContact O-CD1 3.35Å; R243-I247 VanDerWaalsContact O-CG1 3.23Å; R243-I247 WeakPolarHBondContact O-CG1 3.28Å; R243-I247 PolarHBondContact O-N 2.89Å
244T67.7Low71.7Confident32 Ų3262.3 Ų62.320%0.19633%0.331CS..Hα-helixtrans-56.3-46.8177.9-62.70000111.3A240 L241 L242 I247 V248 I297 A301A240-T244 PolarHBondContact O-N 3.39Å; A240-T244 PolarHBondContact O-OG1 2.92Å; L241-T244 PolarHBondContact O-N 2.97Å; L242-T244 VanDerWaalsContact C-N 3.33Å; L242-T244 PolarHBondContact O-N 3.5Å; T244-I247 WeakPolarHBondContact O-CB 3.44Å; T244-I247 PolarHBondContact O-N 3.46Å; T244-V248 WeakPolarHBondContact O-CG2 3.37Å; T244-V248 PolarHBondContact O-N 3.19Å; T244-I297 HydrophobicContact CG2-CG2 4.15Å; T244-A301 HydrophobicContact CG2-CB 3.25Å; T244-A301 WeakPolarHBondContact OG1-CB 3.34Å
245V67.8Low73.2Confident23 Ų2357.8 Ų57.814%0.13931%0.308CS..Hα-helixtrans-75.6-35.8-172.2-178.40000112Y215 L241 L242 R243 I247 V248 V249Y215-V245 HydrophobicContact CD1-CG1 4.04Å; Y215-V245 HydrophobicContact CE1-CB 4.04Å; Y215-V245 HydrophobicContact CE1-CG1 3.17Å; Y215-V245 HydrophobicContact CE2-CG1 3.78Å; Y215-V245 WeakPolarHBondContact OH-CG1 3.24Å; L241-V245 WeakPolarHBondContact O-CG2 3.48Å; L241-V245 PolarHBondContact O-N 2.91Å; L242-V245 PolarHBondContact O-N 3.34Å; L242-V245 VanDerWaalsContact O-N 3.16Å; R243-V245 VanDerWaalsContact C-N 3.29Å; R243-V245 PolarHBondContact O-N 2.93Å; V245-I247 VanDerWaalsContact C-N 3.28Å; V245-I247 PolarHBondContact O-N 3.5Å; V245-V248 PolarHBondContact O-N 3.45Å; V245-V249 WeakPolarHBondContact O-CG2 3.41Å; V245-V249 PolarHBondContact O-N 2.69Å
246V73Confident74.6Confident62 Ų6258.1 Ų58.138%0.37631%0.306SS..Hα-helixtrans-58-44.1169.1171.20000110.1L242 R243 V248 V249 S250L242-V246 HydrophobicContact CD1-CG2 4.16Å; L242-V246 HydrophobicContact CG-CG2 4.33Å; L242-V246 WeakPolarHBondContact O-CG2 3.48Å; L242-V246 PolarHBondContact O-N 2.96Å; R243-V246 PolarHBondContact O-N 3.3Å; V246-V248 PolarHBondContact O-N 3.16Å; V246-V249 PolarHBondContact O-N 2.9Å; V246-S250 VanDerWaalsContact O-CB 3.31Å; V246-S250 WeakPolarHBondContact O-CB 3.46Å; V246-S250 PolarHBondContact O-N 3Å; V246-S250 PolarHBondContact O-OG 2.91Å
247I76.9Confident75.9Confident79 Ų7954.8 Ų54.841%0.40530%0.295SS..Hα-helixtrans-59.5-48175.9-66.9163.1000111R243 T244 V245 V249 S250 V251 I297R243-I247 HydrophobicContact CG-CD1 3.96Å; R243-I247 WeakPolarHBondContact O-CD1 3.35Å; R243-I247 VanDerWaalsContact O-CG1 3.23Å; R243-I247 WeakPolarHBondContact O-CG1 3.28Å; R243-I247 PolarHBondContact O-N 2.89Å; T244-I247 WeakPolarHBondContact O-CB 3.44Å; T244-I247 PolarHBondContact O-N 3.46Å; V245-I247 VanDerWaalsContact C-N 3.28Å; V245-I247 PolarHBondContact O-N 3.5Å; I247-V249 PolarHBondContact O-N 3.36Å; I247-S250 PolarHBondContact O-N 3.36Å; I247-V251 HydrophobicContact CG2-CG2 4.3Å; I247-V251 WeakPolarHBondContact O-CB 3.43Å; I247-V251 VanDerWaalsContact O-CG2 3.28Å; I247-V251 WeakPolarHBondContact O-CG2 3.35Å; I247-V251 PolarHBondContact O-N 3.46Å; I247-I297 HydrophobicContact CG2-CG1 4.34Å; I247-I297 HydrophobicContact CG2-CG2 4.49Å
248V73Confident77.4Confident12 Ų1247.8 Ų47.87%0.07327%0.273CS..Hα-helixtrans-55.8-49.9177.3176.70000111.3L129 T244 V245 V246 V251 F252 I297L129-V248 HydrophobicContact CD2-CG1 4.05Å; T244-V248 WeakPolarHBondContact O-CG2 3.37Å; T244-V248 PolarHBondContact O-N 3.19Å; V245-V248 PolarHBondContact O-N 3.45Å; V246-V248 PolarHBondContact O-N 3.16Å; V248-V251 PolarHBondContact O-N 3.37Å; V248-F252 WeakPolarHBondContact O-CB 3.32Å; V248-F252 PolarHBondContact O-N 3.05Å; V248-I297 HydrophobicContact CG2-CB 4.25Å; V248-I297 HydrophobicContact CG2-CD1 4.15Å; V248-I297 HydrophobicContact CG2-CG2 3.38Å
249V77.6Confident78.9Confident12 Ų1246.2 Ų46.27%0.07326%0.261CS..Hα-helixtrans-66.6-41.8-178.11740000111.4I211 Y215 V245 V246 I247 F252 I253I211-V249 HydrophobicContact CG2-CG1 3.94Å; I211-V249 HydrophobicContact CG2-CG2 3.79Å; Y215-V249 HydrophobicContact CD2-CG2 3.89Å; Y215-V249 HydrophobicContact CE2-CG2 3.57Å; V245-V249 WeakPolarHBondContact O-CG2 3.41Å; V245-V249 PolarHBondContact O-N 2.69Å; V246-V249 PolarHBondContact O-N 2.9Å; I247-V249 PolarHBondContact O-N 3.36Å; V249-F252 WeakPolarHBondContact O-CB 2.98Å; V249-F252 PolarHBondContact O-N 3.33Å; V249-I253 HydrophobicContact CG1-CD1 3.85Å; V249-I253 HydrophobicContact CG1-CG1 4.46Å; V249-I253 WeakPolarHBondContact O-CG1 3.48Å; V249-I253 PolarHBondContact O-N 2.92Å
250S81.2Confident80.3Confident67 Ų6743.2 Ų43.247%0.46925%0.246SC..Hα-helixtrans-62.8-43.3177.4-67.90000112V246 I247 F252 I253 A254V246-S250 VanDerWaalsContact O-CB 3.31Å; V246-S250 WeakPolarHBondContact O-CB 3.46Å; V246-S250 PolarHBondContact O-N 3Å; V246-S250 PolarHBondContact O-OG 2.91Å; I247-S250 PolarHBondContact O-N 3.36Å; S250-F252 VanDerWaalsContact C-N 3.35Å; S250-I253 PolarHBondContact O-N 3.32Å; S250-A254 WeakPolarHBondContact O-CB 3.44Å; S250-A254 PolarHBondContact O-N 2.92Å
251V85.3Confident81.8Confident32 Ų3245.1 Ų45.119%0.19425%0.248CC..Hα-helixtrans-64.7-40.9175.6172.90000110.6I247 V248 A254 C255 M293 I297I247-V251 HydrophobicContact CG2-CG2 4.3Å; I247-V251 WeakPolarHBondContact O-CB 3.43Å; I247-V251 VanDerWaalsContact O-CG2 3.28Å; I247-V251 WeakPolarHBondContact O-CG2 3.35Å; I247-V251 PolarHBondContact O-N 3.46Å; V248-V251 PolarHBondContact O-N 3.37Å; V251-A254 PolarHBondContact O-N 2.91Å; V251-C255 WeakPolarHBondContact O-CB 3.17Å; V251-C255 PolarHBondContact O-N 3.01Å; V251-C255 PolarHBondContact O-SG 2.89Å; V251-M293 HydrophobicContact CG1-CB 3.84Å; V251-M293 HydrophobicContact CG1-CG 4Å; V251-I297 HydrophobicContact CB-CD1 4.37Å; V251-I297 HydrophobicContact CG1-CD1 4.47Å; V251-I297 HydrophobicContact CG2-CD1 4.39Å
252F83.4Confident83.3Confident3 Ų341.6 Ų41.61%0.01323%0.229CC..Hα-helixtrans-57.7-52.2174.1-168.9-80.9000111.9L122 T126 L129 L208 V248 V249 S250 A254 C255 W256 N290L122-F252 HydrophobicContact CD1-CZ 3.99Å; T126-F252 WeakPolarHBondContact OG1-CZ 3.24Å; L129-F252 HydrophobicContact CD1-CB 4.47Å; L129-F252 HydrophobicContact CD1-CD2 3.48Å; L129-F252 VanDerWaalsContact CD1-CD2 3.48Å; L129-F252 HydrophobicContact CD1-CE2 3.75Å; L129-F252 HydrophobicContact CD1-CG 3.91Å; L129-F252 HydrophobicContact CD1-CZ 4.4Å; L208-F252 HydrophobicContact CD1-CE1 4.29Å; L208-F252 HydrophobicContact CD2-CD1 3.62Å; L208-F252 HydrophobicContact CD2-CE1 3.61Å; L208-F252 HydrophobicContact CG-CE1 4.46Å; V248-F252 WeakPolarHBondContact O-CB 3.32Å; V248-F252 PolarHBondContact O-N 3.05Å; V249-F252 WeakPolarHBondContact O-CB 2.98Å; V249-F252 PolarHBondContact O-N 3.33Å; S250-F252 VanDerWaalsContact C-N 3.35Å; F252-A254 PolarHBondContact O-N 2.95Å; F252-C255 PolarHBondContact O-N 3.27Å; F252-W256 AromaticContact CD1-CD1 3.7Å; F252-W256 HydrophobicContact CD1-CG 4.33Å; F252-W256 AromaticContact CD2-CD1 3.75Å; F252-W256 AromaticContact CD2-NE1 3.82Å; F252-W256 HydrophobicContact CE1-CB 4.27Å; F252-W256 AromaticContact CE1-CD1 3.5Å; F252-W256 VanDerWaalsContact CE1-CD1 3.5Å; F252-W256 AromaticContact CE1-CG 3.9Å; F252-W256 HydrophobicContact CE1-CG 3.9Å; F252-W256 AromaticContact CE2-CD1 3.58Å; F252-W256 AromaticContact CE2-NE1 3.38Å; F252-W256 AromaticContact CG-CD1 3.82Å; F252-W256 AromaticContact CZ-CD1 3.45Å; F252-W256 VanDerWaalsContact CZ-CD1 3.45Å; F252-W256 HydrophobicContact CZ-CD2 4.41Å; F252-W256 HydrophobicContact CZ-CG 4.03Å; F252-W256 AromaticContact CZ-NE1 3.52Å; F252-W256 WeakPolarHBondContact O-CB 3.4Å; F252-W256 VanDerWaalsContact O-CD1 3.25Å; F252-W256 PolarHBondContact O-N 3.41Å; F252-N290 VanDerWaalsContact CA-ND2 3.29Å; F252-N290 WeakPolarHBondContact CA-ND2 3.38Å; F252-N290 WeakPolarHBondContact CD2-OD1 3.24Å
