A0A077Z3F3_TRITR Loading...

Golgi to ER traffic protein 4 homolog

AlphaFold DB , UniProt , Accession A0A077Z3F3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 348 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
1M41.4Very low50.3Low197 Ų19793.5 Ų93.597%0.9751%0.507SS*.  0112.10-82.8-175.316200107.8
2S42.9Very low51.4Low89 Ų8991.9 Ų91.962%0.62250%0.502SS*.  trans-59.4141.5-177.2-67.50000111.8D4 Q5S2-D4 PolarHBondContact O-N 3.32Å; S2-D4 VanDerWaalsContact O-N 3.12Å; S2-Q5 PolarHBondContact O-N 3.26Å
3T50.4Low52.1Low100 Ų10098.5 Ų98.561%0.61352%0.515SS*.Hα-helixtrans-51.8-30.3178.626.60000113.4L6 K7T3-L6 PolarHBondContact O-N 2.96Å; T3-K7 WeakPolarHBondContact O-CG 3.12Å; T3-K7 PolarHBondContact O-N 3.46Å; T3-K7 VanDerWaalsContact O-N 3.15Å
4D44.4Very low53.4Low107 Ų10792.4 Ų92.457%0.57249%0.488SS*.Hα-helixtrans-69.7-32.6177.2-71-32.4000113.8S2 L6 K7 G8S2-D4 PolarHBondContact O-N 3.32Å; S2-D4 VanDerWaalsContact O-N 3.12Å; D4-L6 VanDerWaalsContact C-N 3.35Å; D4-K7 PolarHBondContact O-N 3.11Å; D4-G8 PolarHBondContact O-N 3.11Å
5Q41.6Very low54.6Low132 Ų13288.9 Ų88.962%0.61748%0.475SS*.Hα-helixtrans-69.8-34.1176-71.7-129.7-3.800112.4S2 K9S2-Q5 PolarHBondContact O-N 3.26Å; Q5-K9 WeakPolarHBondContact O-CG 3.45Å; Q5-K9 PolarHBondContact O-N 3.15Å
6L47Very low55.9Low107 Ų10789.4 Ų89.456%0.5647%0.473SS*.Hα-helixtrans-69.5-37.6174.5-80.2154.9000111.3T3 D4 S10T3-L6 PolarHBondContact O-N 2.96Å; D4-L6 VanDerWaalsContact C-N 3.35Å; L6-S10 PolarHBondContact O-N 3.39Å
7K52.2Low57.1Low77 Ų7786.2 Ų86.234%0.33546%0.462SS..Hα-helixtrans-67.4-45.5177.3-72.3175.6-176.7177.90112.3T3 D4 K9 S10 L11T3-K7 WeakPolarHBondContact O-CG 3.12Å; T3-K7 PolarHBondContact O-N 3.46Å; T3-K7 VanDerWaalsContact O-N 3.15Å; D4-K7 PolarHBondContact O-N 3.11Å; K7-K9 VanDerWaalsContact C-N 3.34Å; K7-K9 PolarHBondContact O-N 2.86Å; K7-S10 WeakPolarHBondContact O-CB 3.38Å; K7-S10 PolarHBondContact O-N 3.43Å; K7-S10 PolarHBondContact O-OG 3.42Å; K7-L11 PolarHBondContact O-N 3.38Å
8G55.3Low58.2Low33 Ų3381.6 Ų81.634%0.3444%0.438SS..Hα-helixtrans-58.2-43.4176.500000112.8D4 S10 L11 V12D4-G8 PolarHBondContact O-N 3.11Å; G8-S10 PolarHBondContact O-N 2.9Å; G8-L11 PolarHBondContact O-N 3.18Å; G8-V12 WeakPolarHBondContact O-CG2 3.25Å; G8-V12 PolarHBondContact O-N 3.32Å; G8-V12 VanDerWaalsContact O-N 3.15Å
9K55.8Low59.2Low109 Ų10983.4 Ų83.447%0.47444%0.443SS..Hα-helixtrans-60.8-30.9174.4-74.5179.2179.3-178.90113.4Q5 K7 R13Q5-K9 WeakPolarHBondContact O-CG 3.45Å; Q5-K9 PolarHBondContact O-N 3.15Å; K7-K9 VanDerWaalsContact C-N 3.34Å; K7-K9 PolarHBondContact O-N 2.86Å; K9-R13 WeakPolarHBondContact O-CB 3.42Å; K9-R13 VanDerWaalsContact O-CG 3.31Å; K9-R13 WeakPolarHBondContact O-CG 3.42Å; K9-R13 PolarHBondContact O-N 3.34Å
10S58.8Low60.2Low38 Ų3886.4 Ų86.427%0.26645%0.452SS..Hα-helixtrans-74.7-28.6178.882.60000113.5L6 K7 G8 G14L6-S10 PolarHBondContact O-N 3.39Å; K7-S10 WeakPolarHBondContact O-CB 3.38Å; K7-S10 PolarHBondContact O-N 3.43Å; K7-S10 PolarHBondContact O-OG 3.42Å; G8-S10 PolarHBondContact O-N 2.9Å; S10-G14 PolarHBondContact O-N 2.85Å
11L64Low61.2Low39 Ų3985 Ų8520%0.20444%0.443CS..Hα-helixtrans-74.4-45.1174.6-172.465.2000110K7 G8 R13 G14 S15 I37 L41K7-L11 PolarHBondContact O-N 3.38Å; G8-L11 PolarHBondContact O-N 3.18Å; L11-R13 PolarHBondContact O-N 3.16Å; L11-G14 CarbonylContact O-C 3.51Å; L11-G14 WeakPolarHBondContact O-CA 3.5Å; L11-G14 PolarHBondContact O-N 3.16Å; L11-S15 PolarHBondContact O-N 3.04Å; L11-S15 PolarHBondContact O-OG 3.05Å; L11-I37 HydrophobicContact CD1-CG2 3.83Å; L11-L41 HydrophobicContact CD1-CD1 3.96Å
12V62.4Low63Low75 Ų7576.6 Ų76.646%0.45540%0.402SS..Hα-helixtrans-59.2-45.9175.7176.80000111.7G8 G14 S15 E16G8-V12 WeakPolarHBondContact O-CG2 3.25Å; G8-V12 PolarHBondContact O-N 3.32Å; G8-V12 VanDerWaalsContact O-N 3.15Å; V12-G14 VanDerWaalsContact C-N 3.26Å; V12-G14 PolarHBondContact O-N 3.14Å; V12-S15 WeakPolarHBondContact CA-OG 3.38Å; V12-S15 PolarHBondContact O-N 3.33Å; V12-S15 PolarHBondContact O-OG 3.26Å; V12-E16 WeakPolarHBondContact O-CG 3.49Å; V12-E16 PolarHBondContact O-N 3.27Å
13R61.3Low64.8Low177 Ų17780 Ų8067%0.66841%0.408SS*.Hα-helixtrans-63.2-34.4174.7-74.4177.8-176.6173.4-0.2112.8K9 L11 A17K9-R13 WeakPolarHBondContact O-CB 3.42Å; K9-R13 VanDerWaalsContact O-CG 3.31Å; K9-R13 WeakPolarHBondContact O-CG 3.42Å; K9-R13 PolarHBondContact O-N 3.34Å; L11-R13 PolarHBondContact O-N 3.16Å; R13-A17 WeakPolarHBondContact O-CB 3.37Å; R13-A17 PolarHBondContact O-N 3.13Å; R13-A17 VanDerWaalsContact O-N 3.08Å
14G69.5Low66.5Low13 Ų1378 Ų7813%0.13440%0.401CS..Hα-helixtrans-66.5-45.4176.600000112.1S10 L11 V12 A17 I18S10-G14 PolarHBondContact O-N 2.85Å; L11-G14 CarbonylContact O-C 3.51Å; L11-G14 WeakPolarHBondContact O-CA 3.5Å; L11-G14 PolarHBondContact O-N 3.16Å; V12-G14 VanDerWaalsContact C-N 3.26Å; V12-G14 PolarHBondContact O-N 3.14Å; G14-A17 PolarHBondContact O-N 2.99Å; G14-I18 WeakPolarHBondContact O-CD1 3.44Å; G14-I18 WeakPolarHBondContact O-CG1 3.46Å; G14-I18 PolarHBondContact O-N 3.42Å
15S72Confident68.2Low41 Ų4176.4 Ų76.429%0.28740%0.399SS..Hα-helixtrans-65.6-40.8177.158.40000112L11 V12 A17 I18 Q19L11-S15 PolarHBondContact O-N 3.04Å; L11-S15 PolarHBondContact O-OG 3.05Å; V12-S15 WeakPolarHBondContact CA-OG 3.38Å; V12-S15 PolarHBondContact O-N 3.33Å; V12-S15 PolarHBondContact O-OG 3.26Å; S15-A17 PolarHBondContact O-N 2.95Å; S15-I18 PolarHBondContact O-N 3.17Å; S15-Q19 WeakPolarHBondContact O-CG 3.48Å; S15-Q19 PolarHBondContact O-N 3.03Å
16E74.6Confident70.6Confident96 Ų9673.6 Ų73.645%0.44939%0.388SS..Hα-helixtrans-60.6-42.5173.8-73.8172.3-172.700112.3V12 Q19 K20V12-E16 WeakPolarHBondContact O-CG 3.49Å; V12-E16 PolarHBondContact O-N 3.27Å; E16-Q19 PolarHBondContact O-N 3.32Å; E16-K20 WeakPolarHBondContact O-CG 3.45Å; E16-K20 PolarHBondContact O-N 2.98Å
17A76.3Confident72.6Confident35 Ų3571 Ų7129%0.28937%0.371SS..Hα-helixtrans-64.5-42.5177.400000111.7R13 G14 S15 K20 H21 L33R13-A17 WeakPolarHBondContact O-CB 3.37Å; R13-A17 PolarHBondContact O-N 3.13Å; R13-A17 VanDerWaalsContact O-N 3.08Å; G14-A17 PolarHBondContact O-N 2.99Å; S15-A17 PolarHBondContact O-N 2.95Å; A17-K20 PolarHBondContact O-N 2.93Å; A17-H21 PolarHBondContact O-CD2 2.84Å; A17-H21 VanDerWaalsContact O-CD2 3.27Å; A17-H21 PolarHBondContact O-N 3.01Å; A17-L33 HydrophobicContact CB-CD1 4.34Å
18I78.4Confident74.4Confident4 Ų474.7 Ų74.72%0.02138%0.384CS..Hα-helixtrans-60.9-46.7175.7-71.8161.7000110.5G14 S15 K20 H21 L22 L33 C34 I37 F53 V57G14-I18 WeakPolarHBondContact O-CD1 3.44Å; G14-I18 WeakPolarHBondContact O-CG1 3.46Å; G14-I18 PolarHBondContact O-N 3.42Å; S15-I18 PolarHBondContact O-N 3.17Å; I18-K20 VanDerWaalsContact C-N 3.28Å; I18-K20 PolarHBondContact O-N 3.41Å; I18-H21 PolarHBondContact O-N 3.45Å; I18-H21 VanDerWaalsContact O-N 3.14Å; I18-L22 HydrophobicContact CG2-CD1 3.5Å; I18-L22 HydrophobicContact CG2-CG 4.1Å; I18-L22 WeakPolarHBondContact O-CB 3.33Å; I18-L22 VanDerWaalsContact O-CG 3.25Å; I18-L22 WeakPolarHBondContact O-CG 3.38Å; I18-L22 PolarHBondContact O-N 2.82Å; I18-L33 HydrophobicContact CD1-CB 4.44Å; I18-L33 HydrophobicContact CG1-CB 3.9Å; I18-L33 HydrophobicContact CG1-CD1 4.44Å; I18-C34 VanDerWaalsContact CD1-SG 3.6Å; I18-I37 HydrophobicContact CD1-CD1 3.61Å; I18-F53 HydrophobicContact CD1-CE2 3.64Å; I18-F53 HydrophobicContact CD1-CZ 3.49Å; I18-F53 VanDerWaalsContact CD1-CZ 3.49Å; I18-V57 HydrophobicContact CG2-CG1 4.34Å
19Q76.7Confident76.1Confident116 Ų11677 Ų7754%0.54239%0.386SS..Hα-helixtrans-58-40.9176.9-75.1178.5-18.100112.1S15 E16 L22 Q23S15-Q19 WeakPolarHBondContact O-CG 3.48Å; S15-Q19 PolarHBondContact O-N 3.03Å; E16-Q19 PolarHBondContact O-N 3.32Å; Q19-L22 PolarHBondContact O-N 3.01Å; Q19-Q23 WeakPolarHBondContact O-CB 3.25Å; Q19-Q23 VanDerWaalsContact O-CG 3.25Å; Q19-Q23 WeakPolarHBondContact O-CG 3.44Å; Q19-Q23 PolarHBondContact O-N 3.49Å
20K79.8Confident77.8Confident142 Ų14271.8 Ų71.862%0.61736%0.363SS*.Hα-helixtrans-62.6-44.8174.9-72.9178.1-177.5-179.80112.6E16 A17 I18 Q23 A24E16-K20 WeakPolarHBondContact O-CG 3.45Å; E16-K20 PolarHBondContact O-N 2.98Å; A17-K20 PolarHBondContact O-N 2.93Å; I18-K20 VanDerWaalsContact C-N 3.28Å; I18-K20 PolarHBondContact O-N 3.41Å; K20-Q23 PolarHBondContact O-N 3.1Å; K20-A24 WeakPolarHBondContact O-CB 3.5Å; K20-A24 PolarHBondContact O-N 2.99Å
21H80Confident79.4Confident57 Ų5770.7 Ų70.726%0.26435%0.354SS..Hα-helixtrans-66-38.4177.3-81.1-78.8000112.2A17 I18 A24 S25 N26 E29 A30A17-H21 PolarHBondContact O-CD2 2.84Å; A17-H21 VanDerWaalsContact O-CD2 3.27Å; A17-H21 PolarHBondContact O-N 3.01Å; I18-H21 PolarHBondContact O-N 3.45Å; I18-H21 VanDerWaalsContact O-N 3.14Å; H21-A24 CarbonylContact O-C 3.59Å; H21-A24 PolarHBondContact O-N 3.07Å; H21-S25 PolarHBondContact O-N 3.44Å; H21-N26 HydrophobicContact CB-CB 4.3Å; H21-N26 PolarHBondContact O-N 3.3Å; H21-E29 WeakPolarHBondContact ND1-CB 3.38Å; H21-A30 HydrophobicContact CB-CB 3.87Å
22L78.8Confident80.8Confident21 Ų2172 Ų7211%0.1136%0.359CS..Hα-helixtrans-64.6-42.5175.4-70168.9000111.7I18 Q19 A24 S25 Y27 A30 T60 F61I18-L22 HydrophobicContact CG2-CD1 3.5Å; I18-L22 HydrophobicContact CG2-CG 4.1Å; I18-L22 WeakPolarHBondContact O-CB 3.33Å; I18-L22 VanDerWaalsContact O-CG 3.25Å; I18-L22 WeakPolarHBondContact O-CG 3.38Å; I18-L22 PolarHBondContact O-N 2.82Å; Q19-L22 PolarHBondContact O-N 3.01Å; L22-A24 VanDerWaalsContact C-N 3.31Å; L22-A24 PolarHBondContact O-N 3.14Å; L22-S25 PolarHBondContact O-N 2.9Å; L22-S25 VanDerWaalsContact O-N 3.11Å; L22-Y27 HydrophobicContact CD2-CD1 3.77Å; L22-Y27 HydrophobicContact CD2-CE1 3.97Å; L22-A30 HydrophobicContact CD2-CB 3.97Å; L22-A30 HydrophobicContact CG-CB 4.06Å; L22-T60 HydrophobicContact CD1-CG2 3.67Å; L22-F61 HydrophobicContact CD2-CD2 4.24Å; L22-F61 HydrophobicContact CD2-CE1 4.32Å; L22-F61 HydrophobicContact CD2-CE2 3.87Å; L22-F61 HydrophobicContact CD2-CZ 3.92Å
23Q81.4Confident82.2Confident162 Ų16271.3 Ų71.376%0.75735%0.353SS*.Hα-helixtrans-63.2-36.7173.4-74.4173-1.900112.2Q19 K20 S25Q19-Q23 WeakPolarHBondContact O-CB 3.25Å; Q19-Q23 VanDerWaalsContact O-CG 3.25Å; Q19-Q23 WeakPolarHBondContact O-CG 3.44Å; Q19-Q23 PolarHBondContact O-N 3.49Å; K20-Q23 PolarHBondContact O-N 3.1Å; Q23-S25 PolarHBondContact O-N 3.27Å
24A85.2Confident83.7Confident56 Ų5662.9 Ų62.946%0.46332%0.321SS..THydrogen-bonded Turntrans-78.43.9175.500000113.8K20 H21 L22 N26K20-A24 WeakPolarHBondContact O-CB 3.5Å; K20-A24 PolarHBondContact O-N 2.99Å; H21-A24 CarbonylContact O-C 3.59Å; H21-A24 PolarHBondContact O-N 3.07Å; L22-A24 VanDerWaalsContact C-N 3.31Å; L22-A24 PolarHBondContact O-N 3.14Å; A24-N26 PolarHBondContact O-N 2.93Å; A24-N26 VanDerWaalsContact O-N 3.15Å
25S81.9Confident84.9Confident75 Ų7566.7 Ų66.752%0.52433%0.331SS..THydrogen-bonded Turntrans57.620.8-174-59.30000114.8H21 L22 Q23 Y27H21-S25 PolarHBondContact O-N 3.44Å; L22-S25 PolarHBondContact O-N 2.9Å; L22-S25 VanDerWaalsContact O-N 3.11Å; Q23-S25 PolarHBondContact O-N 3.27Å; S25-Y27 VanDerWaalsContact C-N 3.28Å; S25-Y27 WeakPolarHBondContact O-CD2 3.36Å; S25-Y27 PolarHBondContact O-N 3.41Å; S25-Y27 VanDerWaalsContact O-N 3.11Å
26N90.2Very high85.9Confident73 Ų7367.8 Ų67.839%0.3934%0.343SS..  trans-87.964.7176.5-71.7-17.1000110H21 A24 Y28 E29 A30H21-N26 HydrophobicContact CB-CB 4.3Å; H21-N26 PolarHBondContact O-N 3.3Å; A24-N26 PolarHBondContact O-N 2.93Å; A24-N26 VanDerWaalsContact O-N 3.15Å; N26-Y28 VanDerWaalsContact C-N 3.31Å; N26-Y28 PolarHBondContact O-N 2.95Å; N26-E29 HydrophobicContact CB-CB 4.41Å; N26-E29 WeakPolarHBondContact CB-OE2 3.4Å; N26-E29 PolarHBondContact O-N 3.32Å; N26-A30 WeakPolarHBondContact O-CB 2.95Å; N26-A30 PolarHBondContact O-N 3.34Å
27Y89.3Confident86.7Confident52 Ų5263.7 Ų63.720%0.20432%0.324CS..Hα-helixtrans-66.1-31.1-172.2-62.5-75.9000113.6L22 S25 L31 F61 A64 K66L22-Y27 HydrophobicContact CD2-CD1 3.77Å; L22-Y27 HydrophobicContact CD2-CE1 3.97Å; S25-Y27 VanDerWaalsContact C-N 3.28Å; S25-Y27 WeakPolarHBondContact O-CD2 3.36Å; S25-Y27 PolarHBondContact O-N 3.41Å; S25-Y27 VanDerWaalsContact O-N 3.11Å; Y27-L31 WeakPolarHBondContact O-CB 3.29Å; Y27-L31 PolarHBondContact O-N 3.41Å; Y27-F61 HydrophobicContact CD1-CD1 4.38Å; Y27-F61 HydrophobicContact CD1-CE1 4.23Å; Y27-A64 HydrophobicContact CD1-CB 4.29Å; Y27-A64 HydrophobicContact CE1-CB 3.37Å; Y27-K66 HydrophobicContact CD1-CG 3.81Å; Y27-K66 HydrophobicContact CD2-CD 4.25Å; Y27-K66 HydrophobicContact CD2-CG 4.24Å; Y27-K66 HydrophobicContact CE1-CG 4.17Å; Y27-K66 HydrophobicContact CG-CD 4.3Å; Y27-K66 HydrophobicContact CG-CG 3.84Å
28Y90.4Very high87.4Confident155 Ų15562 Ų6261%0.60831%0.31SS*.Hα-helixtrans-66.2-48.6178.1176.2-100.7000110.8N26 L31 Q32N26-Y28 VanDerWaalsContact C-N 3.31Å; N26-Y28 PolarHBondContact O-N 2.95Å; Y28-L31 WeakPolarHBondContact O-CB 3.44Å; Y28-L31 PolarHBondContact O-N 3.08Å; Y28-Q32 HydrophobicContact CE1-CG 4.12Å; Y28-Q32 WeakPolarHBondContact O-CG 3.23Å; Y28-Q32 PolarHBondContact O-N 3.26Å
29E90.5Very high88.1Confident81 Ų8165.7 Ų65.738%0.37934%0.336SS..Hα-helixtrans-63.8-42.3177.6-67.969.7-159.100110.9H21 N26 L31 Q32 L33H21-E29 WeakPolarHBondContact ND1-CB 3.38Å; N26-E29 HydrophobicContact CB-CB 4.41Å; N26-E29 WeakPolarHBondContact CB-OE2 3.4Å; N26-E29 PolarHBondContact O-N 3.32Å; E29-L31 VanDerWaalsContact C-N 3.31Å; E29-L31 PolarHBondContact O-N 2.98Å; E29-Q32 PolarHBondContact O-N 3.04Å; E29-L33 WeakPolarHBondContact O-CG 3.3Å; E29-L33 PolarHBondContact O-N 3.47Å
30A92.2Very high88.8Confident0 Ų064.1 Ų64.10%033%0.325CS..Hα-helixtrans-57.2-44.5173.100000111.4H21 L22 N26 L33 C34 F61H21-A30 HydrophobicContact CB-CB 3.87Å; L22-A30 HydrophobicContact CD2-CB 3.97Å; L22-A30 HydrophobicContact CG-CB 4.06Å; N26-A30 WeakPolarHBondContact O-CB 2.95Å; N26-A30 PolarHBondContact O-N 3.34Å; A30-L33 PolarHBondContact O-N 3.08Å; A30-C34 PolarHBondContact O-N 2.99Å; A30-C34 PolarHBondContact O-SG 3.02Å; A30-F61 HydrophobicContact CB-CE2 4.38Å; A30-F61 HydrophobicContact CB-CZ 3.72Å
31L92.7Very high89.4Confident15 Ų1557.6 Ų57.68%0.07930%0.297CS..Hα-helixtrans-64.7-42.4179.3-178.762.2000112.1Y27 Y28 E29 L33 C34 R35 F61 L73Y27-L31 WeakPolarHBondContact O-CB 3.29Å; Y27-L31 PolarHBondContact O-N 3.41Å; Y28-L31 WeakPolarHBondContact O-CB 3.44Å; Y28-L31 PolarHBondContact O-N 3.08Å; E29-L31 VanDerWaalsContact C-N 3.31Å; E29-L31 PolarHBondContact O-N 2.98Å; L31-L33 VanDerWaalsContact C-N 3.32Å; L31-L33 PolarHBondContact O-N 2.87Å; L31-C34 WeakPolarHBondContact O-CB 3.47Å; L31-C34 PolarHBondContact O-N 2.94Å; L31-R35 WeakPolarHBondContact O-CG 3.42Å; L31-R35 PolarHBondContact O-N 3.2Å; L31-F61 HydrophobicContact CB-CE1 4.26Å; L31-F61 HydrophobicContact CB-CZ 4.12Å; L31-L73 HydrophobicContact CD1-CD1 4.19Å; L31-L73 HydrophobicContact CD1-CD2 3.76Å; L31-L73 HydrophobicContact CD1-CG 3.74Å
32Q93.2Very high89.9Confident66 Ų6657.1 Ų57.131%0.30830%0.298SS..Hα-helixtrans-63.7-39176.7-62.1-52.8-31.400111.9Y28 E29 R35 A36Y28-Q32 HydrophobicContact CE1-CG 4.12Å; Y28-Q32 WeakPolarHBondContact O-CG 3.23Å; Y28-Q32 PolarHBondContact O-N 3.26Å; E29-Q32 PolarHBondContact O-N 3.04Å; Q32-R35 PolarHBondContact O-N 3.32Å; Q32-A36 WeakPolarHBondContact O-CB 3.47Å; Q32-A36 PolarHBondContact O-N 3.45Å
33L92.3Very high90.4Very high61 Ų6160.2 Ų60.232%0.31933%0.327SS..Hα-helixtrans-62.7-43.1173.1-70.5174.1000111.4A17 I18 E29 A30 L31 R35 A36 I37A17-L33 HydrophobicContact CB-CD1 4.34Å; I18-L33 HydrophobicContact CD1-CB 4.44Å; I18-L33 HydrophobicContact CG1-CB 3.9Å; I18-L33 HydrophobicContact CG1-CD1 4.44Å; E29-L33 WeakPolarHBondContact O-CG 3.3Å; E29-L33 PolarHBondContact O-N 3.47Å; A30-L33 PolarHBondContact O-N 3.08Å; L31-L33 VanDerWaalsContact C-N 3.32Å; L31-L33 PolarHBondContact O-N 2.87Å; L33-R35 PolarHBondContact O-N 3.01Å; L33-A36 PolarHBondContact O-N 3.35Å; L33-I37 WeakPolarHBondContact O-CG1 3.39Å; L33-I37 PolarHBondContact O-N 3.23Å
34C93.1Very high90.9Very high0 Ų055.9 Ų55.90%031%0.307CS..Hα-helixtrans-58-46174.7-67.90000111.9I18 A30 L31 A36 I37 G38 F53 L73I18-C34 VanDerWaalsContact CD1-SG 3.6Å; A30-C34 PolarHBondContact O-N 2.99Å; A30-C34 PolarHBondContact O-SG 3.02Å; L31-C34 WeakPolarHBondContact O-CB 3.47Å; L31-C34 PolarHBondContact O-N 2.94Å; C34-A36 PolarHBondContact O-N 3.2Å; C34-I37 PolarHBondContact O-N 3.31Å; C34-G38 PolarHBondContact O-N 2.94Å; C34-F53 HydrophobicContact CB-CE1 4.38Å; C34-F53 HydrophobicContact CB-CZ 4.28Å; C34-L73 HydrophobicContact CB-CD2 3.72Å
35R93.4Very high91Very high93 Ų9361.9 Ų61.935%0.35132%0.322SS..Hα-helixtrans-61.4-43.1176.7-72.4173.4171.7177.3-7.4112.5L31 Q32 L33 G38 S39 D72L31-R35 WeakPolarHBondContact O-CG 3.42Å; L31-R35 PolarHBondContact O-N 3.2Å; Q32-R35 PolarHBondContact O-N 3.32Å; L33-R35 PolarHBondContact O-N 3.01Å; R35-G38 PolarHBondContact O-N 2.94Å; R35-S39 WeakPolarHBondContact O-CB 3.42Å; R35-S39 PolarHBondContact O-N 3.32Å; R35-D72 IonicContact CZ-OD1 3.67Å; R35-D72 IonicContact CZ-OD2 3.14Å; R35-D72 IonicContact NE-OD1 3.89Å; R35-D72 IonicContact NE-OD2 2.66Å; R35-D72 PolarHBondContact NE-OD2 3.03Å; R35-D72 IonicContact NH2-OD1 2.82Å; R35-D72 PolarHBondContact NH2-OD1 3.44Å; R35-D72 IonicContact NH2-OD2 2.84Å; R35-D72 PolarHBondContact NH2-OD2 2.96Å
36A92.9Very high91.4Very high63 Ų6360.2 Ų60.252%0.52131%0.305SS..Hα-helixtrans-64.9-42.9178.400000112.2Q32 L33 C34 G38 R40Q32-A36 WeakPolarHBondContact O-CB 3.47Å; Q32-A36 PolarHBondContact O-N 3.45Å; L33-A36 PolarHBondContact O-N 3.35Å; C34-A36 PolarHBondContact O-N 3.2Å; A36-G38 VanDerWaalsContact C-N 3.35Å; A36-R40 WeakPolarHBondContact O-CB 3.49Å; A36-R40 PolarHBondContact O-N 3.29Å
37I91.7Very high91.4Very high10 Ų1057.5 Ų57.55%0.05129%0.291CS..Hα-helixtrans-63.5-43.8173.8-67.5175.5000110.3L11 I18 L33 C34 R40 L41 F53L11-I37 HydrophobicContact CD1-CG2 3.83Å; I18-I37 HydrophobicContact CD1-CD1 3.61Å; L33-I37 WeakPolarHBondContact O-CG1 3.39Å; L33-I37 PolarHBondContact O-N 3.23Å; C34-I37 PolarHBondContact O-N 3.31Å; I37-R40 PolarHBondContact O-N 2.98Å; I37-L41 HydrophobicContact CG2-CD1 3.88Å; I37-L41 HydrophobicContact CG2-CG 4.31Å; I37-L41 WeakPolarHBondContact O-CG 3.05Å; I37-L41 PolarHBondContact O-N 3.49Å; I37-F53 HydrophobicContact CB-CE1 4.12Å; I37-F53 HydrophobicContact CB-CZ 4.12Å; I37-F53 HydrophobicContact CD1-CE2 4.23Å; I37-F53 HydrophobicContact CD1-CZ 4.02Å; I37-F53 HydrophobicContact CG2-CD1 4.1Å; I37-F53 HydrophobicContact CG2-CE1 3.81Å; I37-F53 HydrophobicContact CG2-CE2 4.31Å; I37-F53 HydrophobicContact CG2-CG 4.47Å; I37-F53 HydrophobicContact CG2-CZ 3.93Å
38G92.2Very high91.5Very high0 Ų059.2 Ų59.20%031%0.307CS..Hα-helixtrans-56.5-56.7178.200000112.5C34 R35 A36 R40 L41 T42C34-G38 PolarHBondContact O-N 2.94Å; R35-G38 PolarHBondContact O-N 2.94Å; A36-G38 VanDerWaalsContact C-N 3.35Å; G38-R40 VanDerWaalsContact C-N 3.26Å; G38-R40 PolarHBondContact O-N 2.7Å; G38-L41 PolarHBondContact O-N 2.91Å; G38-L41 VanDerWaalsContact O-N 3.08Å; G38-T42 PolarHBondContact O-N 2.87Å; G38-T42 PolarHBondContact O-OG1 3.35Å
39S91.7Very high91.5Very high82 Ų8255.2 Ų55.257%0.57329%0.293SS*.Hα-helixtrans-54.1-42.3177.1178.90000112.5R35 A43R35-S39 WeakPolarHBondContact O-CB 3.42Å; R35-S39 PolarHBondContact O-N 3.32Å; S39-A43 WeakPolarHBondContact O-CB 3.48Å; S39-A43 PolarHBondContact O-N 2.71Å
40R92.3Very high91.5Very high83 Ų8351.3 Ų51.331%0.31328%0.275SS..Hα-helixtrans-64.5-44.6177.3-179.1-17865.5-176.91.1112.4A36 I37 G38 A43 Q44A36-R40 WeakPolarHBondContact O-CB 3.49Å; A36-R40 PolarHBondContact O-N 3.29Å; I37-R40 PolarHBondContact O-N 2.98Å; G38-R40 VanDerWaalsContact C-N 3.26Å; G38-R40 PolarHBondContact O-N 2.7Å; R40-A43 PolarHBondContact O-N 2.91Å; R40-Q44 VanDerWaalsContact O-CG 3.27Å; R40-Q44 WeakPolarHBondContact O-CG 3.46Å; R40-Q44 PolarHBondContact O-N 3.4Å
41L91.1Very high91.6Very high4 Ų451.5 Ų51.52%0.02128%0.276CS..Hα-helixtrans-68.1-39.1179.2-71174.5000111.6L11 I37 G38 Q44 K45 K46 L50L11-L41 HydrophobicContact CD1-CD1 3.96Å; I37-L41 HydrophobicContact CG2-CD1 3.88Å; I37-L41 HydrophobicContact CG2-CG 4.31Å; I37-L41 WeakPolarHBondContact O-CG 3.05Å; I37-L41 PolarHBondContact O-N 3.49Å; G38-L41 PolarHBondContact O-N 2.91Å; G38-L41 VanDerWaalsContact O-N 3.08Å; L41-Q44 CarbonylContact O-C 3.5Å; L41-Q44 PolarHBondContact O-N 2.95Å; L41-K45 PolarHBondContact O-N 3.41Å; L41-K45 VanDerWaalsContact O-N 3.13Å; L41-K46 HydrophobicContact CD2-CB 4.1Å; L41-K46 HydrophobicContact CD2-CD 4.02Å; L41-K46 PolarHBondContact O-N 3.1Å; L41-L50 HydrophobicContact CB-CB 3.98Å; L41-L50 HydrophobicContact CB-CD1 4.19Å; L41-L50 HydrophobicContact CB-CD2 4.49Å; L41-L50 HydrophobicContact CB-CG 4.47Å; L41-L50 HydrophobicContact CD1-CB 4.09Å; L41-L50 HydrophobicContact CD1-CD1 4.02Å
42T90.9Very high91.5Very high48 Ų4854.3 Ų54.329%0.29429%0.291SS..Hα-helixtrans-59.2-48.1172.1-53.70000111.1G38 Q44 K45 L50G38-T42 PolarHBondContact O-N 2.87Å; G38-T42 PolarHBondContact O-OG1 3.35Å; T42-Q44 PolarHBondContact O-N 3.28Å; T42-K45 PolarHBondContact O-N 3.12Å; T42-L50 VanDerWaalsContact OG1-CD2 3.26Å; T42-L50 WeakPolarHBondContact OG1-CD2 3.31Å
43A90.7Very high91.5Very high86 Ų8652.3 Ų52.371%0.71128%0.282SS*.Hα-helixtrans-61.6-31.7177.500000112.7S39 R40 K45S39-A43 WeakPolarHBondContact O-CB 3.48Å; S39-A43 PolarHBondContact O-N 2.71Å; R40-A43 PolarHBondContact O-N 2.91Å; A43-K45 VanDerWaalsContact C-N 3.28Å
44Q91.1Very high91.5Very high71 Ų7149.4 Ų49.433%0.33227%0.266SS..THydrogen-bonded Turntrans-82.6-0.5175.2-68.5177.227.300113.8R40 L41 T42 K46R40-Q44 VanDerWaalsContact O-CG 3.27Å; R40-Q44 WeakPolarHBondContact O-CG 3.46Å; R40-Q44 PolarHBondContact O-N 3.4Å; L41-Q44 CarbonylContact O-C 3.5Å; L41-Q44 PolarHBondContact O-N 2.95Å; T42-Q44 PolarHBondContact O-N 3.28Å; Q44-K46 HydrophobicContact CB-CD 3.98Å; Q44-K46 HydrophobicContact CB-CG 4.17Å; Q44-K46 PolarHBondContact O-N 2.86Å
45K88.3Confident91.5Very high181 Ų18151.3 Ų51.379%0.78728%0.276SS*.THydrogen-bonded Turntrans56.924.5-174.7-56-177.4177-175.70114L41 T42 A43 I47L41-K45 PolarHBondContact O-N 3.41Å; L41-K45 VanDerWaalsContact O-N 3.13Å; T42-K45 PolarHBondContact O-N 3.12Å; A43-K45 VanDerWaalsContact C-N 3.28Å; K45-I47 VanDerWaalsContact C-N 3.28Å; K45-I47 PolarHBondContact O-N 2.87Å; K45-I47 VanDerWaalsContact O-N 3.12Å
46K89.7Confident91.4Very high40 Ų4048.7 Ų48.717%0.17428%0.277CS..  trans-88.265.2177.8-74.8169161.4-97.50110.1L41 Q44 E49 L50L41-K46 HydrophobicContact CD2-CB 4.1Å; L41-K46 HydrophobicContact CD2-CD 4.02Å; L41-K46 PolarHBondContact O-N 3.1Å; Q44-K46 HydrophobicContact CB-CD 3.98Å; Q44-K46 HydrophobicContact CB-CG 4.17Å; Q44-K46 PolarHBondContact O-N 2.86Å; K46-E49 HydrophobicContact CB-CB 4.26Å; K46-E49 IonicContact NZ-OE1 3.12Å; K46-E49 PolarHBondContact NZ-OE1 3.47Å; K46-E49 IonicContact NZ-OE2 3.81Å; K46-E49 PolarHBondContact NZ-OE2 3.35Å; K46-L50 WeakPolarHBondContact O-CB 3.49Å; K46-L50 PolarHBondContact O-N 3.18Å; K46-L50 VanDerWaalsContact O-N 3.08Å
47I90.4Very high91.4Very high16 Ų1646.3 Ų46.38%0.08226%0.256CS..Hα-helixtrans-68.1-41.9-170.7-54.6-60.4000111.6K45 L50 L51 A80K45-I47 VanDerWaalsContact C-N 3.28Å; K45-I47 PolarHBondContact O-N 2.87Å; K45-I47 VanDerWaalsContact O-N 3.12Å; I47-L50 WeakPolarHBondContact O-CB 3.43Å; I47-L50 PolarHBondContact O-N 3.04Å; I47-L50 VanDerWaalsContact O-N 3.15Å; I47-L51 HydrophobicContact CG2-CD1 4.14Å; I47-L51 HydrophobicContact CG2-CG 4.32Å; I47-L51 WeakPolarHBondContact O-CG 3.48Å; I47-L51 PolarHBondContact O-N 3.15Å; I47-A80 WeakPolarHBondContact CG2-O 3.37Å
48V89.9Confident91.4Very high89 Ų8945.8 Ų45.854%0.53925%0.254SS..Hα-helixtrans-60.6-50.2178.4-177.90000111.4L50 L51 D52V48-L50 PolarHBondContact O-N 3.34Å; V48-L51 PolarHBondContact O-N 3.06Å; V48-L51 VanDerWaalsContact O-N 3.11Å; V48-D52 PolarHBondContact O-N 3.03Å
49E90.3Very high91.4Very high70 Ų7048.9 Ų48.933%0.32727%0.27SS..Hα-helixtrans-59.3-34.1176.4-66.8171.5-12800112.1K46 F53K46-E49 HydrophobicContact CB-CB 4.26Å; K46-E49 IonicContact NZ-OE1 3.12Å; K46-E49 PolarHBondContact NZ-OE1 3.47Å; K46-E49 IonicContact NZ-OE2 3.81Å; K46-E49 PolarHBondContact NZ-OE2 3.35Å; E49-F53 VanDerWaalsContact O-CB 3.27Å; E49-F53 WeakPolarHBondContact O-CB 3.44Å; E49-F53 PolarHBondContact O-N 3.36Å; E49-F53 VanDerWaalsContact O-N 3.08Å
50L92.3Very high91.3Very high0 Ų047.7 Ų47.70%026%0.259CS..Hα-helixtrans-67.7-45.5175.817757000111.6L41 T42 K46 I47 V48 F53 L54 A80L41-L50 HydrophobicContact CB-CB 3.98Å; L41-L50 HydrophobicContact CB-CD1 4.19Å; L41-L50 HydrophobicContact CB-CD2 4.49Å; L41-L50 HydrophobicContact CB-CG 4.47Å; L41-L50 HydrophobicContact CD1-CB 4.09Å; L41-L50 HydrophobicContact CD1-CD1 4.02Å; T42-L50 VanDerWaalsContact OG1-CD2 3.26Å; T42-L50 WeakPolarHBondContact OG1-CD2 3.31Å; K46-L50 WeakPolarHBondContact O-CB 3.49Å; K46-L50 PolarHBondContact O-N 3.18Å; K46-L50 VanDerWaalsContact O-N 3.08Å; I47-L50 WeakPolarHBondContact O-CB 3.43Å; I47-L50 PolarHBondContact O-N 3.04Å; I47-L50 VanDerWaalsContact O-N 3.15Å; V48-L50 PolarHBondContact O-N 3.34Å; L50-F53 HydrophobicContact CD1-CD1 4.39Å; L50-F53 PolarHBondContact O-N 3.08Å; L50-L54 HydrophobicContact CD1-CD1 3.72Å; L50-L54 HydrophobicContact CD1-CD2 4.32Å; L50-L54 HydrophobicContact CD1-CG 3.78Å; L50-L54 HydrophobicContact CG-CD1 3.77Å; L50-L54 HydrophobicContact CG-CG 4.26Å; L50-L54 WeakPolarHBondContact O-CB 3.4Å; L50-L54 WeakPolarHBondContact O-CG 3.13Å; L50-L54 PolarHBondContact O-N 3.36Å; L50-A80 HydrophobicContact CD2-CB 3.59Å; L50-A80 HydrophobicContact CG-CB 4.14Å
