X2JI73_DROME Loading...

Dynein regulatory complex subunit 4

AlphaFold DB (Q8MT08), UniProt , Accession X2JI73, Species DROME (Drosophila melanogaster, Fruit fly), Gene Gas8, Length 479 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
1M41.6Very low37.1Very low217 Ų217160.5 Ų160.5100%1.06988%0.879SS**  0138.50-61.4177.794.500108.5
2P44.6Very low37Very low130 Ų130164.1 Ų164.184%0.84488%0.88SS**  -99.3138.7127.232.4-26.7000108.3
3P46.6Very low36.9Very low108 Ų108168.4 Ų168.470%0.70189%0.886SS**  trans-110157.8154.531-18.2000112.1
4K37.9Very low37.1Very low220 Ų220167.1 Ų167.196%0.95788%0.878SS**  trans-71.5160178.8-69.5168.7168.5171.60114.2
5G36.2Very low37.6Very low76 Ų76159.7 Ų159.778%0.78485%0.845SS**  trans146.5144.1150.900000112
6K36.4Very low38.6Very low219 Ų219156 Ų15695%0.95283%0.83SS**  cis-166.1163.63.5-119.3177.8-177.3175.60108.7
7K32.6Very low39.2Very low216 Ų216152.5 Ų152.594%0.93981%0.81SS**  trans-75.1161.4-176.7-73172.4166.9176.40116.1
8G33.5Very low40.4Very low78 Ų78148.6 Ų148.680%0.80479%0.789SS**  trans121.1138.5147.300000113.5
9K35.5Very low41.5Very low216 Ų216145.9 Ų145.994%0.93978%0.775SS**  cis-166150.828.9-156.2175.6-1741780109.6
10K31.9Very low42.8Very low212 Ų212141.8 Ų141.892%0.92277%0.768SS**  trans-82.8144.9175.5-81.7-179.3172.6178.50112.4
11G31.7Very low43.6Very low74 Ų74137.4 Ų137.476%0.76375%0.746SS**  trans128.8104.1135.600000118.1
12K35.4Very low44.5Very low203 Ų203130.4 Ų130.488%0.88371%0.713SS**  168144.4112.4-102.5178.8174.5177.80110L14K12-L14 PolarHBondContact O-N 3.26Å
13K36.6Very low45.5Very low220 Ų220125.3 Ų125.396%0.95768%0.68SS**  trans-56.1113.5-174.2-68179175.9-1780111.3
14L39.3Very low46.2Very low150 Ų150124.7 Ų124.779%0.78568%0.678SS**  trans-96.8149.5163.2-80.5144.8000107.8K12K12-L14 PolarHBondContact O-N 3.26Å
15P44.4Very low47.3Very low57 Ų57118.5 Ų118.537%0.3767%0.668SS.*  trans-54.4149175.820.7-27.5000110.1L17 D22P15-L17 VanDerWaalsContact C-N 3.27Å; P15-L17 HydrophobicContact CB-CD1 4.36Å; P15-L17 HydrophobicContact CG-CD1 3.87Å; P15-L17 VanDerWaalsContact O-CD1 3.28Å; P15-L17 WeakPolarHBondContact O-CD1 3.1Å; P15-L17 PolarHBondContact O-N 2.95Å; P15-D22 WeakPolarHBondContact CB-OD1 3.47Å; P15-D22 WeakPolarHBondContact CB-OD2 3.18Å; P15-D22 VanDerWaalsContact CG-OD2 3.27Å; P15-D22 WeakPolarHBondContact CG-OD2 3.06Å
16V53.8Low48.5Very low100 Ų100117.9 Ų117.961%0.60665%0.645SS**  trans-69.289.7-179.5175.20000108I18 T23V16-I18 HydrophobicContact CG1-CD1 4.14Å; V16-I18 HydrophobicContact CG1-CG1 3.87Å; V16-I18 PolarHBondContact O-N 2.97Å; V16-T23 PolarHBondContact O-OG1 2.68Å
17L49.3Very low49.9Very low96 Ų96111.5 Ų111.550%0.50363%0.625SS.*EExtended strand (participates in β ladder)trans-76.6108.2167.2-86.579000107.6P15 V21P15-L17 VanDerWaalsContact C-N 3.27Å; P15-L17 HydrophobicContact CB-CD1 4.36Å; P15-L17 HydrophobicContact CG-CD1 3.87Å; P15-L17 VanDerWaalsContact O-CD1 3.28Å; P15-L17 WeakPolarHBondContact O-CD1 3.1Å; P15-L17 PolarHBondContact O-N 2.95Å; L17-V21 WeakPolarHBondContact CA-O 3.37Å
18I60.7Low51.6Low83 Ų83110.1 Ų110.143%0.42661%0.614SS.*EExtended strand (participates in β ladder)trans-97.7121.9164.2-61.3173.1000104.5V16 G20 V21 T23 F34 L38V16-I18 HydrophobicContact CG1-CD1 4.14Å; V16-I18 HydrophobicContact CG1-CG1 3.87Å; V16-I18 PolarHBondContact O-N 2.97Å; I18-G20 PolarHBondContact O-N 3.1Å; I18-V21 PolarHBondContact N-O 3.08Å; I18-V21 PolarHBondContact O-N 2.82Å; I18-T23 HydrophobicContact CB-CG2 4.5Å; I18-F34 HydrophobicContact CB-CE1 4.05Å; I18-F34 HydrophobicContact CG2-CE1 4.02Å; I18-F34 WeakPolarHBondContact O-CE1 3.08Å; I18-F34 WeakPolarHBondContact O-CZ 3.49Å; I18-L38 HydrophobicContact CG2-CD1 3.67Å
19D61.7Low53.3Low98 Ų98112 Ų11252%0.52461%0.606SS.*THydrogen-bonded Turntrans46.649.3-177.2-15737.5000115.4V21 F34 L38D19-V21 VanDerWaalsContact C-N 3.29Å; D19-V21 PolarHBondContact O-N 3.35Å; D19-F34 HydrophobicContact CB-CZ 3.97Å; D19-L38 HydrophobicContact CB-CD1 3.76Å; D19-L38 HydrophobicContact CB-CD2 4.08Å; D19-L38 HydrophobicContact CB-CG 4.05Å
20G65.8Low54.9Low62 Ų62106.3 Ų106.364%0.63958%0.582SS**THydrogen-bonded Turntrans79.7-2.7173.500000116.2I18I18-G20 PolarHBondContact O-N 3.1Å
21V60.4Low56.6Low50 Ų5099.7 Ų99.730%0.30356%0.556SS.*EExtended strand (participates in β ladder)trans-111.2131.2-176.9-176.20000111.7L17 I18 D19 T23 M26 F34L17-V21 WeakPolarHBondContact CA-O 3.37Å; I18-V21 PolarHBondContact N-O 3.08Å; I18-V21 PolarHBondContact O-N 2.82Å; D19-V21 VanDerWaalsContact C-N 3.29Å; D19-V21 PolarHBondContact O-N 3.35Å; V21-T23 PolarHBondContact O-N 3.33Å; V21-M26 HydrophobicContact CG1-CE 3.64Å; V21-M26 HydrophobicContact CG1-SD 4.4Å; V21-F34 HydrophobicContact CB-CE1 4.49Å; V21-F34 HydrophobicContact CB-CE2 3.79Å; V21-F34 HydrophobicContact CB-CZ 3.76Å; V21-F34 HydrophobicContact CG1-CE2 4.41Å; V21-F34 HydrophobicContact CG2-CD2 4.41Å; V21-F34 HydrophobicContact CG2-CE2 3.49Å; V21-F34 VanDerWaalsContact CG2-CE2 3.49Å; V21-F34 HydrophobicContact CG2-CZ 3.8Å
22D61.5Low58.5Low70 Ų70100.8 Ų100.837%0.37454%0.542SS..EExtended strand (participates in β ladder)trans-76104176.8-167.7-16.8000110.5P15 S24P15-D22 WeakPolarHBondContact CB-OD1 3.47Å; P15-D22 WeakPolarHBondContact CB-OD2 3.18Å; P15-D22 VanDerWaalsContact CG-OD2 3.27Å; P15-D22 WeakPolarHBondContact CG-OD2 3.06Å; D22-S24 VanDerWaalsContact C-N 3.25Å; D22-S24 PolarHBondContact O-N 3.38Å; D22-S24 WeakPolarHBondContact OD1-CB 3.26Å; D22-S24 PolarHBondContact OD1-N 3.31Å; D22-S24 PolarHBondContact OD1-OG 3.08Å
23T63.7Low60.4Low23 Ų2394 Ų9414%0.14152%0.524CS..G310 helixtrans-77.2-6-17453.40000114.1V16 I18 V21 A25 M26 L31V16-T23 PolarHBondContact O-OG1 2.68Å; I18-T23 HydrophobicContact CB-CG2 4.5Å; V21-T23 PolarHBondContact O-N 3.33Å; T23-A25 VanDerWaalsContact C-N 3.33Å; T23-A25 PolarHBondContact O-N 3.19Å; T23-M26 PolarHBondContact O-N 3.4Å; T23-L31 HydrophobicContact CG2-CD2 3.9Å
24S62.7Low62.2Low95 Ų9584.9 Ų84.966%0.66448%0.484SS*.G310 helixtrans-75.8-13.7-170.863.10000115.5D22D22-S24 VanDerWaalsContact C-N 3.25Å; D22-S24 PolarHBondContact O-N 3.38Å; D22-S24 WeakPolarHBondContact OD1-CB 3.26Å; D22-S24 PolarHBondContact OD1-N 3.31Å; D22-S24 PolarHBondContact OD1-OG 3.08Å
25A60.1Low64Low91 Ų9180.5 Ų80.575%0.75247%0.47SS*.G310 helixtrans-112.85.2178.800000113.8T23T23-A25 VanDerWaalsContact C-N 3.33Å; T23-A25 PolarHBondContact O-N 3.19Å
26M62.2Low65.7Low62 Ų6283.5 Ų83.531%0.30548%0.482SS..  trans-87.3134.5-176.1-77.5-167.8163.600112.1V21 T23 Q30 L31V21-M26 HydrophobicContact CG1-CE 3.64Å; V21-M26 HydrophobicContact CG1-SD 4.4Å; T23-M26 PolarHBondContact O-N 3.4Å; M26-Q30 HydrophobicContact CB-CB 3.85Å; M26-Q30 HydrophobicContact CG-CB 3.97Å; M26-Q30 HydrophobicContact SD-CB 4.01Å; M26-L31 HydrophobicContact CB-CG 4.04Å
27T65.1Low67Low86 Ų8686.6 Ų86.653%0.52848%0.483SS..  trans-68.9160.317054.30000110.3D29 Q30 L31T27-D29 PolarHBondContact O-N 3.23Å; T27-D29 VanDerWaalsContact O-N 3.12Å; T27-Q30 WeakPolarHBondContact O-CB 3.42Å; T27-Q30 PolarHBondContact O-N 3.17Å; T27-L31 PolarHBondContact O-N 3.3Å; T27-L31 VanDerWaalsContact O-N 3.13Å
28R69Low68.4Low187 Ų18784.4 Ų84.471%0.70647%0.471SS*.Hα-helixtrans-47.9-43.8-178.6179.7-173.8164.3-169.9-6.9113Q30 L31 E32R28-Q30 VanDerWaalsContact C-N 3.32Å; R28-Q30 PolarHBondContact O-N 3.34Å; R28-L31 PolarHBondContact O-N 3.41Å; R28-E32 IonicContact CZ-OE1 3.56Å; R28-E32 IonicContact NE-OE1 3.09Å; R28-E32 PolarHBondContact NE-OE1 2.75Å; R28-E32 VanDerWaalsContact NE-OE1 3.09Å; R28-E32 IonicContact NH2-OE1 3.11Å; R28-E32 PolarHBondContact NH2-OE1 3.28Å; R28-E32 VanDerWaalsContact NH2-OE1 3.11Å; R28-E32 PolarHBondContact O-N 3.49Å
29D68Low69.4Low118 Ų11886.8 Ų86.863%0.63148%0.479SS*.Hα-helixtrans-66.3-33.8-179.1-61.7-12.5000112.5T27 E32 A33T27-D29 PolarHBondContact O-N 3.23Å; T27-D29 VanDerWaalsContact O-N 3.12Å; D29-E32 PolarHBondContact O-N 3.24Å; D29-A33 WeakPolarHBondContact O-CB 3.45Å; D29-A33 PolarHBondContact O-N 2.96Å
30Q69Low70.4Confident96 Ų9684.9 Ų84.945%0.44948%0.476SS..Hα-helixtrans-71.8-35.2177-69.8176.7-14.500112M26 T27 R28 F34M26-Q30 HydrophobicContact CB-CB 3.85Å; M26-Q30 HydrophobicContact CG-CB 3.97Å; M26-Q30 HydrophobicContact SD-CB 4.01Å; T27-Q30 WeakPolarHBondContact O-CB 3.42Å; T27-Q30 PolarHBondContact O-N 3.17Å; R28-Q30 VanDerWaalsContact C-N 3.32Å; R28-Q30 PolarHBondContact O-N 3.34Å; Q30-F34 WeakPolarHBondContact O-CB 3.06Å; Q30-F34 PolarHBondContact O-N 3.4Å
31L67.7Low71Confident72 Ų7285.7 Ų85.738%0.37746%0.463SS..Hα-helixtrans-68.9-39.4172.7-85.7163.4000112.5T23 M26 T27 R28 F34 A35T23-L31 HydrophobicContact CG2-CD2 3.9Å; M26-L31 HydrophobicContact CB-CG 4.04Å; T27-L31 PolarHBondContact O-N 3.3Å; T27-L31 VanDerWaalsContact O-N 3.13Å; R28-L31 PolarHBondContact O-N 3.41Å; L31-F34 PolarHBondContact O-N 3.45Å; L31-A35 WeakPolarHBondContact O-CB 3.43Å; L31-A35 PolarHBondContact O-N 3.2Å
32E72.1Confident72.1Confident98 Ų9887.6 Ų87.646%0.45847%0.47SS..Hα-helixtrans-63.7-43.1174.1-80.3-179.5-16600111.3R28 D29 A35 L36R28-E32 IonicContact CZ-OE1 3.56Å; R28-E32 IonicContact NE-OE1 3.09Å; R28-E32 PolarHBondContact NE-OE1 2.75Å; R28-E32 VanDerWaalsContact NE-OE1 3.09Å; R28-E32 IonicContact NH2-OE1 3.11Å; R28-E32 PolarHBondContact NH2-OE1 3.28Å; R28-E32 VanDerWaalsContact NH2-OE1 3.11Å; R28-E32 PolarHBondContact O-N 3.49Å; D29-E32 PolarHBondContact O-N 3.24Å; E32-A35 PolarHBondContact O-N 3.08Å; E32-L36 WeakPolarHBondContact O-CG 3.5Å; E32-L36 PolarHBondContact O-N 3.18Å
33A74.9Confident73.2Confident60 Ų6087.3 Ų87.350%0.49647%0.469SS..Hα-helixtrans-64.5-39.9175.200000112.7D29 L36 R37D29-A33 WeakPolarHBondContact O-CB 3.45Å; D29-A33 PolarHBondContact O-N 2.96Å; A33-L36 PolarHBondContact O-N 3.23Å; A33-R37 PolarHBondContact O-N 3.44Å
34F75.7Confident74.3Confident28 Ų2893.7 Ų93.712%0.12349%0.49CS..Hα-helixtrans-66.5-41.9177.4-169.5-108.8000112.1I18 D19 V21 Q30 L31 L36 R37 L38I18-F34 HydrophobicContact CB-CE1 4.05Å; I18-F34 HydrophobicContact CG2-CE1 4.02Å; I18-F34 WeakPolarHBondContact O-CE1 3.08Å; I18-F34 WeakPolarHBondContact O-CZ 3.49Å; D19-F34 HydrophobicContact CB-CZ 3.97Å; V21-F34 HydrophobicContact CB-CE1 4.49Å; V21-F34 HydrophobicContact CB-CE2 3.79Å; V21-F34 HydrophobicContact CB-CZ 3.76Å; V21-F34 HydrophobicContact CG1-CE2 4.41Å; V21-F34 HydrophobicContact CG2-CD2 4.41Å; V21-F34 HydrophobicContact CG2-CE2 3.49Å; V21-F34 VanDerWaalsContact CG2-CE2 3.49Å; V21-F34 HydrophobicContact CG2-CZ 3.8Å; Q30-F34 WeakPolarHBondContact O-CB 3.06Å; Q30-F34 PolarHBondContact O-N 3.4Å; L31-F34 PolarHBondContact O-N 3.45Å; F34-L36 VanDerWaalsContact C-N 3.33Å; F34-L36 PolarHBondContact O-N 3.42Å; F34-R37 PolarHBondContact O-N 2.69Å; F34-L38 HydrophobicContact CD1-CD1 3.77Å; F34-L38 HydrophobicContact CE1-CD1 3.22Å; F34-L38 HydrophobicContact CE2-CD1 4.4Å; F34-L38 HydrophobicContact CZ-CD1 3.59Å; F34-L38 PolarHBondContact O-N 2.72Å
35A75.9Confident75.2Confident59 Ų5994.3 Ų94.349%0.48848%0.482SS..Hα-helixtrans-62.9-38.2174.200000112.4L31 E32 K39L31-A35 WeakPolarHBondContact O-CB 3.43Å; L31-A35 PolarHBondContact O-N 3.2Å; E32-A35 PolarHBondContact O-N 3.08Å; A35-K39 WeakPolarHBondContact O-CB 3.37Å; A35-K39 PolarHBondContact O-N 3.44Å
36L79.8Confident76.4Confident120 Ų12097.2 Ų97.263%0.62847%0.474SS*.Hα-helixtrans-64.5-40.9174.6-78.8167.7000112.2E32 A33 F34 K39 A40E32-L36 WeakPolarHBondContact O-CG 3.5Å; E32-L36 PolarHBondContact O-N 3.18Å; A33-L36 PolarHBondContact O-N 3.23Å; F34-L36 VanDerWaalsContact C-N 3.33Å; F34-L36 PolarHBondContact O-N 3.42Å; L36-K39 PolarHBondContact O-N 2.85Å; L36-A40 PolarHBondContact O-N 3.39Å
37R81.4Confident77.6Confident164 Ų164100.9 Ų100.962%0.61949%0.49SS*.Hα-helixtrans-65.1-48.1176.9-174.6-179.2176.9160.61.7112.1A33 F34 K39 A40 E41A33-R37 PolarHBondContact O-N 3.44Å; F34-R37 PolarHBondContact O-N 2.69Å; R37-K39 PolarHBondContact O-N 3.36Å; R37-A40 WeakPolarHBondContact O-CB 3.32Å; R37-A40 PolarHBondContact O-N 3.31Å; R37-A40 VanDerWaalsContact O-N 3.08Å; R37-E41 IonicContact NE-OE1 3.34Å; R37-E41 PolarHBondContact NE-OE1 3.09Å; R37-E41 IonicContact NH2-OE1 3.86Å; R37-E41 PolarHBondContact O-N 3.26Å
38L78.2Confident78.6Confident50 Ų50100 Ų10026%0.26248%0.48SS..Hα-helixtrans-59.9-37.5176.6-111.1139.9000111.9I18 D19 F34 M42I18-L38 HydrophobicContact CG2-CD1 3.67Å; D19-L38 HydrophobicContact CB-CD1 3.76Å; D19-L38 HydrophobicContact CB-CD2 4.08Å; D19-L38 HydrophobicContact CB-CG 4.05Å; F34-L38 HydrophobicContact CD1-CD1 3.77Å; F34-L38 HydrophobicContact CE1-CD1 3.22Å; F34-L38 HydrophobicContact CE2-CD1 4.4Å; F34-L38 HydrophobicContact CZ-CD1 3.59Å; F34-L38 PolarHBondContact O-N 2.72Å; L38-M42 VanDerWaalsContact O-CB 3.29Å; L38-M42 WeakPolarHBondContact O-CB 3.25Å; L38-M42 PolarHBondContact O-N 3.37Å
39K81.9Confident79.4Confident134 Ų13498.6 Ų98.658%0.58348%0.475SS*.Hα-helixtrans-64.7-43.5173.9-168.9178.5177.9-175.40111.5A35 L36 R37 M42 D43A35-K39 WeakPolarHBondContact O-CB 3.37Å; A35-K39 PolarHBondContact O-N 3.44Å; L36-K39 PolarHBondContact O-N 2.85Å; R37-K39 PolarHBondContact O-N 3.36Å; K39-M42 WeakPolarHBondContact O-CB 3.2Å; K39-M42 PolarHBondContact O-N 3.24Å; K39-D43 WeakPolarHBondContact O-CB 3.1Å; K39-D43 VanDerWaalsContact O-CG 3.32Å; K39-D43 PolarHBondContact O-N 3.22Å
40A82.3Confident80.4Confident58 Ų5897.2 Ų97.248%0.47947%0.467SS..Hα-helixtrans-64.1-40.5176.700000112.8L36 R37 D43 R44L36-A40 PolarHBondContact O-N 3.39Å; R37-A40 WeakPolarHBondContact O-CB 3.32Å; R37-A40 PolarHBondContact O-N 3.31Å; R37-A40 VanDerWaalsContact O-N 3.08Å; A40-D43 PolarHBondContact O-N 3.46Å; A40-R44 WeakPolarHBondContact O-CB 3.13Å; A40-R44 PolarHBondContact O-N 2.77Å
41E79.9Confident81.5Confident78 Ų7898.9 Ų98.936%0.36447%0.471SS..Hα-helixtrans-67.1-40174.1-79.8175.8-16600111.7R37 D43 R44 E45R37-E41 IonicContact NE-OE1 3.34Å; R37-E41 PolarHBondContact NE-OE1 3.09Å; R37-E41 IonicContact NH2-OE1 3.86Å; R37-E41 PolarHBondContact O-N 3.26Å; E41-D43 VanDerWaalsContact C-N 3.34Å; E41-D43 PolarHBondContact O-N 3.42Å; E41-R44 PolarHBondContact O-N 2.87Å; E41-E45 WeakPolarHBondContact O-CB 3.49Å; E41-E45 WeakPolarHBondContact O-CG 3.12Å; E41-E45 PolarHBondContact O-N 3.4Å
42M82.9Confident82.6Confident90 Ų90101.8 Ų101.844%0.44348%0.48SS..Hα-helixtrans-60.3-41172.1-105.6-76.4-51.500112.9L38 K39 R46L38-M42 VanDerWaalsContact O-CB 3.29Å; L38-M42 WeakPolarHBondContact O-CB 3.25Å; L38-M42 PolarHBondContact O-N 3.37Å; K39-M42 WeakPolarHBondContact O-CB 3.2Å; K39-M42 PolarHBondContact O-N 3.24Å; M42-R46 HydrophobicContact CE-CG 4.49Å; M42-R46 WeakPolarHBondContact O-CB 3.45Å; M42-R46 VanDerWaalsContact O-CG 3.26Å; M42-R46 WeakPolarHBondContact O-CG 3.3Å; M42-R46 PolarHBondContact O-N 2.79Å
43D84.4Confident83.4Confident65 Ų65101.3 Ų101.335%0.34848%0.478SS..Hα-helixtrans-70-39.6178-72.2-26.8000110.8K39 A40 E41 R46 E47K39-D43 WeakPolarHBondContact O-CB 3.1Å; K39-D43 VanDerWaalsContact O-CG 3.32Å; K39-D43 PolarHBondContact O-N 3.22Å; A40-D43 PolarHBondContact O-N 3.46Å; E41-D43 VanDerWaalsContact C-N 3.34Å; E41-D43 PolarHBondContact O-N 3.42Å; D43-R46 WeakPolarHBondContact O-CB 3.47Å; D43-R46 PolarHBondContact O-N 2.61Å; D43-E47 WeakPolarHBondContact O-CG 3.35Å; D43-E47 PolarHBondContact O-N 3.17Å
44R86.6Confident84.2Confident157 Ų157102.9 Ų102.959%0.59248%0.478SS*.Hα-helixtrans-61.6-47.8172.9-174.4-174176.5121.24.6112.5A40 E41 R46 E47 E48A40-R44 WeakPolarHBondContact O-CB 3.13Å; A40-R44 PolarHBondContact O-N 2.77Å; E41-R44 PolarHBondContact O-N 2.87Å; R44-R46 PolarHBondContact O-N 2.89Å; R44-E47 WeakPolarHBondContact O-CB 3.12Å; R44-E47 PolarHBondContact O-N 3.38Å; R44-E47 VanDerWaalsContact O-N 3.1Å; R44-E48 IonicContact CZ-OE1 3.58Å; R44-E48 IonicContact NE-OE1 2.88Å; R44-E48 PolarHBondContact NE-OE1 2.79Å; R44-E48 IonicContact NH2-OE1 3.36Å; R44-E48 PolarHBondContact NH2-OE1 3.08Å; R44-E48 WeakPolarHBondContact O-CG 3.43Å; R44-E48 PolarHBondContact O-N 3.35Å
45E83Confident84.9Confident107 Ų107104.2 Ų104.250%0.548%0.484SS..Hα-helixtrans-62.5-30.5176.8-78-72.1158.300112E41 R49E41-E45 WeakPolarHBondContact O-CB 3.49Å; E41-E45 WeakPolarHBondContact O-CG 3.12Å; E41-E45 PolarHBondContact O-N 3.4Å; E45-R49 WeakPolarHBondContact O-CB 3.45Å; E45-R49 PolarHBondContact O-N 3.35Å