253I87.6Confident84.7Confident52 Ų5241.9 Ų41.927%0.26723%0.23SC..Hα-helixtrans-60.8-45.6179.3-66.8168.8000110.5L208 V212 V249 S250 C255 W256 S257L208-I253 HydrophobicContact CD2-CG1 4.46Å; V212-I253 HydrophobicContact CG2-CD1 3.74Å; V249-I253 HydrophobicContact CG1-CD1 3.85Å; V249-I253 HydrophobicContact CG1-CG1 4.46Å; V249-I253 WeakPolarHBondContact O-CG1 3.48Å; V249-I253 PolarHBondContact O-N 2.92Å; S250-I253 PolarHBondContact O-N 3.32Å; I253-C255 VanDerWaalsContact C-N 3.35Å; I253-C255 PolarHBondContact O-N 3.45Å; I253-W256 PolarHBondContact O-N 3.2Å; I253-S257 WeakPolarHBondContact CG2-OG 3.31Å; I253-S257 WeakPolarHBondContact O-CB 3.42Å; I253-S257 PolarHBondContact O-N 3.17Å; I253-S257 PolarHBondContact O-OG 2.91Å
254A90.4Very high85.9Confident63 Ų6337.4 Ų37.452%0.52122%0.219SC..Hα-helixtrans-61.4-40-179.600000113.1S250 V251 F252 P258S250-A254 WeakPolarHBondContact O-CB 3.44Å; S250-A254 PolarHBondContact O-N 2.92Å; V251-A254 PolarHBondContact O-N 2.91Å; F252-A254 PolarHBondContact O-N 2.95Å; A254-P258 WeakPolarHBondContact O-CD 3.39Å
255C91.2Very high87.2Confident14 Ų1438.7 Ų38.710%0.09522%0.224CC..Hα-helixtrans-74.5-38.9179.5-68.70000113V251 F252 I253 N290V251-C255 WeakPolarHBondContact O-CB 3.17Å; V251-C255 PolarHBondContact O-N 3.01Å; V251-C255 PolarHBondContact O-SG 2.89Å; F252-C255 PolarHBondContact O-N 3.27Å; I253-C255 VanDerWaalsContact C-N 3.35Å; I253-C255 PolarHBondContact O-N 3.45Å; C255-N290 HydrophobicContact CB-CB 3.76Å
256W91Very high88.5Confident27 Ų2737.6 Ų37.610%0.10222%0.218CC..Hα-helixtrans-90.3-29.2-173-75.797.5000114.2L122 F252 I253 L259 F260 A287L122-W256 HydrophobicContact CB-CH2 3.93Å; L122-W256 HydrophobicContact CB-CZ2 4.46Å; L122-W256 HydrophobicContact CB-CZ3 4.34Å; L122-W256 HydrophobicContact CD1-CD2 3.86Å; L122-W256 HydrophobicContact CD1-CE3 3.79Å; L122-W256 HydrophobicContact CD1-CH2 3.65Å; L122-W256 HydrophobicContact CD1-CZ2 3.71Å; L122-W256 HydrophobicContact CD1-CZ3 3.69Å; L122-W256 HydrophobicContact CD2-CE3 4.15Å; L122-W256 HydrophobicContact CD2-CH2 4.14Å; L122-W256 HydrophobicContact CD2-CZ3 3.68Å; L122-W256 HydrophobicContact CG-CH2 4.1Å; L122-W256 HydrophobicContact CG-CZ3 4.09Å; F252-W256 AromaticContact CD1-CD1 3.7Å; F252-W256 HydrophobicContact CD1-CG 4.33Å; F252-W256 AromaticContact CD2-CD1 3.75Å; F252-W256 AromaticContact CD2-NE1 3.82Å; F252-W256 HydrophobicContact CE1-CB 4.27Å; F252-W256 AromaticContact CE1-CD1 3.5Å; F252-W256 VanDerWaalsContact CE1-CD1 3.5Å; F252-W256 AromaticContact CE1-CG 3.9Å; F252-W256 HydrophobicContact CE1-CG 3.9Å; F252-W256 AromaticContact CE2-CD1 3.58Å; F252-W256 AromaticContact CE2-NE1 3.38Å; F252-W256 AromaticContact CG-CD1 3.82Å; F252-W256 AromaticContact CZ-CD1 3.45Å; F252-W256 VanDerWaalsContact CZ-CD1 3.45Å; F252-W256 HydrophobicContact CZ-CD2 4.41Å; F252-W256 HydrophobicContact CZ-CG 4.03Å; F252-W256 AromaticContact CZ-NE1 3.52Å; F252-W256 WeakPolarHBondContact O-CB 3.4Å; F252-W256 VanDerWaalsContact O-CD1 3.25Å; F252-W256 PolarHBondContact O-N 3.41Å; I253-W256 PolarHBondContact O-N 3.2Å; W256-L259 HydrophobicContact CE3-CD2 4.15Å; W256-L259 HydrophobicContact CZ3-CD2 3.92Å; W256-L259 PolarHBondContact O-N 3.19Å; W256-L259 VanDerWaalsContact O-N 3.11Å; W256-F260 HydrophobicContact CE3-CE1 4.03Å; W256-F260 PolarHBondContact O-N 3.46Å; W256-A287 HydrophobicContact CD2-CB 3.96Å; W256-A287 HydrophobicContact CE3-CB 3.77Å; W256-A287 HydrophobicContact CH2-CB 4.13Å; W256-A287 HydrophobicContact CZ2-CB 4.32Å; W256-A287 HydrophobicContact CZ3-CB 3.85Å
257S91.8Very high89.6Confident39 Ų3936.7 Ų36.727%0.27321%0.212SC..Hα-helixtrans-57.3-42.8-176.8-59.60000113.7I253 L259 F260 I261I253-S257 WeakPolarHBondContact CG2-OG 3.31Å; I253-S257 WeakPolarHBondContact O-CB 3.42Å; I253-S257 PolarHBondContact O-N 3.17Å; I253-S257 PolarHBondContact O-OG 2.91Å; S257-L259 VanDerWaalsContact C-N 3.26Å; S257-L259 PolarHBondContact O-N 3.41Å; S257-F260 PolarHBondContact O-N 3.48Å; S257-I261 VanDerWaalsContact O-CG1 3.28Å; S257-I261 WeakPolarHBondContact O-CG1 3.39Å; S257-I261 PolarHBondContact O-N 2.88Å
258P95.1Very high90.4Very high36 Ų3637.1 Ų37.123%0.23423%0.228CC..Hα-helixtrans-59.1-37.5178-26.637.9000112.7A254 L262 F283 L286A254-P258 WeakPolarHBondContact O-CD 3.39Å; P258-L262 WeakPolarHBondContact O-CB 3.45Å; P258-L262 PolarHBondContact O-N 3.47Å; P258-F283 HydrophobicContact CB-CD1 3.76Å; P258-F283 HydrophobicContact CB-CE1 4.25Å; P258-L286 HydrophobicContact CB-CD2 4.21Å; P258-L286 HydrophobicContact CG-CD2 3.82Å
259L94.1Very high91.4Very high9 Ų937.6 Ų37.65%0.04723%0.231CC..Hα-helixtrans-72.5-39.6177.4-176.762.2000111.9W256 S257 L262 F263 F283 I284 A287W256-L259 HydrophobicContact CE3-CD2 4.15Å; W256-L259 HydrophobicContact CZ3-CD2 3.92Å; W256-L259 PolarHBondContact O-N 3.19Å; W256-L259 VanDerWaalsContact O-N 3.11Å; S257-L259 VanDerWaalsContact C-N 3.26Å; S257-L259 PolarHBondContact O-N 3.41Å; L259-L262 HydrophobicContact CD1-CD2 4.42Å; L259-L262 WeakPolarHBondContact O-CB 3.38Å; L259-L262 PolarHBondContact O-N 2.96Å; L259-F263 HydrophobicContact CD1-CD2 4.32Å; L259-F263 HydrophobicContact CD1-CE2 3.84Å; L259-F263 HydrophobicContact CD1-CZ 4.08Å; L259-F263 HydrophobicContact CD2-CE2 4Å; L259-F263 HydrophobicContact CG-CD2 4.02Å; L259-F263 HydrophobicContact CG-CE2 3.6Å; L259-F263 HydrophobicContact CG-CZ 4.3Å; L259-F263 VanDerWaalsContact O-CD2 3.27Å; L259-F263 WeakPolarHBondContact O-CD2 3.35Å; L259-F263 PolarHBondContact O-N 3.24Å; L259-F283 HydrophobicContact CB-CB 4.48Å; L259-F283 HydrophobicContact CD1-CB 4.06Å; L259-I284 HydrophobicContact CD1-CG1 3.89Å; L259-I284 HydrophobicContact CD2-CG1 4.48Å; L259-A287 HydrophobicContact CB-CB 4.43Å; L259-A287 HydrophobicContact CD2-CB 3.78Å
260F94.7Very high92Very high13 Ų1347.1 Ų47.16%0.05727%0.266CS..Hα-helixtrans-63.7-42.8175.1-74.22.8000111.9L122 F204 L208 W256 S257 L262 F263 L264L122-F260 HydrophobicContact CD2-CE1 4.06Å; L122-F260 HydrophobicContact CD2-CZ 4.31Å; F204-F260 HydrophobicContact CB-CE2 3.82Å; F204-F260 HydrophobicContact CB-CZ 3.65Å; F204-F260 HydrophobicContact CD2-CZ 4.16Å; F204-F260 HydrophobicContact CG-CZ 4.21Å; L208-F260 HydrophobicContact CD1-CD2 4.44Å; L208-F260 HydrophobicContact CD1-CE2 3.77Å; W256-F260 HydrophobicContact CE3-CE1 4.03Å; W256-F260 PolarHBondContact O-N 3.46Å; S257-F260 PolarHBondContact O-N 3.48Å; F260-L262 VanDerWaalsContact C-N 3.31Å; F260-L262 PolarHBondContact O-N 2.96Å; F260-F263 PolarHBondContact O-N 2.96Å; F260-L264 WeakPolarHBondContact O-CG 3.3Å; F260-L264 PolarHBondContact O-N 2.79Å
261I95.4Very high92.3Very high98 Ų9845.2 Ų45.250%0.50325%0.251SS..Hα-helixtrans-60.3-44.5173.5-67164.6000110S257 F263 L264 I265S257-I261 VanDerWaalsContact O-CG1 3.28Å; S257-I261 WeakPolarHBondContact O-CG1 3.39Å; S257-I261 PolarHBondContact O-N 2.88Å; I261-F263 VanDerWaalsContact C-N 3.32Å; I261-F263 PolarHBondContact O-N 2.94Å; I261-L264 PolarHBondContact O-N 2.9Å; I261-L264 VanDerWaalsContact O-N 3.17Å; I261-I265 HydrophobicContact CG2-CD1 4Å; I261-I265 WeakPolarHBondContact O-CG1 3.37Å; I261-I265 PolarHBondContact O-N 3.23Å