51L92.9Very high91.3Very high3 Ų343.8 Ų43.82%0.01624%0.244CC..Hα-helixtrans-64.2-43.9179.8-64171.8000111.6I47 V48 F53 L54 E55 F77 A80 L81 K95I47-L51 HydrophobicContact CG2-CD1 4.14Å; I47-L51 HydrophobicContact CG2-CG 4.32Å; I47-L51 WeakPolarHBondContact O-CG 3.48Å; I47-L51 PolarHBondContact O-N 3.15Å; V48-L51 PolarHBondContact O-N 3.06Å; V48-L51 VanDerWaalsContact O-N 3.11Å; L51-F53 VanDerWaalsContact C-N 3.33Å; L51-F53 PolarHBondContact O-N 3.3Å; L51-L54 PolarHBondContact O-N 3.26Å; L51-E55 WeakPolarHBondContact O-CB 3.33Å; L51-E55 PolarHBondContact O-N 3.13Å; L51-F77 HydrophobicContact CB-CE2 4.06Å; L51-F77 HydrophobicContact CD2-CD1 4.4Å; L51-F77 HydrophobicContact CD2-CD2 3.79Å; L51-F77 HydrophobicContact CD2-CE1 4.29Å; L51-F77 HydrophobicContact CD2-CE2 3.65Å; L51-F77 HydrophobicContact CD2-CG 4.15Å; L51-F77 HydrophobicContact CD2-CZ 3.91Å; L51-F77 HydrophobicContact CG-CE2 4.44Å; L51-A80 HydrophobicContact CD2-CB 4Å; L51-L81 HydrophobicContact CD1-CD2 3.59Å; L51-L81 HydrophobicContact CD1-CG 4.47Å; L51-L81 HydrophobicContact CD2-CD2 3.93Å; L51-L81 HydrophobicContact CD2-CG 3.91Å; L51-L81 HydrophobicContact CG-CD2 4.43Å; L51-K95 HydrophobicContact CB-CD 4.19Å
52D91.7Very high91.2Very high75 Ų7544 Ų4440%0.40125%0.247SC..Hα-helixtrans-59.1-45.1174.4-68.8-35.8000111.3V48 G56 K95V48-D52 PolarHBondContact O-N 3.03Å; D52-G56 PolarHBondContact O-N 3.38Å; D52-K95 WeakPolarHBondContact OD1-CE 3.42Å; D52-K95 IonicContact OD1-NZ 3.93Å; D52-K95 PolarHBondContact OD1-NZ 3.32Å
53F91.8Very high91.1Very high23 Ų2349.4 Ų49.410%0.10127%0.269CS..Hα-helixtrans-61.9-47.2177.4168.2-104.3000111.7I18 C34 I37 E49 L50 L51 G56 V57I18-F53 HydrophobicContact CD1-CE2 3.64Å; I18-F53 HydrophobicContact CD1-CZ 3.49Å; I18-F53 VanDerWaalsContact CD1-CZ 3.49Å; C34-F53 HydrophobicContact CB-CE1 4.38Å; C34-F53 HydrophobicContact CB-CZ 4.28Å; I37-F53 HydrophobicContact CB-CE1 4.12Å; I37-F53 HydrophobicContact CB-CZ 4.12Å; I37-F53 HydrophobicContact CD1-CE2 4.23Å; I37-F53 HydrophobicContact CD1-CZ 4.02Å; I37-F53 HydrophobicContact CG2-CD1 4.1Å; I37-F53 HydrophobicContact CG2-CE1 3.81Å; I37-F53 HydrophobicContact CG2-CE2 4.31Å; I37-F53 HydrophobicContact CG2-CG 4.47Å; I37-F53 HydrophobicContact CG2-CZ 3.93Å; E49-F53 VanDerWaalsContact O-CB 3.27Å; E49-F53 WeakPolarHBondContact O-CB 3.44Å; E49-F53 PolarHBondContact O-N 3.36Å; E49-F53 VanDerWaalsContact O-N 3.08Å; L50-F53 HydrophobicContact CD1-CD1 4.39Å; L50-F53 PolarHBondContact O-N 3.08Å; L51-F53 VanDerWaalsContact C-N 3.33Å; L51-F53 PolarHBondContact O-N 3.3Å; F53-G56 PolarHBondContact O-N 3.14Å; F53-V57 HydrophobicContact CD2-CG1 4.25Å; F53-V57 HydrophobicContact CE1-CG2 4.4Å; F53-V57 HydrophobicContact CE2-CG1 3.69Å; F53-V57 HydrophobicContact CZ-CG1 3.84Å; F53-V57 HydrophobicContact CZ-CG2 4.47Å; F53-V57 WeakPolarHBondContact O-CG2 3.44Å; F53-V57 PolarHBondContact O-N 2.87Å; F53-V57 VanDerWaalsContact O-N 3.14Å
54L93.7Very high91Very high0 Ų046.9 Ų46.90%025%0.248CC..Hα-helixtrans-64.8-43.5-177.8-72.3174.9000112.2L50 L51 G56 V57 I58 L73 M76 F77L50-L54 HydrophobicContact CD1-CD1 3.72Å; L50-L54 HydrophobicContact CD1-CD2 4.32Å; L50-L54 HydrophobicContact CD1-CG 3.78Å; L50-L54 HydrophobicContact CG-CD1 3.77Å; L50-L54 HydrophobicContact CG-CG 4.26Å; L50-L54 WeakPolarHBondContact O-CB 3.4Å; L50-L54 WeakPolarHBondContact O-CG 3.13Å; L50-L54 PolarHBondContact O-N 3.36Å; L51-L54 PolarHBondContact O-N 3.26Å; L54-G56 VanDerWaalsContact C-N 3.35Å; L54-G56 PolarHBondContact O-N 3.24Å; L54-V57 HydrophobicContact CD2-CG2 4.48Å; L54-V57 WeakPolarHBondContact O-CG2 3.36Å; L54-V57 PolarHBondContact O-N 3.36Å; L54-I58 HydrophobicContact CB-CD1 4.36Å; L54-I58 VanDerWaalsContact O-CB 3.24Å; L54-I58 WeakPolarHBondContact O-CB 3.34Å; L54-I58 WeakPolarHBondContact O-CD1 3.24Å; L54-I58 WeakPolarHBondContact O-CG1 3.42Å; L54-I58 PolarHBondContact O-N 3.46Å; L54-L73 HydrophobicContact CD2-CD2 4.33Å; L54-M76 HydrophobicContact CD1-CG 4.06Å; L54-M76 HydrophobicContact CD2-CE 3.3Å; L54-M76 HydrophobicContact CD2-CG 4.25Å; L54-M76 HydrophobicContact CD2-SD 4.32Å; L54-F77 HydrophobicContact CB-CD2 3.8Å; L54-F77 HydrophobicContact CD1-CB 4.02Å; L54-F77 HydrophobicContact CD1-CD2 4.28Å
55E93.5Very high90.8Very high41 Ų4145.5 Ų45.519%0.19225%0.253CS..Hα-helixtrans-53.4-52.4175.2179.6-174.2-148.900111L51 V57 I58 L59 K95 T98L51-E55 WeakPolarHBondContact O-CB 3.33Å; L51-E55 PolarHBondContact O-N 3.13Å; E55-V57 PolarHBondContact O-N 3.39Å; E55-I58 PolarHBondContact O-N 3.14Å; E55-L59 PolarHBondContact O-N 3.43Å; E55-L59 VanDerWaalsContact O-N 3.13Å; E55-K95 WeakPolarHBondContact OE1-CA 3.36Å; E55-K95 WeakPolarHBondContact OE2-CG 3.18Å; E55-T98 HydrophobicContact CG-CG2 3.92Å; E55-T98 WeakPolarHBondContact OE1-CB 3.46Å; E55-T98 PolarHBondContact OE1-OG1 3.02Å
56G91.1Very high90.9Very high38 Ų3841 Ų4139%0.39223%0.233SC..Hα-helixtrans-62.8-43.1-17800000113.5D52 F53 L54 T60D52-G56 PolarHBondContact O-N 3.38Å; F53-G56 PolarHBondContact O-N 3.14Å; L54-G56 VanDerWaalsContact C-N 3.35Å; L54-G56 PolarHBondContact O-N 3.24Å; G56-T60 PolarHBondContact O-N 2.7Å; G56-T60 PolarHBondContact O-OG1 2.81Å
57V92.2Very high90.8Very high12 Ų1239.8 Ų39.87%0.07323%0.231CC..Hα-helixtrans-70.9-39178-61.70000111.7I18 F53 L54 E55 L59 T60 F61 L73I18-V57 HydrophobicContact CG2-CG1 4.34Å; F53-V57 HydrophobicContact CD2-CG1 4.25Å; F53-V57 HydrophobicContact CE1-CG2 4.4Å; F53-V57 HydrophobicContact CE2-CG1 3.69Å; F53-V57 HydrophobicContact CZ-CG1 3.84Å; F53-V57 HydrophobicContact CZ-CG2 4.47Å; F53-V57 WeakPolarHBondContact O-CG2 3.44Å; F53-V57 PolarHBondContact O-N 2.87Å; F53-V57 VanDerWaalsContact O-N 3.14Å; L54-V57 HydrophobicContact CD2-CG2 4.48Å; L54-V57 WeakPolarHBondContact O-CG2 3.36Å; L54-V57 PolarHBondContact O-N 3.36Å; E55-V57 PolarHBondContact O-N 3.39Å; V57-L59 VanDerWaalsContact C-N 3.31Å; V57-L59 PolarHBondContact O-N 3.43Å; V57-T60 PolarHBondContact O-N 3.3Å; V57-T60 VanDerWaalsContact O-N 3.1Å; V57-F61 HydrophobicContact CB-CD2 4.5Å; V57-F61 VanDerWaalsContact O-CD2 3.3Å; V57-F61 WeakPolarHBondContact O-CD2 3.46Å; V57-F61 PolarHBondContact O-N 3.35Å; V57-L73 HydrophobicContact CG2-CD1 4.11Å; V57-L73 HydrophobicContact CG2-CD2 4.29Å
58I92.8Very high90.8Very high0 Ų043 Ų430%026%0.255CS..Hα-helixtrans-56.6-47.6177.7-77.7165.5000110.6L54 E55 T60 F61 A62 V70 L73 F77 V99 A102L54-I58 HydrophobicContact CB-CD1 4.36Å; L54-I58 VanDerWaalsContact O-CB 3.24Å; L54-I58 WeakPolarHBondContact O-CB 3.34Å; L54-I58 WeakPolarHBondContact O-CD1 3.24Å; L54-I58 WeakPolarHBondContact O-CG1 3.42Å; L54-I58 PolarHBondContact O-N 3.46Å; E55-I58 PolarHBondContact O-N 3.14Å; I58-T60 VanDerWaalsContact C-N 3.32Å; I58-T60 PolarHBondContact O-N 3.24Å; I58-F61 PolarHBondContact O-N 3.5Å; I58-A62 VanDerWaalsContact O-CB 3.29Å; I58-A62 WeakPolarHBondContact O-CB 3.43Å; I58-A62 PolarHBondContact O-N 2.91Å; I58-V70 HydrophobicContact CG2-CG1 4.08Å; I58-L73 HydrophobicContact CD1-CB 4.03Å; I58-L73 HydrophobicContact CG1-CB 3.48Å; I58-L73 VanDerWaalsContact CG1-CB 3.48Å; I58-L73 HydrophobicContact CG1-CD1 4.21Å; I58-L73 HydrophobicContact CG1-CG 4.47Å; I58-F77 HydrophobicContact CD1-CB 4.28Å; I58-V99 HydrophobicContact CD1-CG1 3.87Å; I58-V99 HydrophobicContact CD1-CG2 3.83Å; I58-V99 HydrophobicContact CG2-CG1 4.38Å; I58-V99 HydrophobicContact CG2-CG2 4.34Å; I58-A102 HydrophobicContact CG2-CB 3.86Å
59L90.8Very high90.9Very high65 Ų6539.6 Ų39.634%0.3424%0.235SC..Hα-helixtrans-57.3-46.3176-75.3179.8000111.8E55 V57 F61 A62 E63 T98E55-L59 PolarHBondContact O-N 3.43Å; E55-L59 VanDerWaalsContact O-N 3.13Å; V57-L59 VanDerWaalsContact C-N 3.31Å; V57-L59 PolarHBondContact O-N 3.43Å; L59-F61 PolarHBondContact O-N 3.46Å; L59-A62 WeakPolarHBondContact O-CB 3.24Å; L59-A62 PolarHBondContact O-N 3.28Å; L59-A62 VanDerWaalsContact O-N 3.12Å; L59-E63 WeakPolarHBondContact O-CG 3.41Å; L59-E63 PolarHBondContact O-N 3.39Å; L59-T98 HydrophobicContact CD1-CG2 3.63Å; L59-T98 HydrophobicContact CD2-CG2 3.54Å; L59-T98 HydrophobicContact CG-CG2 3.69Å
60T90.7Very high91.1Very high57 Ų5736.4 Ų36.435%0.3522%0.22SC..Hα-helixtrans-64.2-40.5-178.9-45.10000112.1L22 G56 V57 I58 A62 A64L22-T60 HydrophobicContact CD1-CG2 3.67Å; G56-T60 PolarHBondContact O-N 2.7Å; G56-T60 PolarHBondContact O-OG1 2.81Å; V57-T60 PolarHBondContact O-N 3.3Å; V57-T60 VanDerWaalsContact O-N 3.1Å; I58-T60 VanDerWaalsContact C-N 3.32Å; I58-T60 PolarHBondContact O-N 3.24Å; T60-A62 VanDerWaalsContact C-N 3.35Å; T60-A64 WeakPolarHBondContact O-CB 3.37Å; T60-A64 PolarHBondContact O-N 3.31Å; T60-A64 VanDerWaalsContact O-N 3.14Å
61F91.5Very high91.1Very high0 Ų037.2 Ų37.20%023%0.225CC..Hα-helixtrans-68.8-33.3174.6-85.2-93.2000112.3L22 Y27 A30 L31 V57 I58 L59 A64 G65 K66 V70 L73L22-F61 HydrophobicContact CD2-CD2 4.24Å; L22-F61 HydrophobicContact CD2-CE1 4.32Å; L22-F61 HydrophobicContact CD2-CE2 3.87Å; L22-F61 HydrophobicContact CD2-CZ 3.92Å; Y27-F61 HydrophobicContact CD1-CD1 4.38Å; Y27-F61 HydrophobicContact CD1-CE1 4.23Å; A30-F61 HydrophobicContact CB-CE2 4.38Å; A30-F61 HydrophobicContact CB-CZ 3.72Å; L31-F61 HydrophobicContact CB-CE1 4.26Å; L31-F61 HydrophobicContact CB-CZ 4.12Å; V57-F61 HydrophobicContact CB-CD2 4.5Å; V57-F61 VanDerWaalsContact O-CD2 3.3Å; V57-F61 WeakPolarHBondContact O-CD2 3.46Å; V57-F61 PolarHBondContact O-N 3.35Å; I58-F61 PolarHBondContact O-N 3.5Å; L59-F61 PolarHBondContact O-N 3.46Å; F61-A64 PolarHBondContact O-N 2.94Å; F61-G65 PolarHBondContact O-N 3.17Å; F61-K66 HydrophobicContact CD1-CB 4Å; F61-K66 HydrophobicContact CD1-CG 4.5Å; F61-K66 PolarHBondContact O-N 3.4Å; F61-V70 HydrophobicContact CB-CG2 3.82Å; F61-L73 HydrophobicContact CB-CD1 4.37Å; F61-L73 HydrophobicContact CD2-CD1 3.65Å; F61-L73 HydrophobicContact CE2-CD1 4.05Å; F61-L73 HydrophobicContact CG-CD1 4.02Å
62A89.9Confident91.1Very high10 Ų1039 Ų398%0.08323%0.234CC..Hα-helixtrans-69.1-41.1177.600000112.3I58 L59 T60 A64 G65 V70 A102 R106I58-A62 VanDerWaalsContact O-CB 3.29Å; I58-A62 WeakPolarHBondContact O-CB 3.43Å; I58-A62 PolarHBondContact O-N 2.91Å; L59-A62 WeakPolarHBondContact O-CB 3.24Å; L59-A62 PolarHBondContact O-N 3.28Å; L59-A62 VanDerWaalsContact O-N 3.12Å; T60-A62 VanDerWaalsContact C-N 3.35Å; A62-A64 VanDerWaalsContact C-N 3.34Å; A62-G65 PolarHBondContact O-N 3.38Å; A62-G65 VanDerWaalsContact O-N 3.16Å; A62-V70 HydrophobicContact CB-CG2 3.87Å; A62-A102 HydrophobicContact CB-CB 4Å; A62-R106 PolarHBondContact O-NH1 3.3Å; A62-R106 PolarHBondContact O-NH2 2.84Å
63E88.6Confident91.2Very high161 Ų16135.5 Ų35.575%0.75222%0.215SC*.Hα-helixtrans-61.9-40.7172.4-73.5173.2-178.200111.4L59 G65L59-E63 WeakPolarHBondContact O-CG 3.41Å; L59-E63 PolarHBondContact O-N 3.39Å; E63-G65 PolarHBondContact O-N 3.17Å; E63-G65 VanDerWaalsContact O-N 3.16Å
64A88.3Confident91.3Very high33 Ų3334.4 Ų34.427%0.27321%0.211SC..THydrogen-bonded Turntrans-72.50.5175.200000114.7Y27 T60 F61 A62 K66Y27-A64 HydrophobicContact CD1-CB 4.29Å; Y27-A64 HydrophobicContact CE1-CB 3.37Å; T60-A64 WeakPolarHBondContact O-CB 3.37Å; T60-A64 PolarHBondContact O-N 3.31Å; T60-A64 VanDerWaalsContact O-N 3.14Å; F61-A64 PolarHBondContact O-N 2.94Å; A62-A64 VanDerWaalsContact C-N 3.34Å; A64-K66 VanDerWaalsContact C-N 3.28Å; A64-K66 HydrophobicContact CB-CG 4.18Å; A64-K66 PolarHBondContact O-N 3.3Å
65G86.9Confident91.3Very high42 Ų4237.6 Ų37.643%0.43323%0.225SC..THydrogen-bonded Turntrans72.315.9178.500000115F61 A62 E63 A67F61-G65 PolarHBondContact O-N 3.17Å; A62-G65 PolarHBondContact O-N 3.38Å; A62-G65 VanDerWaalsContact O-N 3.16Å; E63-G65 PolarHBondContact O-N 3.17Å; E63-G65 VanDerWaalsContact O-N 3.16Å; G65-A67 VanDerWaalsContact C-N 3.33Å; G65-A67 PolarHBondContact O-N 3.4Å; G65-A67 VanDerWaalsContact O-N 3.13Å
66K89.4Confident91.4Very high85 Ų8537.2 Ų37.237%0.3722%0.223SC..  trans-91.366.4-175.6-58.3-50.5-178.9-174.40111.7Y27 F61 A64 S68 S69 V70Y27-K66 HydrophobicContact CD1-CG 3.81Å; Y27-K66 HydrophobicContact CD2-CD 4.25Å; Y27-K66 HydrophobicContact CD2-CG 4.24Å; Y27-K66 HydrophobicContact CE1-CG 4.17Å; Y27-K66 HydrophobicContact CG-CD 4.3Å; Y27-K66 HydrophobicContact CG-CG 3.84Å; F61-K66 HydrophobicContact CD1-CB 4Å; F61-K66 HydrophobicContact CD1-CG 4.5Å; F61-K66 PolarHBondContact O-N 3.4Å; A64-K66 VanDerWaalsContact C-N 3.28Å; A64-K66 HydrophobicContact CB-CG 4.18Å; A64-K66 PolarHBondContact O-N 3.3Å; K66-S68 VanDerWaalsContact C-N 3.33Å; K66-S68 PolarHBondContact O-N 2.92Å; K66-S69 WeakPolarHBondContact O-CB 3.36Å; K66-S69 PolarHBondContact O-N 3.39Å; K66-V70 PolarHBondContact O-N 3.11Å; K66-V70 VanDerWaalsContact O-N 3.08Å
67A88.6Confident91.5Very high16 Ų1635.4 Ų35.413%0.13221%0.205CC..Hα-helixtrans-61.3-35.5-169.300000114.2G65 S69 V70 D71 Y109G65-A67 VanDerWaalsContact C-N 3.33Å; G65-A67 PolarHBondContact O-N 3.4Å; G65-A67 VanDerWaalsContact O-N 3.13Å; A67-S69 VanDerWaalsContact C-N 3.32Å; A67-S69 PolarHBondContact O-N 3.47Å; A67-V70 WeakPolarHBondContact O-CB 3.47Å; A67-V70 PolarHBondContact O-N 3.21Å; A67-D71 PolarHBondContact O-N 3.23Å; A67-Y109 HydrophobicContact CB-CD1 3.11Å; A67-Y109 HydrophobicContact CB-CD2 4.35Å; A67-Y109 HydrophobicContact CB-CE1 3.55Å; A67-Y109 HydrophobicContact CB-CG 3.54Å; A67-Y109 WeakPolarHBondContact O-CE1 3.32Å
68S90.5Very high91.6Very high82 Ų8234.9 Ų34.957%0.57320%0.202SC*.Hα-helixtrans-64.3-33.9173.3174.40000113.5K66 D72K66-S68 VanDerWaalsContact C-N 3.33Å; K66-S68 PolarHBondContact O-N 2.92Å; S68-D72 PolarHBondContact O-N 2.98Å
69S92Very high91.6Very high18 Ų1838.8 Ų38.813%0.12622%0.222CC..Hα-helixtrans-72.4-35.6174.6-53.40000111.3K66 A67 D72 L73K66-S69 WeakPolarHBondContact O-CB 3.36Å; K66-S69 PolarHBondContact O-N 3.39Å; A67-S69 VanDerWaalsContact C-N 3.32Å; A67-S69 PolarHBondContact O-N 3.47Å; S69-D72 PolarHBondContact O-N 3.46Å; S69-L73 WeakPolarHBondContact O-CB 3.38Å; S69-L73 VanDerWaalsContact O-CG 3.23Å; S69-L73 WeakPolarHBondContact O-CG 3.42Å; S69-L73 PolarHBondContact O-N 2.91Å
70V93Very high91.7Very high3 Ų335.8 Ų35.82%0.01821%0.207CC..Hα-helixtrans-61.6-45.5174.6172.60000111.1I58 F61 A62 K66 A67 D72 L73 A74 A102 L103I58-V70 HydrophobicContact CG2-CG1 4.08Å; F61-V70 HydrophobicContact CB-CG2 3.82Å; A62-V70 HydrophobicContact CB-CG2 3.87Å; K66-V70 PolarHBondContact O-N 3.11Å; K66-V70 VanDerWaalsContact O-N 3.08Å; A67-V70 WeakPolarHBondContact O-CB 3.47Å; A67-V70 PolarHBondContact O-N 3.21Å; V70-D72 PolarHBondContact O-N 3.05Å; V70-L73 PolarHBondContact O-N 3.01Å; V70-A74 VanDerWaalsContact O-CB 3.24Å; V70-A74 WeakPolarHBondContact O-CB 3.43Å; V70-A74 PolarHBondContact O-N 3.19Å; V70-A102 HydrophobicContact CG1-CB 4.4Å; V70-L103 HydrophobicContact CG1-CD2 3.84Å; V70-L103 HydrophobicContact CG1-CG 4.48Å
71D92.3Very high91.8Very high18 Ų1833.1 Ų33.110%0.09619%0.191CC..Hα-helixtrans-60.1-43.3177.7-177.569.9000112.5A67 A74 K75 Y109 D112A67-D71 PolarHBondContact O-N 3.23Å; D71-A74 PolarHBondContact O-N 3.31Å; D71-K75 WeakPolarHBondContact O-CG 3.4Å; D71-K75 PolarHBondContact O-N 3.34Å; D71-K75 IonicContact OD1-NZ 2.94Å; D71-K75 WeakPolarHBondContact OD2-CE 3.28Å; D71-K75 IonicContact OD2-NZ 2.86Å; D71-K75 PolarHBondContact OD2-NZ 2.94Å; D71-Y109 HydrophobicContact CB-CE1 4.49Å; D71-Y109 WeakPolarHBondContact CB-OH 3.44Å; D71-D112 PolarHBondContact OD1-N 3.14Å
72D93.2Very high91.7Very high41 Ų4135.2 Ų35.222%0.21920%0.201CC..Hα-helixtrans-63.7-44.9175.9-17868.6000112.8R35 S68 S69 V70 A74 K75 M76R35-D72 IonicContact CZ-OD1 3.67Å; R35-D72 IonicContact CZ-OD2 3.14Å; R35-D72 IonicContact NE-OD1 3.89Å; R35-D72 IonicContact NE-OD2 2.66Å; R35-D72 PolarHBondContact NE-OD2 3.03Å; R35-D72 IonicContact NH2-OD1 2.82Å; R35-D72 PolarHBondContact NH2-OD1 3.44Å; R35-D72 IonicContact NH2-OD2 2.84Å; R35-D72 PolarHBondContact NH2-OD2 2.96Å; S68-D72 PolarHBondContact O-N 2.98Å; S69-D72 PolarHBondContact O-N 3.46Å; V70-D72 PolarHBondContact O-N 3.05Å; D72-A74 VanDerWaalsContact C-N 3.33Å; D72-A74 PolarHBondContact O-N 3.41Å; D72-K75 PolarHBondContact O-N 3.24Å; D72-M76 PolarHBondContact O-N 2.99Å; D72-M76 VanDerWaalsContact O-N 3.11Å
73L94.4Very high91.6Very high0 Ų039.7 Ų39.70%023%0.228CC..Hα-helixtrans-66.3-36.3176.5-68.4170.2000111.7L31 C34 L54 V57 I58 F61 S69 V70 M76 F77L31-L73 HydrophobicContact CD1-CD1 4.19Å; L31-L73 HydrophobicContact CD1-CD2 3.76Å; L31-L73 HydrophobicContact CD1-CG 3.74Å; C34-L73 HydrophobicContact CB-CD2 3.72Å; L54-L73 HydrophobicContact CD2-CD2 4.33Å; V57-L73 HydrophobicContact CG2-CD1 4.11Å; V57-L73 HydrophobicContact CG2-CD2 4.29Å; I58-L73 HydrophobicContact CD1-CB 4.03Å; I58-L73 HydrophobicContact CG1-CB 3.48Å; I58-L73 VanDerWaalsContact CG1-CB 3.48Å; I58-L73 HydrophobicContact CG1-CD1 4.21Å; I58-L73 HydrophobicContact CG1-CG 4.47Å; F61-L73 HydrophobicContact CB-CD1 4.37Å; F61-L73 HydrophobicContact CD2-CD1 3.65Å; F61-L73 HydrophobicContact CE2-CD1 4.05Å; F61-L73 HydrophobicContact CG-CD1 4.02Å; S69-L73 WeakPolarHBondContact O-CB 3.38Å; S69-L73 VanDerWaalsContact O-CG 3.23Å; S69-L73 WeakPolarHBondContact O-CG 3.42Å; S69-L73 PolarHBondContact O-N 2.91Å; V70-L73 PolarHBondContact O-N 3.01Å; L73-M76 HydrophobicContact CD2-CE 3.65Å; L73-M76 WeakPolarHBondContact O-CB 3.17Å; L73-M76 PolarHBondContact O-N 3.38Å; L73-F77 PolarHBondContact O-N 3.14Å
74A94.7Very high90.9Very high1 Ų132.6 Ų32.61%0.00820%0.197CC..Hα-helixtrans-67.2-40.4176.100000111.9V70 D71 D72 M76 F77 T78 V99 L103 F116V70-A74 VanDerWaalsContact O-CB 3.24Å; V70-A74 WeakPolarHBondContact O-CB 3.43Å; V70-A74 PolarHBondContact O-N 3.19Å; D71-A74 PolarHBondContact O-N 3.31Å; D72-A74 VanDerWaalsContact C-N 3.33Å; D72-A74 PolarHBondContact O-N 3.41Å; A74-M76 VanDerWaalsContact C-N 3.29Å; A74-M76 PolarHBondContact O-N 3.22Å; A74-F77 WeakPolarHBondContact O-CA 3.38Å; A74-F77 VanDerWaalsContact O-CB 3.29Å; A74-F77 WeakPolarHBondContact O-CB 3.37Å; A74-F77 PolarHBondContact O-N 2.95Å; A74-T78 PolarHBondContact O-N 2.58Å; A74-T78 PolarHBondContact O-OG1 2.71Å; A74-V99 HydrophobicContact CB-CG1 4.11Å; A74-L103 HydrophobicContact CB-CD1 3.83Å; A74-L103 HydrophobicContact CB-CD2 3.93Å; A74-L103 HydrophobicContact CB-CG 4.22Å; A74-F116 HydrophobicContact CB-CD2 3.79Å; A74-F116 HydrophobicContact CB-CE2 3.73Å; A74-F116 VanDerWaalsContact O-CE2 3.32Å; A74-F116 WeakPolarHBondContact O-CE2 3.29Å
75K93.6Very high89.9Confident67 Ų6737.3 Ų37.329%0.29123%0.225SC..Hα-helixtrans-57.8-43.7171.1-76.6165.2175.3162.10111.5D71 D72 F77 T78 N79D71-K75 WeakPolarHBondContact O-CG 3.4Å; D71-K75 PolarHBondContact O-N 3.34Å; D71-K75 IonicContact OD1-NZ 2.94Å; D71-K75 WeakPolarHBondContact OD2-CE 3.28Å; D71-K75 IonicContact OD2-NZ 2.86Å; D71-K75 PolarHBondContact OD2-NZ 2.94Å; D72-K75 PolarHBondContact O-N 3.24Å; K75-F77 VanDerWaalsContact C-N 3.31Å; K75-F77 PolarHBondContact O-N 3.21Å; K75-T78 PolarHBondContact O-N 3.34Å; K75-T78 PolarHBondContact O-OG1 3.18Å; K75-T78 VanDerWaalsContact O-OG1 3.05Å; K75-N79 WeakPolarHBondContact O-CB 3.42Å; K75-N79 PolarHBondContact O-N 3.11Å; K75-N79 PolarHBondContact O-ND2 3.36Å
76M93.9Very high89.4Confident32 Ų3235.5 Ų35.516%0.15821%0.206CC..Hα-helixtrans-62.9-37174.3-177.21645300112.2L54 D72 L73 A74 N79 A80L54-M76 HydrophobicContact CD1-CG 4.06Å; L54-M76 HydrophobicContact CD2-CE 3.3Å; L54-M76 HydrophobicContact CD2-CG 4.25Å; L54-M76 HydrophobicContact CD2-SD 4.32Å; D72-M76 PolarHBondContact O-N 2.99Å; D72-M76 VanDerWaalsContact O-N 3.11Å; L73-M76 HydrophobicContact CD2-CE 3.65Å; L73-M76 WeakPolarHBondContact O-CB 3.17Å; L73-M76 PolarHBondContact O-N 3.38Å; A74-M76 VanDerWaalsContact C-N 3.29Å; A74-M76 PolarHBondContact O-N 3.22Å; M76-N79 PolarHBondContact O-N 3.38Å; M76-A80 WeakPolarHBondContact O-CB 3.33Å; M76-A80 PolarHBondContact O-N 3.4Å
77F95Very high89.2Confident1 Ų134.8 Ų34.80%0.00421%0.21CC..Hα-helixtrans-62.6-51.2175.3-175.4-83.7000112.1L51 L54 I58 L73 A74 K75 N79 A80 L81 K95 I96 V99 F116L51-F77 HydrophobicContact CB-CE2 4.06Å; L51-F77 HydrophobicContact CD2-CD1 4.4Å; L51-F77 HydrophobicContact CD2-CD2 3.79Å; L51-F77 HydrophobicContact CD2-CE1 4.29Å; L51-F77 HydrophobicContact CD2-CE2 3.65Å; L51-F77 HydrophobicContact CD2-CG 4.15Å; L51-F77 HydrophobicContact CD2-CZ 3.91Å; L51-F77 HydrophobicContact CG-CE2 4.44Å; L54-F77 HydrophobicContact CB-CD2 3.8Å; L54-F77 HydrophobicContact CD1-CB 4.02Å; L54-F77 HydrophobicContact CD1-CD2 4.28Å; I58-F77 HydrophobicContact CD1-CB 4.28Å; L73-F77 PolarHBondContact O-N 3.14Å; A74-F77 WeakPolarHBondContact O-CA 3.38Å; A74-F77 VanDerWaalsContact O-CB 3.29Å; A74-F77 WeakPolarHBondContact O-CB 3.37Å; A74-F77 PolarHBondContact O-N 2.95Å; K75-F77 VanDerWaalsContact C-N 3.31Å; K75-F77 PolarHBondContact O-N 3.21Å; F77-N79 VanDerWaalsContact C-N 3.33Å; F77-N79 PolarHBondContact O-N 2.97Å; F77-A80 WeakPolarHBondContact O-CB 3.49Å; F77-A80 PolarHBondContact O-N 3.34Å; F77-L81 HydrophobicContact CD1-CD1 3.96Å; F77-L81 HydrophobicContact CD1-CG 4.49Å; F77-L81 HydrophobicContact CE1-CD1 3.59Å; F77-L81 HydrophobicContact CE1-CG 4.25Å; F77-L81 HydrophobicContact CZ-CD1 4.5Å; F77-L81 PolarHBondContact O-N 3.38Å; F77-L81 VanDerWaalsContact O-N 3.12Å; F77-K95 HydrophobicContact CE2-CB 4.3Å; F77-K95 HydrophobicContact CZ-CB 3.88Å; F77-I96 HydrophobicContact CE1-CG1 4.04Å; F77-I96 HydrophobicContact CZ-CG1 4.44Å; F77-V99 HydrophobicContact CD2-CG2 4.13Å; F77-V99 HydrophobicContact CE2-CG2 4.05Å; F77-V99 HydrophobicContact CG-CG2 4.44Å; F77-V99 HydrophobicContact CZ-CG2 4.29Å; F77-F116 HydrophobicContact CD1-CE2 4.23Å; F77-F116 HydrophobicContact CD1-CZ 4.13Å
78T93.8Very high89.2Confident1 Ų135.9 Ų35.91%0.00621%0.213CC..Hα-helixtrans-64.2-36.6176.941.30000112.9A74 K75 A80 L81 L82 F116 H119 L120A74-T78 PolarHBondContact O-N 2.58Å; A74-T78 PolarHBondContact O-OG1 2.71Å; K75-T78 PolarHBondContact O-N 3.34Å; K75-T78 PolarHBondContact O-OG1 3.18Å; K75-T78 VanDerWaalsContact O-OG1 3.05Å; T78-A80 VanDerWaalsContact C-N 3.33Å; T78-A80 PolarHBondContact O-N 2.95Å; T78-L81 WeakPolarHBondContact O-CB 3.48Å; T78-L81 PolarHBondContact O-N 2.75Å; T78-L82 WeakPolarHBondContact O-CG 3.48Å; T78-L82 PolarHBondContact O-N 3.12Å; T78-F116 HydrophobicContact CG2-CD1 4.47Å; T78-F116 HydrophobicContact CG2-CD2 3.32Å; T78-F116 HydrophobicContact CG2-CE1 4.48Å; T78-F116 HydrophobicContact CG2-CE2 3.3Å; T78-F116 HydrophobicContact CG2-CG 3.95Å; T78-F116 HydrophobicContact CG2-CZ 3.92Å; T78-H119 HydrophobicContact CG2-CB 3.78Å; T78-L120 HydrophobicContact CG2-CD2 3.95Å; T78-L120 HydrophobicContact CG2-CG 4.07Å
79N92.8Very high89.2Confident82 Ų8235.1 Ų35.144%0.43920%0.203SC..Hα-helixtrans-65.3-37.9175.6-72.1-19.9000111.7K75 M76 F77 L81 L82 V83K75-N79 WeakPolarHBondContact O-CB 3.42Å; K75-N79 PolarHBondContact O-N 3.11Å; K75-N79 PolarHBondContact O-ND2 3.36Å; M76-N79 PolarHBondContact O-N 3.38Å; F77-N79 VanDerWaalsContact C-N 3.33Å; F77-N79 PolarHBondContact O-N 2.97Å; N79-L81 VanDerWaalsContact C-N 3.33Å; N79-L82 PolarHBondContact O-N 3.42Å; N79-V83 WeakPolarHBondContact O-CG2 3.27Å; N79-V83 PolarHBondContact O-N 2.94Å; N79-V83 VanDerWaalsContact O-N 3.13Å
80A92.7Very high89.2Confident2 Ų238.8 Ų38.82%0.01723%0.229CC..Hα-helixtrans-62.7-40.7174.700000111.9I47 L50 L51 M76 F77 T78 G84I47-A80 WeakPolarHBondContact CG2-O 3.37Å; L50-A80 HydrophobicContact CD2-CB 3.59Å; L50-A80 HydrophobicContact CG-CB 4.14Å; L51-A80 HydrophobicContact CD2-CB 4Å; M76-A80 WeakPolarHBondContact O-CB 3.33Å; M76-A80 PolarHBondContact O-N 3.4Å; F77-A80 WeakPolarHBondContact O-CB 3.49Å; F77-A80 PolarHBondContact O-N 3.34Å; T78-A80 VanDerWaalsContact C-N 3.33Å; T78-A80 PolarHBondContact O-N 2.95Å; A80-G84 PolarHBondContact O-N 3.32Å
81L92Very high89.2Confident1 Ų141.5 Ų41.51%0.00525%0.248CC..Hα-helixtrans-61.3-45.5173.8-71.9174.1000111.9L51 F77 T78 N79 V83 G84 I96 L120 W123L51-L81 HydrophobicContact CD1-CD2 3.59Å; L51-L81 HydrophobicContact CD1-CG 4.47Å; L51-L81 HydrophobicContact CD2-CD2 3.93Å; L51-L81 HydrophobicContact CD2-CG 3.91Å; L51-L81 HydrophobicContact CG-CD2 4.43Å; F77-L81 HydrophobicContact CD1-CD1 3.96Å; F77-L81 HydrophobicContact CD1-CG 4.49Å; F77-L81 HydrophobicContact CE1-CD1 3.59Å; F77-L81 HydrophobicContact CE1-CG 4.25Å; F77-L81 HydrophobicContact CZ-CD1 4.5Å; F77-L81 PolarHBondContact O-N 3.38Å; F77-L81 VanDerWaalsContact O-N 3.12Å; T78-L81 WeakPolarHBondContact O-CB 3.48Å; T78-L81 PolarHBondContact O-N 2.75Å; N79-L81 VanDerWaalsContact C-N 3.33Å; L81-V83 VanDerWaalsContact C-N 3.33Å; L81-V83 PolarHBondContact O-N 3.48Å; L81-G84 PolarHBondContact O-N 2.86Å; L81-G84 VanDerWaalsContact O-O 3.05Å; L81-I96 HydrophobicContact CD1-CD1 4.28Å; L81-I96 HydrophobicContact CD1-CG1 4.3Å; L81-L120 HydrophobicContact CD1-CD2 3.59Å; L81-W123 VanDerWaalsContact C-CD1 3.49Å; L81-W123 HydrophobicContact CB-CB 4.43Å; L81-W123 HydrophobicContact CB-CD2 4.18Å; L81-W123 HydrophobicContact CB-CG 3.85Å; L81-W123 HydrophobicContact CD1-CD2 4.33Å; L81-W123 HydrophobicContact CD1-CE3 4.43Å; L81-W123 HydrophobicContact CD2-CD2 4.38Å; L81-W123 HydrophobicContact CD2-CZ2 4.01Å; L81-W123 PolarHBondContact O-NE1 3.08Å
82L89.8Confident89.2Confident43 Ų4341 Ų4123%0.22525%0.246CC..Hα-helixtrans-67.5-27.9-178.6-72169.5000114.2T78 N79 H119 A122 W123 Q126T78-L82 WeakPolarHBondContact O-CG 3.48Å; T78-L82 PolarHBondContact O-N 3.12Å; N79-L82 PolarHBondContact O-N 3.42Å; L82-H119 HydrophobicContact CD1-CB 4.12Å; L82-A122 HydrophobicContact CD2-CB 4.25Å; L82-W123 HydrophobicContact CD2-CB 3.85Å; L82-W123 HydrophobicContact CG-CB 4.44Å; L82-Q126 PolarHBondContact O-OE1 3.32Å
83V87.7Confident89.3Confident105 Ų10540.3 Ų40.364%0.63624%0.242SC*.Hα-helixtrans-86.2-24.5-179.2173.10000112.2N79 L81N79-V83 WeakPolarHBondContact O-CG2 3.27Å; N79-V83 PolarHBondContact O-N 2.94Å; N79-V83 VanDerWaalsContact O-N 3.13Å; L81-V83 VanDerWaalsContact C-N 3.33Å; L81-V83 PolarHBondContact O-N 3.48Å
84G73.5Confident89.4Confident11 Ų1145.5 Ų45.511%0.11327%0.266CS..SBendtrans-110.9146.5-168.500000114.3A80 L81 S86A80-G84 PolarHBondContact O-N 3.32Å; L81-G84 PolarHBondContact O-N 2.86Å; L81-G84 VanDerWaalsContact O-O 3.05Å; G84-S86 PolarHBondContact O-N 3Å
85P68.2Low89.3Confident132 Ų13246.2 Ų46.286%0.85727%0.269SS*.  trans-71.877.216432.1-32.7000108.9
86S77Confident89.4Confident4 Ų443.1 Ų43.13%0.02826%0.256CS..  trans-85.6122.7168.5-161.60000107.9G84G84-S86 PolarHBondContact O-N 3Å
87P84.7Confident89.5Confident71 Ų7143.7 Ų43.746%0.46126%0.257SS..  trans-62.7146.2174.728.2-33.7000109.6D89 S92P87-D89 VanDerWaalsContact C-N 3.3Å; P87-D89 PolarHBondContact O-N 3.33Å; P87-D89 VanDerWaalsContact O-N 3.14Å; P87-S92 WeakPolarHBondContact O-CB 3.11Å; P87-S92 PolarHBondContact O-OG 2.93Å