46R85.1Confident85.7Confident153 Ų153108.6 Ų108.658%0.57749%0.488SS*.Hα-helixtrans-70-43.2171.5-77.9173.1172.1-167.70.7111.9M42 D43 R44 R49 N50M42-R46 HydrophobicContact CE-CG 4.49Å; M42-R46 WeakPolarHBondContact O-CB 3.45Å; M42-R46 VanDerWaalsContact O-CG 3.26Å; M42-R46 WeakPolarHBondContact O-CG 3.3Å; M42-R46 PolarHBondContact O-N 2.79Å; D43-R46 WeakPolarHBondContact O-CB 3.47Å; D43-R46 PolarHBondContact O-N 2.61Å; R44-R46 PolarHBondContact O-N 2.89Å; R46-R49 PolarHBondContact O-N 2.88Å; R46-N50 VanDerWaalsContact O-CB 3.3Å; R46-N50 WeakPolarHBondContact O-CB 3.28Å; R46-N50 PolarHBondContact O-N 3.41Å
47E85.9Confident86.3Confident138 Ų138107 Ų10765%0.64548%0.481SS*.Hα-helixtrans-61.9-46.4175.4-72.8173.8-177.600111.5D43 R44 R49 N50 Y51D43-E47 WeakPolarHBondContact O-CG 3.35Å; D43-E47 PolarHBondContact O-N 3.17Å; R44-E47 WeakPolarHBondContact O-CB 3.12Å; R44-E47 PolarHBondContact O-N 3.38Å; R44-E47 VanDerWaalsContact O-N 3.1Å; E47-R49 PolarHBondContact O-N 3.39Å; E47-N50 PolarHBondContact O-N 3.45Å; E47-Y51 WeakPolarHBondContact O-CB 3.45Å; E47-Y51 PolarHBondContact O-N 3.4Å
48E86.3Confident86.9Confident67 Ų67104 Ų10431%0.31347%0.472SS..Hα-helixtrans-63.6-43.3177.9-71.5-177.7-170.300111.3R44 N50 Y51 F52R44-E48 IonicContact CZ-OE1 3.58Å; R44-E48 IonicContact NE-OE1 2.88Å; R44-E48 PolarHBondContact NE-OE1 2.79Å; R44-E48 IonicContact NH2-OE1 3.36Å; R44-E48 PolarHBondContact NH2-OE1 3.08Å; R44-E48 WeakPolarHBondContact O-CG 3.43Å; R44-E48 PolarHBondContact O-N 3.35Å; E48-N50 VanDerWaalsContact C-N 3.33Å; E48-N50 PolarHBondContact O-N 2.8Å; E48-Y51 WeakPolarHBondContact O-CB 3.37Å; E48-Y51 PolarHBondContact O-N 3.32Å; E48-F52 HydrophobicContact CB-CE2 4.49Å; E48-F52 WeakPolarHBondContact O-CD2 3.39Å; E48-F52 PolarHBondContact O-N 3.2Å
49R87.3Confident87.6Confident159 Ų159107 Ų10760%0.649%0.487SS*.Hα-helixtrans-63.7-38.2175.7-164.1-170.8-54.3-162.11.5112.3E45 R46 E47 Q53E45-R49 WeakPolarHBondContact O-CB 3.45Å; E45-R49 PolarHBondContact O-N 3.35Å; R46-R49 PolarHBondContact O-N 2.88Å; E47-R49 PolarHBondContact O-N 3.39Å; R49-Q53 WeakPolarHBondContact O-CB 3.48Å; R49-Q53 VanDerWaalsContact O-CG 3.31Å; R49-Q53 WeakPolarHBondContact O-CG 3.29Å; R49-Q53 PolarHBondContact O-N 3.39Å
50N88.9Confident88.1Confident88 Ų88108.4 Ų108.447%0.47149%0.488SS..Hα-helixtrans-65.7-45175-169.9-25.9000110.6R46 E47 E48 F52 Q53 L54R46-N50 VanDerWaalsContact O-CB 3.3Å; R46-N50 WeakPolarHBondContact O-CB 3.28Å; R46-N50 PolarHBondContact O-N 3.41Å; E47-N50 PolarHBondContact O-N 3.45Å; E48-N50 VanDerWaalsContact C-N 3.33Å; E48-N50 PolarHBondContact O-N 2.8Å; N50-F52 PolarHBondContact O-N 3.06Å; N50-Q53 WeakPolarHBondContact O-CB 3.43Å; N50-Q53 PolarHBondContact O-N 3.41Å; N50-Q53 VanDerWaalsContact O-N 3.13Å; N50-L54 WeakPolarHBondContact O-CG 3.46Å; N50-L54 PolarHBondContact O-N 3.04Å; N50-L54 WeakPolarHBondContact OD1-CD1 3.24Å
51Y91.3Very high88.6Confident132 Ų132108.9 Ų108.952%0.51849%0.486SS..Hα-helixtrans-57.2-49.2175.2179.9-98.9000112.2E47 E48 Q53 L54 E55E47-Y51 WeakPolarHBondContact O-CB 3.45Å; E47-Y51 PolarHBondContact O-N 3.4Å; E48-Y51 WeakPolarHBondContact O-CB 3.37Å; E48-Y51 PolarHBondContact O-N 3.32Å; Y51-Q53 VanDerWaalsContact C-N 3.29Å; Y51-Q53 PolarHBondContact O-N 3.48Å; Y51-L54 PolarHBondContact O-N 3.38Å; Y51-E55 HydrophobicContact CD1-CG 4.35Å; Y51-E55 HydrophobicContact CE1-CG 3.87Å; Y51-E55 HydrophobicContact CE2-CG 4.16Å; Y51-E55 PolarHBondContact O-N 3.15Å
52F90.6Very high89.3Confident132 Ų132111.6 Ų111.658%0.57950%0.496SS*.Hα-helixtrans-68.7-25177.3-71.6-60.5000113.7E48 N50 R56E48-F52 HydrophobicContact CB-CE2 4.49Å; E48-F52 WeakPolarHBondContact O-CD2 3.39Å; E48-F52 PolarHBondContact O-N 3.2Å; N50-F52 PolarHBondContact O-N 3.06Å; F52-R56 VanDerWaalsContact O-CB 3.26Å; F52-R56 WeakPolarHBondContact O-CB 3.23Å; F52-R56 PolarHBondContact O-N 3.47Å
53Q88.3Confident89.9Confident88 Ų88114.2 Ų114.241%0.41150%0.501SS..Hα-helixtrans-67.5-50169.4-82.4173.210.300110.8R49 N50 Y51 E55 R56 D57R49-Q53 WeakPolarHBondContact O-CB 3.48Å; R49-Q53 VanDerWaalsContact O-CG 3.31Å; R49-Q53 WeakPolarHBondContact O-CG 3.29Å; R49-Q53 PolarHBondContact O-N 3.39Å; N50-Q53 WeakPolarHBondContact O-CB 3.43Å; N50-Q53 PolarHBondContact O-N 3.41Å; N50-Q53 VanDerWaalsContact O-N 3.13Å; Y51-Q53 VanDerWaalsContact C-N 3.29Å; Y51-Q53 PolarHBondContact O-N 3.48Å; Q53-E55 PolarHBondContact O-N 3.32Å; Q53-R56 PolarHBondContact O-N 2.82Å; Q53-D57 PolarHBondContact O-N 3.44Å
54L91.8Very high90.4Very high94 Ų94115.6 Ų115.649%0.49251%0.506SS..Hα-helixtrans-61.1-43.4178.2-71.2170.7000112.7N50 Y51 D57 K58N50-L54 WeakPolarHBondContact O-CG 3.46Å; N50-L54 PolarHBondContact O-N 3.04Å; N50-L54 WeakPolarHBondContact OD1-CD1 3.24Å; Y51-L54 PolarHBondContact O-N 3.38Å; L54-D57 PolarHBondContact O-N 3.28Å; L54-K58 WeakPolarHBondContact O-CG 3.15Å; L54-K58 PolarHBondContact O-N 3.2Å
55E91.3Very high90.7Very high56 Ų56112 Ų11226%0.26250%0.498SS..Hα-helixtrans-65.8-40.4177.7-74.2-57130.600112.2Y51 Q53 K58 I59Y51-E55 HydrophobicContact CD1-CG 4.35Å; Y51-E55 HydrophobicContact CE1-CG 3.87Å; Y51-E55 HydrophobicContact CE2-CG 4.16Å; Y51-E55 PolarHBondContact O-N 3.15Å; Q53-E55 PolarHBondContact O-N 3.32Å; E55-K58 PolarHBondContact O-N 3.2Å; E55-K58 IonicContact OE1-NZ 3.77Å; E55-K58 PolarHBondContact OE1-NZ 3.38Å; E55-I59 WeakPolarHBondContact O-CG1 3.45Å; E55-I59 PolarHBondContact O-N 3.13Å
56R93.1Very high91.3Very high151 Ų151110.7 Ų110.757%0.5750%0.497SS*.Hα-helixtrans-62.2-44173.4170.3174.335.1142.6-5.7111.6F52 Q53 K58 I59 R60F52-R56 VanDerWaalsContact O-CB 3.26Å; F52-R56 WeakPolarHBondContact O-CB 3.23Å; F52-R56 PolarHBondContact O-N 3.47Å; Q53-R56 PolarHBondContact O-N 2.82Å; R56-K58 VanDerWaalsContact C-N 3.35Å; R56-I59 PolarHBondContact O-N 3.31Å; R56-R60 WeakPolarHBondContact O-CB 3.38Å; R56-R60 PolarHBondContact O-N 3.4Å
57D92.5Very high91.7Very high87 Ų87109.9 Ų109.947%0.46549%0.494SS..Hα-helixtrans-65.9-38.9179.3-69.8-16.3000110.9Q53 L54 R60 T61Q53-D57 PolarHBondContact O-N 3.44Å; L54-D57 PolarHBondContact O-N 3.28Å; D57-R60 WeakPolarHBondContact O-CB 3.45Å; D57-R60 PolarHBondContact O-N 2.79Å; D57-T61 WeakPolarHBondContact O-CG2 3.5Å; D57-T61 PolarHBondContact O-N 2.85Å; D57-T61 PolarHBondContact O-OG1 3.47Å
58K93.1Very high92.2Very high101 Ų101108.9 Ų108.944%0.43949%0.489SS..Hα-helixtrans-60.7-45.5171.4-75.7176.6-170.4169.70113L54 E55 R56 R60 T61 F62L54-K58 WeakPolarHBondContact O-CG 3.15Å; L54-K58 PolarHBondContact O-N 3.2Å; E55-K58 PolarHBondContact O-N 3.2Å; E55-K58 IonicContact OE1-NZ 3.77Å; E55-K58 PolarHBondContact OE1-NZ 3.38Å; R56-K58 VanDerWaalsContact C-N 3.35Å; K58-R60 PolarHBondContact O-N 2.81Å; K58-T61 WeakPolarHBondContact CA-OG1 3.37Å; K58-T61 PolarHBondContact O-N 3.45Å; K58-T61 PolarHBondContact O-OG1 3.44Å; K58-F62 WeakPolarHBondContact O-CD2 3.36Å; K58-F62 WeakPolarHBondContact O-CG 3.5Å; K58-F62 PolarHBondContact O-N 2.83Å
59I92.4Very high92.6Very high112 Ų112110.5 Ų110.557%0.57450%0.497SS*.Hα-helixtrans-63.3-38177.4-69.3168.8000110E55 R56 F62 W63E55-I59 WeakPolarHBondContact O-CG1 3.45Å; E55-I59 PolarHBondContact O-N 3.13Å; R56-I59 PolarHBondContact O-N 3.31Å; I59-F62 PolarHBondContact O-N 3.47Å; I59-W63 WeakPolarHBondContact O-CB 3.34Å; I59-W63 PolarHBondContact O-N 3Å
60R92.9Very high92.9Very high163 Ų163106.9 Ų106.962%0.61549%0.489SS*.Hα-helixtrans-65.2-44.4177.8-147.8178.4-156.1-141.52.1111.8R56 D57 K58 W63 E64R56-R60 WeakPolarHBondContact O-CB 3.38Å; R56-R60 PolarHBondContact O-N 3.4Å; D57-R60 WeakPolarHBondContact O-CB 3.45Å; D57-R60 PolarHBondContact O-N 2.79Å; K58-R60 PolarHBondContact O-N 2.81Å; R60-W63 PolarHBondContact O-N 3Å; R60-E64 WeakPolarHBondContact O-CG 3.21Å; R60-E64 PolarHBondContact O-N 3.27Å
61T93.4Very high93.2Very high68 Ų68106.4 Ų106.442%0.41749%0.486SS..Hα-helixtrans-64.8-41.9175.856.20000111.8D57 K58 W63 E64 I65D57-T61 WeakPolarHBondContact O-CG2 3.5Å; D57-T61 PolarHBondContact O-N 2.85Å; D57-T61 PolarHBondContact O-OG1 3.47Å; K58-T61 WeakPolarHBondContact CA-OG1 3.37Å; K58-T61 PolarHBondContact O-N 3.45Å; K58-T61 PolarHBondContact O-OG1 3.44Å; T61-W63 VanDerWaalsContact C-N 3.33Å; T61-W63 PolarHBondContact O-N 3.28Å; T61-E64 PolarHBondContact O-N 3.08Å; T61-I65 WeakPolarHBondContact O-CB 3.38Å; T61-I65 VanDerWaalsContact O-CG1 3.24Å; T61-I65 WeakPolarHBondContact O-CG1 3.49Å; T61-I65 PolarHBondContact O-N 3.25Å
62F94.3Very high93.4Very high135 Ų135104.6 Ų104.659%0.59248%0.482SS*.Hα-helixtrans-61.6-40.7174-73.3-46.9000112.6K58 I59 I65 T66K58-F62 WeakPolarHBondContact O-CD2 3.36Å; K58-F62 WeakPolarHBondContact O-CG 3.5Å; K58-F62 PolarHBondContact O-N 2.83Å; I59-F62 PolarHBondContact O-N 3.47Å; F62-I65 PolarHBondContact O-N 3.36Å; F62-T66 WeakPolarHBondContact O-CB 3.13Å; F62-T66 WeakPolarHBondContact O-CG2 3.42Å; F62-T66 PolarHBondContact O-N 2.98Å; F62-T66 PolarHBondContact O-OG1 3.12Å
63W95.2Very high93.5Very high145 Ų145101.5 Ų101.555%0.54948%0.475SS..Hα-helixtrans-65.2-41.6176.1-17880.8000112.1I59 R60 T61 T66 R67I59-W63 WeakPolarHBondContact O-CB 3.34Å; I59-W63 PolarHBondContact O-N 3Å; R60-W63 PolarHBondContact O-N 3Å; T61-W63 VanDerWaalsContact C-N 3.33Å; T61-W63 PolarHBondContact O-N 3.28Å; W63-T66 WeakPolarHBondContact CA-OG1 3.37Å; W63-T66 PolarHBondContact O-OG1 3.43Å; W63-R67 VanDerWaalsContact CH2-NH1 3.32Å; W63-R67 WeakPolarHBondContact O-CB 3.43Å; W63-R67 PolarHBondContact O-N 2.88Å
64E94.7Very high93.9Very high95 Ų95103.9 Ų103.944%0.44448%0.48SS..Hα-helixtrans-63.6-45175.9-73.8170.6-173.300111.6R60 T61 R67 Q68R60-E64 WeakPolarHBondContact O-CG 3.21Å; R60-E64 PolarHBondContact O-N 3.27Å; T61-E64 PolarHBondContact O-N 3.08Å; E64-R67 PolarHBondContact O-N 3.45Å; E64-Q68 WeakPolarHBondContact O-CB 3.48Å; E64-Q68 PolarHBondContact O-N 3.26Å
65I94.4Very high94Very high82 Ų82106.7 Ų106.742%0.42149%0.485SS..Hα-helixtrans-62.6-50.7177-67.9164.6000111T61 F62 R67 Q68 Q69T61-I65 WeakPolarHBondContact O-CB 3.38Å; T61-I65 VanDerWaalsContact O-CG1 3.24Å; T61-I65 WeakPolarHBondContact O-CG1 3.49Å; T61-I65 PolarHBondContact O-N 3.25Å; F62-I65 PolarHBondContact O-N 3.36Å; I65-R67 VanDerWaalsContact C-N 3.3Å; I65-R67 PolarHBondContact O-N 2.99Å; I65-Q68 PolarHBondContact O-N 3.49Å; I65-Q69 HydrophobicContact CG2-CG 4.39Å; I65-Q69 WeakPolarHBondContact O-CG 3.42Å; I65-Q69 PolarHBondContact O-N 3.1Å
66T93.8Very high94.2Very high78 Ų78109.9 Ų109.948%0.47950%0.5SS..Hα-helixtrans-66-34.6-178.447.20000112.2F62 W63 L70F62-T66 WeakPolarHBondContact O-CB 3.13Å; F62-T66 WeakPolarHBondContact O-CG2 3.42Å; F62-T66 PolarHBondContact O-N 2.98Å; F62-T66 PolarHBondContact O-OG1 3.12Å; W63-T66 WeakPolarHBondContact CA-OG1 3.37Å; W63-T66 PolarHBondContact O-OG1 3.43Å; T66-L70 WeakPolarHBondContact O-CB 3.33Å; T66-L70 PolarHBondContact O-N 3.04Å
67R95.1Very high94.3Very high136 Ų136108 Ų10851%0.51350%0.5SS..Hα-helixtrans-64.8-45.1171.6-179.3178.7171.6-168-2.1111.5W63 E64 I65 L70 D71W63-R67 VanDerWaalsContact CH2-NH1 3.32Å; W63-R67 WeakPolarHBondContact O-CB 3.43Å; W63-R67 PolarHBondContact O-N 2.88Å; E64-R67 PolarHBondContact O-N 3.45Å; I65-R67 VanDerWaalsContact C-N 3.3Å; I65-R67 PolarHBondContact O-N 2.99Å; R67-L70 WeakPolarHBondContact O-CB 3.33Å; R67-L70 PolarHBondContact O-N 3.47Å; R67-D71 PolarHBondContact O-N 2.89Å
68Q95.5Very high94.4Very high117 Ų117109.3 Ų109.355%0.54750%0.504SS..Hα-helixtrans-61.9-44.5177.2-173.2179.8-16.200111.3E64 I65 L70 D71 E72E64-Q68 WeakPolarHBondContact O-CB 3.48Å; E64-Q68 PolarHBondContact O-N 3.26Å; I65-Q68 PolarHBondContact O-N 3.49Å; Q68-L70 VanDerWaalsContact C-N 3.32Å; Q68-L70 PolarHBondContact O-N 3.12Å; Q68-D71 PolarHBondContact O-N 3.42Å; Q68-D71 VanDerWaalsContact O-N 3.15Å; Q68-E72 WeakPolarHBondContact CG-OE1 3.49Å; Q68-E72 PolarHBondContact NE2-OE1 2.94Å; Q68-E72 WeakPolarHBondContact O-CB 3.5Å; Q68-E72 WeakPolarHBondContact O-CG 3.44Å; Q68-E72 PolarHBondContact O-N 3.2Å
69Q94.6Very high94.5Very high102 Ų102108.9 Ų108.948%0.47750%0.504SS..Hα-helixtrans-61.5-37.8175.3-72.3174.4-17.300112.6I65 T73I65-Q69 HydrophobicContact CG2-CG 4.39Å; I65-Q69 WeakPolarHBondContact O-CG 3.42Å; I65-Q69 PolarHBondContact O-N 3.1Å; Q69-T73 WeakPolarHBondContact O-CB 3.46Å; Q69-T73 WeakPolarHBondContact O-CG2 3.49Å; Q69-T73 PolarHBondContact O-N 2.84Å; Q69-T73 PolarHBondContact O-OG1 3.45Å
70L94.3Very high94.7Very high83 Ų83109 Ų10944%0.43550%0.5SS..Hα-helixtrans-64.2-42.2174.2-175.276.7000111.4T66 R67 Q68 T73 R74T66-L70 WeakPolarHBondContact O-CB 3.33Å; T66-L70 PolarHBondContact O-N 3.04Å; R67-L70 WeakPolarHBondContact O-CB 3.33Å; R67-L70 PolarHBondContact O-N 3.47Å; Q68-L70 VanDerWaalsContact C-N 3.32Å; Q68-L70 PolarHBondContact O-N 3.12Å; L70-T73 WeakPolarHBondContact CA-OG1 3.39Å; L70-T73 PolarHBondContact O-OG1 2.98Å; L70-R74 WeakPolarHBondContact O-CB 3.41Å; L70-R74 WeakPolarHBondContact O-CG 3.38Å; L70-R74 PolarHBondContact O-N 3.25Å
71D95.5Very high94.8Very high77 Ų77105.9 Ų105.941%0.41250%0.495SS..Hα-helixtrans-69.7-38.1179.1-70.8-24.4000111.3R67 Q68 R74 Y75R67-D71 PolarHBondContact O-N 2.89Å; Q68-D71 PolarHBondContact O-N 3.42Å; Q68-D71 VanDerWaalsContact O-N 3.15Å; D71-R74 PolarHBondContact O-N 3.02Å; D71-Y75 PolarHBondContact O-N 2.92Å
72E94.6Very high94.9Very high94 Ų94109.5 Ų109.544%0.43951%0.505SS..Hα-helixtrans-61.7-51173-74.5169.3-173.600111.5Q68 R74 Y75 E76Q68-E72 WeakPolarHBondContact CG-OE1 3.49Å; Q68-E72 PolarHBondContact NE2-OE1 2.94Å; Q68-E72 WeakPolarHBondContact O-CB 3.5Å; Q68-E72 WeakPolarHBondContact O-CG 3.44Å; Q68-E72 PolarHBondContact O-N 3.2Å; E72-R74 VanDerWaalsContact C-N 3.31Å; E72-R74 PolarHBondContact O-N 3.43Å; E72-Y75 WeakPolarHBondContact O-CB 3.3Å; E72-Y75 PolarHBondContact O-N 3.29Å; E72-Y75 VanDerWaalsContact O-N 3.1Å; E72-E76 WeakPolarHBondContact O-CG 3.48Å; E72-E76 PolarHBondContact O-N 2.76Å
73T93.7Very high94.9Very high68 Ų68107.1 Ų107.142%0.41750%0.496SS..Hα-helixtrans-64-33.9178.350.20000113.1Q69 L70 E76 L77Q69-T73 WeakPolarHBondContact O-CB 3.46Å; Q69-T73 WeakPolarHBondContact O-CG2 3.49Å; Q69-T73 PolarHBondContact O-N 2.84Å; Q69-T73 PolarHBondContact O-OG1 3.45Å; L70-T73 WeakPolarHBondContact CA-OG1 3.39Å; L70-T73 PolarHBondContact O-OG1 2.98Å; T73-E76 PolarHBondContact O-N 3.36Å; T73-L77 WeakPolarHBondContact O-CB 3.47Å; T73-L77 PolarHBondContact O-N 3.47Å
74R95Very high94.9Very high137 Ų137104.4 Ų104.452%0.51749%0.491SS..Hα-helixtrans-65.2-40.4172.3-79.3172.2172.6-175.8-2.7112.1L70 D71 E72 L77 Q78L70-R74 WeakPolarHBondContact O-CB 3.41Å; L70-R74 WeakPolarHBondContact O-CG 3.38Å; L70-R74 PolarHBondContact O-N 3.25Å; D71-R74 PolarHBondContact O-N 3.02Å; E72-R74 VanDerWaalsContact C-N 3.31Å; E72-R74 PolarHBondContact O-N 3.43Å; R74-L77 PolarHBondContact O-N 3.4Å; R74-Q78 WeakPolarHBondContact O-CG 3.44Å; R74-Q78 PolarHBondContact O-N 2.95Å; R74-Q78 VanDerWaalsContact O-N 3.09Å
75Y95.5Very high94.9Very high154 Ų154105.5 Ų105.560%0.60450%0.496SS*.Hα-helixtrans-65.8-43.3176.1-175.6-95.2000111.4D71 E72 L77 Q78 Q79D71-Y75 PolarHBondContact O-N 2.92Å; E72-Y75 WeakPolarHBondContact O-CB 3.3Å; E72-Y75 PolarHBondContact O-N 3.29Å; E72-Y75 VanDerWaalsContact O-N 3.1Å; Y75-L77 PolarHBondContact O-N 2.96Å; Y75-Q78 PolarHBondContact O-N 3.12Å; Y75-Q79 WeakPolarHBondContact O-CB 3.48Å; Y75-Q79 PolarHBondContact O-N 3.42Å
76E95Very high94.9Very high123 Ų123104 Ų10458%0.57550%0.497SS*.Hα-helixtrans-59.6-43.8175-71.5178.2172.900112.3E72 T73 Q79 K80E72-E76 WeakPolarHBondContact O-CG 3.48Å; E72-E76 PolarHBondContact O-N 2.76Å; T73-E76 PolarHBondContact O-N 3.36Å; E76-Q79 PolarHBondContact O-N 3.15Å; E76-K80 WeakPolarHBondContact O-CG 3.39Å; E76-K80 PolarHBondContact O-N 3.12Å
77L94.3Very high95Very high110 Ų110104.5 Ų104.558%0.57650%0.499SS*.Hα-helixtrans-58.7-48.2174.8-93.2159000111.8T73 R74 Y75 Q79 K80 D81T73-L77 WeakPolarHBondContact O-CB 3.47Å; T73-L77 PolarHBondContact O-N 3.47Å; R74-L77 PolarHBondContact O-N 3.4Å; Y75-L77 PolarHBondContact O-N 2.96Å; L77-Q79 VanDerWaalsContact C-N 3.26Å; L77-Q79 PolarHBondContact O-N 3.13Å; L77-K80 PolarHBondContact O-N 3.46Å; L77-K80 VanDerWaalsContact O-N 3.14Å; L77-D81 PolarHBondContact O-N 3.3Å