262L95.9Very high92.3Very high2 Ų249 Ų491%0.0127%0.267CS..Hα-helixtrans-60.5-40.8178-169.573.8000112.3I188 P258 L259 F260 I265 D266 V276 L277 A280 F283I188-L262 HydrophobicContact CD1-CD2 3.81Å; I188-L262 HydrophobicContact CD1-CG 3.76Å; P258-L262 WeakPolarHBondContact O-CB 3.45Å; P258-L262 PolarHBondContact O-N 3.47Å; L259-L262 HydrophobicContact CD1-CD2 4.42Å; L259-L262 WeakPolarHBondContact O-CB 3.38Å; L259-L262 PolarHBondContact O-N 2.96Å; F260-L262 VanDerWaalsContact C-N 3.31Å; F260-L262 PolarHBondContact O-N 2.96Å; L262-I265 WeakPolarHBondContact O-CB 3.44Å; L262-I265 PolarHBondContact O-N 3.5Å; L262-D266 PolarHBondContact O-N 3.44Å; L262-V276 HydrophobicContact CD1-CB 4.46Å; L262-V276 HydrophobicContact CD1-CG1 4.04Å; L262-V276 HydrophobicContact CD1-CG2 3.81Å; L262-L277 HydrophobicContact CD1-CD2 4.06Å; L262-L277 HydrophobicContact CG-CD2 4.24Å; L262-A280 HydrophobicContact CD2-CB 3.78Å; L262-F283 HydrophobicContact CD1-CD2 4.43Å; L262-F283 HydrophobicContact CD1-CE2 4.2Å; L262-F283 HydrophobicContact CD1-CZ 4.34Å; L262-F283 HydrophobicContact CD2-CB 4.02Å; L262-F283 HydrophobicContact CD2-CD2 3.72Å; L262-F283 HydrophobicContact CD2-CE2 4.29Å; L262-F283 HydrophobicContact CD2-CG 3.84Å
263F95.7Very high92.6Very high18 Ų1851.9 Ų51.98%0.07929%0.292CS..Hα-helixtrans-68.8-36.7174.7-73.3-55.1000113.1I188 L189 I197 I201 L259 F260 I261 I265 D266 V267I188-F263 HydrophobicContact CB-CD1 4.34Å; I188-F263 HydrophobicContact CB-CE1 3.99Å; I188-F263 HydrophobicContact CD1-CD1 3.6Å; I188-F263 HydrophobicContact CD1-CE1 3.89Å; I188-F263 HydrophobicContact CD1-CG 4.43Å; I188-F263 HydrophobicContact CG2-CD1 4.38Å; I188-F263 HydrophobicContact CG2-CE1 3.62Å; I188-F263 HydrophobicContact CG2-CZ 4.39Å; L189-F263 HydrophobicContact CD1-CD1 4.33Å; L189-F263 HydrophobicContact CD1-CE1 3.37Å; L189-F263 HydrophobicContact CD1-CZ 3.88Å; I197-F263 HydrophobicContact CG2-CB 3.94Å; I197-F263 HydrophobicContact CG2-CD1 3.99Å; I197-F263 HydrophobicContact CG2-CG 4.08Å; I201-F263 HydrophobicContact CD1-CB 3.22Å; I201-F263 HydrophobicContact CD1-CD2 4.34Å; I201-F263 HydrophobicContact CD1-CG 4.07Å; I201-F263 HydrophobicContact CG1-CB 4.3Å; L259-F263 HydrophobicContact CD1-CD2 4.32Å; L259-F263 HydrophobicContact CD1-CE2 3.84Å; L259-F263 HydrophobicContact CD1-CZ 4.08Å; L259-F263 HydrophobicContact CD2-CE2 4Å; L259-F263 HydrophobicContact CG-CD2 4.02Å; L259-F263 HydrophobicContact CG-CE2 3.6Å; L259-F263 HydrophobicContact CG-CZ 4.3Å; L259-F263 VanDerWaalsContact O-CD2 3.27Å; L259-F263 WeakPolarHBondContact O-CD2 3.35Å; L259-F263 PolarHBondContact O-N 3.24Å; F260-F263 PolarHBondContact O-N 2.96Å; I261-F263 VanDerWaalsContact C-N 3.32Å; I261-F263 PolarHBondContact O-N 2.94Å; F263-I265 VanDerWaalsContact C-N 3.28Å; F263-I265 PolarHBondContact O-N 2.87Å; F263-D266 WeakPolarHBondContact O-CB 3.42Å; F263-D266 PolarHBondContact O-N 3.28Å; F263-D266 VanDerWaalsContact O-N 3.14Å; F263-V267 WeakPolarHBondContact O-CG2 3.31Å; F263-V267 PolarHBondContact O-N 3.41Å
264L95.8Very high92.8Very high92 Ų9250.7 Ų50.748%0.48229%0.287SS..Hα-helixtrans-61.6-40173-71.4172.9000111.2I201 F260 I261 D266 V267 A268I201-L264 HydrophobicContact CG2-CD2 4.01Å; I201-L264 HydrophobicContact CG2-CG 4.2Å; F260-L264 WeakPolarHBondContact O-CG 3.3Å; F260-L264 PolarHBondContact O-N 2.79Å; I261-L264 PolarHBondContact O-N 2.9Å; I261-L264 VanDerWaalsContact O-N 3.17Å; L264-D266 VanDerWaalsContact C-N 3.35Å; L264-V267 PolarHBondContact O-N 2.91Å; L264-A268 WeakPolarHBondContact O-CB 3.39Å; L264-A268 PolarHBondContact O-N 3.34Å
265I95.6Very high92.8Very high59 Ų5952.6 Ų52.630%0.30329%0.294SS..Hα-helixtrans-60.9-44.2171.9-66.6167.1000110.3I261 L262 F263 V267 A268 C269 C274 V276 L277I261-I265 HydrophobicContact CG2-CD1 4Å; I261-I265 WeakPolarHBondContact O-CG1 3.37Å; I261-I265 PolarHBondContact O-N 3.23Å; L262-I265 WeakPolarHBondContact O-CB 3.44Å; L262-I265 PolarHBondContact O-N 3.5Å; F263-I265 VanDerWaalsContact C-N 3.28Å; F263-I265 PolarHBondContact O-N 2.87Å; I265-V267 VanDerWaalsContact C-N 3.32Å; I265-V267 PolarHBondContact O-N 3.27Å; I265-A268 PolarHBondContact O-N 3.13Å; I265-C269 VanDerWaalsContact CG2-SG 3.54Å; I265-C269 WeakPolarHBondContact O-CB 3.39Å; I265-C269 PolarHBondContact O-N 3.25Å; I265-C269 PolarHBondContact O-SG 3.23Å; I265-C274 HydrophobicContact CG2-CB 4.46Å; I265-V276 HydrophobicContact CG2-CG1 4.2Å; I265-L277 HydrophobicContact CG2-CD2 4.18Å
266D95Very high92.9Very high0 Ų054.7 Ų54.70%031%0.307CS..Hα-helixtrans-62.6-37.8178.2-168.223.9000113.1S186 T187 I188 K194 L262 F263 L264 L277S186-D266 WeakPolarHBondContact CB-OD2 3.37Å; S186-D266 PolarHBondContact OG-OD2 3.15Å; T187-D266 WeakPolarHBondContact CA-OD1 3.45Å; T187-D266 WeakPolarHBondContact CB-OD1 3.27Å; T187-D266 PolarHBondContact N-OD1 3.41Å; T187-D266 PolarHBondContact N-OD2 2.94Å; T187-D266 VanDerWaalsContact N-OD2 3.15Å; T187-D266 PolarHBondContact OG1-OD1 2.9Å; I188-D266 HydrophobicContact CD1-CB 3.84Å; I188-D266 HydrophobicContact CG1-CB 4.19Å; I188-D266 PolarHBondContact N-OD2 3.5Å; K194-D266 VanDerWaalsContact CE-O 3.23Å; K194-D266 WeakPolarHBondContact CE-O 3.13Å; K194-D266 PolarHBondContact NZ-O 3.38Å; L262-D266 PolarHBondContact O-N 3.44Å; F263-D266 WeakPolarHBondContact O-CB 3.42Å; F263-D266 PolarHBondContact O-N 3.28Å; F263-D266 VanDerWaalsContact O-N 3.14Å; L264-D266 VanDerWaalsContact C-N 3.35Å; D266-L277 HydrophobicContact CB-CD1 4.27Å; D266-L277 HydrophobicContact CB-CD2 3.72Å
267V94.9Very high92.9Very high43 Ų4353.4 Ų53.426%0.26130%0.302SS..Hα-helixtrans-66.7-42.3175.2171.70000111K194 I197 A198 F263 L264 I265K194-V267 HydrophobicContact CB-CG2 4.32Å; K194-V267 WeakPolarHBondContact O-CG2 3.22Å; I197-V267 HydrophobicContact CB-CG2 4.39Å; I197-V267 HydrophobicContact CG2-CG2 4.13Å; A198-V267 HydrophobicContact CB-CG1 4.06Å; A198-V267 HydrophobicContact CB-CG2 4.13Å; F263-V267 WeakPolarHBondContact O-CG2 3.31Å; F263-V267 PolarHBondContact O-N 3.41Å; L264-V267 PolarHBondContact O-N 2.91Å; I265-V267 VanDerWaalsContact C-N 3.32Å; I265-V267 PolarHBondContact O-N 3.27Å
268A94.1Very high92.7Very high88 Ų8855 Ų5573%0.72730%0.304SS*.Hα-helixtrans-79.9-30.2-17700000113.8L264 I265L264-A268 WeakPolarHBondContact O-CB 3.39Å; L264-A268 PolarHBondContact O-N 3.34Å; I265-A268 PolarHBondContact O-N 3.13Å
269C93.1Very high92.4Very high22 Ų2261.7 Ų61.715%0.14933%0.325CS..SBendtrans-79.8148.4-178.4-76.90000112K194 I265 C274 L277K194-C269 PolarHBondContact NZ-O 3.48Å; I265-C269 VanDerWaalsContact CG2-SG 3.54Å; I265-C269 WeakPolarHBondContact O-CB 3.39Å; I265-C269 PolarHBondContact O-N 3.25Å; I265-C269 PolarHBondContact O-SG 3.23Å; C269-C274 HydrophobicContact CB-CB 3.83Å; C269-C274 WeakPolarHBondContact CB-SG 3.35Å; C269-C274 WeakPolarHBondContact SG-CB 2.98Å; C269-C274 CovalentContact SG-SG 2.04Å; C269-C274 PolarHBondContact SG-SG 3.34Å; C269-L277 HydrophobicContact CB-CD1 4.35Å
270R90.4Very high92.1Very high212 Ų21261.5 Ų61.580%0.832%0.324SS*.PPolyproline II helixtrans-68.9151.1162.8-65.3-175.5-176.7-1751.2110A273R270-A273 HydrophobicContact CB-CB 4.18Å; R270-A273 WeakPolarHBondContact O-CB 3.44Å; R270-A273 PolarHBondContact O-N 3.08Å