88L88Confident89.5Confident38 Ų3845.3 Ų45.320%0.19927%0.267CS..  trans-84.183.5167.3-165.5152.1000107.6L93 W123 V127 L128 S135 A137L88-L93 HydrophobicContact CD2-CD1 4.01Å; L88-L93 HydrophobicContact CD2-CD2 4.29Å; L88-L93 HydrophobicContact CD2-CG 4.3Å; L88-L93 HydrophobicContact CG-CD2 4.43Å; L88-W123 HydrophobicContact CB-CH2 4.16Å; L88-W123 HydrophobicContact CD1-CH2 4.15Å; L88-W123 HydrophobicContact CD1-CZ3 4.11Å; L88-W123 HydrophobicContact CG-CH2 4.07Å; L88-W123 HydrophobicContact CG-CZ3 4.45Å; L88-V127 HydrophobicContact CB-CG1 3.98Å; L88-L128 HydrophobicContact CD1-CD1 4.29Å; L88-S135 WeakPolarHBondContact CD1-OG 3.4Å; L88-A137 HydrophobicContact CD2-CB 4.03Å
89D91.2Very high89.6Confident67 Ų6745.3 Ų45.336%0.35827%0.267SS..  trans-116.3173.2177.468.3-4.9000111.3P87 S91 S92 L93P87-D89 VanDerWaalsContact C-N 3.3Å; P87-D89 PolarHBondContact O-N 3.33Å; P87-D89 VanDerWaalsContact O-N 3.14Å; D89-S91 PolarHBondContact O-N 3.15Å; D89-S91 PolarHBondContact OD1-N 3.37Å; D89-S92 PolarHBondContact O-N 3.42Å; D89-S92 WeakPolarHBondContact OD1-CB 3.49Å; D89-S92 PolarHBondContact OD1-N 2.82Å; D89-S92 PolarHBondContact OD1-OG 3.2Å; D89-L93 WeakPolarHBondContact O-CG 3.38Å; D89-L93 PolarHBondContact O-N 3.15Å
90S92.3Very high89.7Confident95 Ų9541.4 Ų41.466%0.66425%0.246SC*.Hα-helixtrans-57.7-38179.2-53.10000112.2S92 L93 E94S90-S92 PolarHBondContact O-N 2.67Å; S90-L93 PolarHBondContact O-N 3.08Å; S90-E94 WeakPolarHBondContact O-CG 3.29Å; S90-E94 PolarHBondContact O-N 2.93Å
91S92.7Very high89.7Confident59 Ų5943.6 Ų43.641%0.41326%0.262SS..Hα-helixtrans-62.2-44.2178.4-178.60000112.3D89 K95D89-S91 PolarHBondContact O-N 3.15Å; D89-S91 PolarHBondContact OD1-N 3.37Å; S91-K95 WeakPolarHBondContact O-CG 3.36Å; S91-K95 PolarHBondContact O-N 3.47Å; S91-K95 PolarHBondContact OG-NZ 3.07Å
92S92.6Very high89.8Confident9 Ų944.2 Ų44.26%0.06327%0.267CS..Hα-helixtrans-69.4-38.9178.8-56.60000111.6P87 D89 S90 K95 I96P87-S92 WeakPolarHBondContact O-CB 3.11Å; P87-S92 PolarHBondContact O-OG 2.93Å; D89-S92 PolarHBondContact O-N 3.42Å; D89-S92 WeakPolarHBondContact OD1-CB 3.49Å; D89-S92 PolarHBondContact OD1-N 2.82Å; D89-S92 PolarHBondContact OD1-OG 3.2Å; S90-S92 PolarHBondContact O-N 2.67Å; S92-K95 PolarHBondContact O-N 3.18Å; S92-I96 WeakPolarHBondContact O-CD1 3.44Å; S92-I96 VanDerWaalsContact O-CG1 3.27Å; S92-I96 WeakPolarHBondContact O-CG1 3.34Å; S92-I96 PolarHBondContact O-N 3.5Å
93L95.3Very high89.9Confident26 Ų2642.2 Ų42.214%0.13626%0.256CS..Hα-helixtrans-66-40.4176.9-70.9172.2000112.4L88 D89 S90 I96 K97 A137 L138 C141L88-L93 HydrophobicContact CD2-CD1 4.01Å; L88-L93 HydrophobicContact CD2-CD2 4.29Å; L88-L93 HydrophobicContact CD2-CG 4.3Å; L88-L93 HydrophobicContact CG-CD2 4.43Å; D89-L93 WeakPolarHBondContact O-CG 3.38Å; D89-L93 PolarHBondContact O-N 3.15Å; S90-L93 PolarHBondContact O-N 3.08Å; L93-I96 PolarHBondContact O-N 3.21Å; L93-K97 WeakPolarHBondContact O-CB 3.32Å; L93-K97 PolarHBondContact O-N 3.06Å; L93-A137 HydrophobicContact CD1-CB 3.9Å; L93-L138 HydrophobicContact CD2-CB 4.43Å; L93-L138 HydrophobicContact CD2-CD1 4.47Å; L93-C141 HydrophobicContact CD2-CB 4.39Å; L93-C141 PolarHBondContact O-SG 3.08Å
94E95.1Very high89.8Confident108 Ų10842.1 Ų42.151%0.50525%0.247SC..Hα-helixtrans-61.7-44.9174.7-73.3-56.7131.800111.2S90 I96 K97 T98S90-E94 WeakPolarHBondContact O-CG 3.29Å; S90-E94 PolarHBondContact O-N 2.93Å; E94-I96 VanDerWaalsContact C-N 3.33Å; E94-I96 PolarHBondContact O-N 2.95Å; E94-K97 VanDerWaalsContact O-CB 3.29Å; E94-K97 WeakPolarHBondContact O-CB 3.46Å; E94-K97 PolarHBondContact O-N 3.48Å; E94-K97 VanDerWaalsContact O-N 3.13Å; E94-T98 PolarHBondContact O-N 3.42Å; E94-T98 PolarHBondContact O-OG1 3.12Å
95K94.4Very high90.4Very high17 Ų1744.8 Ų44.87%0.07426%0.263CS..Hα-helixtrans-58-45.9174.6-69.4171.5173.361.10112.5L51 D52 E55 F77 S91 S92 K97 T98 V99L51-K95 HydrophobicContact CB-CD 4.19Å; D52-K95 WeakPolarHBondContact OD1-CE 3.42Å; D52-K95 IonicContact OD1-NZ 3.93Å; D52-K95 PolarHBondContact OD1-NZ 3.32Å; E55-K95 WeakPolarHBondContact OE1-CA 3.36Å; E55-K95 WeakPolarHBondContact OE2-CG 3.18Å; F77-K95 HydrophobicContact CE2-CB 4.3Å; F77-K95 HydrophobicContact CZ-CB 3.88Å; S91-K95 WeakPolarHBondContact O-CG 3.36Å; S91-K95 PolarHBondContact O-N 3.47Å; S91-K95 PolarHBondContact OG-NZ 3.07Å; S92-K95 PolarHBondContact O-N 3.18Å; K95-K97 VanDerWaalsContact C-N 3.31Å; K95-K97 PolarHBondContact O-N 3.21Å; K95-T98 WeakPolarHBondContact O-CB 3.42Å; K95-T98 PolarHBondContact O-N 3.48Å; K95-V99 WeakPolarHBondContact O-CG2 3.44Å; K95-V99 PolarHBondContact O-N 3.43Å
96I95.8Very high91.1Very high1 Ų143.4 Ų43.41%0.00524%0.24CC..Hα-helixtrans-59.6-45.5177-73.1164.4000109.9F77 L81 S92 L93 E94 T98 V99 F100 L120 W123 L138 I142F77-I96 HydrophobicContact CE1-CG1 4.04Å; F77-I96 HydrophobicContact CZ-CG1 4.44Å; L81-I96 HydrophobicContact CD1-CD1 4.28Å; L81-I96 HydrophobicContact CD1-CG1 4.3Å; S92-I96 WeakPolarHBondContact O-CD1 3.44Å; S92-I96 VanDerWaalsContact O-CG1 3.27Å; S92-I96 WeakPolarHBondContact O-CG1 3.34Å; S92-I96 PolarHBondContact O-N 3.5Å; L93-I96 PolarHBondContact O-N 3.21Å; E94-I96 VanDerWaalsContact C-N 3.33Å; E94-I96 PolarHBondContact O-N 2.95Å; I96-T98 PolarHBondContact O-N 3.27Å; I96-V99 PolarHBondContact O-N 2.95Å; I96-F100 WeakPolarHBondContact O-CB 3.43Å; I96-F100 PolarHBondContact O-N 3.27Å; I96-L120 HydrophobicContact CD1-CD2 3.99Å; I96-L120 HydrophobicContact CG1-CD2 3.91Å; I96-L120 HydrophobicContact CG2-CD1 3.58Å; I96-L120 HydrophobicContact CG2-CD2 4.2Å; I96-W123 HydrophobicContact CD1-CE3 4.23Å; I96-W123 HydrophobicContact CD1-CH2 3.91Å; I96-W123 HydrophobicContact CD1-CZ3 3.46Å; I96-W123 VanDerWaalsContact CD1-CZ3 3.46Å; I96-L138 HydrophobicContact CD1-CD1 4.34Å; I96-L138 HydrophobicContact CG2-CD1 3.96Å; I96-I142 HydrophobicContact CG2-CD1 4.32Å
97K95.4Very high91.1Very high45 Ų4555.3 Ų55.320%0.19629%0.285CS..Hα-helixtrans-57.3-48.3177.3-161.8172.5177.6168.70111.5L93 E94 K95 S101 C141 E144 V145L93-K97 WeakPolarHBondContact O-CB 3.32Å; L93-K97 PolarHBondContact O-N 3.06Å; E94-K97 VanDerWaalsContact O-CB 3.29Å; E94-K97 WeakPolarHBondContact O-CB 3.46Å; E94-K97 PolarHBondContact O-N 3.48Å; E94-K97 VanDerWaalsContact O-N 3.13Å; K95-K97 VanDerWaalsContact C-N 3.31Å; K95-K97 PolarHBondContact O-N 3.21Å; K97-S101 WeakPolarHBondContact O-CB 3.27Å; K97-S101 PolarHBondContact O-N 3.03Å; K97-S101 PolarHBondContact O-OG 3.38Å; K97-C141 VanDerWaalsContact CB-SG 3.51Å; K97-E144 IonicContact NZ-OE2 2.71Å; K97-E144 PolarHBondContact NZ-OE2 2.96Å; K97-V145 HydrophobicContact CG-CG2 3.55Å
98T94.6Very high90.6Very high35 Ų3559.7 Ų59.722%0.21530%0.304CS..Hα-helixtrans-58.3-54.1177.9-59.80000111.4E55 L59 E94 K95 I96 S101 A102E55-T98 HydrophobicContact CG-CG2 3.92Å; E55-T98 WeakPolarHBondContact OE1-CB 3.46Å; E55-T98 PolarHBondContact OE1-OG1 3.02Å; L59-T98 HydrophobicContact CD1-CG2 3.63Å; L59-T98 HydrophobicContact CD2-CG2 3.54Å; L59-T98 HydrophobicContact CG-CG2 3.69Å; E94-T98 PolarHBondContact O-N 3.42Å; E94-T98 PolarHBondContact O-OG1 3.12Å; K95-T98 WeakPolarHBondContact O-CB 3.42Å; K95-T98 PolarHBondContact O-N 3.48Å; I96-T98 PolarHBondContact O-N 3.27Å; T98-S101 PolarHBondContact O-N 3.13Å; T98-A102 PolarHBondContact O-N 3.41Å; T98-A102 VanDerWaalsContact O-N 3.08Å
99V94.8Very high90.2Very high0 Ų061 Ų610%031%0.307CS..Hα-helixtrans-65.8-42.6-178.1173.80000111.4I58 A74 F77 K95 I96 S101 A102 L103 F116I58-V99 HydrophobicContact CD1-CG1 3.87Å; I58-V99 HydrophobicContact CD1-CG2 3.83Å; I58-V99 HydrophobicContact CG2-CG1 4.38Å; I58-V99 HydrophobicContact CG2-CG2 4.34Å; A74-V99 HydrophobicContact CB-CG1 4.11Å; F77-V99 HydrophobicContact CD2-CG2 4.13Å; F77-V99 HydrophobicContact CE2-CG2 4.05Å; F77-V99 HydrophobicContact CG-CG2 4.44Å; F77-V99 HydrophobicContact CZ-CG2 4.29Å; K95-V99 WeakPolarHBondContact O-CG2 3.44Å; K95-V99 PolarHBondContact O-N 3.43Å; I96-V99 PolarHBondContact O-N 2.95Å; V99-S101 VanDerWaalsContact C-N 3.31Å; V99-S101 PolarHBondContact O-N 3.21Å; V99-A102 WeakPolarHBondContact O-CB 3.23Å; V99-A102 PolarHBondContact O-N 3.34Å; V99-A102 VanDerWaalsContact O-N 3.14Å; V99-L103 PolarHBondContact O-N 3.38Å; V99-F116 HydrophobicContact CB-CZ 4.19Å; V99-F116 HydrophobicContact CG1-CE1 4.26Å; V99-F116 HydrophobicContact CG1-CE2 3.82Å; V99-F116 HydrophobicContact CG1-CZ 3.43Å; V99-F116 VanDerWaalsContact CG1-CZ 3.43Å
100F95.6Very high89.6Confident0 Ų063.1 Ų63.10%032%0.322CS..Hα-helixtrans-64.1-37.2179.3-169.3-114000112.2I96 A102 L103 R113 F116 L117 I142 V145 Y146I96-F100 WeakPolarHBondContact O-CB 3.43Å; I96-F100 PolarHBondContact O-N 3.27Å; F100-A102 VanDerWaalsContact C-N 3.34Å; F100-L103 PolarHBondContact O-N 3.23Å; F100-R113 HydrophobicContact CD2-CG 4.03Å; F100-R113 VanDerWaalsContact CE1-CZ 3.46Å; F100-R113 VanDerWaalsContact CE1-NE 3.28Å; F100-R113 HydrophobicContact CE2-CG 3.38Å; F100-R113 HydrophobicContact CZ-CG 3.89Å; F100-R113 PolarHBondContact O-NH2 2.97Å; F100-F116 HydrophobicContact CB-CE1 4.23Å; F100-F116 AromaticContact CD2-CD1 3.74Å; F100-F116 HydrophobicContact CD2-CD1 3.74Å; F100-F116 AromaticContact CD2-CE1 3.92Å; F100-F116 HydrophobicContact CD2-CE1 3.92Å; F100-F116 HydrophobicContact CE2-CD1 4.36Å; F100-L117 HydrophobicContact CE2-CB 4.29Å; F100-I142 HydrophobicContact CB-CD1 4.33Å; F100-I142 HydrophobicContact CD1-CD1 3.59Å; F100-I142 HydrophobicContact CD2-CD1 4.05Å; F100-I142 HydrophobicContact CE1-CB 4.46Å; F100-I142 HydrophobicContact CE1-CD1 3.76Å; F100-I142 HydrophobicContact CE1-CG2 3.68Å; F100-I142 HydrophobicContact CE2-CD1 4.17Å; F100-I142 HydrophobicContact CG-CD1 3.74Å; F100-I142 HydrophobicContact CZ-CD1 4.02Å; F100-I142 HydrophobicContact CZ-CG2 3.85Å; F100-V145 HydrophobicContact CD1-CB 3.89Å; F100-V145 HydrophobicContact CD1-CG1 3.76Å; F100-V145 HydrophobicContact CD1-CG2 4.16Å; F100-V145 HydrophobicContact CE1-CB 4.31Å; F100-V145 HydrophobicContact CE1-CG1 4.25Å; F100-Y146 HydrophobicContact CE1-CD2 4.47Å; F100-Y146 HydrophobicContact CE1-CE1 4.24Å; F100-Y146 HydrophobicContact CE1-CE2 4.05Å; F100-Y146 AromaticContact CE1-CZ 3.93Å; F100-Y146 HydrophobicContact CZ-CE1 4.23Å; F100-Y146 AromaticContact CZ-CE2 3.94Å; F100-Y146 HydrophobicContact CZ-CE2 3.94Å; F100-Y146 AromaticContact CZ-CZ 3.63Å; F100-Y146 WeakPolarHBondContact CZ-OH 3.26Å
101S93.8Very high88.9Confident49 Ų4959.1 Ų59.134%0.34329%0.294SS..Hα-helixtrans-67.5-33.9174-56.60000112K97 T98 V99 L103 K104 V145K97-S101 WeakPolarHBondContact O-CB 3.27Å; K97-S101 PolarHBondContact O-N 3.03Å; K97-S101 PolarHBondContact O-OG 3.38Å; T98-S101 PolarHBondContact O-N 3.13Å; V99-S101 VanDerWaalsContact C-N 3.31Å; V99-S101 PolarHBondContact O-N 3.21Å; S101-L103 PolarHBondContact O-N 3.06Å; S101-K104 WeakPolarHBondContact O-CB 3.48Å; S101-K104 PolarHBondContact O-N 3.07Å; S101-V145 WeakPolarHBondContact OG-CG1 3.21Å
102A92.5Very high88.5Confident13 Ų1359.5 Ų59.511%0.10729%0.292CS..Hα-helixtrans-66.7-25.1175.800000112.9I58 A62 V70 T98 V99 F100 K104I58-A102 HydrophobicContact CG2-CB 3.86Å; A62-A102 HydrophobicContact CB-CB 4Å; V70-A102 HydrophobicContact CG1-CB 4.4Å; T98-A102 PolarHBondContact O-N 3.41Å; T98-A102 VanDerWaalsContact O-N 3.08Å; V99-A102 WeakPolarHBondContact O-CB 3.23Å; V99-A102 PolarHBondContact O-N 3.34Å; V99-A102 VanDerWaalsContact O-N 3.14Å; F100-A102 VanDerWaalsContact C-N 3.34Å; A102-K104 PolarHBondContact O-N 2.86Å
103L91.9Very high88.3Confident2 Ų259.9 Ų59.91%0.0129%0.292CS..THydrogen-bonded Turntrans-84.121.4174-65.7169.8000113.5V70 A74 V99 F100 S101 P111 R113 F116V70-L103 HydrophobicContact CG1-CD2 3.84Å; V70-L103 HydrophobicContact CG1-CG 4.48Å; A74-L103 HydrophobicContact CB-CD1 3.83Å; A74-L103 HydrophobicContact CB-CD2 3.93Å; A74-L103 HydrophobicContact CB-CG 4.22Å; V99-L103 PolarHBondContact O-N 3.38Å; F100-L103 PolarHBondContact O-N 3.23Å; S101-L103 PolarHBondContact O-N 3.06Å; L103-P111 HydrophobicContact CB-CB 4.38Å; L103-P111 HydrophobicContact CB-CG 4.18Å; L103-P111 HydrophobicContact CD2-CB 3.83Å; L103-P111 HydrophobicContact CD2-CG 4.46Å; L103-P111 WeakPolarHBondContact O-CG 3.47Å; L103-R113 HydrophobicContact CB-CG 4.41Å; L103-F116 HydrophobicContact CD1-CB 3.99Å; L103-F116 HydrophobicContact CD1-CD1 3.71Å; L103-F116 HydrophobicContact CD1-CD2 3.85Å; L103-F116 HydrophobicContact CD1-CE1 4.07Å; L103-F116 HydrophobicContact CD1-CE2 4.23Å; L103-F116 HydrophobicContact CD1-CG 3.58Å; L103-F116 HydrophobicContact CD1-CZ 4.34Å
104K87.5Confident88Confident102 Ų10262.8 Ų62.844%0.44330%0.304SS..  trans-61.8133.3172.8-175.9176.3-177.4169.20111S101 A102 E149S101-K104 WeakPolarHBondContact O-CB 3.48Å; S101-K104 PolarHBondContact O-N 3.07Å; A102-K104 PolarHBondContact O-N 2.86Å; K104-E149 HydrophobicContact CD-CG 4.03Å; K104-E149 HydrophobicContact CG-CG 4.45Å
105P85.1Confident87.8Confident67 Ų6761.1 Ų61.144%0.43530%0.297SS..  trans-54.1139.7173.4-26.434.7000112.8
106R83Confident87.7Confident104 Ų10460.6 Ų60.639%0.39230%0.295SS..BIsolated β-bridgetrans-125.2157.6178.1-56.9-174.5-173.3-167.82.8109.6A62 N108 Y109A62-R106 PolarHBondContact O-NH1 3.3Å; A62-R106 PolarHBondContact O-NH2 2.84Å; R106-N108 PolarHBondContact O-N 3.13Å; R106-Y109 PolarHBondContact N-O 2.82Å; R106-Y109 CarbonylContact O-C 3.57Å; R106-Y109 PolarHBondContact O-N 3.33Å
107R77.9Confident87.6Confident253 Ų25361.3 Ų61.396%0.95530%0.298SS*.THydrogen-bonded Turntrans-47-35.6-174.6-69.5-173.6179-175.2-1114.9
108N74.2Confident87.5Confident163 Ų16362.2 Ų62.287%0.87231%0.305SS*.THydrogen-bonded Turntrans-113.26.8-174.6-58.1-18.8000113.4R106R106-N108 PolarHBondContact O-N 3.13Å
109Y77.9Confident87.4Confident65 Ų6562.9 Ų62.926%0.25531%0.306SS..BIsolated β-bridgetrans-159.3123.9-176.7-174.9-95.7000111.8A67 D71 R106 P111A67-Y109 HydrophobicContact CB-CD1 3.11Å; A67-Y109 HydrophobicContact CB-CD2 4.35Å; A67-Y109 HydrophobicContact CB-CE1 3.55Å; A67-Y109 HydrophobicContact CB-CG 3.54Å; A67-Y109 WeakPolarHBondContact O-CE1 3.32Å; D71-Y109 HydrophobicContact CB-CE1 4.49Å; D71-Y109 WeakPolarHBondContact CB-OH 3.44Å; R106-Y109 PolarHBondContact N-O 2.82Å; R106-Y109 CarbonylContact O-C 3.57Å; R106-Y109 PolarHBondContact O-N 3.33Å; Y109-P111 HydrophobicContact CD1-CB 4.44Å; Y109-P111 HydrophobicContact CE1-CB 3.77Å; Y109-P111 HydrophobicContact CE1-CG 4.37Å
110T79.9Confident87.4Confident112 Ų11262.9 Ų62.969%0.68731%0.306SS*.  trans-110106.4173.8-52.70000108.1
111P78Confident87.4Confident11 Ų1164.2 Ų64.27%0.07131%0.313CS..  trans-65.7158.2175.223.9-27.8000111L103 Y109 R113L103-P111 HydrophobicContact CB-CB 4.38Å; L103-P111 HydrophobicContact CB-CG 4.18Å; L103-P111 HydrophobicContact CD2-CB 3.83Å; L103-P111 HydrophobicContact CD2-CG 4.46Å; L103-P111 WeakPolarHBondContact O-CG 3.47Å; Y109-P111 HydrophobicContact CD1-CB 4.44Å; Y109-P111 HydrophobicContact CE1-CB 3.77Å; Y109-P111 HydrophobicContact CE1-CG 4.37Å; P111-R113 PolarHBondContact O-N 3.43Å
112D83.6Confident87.3Confident67 Ų6763.7 Ų63.736%0.35831%0.312SS..  trans-8165.2173.4-166.5-8.5000110.4D71 E114 Q115 F116D71-D112 PolarHBondContact OD1-N 3.14Å; D112-E114 PolarHBondContact O-N 3.32Å; D112-Q115 HydrophobicContact CB-CB 4.27Å; D112-Q115 PolarHBondContact O-N 2.84Å; D112-Q115 WeakPolarHBondContact OD1-CB 3.44Å; D112-Q115 PolarHBondContact OD1-N 2.93Å; D112-Q115 VanDerWaalsContact OD2-CB 3.28Å; D112-Q115 WeakPolarHBondContact OD2-CB 3.32Å; D112-Q115 PolarHBondContact OD2-OE1 3Å; D112-F116 PolarHBondContact O-N 3.03Å
113R89.2Confident87.4Confident17 Ų1763.2 Ų63.26%0.06431%0.307CS..Hα-helixtrans-66.7-28.5-176.9-168.3178.5-172.5175.17.1112F100 L103 P111 F116 L117 V145 E149F100-R113 HydrophobicContact CD2-CG 4.03Å; F100-R113 VanDerWaalsContact CE1-CZ 3.46Å; F100-R113 VanDerWaalsContact CE1-NE 3.28Å; F100-R113 HydrophobicContact CE2-CG 3.38Å; F100-R113 HydrophobicContact CZ-CG 3.89Å; F100-R113 PolarHBondContact O-NH2 2.97Å; L103-R113 HydrophobicContact CB-CG 4.41Å; P111-R113 PolarHBondContact O-N 3.43Å; R113-F116 PolarHBondContact O-N 3.19Å; R113-L117 WeakPolarHBondContact O-CB 3.43Å; R113-L117 PolarHBondContact O-N 3.11Å; R113-V145 VanDerWaalsContact NH2-CG1 3.25Å; R113-E149 IonicContact CZ-OE1 2.7Å; R113-E149 IonicContact CZ-OE2 3.94Å; R113-E149 VanDerWaalsContact NH1-CD 3.29Å; R113-E149 IonicContact NH1-OE1 3.9Å; R113-E149 PolarHBondContact NH1-OE1 3.05Å; R113-E149 VanDerWaalsContact NH1-OE1 3.12Å; R113-E149 IonicContact NH1-OE2 2.83Å; R113-E149 PolarHBondContact NH1-OE2 2.87Å; R113-E149 IonicContact NH2-OE1 2.84Å; R113-E149 PolarHBondContact NH2-OE1 3.46Å; R113-E149 IonicContact NH2-OE2 3.81Å
114E88.1Confident87.5Confident87 Ų8763.1 Ų63.141%0.40731%0.306SS..Hα-helixtrans-67.5-47.9176.4-172.7179.2174.700111D112 F116 L117 N118 L306D112-E114 PolarHBondContact O-N 3.32Å; E114-F116 VanDerWaalsContact C-N 3.3Å; E114-F116 PolarHBondContact O-N 3.47Å; E114-L117 PolarHBondContact O-N 2.86Å; E114-N118 WeakPolarHBondContact O-CB 3.48Å; E114-N118 VanDerWaalsContact O-CG 3.29Å; E114-N118 PolarHBondContact O-N 3.31Å; E114-N118 PolarHBondContact O-ND2 3.33Å; E114-L306 VanDerWaalsContact OE1-CD1 3.23Å; E114-L306 WeakPolarHBondContact OE1-CD1 3.36Å
115Q90.1Very high87.8Confident73 Ų7361.2 Ų61.234%0.34130%0.298SS..Hα-helixtrans-59.6-42.7174.3-179.7175.164.500111.8D112 L117 N118 H119D112-Q115 HydrophobicContact CB-CB 4.27Å; D112-Q115 PolarHBondContact O-N 2.84Å; D112-Q115 WeakPolarHBondContact OD1-CB 3.44Å; D112-Q115 PolarHBondContact OD1-N 2.93Å; D112-Q115 VanDerWaalsContact OD2-CB 3.28Å; D112-Q115 WeakPolarHBondContact OD2-CB 3.32Å; D112-Q115 PolarHBondContact OD2-OE1 3Å; Q115-L117 VanDerWaalsContact C-N 3.34Å; Q115-L117 PolarHBondContact O-N 3.46Å; Q115-N118 PolarHBondContact O-N 3.41Å; Q115-H119 VanDerWaalsContact CG-CE1 3.47Å; Q115-H119 WeakPolarHBondContact CG-CE1 3.37Å; Q115-H119 PolarHBondContact O-N 2.9Å; Q115-H119 PolarHBondContact O-ND1 2.89Å
116F93.2Very high88.2Confident7 Ų763.6 Ų63.63%0.03130%0.304CS..Hα-helixtrans-59.2-46.3175.9-176.1-95.3000111.5A74 F77 T78 V99 F100 L103 D112 R113 E114 H119 L120A74-F116 HydrophobicContact CB-CD2 3.79Å; A74-F116 HydrophobicContact CB-CE2 3.73Å; A74-F116 VanDerWaalsContact O-CE2 3.32Å; A74-F116 WeakPolarHBondContact O-CE2 3.29Å; F77-F116 HydrophobicContact CD1-CE2 4.23Å; F77-F116 HydrophobicContact CD1-CZ 4.13Å; T78-F116 HydrophobicContact CG2-CD1 4.47Å; T78-F116 HydrophobicContact CG2-CD2 3.32Å; T78-F116 HydrophobicContact CG2-CE1 4.48Å; T78-F116 HydrophobicContact CG2-CE2 3.3Å; T78-F116 HydrophobicContact CG2-CG 3.95Å; T78-F116 HydrophobicContact CG2-CZ 3.92Å; V99-F116 HydrophobicContact CB-CZ 4.19Å; V99-F116 HydrophobicContact CG1-CE1 4.26Å; V99-F116 HydrophobicContact CG1-CE2 3.82Å; V99-F116 HydrophobicContact CG1-CZ 3.43Å; V99-F116 VanDerWaalsContact CG1-CZ 3.43Å; F100-F116 HydrophobicContact CB-CE1 4.23Å; F100-F116 AromaticContact CD2-CD1 3.74Å; F100-F116 HydrophobicContact CD2-CD1 3.74Å; F100-F116 AromaticContact CD2-CE1 3.92Å; F100-F116 HydrophobicContact CD2-CE1 3.92Å; F100-F116 HydrophobicContact CE2-CD1 4.36Å; L103-F116 HydrophobicContact CD1-CB 3.99Å; L103-F116 HydrophobicContact CD1-CD1 3.71Å; L103-F116 HydrophobicContact CD1-CD2 3.85Å; L103-F116 HydrophobicContact CD1-CE1 4.07Å; L103-F116 HydrophobicContact CD1-CE2 4.23Å; L103-F116 HydrophobicContact CD1-CG 3.58Å; L103-F116 HydrophobicContact CD1-CZ 4.34Å; D112-F116 PolarHBondContact O-N 3.03Å; R113-F116 PolarHBondContact O-N 3.19Å; E114-F116 VanDerWaalsContact C-N 3.3Å; E114-F116 PolarHBondContact O-N 3.47Å; F116-H119 PolarHBondContact O-N 3.17Å; F116-L120 HydrophobicContact CD1-CD1 3.8Å; F116-L120 HydrophobicContact CD1-CG 4.27Å; F116-L120 HydrophobicContact CE1-CD1 3.45Å; F116-L120 VanDerWaalsContact CE1-CD1 3.45Å; F116-L120 HydrophobicContact CE1-CD2 4.45Å; F116-L120 HydrophobicContact CE1-CG 4.05Å; F116-L120 HydrophobicContact CZ-CD1 4.24Å; F116-L120 HydrophobicContact CZ-CD2 4.46Å; F116-L120 HydrophobicContact CZ-CG 4.49Å; F116-L120 WeakPolarHBondContact O-CG 3.49Å; F116-L120 PolarHBondContact O-N 3.37Å
117L94.2Very high88.6Confident15 Ų1561 Ų618%0.07930%0.299CS..Hα-helixtrans-62.3-43177.2-179.259.8000112.3F100 R113 E114 Q115 H119 L120 I121 I142F100-L117 HydrophobicContact CE2-CB 4.29Å; R113-L117 WeakPolarHBondContact O-CB 3.43Å; R113-L117 PolarHBondContact O-N 3.11Å; E114-L117 PolarHBondContact O-N 2.86Å; Q115-L117 VanDerWaalsContact C-N 3.34Å; Q115-L117 PolarHBondContact O-N 3.46Å; L117-H119 VanDerWaalsContact C-N 3.3Å; L117-H119 PolarHBondContact O-N 3.48Å; L117-L120 WeakPolarHBondContact O-CB 3.4Å; L117-L120 PolarHBondContact O-N 3.28Å; L117-L120 VanDerWaalsContact O-N 3.12Å; L117-I121 HydrophobicContact CD1-CD1 4.16Å; L117-I121 HydrophobicContact CD1-CG1 4.3Å; L117-I121 HydrophobicContact CG-CD1 3.94Å; L117-I121 HydrophobicContact CG-CG1 4.49Å; L117-I121 WeakPolarHBondContact O-CG1 3.32Å; L117-I121 PolarHBondContact O-N 3.38Å; L117-I142 HydrophobicContact CD1-CD1 4.11Å; L117-I142 HydrophobicContact CD1-CG1 3.91Å; L117-I142 HydrophobicContact CD1-CG2 4.06Å
118N92.6Very high89.2Confident65 Ų6551.5 Ų51.535%0.34827%0.267SS..Hα-helixtrans-60.5-40177.8-73.1-21.3000111.7E114 Q115 I121 A122E114-N118 WeakPolarHBondContact O-CB 3.48Å; E114-N118 VanDerWaalsContact O-CG 3.29Å; E114-N118 PolarHBondContact O-N 3.31Å; E114-N118 PolarHBondContact O-ND2 3.33Å; Q115-N118 PolarHBondContact O-N 3.41Å; N118-I121 PolarHBondContact O-N 3.31Å; N118-A122 WeakPolarHBondContact O-CB 2.7Å; N118-A122 PolarHBondContact O-N 3.46Å
119H93.5Very high90Very high49 Ų4948.4 Ų48.423%0.22726%0.256CS..Hα-helixtrans-66.5-39.4173.4-65.4143.3000113.1T78 L82 Q115 F116 L117 A122 W123T78-H119 HydrophobicContact CG2-CB 3.78Å; L82-H119 HydrophobicContact CD1-CB 4.12Å; Q115-H119 VanDerWaalsContact CG-CE1 3.47Å; Q115-H119 WeakPolarHBondContact CG-CE1 3.37Å; Q115-H119 PolarHBondContact O-N 2.9Å; Q115-H119 PolarHBondContact O-ND1 2.89Å; F116-H119 PolarHBondContact O-N 3.17Å; L117-H119 VanDerWaalsContact C-N 3.3Å; L117-H119 PolarHBondContact O-N 3.48Å; H119-A122 PolarHBondContact O-N 3.01Å; H119-W123 WeakPolarHBondContact O-CB 3.29Å; H119-W123 PolarHBondContact O-N 3.42Å
120L94.7Very high90.7Very high0 Ų052.7 Ų52.70%028%0.276CS..Hα-helixtrans-63.4-42.9175.3-69177.3000111.7T78 L81 I96 F116 L117 W123 S124 L138 I142T78-L120 HydrophobicContact CG2-CD2 3.95Å; T78-L120 HydrophobicContact CG2-CG 4.07Å; L81-L120 HydrophobicContact CD1-CD2 3.59Å; I96-L120 HydrophobicContact CD1-CD2 3.99Å; I96-L120 HydrophobicContact CG1-CD2 3.91Å; I96-L120 HydrophobicContact CG2-CD1 3.58Å; I96-L120 HydrophobicContact CG2-CD2 4.2Å; F116-L120 HydrophobicContact CD1-CD1 3.8Å; F116-L120 HydrophobicContact CD1-CG 4.27Å; F116-L120 HydrophobicContact CE1-CD1 3.45Å; F116-L120 VanDerWaalsContact CE1-CD1 3.45Å; F116-L120 HydrophobicContact CE1-CD2 4.45Å; F116-L120 HydrophobicContact CE1-CG 4.05Å; F116-L120 HydrophobicContact CZ-CD1 4.24Å; F116-L120 HydrophobicContact CZ-CD2 4.46Å; F116-L120 HydrophobicContact CZ-CG 4.49Å; F116-L120 WeakPolarHBondContact O-CG 3.49Å; F116-L120 PolarHBondContact O-N 3.37Å; L117-L120 WeakPolarHBondContact O-CB 3.4Å; L117-L120 PolarHBondContact O-N 3.28Å; L117-L120 VanDerWaalsContact O-N 3.12Å; L120-W123 PolarHBondContact O-N 3.13Å; L120-S124 WeakPolarHBondContact O-CB 3.34Å; L120-S124 PolarHBondContact O-N 2.87Å; L120-L138 HydrophobicContact CB-CD1 4.38Å; L120-L138 HydrophobicContact CB-CD2 4Å; L120-L138 HydrophobicContact CD1-CD1 4.46Å; L120-L138 WeakPolarHBondContact O-CD2 3.46Å; L120-I142 HydrophobicContact CD1-CD1 4.23Å
121I93.8Very high91.2Very high27 Ų2750.2 Ų50.214%0.13825%0.254CS..Hα-helixtrans-61.9-49176.3-71170.2000109.4L117 N118 W123 S124 K125 L138L117-I121 HydrophobicContact CD1-CD1 4.16Å; L117-I121 HydrophobicContact CD1-CG1 4.3Å; L117-I121 HydrophobicContact CG-CD1 3.94Å; L117-I121 HydrophobicContact CG-CG1 4.49Å; L117-I121 WeakPolarHBondContact O-CG1 3.32Å; L117-I121 PolarHBondContact O-N 3.38Å; N118-I121 PolarHBondContact O-N 3.31Å; I121-W123 PolarHBondContact O-N 3.21Å; I121-S124 PolarHBondContact O-N 2.96Å; I121-S124 VanDerWaalsContact O-N 3.15Å; I121-S124 PolarHBondContact O-OG 3.03Å; I121-K125 HydrophobicContact CG2-CD 4.38Å; I121-K125 VanDerWaalsContact CG2-CE 3.49Å; I121-K125 WeakPolarHBondContact O-CG 3.47Å; I121-K125 PolarHBondContact O-N 3.11Å; I121-L138 HydrophobicContact CG1-CD2 4.44Å
122A93.3Very high91.8Very high39 Ų3955 Ų5532%0.32228%0.283SS..Hα-helixtrans-58-45.1176.700000112.5L82 N118 H119 K125 Q126L82-A122 HydrophobicContact CD2-CB 4.25Å; N118-A122 WeakPolarHBondContact O-CB 2.7Å; N118-A122 PolarHBondContact O-N 3.46Å; H119-A122 PolarHBondContact O-N 3.01Å; A122-K125 PolarHBondContact O-N 3.24Å; A122-Q126 WeakPolarHBondContact O-CG 3.41Å; A122-Q126 PolarHBondContact O-N 3.01Å; A122-Q126 VanDerWaalsContact O-N 3.12Å
123W94.1Very high92.1Very high2 Ų254.8 Ų54.81%0.00828%0.278CS..Hα-helixtrans-58.7-47.2173.6165.471.1000111.5L81 L82 L88 I96 H119 L120 I121 K125 Q126 V127L81-W123 VanDerWaalsContact C-CD1 3.49Å; L81-W123 HydrophobicContact CB-CB 4.43Å; L81-W123 HydrophobicContact CB-CD2 4.18Å; L81-W123 HydrophobicContact CB-CG 3.85Å; L81-W123 HydrophobicContact CD1-CD2 4.33Å; L81-W123 HydrophobicContact CD1-CE3 4.43Å; L81-W123 HydrophobicContact CD2-CD2 4.38Å; L81-W123 HydrophobicContact CD2-CZ2 4.01Å; L81-W123 PolarHBondContact O-NE1 3.08Å; L82-W123 HydrophobicContact CD2-CB 3.85Å; L82-W123 HydrophobicContact CG-CB 4.44Å; L88-W123 HydrophobicContact CB-CH2 4.16Å; L88-W123 HydrophobicContact CD1-CH2 4.15Å; L88-W123 HydrophobicContact CD1-CZ3 4.11Å; L88-W123 HydrophobicContact CG-CH2 4.07Å; L88-W123 HydrophobicContact CG-CZ3 4.45Å; I96-W123 HydrophobicContact CD1-CE3 4.23Å; I96-W123 HydrophobicContact CD1-CH2 3.91Å; I96-W123 HydrophobicContact CD1-CZ3 3.46Å; I96-W123 VanDerWaalsContact CD1-CZ3 3.46Å; H119-W123 WeakPolarHBondContact O-CB 3.29Å; H119-W123 PolarHBondContact O-N 3.42Å; L120-W123 PolarHBondContact O-N 3.13Å; I121-W123 PolarHBondContact O-N 3.21Å; W123-K125 VanDerWaalsContact C-N 3.28Å; W123-K125 PolarHBondContact O-N 2.86Å; W123-Q126 WeakPolarHBondContact O-CB 3.49Å; W123-Q126 PolarHBondContact O-N 3.12Å; W123-V127 HydrophobicContact CD2-CG2 4.37Å; W123-V127 HydrophobicContact CZ2-CG2 4.08Å; W123-V127 WeakPolarHBondContact O-CG2 3.45Å; W123-V127 PolarHBondContact O-N 3.46Å