78Q95.6Very high95Very high116 Ų116103.5 Ų103.554%0.54250%0.501SS..Hα-helixtrans-62.5-34.8177-72.3178.55.800112.5R74 Y75 K82R74-Q78 WeakPolarHBondContact O-CG 3.44Å; R74-Q78 PolarHBondContact O-N 2.95Å; R74-Q78 VanDerWaalsContact O-N 3.09Å; Y75-Q78 PolarHBondContact O-N 3.12Å; Q78-K82 WeakPolarHBondContact O-CG 3.49Å; Q78-K82 PolarHBondContact O-N 2.89Å
79Q95.2Very high95Very high92 Ų92102.4 Ų102.443%0.4350%0.498SS..Hα-helixtrans-68.9-39.3175.8-170.2164.2-5.700111.2Y75 E76 L77 K82 E83Y75-Q79 WeakPolarHBondContact O-CB 3.48Å; Y75-Q79 PolarHBondContact O-N 3.42Å; E76-Q79 PolarHBondContact O-N 3.15Å; L77-Q79 VanDerWaalsContact C-N 3.26Å; L77-Q79 PolarHBondContact O-N 3.13Å; Q79-K82 PolarHBondContact O-N 3.47Å; Q79-E83 WeakPolarHBondContact O-CG 3.43Å; Q79-E83 PolarHBondContact O-N 2.97Å
80K95.6Very high95.1Very high115 Ų115102.8 Ų102.850%0.550%0.503SS..Hα-helixtrans-66.5-39174.3-69.7-67167.5-158.90113.1E76 L77 K82 E83 I84E76-K80 WeakPolarHBondContact O-CG 3.39Å; E76-K80 PolarHBondContact O-N 3.12Å; L77-K80 PolarHBondContact O-N 3.46Å; L77-K80 VanDerWaalsContact O-N 3.14Å; K80-K82 VanDerWaalsContact C-N 3.31Å; K80-K82 PolarHBondContact O-N 3.39Å; K80-E83 WeakPolarHBondContact CD-OE2 3.42Å; K80-E83 IonicContact NZ-OE1 2.77Å; K80-E83 IonicContact NZ-OE2 3.72Å; K80-E83 PolarHBondContact NZ-OE2 2.88Å; K80-E83 PolarHBondContact O-N 2.9Å; K80-I84 WeakPolarHBondContact O-CG1 3.38Å; K80-I84 PolarHBondContact O-N 3.46Å
81D95.1Very high95.1Very high97 Ų97101.1 Ų101.152%0.51950%0.501SS..Hα-helixtrans-61.3-41.7174.7-71.7-26.9000111.4L77 I84 E85L77-D81 PolarHBondContact O-N 3.3Å; D81-I84 PolarHBondContact O-N 3.27Å; D81-E85 PolarHBondContact O-N 3.38Å
82K95.5Very high95.2Very high144 Ų144101.9 Ų101.963%0.62651%0.505SS*.Hα-helixtrans-65.2-38.4174.3-71.8176.6-177.2178.50113Q78 Q79 K80 I84 E85 A86Q78-K82 WeakPolarHBondContact O-CG 3.49Å; Q78-K82 PolarHBondContact O-N 2.89Å; Q79-K82 PolarHBondContact O-N 3.47Å; K80-K82 VanDerWaalsContact C-N 3.31Å; K80-K82 PolarHBondContact O-N 3.39Å; K82-I84 VanDerWaalsContact C-N 3.35Å; K82-E85 PolarHBondContact O-N 3.33Å; K82-A86 WeakPolarHBondContact O-CB 3.28Å; K82-A86 PolarHBondContact O-N 3.18Å
83E95Very high95.3Very high85 Ų85102.1 Ų102.140%0.39751%0.509SS..Hα-helixtrans-63.3-42.6174.5-75.6173.7-166.600110.9Q79 K80 A86 T87Q79-E83 WeakPolarHBondContact O-CG 3.43Å; Q79-E83 PolarHBondContact O-N 2.97Å; K80-E83 WeakPolarHBondContact CD-OE2 3.42Å; K80-E83 IonicContact NZ-OE1 2.77Å; K80-E83 IonicContact NZ-OE2 3.72Å; K80-E83 PolarHBondContact NZ-OE2 2.88Å; K80-E83 PolarHBondContact O-N 2.9Å; E83-A86 PolarHBondContact O-N 3.12Å; E83-T87 WeakPolarHBondContact O-CG2 3.38Å; E83-T87 PolarHBondContact O-N 2.86Å; E83-T87 PolarHBondContact O-OG1 3.18Å
84I94.8Very high95.3Very high87 Ų87103.9 Ų103.945%0.44652%0.515SS..Hα-helixtrans-61.3-49176.5-68.9166.6000110.4K80 D81 K82 A86 T87 Q88K80-I84 WeakPolarHBondContact O-CG1 3.38Å; K80-I84 PolarHBondContact O-N 3.46Å; D81-I84 PolarHBondContact O-N 3.27Å; K82-I84 VanDerWaalsContact C-N 3.35Å; I84-A86 PolarHBondContact O-N 3.45Å; I84-T87 PolarHBondContact O-N 3.42Å; I84-T87 PolarHBondContact O-OG1 3.03Å; I84-Q88 HydrophobicContact CG2-CG 4.48Å; I84-Q88 WeakPolarHBondContact O-CG 3.45Å; I84-Q88 PolarHBondContact O-N 2.86Å
85E95.4Very high95.4Very high119 Ų119101 Ų10156%0.55651%0.513SS*.Hα-helixtrans-57.3-47.4178.2-170.2175.6-163.700111.4D81 K82 T87 Q88 D89D81-E85 PolarHBondContact O-N 3.38Å; K82-E85 PolarHBondContact O-N 3.33Å; E85-T87 VanDerWaalsContact C-N 3.33Å; E85-T87 PolarHBondContact O-N 3.15Å; E85-Q88 PolarHBondContact O-N 3.23Å; E85-Q88 VanDerWaalsContact O-N 3.15Å; E85-D89 PolarHBondContact O-N 3.39Å
86A95Very high95.4Very high51 Ų5199.8 Ų99.842%0.42151%0.511SS..Hα-helixtrans-62.3-37.4177.600000113.2K82 E83 I84 L90K82-A86 WeakPolarHBondContact O-CB 3.28Å; K82-A86 PolarHBondContact O-N 3.18Å; E83-A86 PolarHBondContact O-N 3.12Å; I84-A86 PolarHBondContact O-N 3.45Å; A86-L90 PolarHBondContact O-N 3.5Å
87T95.4Very high95.5Very high87 Ų8798.8 Ų98.853%0.53451%0.506SS..Hα-helixtrans-70.7-33.3175.658.80000112.8E83 I84 E85 A91E83-T87 WeakPolarHBondContact O-CG2 3.38Å; E83-T87 PolarHBondContact O-N 2.86Å; E83-T87 PolarHBondContact O-OG1 3.18Å; I84-T87 PolarHBondContact O-N 3.42Å; I84-T87 PolarHBondContact O-OG1 3.03Å; E85-T87 VanDerWaalsContact C-N 3.33Å; E85-T87 PolarHBondContact O-N 3.15Å; T87-A91 WeakPolarHBondContact O-CB 3.47Å; T87-A91 PolarHBondContact O-N 3.12Å
88Q95.6Very high95.6Very high116 Ų11697.8 Ų97.854%0.54251%0.505SS..Hα-helixtrans-67.6-43.3174.2-75.2177.2-15.100111.2I84 E85 L90 A91 D92I84-Q88 HydrophobicContact CG2-CG 4.48Å; I84-Q88 WeakPolarHBondContact O-CG 3.45Å; I84-Q88 PolarHBondContact O-N 2.86Å; E85-Q88 PolarHBondContact O-N 3.23Å; E85-Q88 VanDerWaalsContact O-N 3.15Å; Q88-L90 VanDerWaalsContact C-N 3.31Å; Q88-L90 PolarHBondContact O-N 2.97Å; Q88-A91 PolarHBondContact O-N 3.15Å; Q88-D92 PolarHBondContact O-N 3.3Å
89D95.5Very high95.6Very high93 Ų9397 Ų9750%0.49750%0.502SS..Hα-helixtrans-58.6-42.8175.8-77.6-21.3000112.1E85 D92 I93E85-D89 PolarHBondContact O-N 3.39Å; D89-D92 PolarHBondContact O-N 2.86Å; D89-I93 VanDerWaalsContact O-CG1 3.28Å; D89-I93 WeakPolarHBondContact O-CG1 3.34Å; D89-I93 PolarHBondContact O-N 2.93Å
90L95.8Very high95.7Very high110 Ų11098.1 Ų98.158%0.57651%0.507SS*.Hα-helixtrans-63.1-46175.1-77167.7000111.8A86 Q88 D92 I93 D94A86-L90 PolarHBondContact O-N 3.5Å; Q88-L90 VanDerWaalsContact C-N 3.31Å; Q88-L90 PolarHBondContact O-N 2.97Å; L90-D92 VanDerWaalsContact C-N 3.29Å; L90-D92 PolarHBondContact O-N 3.43Å; L90-I93 PolarHBondContact O-N 3.28Å; L90-D94 PolarHBondContact O-N 2.98Å
91A95.1Very high95.8Very high49 Ų4997.4 Ų97.441%0.40551%0.506SS..Hα-helixtrans-62-36.9177.600000112.3T87 Q88 D94 T95T87-A91 WeakPolarHBondContact O-CB 3.47Å; T87-A91 PolarHBondContact O-N 3.12Å; Q88-A91 PolarHBondContact O-N 3.15Å; A91-D94 PolarHBondContact O-N 3.4Å; A91-T95 WeakPolarHBondContact O-CB 3.28Å; A91-T95 PolarHBondContact O-N 2.79Å; A91-T95 PolarHBondContact O-OG1 3.02Å
92D96.3Very high95.8Very high92 Ų9298.3 Ų98.349%0.49251%0.508SS..Hα-helixtrans-66.9-38.7176-86.81.4000112.2Q88 D89 L90 K96Q88-D92 PolarHBondContact O-N 3.3Å; D89-D92 PolarHBondContact O-N 2.86Å; L90-D92 VanDerWaalsContact C-N 3.29Å; L90-D92 PolarHBondContact O-N 3.43Å; D92-K96 WeakPolarHBondContact O-CB 3.45Å; D92-K96 WeakPolarHBondContact O-CD 3.34Å; D92-K96 VanDerWaalsContact O-CG 3.24Å; D92-K96 WeakPolarHBondContact O-CG 3.48Å; D92-K96 PolarHBondContact O-N 2.86Å
93I96.5Very high95.9Very high100 Ų10098.3 Ų98.351%0.51351%0.508SS..Hα-helixtrans-64.8-47.1174.4-68.4165000110.3D89 L90 T95 K96 H97D89-I93 VanDerWaalsContact O-CG1 3.28Å; D89-I93 WeakPolarHBondContact O-CG1 3.34Å; D89-I93 PolarHBondContact O-N 2.93Å; L90-I93 PolarHBondContact O-N 3.28Å; I93-T95 VanDerWaalsContact C-N 3.35Å; I93-T95 PolarHBondContact O-N 3.24Å; I93-K96 WeakPolarHBondContact O-CB 3.38Å; I93-K96 PolarHBondContact O-N 2.81Å; I93-H97 PolarHBondContact O-N 2.94Å
94D95Very high95.9Very high104 Ų10499.6 Ų99.656%0.55651%0.514SS*.Hα-helixtrans-62.1-43178.6-77-14.8000111.5L90 A91 K96 H97 V98L90-D94 PolarHBondContact O-N 2.98Å; A91-D94 PolarHBondContact O-N 3.4Å; D94-K96 VanDerWaalsContact C-N 3.31Å; D94-K96 PolarHBondContact O-N 3.06Å; D94-H97 PolarHBondContact O-N 3.34Å; D94-V98 WeakPolarHBondContact O-CG2 3.37Å; D94-V98 PolarHBondContact O-N 3.42Å
95T95.8Very high96.1Very high77 Ų77100.1 Ų100.147%0.47252%0.517SS..Hα-helixtrans-60.9-42176.3-54.80000110.8A91 I93 V98 M99A91-T95 WeakPolarHBondContact O-CB 3.28Å; A91-T95 PolarHBondContact O-N 2.79Å; A91-T95 PolarHBondContact O-OG1 3.02Å; I93-T95 VanDerWaalsContact C-N 3.35Å; I93-T95 PolarHBondContact O-N 3.24Å; T95-V98 PolarHBondContact O-N 3.2Å; T95-M99 HydrophobicContact CG2-CE 4.02Å; T95-M99 WeakPolarHBondContact O-CB 3.49Å; T95-M99 WeakPolarHBondContact O-CG 3.09Å; T95-M99 PolarHBondContact O-N 2.9Å
96K96.9Very high96.1Very high129 Ų129100 Ų10056%0.56152%0.516SS*.Hα-helixtrans-63-42.9174.9-74.6166.2-173.2162.30112D92 I93 D94 M99 Q100D92-K96 WeakPolarHBondContact O-CB 3.45Å; D92-K96 WeakPolarHBondContact O-CD 3.34Å; D92-K96 VanDerWaalsContact O-CG 3.24Å; D92-K96 WeakPolarHBondContact O-CG 3.48Å; D92-K96 PolarHBondContact O-N 2.86Å; I93-K96 WeakPolarHBondContact O-CB 3.38Å; I93-K96 PolarHBondContact O-N 2.81Å; D94-K96 VanDerWaalsContact C-N 3.31Å; D94-K96 PolarHBondContact O-N 3.06Å; K96-M99 HydrophobicContact CG-CE 4.22Å; K96-M99 PolarHBondContact O-N 3.36Å; K96-Q100 WeakPolarHBondContact O-CB 3.44Å; K96-Q100 PolarHBondContact O-N 3.26Å
97H96.4Very high96.2Very high102 Ų102103.8 Ų103.847%0.47252%0.524SS..Hα-helixtrans-63.2-47.1178-179.8-103.3000111.7I93 D94 M99 Q100 Q101I93-H97 PolarHBondContact O-N 2.94Å; D94-H97 PolarHBondContact O-N 3.34Å; H97-M99 PolarHBondContact O-N 2.94Å; H97-Q100 PolarHBondContact O-N 2.81Å; H97-Q100 VanDerWaalsContact O-N 3.16Å; H97-Q101 VanDerWaalsContact CE1-CD 3.42Å; H97-Q101 PolarHBondContact CE1-NE2 3.43Å; H97-Q101 WeakPolarHBondContact O-CG 3.37Å; H97-Q101 PolarHBondContact O-N 3.23Å
98V95.8Very high96.3Very high89 Ų89103.3 Ų103.354%0.53952%0.516SS..Hα-helixtrans-61.3-43.2176.2173.40000111.3D94 T95 Q100 Q101 M102D94-V98 WeakPolarHBondContact O-CG2 3.37Å; D94-V98 PolarHBondContact O-N 3.42Å; T95-V98 PolarHBondContact O-N 3.2Å; V98-Q100 VanDerWaalsContact C-N 3.31Å; V98-Q100 PolarHBondContact O-N 2.91Å; V98-Q101 PolarHBondContact O-N 3.01Å; V98-M102 WeakPolarHBondContact O-CB 3.46Å; V98-M102 PolarHBondContact O-N 3.36Å
99M96.5Very high96.3Very high100 Ų100102.3 Ų102.349%0.49351%0.514SS..Hα-helixtrans-60.5-39.9175.2-78.8-169.9-70.100112.3T95 K96 H97 M102 K103T95-M99 HydrophobicContact CG2-CE 4.02Å; T95-M99 WeakPolarHBondContact O-CB 3.49Å; T95-M99 WeakPolarHBondContact O-CG 3.09Å; T95-M99 PolarHBondContact O-N 2.9Å; K96-M99 HydrophobicContact CG-CE 4.22Å; K96-M99 PolarHBondContact O-N 3.36Å; H97-M99 PolarHBondContact O-N 2.94Å; M99-M102 PolarHBondContact O-N 3.22Å; M99-K103 WeakPolarHBondContact O-CG 3.3Å; M99-K103 PolarHBondContact O-N 3.39Å
100Q96.6Very high96.4Very high115 Ų115104.4 Ų104.454%0.53752%0.521SS..Hα-helixtrans-68.5-42.4177.7-174171.20.700111.8K96 H97 V98 M102 K103 H104K96-Q100 WeakPolarHBondContact O-CB 3.44Å; K96-Q100 PolarHBondContact O-N 3.26Å; H97-Q100 PolarHBondContact O-N 2.81Å; H97-Q100 VanDerWaalsContact O-N 3.16Å; V98-Q100 VanDerWaalsContact C-N 3.31Å; V98-Q100 PolarHBondContact O-N 2.91Å; Q100-M102 VanDerWaalsContact C-N 3.33Å; Q100-M102 PolarHBondContact O-N 2.86Å; Q100-K103 PolarHBondContact O-N 3.11Å; Q100-H104 PolarHBondContact O-CD2 3.44Å; Q100-H104 VanDerWaalsContact O-CD2 3.23Å; Q100-H104 PolarHBondContact O-N 3.44Å
101Q97Very high96.4Very high100 Ų100102.3 Ų102.347%0.46751%0.51SS..Hα-helixtrans-59.5-43.4173.6-72.5-174.7-2700111.8H97 V98 K103 H104 L105H97-Q101 VanDerWaalsContact CE1-CD 3.42Å; H97-Q101 PolarHBondContact CE1-NE2 3.43Å; H97-Q101 WeakPolarHBondContact O-CG 3.37Å; H97-Q101 PolarHBondContact O-N 3.23Å; V98-Q101 PolarHBondContact O-N 3.01Å; Q101-K103 VanDerWaalsContact C-N 3.35Å; Q101-K103 PolarHBondContact O-N 3.2Å; Q101-H104 PolarHBondContact O-N 2.88Å; Q101-L105 WeakPolarHBondContact O-CG 3.36Å; Q101-L105 PolarHBondContact O-N 2.87Å
102M96Very high96.5Very high115 Ų115106 Ų10657%0.56751%0.513SS*.Hα-helixtrans-61.8-42.2176.7-170.3179.5-174.300111.8V98 M99 Q100 L105 Q106V98-M102 WeakPolarHBondContact O-CB 3.46Å; V98-M102 PolarHBondContact O-N 3.36Å; M99-M102 PolarHBondContact O-N 3.22Å; Q100-M102 VanDerWaalsContact C-N 3.33Å; Q100-M102 PolarHBondContact O-N 2.86Å; M102-L105 PolarHBondContact O-N 3.29Å; M102-Q106 WeakPolarHBondContact O-CB 3.43Å; M102-Q106 VanDerWaalsContact O-CG 3.32Å; M102-Q106 WeakPolarHBondContact O-CG 3.49Å; M102-Q106 PolarHBondContact O-N 3.04Å
103K97Very high96.5Very high145 Ų145105.9 Ų105.963%0.6351%0.512SS*.Hα-helixtrans-62.1-43.3175-75.6176.1-178.41780112.1M99 Q100 Q101 Q106 F107M99-K103 WeakPolarHBondContact O-CG 3.3Å; M99-K103 PolarHBondContact O-N 3.39Å; Q100-K103 PolarHBondContact O-N 3.11Å; Q101-K103 VanDerWaalsContact C-N 3.35Å; Q101-K103 PolarHBondContact O-N 3.2Å; K103-Q106 PolarHBondContact O-N 3.08Å; K103-F107 WeakPolarHBondContact O-CB 3.35Å; K103-F107 PolarHBondContact O-N 2.95Å
104H96.5Very high96.5Very high112 Ų112103 Ų10352%0.51951%0.508SS..Hα-helixtrans-63.1-46.4176.4-78.2-59.1000112Q100 Q101 Q106 F107 E108Q100-H104 PolarHBondContact O-CD2 3.44Å; Q100-H104 VanDerWaalsContact O-CD2 3.23Å; Q100-H104 PolarHBondContact O-N 3.44Å; Q101-H104 PolarHBondContact O-N 2.88Å; H104-Q106 VanDerWaalsContact C-N 3.32Å; H104-Q106 PolarHBondContact O-N 3.31Å; H104-F107 PolarHBondContact O-N 3.01Å; H104-E108 WeakPolarHBondContact O-CB 3.28Å; H104-E108 PolarHBondContact O-N 3.32Å
105L97.1Very high96.5Very high98 Ų98103.6 Ų103.651%0.51351%0.507SS..Hα-helixtrans-60.7-39.7176.5-78.6166000112.4Q101 M102 N109Q101-L105 WeakPolarHBondContact O-CG 3.36Å; Q101-L105 PolarHBondContact O-N 2.87Å; M102-L105 PolarHBondContact O-N 3.29Å; L105-N109 WeakPolarHBondContact O-CB 3.48Å; L105-N109 PolarHBondContact O-N 2.83Å; L105-N109 PolarHBondContact O-ND2 3.28Å
106Q96.5Very high96.5Very high115 Ų115104.2 Ų104.254%0.53751%0.51SS..Hα-helixtrans-64.8-44.1175.6-77.3179.5-13.600112.1M102 K103 H104 H110M102-Q106 WeakPolarHBondContact O-CB 3.43Å; M102-Q106 VanDerWaalsContact O-CG 3.32Å; M102-Q106 WeakPolarHBondContact O-CG 3.49Å; M102-Q106 PolarHBondContact O-N 3.04Å; K103-Q106 PolarHBondContact O-N 3.08Å; H104-Q106 VanDerWaalsContact C-N 3.32Å; H104-Q106 PolarHBondContact O-N 3.31Å; Q106-H110 WeakPolarHBondContact O-CB 3.21Å; Q106-H110 PolarHBondContact O-N 3.18Å
107F97.6Very high96.5Very high132 Ų132106.1 Ų106.158%0.57951%0.514SS*.Hα-helixtrans-64.3-44.1177.3-179.3-103000111.8K103 H104 H110 N111K103-F107 WeakPolarHBondContact O-CB 3.35Å; K103-F107 PolarHBondContact O-N 2.95Å; H104-F107 PolarHBondContact O-N 3.01Å; F107-H110 PolarHBondContact O-N 3.46Å; F107-N111 WeakPolarHBondContact CE1-ND2 3.39Å; F107-N111 WeakPolarHBondContact CZ-ND2 3.36Å; F107-N111 PolarHBondContact O-N 3.24Å
108E96.5Very high96.5Very high77 Ų77104 Ų10436%0.3651%0.514SS..Hα-helixtrans-62.1-45.9177.2-172.3-178.8-178.600111.6H104 H110 N111 R112H104-E108 WeakPolarHBondContact O-CB 3.28Å; H104-E108 PolarHBondContact O-N 3.32Å; E108-H110 VanDerWaalsContact C-N 3.34Å; E108-H110 PolarHBondContact O-N 3.3Å; E108-N111 PolarHBondContact O-N 3.43Å; E108-R112 WeakPolarHBondContact O-CB 3.4Å; E108-R112 WeakPolarHBondContact O-CG 3.38Å; E108-R112 PolarHBondContact O-N 2.89Å; E108-R112 IonicContact OE1-CZ 3.91Å; E108-R112 IonicContact OE1-NE 2.69Å; E108-R112 IonicContact OE1-NH1 3.82Å; E108-R112 PolarHBondContact OE1-NH1 2.92Å; E108-R112 IonicContact OE1-NH2 2.84Å; E108-R112 PolarHBondContact OE1-NH2 2.93Å
109N96.7Very high96.5Very high95 Ų95105 Ų10551%0.50851%0.513SS..Hα-helixtrans-63.6-39.3175-82.1-28.2000112.3L105 L113L105-N109 WeakPolarHBondContact O-CB 3.48Å; L105-N109 PolarHBondContact O-N 2.83Å; L105-N109 PolarHBondContact O-ND2 3.28Å; N109-L113 VanDerWaalsContact O-CB 3.31Å; N109-L113 WeakPolarHBondContact O-CB 3.37Å; N109-L113 PolarHBondContact O-N 2.96Å
110H96.7Very high96.5Very high137 Ų137102.9 Ų102.963%0.63451%0.511SS*.Hα-helixtrans-63.7-44.5177.1-171.277.4000111.6Q106 F107 E108 L113 G114Q106-H110 WeakPolarHBondContact O-CB 3.21Å; Q106-H110 PolarHBondContact O-N 3.18Å; F107-H110 PolarHBondContact O-N 3.46Å; E108-H110 VanDerWaalsContact C-N 3.34Å; E108-H110 PolarHBondContact O-N 3.3Å; H110-L113 PolarHBondContact O-N 3.45Å; H110-G114 PolarHBondContact O-N 2.96Å
111N96.2Very high96.5Very high65 Ų65104.3 Ų104.335%0.34852%0.52SS..Hα-helixtrans-64.4-47.7176.8-74.2-8.1000111.8F107 E108 L113 G114 E115F107-N111 WeakPolarHBondContact CE1-ND2 3.39Å; F107-N111 WeakPolarHBondContact CZ-ND2 3.36Å; F107-N111 PolarHBondContact O-N 3.24Å; E108-N111 PolarHBondContact O-N 3.43Å; N111-L113 VanDerWaalsContact C-N 3.29Å; N111-L113 PolarHBondContact O-N 3.34Å; N111-G114 CarbonylContact O-C 3.57Å; N111-G114 WeakPolarHBondContact O-CA 3.26Å; N111-G114 PolarHBondContact O-N 3.41Å; N111-E115 WeakPolarHBondContact O-CG 3.4Å; N111-E115 PolarHBondContact O-N 3.04Å