271V88.4Confident91.7Very high27 Ų2763.3 Ų63.316%0.16433%0.333CS..THydrogen-bonded Turntrans-57.2139.8177.51770000109.4Y24 V25 A273Y24-V271 HydrophobicContact CD1-CG1 4.17Å; Y24-V271 HydrophobicContact CE1-CB 4.22Å; Y24-V271 HydrophobicContact CE1-CG1 3.98Å; Y24-V271 HydrophobicContact CE1-CG2 3.95Å; V25-V271 HydrophobicContact CB-CG1 4.11Å; V25-V271 HydrophobicContact CG1-CG1 4.08Å; V271-A273 PolarHBondContact O-N 2.87Å
272Q85.3Confident91.4Very high111 Ų11165 Ų6552%0.51933%0.333SS..THydrogen-bonded Turntrans64.1-5.1-175.8-63171.7-15.400117.1Y24Y24-Q272 PolarHBondContact O-NE2 3.47Å
273A89.6Confident91.3Very high65 Ų6567.6 Ų67.654%0.53735%0.345SS..THydrogen-bonded Turntrans-78.3-29.2-175.700000114.2R270 V271 P275R270-A273 HydrophobicContact CB-CB 4.18Å; R270-A273 WeakPolarHBondContact O-CB 3.44Å; R270-A273 PolarHBondContact O-N 3.08Å; V271-A273 PolarHBondContact O-N 2.87Å; A273-P275 WeakPolarHBondContact O-CD 3.46Å
274C92.4Very high91.1Very high26 Ų2668.8 Ų68.818%0.17635%0.351CS..  trans-110.9104.1-168.6-66.20000111.2I265 C269 V276 L277I265-C274 HydrophobicContact CG2-CB 4.46Å; C269-C274 HydrophobicContact CB-CB 3.83Å; C269-C274 WeakPolarHBondContact CB-SG 3.35Å; C269-C274 WeakPolarHBondContact SG-CB 2.98Å; C269-C274 CovalentContact SG-SG 2.04Å; C269-C274 PolarHBondContact SG-SG 3.34Å; C274-V276 PolarHBondContact O-N 3.43Å; C274-V276 VanDerWaalsContact O-N 3.17Å; C274-L277 HydrophobicContact CB-CD1 3.76Å; C274-L277 HydrophobicContact CB-CG 4.01Å; C274-L277 WeakPolarHBondContact O-CB 3.26Å; C274-L277 WeakPolarHBondContact O-CG 3.41Å; C274-L277 PolarHBondContact O-N 3.42Å
275P90.2Very high90.8Very high103 Ų10365 Ų6567%0.66933%0.332SS*.G310 helixtrans-61.5-28-173.8-25.735.2000114.4A273 L277 F278A273-P275 WeakPolarHBondContact O-CD 3.46Å; P275-L277 PolarHBondContact O-N 2.97Å; P275-F278 PolarHBondContact O-N 3.34Å
276V92Very high90.6Very high58 Ų5865.5 Ų65.535%0.35234%0.335SS..G310 helixtrans-59-29.6179.869.20000112.6L262 I265 C274 F278 R279 F283L262-V276 HydrophobicContact CD1-CB 4.46Å; L262-V276 HydrophobicContact CD1-CG1 4.04Å; L262-V276 HydrophobicContact CD1-CG2 3.81Å; I265-V276 HydrophobicContact CG2-CG1 4.2Å; C274-V276 PolarHBondContact O-N 3.43Å; C274-V276 VanDerWaalsContact O-N 3.17Å; V276-F278 PolarHBondContact O-N 2.88Å; V276-R279 PolarHBondContact O-N 3.39Å; V276-R279 VanDerWaalsContact O-N 3.08Å; V276-F283 HydrophobicContact CG2-CE2 4.29Å; V276-F283 HydrophobicContact CG2-CZ 4.17Å
277L91.1Very high90.4Very high1 Ų165.5 Ų65.51%0.00534%0.335CS..G310 helixtrans-68.1-18.3-178.6-58.4176.4000113.6K27 T187 I188 L262 I265 D266 C269 C274 P275K27-L277 PolarHBondContact NZ-O 2.9Å; T187-L277 HydrophobicContact CG2-CB 3.93Å; T187-L277 HydrophobicContact CG2-CD1 4.17Å; I188-L277 HydrophobicContact CD1-CD2 3.93Å; I188-L277 HydrophobicContact CG1-CD2 4.09Å; L262-L277 HydrophobicContact CD1-CD2 4.06Å; L262-L277 HydrophobicContact CG-CD2 4.24Å; I265-L277 HydrophobicContact CG2-CD2 4.18Å; D266-L277 HydrophobicContact CB-CD1 4.27Å; D266-L277 HydrophobicContact CB-CD2 3.72Å; C269-L277 HydrophobicContact CB-CD1 4.35Å; C274-L277 HydrophobicContact CB-CD1 3.76Å; C274-L277 HydrophobicContact CB-CG 4.01Å; C274-L277 WeakPolarHBondContact O-CB 3.26Å; C274-L277 WeakPolarHBondContact O-CG 3.41Å; C274-L277 PolarHBondContact O-N 3.42Å; P275-L277 PolarHBondContact O-N 2.97Å
278F88.3Confident90.2Very high72 Ų7263.8 Ų63.832%0.31632%0.324SS..G310 helixtrans-83.7-12.9176.1-63.6-86.3000112.7K27 T187 P275 V276K27-F278 HydrophobicContact CG-CD1 3.8Å; K27-F278 HydrophobicContact CG-CE1 3.72Å; T187-F278 HydrophobicContact CG2-CZ 4.28Å; P275-F278 PolarHBondContact O-N 3.34Å; V276-F278 PolarHBondContact O-N 2.88Å
279R88.1Confident89.9Confident176 Ų17662.6 Ų62.666%0.66431%0.305SS*.G310 helixtrans-103.722.5176.6-61.2-169.5-177.3-1782.3113V276 Q281 W282V276-R279 PolarHBondContact O-N 3.39Å; V276-R279 VanDerWaalsContact O-N 3.08Å; R279-Q281 PolarHBondContact O-N 2.94Å; R279-Q281 VanDerWaalsContact O-N 3.09Å; R279-W282 PolarHBondContact O-N 3.44Å
280A89.2Confident89.7Confident5 Ų561.6 Ų61.64%0.04130%0.299CS..Hα-helixtrans-57.6-25.6-17500000114.3I188 L262 W282 F283 I284I188-A280 HydrophobicContact CG1-CB 4.4Å; I188-A280 HydrophobicContact CG2-CB 4.16Å; L262-A280 HydrophobicContact CD2-CB 3.78Å; A280-W282 VanDerWaalsContact C-N 3.26Å; A280-W282 PolarHBondContact O-N 3.11Å; A280-F283 PolarHBondContact O-N 2.99Å; A280-F283 VanDerWaalsContact O-N 3.16Å; A280-I284 HydrophobicContact CB-CD1 4.44Å; A280-I284 WeakPolarHBondContact O-CG1 3.24Å; A280-I284 PolarHBondContact O-N 3.34Å
281Q86.1Confident89.6Confident51 Ų5151.7 Ų51.724%0.23826%0.262CS..Hα-helixtrans-55.4-37.6-179.757.3-99.515.500113.7F46 R279 F283 I284 V285F46-Q281 HydrophobicContact CE2-CB 4.41Å; R279-Q281 PolarHBondContact O-N 2.94Å; R279-Q281 VanDerWaalsContact O-N 3.09Å; Q281-F283 PolarHBondContact O-N 3.44Å; Q281-I284 PolarHBondContact O-N 3.42Å; Q281-V285 VanDerWaalsContact O-CG2 3.31Å; Q281-V285 WeakPolarHBondContact O-CG2 3.38Å; Q281-V285 PolarHBondContact O-N 3.15Å
282W89.4Confident89.6Confident135 Ų13551 Ų5151%0.51126%0.259SS..Hα-helixtrans-68.2-37.6-178.4-62.8109.3000112.3T42 F46 R279 A280 L286T42-W282 HydrophobicContact CG2-CH2 4.13Å; T42-W282 HydrophobicContact CG2-CZ2 4.39Å; F46-W282 HydrophobicContact CE1-CE3 4.42Å; F46-W282 AromaticContact CE1-CZ3 3.99Å; F46-W282 HydrophobicContact CE1-CZ3 3.99Å; F46-W282 AromaticContact CZ-CE3 3.98Å; F46-W282 HydrophobicContact CZ-CE3 3.98Å; F46-W282 HydrophobicContact CZ-CH2 4.21Å; F46-W282 AromaticContact CZ-CZ3 3.77Å; F46-W282 HydrophobicContact CZ-CZ3 3.77Å; R279-W282 PolarHBondContact O-N 3.44Å; A280-W282 VanDerWaalsContact C-N 3.26Å; A280-W282 PolarHBondContact O-N 3.11Å; W282-L286 WeakPolarHBondContact O-CB 3.32Å; W282-L286 PolarHBondContact O-N 3.32Å
283F93.2Very high89.6Confident56 Ų5649.4 Ų49.425%0.24625%0.253CS..Hα-helixtrans-69.4-38.9175.6-61.1-94.1000111.4P258 L259 L262 V276 A280 Q281 L286 A287P258-F283 HydrophobicContact CB-CD1 3.76Å; P258-F283 HydrophobicContact CB-CE1 4.25Å; L259-F283 HydrophobicContact CB-CB 4.48Å; L259-F283 HydrophobicContact CD1-CB 4.06Å; L262-F283 HydrophobicContact CD1-CD2 4.43Å; L262-F283 HydrophobicContact CD1-CE2 4.2Å; L262-F283 HydrophobicContact CD1-CZ 4.34Å; L262-F283 HydrophobicContact CD2-CB 4.02Å; L262-F283 HydrophobicContact CD2-CD2 3.72Å; L262-F283 HydrophobicContact CD2-CE2 4.29Å; L262-F283 HydrophobicContact CD2-CG 3.84Å; V276-F283 HydrophobicContact CG2-CE2 4.29Å; V276-F283 HydrophobicContact CG2-CZ 4.17Å; A280-F283 PolarHBondContact O-N 2.99Å; A280-F283 VanDerWaalsContact O-N 3.16Å; Q281-F283 PolarHBondContact O-N 3.44Å; F283-L286 PolarHBondContact O-N 3.44Å; F283-A287 PolarHBondContact O-N 2.96Å
284I90.6Very high89.2Confident42 Ų4246.5 Ų46.522%0.21523%0.228CC..Hα-helixtrans-65.9-43.6176.4-63.4166.3000110.5Y92 L259 A280 Q281 L286 A287 V288Y92-I284 HydrophobicContact CD2-CG2 4.17Å; Y92-I284 HydrophobicContact CE2-CG2 3.39Å; L259-I284 HydrophobicContact CD1-CG1 3.89Å; L259-I284 HydrophobicContact CD2-CG1 4.48Å; A280-I284 HydrophobicContact CB-CD1 4.44Å; A280-I284 WeakPolarHBondContact O-CG1 3.24Å; A280-I284 PolarHBondContact O-N 3.34Å; Q281-I284 PolarHBondContact O-N 3.42Å; I284-L286 VanDerWaalsContact C-N 3.35Å; I284-L286 PolarHBondContact O-N 3.4Å; I284-A287 WeakPolarHBondContact O-CB 3.33Å; I284-A287 PolarHBondContact O-N 2.88Å; I284-V288 HydrophobicContact CG2-CG2 4.39Å; I284-V288 VanDerWaalsContact O-CG2 3.31Å; I284-V288 WeakPolarHBondContact O-CG2 3.44Å; I284-V288 PolarHBondContact O-N 2.89Å