124S94.3Very high92.3Very high0 Ų054.2 Ų54.20%028%0.277CS..Hα-helixtrans-63.7-33.2-179.477.60000112.9L120 I121 V127 L128 G134 S135L120-S124 WeakPolarHBondContact O-CB 3.34Å; L120-S124 PolarHBondContact O-N 2.87Å; I121-S124 PolarHBondContact O-N 2.96Å; I121-S124 VanDerWaalsContact O-N 3.15Å; I121-S124 PolarHBondContact O-OG 3.03Å; S124-V127 PolarHBondContact O-N 2.94Å; S124-L128 PolarHBondContact O-N 2.91Å; S124-G134 WeakPolarHBondContact OG-CA 3.46Å; S124-S135 PolarHBondContact OG-N 3.26Å; S124-S135 VanDerWaalsContact OG-N 3.09Å
125K93.3Very high92.6Very high62 Ų6250.3 Ų50.327%0.2726%0.259SS..Hα-helixtrans-66.3-36.1172.3-66.8177.9-170.7-171.90111.5I121 A122 W123 L128 P129 T132 E305I121-K125 HydrophobicContact CG2-CD 4.38Å; I121-K125 VanDerWaalsContact CG2-CE 3.49Å; I121-K125 WeakPolarHBondContact O-CG 3.47Å; I121-K125 PolarHBondContact O-N 3.11Å; A122-K125 PolarHBondContact O-N 3.24Å; W123-K125 VanDerWaalsContact C-N 3.28Å; W123-K125 PolarHBondContact O-N 2.86Å; K125-L128 CarbonylContact O-C 3.59Å; K125-P129 WeakPolarHBondContact O-CA 3.36Å; K125-T132 WeakPolarHBondContact CD-O 3.27Å; K125-T132 WeakPolarHBondContact CE-O 3.33Å; K125-T132 PolarHBondContact NZ-O 2.66Å; K125-E305 IonicContact NZ-OE1 3.42Å
126Q92.6Very high92.9Very high118 Ų11847.3 Ų47.355%0.55125%0.246SC*.Hα-helixtrans-67.8-41.4174.8-67.2176.915.300112.1L82 A122 W123L82-Q126 PolarHBondContact O-OE1 3.32Å; A122-Q126 WeakPolarHBondContact O-CG 3.41Å; A122-Q126 PolarHBondContact O-N 3.01Å; A122-Q126 VanDerWaalsContact O-N 3.12Å; W123-Q126 WeakPolarHBondContact O-CB 3.49Å; W123-Q126 PolarHBondContact O-N 3.12Å
127V91.9Very high93Very high49 Ų4948.9 Ų48.930%0.29726%0.26SS..Hα-helixtrans-72.5-38.8179.9-178.60000111.5L88 W123 S124L88-V127 HydrophobicContact CB-CG1 3.98Å; W123-V127 HydrophobicContact CD2-CG2 4.37Å; W123-V127 HydrophobicContact CZ2-CG2 4.08Å; W123-V127 WeakPolarHBondContact O-CG2 3.45Å; W123-V127 PolarHBondContact O-N 3.46Å; S124-V127 PolarHBondContact O-N 2.94Å
128L91.6Very high93.1Very high54 Ų5448.1 Ų48.128%0.28326%0.256SS..  trans-128.677.8-179.8-62.5175.1000111.5L88 S124 K125 K130 Y131L88-L128 HydrophobicContact CD1-CD1 4.29Å; S124-L128 PolarHBondContact O-N 2.91Å; K125-L128 CarbonylContact O-C 3.59Å; L128-K130 PolarHBondContact O-N 3.4Å; L128-Y131 HydrophobicContact CB-CD2 3.94Å; L128-Y131 HydrophobicContact CD1-CD2 4.13Å; L128-Y131 HydrophobicContact CD1-CE2 4.18Å; L128-Y131 PolarHBondContact O-N 3.49Å
129P91.1Very high93.4Very high98 Ų9845.2 Ų45.264%0.63624%0.241SC*.THydrogen-bonded Turntrans-60.1-19.9-175.5-26.335.5000115.3K125 Y131K125-P129 WeakPolarHBondContact O-CA 3.36Å; P129-Y131 PolarHBondContact O-N 3.37Å
130K92.1Very high93.5Very high154 Ų15444.2 Ų44.267%0.6724%0.237SC*.THydrogen-bonded Turntrans-62.3-25.8175.972.7177.9-169.3169.70112.8L128L128-K130 PolarHBondContact O-N 3.4Å
131Y90.9Very high93.6Very high61 Ų6144.7 Ų44.724%0.23924%0.24CC..  trans-100.895.1179.8-63.1-65.3000110.4L128 P129 R133 G134 P136L128-Y131 HydrophobicContact CB-CD2 3.94Å; L128-Y131 HydrophobicContact CD1-CD2 4.13Å; L128-Y131 HydrophobicContact CD1-CE2 4.18Å; L128-Y131 PolarHBondContact O-N 3.49Å; P129-Y131 PolarHBondContact O-N 3.37Å; Y131-R133 PolarHBondContact O-N 3.39Å; Y131-R133 VanDerWaalsContact O-N 3.17Å; Y131-G134 VanDerWaalsContact CB-O 3.3Å; Y131-G134 WeakPolarHBondContact CB-O 3.44Å; Y131-G134 PolarHBondContact O-N 2.94Å; Y131-G134 VanDerWaalsContact O-N 3.15Å; Y131-P136 HydrophobicContact CD1-CG 3.89Å; Y131-P136 HydrophobicContact CD2-CG 4.4Å; Y131-P136 HydrophobicContact CE1-CG 3.51Å; Y131-P136 VanDerWaalsContact CE2-CD 3.47Å; Y131-P136 HydrophobicContact CE2-CG 4.05Å; Y131-P136 HydrophobicContact CG-CG 4.33Å
132T90Very high93.8Very high111 Ų11143.4 Ų43.468%0.68123%0.233SC*.THydrogen-bonded Turntrans-65.8-18.1-176.356.50000114.3K125K125-T132 WeakPolarHBondContact CD-O 3.27Å; K125-T132 WeakPolarHBondContact CE-O 3.33Å; K125-T132 PolarHBondContact NZ-O 2.66Å
133R89.4Confident94Very high63 Ų6341.5 Ų41.524%0.23822%0.218CC..THydrogen-bonded Turntrans-101.3-1.3178.2-65.7-173.9174.1139.56.4114.3Y131 H139 L161 N298Y131-R133 PolarHBondContact O-N 3.39Å; Y131-R133 VanDerWaalsContact O-N 3.17Å; R133-H139 PolarHBondContact O-NE2 3.26Å; R133-H139 VanDerWaalsContact O-NE2 3.09Å; R133-L161 HydrophobicContact CB-CD2 4.43Å; R133-N298 PolarHBondContact NH2-OD1 3.14Å
134G93.2Very high94.1Very high5 Ų543.5 Ų43.55%0.05223%0.227CC..  trans105.2163.8-172.600000112.4S124 Y131S124-G134 WeakPolarHBondContact OG-CA 3.46Å; Y131-G134 VanDerWaalsContact CB-O 3.3Å; Y131-G134 WeakPolarHBondContact CB-O 3.44Å; Y131-G134 PolarHBondContact O-N 2.94Å; Y131-G134 VanDerWaalsContact O-N 3.15Å
135S94.7Very high94.2Very high4 Ų443.6 Ų43.63%0.02823%0.228CC..  trans-67.1132.2-174.8176.70000112L88 S124 A137 L138 H139L88-S135 WeakPolarHBondContact CD1-OG 3.4Å; S124-S135 PolarHBondContact OG-N 3.26Å; S124-S135 VanDerWaalsContact OG-N 3.09Å; S135-A137 PolarHBondContact O-N 3.19Å; S135-A137 PolarHBondContact OG-N 2.87Å; S135-L138 WeakPolarHBondContact O-CB 3.39Å; S135-L138 PolarHBondContact O-N 3.39Å; S135-H139 PolarHBondContact O-CD2 3.12Å; S135-H139 VanDerWaalsContact O-CD2 3.29Å; S135-H139 PolarHBondContact O-N 3.01Å
136P95.8Very high94.3Very high11 Ų1141.9 Ų41.97%0.07122%0.22CC..Hα-helixtrans-56.2-37.8174.7-2431.9000113.1Y131 L138 H139 L140 L161 S162 Q163Y131-P136 HydrophobicContact CD1-CG 3.89Å; Y131-P136 HydrophobicContact CD2-CG 4.4Å; Y131-P136 HydrophobicContact CE1-CG 3.51Å; Y131-P136 VanDerWaalsContact CE2-CD 3.47Å; Y131-P136 HydrophobicContact CE2-CG 4.05Å; Y131-P136 HydrophobicContact CG-CG 4.33Å; P136-L138 VanDerWaalsContact C-N 3.33Å; P136-L138 PolarHBondContact O-N 3.37Å; P136-H139 PolarHBondContact O-N 3.09Å; P136-L140 PolarHBondContact O-N 3.3Å; P136-L161 WeakPolarHBondContact CA-O 3.35Å; P136-S162 WeakPolarHBondContact CB-O 3.48Å; P136-S162 WeakPolarHBondContact O-CA 3.44Å; P136-Q163 HydrophobicContact CB-CB 3.95Å; P136-Q163 HydrophobicContact CB-CG 4.01Å; P136-Q163 HydrophobicContact CG-CB 4.36Å; P136-Q163 HydrophobicContact CG-CG 3.99Å
137A96.3Very high94.5Very high39 Ų3937.5 Ų37.532%0.32220%0.203SC..Hα-helixtrans-67.3-32.617700000113L88 L93 S135 C141L88-A137 HydrophobicContact CD2-CB 4.03Å; L93-A137 HydrophobicContact CD1-CB 3.9Å; S135-A137 PolarHBondContact O-N 3.19Å; S135-A137 PolarHBondContact OG-N 2.87Å; A137-C141 PolarHBondContact O-N 3.01Å
138L96.8Very high94.7Very high0 Ų041.8 Ų41.80%022%0.224CC..Hα-helixtrans-67.2-47171.6174.265.4000110.1L93 I96 L120 I121 S135 P136 L140 C141 I142L93-L138 HydrophobicContact CD2-CB 4.43Å; L93-L138 HydrophobicContact CD2-CD1 4.47Å; I96-L138 HydrophobicContact CD1-CD1 4.34Å; I96-L138 HydrophobicContact CG2-CD1 3.96Å; L120-L138 HydrophobicContact CB-CD1 4.38Å; L120-L138 HydrophobicContact CB-CD2 4Å; L120-L138 HydrophobicContact CD1-CD1 4.46Å; L120-L138 WeakPolarHBondContact O-CD2 3.46Å; I121-L138 HydrophobicContact CG1-CD2 4.44Å; S135-L138 WeakPolarHBondContact O-CB 3.39Å; S135-L138 PolarHBondContact O-N 3.39Å; P136-L138 VanDerWaalsContact C-N 3.33Å; P136-L138 PolarHBondContact O-N 3.37Å; L138-L140 VanDerWaalsContact C-N 3.29Å; L138-L140 PolarHBondContact O-N 3.18Å; L138-C141 WeakPolarHBondContact O-CB 3.32Å; L138-C141 PolarHBondContact O-N 2.86Å; L138-I142 HydrophobicContact CD1-CD1 4.45Å; L138-I142 HydrophobicContact CD1-CG1 4.12Å; L138-I142 HydrophobicContact CG-CG1 4.41Å; L138-I142 WeakPolarHBondContact O-CG1 3.4Å; L138-I142 PolarHBondContact O-N 3.46Å
139H97.2Very high94.7Very high4 Ų440.9 Ų40.92%0.01922%0.218CC..Hα-helixtrans-59.4-40.3177.7-77.1-74000112.1R133 S135 P136 C141 I142 A143 H158 L161R133-H139 PolarHBondContact O-NE2 3.26Å; R133-H139 VanDerWaalsContact O-NE2 3.09Å; S135-H139 PolarHBondContact O-CD2 3.12Å; S135-H139 VanDerWaalsContact O-CD2 3.29Å; S135-H139 PolarHBondContact O-N 3.01Å; P136-H139 PolarHBondContact O-N 3.09Å; H139-C141 PolarHBondContact O-N 3.4Å; H139-I142 PolarHBondContact O-N 3.44Å; H139-A143 VanDerWaalsContact O-CB 3.3Å; H139-A143 WeakPolarHBondContact O-CB 3.35Å; H139-A143 PolarHBondContact O-N 3.25Å; H139-H158 WeakPolarHBondContact CB-O 3.35Å; H139-H158 AromaticContact CE1-ND1 3.89Å; H139-H158 AromaticContact CG-ND1 3.97Å; H139-H158 AromaticContact ND1-CE1 3.61Å; H139-H158 AromaticContact ND1-CG 4Å; H139-H158 AromaticContact ND1-ND1 3.01Å; H139-H158 PolarHBondContact ND1-ND1 3.23Å; H139-L161 HydrophobicContact CB-CB 3.82Å; H139-L161 WeakPolarHBondContact CE1-CD1 3.36Å; H139-L161 VanDerWaalsContact CG-CB 3.4Å
140L97.5Very high94.8Very high28 Ų2840.5 Ų40.515%0.14721%0.211CC..Hα-helixtrans-57-50.7173.3-174.755.9000111.9P136 L138 I142 A143 E144 F159 N164 R167P136-L140 PolarHBondContact O-N 3.3Å; L138-L140 VanDerWaalsContact C-N 3.29Å; L138-L140 PolarHBondContact O-N 3.18Å; L140-I142 VanDerWaalsContact C-N 3.33Å; L140-I142 PolarHBondContact O-N 3.4Å; L140-A143 WeakPolarHBondContact O-CB 3.23Å; L140-A143 PolarHBondContact O-N 3.21Å; L140-E144 HydrophobicContact CD1-CG 4.47Å; L140-E144 WeakPolarHBondContact O-CG 3.22Å; L140-E144 PolarHBondContact O-N 3.02Å; L140-F159 HydrophobicContact CD1-CD1 4.09Å; L140-F159 HydrophobicContact CD1-CE1 3.75Å; L140-N164 HydrophobicContact CD1-CB 4.14Å; L140-N164 HydrophobicContact CD2-CB 4.04Å; L140-N164 WeakPolarHBondContact CD2-ND2 3.34Å; L140-R167 HydrophobicContact CD1-CB 3.83Å; L140-R167 HydrophobicContact CD1-CG 4.14Å
141C96.8Very high94.9Very high9 Ų936.3 Ų36.36%0.06120%0.196CC..Hα-helixtrans-56.6-46.7179.7171.60000111.7L93 K97 A137 L138 H139 E144 V145L93-C141 HydrophobicContact CD2-CB 4.39Å; L93-C141 PolarHBondContact O-SG 3.08Å; K97-C141 VanDerWaalsContact CB-SG 3.51Å; A137-C141 PolarHBondContact O-N 3.01Å; L138-C141 WeakPolarHBondContact O-CB 3.32Å; L138-C141 PolarHBondContact O-N 2.86Å; H139-C141 PolarHBondContact O-N 3.4Å; C141-E144 PolarHBondContact O-N 2.6Å; C141-V145 WeakPolarHBondContact O-CG2 3.42Å; C141-V145 PolarHBondContact O-N 3.46Å
142I97Very high95.1Very high0 Ų033.9 Ų33.90%019%0.189CC..Hα-helixtrans-66.8-39.8178.2-61.6-58.8000111.8I96 F100 L117 L120 L138 H139 L140 E144 V145 Y146I96-I142 HydrophobicContact CG2-CD1 4.32Å; F100-I142 HydrophobicContact CB-CD1 4.33Å; F100-I142 HydrophobicContact CD1-CD1 3.59Å; F100-I142 HydrophobicContact CD2-CD1 4.05Å; F100-I142 HydrophobicContact CE1-CB 4.46Å; F100-I142 HydrophobicContact CE1-CD1 3.76Å; F100-I142 HydrophobicContact CE1-CG2 3.68Å; F100-I142 HydrophobicContact CE2-CD1 4.17Å; F100-I142 HydrophobicContact CG-CD1 3.74Å; F100-I142 HydrophobicContact CZ-CD1 4.02Å; F100-I142 HydrophobicContact CZ-CG2 3.85Å; L117-I142 HydrophobicContact CD1-CD1 4.11Å; L117-I142 HydrophobicContact CD1-CG1 3.91Å; L117-I142 HydrophobicContact CD1-CG2 4.06Å; L120-I142 HydrophobicContact CD1-CD1 4.23Å; L138-I142 HydrophobicContact CD1-CD1 4.45Å; L138-I142 HydrophobicContact CD1-CG1 4.12Å; L138-I142 HydrophobicContact CG-CG1 4.41Å; L138-I142 WeakPolarHBondContact O-CG1 3.4Å; L138-I142 PolarHBondContact O-N 3.46Å; H139-I142 PolarHBondContact O-N 3.44Å; L140-I142 VanDerWaalsContact C-N 3.33Å; L140-I142 PolarHBondContact O-N 3.4Å; I142-E144 PolarHBondContact O-N 3.34Å; I142-V145 PolarHBondContact O-N 2.88Å; I142-Y146 HydrophobicContact CG2-CD2 3.79Å; I142-Y146 HydrophobicContact CG2-CE2 3.58Å; I142-Y146 WeakPolarHBondContact O-CD2 3.44Å; I142-Y146 PolarHBondContact O-N 3.42Å; I142-Y146 VanDerWaalsContact O-N 3.09Å
143A97.3Very high95.2Very high0 Ų034.3 Ų34.30%019%0.192CC..Hα-helixtrans-60.5-44.6177.700000111.8H139 L140 V145 Y146 A147 H158 F159H139-A143 VanDerWaalsContact O-CB 3.3Å; H139-A143 WeakPolarHBondContact O-CB 3.35Å; H139-A143 PolarHBondContact O-N 3.25Å; L140-A143 WeakPolarHBondContact O-CB 3.23Å; L140-A143 PolarHBondContact O-N 3.21Å; A143-V145 VanDerWaalsContact C-N 3.31Å; A143-V145 PolarHBondContact O-N 2.92Å; A143-Y146 PolarHBondContact O-N 3.4Å; A143-A147 WeakPolarHBondContact O-CB 3.42Å; A143-A147 PolarHBondContact O-N 2.63Å; A143-H158 HydrophobicContact CB-CB 3.61Å; A143-F159 HydrophobicContact CB-CB 4.38Å; A143-F159 HydrophobicContact CB-CD1 3.72Å; A143-F159 HydrophobicContact CB-CD2 3.66Å; A143-F159 HydrophobicContact CB-CE1 3.79Å; A143-F159 HydrophobicContact CB-CE2 3.71Å; A143-F159 HydrophobicContact CB-CG 3.64Å; A143-F159 HydrophobicContact CB-CZ 3.78Å
144E96.5Very high95.4Very high44 Ų4432.2 Ų32.221%0.20619%0.188CC..Hα-helixtrans-62-37.4177.8-71.6-178.516400112.4K97 L140 C141 I142 A147 L148 F159 R167K97-E144 IonicContact NZ-OE2 2.71Å; K97-E144 PolarHBondContact NZ-OE2 2.96Å; L140-E144 HydrophobicContact CD1-CG 4.47Å; L140-E144 WeakPolarHBondContact O-CG 3.22Å; L140-E144 PolarHBondContact O-N 3.02Å; C141-E144 PolarHBondContact O-N 2.6Å; I142-E144 PolarHBondContact O-N 3.34Å; E144-A147 PolarHBondContact O-N 2.92Å; E144-L148 WeakPolarHBondContact O-CG 3.21Å; E144-L148 PolarHBondContact O-N 3.25Å; E144-L148 VanDerWaalsContact O-N 3.11Å; E144-F159 HydrophobicContact CG-CZ 4.47Å; E144-R167 IonicContact OE1-NE 2.7Å
145V96.4Very high95.6Very high2 Ų232 Ų321%0.01219%0.185CC..Hα-helixtrans-66-47.2175.4179.70000110.7K97 F100 S101 R113 C141 I142 A143 A147 L148 E149K97-V145 HydrophobicContact CG-CG2 3.55Å; F100-V145 HydrophobicContact CD1-CB 3.89Å; F100-V145 HydrophobicContact CD1-CG1 3.76Å; F100-V145 HydrophobicContact CD1-CG2 4.16Å; F100-V145 HydrophobicContact CE1-CB 4.31Å; F100-V145 HydrophobicContact CE1-CG1 4.25Å; S101-V145 WeakPolarHBondContact OG-CG1 3.21Å; R113-V145 VanDerWaalsContact NH2-CG1 3.25Å; C141-V145 WeakPolarHBondContact O-CG2 3.42Å; C141-V145 PolarHBondContact O-N 3.46Å; I142-V145 PolarHBondContact O-N 2.88Å; A143-V145 VanDerWaalsContact C-N 3.31Å; A143-V145 PolarHBondContact O-N 2.92Å; V145-A147 VanDerWaalsContact C-N 3.28Å; V145-A147 PolarHBondContact O-N 3.12Å; V145-L148 PolarHBondContact O-N 2.85Å; V145-E149 WeakPolarHBondContact CG1-OE1 3.47Å; V145-E149 WeakPolarHBondContact O-CG 3.41Å; V145-E149 PolarHBondContact O-N 2.7Å; V145-E149 VanDerWaalsContact O-N 3.11Å
146Y96.1Very high95.6Very high26 Ų2633.5 Ų33.510%0.10219%0.193CC..Hα-helixtrans-63.9-34.2177.4-76.1-48.7000113F100 I142 A143 E149 D150 N151 A154 H158F100-Y146 HydrophobicContact CE1-CD2 4.47Å; F100-Y146 HydrophobicContact CE1-CE1 4.24Å; F100-Y146 HydrophobicContact CE1-CE2 4.05Å; F100-Y146 AromaticContact CE1-CZ 3.93Å; F100-Y146 HydrophobicContact CZ-CE1 4.23Å; F100-Y146 AromaticContact CZ-CE2 3.94Å; F100-Y146 HydrophobicContact CZ-CE2 3.94Å; F100-Y146 AromaticContact CZ-CZ 3.63Å; F100-Y146 WeakPolarHBondContact CZ-OH 3.26Å; I142-Y146 HydrophobicContact CG2-CD2 3.79Å; I142-Y146 HydrophobicContact CG2-CE2 3.58Å; I142-Y146 WeakPolarHBondContact O-CD2 3.44Å; I142-Y146 PolarHBondContact O-N 3.42Å; I142-Y146 VanDerWaalsContact O-N 3.09Å; A143-Y146 PolarHBondContact O-N 3.4Å; Y146-E149 CarbonylContact O-C 3.42Å; Y146-E149 PolarHBondContact O-N 3.18Å; Y146-D150 PolarHBondContact O-N 2.84Å; Y146-N151 HydrophobicContact CD1-CB 4.12Å; Y146-N151 PolarHBondContact O-N 3.49Å; Y146-A154 HydrophobicContact CD1-CB 3.93Å; Y146-A154 HydrophobicContact CD2-CB 3.54Å; Y146-A154 HydrophobicContact CE1-CB 4.08Å; Y146-A154 HydrophobicContact CE2-CB 3.7Å; Y146-A154 HydrophobicContact CG-CB 3.65Å; Y146-H158 AromaticContact CE2-CD2 3.88Å
147A96Very high95.5Very high25 Ų2536 Ų3621%0.20720%0.201CC..Hα-helixtrans-61-44.5173.800000111.9A143 E144 V145 E149 D150 A155 F159 Y171A143-A147 WeakPolarHBondContact O-CB 3.42Å; A143-A147 PolarHBondContact O-N 2.63Å; E144-A147 PolarHBondContact O-N 2.92Å; V145-A147 VanDerWaalsContact C-N 3.28Å; V145-A147 PolarHBondContact O-N 3.12Å; A147-E149 PolarHBondContact O-N 3.18Å; A147-D150 PolarHBondContact O-N 3.2Å; A147-A155 HydrophobicContact CB-CB 4.31Å; A147-F159 HydrophobicContact CB-CE2 4.29Å; A147-Y171 HydrophobicContact CB-CD2 3.73Å; A147-Y171 HydrophobicContact CB-CE2 3.3Å
148L95.1Very high95.5Very high140 Ų14034.5 Ų34.573%0.73319%0.187SC*.Hα-helixtrans-66.3-25.6175.6-70.4171.7000113E144 V145 D150E144-L148 WeakPolarHBondContact O-CG 3.21Å; E144-L148 PolarHBondContact O-N 3.25Å; E144-L148 VanDerWaalsContact O-N 3.11Å; V145-L148 PolarHBondContact O-N 2.85Å; L148-D150 VanDerWaalsContact C-N 3.31Å
149E93.3Very high95.5Very high34 Ų3434.9 Ų34.916%0.15919%0.189CC..THydrogen-bonded Turntrans-87.11.2177.5-69178-167.600114.1K104 R113 V145 Y146 A147 N151K104-E149 HydrophobicContact CD-CG 4.03Å; K104-E149 HydrophobicContact CG-CG 4.45Å; R113-E149 IonicContact CZ-OE1 2.7Å; R113-E149 IonicContact CZ-OE2 3.94Å; R113-E149 VanDerWaalsContact NH1-CD 3.29Å; R113-E149 IonicContact NH1-OE1 3.9Å; R113-E149 PolarHBondContact NH1-OE1 3.05Å; R113-E149 VanDerWaalsContact NH1-OE1 3.12Å; R113-E149 IonicContact NH1-OE2 2.83Å; R113-E149 PolarHBondContact NH1-OE2 2.87Å; R113-E149 IonicContact NH2-OE1 2.84Å; R113-E149 PolarHBondContact NH2-OE1 3.46Å; R113-E149 IonicContact NH2-OE2 3.81Å; V145-E149 WeakPolarHBondContact CG1-OE1 3.47Å; V145-E149 WeakPolarHBondContact O-CG 3.41Å; V145-E149 PolarHBondContact O-N 2.7Å; V145-E149 VanDerWaalsContact O-N 3.11Å; Y146-E149 CarbonylContact O-C 3.42Å; Y146-E149 PolarHBondContact O-N 3.18Å; A147-E149 PolarHBondContact O-N 3.18Å; E149-N151 PolarHBondContact O-N 3.36Å
150D93.2Very high95.3Very high91 Ų9136 Ų3649%0.48719%0.194SC..THydrogen-bonded Turntrans60.826.5-175.6-154.337.3000113.5Y146 A147 L148 G152 Y179Y146-D150 PolarHBondContact O-N 2.84Å; A147-D150 PolarHBondContact O-N 3.2Å; L148-D150 VanDerWaalsContact C-N 3.31Å; D150-G152 PolarHBondContact O-N 3.34Å; D150-Y179 PolarHBondContact OD1-OH 3.46Å; D150-Y179 PolarHBondContact OD2-OH 2.56Å
151N93.5Very high95.1Very high66 Ų6635.7 Ų35.735%0.35319%0.192SC..  trans-93.779.3174-171.5-19.7000110.1Y146 E149 T153 A154 A155Y146-N151 HydrophobicContact CD1-CB 4.12Å; Y146-N151 PolarHBondContact O-N 3.49Å; E149-N151 PolarHBondContact O-N 3.36Å; N151-T153 PolarHBondContact O-N 3.47Å; N151-A154 HydrophobicContact CB-CB 4.45Å; N151-A154 PolarHBondContact O-N 3.47Å; N151-A154 WeakPolarHBondContact OD1-CB 3.18Å; N151-A154 PolarHBondContact OD1-N 3.41Å; N151-A155 VanDerWaalsContact O-CB 3.29Å; N151-A155 WeakPolarHBondContact O-CB 3.48Å; N151-A155 PolarHBondContact O-N 2.87Å
152G94.1Very high95Very high9 Ų935.5 Ų35.59%0.09319%0.192CC..Hα-helixtrans-55.4-46.5-175.600000114.4D150 A154 A155 L156 Y171 H175D150-G152 PolarHBondContact O-N 3.34Å; G152-A154 PolarHBondContact O-N 3Å; G152-A155 PolarHBondContact O-N 3.48Å; G152-L156 WeakPolarHBondContact O-CB 3.46Å; G152-L156 VanDerWaalsContact O-CG 3.32Å; G152-L156 WeakPolarHBondContact O-CG 3.3Å; G152-L156 PolarHBondContact O-N 3.23Å; G152-Y171 WeakPolarHBondContact CA-OH 3.4Å; G152-H175 WeakPolarHBondContact CA-NE2 3.29Å
153T93.3Very high94.9Very high121 Ų12138.8 Ų38.874%0.74221%0.207SC*.Hα-helixtrans-61.6-47.8-178.6-51.80000111.9N151 R157N151-T153 PolarHBondContact O-N 3.47Å; T153-R157 WeakPolarHBondContact O-CB 3.44Å; T153-R157 PolarHBondContact O-N 2.95Å
154A93.9Very high94.9Very high18 Ų1841.1 Ų41.115%0.14922%0.219CC..Hα-helixtrans-70.3-38.8179.300000111.8Y146 N151 G152 H158Y146-A154 HydrophobicContact CD1-CB 3.93Å; Y146-A154 HydrophobicContact CD2-CB 3.54Å; Y146-A154 HydrophobicContact CE1-CB 4.08Å; Y146-A154 HydrophobicContact CE2-CB 3.7Å; Y146-A154 HydrophobicContact CG-CB 3.65Å; N151-A154 HydrophobicContact CB-CB 4.45Å; N151-A154 PolarHBondContact O-N 3.47Å; N151-A154 WeakPolarHBondContact OD1-CB 3.18Å; N151-A154 PolarHBondContact OD1-N 3.41Å; G152-A154 PolarHBondContact O-N 3Å; A154-H158 PolarHBondContact O-CD2 2.86Å; A154-H158 VanDerWaalsContact O-CD2 3.3Å; A154-H158 PolarHBondContact O-N 3.37Å
155A96.7Very high94.9Very high0 Ų039 Ų390%021%0.21CC..Hα-helixtrans-60.4-52.7176.800000111.6A147 N151 G152 R157 H158 F159 Y171A147-A155 HydrophobicContact CB-CB 4.31Å; N151-A155 VanDerWaalsContact O-CB 3.29Å; N151-A155 WeakPolarHBondContact O-CB 3.48Å; N151-A155 PolarHBondContact O-N 2.87Å; G152-A155 PolarHBondContact O-N 3.48Å; A155-R157 VanDerWaalsContact C-N 3.32Å; A155-R157 PolarHBondContact O-N 3.02Å; A155-H158 PolarHBondContact O-N 3.49Å; A155-H158 VanDerWaalsContact O-N 3.15Å; A155-F159 HydrophobicContact CB-CD2 4.36Å; A155-F159 HydrophobicContact CB-CE2 4.28Å; A155-F159 WeakPolarHBondContact O-CD2 3.49Å; A155-F159 PolarHBondContact O-N 2.85Å; A155-Y171 HydrophobicContact CB-CE1 3.7Å; A155-Y171 HydrophobicContact CB-CE2 4.46Å; A155-Y171 WeakPolarHBondContact CB-OH 3.35Å
156L95.2Very high95Very high36 Ų3641.5 Ų41.519%0.18823%0.226CC..Hα-helixtrans-57.3-44.7-179.7-74.4173.7000112.2G152 H158 F159 Q160 Y168 Y171 L172G152-L156 WeakPolarHBondContact O-CB 3.46Å; G152-L156 VanDerWaalsContact O-CG 3.32Å; G152-L156 WeakPolarHBondContact O-CG 3.3Å; G152-L156 PolarHBondContact O-N 3.23Å; L156-H158 VanDerWaalsContact C-N 3.33Å; L156-H158 PolarHBondContact O-N 3.29Å; L156-F159 PolarHBondContact O-N 3.25Å; L156-Q160 WeakPolarHBondContact O-CG 3.48Å; L156-Q160 PolarHBondContact O-N 2.82Å; L156-Y168 HydrophobicContact CD2-CE2 4.03Å; L156-Y171 HydrophobicContact CD2-CD1 3.94Å; L156-Y171 HydrophobicContact CD2-CE1 3.85Å; L156-Y171 HydrophobicContact CG-CE1 4.01Å; L156-L172 HydrophobicContact CD2-CD1 3.62Å
157R93.2Very high95.1Very high63 Ų6345.7 Ų45.724%0.23824%0.241CC..Hα-helixtrans-56.8-45.6176.8-174.9-150.9179.986.94.7112.2T153 A155 T302 D303T153-R157 WeakPolarHBondContact O-CB 3.44Å; T153-R157 PolarHBondContact O-N 2.95Å; A155-R157 VanDerWaalsContact C-N 3.32Å; A155-R157 PolarHBondContact O-N 3.02Å; R157-T302 PolarHBondContact NH2-O 3.47Å; R157-D303 VanDerWaalsContact CZ-C 3.48Å; R157-D303 VanDerWaalsContact NH1-C 3.29Å; R157-D303 PolarHBondContact NH1-O 3.44Å; R157-D303 PolarHBondContact NH2-O 2.89Å
158H96.3Very high95.2Very high8 Ų844.9 Ų44.94%0.03723%0.233CC..Hα-helixtrans-73.9-35.6178.6-81.6-88.3000112.3H139 A143 Y146 A154 A155 L156 Q160 L161 S162H139-H158 WeakPolarHBondContact CB-O 3.35Å; H139-H158 AromaticContact CE1-ND1 3.89Å; H139-H158 AromaticContact CG-ND1 3.97Å; H139-H158 AromaticContact ND1-CE1 3.61Å; H139-H158 AromaticContact ND1-CG 4Å; H139-H158 AromaticContact ND1-ND1 3.01Å; H139-H158 PolarHBondContact ND1-ND1 3.23Å; A143-H158 HydrophobicContact CB-CB 3.61Å; Y146-H158 AromaticContact CE2-CD2 3.88Å; A154-H158 PolarHBondContact O-CD2 2.86Å; A154-H158 VanDerWaalsContact O-CD2 3.3Å; A154-H158 PolarHBondContact O-N 3.37Å; A155-H158 PolarHBondContact O-N 3.49Å; A155-H158 VanDerWaalsContact O-N 3.15Å; L156-H158 VanDerWaalsContact C-N 3.33Å; L156-H158 PolarHBondContact O-N 3.29Å; H158-Q160 VanDerWaalsContact C-N 3.3Å; H158-Q160 PolarHBondContact O-N 2.68Å; H158-L161 PolarHBondContact O-N 2.88Å; H158-S162 PolarHBondContact O-N 2.87Å; H158-S162 VanDerWaalsContact O-N 3.13Å
159F96.9Very high95.3Very high8 Ų838.2 Ų38.24%0.03520%0.198CC..Hα-helixtrans-60.6-40.1173.5-82.3-61.8000112.2L140 A143 E144 A147 A155 L156 L161 S162 R167 Y168 Y171L140-F159 HydrophobicContact CD1-CD1 4.09Å; L140-F159 HydrophobicContact CD1-CE1 3.75Å; A143-F159 HydrophobicContact CB-CB 4.38Å; A143-F159 HydrophobicContact CB-CD1 3.72Å; A143-F159 HydrophobicContact CB-CD2 3.66Å; A143-F159 HydrophobicContact CB-CE1 3.79Å; A143-F159 HydrophobicContact CB-CE2 3.71Å; A143-F159 HydrophobicContact CB-CG 3.64Å; A143-F159 HydrophobicContact CB-CZ 3.78Å; E144-F159 HydrophobicContact CG-CZ 4.47Å; A147-F159 HydrophobicContact CB-CE2 4.29Å; A155-F159 HydrophobicContact CB-CD2 4.36Å; A155-F159 HydrophobicContact CB-CE2 4.28Å; A155-F159 WeakPolarHBondContact O-CD2 3.49Å; A155-F159 PolarHBondContact O-N 2.85Å; L156-F159 PolarHBondContact O-N 3.25Å; F159-L161 PolarHBondContact O-N 3.49Å; F159-L161 VanDerWaalsContact O-N 3.14Å; F159-S162 WeakPolarHBondContact O-CB 3.39Å; F159-S162 PolarHBondContact O-N 3.15Å; F159-S162 PolarHBondContact O-OG 3.18Å; F159-R167 HydrophobicContact CE1-CB 4.12Å; F159-Y168 HydrophobicContact CB-CD2 3.43Å; F159-Y168 VanDerWaalsContact CB-CD2 3.43Å; F159-Y168 HydrophobicContact CB-CE2 4.02Å; F159-Y168 HydrophobicContact CB-CG 3.79Å; F159-Y168 HydrophobicContact CG-CD2 4.13Å; F159-Y171 AromaticContact CD2-CD1 3.39Å; F159-Y171 HydrophobicContact CD2-CD1 3.39Å; F159-Y171 AromaticContact CD2-CE1 3.95Å; F159-Y171 HydrophobicContact CD2-CE1 3.95Å; F159-Y171 AromaticContact CD2-CG 3.79Å; F159-Y171 HydrophobicContact CD2-CG 3.79Å; F159-Y171 AromaticContact CE2-CD1 3.35Å; F159-Y171 HydrophobicContact CE2-CD1 3.35Å; F159-Y171 AromaticContact CE2-CD2 3.8Å; F159-Y171 HydrophobicContact CE2-CD2 3.8Å; F159-Y171 AromaticContact CE2-CE1 3.91Å; F159-Y171 HydrophobicContact CE2-CE1 3.91Å; F159-Y171 HydrophobicContact CE2-CE2 4.32Å; F159-Y171 AromaticContact CE2-CG 3.27Å; F159-Y171 HydrophobicContact CE2-CG 3.27Å; F159-Y171 HydrophobicContact CG-CD1 4.48Å; F159-Y171 HydrophobicContact CZ-CD1 4.4Å; F159-Y171 HydrophobicContact CZ-CD2 4.36Å; F159-Y171 AromaticContact CZ-CG 3.94Å; F159-Y171 HydrophobicContact CZ-CG 3.94Å
160Q92.9Very high95.5Very high28 Ų2839.3 Ų39.313%0.13120%0.203CC..THydrogen-bonded Turntrans-59.7-21.3173.5-74.5174.9-2500113.6L156 H158 Y168 R196 L301L156-Q160 WeakPolarHBondContact O-CG 3.48Å; L156-Q160 PolarHBondContact O-N 2.82Å; H158-Q160 VanDerWaalsContact C-N 3.3Å; H158-Q160 PolarHBondContact O-N 2.68Å; Q160-Y168 HydrophobicContact CG-CE1 3.93Å; Q160-Y168 HydrophobicContact CG-CE2 4.49Å; Q160-Y168 WeakPolarHBondContact CG-OH 3.43Å; Q160-R196 PolarHBondContact O-NH1 3.36Å; Q160-R196 PolarHBondContact O-NH2 2.85Å; Q160-L301 HydrophobicContact CB-CD2 4.05Å