112R96.3Very high96.4Very high127 Ų127103.4 Ų103.448%0.47952%0.521SS..Hα-helixtrans-57.2-42.4175.9-77.4179.3174.2150.33.9112.1E108 G114 E115 V116E108-R112 WeakPolarHBondContact O-CB 3.4Å; E108-R112 WeakPolarHBondContact O-CG 3.38Å; E108-R112 PolarHBondContact O-N 2.89Å; E108-R112 IonicContact OE1-CZ 3.91Å; E108-R112 IonicContact OE1-NE 2.69Å; E108-R112 IonicContact OE1-NH1 3.82Å; E108-R112 PolarHBondContact OE1-NH1 2.92Å; E108-R112 IonicContact OE1-NH2 2.84Å; E108-R112 PolarHBondContact OE1-NH2 2.93Å; R112-G114 VanDerWaalsContact C-N 3.29Å; R112-G114 PolarHBondContact O-N 3.41Å; R112-E115 PolarHBondContact O-N 3.41Å; R112-V116 VanDerWaalsContact O-CG2 3.32Å; R112-V116 WeakPolarHBondContact O-CG2 3.42Å; R112-V116 PolarHBondContact O-N 3.48Å
113L96.4Very high96.4Very high89 Ų89104.1 Ų104.147%0.46652%0.523SS..Hα-helixtrans-64.3-37.1176.2-169.173000111.5N109 H110 N111 R117N109-L113 VanDerWaalsContact O-CB 3.31Å; N109-L113 WeakPolarHBondContact O-CB 3.37Å; N109-L113 PolarHBondContact O-N 2.96Å; H110-L113 PolarHBondContact O-N 3.45Å; N111-L113 VanDerWaalsContact C-N 3.29Å; N111-L113 PolarHBondContact O-N 3.34Å; L113-R117 WeakPolarHBondContact O-CB 3.48Å; L113-R117 WeakPolarHBondContact O-CG 3.28Å; L113-R117 PolarHBondContact O-N 3.46Å
114G96Very high96.4Very high41 Ų41103 Ų10342%0.42352%0.523SS..Hα-helixtrans-62.5-47.2173.200000112.7H110 N111 R112 R117 A118H110-G114 PolarHBondContact O-N 2.96Å; N111-G114 CarbonylContact O-C 3.57Å; N111-G114 WeakPolarHBondContact O-CA 3.26Å; N111-G114 PolarHBondContact O-N 3.41Å; R112-G114 VanDerWaalsContact C-N 3.29Å; R112-G114 PolarHBondContact O-N 3.41Å; G114-R117 PolarHBondContact O-N 3.46Å; G114-A118 WeakPolarHBondContact O-CB 3.35Å; G114-A118 PolarHBondContact O-N 2.83Å
115E96.4Very high96.4Very high115 Ų115103.7 Ų103.754%0.53753%0.525SS..Hα-helixtrans-60.5-51.5177.2-71.6170.4176.800111.3N111 R112 R117 A118 E119N111-E115 WeakPolarHBondContact O-CG 3.4Å; N111-E115 PolarHBondContact O-N 3.04Å; R112-E115 PolarHBondContact O-N 3.41Å; E115-R117 VanDerWaalsContact C-N 3.29Å; E115-R117 PolarHBondContact O-N 2.93Å; E115-A118 WeakPolarHBondContact O-CB 3.5Å; E115-A118 PolarHBondContact O-N 3.07Å; E115-A118 VanDerWaalsContact O-N 3.08Å; E115-E119 WeakPolarHBondContact O-CG 3.39Å; E115-E119 PolarHBondContact O-N 3.44Å
116V96.2Very high96.4Very high90 Ų90104.4 Ų104.455%0.54553%0.528SS..Hα-helixtrans-60.6-38.5178.7172.60000111.6R112 A120R112-V116 VanDerWaalsContact O-CG2 3.32Å; R112-V116 WeakPolarHBondContact O-CG2 3.42Å; R112-V116 PolarHBondContact O-N 3.48Å; V116-A120 VanDerWaalsContact O-CB 3.28Å; V116-A120 WeakPolarHBondContact O-CB 3.47Å; V116-A120 PolarHBondContact O-N 2.86Å
117R96.9Very high96.4Very high169 Ų169100.9 Ų100.964%0.63852%0.519SS*.Hα-helixtrans-66.5-41.2175.4-77.8175.3179.8-171.31.1112L113 G114 E115 M121L113-R117 WeakPolarHBondContact O-CB 3.48Å; L113-R117 WeakPolarHBondContact O-CG 3.28Å; L113-R117 PolarHBondContact O-N 3.46Å; G114-R117 PolarHBondContact O-N 3.46Å; E115-R117 VanDerWaalsContact C-N 3.29Å; E115-R117 PolarHBondContact O-N 2.93Å; R117-M121 WeakPolarHBondContact O-CB 3.42Å; R117-M121 PolarHBondContact O-N 3.23Å
118A96.3Very high96.3Very high58 Ų58100.7 Ų100.748%0.47952%0.52SS..Hα-helixtrans-64.4-45.617700000111.1G114 E115 M121 T122G114-A118 WeakPolarHBondContact O-CB 3.35Å; G114-A118 PolarHBondContact O-N 2.83Å; E115-A118 WeakPolarHBondContact O-CB 3.5Å; E115-A118 PolarHBondContact O-N 3.07Å; E115-A118 VanDerWaalsContact O-N 3.08Å; A118-M121 PolarHBondContact O-N 3.45Å; A118-T122 WeakPolarHBondContact O-CG2 3.5Å; A118-T122 PolarHBondContact O-N 2.97Å; A118-T122 PolarHBondContact O-OG1 2.87Å
119E95.9Very high96.3Very high111 Ų111101.7 Ų101.752%0.51953%0.525SS..Hα-helixtrans-61.8-44175.5-71.8179.3178.900112.4E115 M121 T122 Q123E115-E119 WeakPolarHBondContact O-CG 3.39Å; E115-E119 PolarHBondContact O-N 3.44Å; E119-M121 VanDerWaalsContact C-N 3.27Å; E119-M121 PolarHBondContact O-N 3.47Å; E119-T122 WeakPolarHBondContact CA-OG1 3.32Å; E119-T122 PolarHBondContact O-N 3.07Å; E119-T122 PolarHBondContact O-OG1 3.45Å; E119-Q123 WeakPolarHBondContact O-CB 3.19Å; E119-Q123 VanDerWaalsContact O-CG 3.28Å; E119-Q123 WeakPolarHBondContact O-CG 3.33Å; E119-Q123 PolarHBondContact O-N 3.19Å
120A95.1Very high96.3Very high54 Ų54102 Ų10245%0.44652%0.523SS..Hα-helixtrans-61.9-38.4176.100000111.6V116 L124V116-A120 VanDerWaalsContact O-CB 3.28Å; V116-A120 WeakPolarHBondContact O-CB 3.47Å; V116-A120 PolarHBondContact O-N 2.86Å; A120-L124 VanDerWaalsContact O-CB 3.32Å; A120-L124 WeakPolarHBondContact O-CB 3.43Å; A120-L124 PolarHBondContact O-N 2.84Å
121M96.7Very high96.2Very high146 Ų146101.2 Ų101.272%0.71952%0.519SS*.Hα-helixtrans-70.8-38.2179.2-165.2167-174.200112.3R117 A118 E119 K125R117-M121 WeakPolarHBondContact O-CB 3.42Å; R117-M121 PolarHBondContact O-N 3.23Å; A118-M121 PolarHBondContact O-N 3.45Å; E119-M121 VanDerWaalsContact C-N 3.27Å; E119-M121 PolarHBondContact O-N 3.47Å; M121-K125 WeakPolarHBondContact O-CB 3.45Å; M121-K125 PolarHBondContact O-N 3.21Å
122T96.4Very high96.2Very high81 Ų81101.4 Ų101.450%0.49752%0.523SS..Hα-helixtrans-68.1-42.5174.656.50000111.4A118 E119 L124 K125 L126A118-T122 WeakPolarHBondContact O-CG2 3.5Å; A118-T122 PolarHBondContact O-N 2.97Å; A118-T122 PolarHBondContact O-OG1 2.87Å; E119-T122 WeakPolarHBondContact CA-OG1 3.32Å; E119-T122 PolarHBondContact O-N 3.07Å; E119-T122 PolarHBondContact O-OG1 3.45Å; T122-L124 PolarHBondContact O-N 2.98Å; T122-K125 PolarHBondContact O-N 3.39Å; T122-L126 WeakPolarHBondContact O-CG 3.42Å; T122-L126 PolarHBondContact O-N 2.88Å
123Q95.8Very high96.2Very high129 Ų129100.6 Ų100.660%0.60353%0.527SS*.Hα-helixtrans-61.1-44174.7-73.1178.91100112.1E119 K125 L126 A127E119-Q123 WeakPolarHBondContact O-CB 3.19Å; E119-Q123 VanDerWaalsContact O-CG 3.28Å; E119-Q123 WeakPolarHBondContact O-CG 3.33Å; E119-Q123 PolarHBondContact O-N 3.19Å; Q123-K125 VanDerWaalsContact C-N 3.31Å; Q123-K125 PolarHBondContact O-N 2.94Å; Q123-L126 PolarHBondContact O-N 3.01Å; Q123-A127 WeakPolarHBondContact O-CB 3.44Å; Q123-A127 PolarHBondContact O-N 3.48Å
124L96.5Very high96.2Very high121 Ų121100.3 Ų100.363%0.63452%0.523SS*.Hα-helixtrans-61.4-41.5176.9-176.165.5000111.4A120 T122 A127 Q128A120-L124 VanDerWaalsContact O-CB 3.32Å; A120-L124 WeakPolarHBondContact O-CB 3.43Å; A120-L124 PolarHBondContact O-N 2.84Å; T122-L124 PolarHBondContact O-N 2.98Å; L124-A127 PolarHBondContact O-N 3.44Å; L124-Q128 WeakPolarHBondContact O-CB 3.38Å; L124-Q128 PolarHBondContact O-N 2.81Å
125K96.8Very high96.2Very high128 Ų128103.6 Ų103.656%0.55753%0.528SS*.Hα-helixtrans-66-43.9177.9-169.1175.9179.1-175.30112.1M121 T122 Q123 A127 Q128 E129M121-K125 WeakPolarHBondContact O-CB 3.45Å; M121-K125 PolarHBondContact O-N 3.21Å; T122-K125 PolarHBondContact O-N 3.39Å; Q123-K125 VanDerWaalsContact C-N 3.31Å; Q123-K125 PolarHBondContact O-N 2.94Å; K125-A127 VanDerWaalsContact C-N 3.34Å; K125-A127 PolarHBondContact O-N 2.73Å; K125-Q128 PolarHBondContact O-N 2.93Å; K125-E129 VanDerWaalsContact CE-OE1 3.31Å; K125-E129 WeakPolarHBondContact CE-OE1 3.33Å; K125-E129 WeakPolarHBondContact O-CG 3.47Å; K125-E129 PolarHBondContact O-N 3.39Å
126L96.4Very high96.2Very high112 Ų112101 Ų10159%0.58652%0.518SS*.Hα-helixtrans-61.3-42.8174.9-73.4171000111.8T122 Q123 Q128 E129 H130T122-L126 WeakPolarHBondContact O-CG 3.42Å; T122-L126 PolarHBondContact O-N 2.88Å; Q123-L126 PolarHBondContact O-N 3.01Å; L126-Q128 VanDerWaalsContact C-N 3.34Å; L126-Q128 PolarHBondContact O-N 3.4Å; L126-E129 PolarHBondContact O-N 3.22Å; L126-H130 WeakPolarHBondContact O-CB 3.45Å; L126-H130 PolarHBondContact O-N 3.48Å
127A95.9Very high96.2Very high42 Ų42101.8 Ų101.835%0.34752%0.516SS..Hα-helixtrans-62.5-42.1175.500000111.6Q123 L124 K125 H130 H131Q123-A127 WeakPolarHBondContact O-CB 3.44Å; Q123-A127 PolarHBondContact O-N 3.48Å; L124-A127 PolarHBondContact O-N 3.44Å; K125-A127 VanDerWaalsContact C-N 3.34Å; K125-A127 PolarHBondContact O-N 2.73Å; A127-H130 PolarHBondContact O-N 3.46Å; A127-H131 PolarHBondContact O-CD2 2.91Å; A127-H131 PolarHBondContact O-N 2.92Å
128Q96.4Very high96.1Very high127 Ų12799.4 Ų99.459%0.59352%0.515SS*.Hα-helixtrans-63.2-46.2176.1-173178.23.500111.9L124 K125 L126 H130 H131 V132L124-Q128 WeakPolarHBondContact O-CB 3.38Å; L124-Q128 PolarHBondContact O-N 2.81Å; K125-Q128 PolarHBondContact O-N 2.93Å; L126-Q128 VanDerWaalsContact C-N 3.34Å; L126-Q128 PolarHBondContact O-N 3.4Å; Q128-H130 VanDerWaalsContact C-N 3.34Å; Q128-H130 PolarHBondContact O-N 2.88Å; Q128-H131 PolarHBondContact O-N 3.38Å; Q128-V132 WeakPolarHBondContact O-CG2 3.36Å; Q128-V132 PolarHBondContact O-N 3.17Å
129E96.6Very high96.1Very high98 Ų98100.2 Ų100.246%0.45851%0.508SS..Hα-helixtrans-60.6-43.3176.7-73.5172.7-173.100111.5K125 L126 V132 L133K125-E129 VanDerWaalsContact CE-OE1 3.31Å; K125-E129 WeakPolarHBondContact CE-OE1 3.33Å; K125-E129 WeakPolarHBondContact O-CG 3.47Å; K125-E129 PolarHBondContact O-N 3.39Å; L126-E129 PolarHBondContact O-N 3.22Å; E129-V132 PolarHBondContact O-N 3Å; E129-L133 WeakPolarHBondContact O-CG 3.45Å; E129-L133 PolarHBondContact O-N 2.98Å
130H95.8Very high96.2Very high103 Ų103102.1 Ų102.148%0.47751%0.511SS..Hα-helixtrans-62.8-43.1175.7-177.3-97.1000112.5L126 A127 Q128 V132 L133 Q134L126-H130 WeakPolarHBondContact O-CB 3.45Å; L126-H130 PolarHBondContact O-N 3.48Å; A127-H130 PolarHBondContact O-N 3.46Å; Q128-H130 VanDerWaalsContact C-N 3.34Å; Q128-H130 PolarHBondContact O-N 2.88Å; H130-V132 VanDerWaalsContact C-N 3.34Å; H130-V132 PolarHBondContact O-N 3.37Å; H130-L133 PolarHBondContact O-N 3.12Å; H130-Q134 VanDerWaalsContact CE1-CD 3.47Å; H130-Q134 PolarHBondContact CE1-NE2 3.4Å; H130-Q134 WeakPolarHBondContact O-CG 3.47Å; H130-Q134 PolarHBondContact O-N 3.1Å
131H94.7Very high96.2Very high119 Ų119103.4 Ų103.455%0.55151%0.51SS*.Hα-helixtrans-62.1-40.8175.1-79-53.8000112.5A127 Q128 L133 Q134 E135A127-H131 PolarHBondContact O-CD2 2.91Å; A127-H131 PolarHBondContact O-N 2.92Å; Q128-H131 PolarHBondContact O-N 3.38Å; H131-L133 VanDerWaalsContact C-N 3.34Å; H131-L133 PolarHBondContact O-N 2.95Å; H131-Q134 PolarHBondContact O-N 2.93Å; H131-E135 WeakPolarHBondContact O-CB 3.47Å; H131-E135 PolarHBondContact O-N 3.49Å
132V97.1Very high96.2Very high70 Ų70102.4 Ų102.442%0.42450%0.502SS..Hα-helixtrans-64.3-38.8176.3170.60000111.3Q128 E129 H130 E135 N136Q128-V132 WeakPolarHBondContact O-CG2 3.36Å; Q128-V132 PolarHBondContact O-N 3.17Å; E129-V132 PolarHBondContact O-N 3Å; H130-V132 VanDerWaalsContact C-N 3.34Å; H130-V132 PolarHBondContact O-N 3.37Å; V132-E135 PolarHBondContact O-N 3.15Å; V132-N136 WeakPolarHBondContact O-CB 3.04Å; V132-N136 PolarHBondContact O-N 3.04Å; V132-N136 PolarHBondContact O-ND2 3.49Å
133L97Very high96.2Very high109 Ų109105.2 Ų105.257%0.57150%0.503SS*.Hα-helixtrans-63.6-48.2175.1-72.3172.6000111.7E129 H130 H131 E135 N136 E137E129-L133 WeakPolarHBondContact O-CG 3.45Å; E129-L133 PolarHBondContact O-N 2.98Å; H130-L133 PolarHBondContact O-N 3.12Å; H131-L133 VanDerWaalsContact C-N 3.34Å; H131-L133 PolarHBondContact O-N 2.95Å; L133-E135 VanDerWaalsContact C-N 3.33Å; L133-E135 PolarHBondContact O-N 3.02Å; L133-N136 WeakPolarHBondContact O-CB 3.33Å; L133-N136 PolarHBondContact O-N 3.33Å; L133-E137 WeakPolarHBondContact O-CG 3.39Å; L133-E137 PolarHBondContact O-N 3.27Å
134Q95.5Very high96.2Very high83 Ų83104.7 Ų104.739%0.38850%0.501SS..Hα-helixtrans-60.2-41.7176.7-73.5-173-24.500112.4H130 H131 N136 E137 L138H130-Q134 VanDerWaalsContact CE1-CD 3.47Å; H130-Q134 PolarHBondContact CE1-NE2 3.4Å; H130-Q134 WeakPolarHBondContact O-CG 3.47Å; H130-Q134 PolarHBondContact O-N 3.1Å; H131-Q134 PolarHBondContact O-N 2.93Å; Q134-N136 VanDerWaalsContact C-N 3.32Å; Q134-N136 PolarHBondContact O-N 3.01Å; Q134-E137 PolarHBondContact O-N 2.95Å; Q134-L138 WeakPolarHBondContact O-CG 3.5Å; Q134-L138 PolarHBondContact O-N 3.02Å
135E95.6Very high96.2Very high110 Ų110104 Ų10451%0.51450%0.497SS..Hα-helixtrans-61.9-42.8177-166.6-172160.400111.2H131 V132 L133 E137 L138 Q139H131-E135 WeakPolarHBondContact O-CB 3.47Å; H131-E135 PolarHBondContact O-N 3.49Å; V132-E135 PolarHBondContact O-N 3.15Å; L133-E135 VanDerWaalsContact C-N 3.33Å; L133-E135 PolarHBondContact O-N 3.02Å; E135-E137 PolarHBondContact O-N 3.39Å; E135-L138 PolarHBondContact O-N 3.15Å; E135-Q139 WeakPolarHBondContact O-CB 3.28Å; E135-Q139 VanDerWaalsContact O-CG 3.29Å; E135-Q139 WeakPolarHBondContact O-CG 3.48Å; E135-Q139 PolarHBondContact O-N 3.5Å; E135-Q139 PolarHBondContact OE1-NE2 2.94Å
136N96.5Very high96.2Very high61 Ų61104.8 Ų104.833%0.32650%0.497SS..Hα-helixtrans-64.1-39.2177.3-78-50000112.7V132 L133 Q134 Q139 R140V132-N136 WeakPolarHBondContact O-CB 3.04Å; V132-N136 PolarHBondContact O-N 3.04Å; V132-N136 PolarHBondContact O-ND2 3.49Å; L133-N136 WeakPolarHBondContact O-CB 3.33Å; L133-N136 PolarHBondContact O-N 3.33Å; Q134-N136 VanDerWaalsContact C-N 3.32Å; Q134-N136 PolarHBondContact O-N 3.01Å; N136-Q139 PolarHBondContact O-N 3.43Å; N136-R140 WeakPolarHBondContact O-CG 3.4Å; N136-R140 PolarHBondContact O-N 3.28Å
137E96.1Very high96.2Very high107 Ų107107.2 Ų107.250%0.550%0.498SS..Hα-helixtrans-62.1-51.6173.5-73.1177.6169.400111.1L133 Q134 E135 Q139 R140 D141L133-E137 WeakPolarHBondContact O-CG 3.39Å; L133-E137 PolarHBondContact O-N 3.27Å; Q134-E137 PolarHBondContact O-N 2.95Å; E135-E137 PolarHBondContact O-N 3.39Å; E137-Q139 VanDerWaalsContact C-N 3.25Å; E137-Q139 PolarHBondContact O-N 3.33Å; E137-R140 WeakPolarHBondContact O-CA 3.48Å; E137-R140 WeakPolarHBondContact O-CB 3.33Å; E137-R140 PolarHBondContact O-N 3.07Å; E137-D141 PolarHBondContact O-N 3.49Å
138L95.7Very high96.2Very high119 Ų119109.2 Ų109.262%0.62350%0.502SS*.Hα-helixtrans-58.5-37.2176.9-70.7172.9000112.3Q134 E135 K142Q134-L138 WeakPolarHBondContact O-CG 3.5Å; Q134-L138 PolarHBondContact O-N 3.02Å; E135-L138 PolarHBondContact O-N 3.15Å; L138-K142 VanDerWaalsContact O-CB 3.23Å; L138-K142 WeakPolarHBondContact O-CB 3.25Å; L138-K142 PolarHBondContact O-N 3.03Å
139Q96.6Very high96.1Very high74 Ų74108.3 Ų108.335%0.34650%0.5SS..Hα-helixtrans-67.9-36.4174.4-73.8-174.615.900112.7E135 N136 E137 R143E135-Q139 WeakPolarHBondContact O-CB 3.28Å; E135-Q139 VanDerWaalsContact O-CG 3.29Å; E135-Q139 WeakPolarHBondContact O-CG 3.48Å; E135-Q139 PolarHBondContact O-N 3.5Å; E135-Q139 PolarHBondContact OE1-NE2 2.94Å; N136-Q139 PolarHBondContact O-N 3.43Å; E137-Q139 VanDerWaalsContact C-N 3.25Å; E137-Q139 PolarHBondContact O-N 3.33Å; Q139-R143 WeakPolarHBondContact O-CG 3.39Å; Q139-R143 PolarHBondContact O-N 2.93Å; Q139-R143 VanDerWaalsContact O-N 3.14Å; Q139-R143 PolarHBondContact O-NE 2.92Å
140R96.9Very high96.1Very high152 Ų152109.5 Ų109.557%0.57450%0.5SS*.Hα-helixtrans-66-47.5173.6-72.8171.6-173.6150.41.9110.6N136 E137 K142 R143 Q144N136-R140 WeakPolarHBondContact O-CG 3.4Å; N136-R140 PolarHBondContact O-N 3.28Å; E137-R140 WeakPolarHBondContact O-CA 3.48Å; E137-R140 WeakPolarHBondContact O-CB 3.33Å; E137-R140 PolarHBondContact O-N 3.07Å; R140-K142 VanDerWaalsContact C-N 3.35Å; R140-K142 PolarHBondContact O-N 3.38Å; R140-R143 WeakPolarHBondContact O-CB 3.39Å; R140-R143 PolarHBondContact O-N 2.93Å; R140-Q144 PolarHBondContact O-N 3.14Å
141D95.5Very high96.1Very high81 Ų81109.2 Ų109.243%0.43350%0.499SS..Hα-helixtrans-60.9-44.6178.4-68.4-9.2000111.3E137 R143 Q144 L145E137-D141 PolarHBondContact O-N 3.49Å; D141-R143 VanDerWaalsContact C-N 3.29Å; D141-R143 PolarHBondContact O-N 3.27Å; D141-Q144 PolarHBondContact O-N 3.41Å; D141-Q144 VanDerWaalsContact O-N 3.16Å; D141-L145 WeakPolarHBondContact O-CB 3.21Å; D141-L145 WeakPolarHBondContact O-CG 3.38Å; D141-L145 PolarHBondContact O-N 3.43Å
142K96.7Very high96.1Very high125 Ų125113.1 Ų113.154%0.54351%0.509SS..Hα-helixtrans-57.4-41.1174179.9-179175.8-179.40112.1L138 R140 R146L138-K142 VanDerWaalsContact O-CB 3.23Å; L138-K142 WeakPolarHBondContact O-CB 3.25Å; L138-K142 PolarHBondContact O-N 3.03Å; R140-K142 VanDerWaalsContact C-N 3.35Å; R140-K142 PolarHBondContact O-N 3.38Å; K142-R146 WeakPolarHBondContact O-CB 3.42Å; K142-R146 VanDerWaalsContact O-CG 3.3Å; K142-R146 WeakPolarHBondContact O-CG 3.28Å; K142-R146 PolarHBondContact O-N 2.93Å; K142-R146 VanDerWaalsContact O-N 3.11Å