285V89.5Confident88.7Confident12 Ų1245.3 Ų45.37%0.07322%0.22CC..Hα-helixtrans-62.9-42.4176.6170.80000111.4F46 Y92 Q281 A287 V288 L289F46-V285 HydrophobicContact CD1-CG1 4.11Å; F46-V285 HydrophobicContact CD1-CG2 3.72Å; F46-V285 HydrophobicContact CD2-CG2 3.74Å; F46-V285 HydrophobicContact CE1-CB 4.25Å; F46-V285 HydrophobicContact CE1-CG1 3.96Å; F46-V285 HydrophobicContact CE1-CG2 3.62Å; F46-V285 HydrophobicContact CE2-CG2 3.62Å; F46-V285 HydrophobicContact CG-CG2 3.8Å; F46-V285 HydrophobicContact CZ-CB 4.4Å; F46-V285 HydrophobicContact CZ-CG2 3.57Å; Y92-V285 HydrophobicContact CE1-CG2 4.08Å; Y92-V285 WeakPolarHBondContact OH-CG2 3.41Å; Q281-V285 VanDerWaalsContact O-CG2 3.31Å; Q281-V285 WeakPolarHBondContact O-CG2 3.38Å; Q281-V285 PolarHBondContact O-N 3.15Å; V285-A287 VanDerWaalsContact C-N 3.29Å; V285-A287 PolarHBondContact O-N 3.18Å; V285-V288 PolarHBondContact O-N 3.43Å; V285-V288 VanDerWaalsContact O-N 3.16Å; V285-L289 HydrophobicContact CG1-CD1 4.31Å; V285-L289 HydrophobicContact CG1-CG 4.38Å; V285-L289 WeakPolarHBondContact O-CG 3.28Å; V285-L289 PolarHBondContact O-N 2.91Å
286L92.3Very high88.2Confident70 Ų7043.1 Ų43.137%0.36621%0.205SC..Hα-helixtrans-59-41.4175.2-179.462.2000112.1P258 W282 F283 I284 L289P258-L286 HydrophobicContact CB-CD2 4.21Å; P258-L286 HydrophobicContact CG-CD2 3.82Å; W282-L286 WeakPolarHBondContact O-CB 3.32Å; W282-L286 PolarHBondContact O-N 3.32Å; F283-L286 PolarHBondContact O-N 3.44Å; I284-L286 VanDerWaalsContact C-N 3.35Å; I284-L286 PolarHBondContact O-N 3.4Å; L286-L289 PolarHBondContact O-N 3.31Å
287A91Very high87.5Confident1 Ų140.9 Ų40.91%0.00819%0.191CC..Hα-helixtrans-64.3-42.8174.600000111.7W256 L259 F283 I284 V285 L289 N290W256-A287 HydrophobicContact CD2-CB 3.96Å; W256-A287 HydrophobicContact CE3-CB 3.77Å; W256-A287 HydrophobicContact CH2-CB 4.13Å; W256-A287 HydrophobicContact CZ2-CB 4.32Å; W256-A287 HydrophobicContact CZ3-CB 3.85Å; L259-A287 HydrophobicContact CB-CB 4.43Å; L259-A287 HydrophobicContact CD2-CB 3.78Å; F283-A287 PolarHBondContact O-N 2.96Å; I284-A287 WeakPolarHBondContact O-CB 3.33Å; I284-A287 PolarHBondContact O-N 2.88Å; V285-A287 VanDerWaalsContact C-N 3.29Å; V285-A287 PolarHBondContact O-N 3.18Å; A287-L289 VanDerWaalsContact C-N 3.34Å; A287-L289 PolarHBondContact O-N 2.9Å; A287-N290 WeakPolarHBondContact O-CB 3.46Å; A287-N290 PolarHBondContact O-N 3.26Å
288V89.1Confident86.7Confident6 Ų641.6 Ų41.64%0.03619%0.193CC..Hα-helixtrans-66.8-32.7178.5170.70000112.4I53 Y92 M118 I284 V285 N290 S291I53-V288 HydrophobicContact CD1-CG1 3.48Å; I53-V288 VanDerWaalsContact CD1-CG1 3.48Å; Y92-V288 HydrophobicContact CD1-CB 4.17Å; Y92-V288 HydrophobicContact CD1-CG1 3.76Å; Y92-V288 HydrophobicContact CD1-CG2 3.76Å; Y92-V288 HydrophobicContact CD2-CG2 4.13Å; Y92-V288 HydrophobicContact CE1-CB 4.38Å; Y92-V288 HydrophobicContact CE1-CG1 4.32Å; Y92-V288 HydrophobicContact CE1-CG2 4.08Å; Y92-V288 HydrophobicContact CE2-CG2 4.43Å; Y92-V288 HydrophobicContact CG-CG1 4.37Å; Y92-V288 HydrophobicContact CG-CG2 3.82Å; M118-V288 HydrophobicContact CE-CG2 3.95Å; I284-V288 HydrophobicContact CG2-CG2 4.39Å; I284-V288 VanDerWaalsContact O-CG2 3.31Å; I284-V288 WeakPolarHBondContact O-CG2 3.44Å; I284-V288 PolarHBondContact O-N 2.89Å; V285-V288 PolarHBondContact O-N 3.43Å; V285-V288 VanDerWaalsContact O-N 3.16Å; V288-N290 PolarHBondContact O-N 3.41Å; V288-N290 VanDerWaalsContact O-N 3.12Å; V288-S291 WeakPolarHBondContact O-CB 3.33Å; V288-S291 PolarHBondContact O-N 3.15Å
289L89.3Confident86.1Confident63 Ų6339.5 Ų39.533%0.3319%0.187SC..Hα-helixtrans-60.7-20.3174.9-76.1172.8000112.9I49 V285 L286 A287 S291 A292 M293I49-L289 HydrophobicContact CG2-CD2 3.64Å; V285-L289 HydrophobicContact CG1-CD1 4.31Å; V285-L289 HydrophobicContact CG1-CG 4.38Å; V285-L289 WeakPolarHBondContact O-CG 3.28Å; V285-L289 PolarHBondContact O-N 2.91Å; L286-L289 PolarHBondContact O-N 3.31Å; A287-L289 VanDerWaalsContact C-N 3.34Å; A287-L289 PolarHBondContact O-N 2.9Å; L289-S291 PolarHBondContact O-N 3.02Å; L289-A292 WeakPolarHBondContact O-CB 3.42Å; L289-A292 PolarHBondContact O-N 2.83Å; L289-M293 PolarHBondContact O-N 2.97Å
290N89.1Confident85.2Confident1 Ų137.8 Ų37.81%0.00519%0.19CC..Hα-helixtrans-53.8-41.2170.5-177.1-108.3000112.2F252 C255 A287 V288 A292 M293 N294F252-N290 VanDerWaalsContact CA-ND2 3.29Å; F252-N290 WeakPolarHBondContact CA-ND2 3.38Å; F252-N290 WeakPolarHBondContact CD2-OD1 3.24Å; C255-N290 HydrophobicContact CB-CB 3.76Å; A287-N290 WeakPolarHBondContact O-CB 3.46Å; A287-N290 PolarHBondContact O-N 3.26Å; V288-N290 PolarHBondContact O-N 3.41Å; V288-N290 VanDerWaalsContact O-N 3.12Å; N290-A292 PolarHBondContact O-N 3.42Å; N290-M293 WeakPolarHBondContact O-CB 3.24Å; N290-M293 PolarHBondContact O-N 3.43Å; N290-N294 PolarHBondContact O-N 3.47Å
291S88Confident84.1Confident5 Ų539.8 Ų39.84%0.03521%0.206CC..Hα-helixtrans-67.1-21.4179.7-64.50000113.5N57 D85 V288 L289N57-S291 PolarHBondContact ND2-O 3.18Å; D85-S291 VanDerWaalsContact OD1-CB 3.3Å; D85-S291 WeakPolarHBondContact OD1-CB 3.31Å; D85-S291 PolarHBondContact OD1-OG 2.86Å; V288-S291 WeakPolarHBondContact O-CB 3.33Å; V288-S291 PolarHBondContact O-N 3.15Å; L289-S291 PolarHBondContact O-N 3.02Å
292A87.4Confident83.3Confident12 Ų1238.3 Ų38.310%0.09920%0.202CC..Hα-helixtrans-80.4-28.8171.400000112.2I53 L289 N290 N294I53-A292 HydrophobicContact CD1-CB 4.48Å; I53-A292 HydrophobicContact CG1-CB 3.81Å; L289-A292 WeakPolarHBondContact O-CB 3.42Å; L289-A292 PolarHBondContact O-N 2.83Å; N290-A292 PolarHBondContact O-N 3.42Å; A292-N294 VanDerWaalsContact C-N 3.35Å; A292-N294 PolarHBondContact O-N 3.29Å
293M85.3Confident82.3Confident78 Ų7838.5 Ų38.538%0.38421%0.206SC..Hα-helixtrans-74.5-26.3-177.5-66.1-59.3-63.200112.8V251 L289 N290 V296 I297V251-M293 HydrophobicContact CG1-CB 3.84Å; V251-M293 HydrophobicContact CG1-CG 4Å; L289-M293 PolarHBondContact O-N 2.97Å; N290-M293 WeakPolarHBondContact O-CB 3.24Å; N290-M293 PolarHBondContact O-N 3.43Å; M293-V296 WeakPolarHBondContact O-CB 3.46Å; M293-V296 PolarHBondContact O-N 3.22Å; M293-I297 HydrophobicContact CB-CD1 4.27Å; M293-I297 WeakPolarHBondContact O-CD1 3.45Å; M293-I297 VanDerWaalsContact O-CG1 3.25Å; M293-I297 WeakPolarHBondContact O-CG1 3.39Å; M293-I297 PolarHBondContact O-N 3.42Å
294N82.8Confident81.2Confident3 Ų339.8 Ų39.82%0.01621%0.213CC..Hα-helixtrans-60.1-51.5-174.8-68.6-27000113D85 N290 A292 V296 I297 Y298D85-N294 PolarHBondContact OD2-ND2 3.43Å; N290-N294 PolarHBondContact O-N 3.47Å; A292-N294 VanDerWaalsContact C-N 3.35Å; A292-N294 PolarHBondContact O-N 3.29Å; N294-V296 VanDerWaalsContact C-N 3.32Å; N294-V296 PolarHBondContact O-N 3.2Å; N294-I297 PolarHBondContact O-N 3.28Å; N294-Y298 HydrophobicContact CB-CE2 4.05Å; N294-Y298 WeakPolarHBondContact O-CD1 3.47Å; N294-Y298 WeakPolarHBondContact O-CD2 3.06Å; N294-Y298 WeakPolarHBondContact O-CE2 3.36Å; N294-Y298 PolarHBondContact O-N 3Å