161L93.7Very high95.7Very high21 Ų2136.5 Ų36.511%0.1119%0.186CC..THydrogen-bonded Turntrans-99.4-7176.6-66.8168.4000112.6R133 P136 H139 H158 F159 Q163 L301R133-L161 HydrophobicContact CB-CD2 4.43Å; P136-L161 WeakPolarHBondContact CA-O 3.35Å; H139-L161 HydrophobicContact CB-CB 3.82Å; H139-L161 WeakPolarHBondContact CE1-CD1 3.36Å; H139-L161 VanDerWaalsContact CG-CB 3.4Å; H158-L161 PolarHBondContact O-N 2.88Å; F159-L161 PolarHBondContact O-N 3.49Å; F159-L161 VanDerWaalsContact O-N 3.14Å; L161-Q163 VanDerWaalsContact C-N 3.34Å; L161-Q163 PolarHBondContact O-N 3.37Å; L161-L301 HydrophobicContact CD2-CB 4.07Å; L161-L301 HydrophobicContact CD2-CD2 3.79Å; L161-L301 HydrophobicContact CD2-CG 4.43Å; L161-L301 HydrophobicContact CG-CD2 4.28Å
162S94.6Very high95.9Very high6 Ų633.8 Ų33.84%0.04217%0.171CC..SBendtrans-79.2-13.6-170.475.90000114.9P136 H158 F159 N164P136-S162 WeakPolarHBondContact CB-O 3.48Å; P136-S162 WeakPolarHBondContact O-CA 3.44Å; H158-S162 PolarHBondContact O-N 2.87Å; H158-S162 VanDerWaalsContact O-N 3.13Å; F159-S162 WeakPolarHBondContact O-CB 3.39Å; F159-S162 PolarHBondContact O-N 3.15Å; F159-S162 PolarHBondContact O-OG 3.18Å; S162-N164 PolarHBondContact O-N 3.17Å; S162-N164 PolarHBondContact OG-N 2.9Å
163Q94.8Very high95.9Very high69 Ų6933.3 Ų33.332%0.32217%0.167SC..  trans49.416.5-171.6-59.3-174.8-23.800113.8P136 L161 E201 V204P136-Q163 HydrophobicContact CB-CB 3.95Å; P136-Q163 HydrophobicContact CB-CG 4.01Å; P136-Q163 HydrophobicContact CG-CB 4.36Å; P136-Q163 HydrophobicContact CG-CG 3.99Å; L161-Q163 VanDerWaalsContact C-N 3.34Å; L161-Q163 PolarHBondContact O-N 3.37Å; Q163-E201 WeakPolarHBondContact CG-OE1 3.19Å; Q163-E201 PolarHBondContact NE2-OE1 3.02Å; Q163-V204 HydrophobicContact CB-CG2 4.44Å; Q163-V204 WeakPolarHBondContact O-CG2 3.45Å
164N97Very high96Very high49 Ų4931.8 Ų31.826%0.26215%0.153SC..  trans-101.592.2-180-169-57.6000108.8L140 S162 P166 R167 Y168L140-N164 HydrophobicContact CD1-CB 4.14Å; L140-N164 HydrophobicContact CD2-CB 4.04Å; L140-N164 WeakPolarHBondContact CD2-ND2 3.34Å; S162-N164 PolarHBondContact O-N 3.17Å; S162-N164 PolarHBondContact OG-N 2.9Å; N164-P166 WeakPolarHBondContact OD1-CD 3.48Å; N164-R167 HydrophobicContact CB-CB 4.43Å; N164-R167 VanDerWaalsContact OD1-CB 3.29Å; N164-R167 WeakPolarHBondContact OD1-CB 3.21Å; N164-R167 WeakPolarHBondContact OD1-CG 3.01Å; N164-R167 PolarHBondContact OD1-N 3Å; N164-Y168 VanDerWaalsContact O-CB 3.31Å; N164-Y168 WeakPolarHBondContact O-CB 3.39Å; N164-Y168 PolarHBondContact O-N 2.95Å
165G97.4Very high96.1Very high0 Ų032.6 Ų32.60%015%0.154CC..Hα-helixtrans-55.1-50.8-178.900000112.7R167 Y168 G169 L208G165-R167 PolarHBondContact O-N 3.14Å; G165-Y168 PolarHBondContact O-N 3.39Å; G165-G169 PolarHBondContact O-N 3.02Å; G165-L208 WeakPolarHBondContact O-CA 3.39Å
166P97.7Very high96.1Very high54 Ų5433.1 Ų33.135%0.35116%0.157SC..Hα-helixtrans-59.6-48.8-176.5-26.935.7000113.5N164 G169 E170 E207 S211N164-P166 WeakPolarHBondContact OD1-CD 3.48Å; P166-G169 PolarHBondContact O-N 3.4Å; P166-E170 WeakPolarHBondContact O-CB 3.5Å; P166-E170 PolarHBondContact O-N 3.13Å; P166-E207 WeakPolarHBondContact CD-OE2 3.26Å; P166-E207 HydrophobicContact CG-CB 4.02Å; P166-S211 WeakPolarHBondContact O-CB 3.39Å; P166-S211 PolarHBondContact O-OG 3.43Å
167R97.8Very high96Very high113 Ų11334.1 Ų34.143%0.42616%0.162SC..Hα-helixtrans-68.9-38.7-179.6-71.8-60.5-156.7-171.62.2112.6L140 E144 F159 N164 G165 E170 Y171L140-R167 HydrophobicContact CD1-CB 3.83Å; L140-R167 HydrophobicContact CD1-CG 4.14Å; E144-R167 IonicContact OE1-NE 2.7Å; F159-R167 HydrophobicContact CE1-CB 4.12Å; N164-R167 HydrophobicContact CB-CB 4.43Å; N164-R167 VanDerWaalsContact OD1-CB 3.29Å; N164-R167 WeakPolarHBondContact OD1-CB 3.21Å; N164-R167 WeakPolarHBondContact OD1-CG 3.01Å; N164-R167 PolarHBondContact OD1-N 3Å; G165-R167 PolarHBondContact O-N 3.14Å; R167-E170 IonicContact CZ-OE2 2.73Å; R167-E170 IonicContact NH1-OE1 3.73Å; R167-E170 IonicContact NH1-OE2 3.65Å; R167-E170 PolarHBondContact NH1-OE2 3.03Å; R167-Y171 WeakPolarHBondContact O-CB 3.29Å; R167-Y171 PolarHBondContact O-N 2.8Å
168Y98.1Very high96.1Very high9 Ų939.5 Ų39.54%0.03518%0.182CC..Hα-helixtrans-66.1-44.4176.7-176.6-161.6000110.9L156 F159 Q160 N164 G165 Y171 L172 A192 L208L156-Y168 HydrophobicContact CD2-CE2 4.03Å; F159-Y168 HydrophobicContact CB-CD2 3.43Å; F159-Y168 VanDerWaalsContact CB-CD2 3.43Å; F159-Y168 HydrophobicContact CB-CE2 4.02Å; F159-Y168 HydrophobicContact CB-CG 3.79Å; F159-Y168 HydrophobicContact CG-CD2 4.13Å; Q160-Y168 HydrophobicContact CG-CE1 3.93Å; Q160-Y168 HydrophobicContact CG-CE2 4.49Å; Q160-Y168 WeakPolarHBondContact CG-OH 3.43Å; N164-Y168 VanDerWaalsContact O-CB 3.31Å; N164-Y168 WeakPolarHBondContact O-CB 3.39Å; N164-Y168 PolarHBondContact O-N 2.95Å; G165-Y168 PolarHBondContact O-N 3.39Å; Y168-Y171 PolarHBondContact O-N 3.14Å; Y168-L172 HydrophobicContact CD2-CB 4.24Å; Y168-L172 HydrophobicContact CE2-CB 4.14Å; Y168-L172 HydrophobicContact CE2-CD1 4.31Å; Y168-L172 HydrophobicContact CE2-CD2 4.19Å; Y168-L172 HydrophobicContact CE2-CG 4.46Å; Y168-L172 WeakPolarHBondContact O-CB 2.92Å; Y168-L172 PolarHBondContact O-N 3.14Å; Y168-A192 HydrophobicContact CE1-CB 4.29Å; Y168-L208 HydrophobicContact CD1-CD1 3.14Å; Y168-L208 HydrophobicContact CD1-CG 4.34Å; Y168-L208 HydrophobicContact CE1-CD1 3.49Å; Y168-L208 VanDerWaalsContact CE1-CD1 3.49Å; Y168-L208 HydrophobicContact CG-CD1 3.87Å
169G97.4Very high96Very high0 Ų044.4 Ų44.40%020%0.202CC..Hα-helixtrans-60.5-46176.300000113.1G165 P166 L172 A173 Y212G165-G169 PolarHBondContact O-N 3.02Å; P166-G169 PolarHBondContact O-N 3.4Å; G169-L172 PolarHBondContact O-N 3.09Å; G169-A173 WeakPolarHBondContact O-CB 3.5Å; G169-A173 PolarHBondContact O-N 3.15Å; G169-Y212 WeakPolarHBondContact O-CA 3.35Å
170E96.9Very high95.8Very high57 Ų5745 Ų4527%0.26621%0.21SC..Hα-helixtrans-58-52.8176.4177.1-176.5-166.200110.9P166 R167 A173 L174 S211P166-E170 WeakPolarHBondContact O-CB 3.5Å; P166-E170 PolarHBondContact O-N 3.13Å; R167-E170 IonicContact CZ-OE2 2.73Å; R167-E170 IonicContact NH1-OE1 3.73Å; R167-E170 IonicContact NH1-OE2 3.65Å; R167-E170 PolarHBondContact NH1-OE2 3.03Å; E170-A173 PolarHBondContact O-N 2.78Å; E170-L174 HydrophobicContact CG-CD1 4.37Å; E170-L174 WeakPolarHBondContact O-CG 3.16Å; E170-L174 PolarHBondContact O-N 3.01Å; E170-S211 PolarHBondContact N-OG 3.29Å
171Y97.8Very high95.8Very high32 Ų3248.5 Ų48.513%0.12523%0.228CC..Hα-helixtrans-64.1-44.4-179.1-179.4-101.8000112.3A147 G152 A155 L156 F159 R167 Y168 A173 L174 H175A147-Y171 HydrophobicContact CB-CD2 3.73Å; A147-Y171 HydrophobicContact CB-CE2 3.3Å; G152-Y171 WeakPolarHBondContact CA-OH 3.4Å; A155-Y171 HydrophobicContact CB-CE1 3.7Å; A155-Y171 HydrophobicContact CB-CE2 4.46Å; A155-Y171 WeakPolarHBondContact CB-OH 3.35Å; L156-Y171 HydrophobicContact CD2-CD1 3.94Å; L156-Y171 HydrophobicContact CD2-CE1 3.85Å; L156-Y171 HydrophobicContact CG-CE1 4.01Å; F159-Y171 AromaticContact CD2-CD1 3.39Å; F159-Y171 HydrophobicContact CD2-CD1 3.39Å; F159-Y171 AromaticContact CD2-CE1 3.95Å; F159-Y171 HydrophobicContact CD2-CE1 3.95Å; F159-Y171 AromaticContact CD2-CG 3.79Å; F159-Y171 HydrophobicContact CD2-CG 3.79Å; F159-Y171 AromaticContact CE2-CD1 3.35Å; F159-Y171 HydrophobicContact CE2-CD1 3.35Å; F159-Y171 AromaticContact CE2-CD2 3.8Å; F159-Y171 HydrophobicContact CE2-CD2 3.8Å; F159-Y171 AromaticContact CE2-CE1 3.91Å; F159-Y171 HydrophobicContact CE2-CE1 3.91Å; F159-Y171 HydrophobicContact CE2-CE2 4.32Å; F159-Y171 AromaticContact CE2-CG 3.27Å; F159-Y171 HydrophobicContact CE2-CG 3.27Å; F159-Y171 HydrophobicContact CG-CD1 4.48Å; F159-Y171 HydrophobicContact CZ-CD1 4.4Å; F159-Y171 HydrophobicContact CZ-CD2 4.36Å; F159-Y171 AromaticContact CZ-CG 3.94Å; F159-Y171 HydrophobicContact CZ-CG 3.94Å; R167-Y171 WeakPolarHBondContact O-CB 3.29Å; R167-Y171 PolarHBondContact O-N 2.8Å; Y168-Y171 PolarHBondContact O-N 3.14Å; Y171-A173 VanDerWaalsContact C-N 3.3Å; Y171-A173 PolarHBondContact O-N 3.02Å; Y171-L174 PolarHBondContact O-N 3.12Å; Y171-H175 HydrophobicContact CE1-CB 4.21Å; Y171-H175 AromaticContact CZ-CD2 3.99Å; Y171-H175 WeakPolarHBondContact O-CB 3.36Å; Y171-H175 PolarHBondContact O-N 3.3Å
172L97.2Very high95.7Very high8 Ų850.7 Ų50.74%0.04224%0.238CC..Hα-helixtrans-62-39.6-179.4-174.864.8000111.3L156 Y168 G169 Q176 T188 I189 A192 Y212L156-L172 HydrophobicContact CD2-CD1 3.62Å; Y168-L172 HydrophobicContact CD2-CB 4.24Å; Y168-L172 HydrophobicContact CE2-CB 4.14Å; Y168-L172 HydrophobicContact CE2-CD1 4.31Å; Y168-L172 HydrophobicContact CE2-CD2 4.19Å; Y168-L172 HydrophobicContact CE2-CG 4.46Å; Y168-L172 WeakPolarHBondContact O-CB 2.92Å; Y168-L172 PolarHBondContact O-N 3.14Å; G169-L172 PolarHBondContact O-N 3.09Å; L172-Q176 WeakPolarHBondContact O-CB 3.37Å; L172-Q176 PolarHBondContact O-N 3.32Å; L172-T188 HydrophobicContact CD1-CG2 3.63Å; L172-T188 HydrophobicContact CD2-CG2 4.08Å; L172-T188 HydrophobicContact CG-CG2 3.89Å; L172-I189 HydrophobicContact CD2-CD1 4.43Å; L172-A192 HydrophobicContact CD2-CB 3.68Å; L172-Y212 HydrophobicContact CB-CD2 4.05Å; L172-Y212 HydrophobicContact CB-CE2 4.28Å; L172-Y212 HydrophobicContact CD2-CD2 4.12Å; L172-Y212 HydrophobicContact CD2-CE2 4.22Å; L172-Y212 HydrophobicContact CG-CD2 4Å; L172-Y212 HydrophobicContact CG-CE2 3.86Å
173A96.1Very high95.6Very high0 Ų054.8 Ų54.80%027%0.267CS..Hα-helixtrans-62.4-49.4176.600000112.1G169 E170 Y171 Q176 D177 Y212 H215 H216G169-A173 WeakPolarHBondContact O-CB 3.5Å; G169-A173 PolarHBondContact O-N 3.15Å; E170-A173 PolarHBondContact O-N 2.78Å; Y171-A173 VanDerWaalsContact C-N 3.3Å; Y171-A173 PolarHBondContact O-N 3.02Å; A173-Q176 PolarHBondContact O-N 2.98Å; A173-D177 PolarHBondContact O-N 3.15Å; A173-Y212 HydrophobicContact CB-CD2 3.64Å; A173-Y212 HydrophobicContact CB-CE2 3.93Å; A173-Y212 HydrophobicContact CB-CG 4.15Å; A173-H215 HydrophobicContact CB-CB 3.92Å; A173-H216 HydrophobicContact CB-CB 3.88Å
174L95.3Very high95.6Very high88 Ų8855.5 Ų55.546%0.46127%0.27SS..Hα-helixtrans-67-38.3179.2-63.7175.7000112E170 Y171 R178E170-L174 HydrophobicContact CG-CD1 4.37Å; E170-L174 WeakPolarHBondContact O-CG 3.16Å; E170-L174 PolarHBondContact O-N 3.01Å; Y171-L174 PolarHBondContact O-N 3.12Å; L174-R178 WeakPolarHBondContact O-CB 3.46Å; L174-R178 PolarHBondContact O-N 2.81Å
175H95.7Very high95.5Very high36 Ų3653.4 Ų53.417%0.16726%0.259CS..Hα-helixtrans-67.3-43.2176.9-176-77.4000111.7G152 Y171 R178 Y179G152-H175 WeakPolarHBondContact CA-NE2 3.29Å; Y171-H175 HydrophobicContact CE1-CB 4.21Å; Y171-H175 AromaticContact CZ-CD2 3.99Å; Y171-H175 WeakPolarHBondContact O-CB 3.36Å; Y171-H175 PolarHBondContact O-N 3.3Å; H175-R178 PolarHBondContact O-N 3.03Å; H175-Y179 AromaticContact CD2-CD2 3.68Å; H175-Y179 AromaticContact NE2-CD2 3.66Å; H175-Y179 PolarHBondContact O-N 2.75Å
176Q95.6Very high95.4Very high11 Ų1153.9 Ų53.95%0.05126%0.262CS..Hα-helixtrans-62.7-42.5176.4178.865.222.800111.8L172 A173 R178 G180 I181 Q182 A185 T188 Y212L172-Q176 WeakPolarHBondContact O-CB 3.37Å; L172-Q176 PolarHBondContact O-N 3.32Å; A173-Q176 PolarHBondContact O-N 2.98Å; Q176-R178 VanDerWaalsContact C-N 3.33Å; Q176-R178 PolarHBondContact O-N 3.16Å; Q176-G180 VanDerWaalsContact O-CA 3.23Å; Q176-G180 WeakPolarHBondContact O-CA 3.43Å; Q176-G180 PolarHBondContact O-N 2.74Å; Q176-I181 PolarHBondContact NE2-O 3.03Å; Q176-Q182 PolarHBondContact O-NE2 3.01Å; Q176-A185 HydrophobicContact CG-CB 3.94Å; Q176-T188 PolarHBondContact OE1-OG1 3.41Å; Q176-Y212 HydrophobicContact CB-CE2 4.49Å
177D94.3Very high95.4Very high57 Ų5752.5 Ų52.531%0.30525%0.252SS..Hα-helixtrans-62.2-42177.8-176.367.8000111.6A173 Q182 P217A173-D177 PolarHBondContact O-N 3.15Å; D177-Q182 PolarHBondContact O-NE2 3.01Å; D177-P217 HydrophobicContact CB-CG 4.19Å
178R94.2Very high95.3Very high175 Ų17548.4 Ų48.466%0.6624%0.239SC*.Hα-helixtrans-78.7-43.4-176.3-170-180-71.8-177.90.4114.3L174 H175 Q176L174-R178 WeakPolarHBondContact O-CB 3.46Å; L174-R178 PolarHBondContact O-N 2.81Å; H175-R178 PolarHBondContact O-N 3.03Å; Q176-R178 VanDerWaalsContact C-N 3.33Å; Q176-R178 PolarHBondContact O-N 3.16Å
179Y94.2Very high95.3Very high112 Ų11248 Ų4844%0.43924%0.238SC..Hα-helixtrans-120.3-15.5-168.7-57-61000114.1D150 H175D150-Y179 PolarHBondContact OD1-OH 3.46Å; D150-Y179 PolarHBondContact OD2-OH 2.56Å; H175-Y179 AromaticContact CD2-CD2 3.68Å; H175-Y179 AromaticContact NE2-CD2 3.66Å; H175-Y179 PolarHBondContact O-N 2.75Å
180G92.6Very high95.3Very high21 Ų2148 Ų4822%0.21624%0.238CC..SBendtrans-84.6161.5-173.400000114.3Q176 Q182Q176-G180 VanDerWaalsContact O-CA 3.23Å; Q176-G180 WeakPolarHBondContact O-CA 3.43Å; Q176-G180 PolarHBondContact O-N 2.74Å; G180-Q182 PolarHBondContact O-N 3.06Å; G180-Q182 PolarHBondContact O-NE2 3.42Å
181I94Very high95.3Very high100 Ų10048.7 Ų48.751%0.51324%0.241SC..  trans-72.7116.7170.3-58.7176.9000108.2Q176 S183 E184Q176-I181 PolarHBondContact NE2-O 3.03Å; I181-S183 VanDerWaalsContact C-N 3.26Å; I181-S183 WeakPolarHBondContact CG2-OG 3.31Å; I181-S183 PolarHBondContact O-N 2.88Å; I181-E184 HydrophobicContact CB-CB 4.28Å; I181-E184 HydrophobicContact CB-CG 4.02Å; I181-E184 HydrophobicContact CG2-CG 3.91Å; I181-E184 WeakPolarHBondContact O-CA 3.41Å; I181-E184 WeakPolarHBondContact O-CB 3.18Å; I181-E184 PolarHBondContact O-N 2.94Å
182Q91.7Very high95.2Very high68 Ų6847.2 Ų47.232%0.31824%0.236SC..G310 helixtrans-63.6-30.1-168.4-59-61.6-54.900113.7Q176 D177 G180 E184Q176-Q182 PolarHBondContact O-NE2 3.01Å; D177-Q182 PolarHBondContact O-NE2 3.01Å; G180-Q182 PolarHBondContact O-N 3.06Å; G180-Q182 PolarHBondContact O-NE2 3.42Å; Q182-E184 PolarHBondContact O-N 3.35Å
183S92.2Very high95.3Very high92 Ų9246.9 Ų46.964%0.64323%0.234SC*.G310 helixtrans-72.9-9.7174.253.70000114.1I181 R264I181-S183 VanDerWaalsContact C-N 3.26Å; I181-S183 WeakPolarHBondContact CG2-OG 3.31Å; I181-S183 PolarHBondContact O-N 2.88Å; S183-R264 PolarHBondContact O-NH2 3.07Å
184E94.4Very high95.4Very high83 Ų8346.9 Ų46.939%0.38823%0.234SC..G310 helixtrans-107.55.8-178.7-58-174.3161.900112.5I181 Q182 D186 L187 T188I181-E184 HydrophobicContact CB-CB 4.28Å; I181-E184 HydrophobicContact CB-CG 4.02Å; I181-E184 HydrophobicContact CG2-CG 3.91Å; I181-E184 WeakPolarHBondContact O-CA 3.41Å; I181-E184 WeakPolarHBondContact O-CB 3.18Å; I181-E184 PolarHBondContact O-N 2.94Å; Q182-E184 PolarHBondContact O-N 3.35Å; E184-D186 PolarHBondContact O-N 2.79Å; E184-D186 VanDerWaalsContact O-N 3.1Å; E184-L187 HydrophobicContact CB-CB 4.4Å; E184-L187 HydrophobicContact CB-CD1 4.21Å; E184-L187 HydrophobicContact CG-CD1 4.13Å; E184-L187 WeakPolarHBondContact O-CA 3.36Å; E184-L187 WeakPolarHBondContact O-CB 3.34Å; E184-L187 PolarHBondContact O-N 2.84Å; E184-T188 PolarHBondContact O-N 2.75Å; E184-T188 PolarHBondContact O-OG1 3Å
185A95.5Very high95.4Very high5 Ų543 Ų434%0.04121%0.214CC..Hα-helixtrans-57.4-29.9-178.800000113.3Q176 Y212 L219Q176-A185 HydrophobicContact CG-CB 3.94Å; A185-Y212 PolarHBondContact O-OH 3.24Å; A185-L219 HydrophobicContact CB-CD1 4.01Å
186D95.8Very high95.3Very high11 Ų1141.7 Ų41.76%0.05921%0.207CC..Hα-helixtrans-78.7-31.8174.162.5-13.8000113.4E184 I189 A190 T230 L232 L233 R264E184-D186 PolarHBondContact O-N 2.79Å; E184-D186 VanDerWaalsContact O-N 3.1Å; D186-I189 VanDerWaalsContact O-CG2 3.3Å; D186-I189 WeakPolarHBondContact O-CG2 3.5Å; D186-A190 WeakPolarHBondContact O-CB 3.49Å; D186-A190 PolarHBondContact O-N 2.85Å; D186-T230 HydrophobicContact CB-CG2 4.26Å; D186-T230 VanDerWaalsContact OD2-CB 3.31Å; D186-T230 WeakPolarHBondContact OD2-CB 3.42Å; D186-T230 WeakPolarHBondContact OD2-CG2 3.47Å; D186-T230 PolarHBondContact OD2-OG1 3.07Å; D186-L232 HydrophobicContact CB-CD2 4.35Å; D186-L233 HydrophobicContact CB-CD1 4.31Å; D186-L233 HydrophobicContact CB-CD2 3.97Å; D186-L233 HydrophobicContact CB-CG 3.84Å; D186-R264 IonicContact OD1-CZ 2.83Å; D186-R264 IonicContact OD1-NH1 3.79Å; D186-R264 PolarHBondContact OD1-NH1 3.38Å; D186-R264 VanDerWaalsContact OD1-NH1 3.12Å; D186-R264 IonicContact OD1-NH2 3.7Å; D186-R264 PolarHBondContact OD1-NH2 3.41Å; D186-R264 IonicContact OD2-CZ 2.79Å; D186-R264 IonicContact OD2-NH1 3.12Å; D186-R264 PolarHBondContact OD2-NH1 3.2Å; D186-R264 IonicContact OD2-NH2 3.36Å
187L96.8Very high95.4Very high25 Ų2541.2 Ų41.213%0.13121%0.205CC..Hα-helixtrans-66.6-43.7172-70.3168.6000111.2E184 I189 A190 Q191 L232 R264 D265 F268E184-L187 HydrophobicContact CB-CB 4.4Å; E184-L187 HydrophobicContact CB-CD1 4.21Å; E184-L187 HydrophobicContact CG-CD1 4.13Å; E184-L187 WeakPolarHBondContact O-CA 3.36Å; E184-L187 WeakPolarHBondContact O-CB 3.34Å; E184-L187 PolarHBondContact O-N 2.84Å; L187-I189 VanDerWaalsContact C-N 3.35Å; L187-I189 PolarHBondContact O-N 3.43Å; L187-A190 PolarHBondContact O-N 3.46Å; L187-Q191 WeakPolarHBondContact O-CB 3.39Å; L187-Q191 PolarHBondContact O-N 3.35Å; L187-L232 HydrophobicContact CD2-CD2 3.67Å; L187-L232 HydrophobicContact CG-CD2 4.2Å; L187-R264 HydrophobicContact CD2-CB 3.86Å; L187-D265 HydrophobicContact CD2-CB 4.33Å; L187-F268 HydrophobicContact CD2-CE2 3.73Å; L187-F268 HydrophobicContact CD2-CZ 4.02Å
188T96.1Very high95.4Very high27 Ų2738.6 Ų38.617%0.16619%0.191CC..Hα-helixtrans-55.3-49.6179.6-61.50000111.4L172 Q176 E184 A192L172-T188 HydrophobicContact CD1-CG2 3.63Å; L172-T188 HydrophobicContact CD2-CG2 4.08Å; L172-T188 HydrophobicContact CG-CG2 3.89Å; Q176-T188 PolarHBondContact OE1-OG1 3.41Å; E184-T188 PolarHBondContact O-N 2.75Å; E184-T188 PolarHBondContact O-OG1 3Å; T188-A192 PolarHBondContact O-N 3.05Å
189I96.7Very high95.2Very high0 Ų033.4 Ų33.40%018%0.175CC..Hα-helixtrans-72.4-38.7179-173.356.5000112.5L172 D186 L187 Q191 A192 V193 L208 F209 Y212 L233L172-I189 HydrophobicContact CD2-CD1 4.43Å; D186-I189 VanDerWaalsContact O-CG2 3.3Å; D186-I189 WeakPolarHBondContact O-CG2 3.5Å; L187-I189 VanDerWaalsContact C-N 3.35Å; L187-I189 PolarHBondContact O-N 3.43Å; I189-Q191 VanDerWaalsContact C-N 3.32Å; I189-Q191 PolarHBondContact O-N 3.03Å; I189-A192 PolarHBondContact O-N 3.25Å; I189-V193 HydrophobicContact CD1-CG2 4.04Å; I189-V193 HydrophobicContact CG1-CG2 4.25Å; I189-V193 WeakPolarHBondContact O-CB 3.35Å; I189-V193 VanDerWaalsContact O-CG2 3.31Å; I189-V193 WeakPolarHBondContact O-CG2 3.08Å; I189-V193 PolarHBondContact O-N 2.98Å; I189-L208 HydrophobicContact CD1-CD2 3.26Å; I189-F209 HydrophobicContact CG1-CD2 3.88Å; I189-F209 HydrophobicContact CG1-CE2 4.42Å; I189-Y212 HydrophobicContact CB-CD1 3.59Å; I189-Y212 HydrophobicContact CB-CD2 4.3Å; I189-Y212 HydrophobicContact CB-CE1 3.51Å; I189-Y212 HydrophobicContact CB-CE2 4.25Å; I189-Y212 HydrophobicContact CB-CG 3.98Å; I189-Y212 HydrophobicContact CD1-CD1 3.82Å; I189-Y212 HydrophobicContact CD1-CD2 3.85Å; I189-Y212 HydrophobicContact CD1-CG 3.42Å; I189-Y212 VanDerWaalsContact CD1-CG 3.42Å; I189-Y212 HydrophobicContact CG1-CD1 3.51Å; I189-Y212 HydrophobicContact CG1-CD2 4.36Å; I189-Y212 HydrophobicContact CG1-CE1 4.01Å; I189-Y212 HydrophobicContact CG1-CG 3.7Å; I189-Y212 HydrophobicContact CG2-CD1 4.03Å; I189-Y212 HydrophobicContact CG2-CE1 3.71Å; I189-L233 HydrophobicContact CG2-CD2 3.57Å
190A97.9Very high95.1Very high0 Ų032.4 Ų32.40%018%0.177CC..Hα-helixtrans-58.5-45.9175.700000111.2D186 L187 V193 L194 L232 I236 F268D186-A190 WeakPolarHBondContact O-CB 3.49Å; D186-A190 PolarHBondContact O-N 2.85Å; L187-A190 PolarHBondContact O-N 3.46Å; A190-V193 PolarHBondContact O-N 2.98Å; A190-L194 WeakPolarHBondContact O-CB 3.38Å; A190-L194 WeakPolarHBondContact O-CG 3.39Å; A190-L194 PolarHBondContact O-N 3.12Å; A190-L232 HydrophobicContact CB-CD1 4.22Å; A190-L232 HydrophobicContact CB-CD2 3.87Å; A190-L232 HydrophobicContact CB-CG 4.02Å; A190-I236 HydrophobicContact CB-CD1 3.84Å; A190-I236 HydrophobicContact CB-CG1 3.84Å; A190-F268 HydrophobicContact CB-CE2 3.8Å; A190-F268 HydrophobicContact CB-CZ 3.79Å
191Q97Very high95.2Very high71 Ų7132.7 Ų32.733%0.33217%0.173SC..Hα-helixtrans-59.7-49.2177.1-169.6-17835.600111.5L187 I189 V193 L194 Q195 F268 Y271L187-Q191 WeakPolarHBondContact O-CB 3.39Å; L187-Q191 PolarHBondContact O-N 3.35Å; I189-Q191 VanDerWaalsContact C-N 3.32Å; I189-Q191 PolarHBondContact O-N 3.03Å; Q191-V193 PolarHBondContact O-N 2.66Å; Q191-L194 PolarHBondContact O-N 3.1Å; Q191-Q195 WeakPolarHBondContact O-CB 3.18Å; Q191-Q195 VanDerWaalsContact O-CG 3.24Å; Q191-Q195 WeakPolarHBondContact O-CG 3.38Å; Q191-Q195 PolarHBondContact O-N 3.35Å; Q191-F268 HydrophobicContact CB-CE1 3.81Å; Q191-F268 HydrophobicContact CB-CZ 4.16Å; Q191-F268 HydrophobicContact CG-CE1 4.2Å; Q191-Y271 HydrophobicContact CG-CE2 4.33Å
192A97.1Very high95.3Very high2 Ų231.2 Ų31.22%0.01716%0.163CC..Hα-helixtrans-60.5-45.2-179.700000112.2Y168 L172 T188 I189 Q195 R196 L208Y168-A192 HydrophobicContact CE1-CB 4.29Å; L172-A192 HydrophobicContact CD2-CB 3.68Å; T188-A192 PolarHBondContact O-N 3.05Å; I189-A192 PolarHBondContact O-N 3.25Å; A192-Q195 PolarHBondContact O-N 3.43Å; A192-R196 WeakPolarHBondContact O-CG 3.21Å; A192-R196 PolarHBondContact O-N 2.71Å; A192-R196 VanDerWaalsContact O-N 3.13Å; A192-L208 HydrophobicContact CB-CD1 4.35Å; A192-L208 HydrophobicContact CB-CD2 4.01Å
193V98Very high95.5Very high0 Ų033.7 Ų33.70%018%0.178CC..Hα-helixtrans-63.8-48.8177.8171.30000111.3I189 A190 Q191 Q195 R196 L197 A205 L208 F209 I236 L240I189-V193 HydrophobicContact CD1-CG2 4.04Å; I189-V193 HydrophobicContact CG1-CG2 4.25Å; I189-V193 WeakPolarHBondContact O-CB 3.35Å; I189-V193 VanDerWaalsContact O-CG2 3.31Å; I189-V193 WeakPolarHBondContact O-CG2 3.08Å; I189-V193 PolarHBondContact O-N 2.98Å; A190-V193 PolarHBondContact O-N 2.98Å; Q191-V193 PolarHBondContact O-N 2.66Å; V193-Q195 VanDerWaalsContact C-N 3.31Å; V193-Q195 PolarHBondContact O-N 2.83Å; V193-R196 WeakPolarHBondContact O-CB 3.3Å; V193-R196 PolarHBondContact O-N 2.91Å; V193-R196 VanDerWaalsContact O-N 3.13Å; V193-L197 HydrophobicContact CG1-CD1 4Å; V193-L197 HydrophobicContact CG1-CG 4.43Å; V193-L197 WeakPolarHBondContact O-CG 3.35Å; V193-L197 PolarHBondContact O-N 3.24Å; V193-A205 HydrophobicContact CG1-CB 4.26Å; V193-L208 HydrophobicContact CG2-CD2 3.6Å; V193-F209 HydrophobicContact CG2-CB 3.88Å; V193-F209 HydrophobicContact CG2-CD2 4.11Å; V193-F209 HydrophobicContact CG2-CG 4.47Å; V193-I236 HydrophobicContact CB-CG2 4.17Å; V193-I236 HydrophobicContact CG1-CG2 3.8Å; V193-I236 HydrophobicContact CG2-CG2 4.18Å; V193-L240 HydrophobicContact CG1-CD1 4.37Å; V193-L240 HydrophobicContact CG1-CD2 3.93Å; V193-L240 HydrophobicContact CG1-CG 4.34Å
194L97.6Very high95.7Very high1 Ų130.3 Ų30.31%0.00515%0.154CC..Hα-helixtrans-61.5-40.2-179.8-69.1173.9000111.5A190 Q191 R196 L197 C198 I236 L239 F268 Y271 L272 I275A190-L194 WeakPolarHBondContact O-CB 3.38Å; A190-L194 WeakPolarHBondContact O-CG 3.39Å; A190-L194 PolarHBondContact O-N 3.12Å; Q191-L194 PolarHBondContact O-N 3.1Å; L194-R196 PolarHBondContact O-N 3.23Å; L194-L197 PolarHBondContact O-N 3.39Å; L194-C198 PolarHBondContact O-N 2.93Å; L194-C198 PolarHBondContact O-SG 2.93Å; L194-C198 VanDerWaalsContact O-SG 3.34Å; L194-I236 HydrophobicContact CD2-CD1 4.27Å; L194-I236 HydrophobicContact CG-CD1 4.17Å; L194-L239 HydrophobicContact CD2-CD2 3.64Å; L194-F268 HydrophobicContact CD1-CB 3.89Å; L194-F268 HydrophobicContact CD1-CD1 3.59Å; L194-F268 HydrophobicContact CD1-CD2 4.08Å; L194-F268 HydrophobicContact CD1-CE1 4.11Å; L194-F268 HydrophobicContact CD1-CG 3.58Å; L194-Y271 HydrophobicContact CB-CD2 3.74Å; L194-Y271 HydrophobicContact CB-CG 4.25Å; L194-Y271 HydrophobicContact CD1-CD2 4.22Å; L194-L272 HydrophobicContact CD2-CD2 3.9Å; L194-L272 HydrophobicContact CD2-CG 4.4Å; L194-I275 HydrophobicContact CB-CD1 4.28Å; L194-I275 HydrophobicContact CD2-CD1 3.52Å
195Q95.5Very high95.9Very high7 Ų726.4 Ų26.43%0.03314%0.135CC..Hα-helixtrans-61.8-39.7174.7-74173.7-4.300112.6Q191 A192 V193 C198 M199 Y271 L297Q191-Q195 WeakPolarHBondContact O-CB 3.18Å; Q191-Q195 VanDerWaalsContact O-CG 3.24Å; Q191-Q195 WeakPolarHBondContact O-CG 3.38Å; Q191-Q195 PolarHBondContact O-N 3.35Å; A192-Q195 PolarHBondContact O-N 3.43Å; V193-Q195 VanDerWaalsContact C-N 3.31Å; V193-Q195 PolarHBondContact O-N 2.83Å; Q195-C198 PolarHBondContact O-N 3.34Å; Q195-M199 WeakPolarHBondContact O-CG 3.2Å; Q195-M199 PolarHBondContact O-N 3.14Å; Q195-Y271 HydrophobicContact CG-CE1 4.48Å; Q195-Y271 HydrophobicContact CG-CE2 3.93Å; Q195-Y271 PolarHBondContact NE2-OH 2.9Å; Q195-Y271 VanDerWaalsContact NE2-OH 3.13Å; Q195-L297 HydrophobicContact CB-CD2 4.46Å; Q195-L297 HydrophobicContact CG-CD2 4.07Å
196R95.3Very high96Very high7 Ų728.1 Ų28.13%0.02614%0.144CC..Hα-helixtrans-63.3-43.7173.6-68.3-53.186.7176.915.4111.9Q160 A192 V193 L194 C198 M199 D200 E201 V204 A205 L208Q160-R196 PolarHBondContact O-NH1 3.36Å; Q160-R196 PolarHBondContact O-NH2 2.85Å; A192-R196 WeakPolarHBondContact O-CG 3.21Å; A192-R196 PolarHBondContact O-N 2.71Å; A192-R196 VanDerWaalsContact O-N 3.13Å; V193-R196 WeakPolarHBondContact O-CB 3.3Å; V193-R196 PolarHBondContact O-N 2.91Å; V193-R196 VanDerWaalsContact O-N 3.13Å; L194-R196 PolarHBondContact O-N 3.23Å; R196-C198 VanDerWaalsContact C-N 3.31Å; R196-C198 PolarHBondContact O-N 2.79Å; R196-M199 WeakPolarHBondContact O-CA 3.45Å; R196-M199 WeakPolarHBondContact O-CB 3.44Å; R196-M199 PolarHBondContact O-N 2.74Å; R196-D200 PolarHBondContact O-N 3.44Å; R196-E201 WeakPolarHBondContact CD-OE2 3.34Å; R196-E201 IonicContact CZ-OE2 2.75Å; R196-E201 IonicContact NE-OE2 3.54Å; R196-E201 IonicContact NH1-OE2 3.13Å; R196-E201 PolarHBondContact NH1-OE2 3.09Å; R196-E201 PolarHBondContact O-N 3.25Å; R196-E201 VanDerWaalsContact O-N 3.13Å; R196-V204 HydrophobicContact CG-CG1 4.29Å; R196-A205 HydrophobicContact CB-CB 3.67Å; R196-L208 HydrophobicContact CG-CD1 4.06Å