143R96.2Very high95.9Very high139 Ų139114.5 Ų114.553%0.52551%0.512SS..Hα-helixtrans-67.7-41.2176.9-77.3-178.2-73.3-111.2-4.4111.5Q139 R140 D141 R146 R147Q139-R143 WeakPolarHBondContact O-CG 3.39Å; Q139-R143 PolarHBondContact O-N 2.93Å; Q139-R143 VanDerWaalsContact O-N 3.14Å; Q139-R143 PolarHBondContact O-NE 2.92Å; R140-R143 WeakPolarHBondContact O-CB 3.39Å; R140-R143 PolarHBondContact O-N 2.93Å; D141-R143 VanDerWaalsContact C-N 3.29Å; D141-R143 PolarHBondContact O-N 3.27Å; R143-R146 PolarHBondContact O-N 3.46Å; R143-R147 PolarHBondContact O-N 2.65Å; R143-R147 VanDerWaalsContact O-N 3.08Å
144Q96.5Very high95.8Very high118 Ų118115.3 Ų115.355%0.55151%0.513SS*.Hα-helixtrans-66.6-46.3178.1-174170.7-5.700111.8R140 D141 R146 R147 M148R140-Q144 PolarHBondContact O-N 3.14Å; D141-Q144 PolarHBondContact O-N 3.41Å; D141-Q144 VanDerWaalsContact O-N 3.16Å; Q144-R146 VanDerWaalsContact C-N 3.31Å; Q144-R146 PolarHBondContact O-N 3.46Å; Q144-R147 WeakPolarHBondContact O-CB 3.49Å; Q144-R147 PolarHBondContact O-N 2.81Å; Q144-M148 PolarHBondContact O-N 3.4Å
145L95.5Very high95.8Very high107 Ų107116 Ų11656%0.5652%0.518SS*.Hα-helixtrans-58.5-42174.9-73.5167.9000111.8D141 R147 M148 L149D141-L145 WeakPolarHBondContact O-CB 3.21Å; D141-L145 WeakPolarHBondContact O-CG 3.38Å; D141-L145 PolarHBondContact O-N 3.43Å; L145-R147 VanDerWaalsContact C-N 3.32Å; L145-R147 PolarHBondContact O-N 3.42Å; L145-M148 HydrophobicContact CD2-CE 3.63Å; L145-M148 HydrophobicContact CG-CE 4.4Å; L145-M148 PolarHBondContact O-N 2.89Å; L145-L149 WeakPolarHBondContact O-CB 3.46Å; L145-L149 PolarHBondContact O-N 3.47Å
146R96.5Very high95.6Very high145 Ų145113.6 Ų113.655%0.54751%0.513SS..Hα-helixtrans-63.7-35.4174.8-78178.2177.4-117.3-3.5113K142 R143 Q144 R150K142-R146 WeakPolarHBondContact O-CB 3.42Å; K142-R146 VanDerWaalsContact O-CG 3.3Å; K142-R146 WeakPolarHBondContact O-CG 3.28Å; K142-R146 PolarHBondContact O-N 2.93Å; K142-R146 VanDerWaalsContact O-N 3.11Å; R143-R146 PolarHBondContact O-N 3.46Å; Q144-R146 VanDerWaalsContact C-N 3.31Å; Q144-R146 PolarHBondContact O-N 3.46Å; R146-R150 WeakPolarHBondContact O-CG 3.44Å; R146-R150 PolarHBondContact O-N 2.94Å
147R96.5Very high95.5Very high162 Ų162116.1 Ų116.161%0.61152%0.523SS*.Hα-helixtrans-67.3-50.1174.1179.3-178-78.8171.1-5.5110.6R143 Q144 L145 L149 R150 E151R143-R147 PolarHBondContact O-N 2.65Å; R143-R147 VanDerWaalsContact O-N 3.08Å; Q144-R147 WeakPolarHBondContact O-CB 3.49Å; Q144-R147 PolarHBondContact O-N 2.81Å; L145-R147 VanDerWaalsContact C-N 3.32Å; L145-R147 PolarHBondContact O-N 3.42Å; R147-L149 VanDerWaalsContact C-N 3.28Å; R147-L149 PolarHBondContact O-N 3.16Å; R147-R150 PolarHBondContact O-N 3.04Å; R147-R150 VanDerWaalsContact O-N 3.1Å; R147-E151 WeakPolarHBondContact CD-OE1 3.48Å; R147-E151 HydrophobicContact CG-CG 4.44Å; R147-E151 VanDerWaalsContact CG-OE1 3.22Å; R147-E151 WeakPolarHBondContact CG-OE1 3.11Å; R147-E151 PolarHBondContact O-N 2.93Å
148M95.8Very high95.5Very high85 Ų85115.1 Ų115.142%0.41952%0.519SS..Hα-helixtrans-60.4-37.2178.8-68.2-167.7-58.300112.7Q144 L145 R152Q144-M148 PolarHBondContact O-N 3.4Å; L145-M148 HydrophobicContact CD2-CE 3.63Å; L145-M148 HydrophobicContact CG-CE 4.4Å; L145-M148 PolarHBondContact O-N 2.89Å; M148-R152 WeakPolarHBondContact O-CB 3.33Å; M148-R152 WeakPolarHBondContact O-CG 3.38Å; M148-R152 PolarHBondContact O-N 3.09Å
149L95.5Very high95.5Very high107 Ų107115 Ų11556%0.5652%0.515SS*.Hα-helixtrans-63.6-44.1175.6-172.271.3000111.3L145 R147 R152 M153L145-L149 WeakPolarHBondContact O-CB 3.46Å; L145-L149 PolarHBondContact O-N 3.47Å; R147-L149 VanDerWaalsContact C-N 3.28Å; R147-L149 PolarHBondContact O-N 3.16Å; L149-R152 PolarHBondContact O-N 3.18Å; L149-M153 HydrophobicContact CG-CE 4.24Å; L149-M153 WeakPolarHBondContact O-CG 3.5Å; L149-M153 PolarHBondContact O-N 2.94Å
150R95.9Very high95.4Very high123 Ų123115.6 Ų115.646%0.46452%0.52SS..Hα-helixtrans-62.2-48.5175.7-76.2-173.1-65.5-98.9-1.7112R146 R147 R152 M153 E154R146-R150 WeakPolarHBondContact O-CG 3.44Å; R146-R150 PolarHBondContact O-N 2.94Å; R147-R150 PolarHBondContact O-N 3.04Å; R147-R150 VanDerWaalsContact O-N 3.1Å; R150-R152 VanDerWaalsContact C-N 3.3Å; R150-R152 PolarHBondContact O-N 2.87Å; R150-M153 HydrophobicContact CG-CE 4.17Å; R150-M153 PolarHBondContact O-N 3.37Å; R150-M153 VanDerWaalsContact O-N 3.11Å; R150-E154 WeakPolarHBondContact O-CG 3.42Å; R150-E154 PolarHBondContact O-N 2.84Å
151E95.4Very high95.3Very high98 Ų98116.5 Ų116.546%0.45852%0.524SS..Hα-helixtrans-58.9-41.3178-71.6168.2-175.400111.6R147 E154 M155R147-E151 WeakPolarHBondContact CD-OE1 3.48Å; R147-E151 HydrophobicContact CG-CG 4.44Å; R147-E151 VanDerWaalsContact CG-OE1 3.22Å; R147-E151 WeakPolarHBondContact CG-OE1 3.11Å; R147-E151 PolarHBondContact O-N 2.93Å; E151-E154 PolarHBondContact O-N 3.04Å; E151-M155 WeakPolarHBondContact O-CB 3.43Å; E151-M155 VanDerWaalsContact O-CG 3.24Å; E151-M155 WeakPolarHBondContact O-CG 3.5Å; E151-M155 PolarHBondContact O-N 3.42Å
152R94.4Very high95.3Very high200 Ų200118.3 Ų118.376%0.75553%0.529SS*.Hα-helixtrans-64.7-40.8174.7-81.1-169.9176-142.71.1113M148 L149 R150 S156M148-R152 WeakPolarHBondContact O-CB 3.33Å; M148-R152 WeakPolarHBondContact O-CG 3.38Å; M148-R152 PolarHBondContact O-N 3.09Å; L149-R152 PolarHBondContact O-N 3.18Å; R150-R152 VanDerWaalsContact C-N 3.3Å; R150-R152 PolarHBondContact O-N 2.87Å; R152-S156 WeakPolarHBondContact O-CB 3.42Å; R152-S156 PolarHBondContact O-N 3.3Å
153M94.1Very high95.2Very high100 Ų100117.2 Ų117.249%0.49353%0.527SS..Hα-helixtrans-65.2-45.7177-72.1-175.3-58.600111.2L149 R150 M155 S156 E157L149-M153 HydrophobicContact CG-CE 4.24Å; L149-M153 WeakPolarHBondContact O-CG 3.5Å; L149-M153 PolarHBondContact O-N 2.94Å; R150-M153 HydrophobicContact CG-CE 4.17Å; R150-M153 PolarHBondContact O-N 3.37Å; R150-M153 VanDerWaalsContact O-N 3.11Å; M153-M155 VanDerWaalsContact C-N 3.35Å; M153-M155 PolarHBondContact O-N 3.49Å; M153-S156 PolarHBondContact O-N 3.13Å; M153-E157 PolarHBondContact O-N 2.89Å
154E94.7Very high95.1Very high126 Ų126115.9 Ų115.959%0.58953%0.527SS*.Hα-helixtrans-60.9-43176.9-72.1171.1-169.400111.7R150 E151 E157 M158R150-E154 WeakPolarHBondContact O-CG 3.42Å; R150-E154 PolarHBondContact O-N 2.84Å; E151-E154 PolarHBondContact O-N 3.04Å; E154-E157 PolarHBondContact O-N 3.17Å; E154-M158 WeakPolarHBondContact O-CB 3.13Å; E154-M158 PolarHBondContact O-N 3.02Å
155M94.7Very high95.1Very high98 Ų98113 Ų11348%0.48352%0.524SS..Hα-helixtrans-63.6-41.2174.8-74.8-60.5-59.700112.4E151 M153 M158 Q159E151-M155 WeakPolarHBondContact O-CB 3.43Å; E151-M155 VanDerWaalsContact O-CG 3.24Å; E151-M155 WeakPolarHBondContact O-CG 3.5Å; E151-M155 PolarHBondContact O-N 3.42Å; M153-M155 VanDerWaalsContact C-N 3.35Å; M153-M155 PolarHBondContact O-N 3.49Å; M155-M158 HydrophobicContact CE-CE 3.68Å; M155-M158 PolarHBondContact O-N 3.28Å; M155-M158 HydrophobicContact SD-CE 3.86Å; M155-Q159 WeakPolarHBondContact O-CG 3.5Å; M155-Q159 PolarHBondContact O-N 2.93Å
156S92.4Very high95.1Very high58 Ų58112.4 Ų112.441%0.40652%0.518SS..Hα-helixtrans-66-41.8176.9-172.80000112.1R152 M153 M158 Q159 L160R152-S156 WeakPolarHBondContact O-CB 3.42Å; R152-S156 PolarHBondContact O-N 3.3Å; M153-S156 PolarHBondContact O-N 3.13Å; S156-M158 VanDerWaalsContact C-N 3.34Å; S156-Q159 PolarHBondContact O-N 3.27Å; S156-L160 PolarHBondContact O-N 3.39Å
157E94.9Very high95Very high115 Ų115111.6 Ų111.654%0.53752%0.519SS..Hα-helixtrans-63.4-41174.5-81.3-169.616600111.5M153 E154 Q159 L160 R161M153-E157 PolarHBondContact O-N 2.89Å; E154-E157 PolarHBondContact O-N 3.17Å; E157-Q159 VanDerWaalsContact C-N 3.34Å; E157-Q159 PolarHBondContact O-N 3.36Å; E157-L160 PolarHBondContact O-N 3.31Å; E157-R161 WeakPolarHBondContact O-CG 2.83Å; E157-R161 PolarHBondContact O-N 3.15Å
158M95.6Very high94.9Very high85 Ų85109 Ų10942%0.41952%0.517SS..Hα-helixtrans-62.2-42.2176.1-172.3-18072.100111.5E154 M155 S156 R161 Q162E154-M158 WeakPolarHBondContact O-CB 3.13Å; E154-M158 PolarHBondContact O-N 3.02Å; M155-M158 HydrophobicContact CE-CE 3.68Å; M155-M158 PolarHBondContact O-N 3.28Å; M155-M158 HydrophobicContact SD-CE 3.86Å; S156-M158 VanDerWaalsContact C-N 3.34Å; M158-R161 PolarHBondContact O-N 2.99Å; M158-Q162 WeakPolarHBondContact O-CB 3.38Å; M158-Q162 WeakPolarHBondContact O-CG 3.41Å; M158-Q162 PolarHBondContact O-N 3.15Å
159Q94.9Very high95Very high117 Ų117110 Ų11055%0.54752%0.521SS..Hα-helixtrans-62.9-43.1175.5-74.9175-16.800112.1M155 S156 E157 Q162 M163M155-Q159 WeakPolarHBondContact O-CG 3.5Å; M155-Q159 PolarHBondContact O-N 2.93Å; S156-Q159 PolarHBondContact O-N 3.27Å; E157-Q159 VanDerWaalsContact C-N 3.34Å; E157-Q159 PolarHBondContact O-N 3.36Å; Q159-Q162 PolarHBondContact O-N 2.84Å; Q159-M163 WeakPolarHBondContact O-CB 3.44Å; Q159-M163 PolarHBondContact O-N 2.69Å
160L94.4Very high95Very high86 Ų86109 Ų10945%0.4551%0.512SS..Hα-helixtrans-59.2-48.7174.2-97.1149.4000111.6S156 E157 Q162 M163 E164S156-L160 PolarHBondContact O-N 3.39Å; E157-L160 PolarHBondContact O-N 3.31Å; L160-Q162 VanDerWaalsContact C-N 3.34Å; L160-Q162 PolarHBondContact O-N 2.9Å; L160-M163 PolarHBondContact O-N 3.49Å; L160-M163 VanDerWaalsContact O-N 3.16Å; L160-E164 WeakPolarHBondContact O-CG 3.34Å; L160-E164 PolarHBondContact O-N 2.86Å
161R95.2Very high94.9Very high172 Ų172106.9 Ų106.965%0.64951%0.509SS*.Hα-helixtrans-61.6-39.9177.3-72-176.6-169.9176.78112.7E157 M158 M163 A165E157-R161 WeakPolarHBondContact O-CG 2.83Å; E157-R161 PolarHBondContact O-N 3.15Å; M158-R161 PolarHBondContact O-N 2.99Å; R161-M163 VanDerWaalsContact C-N 3.34Å; R161-A165 WeakPolarHBondContact O-CB 3.31Å; R161-A165 PolarHBondContact O-N 3.44Å
162Q95.3Very high95Very high118 Ų118107.1 Ų107.155%0.55151%0.513SS*.Hα-helixtrans-63.6-41.9175.3-76.3176.23.100111.4M158 Q159 L160 A165 H166M158-Q162 WeakPolarHBondContact O-CB 3.38Å; M158-Q162 WeakPolarHBondContact O-CG 3.41Å; M158-Q162 PolarHBondContact O-N 3.15Å; Q159-Q162 PolarHBondContact O-N 2.84Å; L160-Q162 VanDerWaalsContact C-N 3.34Å; L160-Q162 PolarHBondContact O-N 2.9Å; Q162-A165 PolarHBondContact O-N 2.91Å; Q162-H166 WeakPolarHBondContact O-CB 3.33Å; Q162-H166 PolarHBondContact O-N 2.74Å
163M94.7Very high95Very high102 Ų102101.6 Ų101.650%0.50250%0.496SS..Hα-helixtrans-66.9-43178.2-163.4174.672.800111.7Q159 L160 R161 H166 F167Q159-M163 WeakPolarHBondContact O-CB 3.44Å; Q159-M163 PolarHBondContact O-N 2.69Å; L160-M163 PolarHBondContact O-N 3.49Å; L160-M163 VanDerWaalsContact O-N 3.16Å; R161-M163 VanDerWaalsContact C-N 3.34Å; M163-H166 PolarHBondContact O-N 3.37Å; M163-F167 HydrophobicContact CE-CE2 4.19Å; M163-F167 HydrophobicContact CG-CD2 3.85Å; M163-F167 HydrophobicContact CG-CE2 3.51Å; M163-F167 WeakPolarHBondContact O-CD2 3.32Å; M163-F167 PolarHBondContact O-N 2.9Å; M163-F167 HydrophobicContact SD-CE2 4Å
164E94.9Very high95.1Very high111 Ų111102.2 Ų102.252%0.51950%0.497SS..Hα-helixtrans-60.5-45.3173.6-73.9175.816900112L160 H166 F167 N168L160-E164 WeakPolarHBondContact O-CG 3.34Å; L160-E164 PolarHBondContact O-N 2.86Å; E164-H166 VanDerWaalsContact C-N 3.33Å; E164-H166 PolarHBondContact O-N 3.43Å; E164-F167 PolarHBondContact O-N 3.24Å; E164-N168 WeakPolarHBondContact O-CB 3.35Å; E164-N168 VanDerWaalsContact O-CG 3.24Å; E164-N168 PolarHBondContact O-N 3.44Å; E164-N168 PolarHBondContact O-ND2 3.12Å
165A95.7Very high95.1Very high59 Ų59103.8 Ų103.849%0.48850%0.498SS..Hα-helixtrans-60.2-43.8176.400000111.5R161 Q162 N168 E169R161-A165 WeakPolarHBondContact O-CB 3.31Å; R161-A165 PolarHBondContact O-N 3.44Å; Q162-A165 PolarHBondContact O-N 2.91Å; A165-N168 PolarHBondContact O-N 2.95Å; A165-E169 PolarHBondContact O-N 2.98Å
166H95.8Very high95.2Very high94 Ų94102.4 Ų102.444%0.43549%0.492SS..Hα-helixtrans-64.2-43.1177.6-174.161000112.6Q162 M163 E164 E169 K170Q162-H166 WeakPolarHBondContact O-CB 3.33Å; Q162-H166 PolarHBondContact O-N 2.74Å; M163-H166 PolarHBondContact O-N 3.37Å; E164-H166 VanDerWaalsContact C-N 3.33Å; E164-H166 PolarHBondContact O-N 3.43Å; H166-E169 IonicContact ND1-OE2 3.03Å; H166-E169 PolarHBondContact O-N 3.4Å; H166-K170 WeakPolarHBondContact O-CG 3.47Å; H166-K170 PolarHBondContact O-N 2.98Å
167F93.9Very high95.4Very high127 Ų127102.6 Ų102.656%0.55749%0.491SS*.Hα-helixtrans-65.1-39.6175.9-79.7-57000112.3M163 E164 K170 L171M163-F167 HydrophobicContact CE-CE2 4.19Å; M163-F167 HydrophobicContact CG-CD2 3.85Å; M163-F167 HydrophobicContact CG-CE2 3.51Å; M163-F167 WeakPolarHBondContact O-CD2 3.32Å; M163-F167 PolarHBondContact O-N 2.9Å; M163-F167 HydrophobicContact SD-CE2 4Å; E164-F167 PolarHBondContact O-N 3.24Å; F167-K170 PolarHBondContact O-N 3.4Å; F167-L171 VanDerWaalsContact O-CB 3.31Å; F167-L171 WeakPolarHBondContact O-CB 3.38Å; F167-L171 PolarHBondContact O-N 2.92Å
168N95.8Very high95.4Very high107 Ų107103.3 Ų103.357%0.57249%0.492SS*.Hα-helixtrans-64.1-40.3176.2-74.4-29.1000112E164 A165 L171 L172E164-N168 WeakPolarHBondContact O-CB 3.35Å; E164-N168 VanDerWaalsContact O-CG 3.24Å; E164-N168 PolarHBondContact O-N 3.44Å; E164-N168 PolarHBondContact O-ND2 3.12Å; A165-N168 PolarHBondContact O-N 2.95Å; N168-L171 PolarHBondContact O-N 3.5Å; N168-L172 WeakPolarHBondContact O-CB 3.47Å; N168-L172 PolarHBondContact O-N 2.87Å
169E96.3Very high95.4Very high108 Ų108103.6 Ų103.651%0.50549%0.493SS..Hα-helixtrans-60.5-49.6173.5-177.4-179.4-15600111.2A165 H166 L171 L172 E173A165-E169 PolarHBondContact O-N 2.98Å; H166-E169 IonicContact ND1-OE2 3.03Å; H166-E169 PolarHBondContact O-N 3.4Å; E169-L171 VanDerWaalsContact C-N 3.34Å; E169-L171 PolarHBondContact O-N 2.87Å; E169-L172 WeakPolarHBondContact O-CB 3.33Å; E169-L172 PolarHBondContact O-N 3.44Å; E169-L172 VanDerWaalsContact O-N 3.16Å; E169-E173 WeakPolarHBondContact O-CG 3.31Å; E169-E173 PolarHBondContact O-N 3.39Å
170K95.8Very high95.4Very high85 Ų85105.8 Ų105.837%0.3750%0.496SS..Hα-helixtrans-63.1-38.2178.2-69.1-71.2154.3-147.20112.8H166 F167 L172 E173 Q174H166-K170 WeakPolarHBondContact O-CG 3.47Å; H166-K170 PolarHBondContact O-N 2.98Å; F167-K170 PolarHBondContact O-N 3.4Å; K170-L172 VanDerWaalsContact C-N 3.35Å; K170-E173 WeakPolarHBondContact CD-OE2 3.38Å; K170-E173 IonicContact NZ-OE1 2.61Å; K170-E173 PolarHBondContact NZ-OE1 2.91Å; K170-E173 IonicContact NZ-OE2 2.97Å; K170-E173 PolarHBondContact NZ-OE2 3.06Å; K170-E173 PolarHBondContact O-N 2.86Å; K170-Q174 WeakPolarHBondContact O-CG 3.35Å; K170-Q174 PolarHBondContact O-N 3.11Å
171L95Very high95.5Very high78 Ų78107.1 Ų107.141%0.40850%0.5SS..Hα-helixtrans-66-38.9175.5-17368.6000111.4F167 N168 E169 Q174 R175F167-L171 VanDerWaalsContact O-CB 3.31Å; F167-L171 WeakPolarHBondContact O-CB 3.38Å; F167-L171 PolarHBondContact O-N 2.92Å; N168-L171 PolarHBondContact O-N 3.5Å; E169-L171 VanDerWaalsContact C-N 3.34Å; E169-L171 PolarHBondContact O-N 2.87Å; L171-Q174 PolarHBondContact O-N 3.28Å; L171-R175 VanDerWaalsContact O-CG 3.31Å; L171-R175 WeakPolarHBondContact O-CG 3.25Å; L171-R175 PolarHBondContact O-N 3.35Å
172L95.7Very high95.5Very high103 Ų103105 Ų10554%0.53949%0.492SS..Hα-helixtrans-66.5-44.5175.9-178.463.2000111.4N168 E169 K170 Q174 R175 I176N168-L172 WeakPolarHBondContact O-CB 3.47Å; N168-L172 PolarHBondContact O-N 2.87Å; E169-L172 WeakPolarHBondContact O-CB 3.33Å; E169-L172 PolarHBondContact O-N 3.44Å; E169-L172 VanDerWaalsContact O-N 3.16Å; K170-L172 VanDerWaalsContact C-N 3.35Å; L172-Q174 VanDerWaalsContact C-N 3.33Å; L172-Q174 PolarHBondContact O-N 3.33Å; L172-R175 PolarHBondContact O-N 2.93Å; L172-I176 HydrophobicContact CD1-CD1 4.25Å; L172-I176 HydrophobicContact CD1-CG1 4.42Å; L172-I176 HydrophobicContact CG-CD1 4Å; L172-I176 WeakPolarHBondContact O-CG1 3.46Å; L172-I176 PolarHBondContact O-N 3.47Å
173E95.9Very high95.5Very high84 Ų84104.4 Ų104.439%0.39349%0.488SS..Hα-helixtrans-54.3-49.4173.6-74.5176.2177.600111E169 K170 R175 I176 T177E169-E173 WeakPolarHBondContact O-CG 3.31Å; E169-E173 PolarHBondContact O-N 3.39Å; K170-E173 WeakPolarHBondContact CD-OE2 3.38Å; K170-E173 IonicContact NZ-OE1 2.61Å; K170-E173 PolarHBondContact NZ-OE1 2.91Å; K170-E173 IonicContact NZ-OE2 2.97Å; K170-E173 PolarHBondContact NZ-OE2 3.06Å; K170-E173 PolarHBondContact O-N 2.86Å; E173-R175 PolarHBondContact O-N 3.5Å; E173-I176 PolarHBondContact O-N 3.3Å; E173-T177 WeakPolarHBondContact O-CG2 3.35Å; E173-T177 PolarHBondContact O-N 2.88Å; E173-T177 PolarHBondContact O-OG1 3.47Å