295P81.9Confident80.3Confident2 Ų238.3 Ų38.31%0.01321%0.205CC..Hα-helixtrans-56.3-39.2172.8-26.835.2000114.5E56 V60 Y298 T299E56-P295 HydrophobicContact CB-CB 4.42Å; E56-P295 HydrophobicContact CB-CG 4.02Å; V60-P295 HydrophobicContact CG2-CB 3.99Å; V60-P295 HydrophobicContact CG2-CG 4.09Å; P295-Y298 PolarHBondContact O-N 2.97Å; P295-T299 WeakPolarHBondContact O-CG2 3.49Å; P295-T299 PolarHBondContact O-N 3.39Å; P295-T299 PolarHBondContact O-OG1 3.35Å; P295-T299 VanDerWaalsContact O-OG1 3.09Å
296V79.6Confident79.8Confident57 Ų5743 Ų4335%0.34522%0.222SC..Hα-helixtrans-62.3-47176.6179.30000110.2M293 N294 Y298 T299 L300M293-V296 WeakPolarHBondContact O-CB 3.46Å; M293-V296 PolarHBondContact O-N 3.22Å; N294-V296 VanDerWaalsContact C-N 3.32Å; N294-V296 PolarHBondContact O-N 3.2Å; V296-Y298 VanDerWaalsContact C-N 3.3Å; V296-Y298 PolarHBondContact O-N 2.87Å; V296-T299 PolarHBondContact O-N 2.96Å; V296-T299 PolarHBondContact O-OG1 2.94Å; V296-L300 HydrophobicContact CG1-CD1 3.97Å; V296-L300 HydrophobicContact CG1-CG 4.47Å; V296-L300 VanDerWaalsContact O-CG 3.29Å; V296-L300 WeakPolarHBondContact O-CG 3.45Å; V296-L300 PolarHBondContact O-N 3.34Å
297I77.1Confident79.1Confident11 Ų1146.2 Ų46.26%0.05623%0.229CC..Hα-helixtrans-61.9-40.8178.8-62.7158000110.7T244 I247 V248 V251 M293 N294 L300 A301T244-I297 HydrophobicContact CG2-CG2 4.15Å; I247-I297 HydrophobicContact CG2-CG1 4.34Å; I247-I297 HydrophobicContact CG2-CG2 4.49Å; V248-I297 HydrophobicContact CG2-CB 4.25Å; V248-I297 HydrophobicContact CG2-CD1 4.15Å; V248-I297 HydrophobicContact CG2-CG2 3.38Å; V251-I297 HydrophobicContact CB-CD1 4.37Å; V251-I297 HydrophobicContact CG1-CD1 4.47Å; V251-I297 HydrophobicContact CG2-CD1 4.39Å; M293-I297 HydrophobicContact CB-CD1 4.27Å; M293-I297 WeakPolarHBondContact O-CD1 3.45Å; M293-I297 VanDerWaalsContact O-CG1 3.25Å; M293-I297 WeakPolarHBondContact O-CG1 3.39Å; M293-I297 PolarHBondContact O-N 3.42Å; N294-I297 PolarHBondContact O-N 3.28Å; I297-L300 PolarHBondContact O-N 3.44Å; I297-A301 WeakPolarHBondContact O-CB 3.33Å; I297-A301 PolarHBondContact O-N 3.28Å
298Y74.2Confident78.4Confident16 Ų1646.5 Ų46.56%0.06323%0.231CC..Hα-helixtrans-68.3-39.3179.9-48.9-39.8000113.6I78 L81 N294 P295 V296 L300 A301 S302 M305I78-Y298 HydrophobicContact CG1-CE1 4.48Å; I78-Y298 HydrophobicContact CG2-CD2 3.89Å; I78-Y298 HydrophobicContact CG2-CE1 4.28Å; I78-Y298 HydrophobicContact CG2-CE2 3.66Å; I78-Y298 HydrophobicContact CG2-CG 4.33Å; L81-Y298 WeakPolarHBondContact CD2-OH 3.33Å; L81-Y298 VanDerWaalsContact CG-OH 3.3Å; L81-Y298 WeakPolarHBondContact CG-OH 3.31Å; N294-Y298 HydrophobicContact CB-CE2 4.05Å; N294-Y298 WeakPolarHBondContact O-CD1 3.47Å; N294-Y298 WeakPolarHBondContact O-CD2 3.06Å; N294-Y298 WeakPolarHBondContact O-CE2 3.36Å; N294-Y298 PolarHBondContact O-N 3Å; P295-Y298 PolarHBondContact O-N 2.97Å; V296-Y298 VanDerWaalsContact C-N 3.3Å; V296-Y298 PolarHBondContact O-N 2.87Å; Y298-L300 VanDerWaalsContact C-N 3.32Å; Y298-A301 PolarHBondContact O-N 2.96Å; Y298-S302 PolarHBondContact O-N 3.48Å; Y298-M305 WeakPolarHBondContact CB-SD 3.47Å; Y298-M305 HydrophobicContact CD2-SD 4.15Å; Y298-M305 HydrophobicContact CG-SD 4.01Å
299T74.8Confident77.9Confident28 Ų2848 Ų4817%0.17224%0.237CC..Hα-helixtrans-69.6-30.6177.7540000112.2P295 V296 R306 F309P295-T299 WeakPolarHBondContact O-CG2 3.49Å; P295-T299 PolarHBondContact O-N 3.39Å; P295-T299 PolarHBondContact O-OG1 3.35Å; P295-T299 VanDerWaalsContact O-OG1 3.09Å; V296-T299 PolarHBondContact O-N 2.96Å; V296-T299 PolarHBondContact O-OG1 2.94Å; T299-R306 WeakPolarHBondContact O-CB 3.41Å; T299-F309 HydrophobicContact CG2-CB 4.24Å; T299-F309 HydrophobicContact CG2-CD2 4.12Å; T299-F309 HydrophobicContact CG2-CG 4.11Å
300L69.9Low77.4Confident140 Ų14051.1 Ų51.173%0.73325%0.248SC*.Hα-helixtrans-73.5-35.3170.9-67.3175.5000112.3V296 I297 Y298V296-L300 HydrophobicContact CG1-CD1 3.97Å; V296-L300 HydrophobicContact CG1-CG 4.47Å; V296-L300 VanDerWaalsContact O-CG 3.29Å; V296-L300 WeakPolarHBondContact O-CG 3.45Å; V296-L300 PolarHBondContact O-N 3.34Å; I297-L300 PolarHBondContact O-N 3.44Å; Y298-L300 VanDerWaalsContact C-N 3.32Å
301A65.2Low76.9Confident46 Ų4657.3 Ų57.338%0.3827%0.271SS..Hα-helixtrans-79.1-31-176.300000115T244 I297 Y298T244-A301 HydrophobicContact CG2-CB 3.25Å; T244-A301 WeakPolarHBondContact OG1-CB 3.34Å; I297-A301 WeakPolarHBondContact O-CB 3.33Å; I297-A301 PolarHBondContact O-N 3.28Å; Y298-A301 PolarHBondContact O-N 2.96Å
302S68.8Low76.4Confident21 Ų2158.4 Ų58.415%0.14728%0.277CS..  trans-128.3119.1-175.2173.30000112.5Y298 E304 M305 R306Y298-S302 PolarHBondContact O-N 3.48Å; S302-E304 PolarHBondContact O-N 3.13Å; S302-E304 PolarHBondContact OG-N 3.25Å; S302-E304 PolarHBondContact OG-OE2 3.28Å; S302-M305 PolarHBondContact O-N 3.44Å; S302-M305 PolarHBondContact OG-N 3.3Å; S302-M305 VanDerWaalsContact OG-N 3.14Å; S302-R306 WeakPolarHBondContact O-CB 3.43Å; S302-R306 PolarHBondContact O-N 3.42Å
303K69.9Low75.9Confident139 Ų13960 Ų6060%0.60429%0.285SS*.Hα-helixtrans-61.3-31.5172-65.2-174.6-1791780111.5R307K303-R307 WeakPolarHBondContact O-CB 3.46Å; K303-R307 VanDerWaalsContact O-CG 3.25Å; K303-R307 WeakPolarHBondContact O-CG 3.26Å; K303-R307 PolarHBondContact O-N 3.25Å; K303-R307 VanDerWaalsContact O-N 3.09Å; K303-R307 PolarHBondContact O-NE 3.47Å
304E70.5Confident75.4Confident82 Ų8259.1 Ų59.138%0.38329%0.286SS..Hα-helixtrans-69.5-47.9178.4-63.159.4-125.100110.8F70 S302 R307 A308F70-E304 HydrophobicContact CE1-CB 3.87Å; F70-E304 HydrophobicContact CZ-CB 4.13Å; S302-E304 PolarHBondContact O-N 3.13Å; S302-E304 PolarHBondContact OG-N 3.25Å; S302-E304 PolarHBondContact OG-OE2 3.28Å; E304-R307 PolarHBondContact O-N 2.76Å; E304-R307 IonicContact OE1-NH2 3.91Å; E304-R307 PolarHBondContact OE1-NH2 3.08Å; E304-A308 PolarHBondContact O-N 2.8Å
305M70.1Confident74.8Confident11 Ų1163.3 Ų63.35%0.05431%0.309CS..Hα-helixtrans-66.3-43.2178.9-166.8176.8-7000111.2Y75 I78 Y298 S302 R307 A308 F309Y75-M305 HydrophobicContact CD1-CE 4.13Å; Y75-M305 HydrophobicContact CE1-CE 4.01Å; I78-M305 HydrophobicContact CD1-CE 4.15Å; I78-M305 HydrophobicContact CG2-CE 4.02Å; Y298-M305 WeakPolarHBondContact CB-SD 3.47Å; Y298-M305 HydrophobicContact CD2-SD 4.15Å; Y298-M305 HydrophobicContact CG-SD 4.01Å; S302-M305 PolarHBondContact O-N 3.44Å; S302-M305 PolarHBondContact OG-N 3.3Å; S302-M305 VanDerWaalsContact OG-N 3.14Å; M305-R307 VanDerWaalsContact C-N 3.33Å; M305-R307 PolarHBondContact O-N 3.04Å; M305-A308 PolarHBondContact O-N 3.46Å; M305-A308 VanDerWaalsContact O-N 3.11Å; M305-F309 WeakPolarHBondContact O-CB 3.45Å; M305-F309 PolarHBondContact O-N 3.49Å
306R79.5Confident73.8Confident112 Ų11267.7 Ų67.742%0.42334%0.338SS..Hα-helixtrans-54.6-47.5173.2-172.3171.459.9165.91.3112.1T299 S302 A308 F309 F310T299-R306 WeakPolarHBondContact O-CB 3.41Å; S302-R306 WeakPolarHBondContact O-CB 3.43Å; S302-R306 PolarHBondContact O-N 3.42Å; R306-A308 VanDerWaalsContact C-N 3.34Å; R306-A308 PolarHBondContact O-N 2.99Å; R306-F309 PolarHBondContact O-N 2.89Å; R306-F310 HydrophobicContact CG-CD2 3.79Å; R306-F310 HydrophobicContact CG-CE2 3.66Å; R306-F310 VanDerWaalsContact O-CD2 3.25Å; R306-F310 WeakPolarHBondContact O-CD2 3.37Å; R306-F310 PolarHBondContact O-N 3.39Å