197L96.2Very high96.1Very high1 Ų132 Ų321%0.00516%0.162CC..Hα-helixtrans-64.4-34.9177.6-66172.1000112.3V193 L194 M199 D200 K202 A205 L239 L240 I243 I275V193-L197 HydrophobicContact CG1-CD1 4Å; V193-L197 HydrophobicContact CG1-CG 4.43Å; V193-L197 WeakPolarHBondContact O-CG 3.35Å; V193-L197 PolarHBondContact O-N 3.24Å; L194-L197 PolarHBondContact O-N 3.39Å; L197-M199 PolarHBondContact O-N 2.98Å; L197-D200 PolarHBondContact O-N 3.19Å; L197-D200 VanDerWaalsContact O-N 3.1Å; L197-K202 HydrophobicContact CD2-CG 4.39Å; L197-A205 HydrophobicContact CD2-CB 3.75Å; L197-A205 HydrophobicContact CG-CB 3.9Å; L197-L239 HydrophobicContact CD1-CD2 4.22Å; L197-L240 HydrophobicContact CD1-CD2 4.11Å; L197-L240 HydrophobicContact CD2-CD2 4.12Å; L197-L240 HydrophobicContact CG-CD2 4.48Å; L197-I243 HydrophobicContact CD1-CD1 3.69Å; L197-I243 HydrophobicContact CD2-CD1 3.97Å; L197-I243 HydrophobicContact CG-CD1 4.38Å; L197-I275 HydrophobicContact CB-CD1 3.6Å; L197-I275 HydrophobicContact CB-CG1 3.66Å; L197-I275 HydrophobicContact CB-CG2 4.36Å; L197-I275 HydrophobicContact CD1-CD1 4.08Å
198C94.4Very high96.1Very high3 Ų330.9 Ų30.92%0.0216%0.155CC..THydrogen-bonded Turntrans-64.5-17.9171.9-71.60000113.8L194 Q195 R196 K274 I278 L297L194-C198 PolarHBondContact O-N 2.93Å; L194-C198 PolarHBondContact O-SG 2.93Å; L194-C198 VanDerWaalsContact O-SG 3.34Å; Q195-C198 PolarHBondContact O-N 3.34Å; R196-C198 VanDerWaalsContact C-N 3.31Å; R196-C198 PolarHBondContact O-N 2.79Å; C198-K274 HydrophobicContact CB-CD 4.05Å; C198-K274 HydrophobicContact CB-CG 4.45Å; C198-K274 VanDerWaalsContact O-CE 3.23Å; C198-K274 WeakPolarHBondContact O-CE 3.43Å; C198-I278 VanDerWaalsContact O-CD1 3.26Å; C198-I278 WeakPolarHBondContact O-CD1 3.33Å; C198-L297 HydrophobicContact CB-CD1 3.75Å
199M90.7Very high96.1Very high66 Ų6629.6 Ų29.633%0.32515%0.148SC..THydrogen-bonded Turntrans-966.9175.5-62.1-61-63.700112.7Q195 R196 L197 E201 L301Q195-M199 WeakPolarHBondContact O-CG 3.2Å; Q195-M199 PolarHBondContact O-N 3.14Å; R196-M199 WeakPolarHBondContact O-CA 3.45Å; R196-M199 WeakPolarHBondContact O-CB 3.44Å; R196-M199 PolarHBondContact O-N 2.74Å; L197-M199 PolarHBondContact O-N 2.98Å; M199-E201 HydrophobicContact CB-CG 3.92Å; M199-E201 PolarHBondContact O-N 3.42Å; M199-L301 HydrophobicContact CE-CD1 4.26Å; M199-L301 HydrophobicContact SD-CD1 4.07Å
200D92.6Very high96.1Very high91 Ų9132.8 Ų32.849%0.48717%0.165SC..THydrogen-bonded Turntrans60.127.9-172.6-16028.9000113.6R196 L197 K202 I278R196-D200 PolarHBondContact O-N 3.44Å; L197-D200 PolarHBondContact O-N 3.19Å; L197-D200 VanDerWaalsContact O-N 3.1Å; D200-K202 PolarHBondContact O-N 3.15Å; D200-K202 WeakPolarHBondContact OD1-CE 3.08Å; D200-K202 IonicContact OD1-NZ 2.67Å; D200-I278 HydrophobicContact CB-CG2 3.78Å; D200-I278 WeakPolarHBondContact OD1-CG2 3.41Å
201E93.9Very high96Very high26 Ų2633.4 Ų33.412%0.12117%0.169CC..  trans-99.565-179.1-61.1177.5169.500110.8Q163 R196 M199 V204 A205Q163-E201 WeakPolarHBondContact CG-OE1 3.19Å; Q163-E201 PolarHBondContact NE2-OE1 3.02Å; R196-E201 WeakPolarHBondContact CD-OE2 3.34Å; R196-E201 IonicContact CZ-OE2 2.75Å; R196-E201 IonicContact NE-OE2 3.54Å; R196-E201 IonicContact NH1-OE2 3.13Å; R196-E201 PolarHBondContact NH1-OE2 3.09Å; R196-E201 PolarHBondContact O-N 3.25Å; R196-E201 VanDerWaalsContact O-N 3.13Å; M199-E201 HydrophobicContact CB-CG 3.92Å; M199-E201 PolarHBondContact O-N 3.42Å; E201-V204 HydrophobicContact CB-CB 3.96Å; E201-V204 HydrophobicContact CB-CG2 4Å; E201-V204 PolarHBondContact O-N 3.46Å; E201-A205 WeakPolarHBondContact O-CB 3.39Å; E201-A205 PolarHBondContact O-N 3.13Å
202K95.7Very high95.9Very high69 Ų6930 Ų3030%0.315%0.153SC..Hα-helixtrans-62.7-48.1-172.4-55.9173.5-152.1-165.20112.8L197 D200 V204 A205 I206 I243 N279L197-K202 HydrophobicContact CD2-CG 4.39Å; D200-K202 PolarHBondContact O-N 3.15Å; D200-K202 WeakPolarHBondContact OD1-CE 3.08Å; D200-K202 IonicContact OD1-NZ 2.67Å; K202-V204 VanDerWaalsContact C-N 3.33Å; K202-V204 PolarHBondContact O-N 3.14Å; K202-A205 WeakPolarHBondContact O-CB 3.21Å; K202-A205 PolarHBondContact O-N 3.17Å; K202-I206 WeakPolarHBondContact O-CG1 3.31Å; K202-I206 PolarHBondContact O-N 3.03Å; K202-I243 HydrophobicContact CD-CG2 3.8Å; K202-I243 HydrophobicContact CG-CG2 4.13Å; K202-N279 WeakPolarHBondContact CE-OD1 3.34Å; K202-N279 PolarHBondContact NZ-OD1 2.88Å
203D96.6Very high95.8Very high121 Ų12130 Ų3065%0.64715%0.153SC*.Hα-helixtrans-62.6-43.8-179.2-59.1-38.9000110.6A205 I206 E207D203-A205 VanDerWaalsContact C-N 3.31Å; D203-A205 PolarHBondContact O-N 3Å; D203-I206 PolarHBondContact O-N 2.88Å; D203-E207 WeakPolarHBondContact O-CG 3.34Å; D203-E207 PolarHBondContact O-N 2.79Å
204V97.2Very high95.6Very high21 Ų2135.5 Ų35.513%0.12718%0.182CC..Hα-helixtrans-60.4-41.5175.6-176.40000111.2Q163 R196 E201 K202 L208Q163-V204 HydrophobicContact CB-CG2 4.44Å; Q163-V204 WeakPolarHBondContact O-CG2 3.45Å; R196-V204 HydrophobicContact CG-CG1 4.29Å; E201-V204 HydrophobicContact CB-CB 3.96Å; E201-V204 HydrophobicContact CB-CG2 4Å; E201-V204 PolarHBondContact O-N 3.46Å; K202-V204 VanDerWaalsContact C-N 3.33Å; K202-V204 PolarHBondContact O-N 3.14Å; V204-L208 WeakPolarHBondContact O-CB 3.37Å; V204-L208 PolarHBondContact O-N 2.64Å
205A97.9Very high95.4Very high0 Ų038.5 Ų38.50%020%0.195CC..Hα-helixtrans-63.9-39.8178.800000112.4V193 R196 L197 E201 K202 D203 F209 L240V193-A205 HydrophobicContact CG1-CB 4.26Å; R196-A205 HydrophobicContact CB-CB 3.67Å; L197-A205 HydrophobicContact CD2-CB 3.75Å; L197-A205 HydrophobicContact CG-CB 3.9Å; E201-A205 WeakPolarHBondContact O-CB 3.39Å; E201-A205 PolarHBondContact O-N 3.13Å; K202-A205 WeakPolarHBondContact O-CB 3.21Å; K202-A205 PolarHBondContact O-N 3.17Å; D203-A205 VanDerWaalsContact C-N 3.31Å; D203-A205 PolarHBondContact O-N 3Å; A205-F209 WeakPolarHBondContact O-CB 3.43Å; A205-F209 PolarHBondContact O-N 3.29Å; A205-F209 VanDerWaalsContact O-N 3.07Å; A205-L240 HydrophobicContact CB-CD2 4.11Å
206I97.1Very high95.3Very high42 Ų4238.2 Ų38.222%0.21519%0.194CC..Hα-helixtrans-66.4-53.9176.7-65.1164000110.1K202 D203 L208 F209 D210 L240 V244K202-I206 WeakPolarHBondContact O-CG1 3.31Å; K202-I206 PolarHBondContact O-N 3.03Å; D203-I206 PolarHBondContact O-N 2.88Å; I206-L208 PolarHBondContact O-N 3.43Å; I206-F209 PolarHBondContact O-N 2.8Å; I206-F209 VanDerWaalsContact O-N 3.11Å; I206-D210 PolarHBondContact O-N 3.12Å; I206-L240 HydrophobicContact CG1-CB 4.39Å; I206-L240 HydrophobicContact CG1-CD1 4.44Å; I206-L240 HydrophobicContact CG1-CD2 3.97Å; I206-V244 HydrophobicContact CD1-CG2 3.48Å; I206-V244 VanDerWaalsContact CD1-CG2 3.48Å
207E97.3Very high94.9Very high93 Ų9341.6 Ų41.644%0.43522%0.217SC..Hα-helixtrans-59.5-36.9-179.8-69.2176.5162.700112.4P166 D203 S211P166-E207 WeakPolarHBondContact CD-OE2 3.26Å; P166-E207 HydrophobicContact CG-CB 4.02Å; D203-E207 WeakPolarHBondContact O-CG 3.34Å; D203-E207 PolarHBondContact O-N 2.79Å; E207-S211 WeakPolarHBondContact O-CB 3.24Å; E207-S211 PolarHBondContact O-N 3.4Å
208L97.7Very high94.4Very high0 Ų048 Ų480%025%0.245CC..Hα-helixtrans-63.5-47.7174.8-179.3154.1000111.9G165 Y168 I189 A192 V193 R196 V204 I206 Y212G165-L208 WeakPolarHBondContact O-CA 3.39Å; Y168-L208 HydrophobicContact CD1-CD1 3.14Å; Y168-L208 HydrophobicContact CD1-CG 4.34Å; Y168-L208 HydrophobicContact CE1-CD1 3.49Å; Y168-L208 VanDerWaalsContact CE1-CD1 3.49Å; Y168-L208 HydrophobicContact CG-CD1 3.87Å; I189-L208 HydrophobicContact CD1-CD2 3.26Å; A192-L208 HydrophobicContact CB-CD1 4.35Å; A192-L208 HydrophobicContact CB-CD2 4.01Å; V193-L208 HydrophobicContact CG2-CD2 3.6Å; R196-L208 HydrophobicContact CG-CD1 4.06Å; V204-L208 WeakPolarHBondContact O-CB 3.37Å; V204-L208 PolarHBondContact O-N 2.64Å; I206-L208 PolarHBondContact O-N 3.43Å; L208-Y212 VanDerWaalsContact O-CB 3.32Å; L208-Y212 WeakPolarHBondContact O-CB 3.29Å; L208-Y212 PolarHBondContact O-N 3.17Å
209F96.8Very high94Very high1 Ų148.9 Ų48.90%0.00425%0.249CC..Hα-helixtrans-61.9-49.1178.9-178.3-101.9000110.9I189 V193 A205 I206 S211 Y212 M213 L228 L233 I236 H237 L240I189-F209 HydrophobicContact CG1-CD2 3.88Å; I189-F209 HydrophobicContact CG1-CE2 4.42Å; V193-F209 HydrophobicContact CG2-CB 3.88Å; V193-F209 HydrophobicContact CG2-CD2 4.11Å; V193-F209 HydrophobicContact CG2-CG 4.47Å; A205-F209 WeakPolarHBondContact O-CB 3.43Å; A205-F209 PolarHBondContact O-N 3.29Å; A205-F209 VanDerWaalsContact O-N 3.07Å; I206-F209 PolarHBondContact O-N 2.8Å; I206-F209 VanDerWaalsContact O-N 3.11Å; F209-S211 PolarHBondContact O-N 2.88Å; F209-Y212 PolarHBondContact O-N 3.1Å; F209-M213 HydrophobicContact CD1-CG 4.35Å; F209-M213 HydrophobicContact CD2-CG 4.43Å; F209-M213 HydrophobicContact CE1-CG 4Å; F209-M213 HydrophobicContact CE2-CG 4.09Å; F209-M213 HydrophobicContact CE2-SD 4.37Å; F209-M213 HydrophobicContact CZ-CG 3.87Å; F209-M213 HydrophobicContact CZ-SD 4.31Å; F209-M213 WeakPolarHBondContact O-CB 3.48Å; F209-M213 VanDerWaalsContact O-CG 3.29Å; F209-M213 WeakPolarHBondContact O-CG 3.32Å; F209-M213 PolarHBondContact O-N 3.49Å; F209-L228 HydrophobicContact CE1-CD1 4.31Å; F209-L228 HydrophobicContact CZ-CD1 3.83Å; F209-L233 HydrophobicContact CE2-CD2 4.17Å; F209-I236 HydrophobicContact CD2-CB 4.46Å; F209-I236 HydrophobicContact CD2-CG2 3.53Å; F209-I236 HydrophobicContact CE2-CB 4.03Å; F209-I236 HydrophobicContact CE2-CG2 3.58Å; F209-I236 HydrophobicContact CG-CG2 4.25Å; F209-I236 HydrophobicContact CZ-CG2 4.34Å; F209-H237 HydrophobicContact CE1-CB 4.05Å; F209-H237 AromaticContact CE1-ND1 3.99Å; F209-H237 HydrophobicContact CZ-CB 4.12Å; F209-L240 HydrophobicContact CB-CD1 3.82Å; F209-L240 HydrophobicContact CD1-CD1 4.05Å; F209-L240 HydrophobicContact CG-CD1 3.91Å
210D95.1Very high93.1Very high67 Ų6748.5 Ų48.536%0.35826%0.256SS..Hα-helixtrans-61.5-44.7-179.5-70.5-20.3000111.6I206 M213 L214 N224I206-D210 PolarHBondContact O-N 3.12Å; D210-M213 PolarHBondContact O-N 3.47Å; D210-L214 WeakPolarHBondContact O-CB 3.21Å; D210-L214 PolarHBondContact O-N 2.92Å; D210-N224 PolarHBondContact O-ND2 3.21Å
211S95.9Very high91.7Very high13 Ų1346.2 Ų46.29%0.09125%0.247CC..Hα-helixtrans-66.6-41.3178.2-174.80000112.6P166 E170 E207 F209 L214 H215P166-S211 WeakPolarHBondContact O-CB 3.39Å; P166-S211 PolarHBondContact O-OG 3.43Å; E170-S211 PolarHBondContact N-OG 3.29Å; E207-S211 WeakPolarHBondContact O-CB 3.24Å; E207-S211 PolarHBondContact O-N 3.4Å; F209-S211 PolarHBondContact O-N 2.88Å; S211-L214 PolarHBondContact O-N 3.26Å; S211-H215 PolarHBondContact O-N 2.96Å; S211-H215 VanDerWaalsContact O-N 3.08Å; S211-H215 PolarHBondContact O-ND1 3.34Å; S211-H215 PolarHBondContact OG-ND1 3.44Å
212Y96Very high90Very high0 Ų052.1 Ų52.10%029%0.285CS..Hα-helixtrans-61.7-47.3176.4-178.8-89.3000111.4G169 L172 A173 Q176 A185 I189 L208 F209 L214 H215 H216 L219G169-Y212 WeakPolarHBondContact O-CA 3.35Å; L172-Y212 HydrophobicContact CB-CD2 4.05Å; L172-Y212 HydrophobicContact CB-CE2 4.28Å; L172-Y212 HydrophobicContact CD2-CD2 4.12Å; L172-Y212 HydrophobicContact CD2-CE2 4.22Å; L172-Y212 HydrophobicContact CG-CD2 4Å; L172-Y212 HydrophobicContact CG-CE2 3.86Å; A173-Y212 HydrophobicContact CB-CD2 3.64Å; A173-Y212 HydrophobicContact CB-CE2 3.93Å; A173-Y212 HydrophobicContact CB-CG 4.15Å; Q176-Y212 HydrophobicContact CB-CE2 4.49Å; A185-Y212 PolarHBondContact O-OH 3.24Å; I189-Y212 HydrophobicContact CB-CD1 3.59Å; I189-Y212 HydrophobicContact CB-CD2 4.3Å; I189-Y212 HydrophobicContact CB-CE1 3.51Å; I189-Y212 HydrophobicContact CB-CE2 4.25Å; I189-Y212 HydrophobicContact CB-CG 3.98Å; I189-Y212 HydrophobicContact CD1-CD1 3.82Å; I189-Y212 HydrophobicContact CD1-CD2 3.85Å; I189-Y212 HydrophobicContact CD1-CG 3.42Å; I189-Y212 VanDerWaalsContact CD1-CG 3.42Å; I189-Y212 HydrophobicContact CG1-CD1 3.51Å; I189-Y212 HydrophobicContact CG1-CD2 4.36Å; I189-Y212 HydrophobicContact CG1-CE1 4.01Å; I189-Y212 HydrophobicContact CG1-CG 3.7Å; I189-Y212 HydrophobicContact CG2-CD1 4.03Å; I189-Y212 HydrophobicContact CG2-CE1 3.71Å; L208-Y212 VanDerWaalsContact O-CB 3.32Å; L208-Y212 WeakPolarHBondContact O-CB 3.29Å; L208-Y212 PolarHBondContact O-N 3.17Å; F209-Y212 PolarHBondContact O-N 3.1Å; Y212-L214 VanDerWaalsContact C-N 3.29Å; Y212-L214 PolarHBondContact O-N 3.08Å; Y212-H215 PolarHBondContact O-N 3.41Å; Y212-H216 HydrophobicContact CD1-CB 4.41Å; Y212-H216 HydrophobicContact CE1-CB 4.19Å; Y212-H216 AromaticContact CE1-CD2 3.96Å; Y212-H216 AromaticContact CZ-CD2 3.57Å; Y212-H216 VanDerWaalsContact O-CB 3.29Å; Y212-H216 WeakPolarHBondContact O-CB 3.41Å; Y212-H216 PolarHBondContact O-N 3.47Å; Y212-H216 PolarHBondContact OH-CD2 2.98Å; Y212-L219 HydrophobicContact CE1-CD1 3.87Å
213M94.6Very high88.5Confident1 Ų155.6 Ų55.61%0.00530%0.303CS..Hα-helixtrans-63.3-37.1179.1-69.5-59.6-59.600111.6F209 D210 L219 A220 N224 L228 L233F209-M213 HydrophobicContact CD1-CG 4.35Å; F209-M213 HydrophobicContact CD2-CG 4.43Å; F209-M213 HydrophobicContact CE1-CG 4Å; F209-M213 HydrophobicContact CE2-CG 4.09Å; F209-M213 HydrophobicContact CE2-SD 4.37Å; F209-M213 HydrophobicContact CZ-CG 3.87Å; F209-M213 HydrophobicContact CZ-SD 4.31Å; F209-M213 WeakPolarHBondContact O-CB 3.48Å; F209-M213 VanDerWaalsContact O-CG 3.29Å; F209-M213 WeakPolarHBondContact O-CG 3.32Å; F209-M213 PolarHBondContact O-N 3.49Å; D210-M213 PolarHBondContact O-N 3.47Å; M213-L219 HydrophobicContact CE-CB 4.05Å; M213-L219 VanDerWaalsContact CE-O 3.31Å; M213-L219 WeakPolarHBondContact CE-O 3.44Å; M213-L219 HydrophobicContact SD-CB 4.3Å; M213-A220 WeakPolarHBondContact O-CA 3.31Å; M213-N224 VanDerWaalsContact CB-OD1 3.24Å; M213-N224 WeakPolarHBondContact CB-OD1 3.31Å; M213-L228 HydrophobicContact CE-CD2 4.28Å; M213-L233 HydrophobicContact CE-CD1 4.21Å; M213-L233 HydrophobicContact SD-CD1 4.21Å; M213-L233 HydrophobicContact SD-CD2 3.97Å
214L93.2Very high86.9Confident116 Ų11651.1 Ų51.161%0.60728%0.278SS*.Hα-helixtrans-64.8-38.9176.218062.7000113D210 S211 Y212D210-L214 WeakPolarHBondContact O-CB 3.21Å; D210-L214 PolarHBondContact O-N 2.92Å; S211-L214 PolarHBondContact O-N 3.26Å; Y212-L214 VanDerWaalsContact C-N 3.29Å; Y212-L214 PolarHBondContact O-N 3.08Å
215H94.1Very high85.6Confident64 Ų6456 Ų5630%0.29630%0.3SS..Hα-helixtrans-97.3-17.1-171.3-66.292.4000114.6A173 S211 Y212 P217A173-H215 HydrophobicContact CB-CB 3.92Å; S211-H215 PolarHBondContact O-N 2.96Å; S211-H215 VanDerWaalsContact O-N 3.08Å; S211-H215 PolarHBondContact O-ND1 3.34Å; S211-H215 PolarHBondContact OG-ND1 3.44Å; Y212-H215 PolarHBondContact O-N 3.41Å; H215-P217 WeakPolarHBondContact O-CD 3.34Å
216H93Very high84.5Confident1 Ų158.6 Ų58.61%0.00532%0.317CS..  trans-76.4116.4-176.3-170.7-71.2000111.6A173 Y212 K218 L219 A220A173-H216 HydrophobicContact CB-CB 3.88Å; Y212-H216 HydrophobicContact CD1-CB 4.41Å; Y212-H216 HydrophobicContact CE1-CB 4.19Å; Y212-H216 AromaticContact CE1-CD2 3.96Å; Y212-H216 AromaticContact CZ-CD2 3.57Å; Y212-H216 VanDerWaalsContact O-CB 3.29Å; Y212-H216 WeakPolarHBondContact O-CB 3.41Å; Y212-H216 PolarHBondContact O-N 3.47Å; Y212-H216 PolarHBondContact OH-CD2 2.98Å; H216-K218 VanDerWaalsContact C-N 3.26Å; H216-K218 PolarHBondContact ND1-N 2.93Å; H216-K218 PolarHBondContact O-N 3.33Å; H216-L219 HydrophobicContact CB-CB 4.11Å; H216-L219 WeakPolarHBondContact ND1-CG 3.41Å; H216-L219 PolarHBondContact ND1-N 2.96Å; H216-L219 PolarHBondContact O-N 3.45Å; H216-A220 WeakPolarHBondContact O-CB 3.3Å; H216-A220 PolarHBondContact O-N 3.18Å
217P88Confident83.8Confident78 Ų7862.4 Ų62.451%0.50634%0.344SS..THydrogen-bonded Turntrans-57.4-32-167.8-28.636.9000115.5D177 H215D177-P217 HydrophobicContact CB-CG 4.19Å; H215-P217 WeakPolarHBondContact O-CD 3.34Å
218K85.6Confident83.3Confident135 Ų13558.5 Ų58.559%0.58733%0.326SS*.THydrogen-bonded Turntrans-95.1-15.3-178.6-60.6177.1-177.4167.10114.9H216H216-K218 VanDerWaalsContact C-N 3.26Å; H216-K218 PolarHBondContact ND1-N 2.93Å; H216-K218 PolarHBondContact O-N 3.33Å
219L84.6Confident82.9Confident21 Ų2162.3 Ų62.311%0.1135%0.353CS..THydrogen-bonded Turntrans-111.5-13.9-175-61177.5000112.1A185 Y212 M213 H216 S221 S229 L233A185-L219 HydrophobicContact CB-CD1 4.01Å; Y212-L219 HydrophobicContact CE1-CD1 3.87Å; M213-L219 HydrophobicContact CE-CB 4.05Å; M213-L219 VanDerWaalsContact CE-O 3.31Å; M213-L219 WeakPolarHBondContact CE-O 3.44Å; M213-L219 HydrophobicContact SD-CB 4.3Å; H216-L219 HydrophobicContact CB-CB 4.11Å; H216-L219 WeakPolarHBondContact ND1-CG 3.41Å; H216-L219 PolarHBondContact ND1-N 2.96Å; H216-L219 PolarHBondContact O-N 3.45Å; L219-S221 PolarHBondContact O-N 2.73Å; L219-S229 VanDerWaalsContact CD2-OG 3.24Å; L219-S229 WeakPolarHBondContact CD2-OG 3.08Å; L219-L233 HydrophobicContact CD1-CD1 4.2Å; L219-L233 HydrophobicContact CD2-CD1 3.96Å
220A72.1Confident82.7Confident58 Ų5863.7 Ų63.748%0.47936%0.362SS..  trans-50.3106.5173.800000110.5M213 H216M213-A220 WeakPolarHBondContact O-CA 3.31Å; H216-A220 WeakPolarHBondContact O-CB 3.3Å; H216-A220 PolarHBondContact O-N 3.18Å
221S63.5Low82.7Confident43 Ų4364 Ų6430%0.30137%0.367SS..  trans-105.3136.8168.769.10000106.8L219 E223 N224L219-S221 PolarHBondContact O-N 2.73Å; S221-E223 PolarHBondContact O-N 3.47Å; S221-N224 PolarHBondContact O-N 2.78Å; S221-N224 VanDerWaalsContact OG-CA 3.31Å; S221-N224 WeakPolarHBondContact OG-CA 3.22Å; S221-N224 PolarHBondContact OG-N 3.05Å; S221-N224 VanDerWaalsContact OG-N 3.15Å; S221-N224 PolarHBondContact OG-OD1 3.22Å
222V58.9Low82.7Confident151 Ų15163.4 Ų63.492%0.91536%0.363SS*.THydrogen-bonded Turntrans-57.9-21.6-171.6177.90000112.4
223E62.4Low82.7Confident142 Ų14263.4 Ų63.466%0.66436%0.363SS*.THydrogen-bonded Turntrans-128.3-2.4-173-61.7-176.6160.700114.7S221 E225S221-E223 PolarHBondContact O-N 3.47Å; E223-E225 HydrophobicContact CB-CB 4.24Å; E223-E225 HydrophobicContact CB-CG 4.04Å; E223-E225 WeakPolarHBondContact O-CG 3.48Å; E223-E225 PolarHBondContact O-N 2.96Å
224N64.7Low82.7Confident26 Ų2664.3 Ų64.314%0.13937%0.368CS..  trans46.826.1-171.2-73.9-13000113.4D210 M213 S221 H237D210-N224 PolarHBondContact O-ND2 3.21Å; M213-N224 VanDerWaalsContact CB-OD1 3.24Å; M213-N224 WeakPolarHBondContact CB-OD1 3.31Å; S221-N224 PolarHBondContact O-N 2.78Å; S221-N224 VanDerWaalsContact OG-CA 3.31Å; S221-N224 WeakPolarHBondContact OG-CA 3.22Å; S221-N224 PolarHBondContact OG-N 3.05Å; S221-N224 VanDerWaalsContact OG-N 3.15Å; S221-N224 PolarHBondContact OG-OD1 3.22Å; N224-H237 PolarHBondContact O-CE1 3.25Å
225E70.1Confident82.9Confident124 Ų12458.8 Ų58.858%0.57934%0.339SS*.PPolyproline II helixtrans-96.4135.6179.4-71.8-162.3172.500110E223E223-E225 HydrophobicContact CB-CB 4.24Å; E223-E225 HydrophobicContact CB-CG 4.04Å; E223-E225 WeakPolarHBondContact O-CG 3.48Å; E223-E225 PolarHBondContact O-N 2.96Å
226P73.4Confident83.1Confident55 Ų5555.7 Ų55.736%0.35733%0.325SS..SBendtrans-57.7149.3172.9-25.634.6000112.6H237P226-H237 WeakPolarHBondContact CD-NE2 3.46Å; P226-H237 WeakPolarHBondContact CG-CD2 3.38Å; P226-H237 WeakPolarHBondContact CG-NE2 3.44Å
227P82.2Confident83.2Confident121 Ų12156.5 Ų56.579%0.78633%0.328SS*.SBendcis-81.51244.231-32.7000112.4
228L87.7Confident83.5Confident11 Ų1155.1 Ų55.16%0.05832%0.316CS..PPolyproline II helixtrans-73.4163.2170.7-57.8179.4000110.3F209 M213 T230 L233 N234 H237F209-L228 HydrophobicContact CE1-CD1 4.31Å; F209-L228 HydrophobicContact CZ-CD1 3.83Å; M213-L228 HydrophobicContact CE-CD2 4.28Å; L228-T230 VanDerWaalsContact C-N 3.29Å; L228-T230 PolarHBondContact O-N 3.42Å; L228-L233 HydrophobicContact CB-CB 3.84Å; L228-L233 HydrophobicContact CD1-CB 3.92Å; L228-N234 PolarHBondContact N-OD1 3.3Å; L228-N234 PolarHBondContact O-ND2 3.13Å; L228-H237 HydrophobicContact CD1-CB 3.86Å
229S88.2Confident84.1Confident81 Ų8148.7 Ų48.757%0.56629%0.289SS*.SBendtrans-62.4-26.8-168.457.40000115.3L219 L233L219-S229 VanDerWaalsContact CD2-OG 3.24Å; L219-S229 WeakPolarHBondContact CD2-OG 3.08Å; S229-L233 WeakPolarHBondContact OG-CD1 3.41Å
230T93Very high84.7Confident30 Ų3048.3 Ų48.318%0.18429%0.286CS..SBendtrans-126.8151.6176.883.70000111.9D186 L228 L232 L233 N234D186-T230 HydrophobicContact CB-CG2 4.26Å; D186-T230 VanDerWaalsContact OD2-CB 3.31Å; D186-T230 WeakPolarHBondContact OD2-CB 3.42Å; D186-T230 WeakPolarHBondContact OD2-CG2 3.47Å; D186-T230 PolarHBondContact OD2-OG1 3.07Å; L228-T230 VanDerWaalsContact C-N 3.29Å; L228-T230 PolarHBondContact O-N 3.42Å; T230-L232 PolarHBondContact O-N 2.92Å; T230-L232 PolarHBondContact OG1-N 2.92Å; T230-L233 HydrophobicContact CG2-CD1 4.35Å; T230-L233 PolarHBondContact O-N 3.43Å; T230-L233 WeakPolarHBondContact OG1-CG 3.24Å; T230-L233 PolarHBondContact OG1-N 3.4Å; T230-N234 PolarHBondContact O-N 2.96Å; T230-N234 VanDerWaalsContact O-N 3.13Å; T230-N234 PolarHBondContact O-ND2 3.45Å
231P95.2Very high85.7Confident73 Ų7351.5 Ų51.547%0.47429%0.286SS..Hα-helixtrans-57.6-34.4173.7-25.234.9000112.7N234 F235 Y258 S261P231-N234 PolarHBondContact O-N 3.13Å; P231-F235 WeakPolarHBondContact O-CB 3.18Å; P231-F235 PolarHBondContact O-N 2.99Å; P231-Y258 HydrophobicContact CB-CD1 4.03Å; P231-Y258 HydrophobicContact CB-CE1 3.98Å; P231-Y258 WeakPolarHBondContact O-CD1 3.35Å; P231-Y258 WeakPolarHBondContact O-CE1 3.37Å; P231-S261 WeakPolarHBondContact CB-OG 3.42Å
232L96.4Very high87.2Confident1 Ų149.5 Ų49.51%0.00527%0.272CS..Hα-helixtrans-65.6-40.3177.7-175.460000112.1D186 L187 A190 T230 F235 I236 F268D186-L232 HydrophobicContact CB-CD2 4.35Å; L187-L232 HydrophobicContact CD2-CD2 3.67Å; L187-L232 HydrophobicContact CG-CD2 4.2Å; A190-L232 HydrophobicContact CB-CD1 4.22Å; A190-L232 HydrophobicContact CB-CD2 3.87Å; A190-L232 HydrophobicContact CB-CG 4.02Å; T230-L232 PolarHBondContact O-N 2.92Å; T230-L232 PolarHBondContact OG1-N 2.92Å; L232-F235 HydrophobicContact CD1-CD1 4.12Å; L232-F235 WeakPolarHBondContact O-CB 3.43Å; L232-F235 PolarHBondContact O-N 3.38Å; L232-I236 WeakPolarHBondContact O-CG1 3.46Å; L232-I236 PolarHBondContact O-N 3.45Å; L232-F268 HydrophobicContact CD1-CE2 4.41Å; L232-F268 HydrophobicContact CD2-CE2 4.21Å
233L95.7Very high89Confident0 Ų042.6 Ų42.60%023%0.23CC..Hα-helixtrans-65.1-42.3175-67.1174.3000111.6D186 I189 F209 M213 L219 L228 S229 T230 F235 I236 H237D186-L233 HydrophobicContact CB-CD1 4.31Å; D186-L233 HydrophobicContact CB-CD2 3.97Å; D186-L233 HydrophobicContact CB-CG 3.84Å; I189-L233 HydrophobicContact CG2-CD2 3.57Å; F209-L233 HydrophobicContact CE2-CD2 4.17Å; M213-L233 HydrophobicContact CE-CD1 4.21Å; M213-L233 HydrophobicContact SD-CD1 4.21Å; M213-L233 HydrophobicContact SD-CD2 3.97Å; L219-L233 HydrophobicContact CD1-CD1 4.2Å; L219-L233 HydrophobicContact CD2-CD1 3.96Å; L228-L233 HydrophobicContact CB-CB 3.84Å; L228-L233 HydrophobicContact CD1-CB 3.92Å; S229-L233 WeakPolarHBondContact OG-CD1 3.41Å; T230-L233 HydrophobicContact CG2-CD1 4.35Å; T230-L233 PolarHBondContact O-N 3.43Å; T230-L233 WeakPolarHBondContact OG1-CG 3.24Å; T230-L233 PolarHBondContact OG1-N 3.4Å; L233-F235 VanDerWaalsContact C-N 3.29Å; L233-F235 PolarHBondContact O-N 3.49Å; L233-I236 PolarHBondContact O-N 2.83Å; L233-H237 WeakPolarHBondContact O-CB 3.4Å; L233-H237 PolarHBondContact O-N 3.04Å
234N95Very high90.5Very high19 Ų1939.8 Ų39.810%0.10222%0.222CC..Hα-helixtrans-59.7-41.7173.6-72-61.2000111.6L228 T230 P231 H237 L238 Y258L228-N234 PolarHBondContact N-OD1 3.3Å; L228-N234 PolarHBondContact O-ND2 3.13Å; T230-N234 PolarHBondContact O-N 2.96Å; T230-N234 VanDerWaalsContact O-N 3.13Å; T230-N234 PolarHBondContact O-ND2 3.45Å; P231-N234 PolarHBondContact O-N 3.13Å; N234-H237 PolarHBondContact O-N 2.9Å; N234-L238 WeakPolarHBondContact O-CB 3.48Å; N234-L238 VanDerWaalsContact O-CG 3.24Å; N234-L238 WeakPolarHBondContact O-CG 3.43Å; N234-L238 PolarHBondContact O-N 3.24Å; N234-Y258 HydrophobicContact CB-CE1 4.18Å
235F97.3Very high91.9Very high0 Ų044.7 Ų44.70%024%0.244CC..Hα-helixtrans-57.7-52.9173.8169.7-105.5000111.6P231 L232 L233 H237 L238 L239 L254 V255 Y258 I262 L272P231-F235 WeakPolarHBondContact O-CB 3.18Å; P231-F235 PolarHBondContact O-N 2.99Å; L232-F235 HydrophobicContact CD1-CD1 4.12Å; L232-F235 WeakPolarHBondContact O-CB 3.43Å; L232-F235 PolarHBondContact O-N 3.38Å; L233-F235 VanDerWaalsContact C-N 3.29Å; L233-F235 PolarHBondContact O-N 3.49Å; F235-H237 PolarHBondContact O-N 3.2Å; F235-L238 PolarHBondContact O-N 3.41Å; F235-L239 HydrophobicContact CE1-CD2 3.92Å; F235-L239 HydrophobicContact CZ-CB 4.49Å; F235-L239 HydrophobicContact CZ-CD1 4.42Å; F235-L239 HydrophobicContact CZ-CD2 3.99Å; F235-L239 WeakPolarHBondContact O-CB 3.38Å; F235-L239 PolarHBondContact O-N 3Å; F235-L254 HydrophobicContact CD2-CB 4.12Å; F235-L254 HydrophobicContact CE2-CB 4.01Å; F235-V255 HydrophobicContact CE2-CG2 4.34Å; F235-V255 HydrophobicContact CZ-CG2 4.43Å; F235-Y258 HydrophobicContact CB-CD1 3.75Å; F235-Y258 HydrophobicContact CB-CD2 4.08Å; F235-Y258 HydrophobicContact CB-CE1 4.23Å; F235-Y258 HydrophobicContact CB-CG 3.65Å; F235-Y258 AromaticContact CD2-CD2 3.91Å; F235-Y258 HydrophobicContact CD2-CD2 3.91Å; F235-Y258 AromaticContact CD2-CG 3.92Å; F235-Y258 HydrophobicContact CD2-CG 3.92Å; F235-Y258 HydrophobicContact CG-CD2 4.47Å; F235-Y258 HydrophobicContact CG-CG 4.15Å; F235-I262 HydrophobicContact CD1-CD1 4.49Å; F235-I262 HydrophobicContact CD1-CG1 4.2Å; F235-I262 HydrophobicContact CD2-CD1 4.19Å; F235-I262 HydrophobicContact CE1-CD1 4.02Å; F235-I262 HydrophobicContact CE1-CG1 3.94Å; F235-I262 HydrophobicContact CE2-CD1 3.7Å; F235-I262 HydrophobicContact CE2-CG1 4.41Å; F235-I262 HydrophobicContact CZ-CD1 3.59Å; F235-I262 HydrophobicContact CZ-CG1 4.06Å; F235-L272 HydrophobicContact CE1-CD1 4.37Å; F235-L272 HydrophobicContact CE1-CD2 4.3Å; F235-L272 HydrophobicContact CZ-CD1 3.9Å; F235-L272 HydrophobicContact CZ-CD2 3.78Å; F235-L272 HydrophobicContact CZ-CG 4.49Å
236I97.3Very high92.9Very high0 Ų044 Ų440%024%0.244CC..Hα-helixtrans-60.4-44.8-179.1-65.2-63.2000111.3A190 V193 L194 F209 L232 L233 L238 L239 L240A190-I236 HydrophobicContact CB-CD1 3.84Å; A190-I236 HydrophobicContact CB-CG1 3.84Å; V193-I236 HydrophobicContact CB-CG2 4.17Å; V193-I236 HydrophobicContact CG1-CG2 3.8Å; V193-I236 HydrophobicContact CG2-CG2 4.18Å; L194-I236 HydrophobicContact CD2-CD1 4.27Å; L194-I236 HydrophobicContact CG-CD1 4.17Å; F209-I236 HydrophobicContact CD2-CB 4.46Å; F209-I236 HydrophobicContact CD2-CG2 3.53Å; F209-I236 HydrophobicContact CE2-CB 4.03Å; F209-I236 HydrophobicContact CE2-CG2 3.58Å; F209-I236 HydrophobicContact CG-CG2 4.25Å; F209-I236 HydrophobicContact CZ-CG2 4.34Å; L232-I236 WeakPolarHBondContact O-CG1 3.46Å; L232-I236 PolarHBondContact O-N 3.45Å; L233-I236 PolarHBondContact O-N 2.83Å; I236-L238 PolarHBondContact O-N 2.72Å; I236-L239 HydrophobicContact CD1-CD2 4.32Å; I236-L239 WeakPolarHBondContact O-CB 3.4Å; I236-L239 PolarHBondContact O-N 3Å; I236-L240 HydrophobicContact CG2-CD1 4.21Å; I236-L240 WeakPolarHBondContact O-CG 3.23Å; I236-L240 PolarHBondContact O-N 3.07Å