174Q95.6Very high95.5Very high113 Ų113104.2 Ų104.253%0.52849%0.488SS..Hα-helixtrans-62.8-38.3177.7-75.5-174.7-10.600113.2K170 L171 L172 I176 T177 F178K170-Q174 WeakPolarHBondContact O-CG 3.35Å; K170-Q174 PolarHBondContact O-N 3.11Å; L171-Q174 PolarHBondContact O-N 3.28Å; L172-Q174 VanDerWaalsContact C-N 3.33Å; L172-Q174 PolarHBondContact O-N 3.33Å; Q174-I176 VanDerWaalsContact C-N 3.35Å; Q174-T177 WeakPolarHBondContact CA-OG1 3.17Å; Q174-T177 PolarHBondContact O-N 2.97Å; Q174-T177 PolarHBondContact O-OG1 3.34Å; Q174-F178 WeakPolarHBondContact O-CD2 3.37Å; Q174-F178 PolarHBondContact O-N 3.03Å
175R95.7Very high95.5Very high160 Ų160103.1 Ų103.160%0.60449%0.486SS*.Hα-helixtrans-62.9-43.9175.1-76.9173.3-176.5-96.61.9111.1L171 L172 E173 F178 E179L171-R175 VanDerWaalsContact O-CG 3.31Å; L171-R175 WeakPolarHBondContact O-CG 3.25Å; L171-R175 PolarHBondContact O-N 3.35Å; L172-R175 PolarHBondContact O-N 2.93Å; E173-R175 PolarHBondContact O-N 3.5Å; R175-F178 PolarHBondContact O-N 3.32Å; R175-E179 WeakPolarHBondContact O-CB 3.45Å; R175-E179 PolarHBondContact O-N 3.43Å
176I96Very high95.3Very high68 Ų68105 Ų10535%0.34949%0.485SS..Hα-helixtrans-64.3-41.4178.4-67.6167.8000110.6L172 E173 Q174 E179 R180L172-I176 HydrophobicContact CD1-CD1 4.25Å; L172-I176 HydrophobicContact CD1-CG1 4.42Å; L172-I176 HydrophobicContact CG-CD1 4Å; L172-I176 WeakPolarHBondContact O-CG1 3.46Å; L172-I176 PolarHBondContact O-N 3.47Å; E173-I176 PolarHBondContact O-N 3.3Å; Q174-I176 VanDerWaalsContact C-N 3.35Å; I176-E179 PolarHBondContact O-N 2.82Å; I176-R180 WeakPolarHBondContact O-CG 3.39Å; I176-R180 PolarHBondContact O-N 2.99Å
177T95.9Very high95.3Very high63 Ų63106.4 Ų106.439%0.38749%0.493SS..Hα-helixtrans-64-47.5177.254.30000111.5E173 Q174 E179 R180 E181E173-T177 WeakPolarHBondContact O-CG2 3.35Å; E173-T177 PolarHBondContact O-N 2.88Å; E173-T177 PolarHBondContact O-OG1 3.47Å; Q174-T177 WeakPolarHBondContact CA-OG1 3.17Å; Q174-T177 PolarHBondContact O-N 2.97Å; Q174-T177 PolarHBondContact O-OG1 3.34Å; T177-E179 VanDerWaalsContact C-N 3.29Å; T177-E179 PolarHBondContact O-N 3.44Å; T177-R180 WeakPolarHBondContact O-CB 3.41Å; T177-R180 PolarHBondContact O-N 3.42Å; T177-E181 WeakPolarHBondContact O-CG 3.49Å; T177-E181 PolarHBondContact O-N 2.91Å
178F95.2Very high95.4Very high129 Ų129104.1 Ų104.157%0.56649%0.486SS*.Hα-helixtrans-64.5-34.4177.8-74.6-48.6000112.8Q174 R175 E181 R182Q174-F178 WeakPolarHBondContact O-CD2 3.37Å; Q174-F178 PolarHBondContact O-N 3.03Å; R175-F178 PolarHBondContact O-N 3.32Å; F178-E181 WeakPolarHBondContact CD1-OE2 3.41Å; F178-R182 VanDerWaalsContact O-CB 3.25Å; F178-R182 WeakPolarHBondContact O-CB 3.4Å; F178-R182 PolarHBondContact O-N 2.96Å
179E95.5Very high95.3Very high92 Ų92103.7 Ų103.743%0.4348%0.481SS..Hα-helixtrans-69.3-36176.7-168171.3-171.900112.2R175 I176 T177 K183R175-E179 WeakPolarHBondContact O-CB 3.45Å; R175-E179 PolarHBondContact O-N 3.43Å; I176-E179 PolarHBondContact O-N 2.82Å; T177-E179 VanDerWaalsContact C-N 3.29Å; T177-E179 PolarHBondContact O-N 3.44Å; E179-K183 WeakPolarHBondContact O-CG 3.5Å; E179-K183 PolarHBondContact O-N 3.44Å; E179-K183 VanDerWaalsContact O-N 3.11Å; E179-K183 IonicContact OE1-NZ 3.1Å
180R95.7Very high95.2Very high162 Ų162104.1 Ų104.161%0.61148%0.483SS*.Hα-helixtrans-64.7-51.9170.9-73176.7-173.2164.63.2111.1I176 T177 R182 K183 D184I176-R180 WeakPolarHBondContact O-CG 3.39Å; I176-R180 PolarHBondContact O-N 2.99Å; T177-R180 WeakPolarHBondContact O-CB 3.41Å; T177-R180 PolarHBondContact O-N 3.42Å; R180-R182 VanDerWaalsContact C-N 3.26Å; R180-R182 PolarHBondContact O-N 3.43Å; R180-K183 PolarHBondContact O-N 3.48Å; R180-D184 PolarHBondContact O-N 2.88Å
181E95.8Very high95.2Very high115 Ų115106.5 Ų106.554%0.53750%0.495SS..Hα-helixtrans-56.8-41.4178.5-72.9177.2172.700111.8T177 F178 D184 N185T177-E181 WeakPolarHBondContact O-CG 3.49Å; T177-E181 PolarHBondContact O-N 2.91Å; F178-E181 WeakPolarHBondContact CD1-OE2 3.41Å; E181-D184 PolarHBondContact O-N 3.38Å; E181-N185 WeakPolarHBondContact O-CB 3.17Å; E181-N185 PolarHBondContact O-N 2.95Å
182R95Very high95.1Very high127 Ų127107.3 Ų107.348%0.47950%0.495SS..Hα-helixtrans-60.4-48.2174.8-176.8-17669.1109.1-8.2111.8F178 R180 N185 E186F178-R182 VanDerWaalsContact O-CB 3.25Å; F178-R182 WeakPolarHBondContact O-CB 3.4Å; F178-R182 PolarHBondContact O-N 2.96Å; R180-R182 VanDerWaalsContact C-N 3.26Å; R180-R182 PolarHBondContact O-N 3.43Å; R182-N185 PolarHBondContact O-N 3.27Å; R182-E186 HydrophobicContact CG-CG 4.49Å; R182-E186 WeakPolarHBondContact CG-OE1 3.46Å; R182-E186 IonicContact CZ-OE1 3.26Å; R182-E186 IonicContact NE-OE1 2.7Å; R182-E186 IonicContact NH1-OE1 2.63Å; R182-E186 PolarHBondContact NH1-OE1 3Å; R182-E186 IonicContact NH1-OE2 3.98Å; R182-E186 WeakPolarHBondContact O-CB 3.3Å; R182-E186 WeakPolarHBondContact O-CG 3.43Å; R182-E186 PolarHBondContact O-N 3.02Å
183K95.7Very high95Very high106 Ų106107.9 Ų107.946%0.46150%0.496SS..Hα-helixtrans-63.3-43.3179.1-76.6176.9-179173.60111.8E179 R180 N185 E186 M187E179-K183 WeakPolarHBondContact O-CG 3.5Å; E179-K183 PolarHBondContact O-N 3.44Å; E179-K183 VanDerWaalsContact O-N 3.11Å; E179-K183 IonicContact OE1-NZ 3.1Å; R180-K183 PolarHBondContact O-N 3.48Å; K183-N185 VanDerWaalsContact C-N 3.29Å; K183-N185 PolarHBondContact O-N 2.96Å; K183-E186 PolarHBondContact O-N 3.37Å; K183-M187 WeakPolarHBondContact O-CG 3.46Å; K183-M187 PolarHBondContact O-N 3.28Å
184D95Very high95Very high97 Ų97108.8 Ų108.852%0.51950%0.503SS..Hα-helixtrans-63.1-39.7177.8-66.9-16.8000111R180 E181 M187 L188R180-D184 PolarHBondContact O-N 2.88Å; E181-D184 PolarHBondContact O-N 3.38Å; D184-M187 PolarHBondContact O-N 2.9Å; D184-L188 WeakPolarHBondContact O-CB 3.46Å; D184-L188 PolarHBondContact O-N 3.02Å
185N94.3Very high94.9Very high88 Ų88108.1 Ų108.147%0.47150%0.5SS..Hα-helixtrans-68.1-43.5176.7-159.1-74000112.1E181 R182 K183 L188 H189E181-N185 WeakPolarHBondContact O-CB 3.17Å; E181-N185 PolarHBondContact O-N 2.95Å; R182-N185 PolarHBondContact O-N 3.27Å; K183-N185 VanDerWaalsContact C-N 3.29Å; K183-N185 PolarHBondContact O-N 2.96Å; N185-L188 PolarHBondContact O-N 2.91Å; N185-H189 PolarHBondContact O-CD2 3.2Å; N185-H189 PolarHBondContact O-N 3.44Å; N185-H189 PolarHBondContact OD1-CD2 3.43Å; N185-H189 PolarHBondContact OD1-NE2 3.32Å; N185-H189 VanDerWaalsContact OD1-NE2 3.15Å
186E92.6Very high94.8Very high98 Ų98105.9 Ų105.946%0.45850%0.496SS..Hα-helixtrans-58.4-47.5173.3-77.2171.7-169.800111R182 K183 L188 H189 E190R182-E186 HydrophobicContact CG-CG 4.49Å; R182-E186 WeakPolarHBondContact CG-OE1 3.46Å; R182-E186 IonicContact CZ-OE1 3.26Å; R182-E186 IonicContact NE-OE1 2.7Å; R182-E186 IonicContact NH1-OE1 2.63Å; R182-E186 PolarHBondContact NH1-OE1 3Å; R182-E186 IonicContact NH1-OE2 3.98Å; R182-E186 WeakPolarHBondContact O-CB 3.3Å; R182-E186 WeakPolarHBondContact O-CG 3.43Å; R182-E186 PolarHBondContact O-N 3.02Å; K183-E186 PolarHBondContact O-N 3.37Å; E186-L188 PolarHBondContact O-N 3.42Å; E186-H189 PolarHBondContact O-N 3.23Å; E186-E190 WeakPolarHBondContact O-CB 3.46Å; E186-E190 PolarHBondContact O-N 3.12Å
187M95.3Very high94.8Very high124 Ų124109.1 Ų109.161%0.61151%0.508SS*.Hα-helixtrans-61.8-44.1176.9-72.5-163.8-55.600112.5K183 D184 H189 E190 E191K183-M187 WeakPolarHBondContact O-CG 3.46Å; K183-M187 PolarHBondContact O-N 3.28Å; D184-M187 PolarHBondContact O-N 2.9Å; M187-H189 VanDerWaalsContact C-N 3.29Å; M187-H189 PolarHBondContact O-N 3.42Å; M187-E190 PolarHBondContact O-N 3.39Å; M187-E191 WeakPolarHBondContact O-CB 3.24Å; M187-E191 PolarHBondContact O-N 2.96Å
188L95.9Very high94.7Very high79 Ų79108.9 Ų108.941%0.41451%0.512SS..Hα-helixtrans-60.5-39.9178179.767.2000111.9D184 N185 E186 K192D184-L188 WeakPolarHBondContact O-CB 3.46Å; D184-L188 PolarHBondContact O-N 3.02Å; N185-L188 PolarHBondContact O-N 2.91Å; E186-L188 PolarHBondContact O-N 3.42Å; L188-K192 WeakPolarHBondContact O-CG 3.44Å; L188-K192 PolarHBondContact O-N 2.95Å; L188-K192 VanDerWaalsContact O-N 3.15Å
189H92.4Very high94.7Very high98 Ų98108.5 Ų108.545%0.45451%0.51SS..Hα-helixtrans-73.1-37.7177.8-77.3-59000112.4N185 E186 M187 K192 M193N185-H189 PolarHBondContact O-CD2 3.2Å; N185-H189 PolarHBondContact O-N 3.44Å; N185-H189 PolarHBondContact OD1-CD2 3.43Å; N185-H189 PolarHBondContact OD1-NE2 3.32Å; N185-H189 VanDerWaalsContact OD1-NE2 3.15Å; E186-H189 PolarHBondContact O-N 3.23Å; M187-H189 VanDerWaalsContact C-N 3.29Å; M187-H189 PolarHBondContact O-N 3.42Å; H189-K192 PolarHBondContact O-N 2.95Å; H189-M193 VanDerWaalsContact O-CG 3.28Å; H189-M193 WeakPolarHBondContact O-CG 3.33Å; H189-M193 PolarHBondContact O-N 3.01Å
190E94.8Very high94.5Very high117 Ų117108.4 Ų108.455%0.54751%0.512SS..Hα-helixtrans-63-44.9174.7-167.463.4-156.700111.2E186 M187 K192 M193 I194E186-E190 WeakPolarHBondContact O-CB 3.46Å; E186-E190 PolarHBondContact O-N 3.12Å; M187-E190 PolarHBondContact O-N 3.39Å; E190-K192 PolarHBondContact O-N 2.95Å; E190-M193 WeakPolarHBondContact O-CB 3.38Å; E190-M193 PolarHBondContact O-N 3.3Å; E190-M193 VanDerWaalsContact O-N 3.14Å; E190-I194 HydrophobicContact CG-CD1 4.31Å; E190-I194 WeakPolarHBondContact O-CG1 3.41Å; E190-I194 PolarHBondContact O-N 3.12Å
191E95.4Very high94.4Very high136 Ų136105.2 Ų105.264%0.63651%0.507SS*.Hα-helixtrans-58.8-45.8175.8-173.3179.4-170.400111.4M187 M193 I194 E195M187-E191 WeakPolarHBondContact O-CB 3.24Å; M187-E191 PolarHBondContact O-N 2.96Å; E191-M193 VanDerWaalsContact C-N 3.32Å; E191-M193 PolarHBondContact O-N 2.93Å; E191-I194 PolarHBondContact O-N 3.33Å; E191-E195 WeakPolarHBondContact O-CB 3.46Å; E191-E195 PolarHBondContact O-N 3.2Å
192K94.6Very high94.3Very high95 Ų95105.6 Ų105.641%0.41351%0.512SS..Hα-helixtrans-61.2-38.9175.1-76.8175.1-179.7174.70112.6L188 H189 E190 E195 Q196L188-K192 WeakPolarHBondContact O-CG 3.44Å; L188-K192 PolarHBondContact O-N 2.95Å; L188-K192 VanDerWaalsContact O-N 3.15Å; H189-K192 PolarHBondContact O-N 2.95Å; E190-K192 PolarHBondContact O-N 2.95Å; K192-E195 PolarHBondContact O-N 3.43Å; K192-Q196 WeakPolarHBondContact O-CB 3.45Å; K192-Q196 VanDerWaalsContact O-CG 3.28Å; K192-Q196 WeakPolarHBondContact O-CG 3.39Å; K192-Q196 PolarHBondContact O-N 3.26Å
193M92.7Very high94.2Very high114 Ų114105.4 Ų105.456%0.56252%0.515SS*.Hα-helixtrans-66.3-41.9177.3-74.4-63.5-7100111.4H189 E190 E191 Q196 K197H189-M193 VanDerWaalsContact O-CG 3.28Å; H189-M193 WeakPolarHBondContact O-CG 3.33Å; H189-M193 PolarHBondContact O-N 3.01Å; E190-M193 WeakPolarHBondContact O-CB 3.38Å; E190-M193 PolarHBondContact O-N 3.3Å; E190-M193 VanDerWaalsContact O-N 3.14Å; E191-M193 VanDerWaalsContact C-N 3.32Å; E191-M193 PolarHBondContact O-N 2.93Å; M193-Q196 PolarHBondContact O-N 2.69Å; M193-K197 WeakPolarHBondContact O-CB 3.45Å; M193-K197 PolarHBondContact O-N 3.44Å
194I95.1Very high93.9Very high104 Ų104106.7 Ų106.753%0.53352%0.518SS..Hα-helixtrans-63.1-46174.9-67168.2000110.5E190 E191 Q196 K197 A198E190-I194 HydrophobicContact CG-CD1 4.31Å; E190-I194 WeakPolarHBondContact O-CG1 3.41Å; E190-I194 PolarHBondContact O-N 3.12Å; E191-I194 PolarHBondContact O-N 3.33Å; I194-Q196 PolarHBondContact O-N 2.94Å; I194-K197 PolarHBondContact O-N 3.03Å; I194-A198 WeakPolarHBondContact O-CB 3.34Å; I194-A198 PolarHBondContact O-N 3.42Å
195E95.1Very high93.9Very high98 Ų98104 Ų10446%0.45851%0.513SS..Hα-helixtrans-61-44.4178.5-166.8-162.816900111.6E191 K192 K197 A198 K199E191-E195 WeakPolarHBondContact O-CB 3.46Å; E191-E195 PolarHBondContact O-N 3.2Å; K192-E195 PolarHBondContact O-N 3.43Å; E195-K197 VanDerWaalsContact C-N 3.34Å; E195-K197 PolarHBondContact O-N 3.39Å; E195-A198 PolarHBondContact O-N 3.09Å; E195-K199 WeakPolarHBondContact O-CG 3.43Å; E195-K199 PolarHBondContact O-N 3.16Å; E195-K199 WeakPolarHBondContact OE1-CE 3.41Å; E195-K199 IonicContact OE1-NZ 3.71Å; E195-K199 PolarHBondContact OE1-NZ 2.91Å; E195-K199 IonicContact OE2-NZ 3.98Å
196Q93.9Very high93.8Very high113 Ų113103 Ų10353%0.52851%0.51SS..Hα-helixtrans-63-40.4175.9-76.5-178.8-4.200112.1K192 M193 I194 K199 L200K192-Q196 WeakPolarHBondContact O-CB 3.45Å; K192-Q196 VanDerWaalsContact O-CG 3.28Å; K192-Q196 WeakPolarHBondContact O-CG 3.39Å; K192-Q196 PolarHBondContact O-N 3.26Å; M193-Q196 PolarHBondContact O-N 2.69Å; I194-Q196 PolarHBondContact O-N 2.94Å; Q196-K199 PolarHBondContact O-N 2.97Å; Q196-L200 PolarHBondContact O-N 3.48Å
197K94.4Very high93.7Very high137 Ų137101.8 Ų101.860%0.59651%0.505SS*.Hα-helixtrans-63.9-45.4176.5-165.3178.9-179.1-176.20111.3M193 I194 E195 K199 L200 D201M193-K197 WeakPolarHBondContact O-CB 3.45Å; M193-K197 PolarHBondContact O-N 3.44Å; I194-K197 PolarHBondContact O-N 3.03Å; E195-K197 VanDerWaalsContact C-N 3.34Å; E195-K197 PolarHBondContact O-N 3.39Å; K197-K199 VanDerWaalsContact C-N 3.32Å; K197-K199 PolarHBondContact O-N 3.47Å; K197-L200 PolarHBondContact O-N 2.93Å; K197-D201 VanDerWaalsContact O-CG 3.32Å; K197-D201 PolarHBondContact O-N 3.44Å
198A94.5Very high93.5Very high57 Ų57100.9 Ų100.947%0.47150%0.5SS..Hα-helixtrans-60.9-39.6175.900000112.5I194 E195 D201 L202I194-A198 WeakPolarHBondContact O-CB 3.34Å; I194-A198 PolarHBondContact O-N 3.42Å; E195-A198 PolarHBondContact O-N 3.09Å; A198-D201 PolarHBondContact O-N 3.42Å; A198-L202 WeakPolarHBondContact O-CB 3.44Å; A198-L202 PolarHBondContact O-N 3.04Å
199K94.1Very high93.3Very high121 Ų121103.1 Ų103.153%0.52651%0.507SS..Hα-helixtrans-63.4-42.3174.3-74.8173.4-175.8167.70112.3E195 Q196 K197 F203E195-K199 WeakPolarHBondContact O-CG 3.43Å; E195-K199 PolarHBondContact O-N 3.16Å; E195-K199 WeakPolarHBondContact OE1-CE 3.41Å; E195-K199 IonicContact OE1-NZ 3.71Å; E195-K199 PolarHBondContact OE1-NZ 2.91Å; E195-K199 IonicContact OE2-NZ 3.98Å; Q196-K199 PolarHBondContact O-N 2.97Å; K197-K199 VanDerWaalsContact C-N 3.32Å; K197-K199 PolarHBondContact O-N 3.47Å; K199-F203 WeakPolarHBondContact O-CB 3.32Å; K199-F203 PolarHBondContact O-N 3.37Å
200L92.5Very high93.3Very high91 Ų91103.3 Ų103.348%0.47651%0.508SS..Hα-helixtrans-64.7-45.7175.8-80.8163.6000111.4Q196 K197 L202 F203 Y204Q196-L200 PolarHBondContact O-N 3.48Å; K197-L200 PolarHBondContact O-N 2.93Å; L200-L202 VanDerWaalsContact C-N 3.33Å; L200-L202 PolarHBondContact O-N 2.83Å; L200-F203 PolarHBondContact O-N 3.42Å; L200-Y204 HydrophobicContact CB-CD2 4.48Å; L200-Y204 HydrophobicContact CB-CE2 4.38Å; L200-Y204 HydrophobicContact CD2-CE2 4.29Å; L200-Y204 WeakPolarHBondContact O-CD2 3.39Å; L200-Y204 PolarHBondContact O-N 3.22Å
201D93.2Very high93.2Very high94 Ų9499.5 Ų99.550%0.50349%0.493SS..Hα-helixtrans-62.2-41.2178.7-69.7-21.3000111.3K197 A198 Y204 G205K197-D201 VanDerWaalsContact O-CG 3.32Å; K197-D201 PolarHBondContact O-N 3.44Å; A198-D201 PolarHBondContact O-N 3.42Å; D201-Y204 PolarHBondContact O-N 3.46Å; D201-G205 PolarHBondContact O-N 3.48Å
202L93.9Very high93Very high123 Ų12398.4 Ų98.464%0.64449%0.487SS*.Hα-helixtrans-62.2-46.1173.1-178.964.6000111.5A198 L200 Y204 G205 T206A198-L202 WeakPolarHBondContact O-CB 3.44Å; A198-L202 PolarHBondContact O-N 3.04Å; L200-L202 VanDerWaalsContact C-N 3.33Å; L200-L202 PolarHBondContact O-N 2.83Å; L202-Y204 PolarHBondContact O-N 2.84Å; L202-G205 PolarHBondContact O-N 3.09Å; L202-T206 PolarHBondContact O-N 2.96Å; L202-T206 PolarHBondContact O-OG1 3.48Å; L202-T206 VanDerWaalsContact O-OG1 3.07Å
203F93Very high92.8Very high123 Ų12398.4 Ų98.454%0.53949%0.489SS..Hα-helixtrans-61.6-42.8178.5179-113.7000112.2K199 L200 Q207K199-F203 WeakPolarHBondContact O-CB 3.32Å; K199-F203 PolarHBondContact O-N 3.37Å; L200-F203 PolarHBondContact O-N 3.42Å; F203-Q207 PolarHBondContact O-N 2.95Å
204Y90.2Very high92.8Very high133 Ų133100.2 Ų100.252%0.52249%0.489SS..Hα-helixtrans-64.8-42.7173.5-75.7-58.4000111.8L200 D201 L202 Q207 M208L200-Y204 HydrophobicContact CB-CD2 4.48Å; L200-Y204 HydrophobicContact CB-CE2 4.38Å; L200-Y204 HydrophobicContact CD2-CE2 4.29Å; L200-Y204 WeakPolarHBondContact O-CD2 3.39Å; L200-Y204 PolarHBondContact O-N 3.22Å; D201-Y204 PolarHBondContact O-N 3.46Å; L202-Y204 PolarHBondContact O-N 2.84Å; Y204-Q207 PolarHBondContact O-N 3.34Å; Y204-M208 WeakPolarHBondContact O-CG 3.23Å; Y204-M208 PolarHBondContact O-N 2.83Å