307R78.4Confident72.8Confident137 Ų13770.8 Ų70.852%0.51735%0.352SS..Hα-helixtrans-62.3-39.5176.5-77.7-178.4-72.3-175.1-2.2112.4K303 E304 M305 R311K303-R307 WeakPolarHBondContact O-CB 3.46Å; K303-R307 VanDerWaalsContact O-CG 3.25Å; K303-R307 WeakPolarHBondContact O-CG 3.26Å; K303-R307 PolarHBondContact O-N 3.25Å; K303-R307 VanDerWaalsContact O-N 3.09Å; K303-R307 PolarHBondContact O-NE 3.47Å; E304-R307 PolarHBondContact O-N 2.76Å; E304-R307 IonicContact OE1-NH2 3.91Å; E304-R307 PolarHBondContact OE1-NH2 3.08Å; M305-R307 VanDerWaalsContact C-N 3.33Å; M305-R307 PolarHBondContact O-N 3.04Å; R307-R311 WeakPolarHBondContact O-CG 3.16Å; R307-R311 PolarHBondContact O-N 3.3Å
308A74.6Confident71.8Confident6 Ų675 Ų755%0.0538%0.378CS..Hα-helixtrans-66.2-42.4176.900000111.9F70 E304 M305 R306 R311 L312F70-A308 HydrophobicContact CE2-CB 3.61Å; F70-A308 HydrophobicContact CZ-CB 3.94Å; E304-A308 PolarHBondContact O-N 2.8Å; M305-A308 PolarHBondContact O-N 3.46Å; M305-A308 VanDerWaalsContact O-N 3.11Å; R306-A308 VanDerWaalsContact C-N 3.34Å; R306-A308 PolarHBondContact O-N 2.99Å; A308-R311 PolarHBondContact O-N 3.39Å; A308-L312 PolarHBondContact O-N 2.92Å
309F79.5Confident70.7Confident39 Ų3984.1 Ų84.117%0.17141%0.412CS..Hα-helixtrans-60.9-50.8176.3-162.2-87000111.5M59 T299 M305 R306 R311 L312 V313M59-F309 HydrophobicContact CE-CD1 4.38Å; M59-F309 HydrophobicContact CE-CD2 4.05Å; M59-F309 HydrophobicContact CE-CE1 3.61Å; M59-F309 HydrophobicContact CE-CE2 3.22Å; M59-F309 HydrophobicContact CE-CZ 2.98Å; M59-F309 HydrophobicContact CG-CD2 4.23Å; M59-F309 HydrophobicContact CG-CE2 4.13Å; M59-F309 HydrophobicContact SD-CD1 4.32Å; M59-F309 HydrophobicContact SD-CD2 4.02Å; M59-F309 HydrophobicContact SD-CE1 4.1Å; M59-F309 HydrophobicContact SD-CE2 3.81Å; M59-F309 HydrophobicContact SD-CG 4.31Å; M59-F309 HydrophobicContact SD-CZ 3.88Å; T299-F309 HydrophobicContact CG2-CB 4.24Å; T299-F309 HydrophobicContact CG2-CD2 4.12Å; T299-F309 HydrophobicContact CG2-CG 4.11Å; M305-F309 WeakPolarHBondContact O-CB 3.45Å; M305-F309 PolarHBondContact O-N 3.49Å; R306-F309 PolarHBondContact O-N 2.89Å; F309-R311 VanDerWaalsContact C-N 3.32Å; F309-R311 PolarHBondContact O-N 3.41Å; F309-L312 WeakPolarHBondContact O-CB 3.35Å; F309-L312 PolarHBondContact O-N 3.02Å; F309-L312 VanDerWaalsContact O-N 3.09Å; F309-V313 HydrophobicContact CD1-CG2 3.94Å; F309-V313 HydrophobicContact CE1-CG2 3.94Å; F309-V313 WeakPolarHBondContact O-CG2 3.44Å; F309-V313 PolarHBondContact O-N 3.41Å
310F78.1Confident69.4Low127 Ų12786 Ų8656%0.55744%0.437SS*.Hα-helixtrans-59.1-40.6175.3-85.1-69000112.5R306 L312 V313 C314R306-F310 HydrophobicContact CG-CD2 3.79Å; R306-F310 HydrophobicContact CG-CE2 3.66Å; R306-F310 VanDerWaalsContact O-CD2 3.25Å; R306-F310 WeakPolarHBondContact O-CD2 3.37Å; R306-F310 PolarHBondContact O-N 3.39Å; F310-L312 VanDerWaalsContact C-N 3.31Å; F310-L312 PolarHBondContact O-N 2.91Å; F310-V313 PolarHBondContact O-N 3.37Å; F310-C314 WeakPolarHBondContact O-CB 3.43Å; F310-C314 PolarHBondContact O-N 2.94Å; F310-C314 PolarHBondContact O-SG 3.43Å
311R79.8Confident68.1Low131 Ų13190.9 Ų90.949%0.49445%0.446SS..Hα-helixtrans-62.9-36.5175.6-78.1-172-63-102.3-0.4112.8R307 A308 F309 N315R307-R311 WeakPolarHBondContact O-CG 3.16Å; R307-R311 PolarHBondContact O-N 3.3Å; A308-R311 PolarHBondContact O-N 3.39Å; F309-R311 VanDerWaalsContact C-N 3.32Å; F309-R311 PolarHBondContact O-N 3.41Å; R311-N315 WeakPolarHBondContact O-CB 3.35Å; R311-N315 PolarHBondContact O-N 3.42Å; R311-N315 PolarHBondContact O-ND2 3.19Å
312L77Confident67.2Low28 Ų2891 Ų9115%0.14745%0.451CS..Hα-helixtrans-69.6-49.3176.7-88.6148.8000111.3M59 I62 A63 A308 F309 F310 N315 C316M59-L312 HydrophobicContact SD-CB 4.46Å; I62-L312 HydrophobicContact CG2-CD2 3.81Å; A63-L312 HydrophobicContact CB-CD1 3.41Å; A63-L312 VanDerWaalsContact CB-CD1 3.41Å; A308-L312 PolarHBondContact O-N 2.92Å; F309-L312 WeakPolarHBondContact O-CB 3.35Å; F309-L312 PolarHBondContact O-N 3.02Å; F309-L312 VanDerWaalsContact O-N 3.09Å; F310-L312 VanDerWaalsContact C-N 3.31Å; F310-L312 PolarHBondContact O-N 2.91Å; L312-N315 PolarHBondContact O-N 2.86Å; L312-C316 WeakPolarHBondContact O-CB 3.24Å; L312-C316 PolarHBondContact O-N 3.25Å; L312-C316 PolarHBondContact O-SG 3.35Å
313V76.7Confident66Low46 Ų4694.8 Ų94.828%0.27948%0.484SS..Hα-helixtrans-60.9-49.4177.2176.70000110.6M59 F309 F310 N315 C316 L317M59-V313 HydrophobicContact CE-CG2 4.26Å; M59-V313 HydrophobicContact SD-CG2 3.6Å; M59-V313 VanDerWaalsContact SD-CG2 3.6Å; F309-V313 HydrophobicContact CD1-CG2 3.94Å; F309-V313 HydrophobicContact CE1-CG2 3.94Å; F309-V313 WeakPolarHBondContact O-CG2 3.44Å; F309-V313 PolarHBondContact O-N 3.41Å; F310-V313 PolarHBondContact O-N 3.37Å; V313-N315 PolarHBondContact O-N 3.3Å; V313-C316 PolarHBondContact O-N 2.92Å; V313-L317 HydrophobicContact CG1-CD1 3.68Å; V313-L317 HydrophobicContact CG1-CG 4.26Å; V313-L317 WeakPolarHBondContact O-CB 3.46Å; V313-L317 VanDerWaalsContact O-CG 3.23Å; V313-L317 WeakPolarHBondContact O-CG 3.48Å; V313-L317 PolarHBondContact O-N 2.89Å
314C74.4Confident64.5Low60 Ų6099.3 Ų99.341%0.40550%0.497SS..Hα-helixtrans-62.6-42.1177.5-67.80000112.1F310 C316 L317 V318F310-C314 WeakPolarHBondContact O-CB 3.43Å; F310-C314 PolarHBondContact O-N 2.94Å; F310-C314 PolarHBondContact O-SG 3.43Å; C314-C316 VanDerWaalsContact C-N 3.34Å; C314-C316 PolarHBondContact O-N 3.41Å; C314-L317 PolarHBondContact O-N 2.94Å; C314-V318 WeakPolarHBondContact O-CB 3.43Å; C314-V318 WeakPolarHBondContact O-CG2 3.43Å; C314-V318 PolarHBondContact O-N 3.28Å
315N70.3Confident63Low91 Ų91100 Ų10049%0.48752%0.518SS..Hα-helixtrans-67.6-33.9176.2-75.5-12.8000112.3R311 L312 V313 R319R311-N315 WeakPolarHBondContact O-CB 3.35Å; R311-N315 PolarHBondContact O-N 3.42Å; R311-N315 PolarHBondContact O-ND2 3.19Å; L312-N315 PolarHBondContact O-N 2.86Å; V313-N315 PolarHBondContact O-N 3.3Å; N315-R319 WeakPolarHBondContact O-CB 3.46Å; N315-R319 PolarHBondContact O-N 3.46Å
316C62Low61.3Low94 Ų94104.9 Ų104.964%0.63555%0.553SS**Hα-helixtrans-68.2-40.3173.1-70.60000111.8L312 V313 C314 G320L312-C316 WeakPolarHBondContact O-CB 3.24Å; L312-C316 PolarHBondContact O-N 3.25Å; L312-C316 PolarHBondContact O-SG 3.35Å; V313-C316 PolarHBondContact O-N 2.92Å; C314-C316 VanDerWaalsContact C-N 3.34Å; C314-C316 PolarHBondContact O-N 3.41Å; C316-G320 PolarHBondContact O-N 3.26Å
317L58.5Low59.3Low122 Ų122105.3 Ų105.364%0.63957%0.57SS**Hα-helixtrans-72.7-37.4178.4-67.6173000113V313 C314V313-L317 HydrophobicContact CG1-CD1 3.68Å; V313-L317 HydrophobicContact CG1-CG 4.26Å; V313-L317 WeakPolarHBondContact O-CB 3.46Å; V313-L317 VanDerWaalsContact O-CG 3.23Å; V313-L317 WeakPolarHBondContact O-CG 3.48Å; V313-L317 PolarHBondContact O-N 2.89Å; C314-L317 PolarHBondContact O-N 2.94Å
318V56.6Low57.4Low99 Ų99106.4 Ų106.460%0.658%0.584SS**Hα-helixtrans-79.9-37.3-179.4174.10000111.3C314 G320 R321 G322C314-V318 WeakPolarHBondContact O-CB 3.43Å; C314-V318 WeakPolarHBondContact O-CG2 3.43Å; C314-V318 PolarHBondContact O-N 3.28Å; V318-G320 PolarHBondContact O-N 3.19Å; V318-R321 CarbonylContact O-C 3.44Å; V318-R321 PolarHBondContact O-N 3.4Å; V318-G322 PolarHBondContact O-N 3.41Å
319R50.4Low55.5Low207 Ų207114.9 Ų114.978%0.78162%0.623SS**Hα-helixtrans-73.3-17.5177.9-153.9170.8-171.6172.21.8112.7N315 R321N315-R319 WeakPolarHBondContact O-CB 3.46Å; N315-R319 PolarHBondContact O-N 3.46Å; R319-R321 VanDerWaalsContact C-N 3.3Å
320G46.6Very low53.4Low68 Ų68118.1 Ų118.170%0.70165%0.648SS**THydrogen-bonded Turntrans-75.4-10.8165.700000114.8C316 V318C316-G320 PolarHBondContact O-N 3.26Å; V318-G320 PolarHBondContact O-N 3.19Å