237H95.3Very high93.9Very high17 Ų1748.8 Ų48.88%0.07926%0.255CS..Hα-helixtrans-58.7-47.6177.2-179.590.2000112.4F209 N224 P226 L228 L233 N234 F235 R241F209-H237 HydrophobicContact CE1-CB 4.05Å; F209-H237 AromaticContact CE1-ND1 3.99Å; F209-H237 HydrophobicContact CZ-CB 4.12Å; N224-H237 PolarHBondContact O-CE1 3.25Å; P226-H237 WeakPolarHBondContact CD-NE2 3.46Å; P226-H237 WeakPolarHBondContact CG-CD2 3.38Å; P226-H237 WeakPolarHBondContact CG-NE2 3.44Å; L228-H237 HydrophobicContact CD1-CB 3.86Å; L233-H237 WeakPolarHBondContact O-CB 3.4Å; L233-H237 PolarHBondContact O-N 3.04Å; N234-H237 PolarHBondContact O-N 2.9Å; F235-H237 PolarHBondContact O-N 3.2Å; H237-R241 PolarHBondContact CE1-NH2 3.21Å; H237-R241 PolarHBondContact NE2-NE 3.34Å; H237-R241 PolarHBondContact NE2-NH2 2.91Å; H237-R241 PolarHBondContact O-N 3.29Å
238L95.6Very high94.4Very high50 Ų5045 Ų4526%0.26223%0.228SC..Hα-helixtrans-71.1-34.3179-66.8171.2000112.1N234 F235 I236 R241 A242 L254 Y258N234-L238 WeakPolarHBondContact O-CB 3.48Å; N234-L238 VanDerWaalsContact O-CG 3.24Å; N234-L238 WeakPolarHBondContact O-CG 3.43Å; N234-L238 PolarHBondContact O-N 3.24Å; F235-L238 PolarHBondContact O-N 3.41Å; I236-L238 PolarHBondContact O-N 2.72Å; L238-R241 PolarHBondContact O-N 3.47Å; L238-A242 WeakPolarHBondContact O-CB 3.29Å; L238-A242 PolarHBondContact O-N 3.25Å; L238-L254 HydrophobicContact CB-CD1 3.7Å; L238-L254 HydrophobicContact CB-CD2 3.69Å; L238-L254 HydrophobicContact CB-CG 4.37Å; L238-L254 HydrophobicContact CD1-CD2 3.72Å; L238-L254 HydrophobicContact CG-CD2 4.34Å; L238-Y258 HydrophobicContact CD1-CE2 4.35Å
239L97.2Very high94.6Very high0 Ų051.2 Ų51.20%026%0.261CS..Hα-helixtrans-60.3-48.5175.6174.567.3000110.7L194 L197 F235 I236 R241 A242 I243 F251 L272L194-L239 HydrophobicContact CD2-CD2 3.64Å; L197-L239 HydrophobicContact CD1-CD2 4.22Å; F235-L239 HydrophobicContact CE1-CD2 3.92Å; F235-L239 HydrophobicContact CZ-CB 4.49Å; F235-L239 HydrophobicContact CZ-CD1 4.42Å; F235-L239 HydrophobicContact CZ-CD2 3.99Å; F235-L239 WeakPolarHBondContact O-CB 3.38Å; F235-L239 PolarHBondContact O-N 3Å; I236-L239 HydrophobicContact CD1-CD2 4.32Å; I236-L239 WeakPolarHBondContact O-CB 3.4Å; I236-L239 PolarHBondContact O-N 3Å; L239-R241 VanDerWaalsContact C-N 3.34Å; L239-R241 PolarHBondContact O-N 3.16Å; L239-A242 WeakPolarHBondContact O-CB 3.15Å; L239-A242 PolarHBondContact O-N 3.4Å; L239-A242 VanDerWaalsContact O-N 3.16Å; L239-I243 HydrophobicContact CD1-CD1 4.03Å; L239-I243 HydrophobicContact CD1-CG1 4.45Å; L239-I243 HydrophobicContact CG-CD1 4Å; L239-I243 WeakPolarHBondContact O-CG1 3.1Å; L239-I243 PolarHBondContact O-N 3.28Å; L239-F251 HydrophobicContact CD1-CD2 3.41Å; L239-F251 VanDerWaalsContact CD1-CD2 3.41Å; L239-F251 HydrophobicContact CD1-CE2 3.52Å; L239-L272 HydrophobicContact CD1-CD2 4.22Å; L239-L272 HydrophobicContact CD2-CD2 3.93Å
240L96.8Very high94.9Very high12 Ų1250.9 Ų50.96%0.06325%0.253CS..Hα-helixtrans-57.4-47176.5-70.8170.5000111.1V193 L197 A205 I206 F209 I236 A242 I243 V244V193-L240 HydrophobicContact CG1-CD1 4.37Å; V193-L240 HydrophobicContact CG1-CD2 3.93Å; V193-L240 HydrophobicContact CG1-CG 4.34Å; L197-L240 HydrophobicContact CD1-CD2 4.11Å; L197-L240 HydrophobicContact CD2-CD2 4.12Å; L197-L240 HydrophobicContact CG-CD2 4.48Å; A205-L240 HydrophobicContact CB-CD2 4.11Å; I206-L240 HydrophobicContact CG1-CB 4.39Å; I206-L240 HydrophobicContact CG1-CD1 4.44Å; I206-L240 HydrophobicContact CG1-CD2 3.97Å; F209-L240 HydrophobicContact CB-CD1 3.82Å; F209-L240 HydrophobicContact CD1-CD1 4.05Å; F209-L240 HydrophobicContact CG-CD1 3.91Å; I236-L240 HydrophobicContact CG2-CD1 4.21Å; I236-L240 WeakPolarHBondContact O-CG 3.23Å; I236-L240 PolarHBondContact O-N 3.07Å; L240-A242 PolarHBondContact O-N 2.79Å; L240-I243 PolarHBondContact O-N 3.13Å; L240-V244 VanDerWaalsContact O-CG2 3.32Å; L240-V244 WeakPolarHBondContact O-CG2 3.34Å; L240-V244 PolarHBondContact O-N 2.87Å
241R94.5Very high95.1Very high126 Ų12650 Ų5048%0.47525%0.247SC..Hα-helixtrans-61.2-41.4175.2-66.5-177.1-175.5-139.94.6112.5H237 L238 L239 I243 V244 H245H237-R241 PolarHBondContact CE1-NH2 3.21Å; H237-R241 PolarHBondContact NE2-NE 3.34Å; H237-R241 PolarHBondContact NE2-NH2 2.91Å; H237-R241 PolarHBondContact O-N 3.29Å; L238-R241 PolarHBondContact O-N 3.47Å; L239-R241 VanDerWaalsContact C-N 3.34Å; L239-R241 PolarHBondContact O-N 3.16Å; R241-I243 VanDerWaalsContact C-N 3.3Å; R241-I243 PolarHBondContact O-N 3.14Å; R241-V244 PolarHBondContact O-N 3.38Å; R241-H245 WeakPolarHBondContact O-CB 3.26Å; R241-H245 PolarHBondContact O-CD2 2.65Å; R241-H245 PolarHBondContact O-N 2.85Å
242A95.3Very high95Very high0 Ų050 Ų500%025%0.245CC..Hα-helixtrans-62.5-38.9178.400000112L238 L239 L240 N246 R247 L250 F251 L254L238-A242 WeakPolarHBondContact O-CB 3.29Å; L238-A242 PolarHBondContact O-N 3.25Å; L239-A242 WeakPolarHBondContact O-CB 3.15Å; L239-A242 PolarHBondContact O-N 3.4Å; L239-A242 VanDerWaalsContact O-N 3.16Å; L240-A242 PolarHBondContact O-N 2.79Å; A242-N246 PolarHBondContact O-N 3.32Å; A242-R247 PolarHBondContact O-N 2.96Å; A242-L250 HydrophobicContact CB-CB 4.2Å; A242-L250 HydrophobicContact CB-CD2 3.79Å; A242-L250 HydrophobicContact CB-CG 3.85Å; A242-F251 HydrophobicContact CB-CB 4.47Å; A242-L254 HydrophobicContact CB-CD1 4.11Å
243I95.3Very high95Very high7 Ų752.4 Ų52.44%0.03627%0.265CS..Hα-helixtrans-69.4-49.5177.1-70.8168.8000111L197 K202 L239 L240 R241 H245 N246 I275 N279 F280L197-I243 HydrophobicContact CD1-CD1 3.69Å; L197-I243 HydrophobicContact CD2-CD1 3.97Å; L197-I243 HydrophobicContact CG-CD1 4.38Å; K202-I243 HydrophobicContact CD-CG2 3.8Å; K202-I243 HydrophobicContact CG-CG2 4.13Å; L239-I243 HydrophobicContact CD1-CD1 4.03Å; L239-I243 HydrophobicContact CD1-CG1 4.45Å; L239-I243 HydrophobicContact CG-CD1 4Å; L239-I243 WeakPolarHBondContact O-CG1 3.1Å; L239-I243 PolarHBondContact O-N 3.28Å; L240-I243 PolarHBondContact O-N 3.13Å; R241-I243 VanDerWaalsContact C-N 3.3Å; R241-I243 PolarHBondContact O-N 3.14Å; I243-H245 VanDerWaalsContact C-N 3.27Å; I243-H245 PolarHBondContact O-N 3.35Å; I243-N246 PolarHBondContact O-N 2.96Å; I243-I275 HydrophobicContact CD1-CG2 3.65Å; I243-I275 HydrophobicContact CG1-CG2 4.48Å; I243-N279 VanDerWaalsContact CG2-OD1 3.29Å; I243-N279 WeakPolarHBondContact CG2-OD1 3.05Å; I243-F280 HydrophobicContact CG1-CZ 4.39Å
244V94.2Very high95Very high82 Ų8252.9 Ų52.950%0.49727%0.268SS..Hα-helixtrans-56.5-42178.9169.40000111.6I206 L240 R241 N246I206-V244 HydrophobicContact CD1-CG2 3.48Å; I206-V244 VanDerWaalsContact CD1-CG2 3.48Å; L240-V244 VanDerWaalsContact O-CG2 3.32Å; L240-V244 WeakPolarHBondContact O-CG2 3.34Å; L240-V244 PolarHBondContact O-N 2.87Å; R241-V244 PolarHBondContact O-N 3.38Å; V244-N246 VanDerWaalsContact C-N 3.32Å
245H93.8Very high95.1Very high130 Ų13053.8 Ų53.860%0.60227%0.273SS*.THydrogen-bonded Turntrans-89.16.5-179.8-64.3-58.5000114.2R241 I243 R247R241-H245 WeakPolarHBondContact O-CB 3.26Å; R241-H245 PolarHBondContact O-CD2 2.65Å; R241-H245 PolarHBondContact O-N 2.85Å; I243-H245 VanDerWaalsContact C-N 3.27Å; I243-H245 PolarHBondContact O-N 3.35Å; H245-R247 VanDerWaalsContact C-N 3.34Å; H245-R247 HydrophobicContact CB-CG 3.73Å; H245-R247 WeakPolarHBondContact O-CG 3.47Å; H245-R247 PolarHBondContact O-N 3.45Å
246N92.4Very high95Very high108 Ų10861 Ų6158%0.57831%0.307SS*.THydrogen-bonded Turntrans50.248.5-179.2-167.120.2000113.4A242 I243 V244 F280A242-N246 PolarHBondContact O-N 3.32Å; I243-N246 PolarHBondContact O-N 2.96Å; V244-N246 VanDerWaalsContact C-N 3.32Å; N246-F280 WeakPolarHBondContact OD1-CD1 3.41Å; N246-F280 WeakPolarHBondContact OD1-CE1 3.45Å
247R93.7Very high95Very high157 Ų15764.5 Ų64.559%0.59234%0.336SS*.  trans-104.279.1-174.9-58.6-64.5-73.7-170.8-5111.4A242 H245 N249 L250 F251A242-R247 PolarHBondContact O-N 2.96Å; H245-R247 VanDerWaalsContact C-N 3.34Å; H245-R247 HydrophobicContact CB-CG 3.73Å; H245-R247 WeakPolarHBondContact O-CG 3.47Å; H245-R247 PolarHBondContact O-N 3.45Å; R247-N249 VanDerWaalsContact C-N 3.3Å; R247-N249 PolarHBondContact O-N 3.47Å; R247-L250 HydrophobicContact CB-CB 3.79Å; R247-L250 HydrophobicContact CB-CD2 4.47Å; R247-L250 WeakPolarHBondContact O-CB 3.48Å; R247-L250 PolarHBondContact O-N 3.15Å; R247-F251 PolarHBondContact O-N 2.93Å
248L91.9Very high95.1Very high42 Ų4266.2 Ų66.222%0.2234%0.342CS..Hα-helixtrans-52.2-44.4178.9177.458.8000113L250 F251 T252 F280L248-L250 VanDerWaalsContact C-N 3.27Å; L248-L250 PolarHBondContact O-N 3.38Å; L248-F251 HydrophobicContact CD1-CD1 4.39Å; L248-F251 WeakPolarHBondContact O-CB 3.31Å; L248-F251 PolarHBondContact O-N 2.79Å; L248-T252 PolarHBondContact O-N 3.27Å; L248-T252 PolarHBondContact O-OG1 2.93Å; L248-T252 VanDerWaalsContact O-OG1 3.11Å; L248-F280 HydrophobicContact CB-CB 4.45Å; L248-F280 HydrophobicContact CB-CD1 3.83Å; L248-F280 HydrophobicContact CB-CE1 4.27Å; L248-F280 HydrophobicContact CB-CG 4.1Å; L248-F280 HydrophobicContact CD1-CB 3.91Å; L248-F280 HydrophobicContact CD1-CD1 4.35Å; L248-F280 HydrophobicContact CD1-CD2 3.8Å; L248-F280 HydrophobicContact CD1-CE2 4.45Å; L248-F280 HydrophobicContact CD1-CG 3.76Å; L248-F280 HydrophobicContact CD2-CB 4.41Å; L248-F280 HydrophobicContact CG-CB 4.48Å; L248-F280 HydrophobicContact CG-CG 4.43Å
249N93.1Very high95.1Very high141 Ų14168.5 Ų68.575%0.75435%0.35SS*.Hα-helixtrans-61.5-36.7179.3-65.4-9.2000112.6R247 A253R247-N249 VanDerWaalsContact C-N 3.3Å; R247-N249 PolarHBondContact O-N 3.47Å; N249-A253 WeakPolarHBondContact O-CB 3.24Å; N249-A253 PolarHBondContact O-N 2.87Å; N249-A253 VanDerWaalsContact O-N 3.1Å
250L94.5Very high95.1Very high74 Ų7473.5 Ų73.539%0.38738%0.382SS..Hα-helixtrans-70.5-44.8176178.860.2000110.2A242 R247 L248 T252 A253 L254A242-L250 HydrophobicContact CB-CB 4.2Å; A242-L250 HydrophobicContact CB-CD2 3.79Å; A242-L250 HydrophobicContact CB-CG 3.85Å; R247-L250 HydrophobicContact CB-CB 3.79Å; R247-L250 HydrophobicContact CB-CD2 4.47Å; R247-L250 WeakPolarHBondContact O-CB 3.48Å; R247-L250 PolarHBondContact O-N 3.15Å; L248-L250 VanDerWaalsContact C-N 3.27Å; L248-L250 PolarHBondContact O-N 3.38Å; L250-T252 PolarHBondContact O-N 3.27Å; L250-A253 PolarHBondContact O-N 3.43Å; L250-L254 HydrophobicContact CD1-CD1 4.16Å; L250-L254 HydrophobicContact CD1-CD2 4.49Å; L250-L254 HydrophobicContact CD1-CG 4.07Å; L250-L254 HydrophobicContact CG-CD1 3.93Å; L250-L254 HydrophobicContact CG-CG 4.32Å; L250-L254 WeakPolarHBondContact O-CB 3.37Å; L250-L254 WeakPolarHBondContact O-CG 3.45Å; L250-L254 PolarHBondContact O-N 3.34Å
251F95.8Very high95.1Very high12 Ų1273.8 Ų73.85%0.05339%0.385CS..Hα-helixtrans-52.7-52.8174.1173.4-84.9000111.4L239 A242 R247 L248 A253 L254 V255 L272 I275 A276 F280L239-F251 HydrophobicContact CD1-CD2 3.41Å; L239-F251 VanDerWaalsContact CD1-CD2 3.41Å; L239-F251 HydrophobicContact CD1-CE2 3.52Å; A242-F251 HydrophobicContact CB-CB 4.47Å; R247-F251 PolarHBondContact O-N 2.93Å; L248-F251 HydrophobicContact CD1-CD1 4.39Å; L248-F251 WeakPolarHBondContact O-CB 3.31Å; L248-F251 PolarHBondContact O-N 2.79Å; F251-A253 PolarHBondContact O-N 2.93Å; F251-L254 PolarHBondContact O-N 3.11Å; F251-V255 HydrophobicContact CD1-CG2 4.34Å; F251-V255 HydrophobicContact CE1-CG2 3.93Å; F251-V255 HydrophobicContact CE2-CG2 4.48Å; F251-V255 HydrophobicContact CZ-CG2 4.01Å; F251-V255 WeakPolarHBondContact O-CG2 3.35Å; F251-V255 PolarHBondContact O-N 3.2Å; F251-L272 HydrophobicContact CE2-CD2 4.15Å; F251-L272 HydrophobicContact CZ-CB 4.41Å; F251-L272 HydrophobicContact CZ-CD2 4.23Å; F251-I275 HydrophobicContact CE2-CG2 4.14Å; F251-A276 HydrophobicContact CE1-CB 3.73Å; F251-A276 HydrophobicContact CZ-CB 3.79Å; F251-F280 HydrophobicContact CB-CE2 3.8Å; F251-F280 HydrophobicContact CB-CZ 3.86Å; F251-F280 HydrophobicContact CD1-CE2 4.11Å; F251-F280 AromaticContact CD2-CE2 3.62Å; F251-F280 HydrophobicContact CD2-CE2 3.62Å; F251-F280 HydrophobicContact CD2-CZ 4.21Å; F251-F280 HydrophobicContact CE2-CE2 4.22Å; F251-F280 HydrophobicContact CG-CD2 4.41Å; F251-F280 AromaticContact CG-CE2 3.57Å; F251-F280 HydrophobicContact CG-CE2 3.57Å; F251-F280 HydrophobicContact CG-CZ 4.13Å
252T94.4Very high95.2Very high73 Ų7367.8 Ų67.845%0.44836%0.363SS..Hα-helixtrans-61.1-45.2-179.1-54.80000111.8L248 L250 L254 V255 E256L248-T252 PolarHBondContact O-N 3.27Å; L248-T252 PolarHBondContact O-OG1 2.93Å; L248-T252 VanDerWaalsContact O-OG1 3.11Å; L250-T252 PolarHBondContact O-N 3.27Å; T252-L254 VanDerWaalsContact C-N 3.32Å; T252-L254 PolarHBondContact O-N 3.13Å; T252-V255 PolarHBondContact O-N 2.97Å; T252-E256 PolarHBondContact O-N 3.28Å; T252-E256 VanDerWaalsContact O-N 3.11Å
253A95.8Very high95.3Very high50 Ų5071 Ų7141%0.41338%0.38SS..Hα-helixtrans-63.1-3717800000112.5N249 L250 F251 A257N249-A253 WeakPolarHBondContact O-CB 3.24Å; N249-A253 PolarHBondContact O-N 2.87Å; N249-A253 VanDerWaalsContact O-N 3.1Å; L250-A253 PolarHBondContact O-N 3.43Å; F251-A253 PolarHBondContact O-N 2.93Å; A253-A257 WeakPolarHBondContact O-CB 3.4Å; A253-A257 PolarHBondContact O-N 3.5Å
254L96.8Very high95.4Very high11 Ų1175.8 Ų75.86%0.05840%0.398CS..Hα-helixtrans-66.8-44.6176.3-70.9169.6000111.7F235 L238 A242 L250 F251 T252 E256 A257 Y258F235-L254 HydrophobicContact CD2-CB 4.12Å; F235-L254 HydrophobicContact CE2-CB 4.01Å; L238-L254 HydrophobicContact CB-CD1 3.7Å; L238-L254 HydrophobicContact CB-CD2 3.69Å; L238-L254 HydrophobicContact CB-CG 4.37Å; L238-L254 HydrophobicContact CD1-CD2 3.72Å; L238-L254 HydrophobicContact CG-CD2 4.34Å; A242-L254 HydrophobicContact CB-CD1 4.11Å; L250-L254 HydrophobicContact CD1-CD1 4.16Å; L250-L254 HydrophobicContact CD1-CD2 4.49Å; L250-L254 HydrophobicContact CD1-CG 4.07Å; L250-L254 HydrophobicContact CG-CD1 3.93Å; L250-L254 HydrophobicContact CG-CG 4.32Å; L250-L254 WeakPolarHBondContact O-CB 3.37Å; L250-L254 WeakPolarHBondContact O-CG 3.45Å; L250-L254 PolarHBondContact O-N 3.34Å; F251-L254 PolarHBondContact O-N 3.11Å; T252-L254 VanDerWaalsContact C-N 3.32Å; T252-L254 PolarHBondContact O-N 3.13Å; L254-E256 VanDerWaalsContact C-N 3.29Å; L254-E256 PolarHBondContact O-N 2.95Å; L254-A257 PolarHBondContact O-N 3.43Å; L254-Y258 HydrophobicContact CD2-CD2 4.16Å; L254-Y258 HydrophobicContact CD2-CE2 3.81Å; L254-Y258 WeakPolarHBondContact O-CB 3.05Å; L254-Y258 WeakPolarHBondContact O-CD2 3.2Å; L254-Y258 PolarHBondContact O-N 3.28Å
255V96.4Very high95.4Very high37 Ų3773.9 Ų73.922%0.22439%0.385CS..Hα-helixtrans-60.4-40.7178173.60000111.1F235 F251 T252 K259 I262 L272F235-V255 HydrophobicContact CE2-CG2 4.34Å; F235-V255 HydrophobicContact CZ-CG2 4.43Å; F251-V255 HydrophobicContact CD1-CG2 4.34Å; F251-V255 HydrophobicContact CE1-CG2 3.93Å; F251-V255 HydrophobicContact CE2-CG2 4.48Å; F251-V255 HydrophobicContact CZ-CG2 4.01Å; F251-V255 WeakPolarHBondContact O-CG2 3.35Å; F251-V255 PolarHBondContact O-N 3.2Å; T252-V255 PolarHBondContact O-N 2.97Å; V255-K259 PolarHBondContact O-N 3.3Å; V255-I262 HydrophobicContact CG1-CD1 4.45Å; V255-L272 HydrophobicContact CG1-CD1 4.5Å; V255-L272 HydrophobicContact CG2-CD1 4.18Å; V255-L272 HydrophobicContact CG2-CD2 4.35Å
256E95.8Very high95.3Very high152 Ų15272 Ų7271%0.7138%0.384SS*.Hα-helixtrans-68.6-49.4176.3-173.1176.1-175.700112.1T252 L254 Y258 K259T252-E256 PolarHBondContact O-N 3.28Å; T252-E256 VanDerWaalsContact O-N 3.11Å; L254-E256 VanDerWaalsContact C-N 3.29Å; L254-E256 PolarHBondContact O-N 2.95Å; E256-Y258 PolarHBondContact O-N 2.98Å; E256-K259 WeakPolarHBondContact O-CB 3.49Å; E256-K259 PolarHBondContact O-N 2.97Å
257A96.7Very high95.3Very high74 Ų7468.5 Ų68.561%0.61237%0.365SS*.Hα-helixtrans-65.9-34.9-175.300000113.4A253 L254A253-A257 WeakPolarHBondContact O-CB 3.4Å; A253-A257 PolarHBondContact O-N 3.5Å; L254-A257 PolarHBondContact O-N 3.43Å
258Y97.1Very high95.4Very high52 Ų5261.1 Ų61.120%0.20434%0.337CS..THydrogen-bonded Turntrans-99.712-177.4-71.8-89000113.7P231 N234 F235 L238 L254 E256 P260 S261 I262P231-Y258 HydrophobicContact CB-CD1 4.03Å; P231-Y258 HydrophobicContact CB-CE1 3.98Å; P231-Y258 WeakPolarHBondContact O-CD1 3.35Å; P231-Y258 WeakPolarHBondContact O-CE1 3.37Å; N234-Y258 HydrophobicContact CB-CE1 4.18Å; F235-Y258 HydrophobicContact CB-CD1 3.75Å; F235-Y258 HydrophobicContact CB-CD2 4.08Å; F235-Y258 HydrophobicContact CB-CE1 4.23Å; F235-Y258 HydrophobicContact CB-CG 3.65Å; F235-Y258 AromaticContact CD2-CD2 3.91Å; F235-Y258 HydrophobicContact CD2-CD2 3.91Å; F235-Y258 AromaticContact CD2-CG 3.92Å; F235-Y258 HydrophobicContact CD2-CG 3.92Å; F235-Y258 HydrophobicContact CG-CD2 4.47Å; F235-Y258 HydrophobicContact CG-CG 4.15Å; L238-Y258 HydrophobicContact CD1-CE2 4.35Å; L254-Y258 HydrophobicContact CD2-CD2 4.16Å; L254-Y258 HydrophobicContact CD2-CE2 3.81Å; L254-Y258 WeakPolarHBondContact O-CB 3.05Å; L254-Y258 WeakPolarHBondContact O-CD2 3.2Å; L254-Y258 PolarHBondContact O-N 3.28Å; E256-Y258 PolarHBondContact O-N 2.98Å; Y258-P260 VanDerWaalsContact C-CD 3.44Å; Y258-P260 VanDerWaalsContact C-N 3.34Å; Y258-P260 VanDerWaalsContact O-N 3.16Å; Y258-S261 WeakPolarHBondContact O-CA 3.34Å; Y258-S261 WeakPolarHBondContact O-CB 3.46Å; Y258-S261 PolarHBondContact O-N 3.05Å; Y258-I262 PolarHBondContact O-N 3.45Å
259K96.5Very high95.6Very high99 Ų9961.3 Ų61.343%0.4334%0.339SS..Hα-helixtrans-46.7-45.3-178.4-178165-177.650.60114.6V255 E256 S261 I262 D263V255-K259 PolarHBondContact O-N 3.3Å; E256-K259 WeakPolarHBondContact O-CB 3.49Å; E256-K259 PolarHBondContact O-N 2.97Å; K259-S261 PolarHBondContact O-N 3.23Å; K259-I262 PolarHBondContact O-N 3.19Å; K259-D263 VanDerWaalsContact CE-OD2 3.29Å; K259-D263 WeakPolarHBondContact CE-OD2 3.41Å; K259-D263 WeakPolarHBondContact CG-OD2 3.42Å; K259-D263 IonicContact NZ-OD1 3.76Å; K259-D263 PolarHBondContact NZ-OD1 3.38Å; K259-D263 VanDerWaalsContact NZ-OD1 3.13Å; K259-D263 IonicContact NZ-OD2 2.65Å; K259-D263 PolarHBondContact NZ-OD2 3.47Å; K259-D263 WeakPolarHBondContact O-CB 3.46Å; K259-D263 PolarHBondContact O-N 2.97Å
260P96.6Very high95.6Very high104 Ų10456.9 Ų56.968%0.67531%0.313SS*.Hα-helixtrans-61.8-27.5177.5-23.634.8000114.5Y258Y258-P260 VanDerWaalsContact C-CD 3.44Å; Y258-P260 VanDerWaalsContact C-N 3.34Å; Y258-P260 VanDerWaalsContact O-N 3.16Å
261S96.6Very high95.6Very high18 Ų1853.3 Ų53.313%0.12630%0.295CS..Hα-helixtrans-83.9-34.4177.8-59.30000112.2P231 Y258 K259 R264P231-S261 WeakPolarHBondContact CB-OG 3.42Å; Y258-S261 WeakPolarHBondContact O-CA 3.34Å; Y258-S261 WeakPolarHBondContact O-CB 3.46Å; Y258-S261 PolarHBondContact O-N 3.05Å; K259-S261 PolarHBondContact O-N 3.23Å; S261-R264 WeakPolarHBondContact O-CB 3.44Å
262I97.1Very high95.6Very high1 Ų153 Ų531%0.00529%0.294CS..Hα-helixtrans-69.7-44.6176.7-63.9165.1000110.1F235 V255 Y258 K259 R264 D265 F268 L272F235-I262 HydrophobicContact CD1-CD1 4.49Å; F235-I262 HydrophobicContact CD1-CG1 4.2Å; F235-I262 HydrophobicContact CD2-CD1 4.19Å; F235-I262 HydrophobicContact CE1-CD1 4.02Å; F235-I262 HydrophobicContact CE1-CG1 3.94Å; F235-I262 HydrophobicContact CE2-CD1 3.7Å; F235-I262 HydrophobicContact CE2-CG1 4.41Å; F235-I262 HydrophobicContact CZ-CD1 3.59Å; F235-I262 HydrophobicContact CZ-CG1 4.06Å; V255-I262 HydrophobicContact CG1-CD1 4.45Å; Y258-I262 PolarHBondContact O-N 3.45Å; K259-I262 PolarHBondContact O-N 3.19Å; I262-R264 PolarHBondContact O-N 2.86Å; I262-D265 PolarHBondContact O-N 3.39Å; I262-D265 VanDerWaalsContact O-N 3.15Å; I262-D265 VanDerWaalsContact O-O 3.11Å; I262-F268 HydrophobicContact CG2-CB 3.8Å; I262-L272 HydrophobicContact CD1-CD1 3.94Å; I262-L272 HydrophobicContact CG1-CD1 4.39Å; I262-L272 HydrophobicContact CG2-CD1 3.79Å
263D96.6Very high95.5Very high67 Ų6752.7 Ų52.736%0.35829%0.287SS..THydrogen-bonded Turntrans-68.5-1.4-177.2-70.4-16.5000113.8K259 D265 N269K259-D263 VanDerWaalsContact CE-OD2 3.29Å; K259-D263 WeakPolarHBondContact CE-OD2 3.41Å; K259-D263 WeakPolarHBondContact CG-OD2 3.42Å; K259-D263 IonicContact NZ-OD1 3.76Å; K259-D263 PolarHBondContact NZ-OD1 3.38Å; K259-D263 VanDerWaalsContact NZ-OD1 3.13Å; K259-D263 IonicContact NZ-OD2 2.65Å; K259-D263 PolarHBondContact NZ-OD2 3.47Å; K259-D263 WeakPolarHBondContact O-CB 3.46Å; K259-D263 PolarHBondContact O-N 2.97Å; D263-D265 PolarHBondContact O-N 3.36Å; D263-N269 PolarHBondContact OD1-ND2 3.44Å
264R96.6Very high95.3Very high108 Ų10851.8 Ų51.841%0.40827%0.274SS..THydrogen-bonded Turntrans-62-31.8167.3-74.1171.162.7-162.32.7112.1S183 D186 L187 S261 I262S183-R264 PolarHBondContact O-NH2 3.07Å; D186-R264 IonicContact OD1-CZ 2.83Å; D186-R264 IonicContact OD1-NH1 3.79Å; D186-R264 PolarHBondContact OD1-NH1 3.38Å; D186-R264 VanDerWaalsContact OD1-NH1 3.12Å; D186-R264 IonicContact OD1-NH2 3.7Å; D186-R264 PolarHBondContact OD1-NH2 3.41Å; D186-R264 IonicContact OD2-CZ 2.79Å; D186-R264 IonicContact OD2-NH1 3.12Å; D186-R264 PolarHBondContact OD2-NH1 3.2Å; D186-R264 IonicContact OD2-NH2 3.36Å; L187-R264 HydrophobicContact CD2-CB 3.86Å; S261-R264 WeakPolarHBondContact O-CB 3.44Å; I262-R264 PolarHBondContact O-N 2.86Å
265D94.7Very high95.2Very high41 Ų4151.3 Ų51.322%0.21927%0.271CS..SBendtrans-127.8107.9170-173.2-12.1000109.6L187 I262 D263 I267 F268L187-D265 HydrophobicContact CD2-CB 4.33Å; I262-D265 PolarHBondContact O-N 3.39Å; I262-D265 VanDerWaalsContact O-N 3.15Å; I262-D265 VanDerWaalsContact O-O 3.11Å; D263-D265 PolarHBondContact O-N 3.36Å; D265-I267 VanDerWaalsContact CG-CG2 3.47Å; D265-I267 PolarHBondContact O-N 3.41Å; D265-I267 WeakPolarHBondContact OD1-CG2 3.41Å; D265-I267 PolarHBondContact OD1-N 3.13Å; D265-I267 VanDerWaalsContact OD1-N 3.14Å; D265-I267 WeakPolarHBondContact OD2-CG2 3.21Å; D265-F268 HydrophobicContact CB-CD1 4.02Å; D265-F268 HydrophobicContact CB-CD2 4.07Å; D265-F268 HydrophobicContact CB-CE1 3.91Å; D265-F268 HydrophobicContact CB-CE2 3.97Å; D265-F268 HydrophobicContact CB-CG 4.1Å; D265-F268 HydrophobicContact CB-CZ 3.89Å; D265-F268 WeakPolarHBondContact O-CB 3.42Å; D265-F268 PolarHBondContact O-N 3.1Å
266P91.4Very high95.1Very high92 Ų9249.7 Ų49.760%0.59726%0.262SS*.THydrogen-bonded Turntrans-53.8-30-177.9-28.135.7000114.6F268 N269P266-F268 PolarHBondContact O-N 2.99Å; P266-N269 PolarHBondContact O-N 3.5Å
267I93.3Very high94.8Very high34 Ų3445.2 Ų45.217%0.17424%0.241CC..Hα-helixtrans-65.8-21.8-178.5-156.4169.3000112.4D265 N269 E270 Y271 V296D265-I267 VanDerWaalsContact CG-CG2 3.47Å; D265-I267 PolarHBondContact O-N 3.41Å; D265-I267 WeakPolarHBondContact OD1-CG2 3.41Å; D265-I267 PolarHBondContact OD1-N 3.13Å; D265-I267 VanDerWaalsContact OD1-N 3.14Å; D265-I267 WeakPolarHBondContact OD2-CG2 3.21Å; I267-N269 VanDerWaalsContact C-N 3.29Å; I267-N269 PolarHBondContact O-N 3.39Å; I267-E270 WeakPolarHBondContact O-CB 3.48Å; I267-E270 PolarHBondContact O-N 2.82Å; I267-E270 VanDerWaalsContact O-N 3.16Å; I267-Y271 HydrophobicContact CD1-CE1 4.07Å; I267-Y271 HydrophobicContact CD1-CE2 4.4Å; I267-Y271 WeakPolarHBondContact CD1-OH 3.16Å; I267-Y271 HydrophobicContact CG1-CD1 4.48Å; I267-Y271 HydrophobicContact CG1-CE1 3.95Å; I267-Y271 HydrophobicContact CG1-CE2 4.19Å; I267-Y271 HydrophobicContact CG2-CD2 4.22Å; I267-Y271 HydrophobicContact CG2-CE2 3.7Å; I267-Y271 PolarHBondContact O-N 3.38Å; I267-V296 HydrophobicContact CD1-CG1 4.27Å
268F96.7Very high94.6Very high1 Ų144.6 Ų44.60%0.00423%0.227CC..Hα-helixtrans-64.5-34.8179.4-69-3.3000112.2L187 A190 Q191 L194 L232 I262 D265 P266 E270 Y271 L272L187-F268 HydrophobicContact CD2-CE2 3.73Å; L187-F268 HydrophobicContact CD2-CZ 4.02Å; A190-F268 HydrophobicContact CB-CE2 3.8Å; A190-F268 HydrophobicContact CB-CZ 3.79Å; Q191-F268 HydrophobicContact CB-CE1 3.81Å; Q191-F268 HydrophobicContact CB-CZ 4.16Å; Q191-F268 HydrophobicContact CG-CE1 4.2Å; L194-F268 HydrophobicContact CD1-CB 3.89Å; L194-F268 HydrophobicContact CD1-CD1 3.59Å; L194-F268 HydrophobicContact CD1-CD2 4.08Å; L194-F268 HydrophobicContact CD1-CE1 4.11Å; L194-F268 HydrophobicContact CD1-CG 3.58Å; L232-F268 HydrophobicContact CD1-CE2 4.41Å; L232-F268 HydrophobicContact CD2-CE2 4.21Å; I262-F268 HydrophobicContact CG2-CB 3.8Å; D265-F268 HydrophobicContact CB-CD1 4.02Å; D265-F268 HydrophobicContact CB-CD2 4.07Å; D265-F268 HydrophobicContact CB-CE1 3.91Å; D265-F268 HydrophobicContact CB-CE2 3.97Å; D265-F268 HydrophobicContact CB-CG 4.1Å; D265-F268 HydrophobicContact CB-CZ 3.89Å; D265-F268 WeakPolarHBondContact O-CB 3.42Å; D265-F268 PolarHBondContact O-N 3.1Å; P266-F268 PolarHBondContact O-N 2.99Å; F268-E270 VanDerWaalsContact C-N 3.3Å; F268-E270 PolarHBondContact O-N 3.5Å; F268-Y271 HydrophobicContact CD1-CD2 4.05Å; F268-Y271 HydrophobicContact CD1-CE2 4.35Å; F268-Y271 PolarHBondContact O-N 3.45Å; F268-L272 WeakPolarHBondContact O-CB 3.4Å; F268-L272 WeakPolarHBondContact O-CD1 3.36Å; F268-L272 WeakPolarHBondContact O-CG 3.35Å; F268-L272 PolarHBondContact O-N 3.31Å
269N94.4Very high94.2Very high47 Ų4743 Ų4325%0.25122%0.222SC..Hα-helixtrans-61.9-42.9175-74.1-71.4000110.7D263 P266 I267 L272 E273D263-N269 PolarHBondContact OD1-ND2 3.44Å; P266-N269 PolarHBondContact O-N 3.5Å; I267-N269 VanDerWaalsContact C-N 3.29Å; I267-N269 PolarHBondContact O-N 3.39Å; N269-L272 PolarHBondContact O-N 3.03Å; N269-E273 PolarHBondContact O-N 3.38Å