205G93.6Very high92.7Very high40 Ų40101 Ų10141%0.41249%0.489SS..Hα-helixtrans-58.9-47.2176.200000112.5D201 L202 M208 F209D201-G205 PolarHBondContact O-N 3.48Å; L202-G205 PolarHBondContact O-N 3.09Å; G205-M208 PolarHBondContact O-N 3.26Å; G205-F209 PolarHBondContact O-N 3.35Å
206T92.8Very high92.5Very high67 Ų67100.6 Ų100.641%0.41149%0.49SS..Hα-helixtrans-61.6-45.4175.9-56.70000111.5L202 M208 F209 E210L202-T206 PolarHBondContact O-N 2.96Å; L202-T206 PolarHBondContact O-OG1 3.48Å; L202-T206 VanDerWaalsContact O-OG1 3.07Å; T206-M208 VanDerWaalsContact C-N 3.34Å; T206-M208 PolarHBondContact O-N 3.32Å; T206-F209 PolarHBondContact O-N 3.35Å; T206-E210 WeakPolarHBondContact O-CG 3.48Å; T206-E210 PolarHBondContact O-N 3Å
207Q91.2Very high92.4Very high73 Ų7399.8 Ų99.834%0.34149%0.486SS..Hα-helixtrans-62.4-39.5176.8-81.8-169.763.200113F203 Y204 E210 V211F203-Q207 PolarHBondContact O-N 2.95Å; Y204-Q207 PolarHBondContact O-N 3.34Å; Q207-E210 PolarHBondContact O-N 3.29Å; Q207-V211 VanDerWaalsContact O-CG2 3.28Å; Q207-V211 WeakPolarHBondContact O-CG2 3.24Å; Q207-V211 PolarHBondContact O-N 3.46Å
208M90.8Very high92.3Very high105 Ų10599.7 Ų99.752%0.51749%0.488SS..Hα-helixtrans-64-44.9175.8-72.1-57.4101.900110.9Y204 G205 T206 E210 V211 E212Y204-M208 WeakPolarHBondContact O-CG 3.23Å; Y204-M208 PolarHBondContact O-N 2.83Å; G205-M208 PolarHBondContact O-N 3.26Å; T206-M208 VanDerWaalsContact C-N 3.34Å; T206-M208 PolarHBondContact O-N 3.32Å; M208-E210 PolarHBondContact O-N 3.19Å; M208-V211 PolarHBondContact O-N 2.92Å; M208-E212 WeakPolarHBondContact O-CG 3.43Å; M208-E212 PolarHBondContact O-N 2.97Å
209F92.2Very high92.1Very high127 Ų127101.2 Ų101.256%0.55749%0.487SS*.Hα-helixtrans-60.5-44.1176.3-174-96.8000112.2G205 T206 V211 E212 E213G205-F209 PolarHBondContact O-N 3.35Å; T206-F209 PolarHBondContact O-N 3.35Å; F209-V211 VanDerWaalsContact C-N 3.31Å; F209-V211 PolarHBondContact O-N 2.94Å; F209-E212 PolarHBondContact O-N 3.37Å; F209-E213 HydrophobicContact CD1-CG 4.18Å; F209-E213 HydrophobicContact CE1-CG 3.67Å; F209-E213 HydrophobicContact CZ-CG 3.87Å; F209-E213 PolarHBondContact O-N 2.88Å
210E92.1Very high92Very high102 Ų102100.8 Ų100.848%0.47749%0.485SS..Hα-helixtrans-62-36.7175.4-75.1178.9-173.800113.1T206 Q207 M208 R214T206-E210 WeakPolarHBondContact O-CG 3.48Å; T206-E210 PolarHBondContact O-N 3Å; Q207-E210 PolarHBondContact O-N 3.29Å; M208-E210 PolarHBondContact O-N 3.19Å; E210-R214 WeakPolarHBondContact O-CB 3.33Å; E210-R214 WeakPolarHBondContact O-CG 3.49Å; E210-R214 PolarHBondContact O-N 3.44Å; E210-R214 VanDerWaalsContact O-N 3.11Å; E210-R214 PolarHBondContact O-NE 3.46Å
211V91.8Very high92Very high37 Ų3799.7 Ų99.722%0.22448%0.48CS..Hα-helixtrans-69.5-41.8175.4169.90000110.8Q207 M208 F209 R214 K215Q207-V211 VanDerWaalsContact O-CG2 3.28Å; Q207-V211 WeakPolarHBondContact O-CG2 3.24Å; Q207-V211 PolarHBondContact O-N 3.46Å; M208-V211 PolarHBondContact O-N 2.92Å; F209-V211 VanDerWaalsContact C-N 3.31Å; F209-V211 PolarHBondContact O-N 2.94Å; V211-R214 VanDerWaalsContact CG2-NH2 3.25Å; V211-R214 PolarHBondContact O-N 3.16Å; V211-K215 HydrophobicContact CG1-CD 4.16Å; V211-K215 WeakPolarHBondContact O-CG 3.34Å; V211-K215 PolarHBondContact O-N 3.4Å
212E91.7Very high91.9Very high112 Ų112100.1 Ų100.152%0.52348%0.482SS..Hα-helixtrans-63.1-45.8176.3-76.2179.7176.700111.6M208 F209 R214 K215 N216M208-E212 WeakPolarHBondContact O-CG 3.43Å; M208-E212 PolarHBondContact O-N 2.97Å; F209-E212 PolarHBondContact O-N 3.37Å; E212-R214 PolarHBondContact O-N 3.45Å; E212-K215 WeakPolarHBondContact O-CB 3.33Å; E212-K215 PolarHBondContact O-N 2.97Å; E212-K215 VanDerWaalsContact O-N 3.15Å; E212-N216 WeakPolarHBondContact O-CB 3.47Å; E212-N216 VanDerWaalsContact O-CG 3.26Å; E212-N216 PolarHBondContact O-N 3.06Å; E212-N216 PolarHBondContact O-ND2 2.63Å
213E90.9Very high91.7Very high96 Ų9699.7 Ų99.745%0.44948%0.477SS..Hα-helixtrans-59.7-44.5175-83.6-63.9114.100111.9F209 K215 N216 Q217F209-E213 HydrophobicContact CD1-CG 4.18Å; F209-E213 HydrophobicContact CE1-CG 3.67Å; F209-E213 HydrophobicContact CZ-CG 3.87Å; F209-E213 PolarHBondContact O-N 2.88Å; E213-K215 VanDerWaalsContact C-N 3.32Å; E213-K215 PolarHBondContact O-N 2.94Å; E213-N216 PolarHBondContact O-N 3.41Å; E213-Q217 WeakPolarHBondContact O-CB 3.48Å; E213-Q217 PolarHBondContact O-N 3.47Å
214R91.9Very high91.7Very high151 Ų15197.9 Ų97.957%0.5747%0.473SS*.Hα-helixtrans-60.5-40.7174.7-81.7-176.4-80.7124.5-9.9112.5E210 V211 E212 Q218E210-R214 WeakPolarHBondContact O-CB 3.33Å; E210-R214 WeakPolarHBondContact O-CG 3.49Å; E210-R214 PolarHBondContact O-N 3.44Å; E210-R214 VanDerWaalsContact O-N 3.11Å; E210-R214 PolarHBondContact O-NE 3.46Å; V211-R214 VanDerWaalsContact CG2-NH2 3.25Å; V211-R214 PolarHBondContact O-N 3.16Å; E212-R214 PolarHBondContact O-N 3.45Å; R214-Q218 WeakPolarHBondContact O-CB 3.38Å; R214-Q218 PolarHBondContact O-N 3.28Å
215K92Very high91.6Very high122 Ų12298 Ų9853%0.5348%0.477SS..Hα-helixtrans-67.7-42.8176.5-74.8173.9178.1178.30111.7V211 E212 E213 Q217 Q218 I219V211-K215 HydrophobicContact CG1-CD 4.16Å; V211-K215 WeakPolarHBondContact O-CG 3.34Å; V211-K215 PolarHBondContact O-N 3.4Å; E212-K215 WeakPolarHBondContact O-CB 3.33Å; E212-K215 PolarHBondContact O-N 2.97Å; E212-K215 VanDerWaalsContact O-N 3.15Å; E213-K215 VanDerWaalsContact C-N 3.32Å; E213-K215 PolarHBondContact O-N 2.94Å; K215-Q217 VanDerWaalsContact C-N 3.34Å; K215-Q218 PolarHBondContact O-N 3.25Å; K215-I219 VanDerWaalsContact O-CG1 3.3Å; K215-I219 WeakPolarHBondContact O-CG1 3.4Å; K215-I219 PolarHBondContact O-N 2.91Å
216N91.8Very high91.4Very high89 Ų89101.9 Ų101.948%0.47648%0.484SS..Hα-helixtrans-63.3-42177.7-72.7-19.8000111.2E212 E213 I219 K220E212-N216 WeakPolarHBondContact O-CB 3.47Å; E212-N216 VanDerWaalsContact O-CG 3.26Å; E212-N216 PolarHBondContact O-N 3.06Å; E212-N216 PolarHBondContact O-ND2 2.63Å; E213-N216 PolarHBondContact O-N 3.41Å; N216-I219 PolarHBondContact O-N 2.7Å; N216-K220 WeakPolarHBondContact O-CB 3.29Å; N216-K220 PolarHBondContact O-N 2.87Å
217Q92.2Very high91.3Very high95 Ų95103.4 Ų103.444%0.44449%0.49SS..Hα-helixtrans-61.5-45173.6-172.55950.300111.1E213 K215 I219 K220 D221E213-Q217 WeakPolarHBondContact O-CB 3.48Å; E213-Q217 PolarHBondContact O-N 3.47Å; K215-Q217 VanDerWaalsContact C-N 3.34Å; Q217-I219 VanDerWaalsContact C-N 3.35Å; Q217-I219 PolarHBondContact O-N 3.02Å; Q217-K220 WeakPolarHBondContact O-CB 3.48Å; Q217-K220 PolarHBondContact O-N 2.91Å; Q217-D221 PolarHBondContact NE2-OD1 3.24Å; Q217-D221 PolarHBondContact O-N 3.29Å
218Q91.7Very high91.2Very high136 Ų136105.2 Ų105.264%0.63650%0.502SS*.Hα-helixtrans-62.1-40176.1-173.6-179.49.700112.6R214 K215 K220 D221 L222R214-Q218 WeakPolarHBondContact O-CB 3.38Å; R214-Q218 PolarHBondContact O-N 3.28Å; K215-Q218 PolarHBondContact O-N 3.25Å; Q218-K220 VanDerWaalsContact C-N 3.33Å; Q218-D221 PolarHBondContact O-N 3.36Å; Q218-L222 WeakPolarHBondContact O-CB 3.49Å; Q218-L222 PolarHBondContact O-N 3.01Å
219I90.1Very high91.1Very high89 Ų89102.9 Ų102.946%0.45650%0.499SS..Hα-helixtrans-61.4-45.2175.2-71.3165.4000109.9K215 N216 Q217 L222 Q223K215-I219 VanDerWaalsContact O-CG1 3.3Å; K215-I219 WeakPolarHBondContact O-CG1 3.4Å; K215-I219 PolarHBondContact O-N 2.91Å; N216-I219 PolarHBondContact O-N 2.7Å; Q217-I219 VanDerWaalsContact C-N 3.35Å; Q217-I219 PolarHBondContact O-N 3.02Å; I219-L222 PolarHBondContact O-N 3.4Å; I219-Q223 WeakPolarHBondContact O-CG 3.49Å; I219-Q223 PolarHBondContact O-N 2.88Å
220K92.2Very high90.9Very high111 Ų111103.5 Ų103.548%0.48350%0.502SS..Hα-helixtrans-62.1-47.8177.8-173.1-178.1177.7-175.70111.5N216 Q217 Q218 L222 Q223 D224N216-K220 WeakPolarHBondContact O-CB 3.29Å; N216-K220 PolarHBondContact O-N 2.87Å; Q217-K220 WeakPolarHBondContact O-CB 3.48Å; Q217-K220 PolarHBondContact O-N 2.91Å; Q218-K220 VanDerWaalsContact C-N 3.33Å; K220-L222 PolarHBondContact O-N 2.9Å; K220-Q223 WeakPolarHBondContact O-CB 3.28Å; K220-Q223 PolarHBondContact O-N 2.88Å; K220-Q223 VanDerWaalsContact O-N 3.12Å; K220-D224 PolarHBondContact O-N 2.73Å
221D91.9Very high90.7Very high69 Ų69102.7 Ų102.737%0.36950%0.501SS..Hα-helixtrans-59.2-39.2177.2-64.1-16.2000110.9Q217 Q218 D224 H225Q217-D221 PolarHBondContact NE2-OD1 3.24Å; Q217-D221 PolarHBondContact O-N 3.29Å; Q218-D221 PolarHBondContact O-N 3.36Å; D221-D224 PolarHBondContact O-N 3.14Å; D221-H225 WeakPolarHBondContact O-CB 3.43Å; D221-H225 PolarHBondContact O-N 2.77Å; D221-H225 PolarHBondContact O-ND1 3.25Å
222L91.4Very high90.4Very high102 Ų102105.2 Ų105.253%0.53451%0.513SS..Hα-helixtrans-67.7-40.1177.3-163.273.8000111.9Q218 I219 K220 H225 H226Q218-L222 WeakPolarHBondContact O-CB 3.49Å; Q218-L222 PolarHBondContact O-N 3.01Å; I219-L222 PolarHBondContact O-N 3.4Å; K220-L222 PolarHBondContact O-N 2.9Å; L222-H225 PolarHBondContact O-N 3.44Å; L222-H226 WeakPolarHBondContact O-CB 3.31Å; L222-H226 PolarHBondContact O-CD2 2.93Å; L222-H226 PolarHBondContact O-N 2.85Å
223Q90.5Very high90Very high115 Ų115104.7 Ų104.754%0.53751%0.512SS..Hα-helixtrans-61.3-48.2173.2-74.7176.7-32.700111.1I219 K220 H225 H226 D227I219-Q223 WeakPolarHBondContact O-CG 3.49Å; I219-Q223 PolarHBondContact O-N 2.88Å; K220-Q223 WeakPolarHBondContact O-CB 3.28Å; K220-Q223 PolarHBondContact O-N 2.88Å; K220-Q223 VanDerWaalsContact O-N 3.12Å; Q223-H225 VanDerWaalsContact C-N 3.32Å; Q223-H225 PolarHBondContact O-N 3.3Å; Q223-H226 WeakPolarHBondContact O-CB 3.48Å; Q223-H226 PolarHBondContact O-N 3.39Å; Q223-H226 VanDerWaalsContact O-N 3.12Å; Q223-D227 PolarHBondContact O-N 3.41Å
224D91.6Very high89.8Confident85 Ų85106 Ų10646%0.45552%0.516SS..Hα-helixtrans-60.8-41.8178.6-69.9-18.2000111.2K220 D221 D227 L228K220-D224 PolarHBondContact O-N 2.73Å; D221-D224 PolarHBondContact O-N 3.14Å; D224-D227 PolarHBondContact O-N 3.16Å; D224-L228 WeakPolarHBondContact O-CB 3.4Å; D224-L228 PolarHBondContact O-N 2.92Å
225H89.5Confident89.4Confident135 Ų135102.9 Ų102.963%0.62551%0.511SS*.Hα-helixtrans-65.1-40.6174.2-80.578.2000112.5D221 L222 Q223 L228 A229D221-H225 WeakPolarHBondContact O-CB 3.43Å; D221-H225 PolarHBondContact O-N 2.77Å; D221-H225 PolarHBondContact O-ND1 3.25Å; L222-H225 PolarHBondContact O-N 3.44Å; Q223-H225 VanDerWaalsContact C-N 3.32Å; Q223-H225 PolarHBondContact O-N 3.3Å; H225-L228 PolarHBondContact O-N 3.44Å; H225-A229 VanDerWaalsContact O-CB 3.29Å; H225-A229 WeakPolarHBondContact O-CB 3.24Å; H225-A229 PolarHBondContact O-N 3.34Å
226H89.6Confident89Confident121 Ų121103.8 Ų103.856%0.5651%0.512SS*.Hα-helixtrans-65.3-41.8177-82.1-148.2000111.5L222 Q223 L228 A229 F230L222-H226 WeakPolarHBondContact O-CB 3.31Å; L222-H226 PolarHBondContact O-CD2 2.93Å; L222-H226 PolarHBondContact O-N 2.85Å; Q223-H226 WeakPolarHBondContact O-CB 3.48Å; Q223-H226 PolarHBondContact O-N 3.39Å; Q223-H226 VanDerWaalsContact O-N 3.12Å; H226-L228 VanDerWaalsContact C-N 3.34Å; H226-A229 PolarHBondContact O-N 2.93Å; H226-F230 WeakPolarHBondContact O-CB 3.42Å; H226-F230 PolarHBondContact O-N 3.46Å
227D89.2Confident88.5Confident100 Ų100105.4 Ų105.454%0.53551%0.512SS..Hα-helixtrans-65.4-39.1176.8-78.8-16000111.5Q223 D224 F230 N231Q223-D227 PolarHBondContact O-N 3.41Å; D224-D227 PolarHBondContact O-N 3.16Å; D227-F230 PolarHBondContact O-N 3.49Å; D227-N231 WeakPolarHBondContact O-CB 3.33Å; D227-N231 PolarHBondContact O-N 2.94Å; D227-N231 PolarHBondContact O-ND2 3.25Å
228L90.4Very high88.1Confident110 Ų110105.3 Ų105.358%0.57652%0.515SS*.Hα-helixtrans-66.4-47.9175.4-158.7131.1000111.1D224 H225 H226 F230 N231 D232D224-L228 WeakPolarHBondContact O-CB 3.4Å; D224-L228 PolarHBondContact O-N 2.92Å; H225-L228 PolarHBondContact O-N 3.44Å; H226-L228 VanDerWaalsContact C-N 3.34Å; L228-F230 VanDerWaalsContact C-N 3.31Å; L228-F230 PolarHBondContact O-N 2.93Å; L228-N231 PolarHBondContact O-N 3.32Å; L228-D232 WeakPolarHBondContact O-CB 3.33Å; L228-D232 PolarHBondContact O-N 2.93Å
229A87.8Confident87.6Confident57 Ų57103.8 Ų103.847%0.47151%0.511SS..Hα-helixtrans-62.2-37.3175.400000112.4H225 H226 D232 M233H225-A229 VanDerWaalsContact O-CB 3.29Å; H225-A229 WeakPolarHBondContact O-CB 3.24Å; H225-A229 PolarHBondContact O-N 3.34Å; H226-A229 PolarHBondContact O-N 2.93Å; A229-D232 PolarHBondContact O-N 3.41Å; A229-M233 VanDerWaalsContact O-CB 3.24Å; A229-M233 WeakPolarHBondContact O-CB 3.49Å; A229-M233 PolarHBondContact O-N 2.86Å
230F88.8Confident87Confident140 Ų140102 Ų10261%0.61450%0.502SS*.Hα-helixtrans-66-42.3175.2-177.9-96.3000111.3H226 D227 L228 M233 K234H226-F230 WeakPolarHBondContact O-CB 3.42Å; H226-F230 PolarHBondContact O-N 3.46Å; D227-F230 PolarHBondContact O-N 3.49Å; L228-F230 VanDerWaalsContact C-N 3.31Å; L228-F230 PolarHBondContact O-N 2.93Å; F230-M233 PolarHBondContact O-N 3.48Å; F230-K234 VanDerWaalsContact O-CB 3.23Å; F230-K234 WeakPolarHBondContact O-CB 3.37Å; F230-K234 PolarHBondContact O-N 3.18Å
231N87.5Confident86.3Confident84 Ų84100.2 Ų100.245%0.44950%0.5SS..Hα-helixtrans-65.5-41.7174.1-84.4-33000112.1D227 L228 M233 K234 N235D227-N231 WeakPolarHBondContact O-CB 3.33Å; D227-N231 PolarHBondContact O-N 2.94Å; D227-N231 PolarHBondContact O-ND2 3.25Å; L228-N231 PolarHBondContact O-N 3.32Å; N231-M233 VanDerWaalsContact C-N 3.35Å; N231-K234 PolarHBondContact O-N 2.96Å; N231-N235 WeakPolarHBondContact O-CB 3.42Å; N231-N235 PolarHBondContact O-N 3.49Å; N231-N235 PolarHBondContact O-ND2 2.98Å
232D86.3Confident85.7Confident91 Ų91102.3 Ų102.349%0.48751%0.511SS..Hα-helixtrans-62.5-43.2175.1-74.1-13.6000111.2L228 A229 N235 Y236L228-D232 WeakPolarHBondContact O-CB 3.33Å; L228-D232 PolarHBondContact O-N 2.93Å; A229-D232 PolarHBondContact O-N 3.41Å; D232-N235 PolarHBondContact O-N 2.77Å; D232-Y236 VanDerWaalsContact O-CB 3.28Å; D232-Y236 WeakPolarHBondContact O-CB 3.33Å; D232-Y236 PolarHBondContact O-N 3.34Å
233M82.7Confident84.9Confident101 Ų101102.6 Ų102.650%0.49851%0.513SS..Hα-helixtrans-66-40.5176.2-169.6165.4-157.600111.5A229 F230 N231 Y236 Y237A229-M233 VanDerWaalsContact O-CB 3.24Å; A229-M233 WeakPolarHBondContact O-CB 3.49Å; A229-M233 PolarHBondContact O-N 2.86Å; F230-M233 PolarHBondContact O-N 3.48Å; N231-M233 VanDerWaalsContact C-N 3.35Å; M233-Y236 PolarHBondContact O-N 3.26Å; M233-Y237 HydrophobicContact CE-CE2 3.5Å; M233-Y237 VanDerWaalsContact CE-OH 3.3Å; M233-Y237 WeakPolarHBondContact CE-OH 3.37Å; M233-Y237 HydrophobicContact CG-CD2 3.75Å; M233-Y237 HydrophobicContact CG-CE2 3.42Å; M233-Y237 VanDerWaalsContact CG-CE2 3.42Å; M233-Y237 WeakPolarHBondContact O-CD2 3.4Å; M233-Y237 PolarHBondContact O-N 2.88Å; M233-Y237 HydrophobicContact SD-CE2 4.1Å
234K85.7Confident84Confident123 Ų123100.6 Ų100.654%0.53551%0.506SS..Hα-helixtrans-61.3-45.5173.7-176.6-179176-175.50110.9F230 N231 Y237 N238F230-K234 VanDerWaalsContact O-CB 3.23Å; F230-K234 WeakPolarHBondContact O-CB 3.37Å; F230-K234 PolarHBondContact O-N 3.18Å; N231-K234 PolarHBondContact O-N 2.96Å; K234-Y237 PolarHBondContact O-N 3.44Å; K234-N238 WeakPolarHBondContact O-CB 3.31Å; K234-N238 PolarHBondContact O-N 3.2Å
235N84.2Confident83.1Confident86 Ų86102.1 Ų102.146%0.4651%0.514SS..Hα-helixtrans-63.4-46.1176.3-70.3-23.7000111.1N231 D232 Y237 N238 D239N231-N235 WeakPolarHBondContact O-CB 3.42Å; N231-N235 PolarHBondContact O-N 3.49Å; N231-N235 PolarHBondContact O-ND2 2.98Å; D232-N235 PolarHBondContact O-N 2.77Å; N235-Y237 VanDerWaalsContact C-N 3.35Å; N235-Y237 PolarHBondContact O-N 2.88Å; N235-N238 CarbonylContact O-C 3.59Å; N235-N238 WeakPolarHBondContact O-CB 3.31Å; N235-N238 PolarHBondContact O-N 3.45Å; N235-N238 VanDerWaalsContact O-N 3.08Å; N235-D239 WeakPolarHBondContact O-CB 3.5Å; N235-D239 PolarHBondContact O-N 3.43Å
236Y83.3Confident82Confident141 Ų14198.9 Ų98.955%0.55351%0.51SS*.Hα-helixtrans-56.9-45.4175.4175.8-103.6000112.2D232 M233 D239 I240D232-Y236 VanDerWaalsContact O-CB 3.28Å; D232-Y236 WeakPolarHBondContact O-CB 3.33Å; D232-Y236 PolarHBondContact O-N 3.34Å; M233-Y236 PolarHBondContact O-N 3.26Å; Y236-D239 PolarHBondContact O-N 2.89Å; Y236-I240 HydrophobicContact CD1-CD1 3.81Å; Y236-I240 HydrophobicContact CE1-CD1 3.22Å; Y236-I240 HydrophobicContact CE1-CG1 4.29Å; Y236-I240 HydrophobicContact CE2-CD1 4.11Å; Y236-I240 HydrophobicContact CG-CD1 4.47Å; Y236-I240 VanDerWaalsContact CZ-CD1 3.4Å; Y236-I240 WeakPolarHBondContact O-CB 3.43Å; Y236-I240 WeakPolarHBondContact O-CG1 3.49Å; Y236-I240 PolarHBondContact O-N 2.86Å