321R43.7Very low51.5Low243 Ų243116.9 Ų116.992%0.91766%0.661SS**SBendtrans-121.88.2-179.9-103.4-176.7-179.5-175.40.1115V318 R319V318-R321 CarbonylContact O-C 3.44Å; V318-R321 PolarHBondContact O-N 3.4Å; R319-R321 VanDerWaalsContact C-N 3.3Å
322G46.4Very low49.3Very low47 Ų47118.8 Ų118.849%0.48568%0.68SS.*  trans-16872.9-176.300000113.1V318 R324V318-G322 PolarHBondContact O-N 3.41Å; G322-R324 PolarHBondContact O-N 2.76Å
323A43.2Very low47.1Very low102 Ų102124.2 Ų124.284%0.84371%0.71SS**  trans-71.280.4154.900000108.8
324R38Very low45.2Very low233 Ų233128.3 Ų128.388%0.87974%0.737SS**  trans-125.5107.5147.1-83.6-171.9-175.8177.52.2107G322 S326G322-R324 PolarHBondContact O-N 2.76Å; R324-S326 PolarHBondContact O-N 3.39Å
325A39.4Very low43.1Very low98 Ų98130.4 Ų130.481%0.8175%0.752SS**PPolyproline II helixtrans-51.6123.2166.600000108.6
326S33.7Very low41.4Very low113 Ų113137.6 Ų137.679%0.7977%0.773SS**PPolyproline II helixtrans-86128.4156.5-74.30000107.3R324R324-S326 PolarHBondContact O-N 3.39Å
327P38.3Very low39.9Very low121 Ų121138.6 Ų138.679%0.78678%0.78SS**PPolyproline II helixtrans-65.3141.5176.7-14.728.3000110.7Q329P327-Q329 PolarHBondContact O-N 3.15Å
328I38.7Very low38.7Very low159 Ų159142.5 Ų142.582%0.81579%0.793SS**  trans-58.8115.8166.2-62.9162.2000107.4
329Q33.8Very low37.5Very low185 Ų185143.4 Ų143.486%0.86480%0.803SS**PPolyproline II helixtrans-81.2124.1162.3-91.1-173.9-33.400108.6P327P327-Q329 PolarHBondContact O-N 3.15Å
330P35.6Very low36.6Very low107 Ų107138.4 Ų138.470%0.69580%0.8SS**PPolyproline II helixtrans-70146.4168.1-8.124000110.2L332P330-L332 PolarHBondContact O-N 3.16Å
331A37.9Very low35.8Very low101 Ų101140.6 Ų140.684%0.83581%0.805SS**PPolyproline II helixtrans-55.4130.7170.100000110.5
332L34.1Very low35.1Very low170 Ų170133.7 Ų133.789%0.8979%0.794SS**  trans-111.2117.7170.6-96.4152.5000108.5P330P330-L332 PolarHBondContact O-N 3.16Å
333D30.3Very low34.3Very low143 Ų143139.3 Ų139.377%0.76581%0.812SS**  trans-59.6142.7172.3-70-49.1000111.8S335D333-S335 PolarHBondContact O-N 2.74Å
334P36.9Very low33.7Very low131 Ų131142.1 Ų142.185%0.85181%0.813SS**  trans-91.2100.7169.432.5-25.1000109.7
335S31.3Very low33.3Very low105 Ų105136 Ų13673%0.73481%0.807SS**  trans-133.5114.4162.750.90000112.4D333D333-S335 PolarHBondContact O-N 2.74Å
336R34.6Very low32.8Very low242 Ų242137.1 Ų137.191%0.91380%0.803SS**  trans39.4119.9148.6-75.5179.8168.6-175.5-2.8120.4
337S30.7Very low32.6Very low114 Ų114140.4 Ų140.480%0.79781%0.806SS**  155.3111.2112510000109.9
338K33Very low32.2Very low205 Ų205140 Ų14089%0.89181%0.805SS**  61.4111.397-85-166178.7-176.40116.4
339S31Very low32.2Very low117 Ų117138.1 Ų138.182%0.81880%0.804SS**  trans153.5145131.959.10000107.7
340S31.3Very low31.9Very low103 Ų103138.9 Ų138.972%0.7280%0.804SS**  cis-171176.7240.60000107.3
341S29.6Very low31.6Very low114 Ų114140.3 Ų140.380%0.79781%0.811SS**  trans83.9132.6171.971.60000116.6
342S29.6Very low31.1Very low98 Ų98143.3 Ų143.369%0.68581%0.805SS**  cis-175.9134.4-16.338.30000105.2
343N30Very low30.8Very low164 Ų164141.7 Ų141.788%0.87779%0.793SS**  trans-178.4128.2133.8-92.3-8.6000111.6
344N29.8Very low30.7Very low161 Ų161142.5 Ų142.586%0.86180%0.797SS**  trans-72.5143.5174.1-82-24.5000111.3
345S30.1Very low30.4Very low106 Ų106142 Ų14274%0.74179%0.786SS**  169.3109.7111.858.80000112.3
346T29.2Very low30.7Very low121 Ų121143 Ų14374%0.74279%0.791SS**  trans39.5112.3133.245.70000121.4
347H29.7Very low30.5Very low181 Ų181138.9 Ų138.984%0.83878%0.782SS**  165.9131.2108-100.4-78.2000112.5
348S29.8Very low30.3Very low112 Ų112140.7 Ų140.778%0.78379%0.788SS**  trans-131.2153.7156.6-58.50000106.1
349P38.8Very low30.3Very low120 Ų120135.2 Ų135.278%0.77978%0.781SS**  -153.4159.669.636.2-13.1000119.2
350K27.5Very low30.8Very low201 Ų201135.8 Ų135.887%0.87478%0.782SS**  trans10.5141.7148.6-63.5177.6175.8178.50122.9
351V28.3Very low30.6Very low137 Ų137136.8 Ų136.883%0.8379%0.789SS**  trans-158.5117.8133.2-179.10000107.4
352K28Very low30.4Very low165 Ų165136.3 Ų136.372%0.71779%0.786SS**  54.5142.495.3-101.5-178.9174.1-113.20113.8
353E28.1Very low30.2Very low136 Ų136136.9 Ų136.964%0.63679%0.788SS**  cis-175.5150.33.3-142.1158.9-160.900104.7
354D27.6Very low30.1Very low159 Ų159136 Ų13685%0.8578%0.782SS**  trans152.5120.2139.2-79.3-19.6000114.5
355L30.6Very low30.1Very low120 Ų120136.4 Ų136.463%0.62878%0.781SS**  trans-103.1167.3165.7-135.896.1000107.3H357L355-H357 VanDerWaalsContact CD2-CD2 3.44Å; L355-H357 WeakPolarHBondContact CD2-CD2 3.44Å; L355-H357 WeakPolarHBondContact CD2-NE2 3.37Å
356P38.1Very low30Very low128 Ų128138.9 Ų138.983%0.83179%0.786SS**  -144.6161.79730.2-10.6000115.9
357H29.4Very low30Very low155 Ų155141 Ų14172%0.71879%0.785SS**  trans-71.4160.7-177.6-68.6-85.4000115L355L355-H357 VanDerWaalsContact CD2-CD2 3.44Å; L355-H357 WeakPolarHBondContact CD2-CD2 3.44Å; L355-H357 WeakPolarHBondContact CD2-NE2 3.37Å
358T26.3Very low29.9Very low152 Ų152139.7 Ų139.793%0.93378%0.784SS**  -150.6135128.4-0.30000110.9
359A32.9Very low29.9Very low90 Ų90138.9 Ų138.974%0.74478%0.784SS**  trans-103.1176-169.600000111.1
360P41.8Very low29.5Very low128 Ų128137.3 Ų137.383%0.83178%0.781SS**  trans-96.5165.9-161.638.2-32.9000113.8
361S26.9Very low29.6Very low124 Ų124134.8 Ų134.887%0.86778%0.776SS**  trans-128.3134.1169.552.60000112.8
362S26.2Very low29.7Very low105 Ų105135.6 Ų135.673%0.73477%0.771SS**  trans-87.7-174.9173.849.80000112.3
363C24.9Very low29.9Very low109 Ų109134.7 Ų134.774%0.73677%0.774SS**  trans100.9140.4164.5-69.10000115.5
364I29Very low30Very low147 Ų147131.6 Ų131.675%0.75478%0.779SS**  cis-163.1153.112-101.1152.3000108
365M29.6Very low30.3Very low169 Ų169131.8 Ų131.883%0.83378%0.778SS**  trans-81.4138.1163.7-98.7-174.966.200110.5
366D26.8Very low30.3Very low158 Ų158135 Ų13585%0.84579%0.787SS**  trans-144.9150.9154-137.3-18.5000113.6
367K29.9Very low29.9Very low164 Ų164135.4 Ų135.471%0.71379%0.792SS**  trans-91.2155.2-167-77.4173.5170.4173.20113.5
368N27.9Very low30.1Very low155 Ų155140.7 Ų140.783%0.82981%0.813SS**  trans115.4122.7142.5-68.8-27.5000119.2
369A30.1Very low30.3Very low94 Ų94140.1 Ų140.178%0.77781%0.807SS**  trans72.2118.1135.400000121.6
370A29.6Very low30.2Very low88 Ų88142.7 Ų142.773%0.72781%0.81SS**  91.5125.7128.900000120.5
371L30.1Very low29.5Very low147 Ų147143.6 Ų143.677%0.7781%0.809SS**  trans83.7112.6150-93.488.5000121.5
372Q29.8Very low29.7Very low154 Ų154144.7 Ų144.772%0.7281%0.805SS**  73.7134.9126.7-93.3179.1-17.500121.5
373N32.2Very low29.9Very low146 Ų146147.2 Ų147.278%0.78181%0.81SS**  trans89.194155.4-60-14.8000117.9
374G31.1Very low30.2Very low71 Ų71149.7 Ų149.773%0.73282%0.815SS**  88.9130.596.600000118.2
375I33Very low30.3Very low163 Ų163149.9 Ų149.984%0.83682%0.819SS**  trans99.492.2150.4-50.3174000116.7
376F31.6Very low30.3Very low187 Ų187148.5 Ų148.582%0.8282%0.818SS**  44.9118125.2-98.5-92000120.6
377C28.2Very low30.6Very low137 Ų137147.7 Ų147.793%0.92682%0.816SS**  trans-123.8124.2137.5-91.50000109.1
378K34.4Very low30.7Very low266 Ų266146.2 Ų146.2100%1.15783%0.825SS**  trans-137.70143.8-142.6-173.8-167.8-179.20108.3

Retrieved 378 of 378 residues in 358.5 ms (Link to these results)

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