270E92.8Very high93.9Very high47 Ų4738.6 Ų38.622%0.2220%0.203CC..Hα-helixtrans-64.3-44.1176.9-58.4-170.5-152.200111.3I267 F268 L272 E273 K274 L289 F292 L293I267-E270 WeakPolarHBondContact O-CB 3.48Å; I267-E270 PolarHBondContact O-N 2.82Å; I267-E270 VanDerWaalsContact O-N 3.16Å; F268-E270 VanDerWaalsContact C-N 3.3Å; F268-E270 PolarHBondContact O-N 3.5Å; E270-L272 PolarHBondContact O-N 3.18Å; E270-E273 PolarHBondContact O-N 3.16Å; E270-K274 PolarHBondContact O-N 3.38Å; E270-K274 VanDerWaalsContact O-N 3.14Å; E270-L289 HydrophobicContact CB-CD2 4.35Å; E270-L289 HydrophobicContact CG-CD2 3.82Å; E270-F292 WeakPolarHBondContact OE2-CD1 3.38Å; E270-L293 VanDerWaalsContact C-CD1 3.46Å; E270-L293 HydrophobicContact CB-CD1 3.67Å; E270-L293 HydrophobicContact CB-CD2 3.55Å; E270-L293 HydrophobicContact CB-CG 3.87Å; E270-L293 HydrophobicContact CG-CD2 4.44Å; E270-L293 WeakPolarHBondContact O-CD1 3.18Å; E270-L293 WeakPolarHBondContact OE2-CD2 3.29Å; E270-L293 WeakPolarHBondContact OE2-CG 3.44Å
271Y95.7Very high92.9Very high0 Ų038.9 Ų38.90%021%0.214CC..Hα-helixtrans-58.9-45.1173.4-65.7-25.6000112.4Q191 L194 Q195 I267 F268 E273 K274 I275 L293 L297Q191-Y271 HydrophobicContact CG-CE2 4.33Å; L194-Y271 HydrophobicContact CB-CD2 3.74Å; L194-Y271 HydrophobicContact CB-CG 4.25Å; L194-Y271 HydrophobicContact CD1-CD2 4.22Å; Q195-Y271 HydrophobicContact CG-CE1 4.48Å; Q195-Y271 HydrophobicContact CG-CE2 3.93Å; Q195-Y271 PolarHBondContact NE2-OH 2.9Å; Q195-Y271 VanDerWaalsContact NE2-OH 3.13Å; I267-Y271 HydrophobicContact CD1-CE1 4.07Å; I267-Y271 HydrophobicContact CD1-CE2 4.4Å; I267-Y271 WeakPolarHBondContact CD1-OH 3.16Å; I267-Y271 HydrophobicContact CG1-CD1 4.48Å; I267-Y271 HydrophobicContact CG1-CE1 3.95Å; I267-Y271 HydrophobicContact CG1-CE2 4.19Å; I267-Y271 HydrophobicContact CG2-CD2 4.22Å; I267-Y271 HydrophobicContact CG2-CE2 3.7Å; I267-Y271 PolarHBondContact O-N 3.38Å; F268-Y271 HydrophobicContact CD1-CD2 4.05Å; F268-Y271 HydrophobicContact CD1-CE2 4.35Å; F268-Y271 PolarHBondContact O-N 3.45Å; Y271-E273 VanDerWaalsContact C-N 3.35Å; Y271-E273 PolarHBondContact O-N 3.01Å; Y271-K274 PolarHBondContact O-N 2.85Å; Y271-I275 WeakPolarHBondContact O-CB 3.43Å; Y271-I275 WeakPolarHBondContact O-CD1 3.35Å; Y271-I275 WeakPolarHBondContact O-CG1 3.47Å; Y271-I275 PolarHBondContact O-N 3.32Å; Y271-L293 HydrophobicContact CD1-CD2 4.12Å; Y271-L293 HydrophobicContact CE1-CD2 4.14Å; Y271-L297 HydrophobicContact CE1-CD2 4Å; Y271-L297 HydrophobicContact CE1-CG 4.45Å
272L95.7Very high91.4Very high6 Ų642.9 Ų42.93%0.03124%0.242CC..Hα-helixtrans-63.9-38.5-179.9-72.1166.2000112.1L194 F235 L239 F251 V255 I262 F268 N269 E270 K274 I275 A276L194-L272 HydrophobicContact CD2-CD2 3.9Å; L194-L272 HydrophobicContact CD2-CG 4.4Å; F235-L272 HydrophobicContact CE1-CD1 4.37Å; F235-L272 HydrophobicContact CE1-CD2 4.3Å; F235-L272 HydrophobicContact CZ-CD1 3.9Å; F235-L272 HydrophobicContact CZ-CD2 3.78Å; F235-L272 HydrophobicContact CZ-CG 4.49Å; L239-L272 HydrophobicContact CD1-CD2 4.22Å; L239-L272 HydrophobicContact CD2-CD2 3.93Å; F251-L272 HydrophobicContact CE2-CD2 4.15Å; F251-L272 HydrophobicContact CZ-CB 4.41Å; F251-L272 HydrophobicContact CZ-CD2 4.23Å; V255-L272 HydrophobicContact CG1-CD1 4.5Å; V255-L272 HydrophobicContact CG2-CD1 4.18Å; V255-L272 HydrophobicContact CG2-CD2 4.35Å; I262-L272 HydrophobicContact CD1-CD1 3.94Å; I262-L272 HydrophobicContact CG1-CD1 4.39Å; I262-L272 HydrophobicContact CG2-CD1 3.79Å; F268-L272 WeakPolarHBondContact O-CB 3.4Å; F268-L272 WeakPolarHBondContact O-CD1 3.36Å; F268-L272 WeakPolarHBondContact O-CG 3.35Å; F268-L272 PolarHBondContact O-N 3.31Å; N269-L272 PolarHBondContact O-N 3.03Å; E270-L272 PolarHBondContact O-N 3.18Å; L272-K274 PolarHBondContact O-N 2.87Å; L272-I275 PolarHBondContact O-N 3.44Å; L272-A276 WeakPolarHBondContact O-CB 3.45Å; L272-A276 PolarHBondContact O-N 3.2Å
273E92.3Very high89.8Confident66 Ų6644.6 Ų44.631%0.30825%0.253SS..Hα-helixtrans-59.4-46172.2-75.6-169.6-152.400111.6N269 E270 Y271 A276 Q277 S286 L289N269-E273 PolarHBondContact O-N 3.38Å; E270-E273 PolarHBondContact O-N 3.16Å; Y271-E273 VanDerWaalsContact C-N 3.35Å; Y271-E273 PolarHBondContact O-N 3.01Å; E273-A276 PolarHBondContact O-N 3.1Å; E273-Q277 WeakPolarHBondContact O-CG 3.34Å; E273-Q277 PolarHBondContact O-N 3.34Å; E273-Q277 VanDerWaalsContact O-N 3.16Å; E273-S286 WeakPolarHBondContact OE2-CB 3.2Å; E273-S286 PolarHBondContact OE2-OG 2.93Å; E273-L289 WeakPolarHBondContact OE1-CD1 3.13Å; E273-L289 WeakPolarHBondContact OE2-CD1 3.42Å
274K92.3Very high88Confident31 Ų3146.9 Ų46.914%0.13527%0.272CS..Hα-helixtrans-65-44.1177-179.2167.5178.7178.30112.1C198 E270 Y271 L272 A276 Q277 I278 L293 D294 L297C198-K274 HydrophobicContact CB-CD 4.05Å; C198-K274 HydrophobicContact CB-CG 4.45Å; C198-K274 VanDerWaalsContact O-CE 3.23Å; C198-K274 WeakPolarHBondContact O-CE 3.43Å; E270-K274 PolarHBondContact O-N 3.38Å; E270-K274 VanDerWaalsContact O-N 3.14Å; Y271-K274 PolarHBondContact O-N 2.85Å; L272-K274 PolarHBondContact O-N 2.87Å; K274-A276 VanDerWaalsContact C-N 3.27Å; K274-A276 PolarHBondContact O-N 3.36Å; K274-Q277 PolarHBondContact O-N 3.35Å; K274-I278 HydrophobicContact CG-CD1 3.88Å; K274-I278 WeakPolarHBondContact O-CG1 3.4Å; K274-I278 PolarHBondContact O-N 3Å; K274-L293 HydrophobicContact CB-CD1 4.05Å; K274-L293 HydrophobicContact CD-CD1 4.47Å; K274-D294 IonicContact NZ-OD1 3.51Å; K274-D294 PolarHBondContact NZ-OD1 3.29Å; K274-L297 HydrophobicContact CD-CD1 4.14Å
275I94.5Very high85.9Confident0 Ų048.6 Ų48.60%029%0.289CS..Hα-helixtrans-59.7-40.9177.3-69.4163.7000110.5L194 L197 I243 F251 Y271 L272 I278 N279L194-I275 HydrophobicContact CB-CD1 4.28Å; L194-I275 HydrophobicContact CD2-CD1 3.52Å; L197-I275 HydrophobicContact CB-CD1 3.6Å; L197-I275 HydrophobicContact CB-CG1 3.66Å; L197-I275 HydrophobicContact CB-CG2 4.36Å; L197-I275 HydrophobicContact CD1-CD1 4.08Å; I243-I275 HydrophobicContact CD1-CG2 3.65Å; I243-I275 HydrophobicContact CG1-CG2 4.48Å; F251-I275 HydrophobicContact CE2-CG2 4.14Å; Y271-I275 WeakPolarHBondContact O-CB 3.43Å; Y271-I275 WeakPolarHBondContact O-CD1 3.35Å; Y271-I275 WeakPolarHBondContact O-CG1 3.47Å; Y271-I275 PolarHBondContact O-N 3.32Å; L272-I275 PolarHBondContact O-N 3.44Å; I275-I278 PolarHBondContact O-N 3.4Å; I275-N279 WeakPolarHBondContact O-CB 3.32Å; I275-N279 PolarHBondContact O-N 2.97Å; I275-N279 PolarHBondContact O-ND2 2.77Å
276A93.2Very high84.1Confident4 Ų448.9 Ų48.93%0.03329%0.293CS..Hα-helixtrans-63.3-42.117800000112F251 L272 E273 K274 F280 C283F251-A276 HydrophobicContact CE1-CB 3.73Å; F251-A276 HydrophobicContact CZ-CB 3.79Å; L272-A276 WeakPolarHBondContact O-CB 3.45Å; L272-A276 PolarHBondContact O-N 3.2Å; E273-A276 PolarHBondContact O-N 3.1Å; K274-A276 VanDerWaalsContact C-N 3.27Å; K274-A276 PolarHBondContact O-N 3.36Å; A276-F280 HydrophobicContact CB-CD2 4.42Å; A276-F280 WeakPolarHBondContact O-CB 3.24Å; A276-F280 PolarHBondContact O-N 3.36Å; A276-C283 HydrophobicContact CB-CB 4.44Å
277Q90.5Very high82.2Confident58 Ų5849.8 Ų49.827%0.27130%0.302SS..Hα-helixtrans-64.2-38.7176.5-68.5170.519.800112.7E273 K274 L285E273-Q277 WeakPolarHBondContact O-CG 3.34Å; E273-Q277 PolarHBondContact O-N 3.34Å; E273-Q277 VanDerWaalsContact O-N 3.16Å; K274-Q277 PolarHBondContact O-N 3.35Å; Q277-L285 HydrophobicContact CG-CD2 4.47Å
278I91Very high80.4Confident61 Ų6158.6 Ų58.631%0.31333%0.333SS..Hα-helixtrans-70-44.7179-67.7166.3000111C198 D200 K274 I275C198-I278 VanDerWaalsContact O-CD1 3.26Å; C198-I278 WeakPolarHBondContact O-CD1 3.33Å; D200-I278 HydrophobicContact CB-CG2 3.78Å; D200-I278 WeakPolarHBondContact OD1-CG2 3.41Å; K274-I278 HydrophobicContact CG-CD1 3.88Å; K274-I278 WeakPolarHBondContact O-CG1 3.4Å; K274-I278 PolarHBondContact O-N 3Å; I275-I278 PolarHBondContact O-N 3.4Å
279N90Very high78.5Confident18 Ų1860.3 Ų60.310%0.09634%0.342CS..Hα-helixtrans-93.2-26.6-167.8-72.3-82.8000114.2K202 I243 I275K202-N279 WeakPolarHBondContact CE-OD1 3.34Å; K202-N279 PolarHBondContact NZ-OD1 2.88Å; I243-N279 VanDerWaalsContact CG2-OD1 3.29Å; I243-N279 WeakPolarHBondContact CG2-OD1 3.05Å; I275-N279 WeakPolarHBondContact O-CB 3.32Å; I275-N279 PolarHBondContact O-N 2.97Å; I275-N279 PolarHBondContact O-ND2 2.77Å
280F90.2Very high77Confident6 Ų660.8 Ų60.83%0.02635%0.348CS..  trans-126.899-172.4-50.5-70.2000111I243 N246 L248 F251 A276 S282 C283I243-F280 HydrophobicContact CG1-CZ 4.39Å; N246-F280 WeakPolarHBondContact OD1-CD1 3.41Å; N246-F280 WeakPolarHBondContact OD1-CE1 3.45Å; L248-F280 HydrophobicContact CB-CB 4.45Å; L248-F280 HydrophobicContact CB-CD1 3.83Å; L248-F280 HydrophobicContact CB-CE1 4.27Å; L248-F280 HydrophobicContact CB-CG 4.1Å; L248-F280 HydrophobicContact CD1-CB 3.91Å; L248-F280 HydrophobicContact CD1-CD1 4.35Å; L248-F280 HydrophobicContact CD1-CD2 3.8Å; L248-F280 HydrophobicContact CD1-CE2 4.45Å; L248-F280 HydrophobicContact CD1-CG 3.76Å; L248-F280 HydrophobicContact CD2-CB 4.41Å; L248-F280 HydrophobicContact CG-CB 4.48Å; L248-F280 HydrophobicContact CG-CG 4.43Å; F251-F280 HydrophobicContact CB-CE2 3.8Å; F251-F280 HydrophobicContact CB-CZ 3.86Å; F251-F280 HydrophobicContact CD1-CE2 4.11Å; F251-F280 AromaticContact CD2-CE2 3.62Å; F251-F280 HydrophobicContact CD2-CE2 3.62Å; F251-F280 HydrophobicContact CD2-CZ 4.21Å; F251-F280 HydrophobicContact CE2-CE2 4.22Å; F251-F280 HydrophobicContact CG-CD2 4.41Å; F251-F280 AromaticContact CG-CE2 3.57Å; F251-F280 HydrophobicContact CG-CE2 3.57Å; F251-F280 HydrophobicContact CG-CZ 4.13Å; A276-F280 HydrophobicContact CB-CD2 4.42Å; A276-F280 WeakPolarHBondContact O-CB 3.24Å; A276-F280 PolarHBondContact O-N 3.36Å; F280-S282 PolarHBondContact O-N 3.27Å; F280-C283 HydrophobicContact CB-CB 4.3Å; F280-C283 WeakPolarHBondContact O-CB 3.21Å; F280-C283 PolarHBondContact O-N 3.44Å
281A76Confident75.7Confident110 Ų11068.7 Ų68.791%0.90938%0.376SS*.THydrogen-bonded Turntrans-56.6-23.1-179.800000114.4
282S64.9Low74.5Confident103 Ų10374.4 Ų74.472%0.7240%0.401SS*.THydrogen-bonded Turntrans-91.11.9-179.5-48.20000114.1F280F280-S282 PolarHBondContact O-N 3.27Å
283C62.4Low73.2Confident36 Ų3674.2 Ų74.224%0.24340%0.4CS..SBendtrans-73.1125178.8-168.10000110A276 F280 L285A276-C283 HydrophobicContact CB-CB 4.44Å; F280-C283 HydrophobicContact CB-CB 4.3Å; F280-C283 WeakPolarHBondContact O-CB 3.21Å; F280-C283 PolarHBondContact O-N 3.44Å; C283-L285 PolarHBondContact O-N 2.96Å
284P59.2Low72.2Confident116 Ų11674 Ų7475%0.75340%0.4SS*.  trans-60.7125.8178.122.4-30.3000110.1S286P284-S286 PolarHBondContact O-N 2.97Å; P284-S286 VanDerWaalsContact O-N 3.14Å
285L53.2Low71.5Confident144 Ų14477.6 Ų77.675%0.75442%0.421SS*.  trans-61.3112.8179.9-74.7153.5000110.3Q277 C283 S287Q277-L285 HydrophobicContact CG-CD2 4.47Å; C283-L285 PolarHBondContact O-N 2.96Å; L285-S287 PolarHBondContact O-N 3.16Å
286S55.4Low70.6Confident46 Ų4679 Ų7932%0.32243%0.43SS..  trans-69115.7160176.70000107.8E273 P284 R288E273-S286 WeakPolarHBondContact OE2-CB 3.2Å; E273-S286 PolarHBondContact OE2-OG 2.93Å; P284-S286 PolarHBondContact O-N 2.97Å; P284-S286 VanDerWaalsContact O-N 3.14Å; S286-R288 PolarHBondContact O-N 2.93Å; S286-R288 VanDerWaalsContact O-N 3.1Å
287S51.8Low69.8Low111 Ų11179 Ų7978%0.77643%0.429SS*.THydrogen-bonded Turntrans-71-1.5-172.857.70000114.8L285L285-S287 PolarHBondContact O-N 3.16Å
288R55.5Low69.1Low220 Ų22079.3 Ų79.383%0.8343%0.433SS*.THydrogen-bonded Turntrans-106.8-18.1-165-70.5-174.8-179.8173.80.8116S286S286-R288 PolarHBondContact O-N 2.93Å; S286-R288 VanDerWaalsContact O-N 3.1Å
289L58.3Low68.3Low37 Ų3779.4 Ų79.419%0.19444%0.439CS..SBendtrans-116.84.8-161.5-80.8158.1000120.4E270 E273E270-L289 HydrophobicContact CB-CD2 4.35Å; E270-L289 HydrophobicContact CG-CD2 3.82Å; E273-L289 WeakPolarHBondContact OE1-CD1 3.13Å; E273-L289 WeakPolarHBondContact OE2-CD1 3.42Å
290P62.7Low67.4Low57 Ų5781 Ų8137%0.3745%0.447SS..Hα-helixtrans-68.6-46.5178.2-21.332.1000114.9D294P290-D294 WeakPolarHBondContact O-CB 3.42Å; P290-D294 PolarHBondContact O-N 3.33Å
291R64.3Low66.3Low212 Ų21281.2 Ų81.280%0.845%0.448SS*.Hα-helixtrans-78.4-37.3-163.4-84.2-173.4-94.7177.1-7.2115.5N295R291-N295 VanDerWaalsContact O-CG 3.26Å; R291-N295 PolarHBondContact O-N 3.21Å; R291-N295 VanDerWaalsContact O-N 3.17Å; R291-N295 PolarHBondContact O-ND2 2.73Å
292F71Confident65.5Low121 Ų12178.2 Ų78.253%0.53142%0.419SS..Hα-helixtrans-69-45.8-178.7173.6-102.8000111E270 D294 N295 V296E270-F292 WeakPolarHBondContact OE2-CD1 3.38Å; F292-D294 PolarHBondContact O-N 3.38Å; F292-N295 CarbonylContact O-C 3.47Å; F292-N295 WeakPolarHBondContact O-CB 3.47Å; F292-N295 PolarHBondContact O-N 3.41Å; F292-N295 VanDerWaalsContact O-N 3.12Å; F292-V296 HydrophobicContact CD1-CG2 4.17Å; F292-V296 HydrophobicContact CD2-CG2 4.35Å; F292-V296 HydrophobicContact CE1-CG2 3.69Å; F292-V296 HydrophobicContact CE2-CG2 3.88Å; F292-V296 HydrophobicContact CG-CG2 4.49Å; F292-V296 HydrophobicContact CZ-CG2 3.52Å; F292-V296 WeakPolarHBondContact O-CG2 3.39Å; F292-V296 PolarHBondContact O-N 3.11Å
293L68.2Low64.8Low1 Ų179.3 Ų79.31%0.00542%0.416CS..Hα-helixtrans-62-41.9176.5-76.6-179.7000113.2E270 Y271 K274 N295 V296 L297E270-L293 VanDerWaalsContact C-CD1 3.46Å; E270-L293 HydrophobicContact CB-CD1 3.67Å; E270-L293 HydrophobicContact CB-CD2 3.55Å; E270-L293 HydrophobicContact CB-CG 3.87Å; E270-L293 HydrophobicContact CG-CD2 4.44Å; E270-L293 WeakPolarHBondContact O-CD1 3.18Å; E270-L293 WeakPolarHBondContact OE2-CD2 3.29Å; E270-L293 WeakPolarHBondContact OE2-CG 3.44Å; Y271-L293 HydrophobicContact CD1-CD2 4.12Å; Y271-L293 HydrophobicContact CE1-CD2 4.14Å; K274-L293 HydrophobicContact CB-CD1 4.05Å; K274-L293 HydrophobicContact CD-CD1 4.47Å; L293-N295 PolarHBondContact O-N 3.43Å; L293-V296 PolarHBondContact O-N 2.91Å; L293-L297 WeakPolarHBondContact O-CB 3.02Å; L293-L297 WeakPolarHBondContact O-CG 3.35Å; L293-L297 PolarHBondContact O-N 2.98Å
294D71.7Confident63.8Low61 Ų6179 Ų7933%0.32642%0.42SS..Hα-helixtrans-58.6-42.7174.7-73-19.9000110.2K274 P290 F292 N298K274-D294 IonicContact NZ-OD1 3.51Å; K274-D294 PolarHBondContact NZ-OD1 3.29Å; P290-D294 WeakPolarHBondContact O-CB 3.42Å; P290-D294 PolarHBondContact O-N 3.33Å; F292-D294 PolarHBondContact O-N 3.38Å; D294-N298 WeakPolarHBondContact O-CB 2.91Å; D294-N298 PolarHBondContact O-N 3.34Å; D294-N298 PolarHBondContact O-ND2 3.02Å; D294-N298 VanDerWaalsContact O-ND2 3.1Å; D294-N298 PolarHBondContact O-OD1 3.16Å
295N76.5Confident62.6Low107 Ų10778.9 Ų78.957%0.57241%0.409SS*.Hα-helixtrans-65.8-39.3175.6-68.6-11.2000113.1R291 F292 L293 S299R291-N295 VanDerWaalsContact O-CG 3.26Å; R291-N295 PolarHBondContact O-N 3.21Å; R291-N295 VanDerWaalsContact O-N 3.17Å; R291-N295 PolarHBondContact O-ND2 2.73Å; F292-N295 CarbonylContact O-C 3.47Å; F292-N295 WeakPolarHBondContact O-CB 3.47Å; F292-N295 PolarHBondContact O-N 3.41Å; F292-N295 VanDerWaalsContact O-N 3.12Å; L293-N295 PolarHBondContact O-N 3.43Å; N295-S299 WeakPolarHBondContact O-CB 3.47Å; N295-S299 PolarHBondContact O-N 3.44Å
296V77.1Confident61.4Low31 Ų3178.2 Ų78.219%0.18841%0.406CS..Hα-helixtrans-69.7-46.5177.9171.80000111.2I267 F292 L293 N298 S299 I300I267-V296 HydrophobicContact CD1-CG1 4.27Å; F292-V296 HydrophobicContact CD1-CG2 4.17Å; F292-V296 HydrophobicContact CD2-CG2 4.35Å; F292-V296 HydrophobicContact CE1-CG2 3.69Å; F292-V296 HydrophobicContact CE2-CG2 3.88Å; F292-V296 HydrophobicContact CG-CG2 4.49Å; F292-V296 HydrophobicContact CZ-CG2 3.52Å; F292-V296 WeakPolarHBondContact O-CG2 3.39Å; F292-V296 PolarHBondContact O-N 3.11Å; L293-V296 PolarHBondContact O-N 2.91Å; V296-N298 VanDerWaalsContact C-N 3.3Å; V296-N298 PolarHBondContact O-N 2.92Å; V296-S299 PolarHBondContact O-N 2.86Å; V296-S299 VanDerWaalsContact O-N 3.16Å; V296-I300 HydrophobicContact CG1-CD1 3.72Å; V296-I300 HydrophobicContact CG1-CG1 4.33Å; V296-I300 WeakPolarHBondContact O-CB 3.19Å; V296-I300 VanDerWaalsContact O-CG1 3.26Å; V296-I300 WeakPolarHBondContact O-CG1 3.45Å; V296-I300 PolarHBondContact O-N 3.07Å
297L75.9Confident60.2Low3 Ų382.9 Ų82.92%0.01642%0.422CS..Hα-helixtrans-63-40.5175.2-71.2169.9000110.6Q195 C198 Y271 K274 L293 L301Q195-L297 HydrophobicContact CB-CD2 4.46Å; Q195-L297 HydrophobicContact CG-CD2 4.07Å; C198-L297 HydrophobicContact CB-CD1 3.75Å; Y271-L297 HydrophobicContact CE1-CD2 4Å; Y271-L297 HydrophobicContact CE1-CG 4.45Å; K274-L297 HydrophobicContact CD-CD1 4.14Å; L293-L297 WeakPolarHBondContact O-CB 3.02Å; L293-L297 WeakPolarHBondContact O-CG 3.35Å; L293-L297 PolarHBondContact O-N 2.98Å; L297-L301 WeakPolarHBondContact O-CB 3.49Å; L297-L301 WeakPolarHBondContact O-CD1 3.4Å; L297-L301 WeakPolarHBondContact O-CG 3.34Å; L297-L301 PolarHBondContact O-N 3.47Å
298N75.6Confident59.1Low65 Ų6584.6 Ų84.635%0.34842%0.423SS..Hα-helixtrans-62.5-46.9172.3-67.6-15.5000110.2R133 D294 V296 L301 T302R133-N298 PolarHBondContact NH2-OD1 3.14Å; D294-N298 WeakPolarHBondContact O-CB 2.91Å; D294-N298 PolarHBondContact O-N 3.34Å; D294-N298 PolarHBondContact O-ND2 3.02Å; D294-N298 VanDerWaalsContact O-ND2 3.1Å; D294-N298 PolarHBondContact O-OD1 3.16Å; V296-N298 VanDerWaalsContact C-N 3.3Å; V296-N298 PolarHBondContact O-N 2.92Å; N298-L301 CarbonylContact O-C 3.37Å; N298-L301 PolarHBondContact O-N 3.03Å; N298-L301 VanDerWaalsContact O-N 3.14Å; N298-T302 WeakPolarHBondContact O-CA 3.45Å; N298-T302 WeakPolarHBondContact O-CB 3.21Å; N298-T302 PolarHBondContact O-N 3.42Å; N298-T302 PolarHBondContact O-OG1 3.33Å
299S74.1Confident58Low63 Ų6380.5 Ų80.544%0.44142%0.417SS..Hα-helixtrans-59.3-51.8178.6173.10000111.6N295 V296 L301 T302 D303N295-S299 WeakPolarHBondContact O-CB 3.47Å; N295-S299 PolarHBondContact O-N 3.44Å; V296-S299 PolarHBondContact O-N 2.86Å; V296-S299 VanDerWaalsContact O-N 3.16Å; S299-L301 PolarHBondContact O-N 3.3Å; S299-L301 VanDerWaalsContact O-N 3.14Å; S299-T302 PolarHBondContact O-N 3.17Å; S299-D303 VanDerWaalsContact O-CB 3.32Å; S299-D303 WeakPolarHBondContact O-CB 3.36Å; S299-D303 PolarHBondContact O-N 3.1Å
300I72.1Confident56.8Low52 Ų5287.8 Ų87.827%0.26745%0.448SS..Hα-helixtrans-54-38.6176-68.7168.3000111.1V296V296-I300 HydrophobicContact CG1-CD1 3.72Å; V296-I300 HydrophobicContact CG1-CG1 4.33Å; V296-I300 WeakPolarHBondContact O-CB 3.19Å; V296-I300 VanDerWaalsContact O-CG1 3.26Å; V296-I300 WeakPolarHBondContact O-CG1 3.45Å; V296-I300 PolarHBondContact O-N 3.07Å
301L67.1Low55.5Low10 Ų1090.3 Ų90.35%0.05246%0.464CS..Hα-helixtrans-88.5-12.9-178.1-63.5172000114.1Q160 L161 M199 L297 N298 S299Q160-L301 HydrophobicContact CB-CD2 4.05Å; L161-L301 HydrophobicContact CD2-CB 4.07Å; L161-L301 HydrophobicContact CD2-CD2 3.79Å; L161-L301 HydrophobicContact CD2-CG 4.43Å; L161-L301 HydrophobicContact CG-CD2 4.28Å; M199-L301 HydrophobicContact CE-CD1 4.26Å; M199-L301 HydrophobicContact SD-CD1 4.07Å; L297-L301 WeakPolarHBondContact O-CB 3.49Å; L297-L301 WeakPolarHBondContact O-CD1 3.4Å; L297-L301 WeakPolarHBondContact O-CG 3.34Å; L297-L301 PolarHBondContact O-N 3.47Å; N298-L301 CarbonylContact O-C 3.37Å; N298-L301 PolarHBondContact O-N 3.03Å; N298-L301 VanDerWaalsContact O-N 3.14Å; S299-L301 PolarHBondContact O-N 3.3Å; S299-L301 VanDerWaalsContact O-N 3.14Å
302T59.5Low54.1Low47 Ų4786 Ų8629%0.28846%0.464SS..Hα-helixtrans-124-11.6-167.6-42.20000114.1R157 N298 S299 G304 E305R157-T302 PolarHBondContact NH2-O 3.47Å; N298-T302 WeakPolarHBondContact O-CA 3.45Å; N298-T302 WeakPolarHBondContact O-CB 3.21Å; N298-T302 PolarHBondContact O-N 3.42Å; N298-T302 PolarHBondContact O-OG1 3.33Å; S299-T302 PolarHBondContact O-N 3.17Å; T302-G304 PolarHBondContact O-N 3.17Å; T302-E305 PolarHBondContact O-N 2.91Å
303D48.9Very low52.3Low125 Ų12589.4 Ų89.467%0.66848%0.478SS*.THydrogen-bonded Turntrans-65.963.6-170.6-158.421.2000116.4R157 S299R157-D303 VanDerWaalsContact CZ-C 3.48Å; R157-D303 VanDerWaalsContact NH1-C 3.29Å; R157-D303 PolarHBondContact NH1-O 3.44Å; R157-D303 PolarHBondContact NH2-O 2.89Å; S299-D303 VanDerWaalsContact O-CB 3.32Å; S299-D303 WeakPolarHBondContact O-CB 3.36Å; S299-D303 PolarHBondContact O-N 3.1Å
304G42.4Very low50.8Low30 Ų3095.3 Ų95.331%0.30952%0.517SS..THydrogen-bonded Turntrans-172.3-0.2-167.100000112.1T302 L306T302-G304 PolarHBondContact O-N 3.17Å; G304-L306 PolarHBondContact O-N 3.3Å
305E33.2Very low49Very low113 Ų11397.6 Ų97.653%0.52854%0.537SS..  trans-81.597.6150.2-69.6-176169.100107.1K125 T302 E307K125-E305 IonicContact NZ-OE1 3.42Å; T302-E305 PolarHBondContact O-N 2.91Å; E305-E307 PolarHBondContact O-N 2.96Å
306L29Very low46.9Very low131 Ų131100.3 Ų100.369%0.68655%0.552SS**  trans-61.179.5154.8-72.5175.7000107.9E114 G304 N308E114-L306 VanDerWaalsContact OE1-CD1 3.23Å; E114-L306 WeakPolarHBondContact OE1-CD1 3.36Å; G304-L306 PolarHBondContact O-N 3.3Å; L306-N308 PolarHBondContact O-N 3Å; L306-N308 VanDerWaalsContact O-N 3.14Å
307E30.3Very low45.1Very low143 Ų143104.2 Ų104.267%0.66858%0.581SS**  trans-72.8101.8161-81.9-169.6155.600107.8E305 D309E305-E307 PolarHBondContact O-N 2.96Å; E307-D309 PolarHBondContact O-N 3.11Å
308N28.6Very low43.1Very low148 Ų148115.7 Ų115.779%0.79162%0.624SS**  trans-6356.1158.9-90-55.7000111.1L306L306-N308 PolarHBondContact O-N 3Å; L306-N308 VanDerWaalsContact O-N 3.14Å
309D31.7Very low41.5Very low134 Ų134121.6 Ų121.672%0.71765%0.649SS**  trans-104.466.2171.4-92.31.7000109.7E307 P311E307-D309 PolarHBondContact O-N 3.11Å; D309-P311 WeakPolarHBondContact O-CD 3.41Å
310F32Very low39.7Very low190 Ų190125.9 Ų125.983%0.83367%0.667SS**PPolyproline II helixtrans-76.4116.8148.8-84.3-79.2000107.4
311P36.3Very low38.2Very low110 Ų110129.9 Ų129.971%0.71469%0.689SS**PPolyproline II helixtrans-60.513817225.6-31.6000108.4D309 K313D309-P311 WeakPolarHBondContact O-CD 3.41Å; P311-K313 PolarHBondContact O-N 3.24Å; P311-K313 VanDerWaalsContact O-N 3.14Å
312P34.9Very low36.9Very low121 Ų121137.7 Ų137.779%0.78673%0.725SS**PPolyproline II helixtrans-63.9123.4-175.826.1-31.6000108.8
313K33.1Very low35.9Very low193 Ų193139.5 Ų139.584%0.83975%0.745SS**PPolyproline II helixtrans-51.1132.2163.2-99.3177.3176.2172.90107.9P311 S315P311-K313 PolarHBondContact O-N 3.24Å; P311-K313 VanDerWaalsContact O-N 3.14Å; K313-S315 PolarHBondContact O-N 3Å
314P36.2Very low35.5Very low125 Ų125140.5 Ų140.581%0.81276%0.756SS**  trans-64.4109.2178.825.1-31.1000109.1N316P314-N316 PolarHBondContact O-N 3Å
315S35Very low35.3Very low109 Ų109142.3 Ų142.376%0.76277%0.774SS**  trans-76.4118.417055.40000109K313 S317K313-S315 PolarHBondContact O-N 3Å; S315-S317 PolarHBondContact O-N 3.24Å; S315-S317 VanDerWaalsContact O-N 3.1Å
316N32.3Very low35.7Very low163 Ų163142.4 Ų142.487%0.87279%0.788SS**  trans-44.1109171.3-78.3-26.8000112.7P314P314-N316 PolarHBondContact O-N 3Å
317S38.8Very low36.3Very low114 Ų114140.8 Ų140.880%0.79779%0.793SS**  trans-85.4108.915643.20000108.7S315 Q319S315-S317 PolarHBondContact O-N 3.24Å; S315-S317 VanDerWaalsContact O-N 3.1Å; S317-Q319 PolarHBondContact O-N 3.33Å
318R33.9Very low36.8Very low243 Ų243139.3 Ų139.392%0.91780%0.798SS**  trans-56.3118.2164.4-73.2172.6170.1160.8-3.6109.2
319Q41.5Very low37.5Very low190 Ų190136.8 Ų136.889%0.88880%0.798SS**  trans-127.2121149.7-95.5178.5-17.400108S317S317-Q319 PolarHBondContact O-N 3.33Å
320N37.1Very low37.9Very low152 Ų152135.1 Ų135.181%0.81380%0.797SS**  trans-46.5132.7165.9-79.3-22.7000109.8
321D39.7Very low38.4Very low137 Ų137135 Ų13573%0.73380%0.799SS**  -176.4131.6108.7-90.6-30.5000111.7
322Q39.6Very low38.3Very low174 Ų174138 Ų13881%0.81381%0.809SS**  trans72.5104.3147.7-64.6176.123.200120.6
323A39.5Very low38.5Very low84 Ų84136 Ų13669%0.69481%0.811SS**  101.8117.1118.100000119.6
324T41.5Very low38.7Very low147 Ų147131.2 Ų131.290%0.90281%0.807SS**  trans92.5123.5147.670.90000120.9
325G37.1Very low38.8Very low67 Ų67132.1 Ų132.169%0.69181%0.81SS**  trans10081.9143.300000117.9
326S40.8Very low38.8Very low116 Ų116131.8 Ų131.881%0.81181%0.808SS**  80.3112.4105.2620000119.1
327A42.1Very low39.2Very low97 Ų97131.2 Ų131.280%0.80281%0.811SS**  trans56.8142.5133.300000120
328S42Very low38.9Very low111 Ų111131.2 Ų131.278%0.77681%0.811SS**  cis176.9160.517.3340000111.3
329A41.8Very low39.2Very low96 Ų96124.6 Ų124.679%0.79381%0.808SS**  trans71.8117.7149.800000120.1
330S41.4Very low38.9Very low98 Ų98121.1 Ų121.169%0.68580%0.8SS**  83115.568152.60000114.4
331Q42.8Very low39.3Very low188 Ų188120.9 Ų120.988%0.87980%0.804SS**  164.5143.8105.1-118.3161.519.600114.3
332N34.1Very low39.2Very low172 Ų172121.5 Ų121.592%0.9280%0.804SS**  trans-79158172.6-77.8-28.4000112.8
333G37.6Very low39.5Very low81 Ų81118.8 Ų118.884%0.83580%0.8SS**  trans-169.2118.1162.800000113
334A37Very low39.9Very low92 Ų92122 Ų12276%0.7681%0.805SS**  trans-86.1157.4178.800000112.4
335T38.5Very low40.4Very low143 Ų143123.6 Ų123.688%0.87780%0.802SS**  172.6138.7121.134.90000114.2
336S35.3Very low40.6Very low102 Ų102127.5 Ų127.571%0.71381%0.807SS**  trans-23.4150163.556.80000121.9
337T40Very low41Very low152 Ų152129.6 Ų129.693%0.93381%0.808SS**  -163140124.518.70000112
338S32.8Very low41.4Very low114 Ų114136 Ų13680%0.79783%0.829SS**  trans-98.1147.5-179.6-175.60000110.9
339A41.5Very low41.4Very low104 Ų104137.3 Ų137.386%0.8683%0.832SS**  trans-153.9123.8159.400000111.4
340T34.3Very low41.3Very low116 Ų116139.4 Ų139.471%0.71283%0.834SS**  trans-89.6139.9176.3-60.60000110.5
341V44.9Very low41.3Very low147 Ų147141.7 Ų141.789%0.89184%0.842SS**  trans-143.1133.6153179.70000109.3
342M39.3Very low41.3Very low151 Ų151139 Ų13974%0.74484%0.84SS**  trans-93.5147.1-176.4-68.4170.575.300112.3
343T44Very low41.7Very low117 Ų117136.9 Ų136.972%0.71884%0.835SS**  trans36.2131.6137.763.80000122.3
344D48.5Very low42Very low150 Ų150140.7 Ų140.780%0.80284%0.835SS**  trans-150.2115.2132.9-97.7-16.2000105.2
345E51.8Low42.3Very low181 Ų181144.1 Ų144.185%0.84684%0.841SS**  87.5131.380.5-87.3-162.8166.700113.8
346D42.7Very low42.6Very low150 Ų150144.2 Ų144.280%0.80284%0.838SS**  trans-63.2161.5-173.1-59.8-66.7000113.9
347L47.7Very low43.2Very low159 Ų159147.8 Ų147.883%0.83285%0.848SS**  trans178.9119.6130.4-92.7156.2000110.7
348D51.2Low43.5Very low232 Ų232147.4 Ų147.4100%1.24184%0.84SS**  trans600158.2-62.6-23.8000122.4

Retrieved 348 of 348 residues in 153.3 ms (Link to these results)

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