237Y82.4Confident80.9Confident122 Ų12295.8 Ų95.848%0.47850%0.497SS..Hα-helixtrans-69.2-35.2175.3-76-57.7000112.4M233 K234 N235 D239 I240 T241M233-Y237 HydrophobicContact CE-CE2 3.5Å; M233-Y237 VanDerWaalsContact CE-OH 3.3Å; M233-Y237 WeakPolarHBondContact CE-OH 3.37Å; M233-Y237 HydrophobicContact CG-CD2 3.75Å; M233-Y237 HydrophobicContact CG-CE2 3.42Å; M233-Y237 VanDerWaalsContact CG-CE2 3.42Å; M233-Y237 WeakPolarHBondContact O-CD2 3.4Å; M233-Y237 PolarHBondContact O-N 2.88Å; M233-Y237 HydrophobicContact SD-CE2 4.1Å; K234-Y237 PolarHBondContact O-N 3.44Å; N235-Y237 VanDerWaalsContact C-N 3.35Å; N235-Y237 PolarHBondContact O-N 2.88Å; Y237-D239 VanDerWaalsContact C-N 3.35Å; Y237-I240 HydrophobicContact CD1-CD1 4.36Å; Y237-I240 CarbonylContact O-C 3.57Å; Y237-I240 PolarHBondContact O-N 3.09Å; Y237-T241 WeakPolarHBondContact O-CB 3.41Å; Y237-T241 PolarHBondContact O-N 2.95Å; Y237-T241 PolarHBondContact O-OG1 3.3Å
238N83.7Confident79.6Confident94 Ų9495.6 Ų95.650%0.50350%0.495SS..Hα-helixtrans-64.9-41.8175.6-137.817000111K234 N235 T241 L242K234-N238 WeakPolarHBondContact O-CB 3.31Å; K234-N238 PolarHBondContact O-N 3.2Å; N235-N238 CarbonylContact O-C 3.59Å; N235-N238 WeakPolarHBondContact O-CB 3.31Å; N235-N238 PolarHBondContact O-N 3.45Å; N235-N238 VanDerWaalsContact O-N 3.08Å; N238-T241 WeakPolarHBondContact O-CB 3.43Å; N238-T241 PolarHBondContact O-N 3.32Å; N238-T241 VanDerWaalsContact O-N 3.09Å; N238-L242 PolarHBondContact O-N 2.93Å
239D79.9Confident78.2Confident103 Ų10392.7 Ų92.755%0.55149%0.492SS*.Hα-helixtrans-64.9-42.2173.9-73-15000111.2N235 Y236 Y237 T241 L242 N243N235-D239 WeakPolarHBondContact O-CB 3.5Å; N235-D239 PolarHBondContact O-N 3.43Å; Y236-D239 PolarHBondContact O-N 2.89Å; Y237-D239 VanDerWaalsContact C-N 3.35Å; D239-T241 VanDerWaalsContact C-N 3.26Å; D239-T241 PolarHBondContact O-N 2.98Å; D239-L242 PolarHBondContact O-N 3.48Å; D239-N243 WeakPolarHBondContact O-CB 3.37Å; D239-N243 PolarHBondContact O-N 3.42Å
240I77.6Confident76.8Confident51 Ų5191.9 Ų91.926%0.26248%0.483SS..Hα-helixtrans-59.6-39.1169.8-77.2178.3000110.6Y236 Y237 N243 N244Y236-I240 HydrophobicContact CD1-CD1 3.81Å; Y236-I240 HydrophobicContact CE1-CD1 3.22Å; Y236-I240 HydrophobicContact CE1-CG1 4.29Å; Y236-I240 HydrophobicContact CE2-CD1 4.11Å; Y236-I240 HydrophobicContact CG-CD1 4.47Å; Y236-I240 VanDerWaalsContact CZ-CD1 3.4Å; Y236-I240 WeakPolarHBondContact O-CB 3.43Å; Y236-I240 WeakPolarHBondContact O-CG1 3.49Å; Y236-I240 PolarHBondContact O-N 2.86Å; Y237-I240 HydrophobicContact CD1-CD1 4.36Å; Y237-I240 CarbonylContact O-C 3.57Å; Y237-I240 PolarHBondContact O-N 3.09Å; I240-N243 PolarHBondContact O-N 3.36Å; I240-N244 WeakPolarHBondContact CG2-ND2 3.4Å; I240-N244 WeakPolarHBondContact O-CA 3.3Å; I240-N244 WeakPolarHBondContact O-CB 3.45Å; I240-N244 PolarHBondContact O-N 2.99Å; I240-N244 PolarHBondContact O-ND2 3.26Å; I240-N244 PolarHBondContact O-OD1 3.1Å
241T78.1Confident74.9Confident74 Ų7489.3 Ų89.345%0.45447%0.474SS..Hα-helixtrans-69.9-42.8-177.9-480000110.6Y237 N238 D239 N244 L245Y237-T241 WeakPolarHBondContact O-CB 3.41Å; Y237-T241 PolarHBondContact O-N 2.95Å; Y237-T241 PolarHBondContact O-OG1 3.3Å; N238-T241 WeakPolarHBondContact O-CB 3.43Å; N238-T241 PolarHBondContact O-N 3.32Å; N238-T241 VanDerWaalsContact O-N 3.09Å; D239-T241 VanDerWaalsContact C-N 3.26Å; D239-T241 PolarHBondContact O-N 2.98Å; T241-N244 PolarHBondContact O-N 3.39Å; T241-L245 PolarHBondContact O-N 2.87Å
242L78.6Confident73.4Confident114 Ų11493.4 Ų93.460%0.59749%0.488SS*.Hα-helixtrans-62.8-45.1172.3-83.2161.9000111.9N238 D239 L245 A246N238-L242 PolarHBondContact O-N 2.93Å; D239-L242 PolarHBondContact O-N 3.48Å; L242-L245 WeakPolarHBondContact O-CB 3.34Å; L242-L245 PolarHBondContact O-N 3.41Å; L242-A246 PolarHBondContact O-N 3.11Å; L242-A246 VanDerWaalsContact O-N 3.08Å
243N75.2Confident71.7Confident107 Ų10797.1 Ų97.157%0.57250%0.502SS*.Hα-helixtrans-68-37.9177.6-162.77.4000111.1D239 I240 L245 A246 L247D239-N243 WeakPolarHBondContact O-CB 3.37Å; D239-N243 PolarHBondContact O-N 3.42Å; I240-N243 PolarHBondContact O-N 3.36Å; N243-L245 VanDerWaalsContact C-N 3.32Å; N243-L245 PolarHBondContact O-N 2.81Å; N243-A246 CarbonylContact O-C 3.6Å; N243-A246 WeakPolarHBondContact O-CB 3.5Å; N243-A246 PolarHBondContact O-N 2.94Å; N243-L247 WeakPolarHBondContact O-CB 3.4Å; N243-L247 PolarHBondContact O-N 3.35Å
244N71.6Confident70.2Confident74 Ų7497.5 Ų97.540%0.39650%0.502SS..Hα-helixtrans-64.9-34.4173.7-76.8-17.4000111.5I240 T241 L247 I248I240-N244 WeakPolarHBondContact CG2-ND2 3.4Å; I240-N244 WeakPolarHBondContact O-CA 3.3Å; I240-N244 WeakPolarHBondContact O-CB 3.45Å; I240-N244 PolarHBondContact O-N 2.99Å; I240-N244 PolarHBondContact O-ND2 3.26Å; I240-N244 PolarHBondContact O-OD1 3.1Å; T241-N244 PolarHBondContact O-N 3.39Å; N244-L247 CarbonylContact O-C 3.5Å; N244-L247 PolarHBondContact O-N 3.44Å; N244-I248 WeakPolarHBondContact O-CB 3.48Å; N244-I248 WeakPolarHBondContact O-CD1 3.45Å; N244-I248 WeakPolarHBondContact O-CG1 3.3Å; N244-I248 PolarHBondContact O-N 3.26Å
245L73.7Confident68.4Low117 Ų11796 Ų9661%0.61350%0.5SS*.Hα-helixtrans-66.3-42.1171.9-83.7157000111.7T241 L242 N243 G249T241-L245 PolarHBondContact O-N 2.87Å; L242-L245 WeakPolarHBondContact O-CB 3.34Å; L242-L245 PolarHBondContact O-N 3.41Å; N243-L245 VanDerWaalsContact C-N 3.32Å; N243-L245 PolarHBondContact O-N 2.81Å; L245-G249 PolarHBondContact O-N 2.89Å
246A66.3Low66.8Low66 Ų66100.5 Ų100.555%0.54552%0.518SS..Hα-helixtrans-65.6-39.5173.400000112.1L242 N243 G249 S250L242-A246 PolarHBondContact O-N 3.11Å; L242-A246 VanDerWaalsContact O-N 3.08Å; N243-A246 CarbonylContact O-C 3.6Å; N243-A246 WeakPolarHBondContact O-CB 3.5Å; N243-A246 PolarHBondContact O-N 2.94Å; A246-G249 WeakPolarHBondContact O-CA 3.32Å; A246-G249 PolarHBondContact O-N 3.28Å; A246-S250 PolarHBondContact O-N 3.47Å; A246-S250 VanDerWaalsContact O-N 3.17Å
247L64.9Low64.9Low56 Ų56101.4 Ų101.429%0.29353%0.527SS..Hα-helixtrans-71.6-34.1178.2-172.265.3000111.8N243 N244 G249 S250 M251N243-L247 WeakPolarHBondContact O-CB 3.4Å; N243-L247 PolarHBondContact O-N 3.35Å; N244-L247 CarbonylContact O-C 3.5Å; N244-L247 PolarHBondContact O-N 3.44Å; L247-G249 PolarHBondContact O-N 2.99Å; L247-S250 PolarHBondContact O-N 2.9Å; L247-S250 PolarHBondContact O-OG 3.5Å; L247-M251 HydrophobicContact CD1-CE 3.94Å; L247-M251 HydrophobicContact CD1-CG 3.91Å; L247-M251 HydrophobicContact CD1-SD 4.24Å; L247-M251 HydrophobicContact CD2-CE 3.67Å; L247-M251 HydrophobicContact CD2-SD 3.95Å; L247-M251 HydrophobicContact CG-CE 3.78Å; L247-M251 HydrophobicContact CG-CG 3.8Å; L247-M251 HydrophobicContact CG-SD 3.65Å; L247-M251 WeakPolarHBondContact O-CA 3.39Å; L247-M251 WeakPolarHBondContact O-CB 3.37Å; L247-M251 WeakPolarHBondContact O-CG 3.31Å; L247-M251 PolarHBondContact O-N 2.88Å
248I63.6Low63.2Low96 Ų96102.1 Ų102.149%0.49254%0.539SS..Hα-helixtrans-63.3-32.7170.3-74.9162.2000110.3N244 K252N244-I248 WeakPolarHBondContact O-CB 3.48Å; N244-I248 WeakPolarHBondContact O-CD1 3.45Å; N244-I248 WeakPolarHBondContact O-CG1 3.3Å; N244-I248 PolarHBondContact O-N 3.26Å; I248-K252 WeakPolarHBondContact O-CG 3.45Å; I248-K252 PolarHBondContact O-N 3.37Å
249G59.4Low61.5Low49 Ų49107.6 Ų107.651%0.50555%0.552SS.*Hα-helixtrans-62.1-49.117100000112.6L245 A246 L247L245-G249 PolarHBondContact O-N 2.89Å; A246-G249 WeakPolarHBondContact O-CA 3.32Å; A246-G249 PolarHBondContact O-N 3.28Å; L247-G249 PolarHBondContact O-N 2.99Å
250S59.4Low59.8Low40 Ų40111.7 Ų111.728%0.2857%0.565SS.*Hα-helixtrans-82-26.4-178.565.70000114.2A246 L247 E253 Q254A246-S250 PolarHBondContact O-N 3.47Å; A246-S250 VanDerWaalsContact O-N 3.17Å; L247-S250 PolarHBondContact O-N 2.9Å; L247-S250 PolarHBondContact O-OG 3.5Å; S250-E253 WeakPolarHBondContact O-CA 3.47Å; S250-E253 VanDerWaalsContact O-CB 3.26Å; S250-E253 WeakPolarHBondContact O-CB 3.37Å; S250-E253 PolarHBondContact O-N 3.1Å; S250-E253 VanDerWaalsContact O-N 3.08Å; S250-Q254 PolarHBondContact O-N 3.43Å; S250-Q254 VanDerWaalsContact O-N 3.08Å
251M49.6Very low58Low87 Ų87118.4 Ų118.443%0.42960%0.595SS.*Hα-helixtrans-75.8-23.2177.7-78.2-173160.100112.6L247 E253 Q254 L255L247-M251 HydrophobicContact CD1-CE 3.94Å; L247-M251 HydrophobicContact CD1-CG 3.91Å; L247-M251 HydrophobicContact CD1-SD 4.24Å; L247-M251 HydrophobicContact CD2-CE 3.67Å; L247-M251 HydrophobicContact CD2-SD 3.95Å; L247-M251 HydrophobicContact CG-CE 3.78Å; L247-M251 HydrophobicContact CG-CG 3.8Å; L247-M251 HydrophobicContact CG-SD 3.65Å; L247-M251 WeakPolarHBondContact O-CA 3.39Å; L247-M251 WeakPolarHBondContact O-CB 3.37Å; L247-M251 WeakPolarHBondContact O-CG 3.31Å; L247-M251 PolarHBondContact O-N 2.88Å; M251-E253 PolarHBondContact O-N 3.01Å; M251-Q254 PolarHBondContact O-N 3.5Å; M251-L255 WeakPolarHBondContact O-CA 3.32Å; M251-L255 WeakPolarHBondContact O-CB 3.29Å; M251-L255 WeakPolarHBondContact O-CD1 3.38Å; M251-L255 WeakPolarHBondContact O-CG 3.23Å; M251-L255 PolarHBondContact O-N 3.11Å
252K54.8Low56.3Low170 Ų170119.4 Ų119.474%0.73961%0.611SS**Hα-helixtrans-62.1-25.5165-79.8-179177.6-179.30112.3I248I248-K252 WeakPolarHBondContact O-CG 3.45Å; I248-K252 PolarHBondContact O-N 3.37Å
253E51.6Low54.8Low169 Ų169123.5 Ų123.579%0.7963%0.627SS**Hα-helixtrans-90.2-26.4178.8-139.8169.4-164.500112.4S250 M251S250-E253 WeakPolarHBondContact O-CA 3.47Å; S250-E253 VanDerWaalsContact O-CB 3.26Å; S250-E253 WeakPolarHBondContact O-CB 3.37Å; S250-E253 PolarHBondContact O-N 3.1Å; S250-E253 VanDerWaalsContact O-N 3.08Å; M251-E253 PolarHBondContact O-N 3.01Å
254Q51Low53.8Low108 Ų108130.3 Ų130.351%0.50565%0.645SS.*Hα-helixtrans-104.9-11.8-177.1-65.9-179.1-11.300115S250 M251 E256 H257S250-Q254 PolarHBondContact O-N 3.43Å; S250-Q254 VanDerWaalsContact O-N 3.08Å; M251-Q254 PolarHBondContact O-N 3.5Å; Q254-E256 PolarHBondContact O-N 2.89Å; Q254-E256 VanDerWaalsContact O-N 3.1Å; Q254-H257 PolarHBondContact O-N 2.95Å
255L47.3Very low52.9Low93 Ų93131.3 Ų131.349%0.48766%0.658SS.*THydrogen-bonded Turntrans-61.1-13.5174.2-94.1166000113.9M251M251-L255 WeakPolarHBondContact O-CA 3.32Å; M251-L255 WeakPolarHBondContact O-CB 3.29Å; M251-L255 WeakPolarHBondContact O-CD1 3.38Å; M251-L255 WeakPolarHBondContact O-CG 3.23Å; M251-L255 PolarHBondContact O-N 3.11Å
256E50.3Low52.1Low179 Ų179132.5 Ų132.584%0.83667%0.665SS**THydrogen-bonded Turntrans-76.2-22.9172.6-158.161.2-152.800112.3Q254Q254-E256 PolarHBondContact O-N 2.89Å; Q254-E256 VanDerWaalsContact O-N 3.1Å
257H43.7Very low51.8Low160 Ų160140.2 Ų140.274%0.74168%0.68SS**THydrogen-bonded Turntrans-116.6-30.6-163.5-159-75.4000116.5Q254Q254-H257 PolarHBondContact O-N 2.95Å
258L47.8Very low51.8Low138 Ų138144.7 Ų144.772%0.72370%0.702SS**SBendtrans-105.15-170.6-73.5168.7000115.7K260L258-K260 PolarHBondContact O-N 3.35Å
259R46.5Very low51.9Low208 Ų208144.1 Ų144.179%0.78571%0.712SS**THydrogen-bonded Turntrans-66.97.3-178.7-126.6174.6-172.91721.9115.8
260K45.3Very low52.3Low190 Ų190145 Ų14583%0.82672%0.715SS**THydrogen-bonded Turntrans-117-11.6-162.4-94-177.8178.8174.90119.4L258L258-K260 PolarHBondContact O-N 3.35Å
261Q40Very low52.6Low191 Ų191149.4 Ų149.489%0.89374%0.735SS**SBendtrans-156.32.1-169.4-130165.8-9.300125.3
262A42.1Very low53.4Low96 Ų96150.2 Ų150.279%0.79375%0.745SS**  trans-108.9-4.9-170.800000117.9R264A262-R264 PolarHBondContact O-N 2.96Å
263E45.8Very low54.1Low199 Ų199144.5 Ų144.593%0.9373%0.73SS**THydrogen-bonded Turntrans-87.817.5-161.1-118.8178.7-173.800118.1
264R54.6Low55Low250 Ų250139.6 Ų139.694%0.94372%0.718SS**THydrogen-bonded Turntrans-110.3-13-172.7-85.2-175.7180176.80.4118.4A262A262-R264 PolarHBondContact O-N 2.96Å
265S52.3Low55.9Low96 Ų96139.6 Ų139.667%0.67172%0.718SS**SBendtrans-95.2-24.8-169.360.60000117.5
266D58.6Low56.9Low141 Ų141141.3 Ų141.375%0.75473%0.728SS**THydrogen-bonded Turntrans-91.1-7.2-161.1-70.2-3.6000116.2
267R58.5Low57.9Low228 Ų228142 Ų14286%0.8672%0.723SS**THydrogen-bonded Turntrans-81.1-16.6-172.3-81-176.9-180166.32.7116.5
268I64.5Low59.3Low150 Ų150142.5 Ų142.577%0.76972%0.718SS**SBendtrans-89.3-17-171.2-63.4174.7000113
269A66.5Low60.4Low84 Ų84141.5 Ų141.569%0.69471%0.713SS**SBendtrans-82.9-20.2-172.300000115.3
270A67Low61.9Low69 Ų69138 Ų13857%0.5770%0.703SS**SBendtrans-83.3-35.2-17100000114.3T272 A273A270-T272 PolarHBondContact O-N 3Å; A270-A273 PolarHBondContact O-N 3.32Å
271D67.1Low63.3Low132 Ų132135.7 Ų135.771%0.70670%0.696SS**Hα-helixtrans-71-30.7-171-68.5-18000113.1A273D271-A273 VanDerWaalsContact C-N 3.29Å; D271-A273 PolarHBondContact O-N 2.95Å
272T66.1Low65.3Low104 Ų104130.7 Ų130.764%0.63868%0.679SS**Hα-helixtrans-73.1-19.5-177.9-310000113.3A270A270-T272 PolarHBondContact O-N 3Å
273A69Low67.1Low50 Ų50131.6 Ų131.641%0.41367%0.671SS.*Hα-helixtrans-86.2-19.4-177.400000113.8A270 D271A270-A273 PolarHBondContact O-N 3.32Å; D271-A273 VanDerWaalsContact C-N 3.29Å; D271-A273 PolarHBondContact O-N 2.95Å
274A71Confident68.8Low66 Ų66126.9 Ų126.955%0.54565%0.648SS.*Hα-helixtrans-80.7-40-177.600000112.7N276 R277A274-N276 PolarHBondContact O-N 3.44Å; A274-R277 PolarHBondContact O-N 2.95Å
275E70.5Confident70.1Confident107 Ų107121 Ų12150%0.563%0.631SS.*Hα-helixtrans-70.3-30.4-174.3-152.161.9-150.100112.7R277 R278E275-R277 VanDerWaalsContact C-N 3.32Å; E275-R277 PolarHBondContact O-N 3.37Å; E275-R278 PolarHBondContact O-N 3.49Å; E275-R278 IonicContact OE1-CZ 3.66Å; E275-R278 IonicContact OE1-NE 3.23Å; E275-R278 PolarHBondContact OE1-NE 3.25Å; E275-R278 IonicContact OE1-NH2 3.18Å; E275-R278 PolarHBondContact OE1-NH2 2.82Å
276N67.7Low71.6Confident129 Ų129119 Ų11969%0.6962%0.621SS**Hα-helixtrans-69.6-22.5177.5-102.8-37.8000114.1A274A274-N276 PolarHBondContact O-N 3.44Å
277R70.1Confident72.8Confident194 Ų194116.6 Ų116.673%0.73261%0.608SS**Hα-helixtrans-79.9-29.9177.4-67.5-175.1-158.51656.2112.5A274 E275 L279A274-R277 PolarHBondContact O-N 2.95Å; E275-R277 VanDerWaalsContact C-N 3.32Å; E275-R277 PolarHBondContact O-N 3.37Å; R277-L279 VanDerWaalsContact C-N 3.33Å; R277-L279 PolarHBondContact O-N 3.49Å
278R73.3Confident74.2Confident170 Ų170110.4 Ų110.464%0.64259%0.591SS**Hα-helixtrans-70.2-24.1-173.7-161.9174.173.2101.8-2114.3E275E275-R278 PolarHBondContact O-N 3.49Å; E275-R278 IonicContact OE1-CZ 3.66Å; E275-R278 IonicContact OE1-NE 3.23Å; E275-R278 PolarHBondContact OE1-NE 3.25Å; E275-R278 IonicContact OE1-NH2 3.18Å; E275-R278 PolarHBondContact OE1-NH2 2.82Å
279L71.7Confident75.4Confident118 Ų118108.5 Ų108.562%0.61858%0.579SS**THydrogen-bonded Turntrans-95.4-11.6-174-68.8170.8000114.7R277R277-L279 VanDerWaalsContact C-N 3.33Å; R277-L279 PolarHBondContact O-N 3.49Å
280K78Confident76.4Confident133 Ų133108.4 Ų108.458%0.57857%0.566SS**Hα-helixtrans-81.2-41-170.6-165.6178.1176.1-171.30113.5L283 E284K280-L283 PolarHBondContact O-N 2.85Å; K280-E284 VanDerWaalsContact CE-OE1 3.25Å; K280-E284 WeakPolarHBondContact CE-OE1 3.46Å; K280-E284 PolarHBondContact O-N 2.97Å
281E74.8Confident77.4Confident143 Ų143109.6 Ų109.667%0.66856%0.563SS**Hα-helixtrans-67.2-42-174.5-67.2177.3162.500114.5L283 E284 H285E281-L283 VanDerWaalsContact C-N 3.27Å; E281-L283 PolarHBondContact O-N 3.18Å; E281-E284 PolarHBondContact O-N 3.49Å; E281-H285 PolarHBondContact O-N 3.01Å; E281-H285 PolarHBondContact O-ND1 2.81Å
282P81.4Confident78.6Confident85 Ų85108.3 Ų108.355%0.55255%0.553SS**Hα-helixtrans-65.2-31.6177.1-21.834.3000112.8A286P282-A286 PolarHBondContact O-N 3.48Å; P282-A286 VanDerWaalsContact O-N 3.17Å
283L79.5Confident79.7Confident116 Ų116110.6 Ų110.661%0.60755%0.551SS**Hα-helixtrans-70.8-39.7179.3-174.665.1000111.8K280 E281 N287K280-L283 PolarHBondContact O-N 2.85Å; E281-L283 VanDerWaalsContact C-N 3.27Å; E281-L283 PolarHBondContact O-N 3.18Å; L283-N287 PolarHBondContact O-N 3.09Å
284E83.2Confident80.7Confident99 Ų99115.4 Ų115.446%0.46356%0.558SS.*Hα-helixtrans-66.3-40.6176-75.2178.6179.200111.8K280 E281 N287 I288K280-E284 VanDerWaalsContact CE-OE1 3.25Å; K280-E284 WeakPolarHBondContact CE-OE1 3.46Å; K280-E284 PolarHBondContact O-N 2.97Å; E281-E284 PolarHBondContact O-N 3.49Å; E284-N287 PolarHBondContact O-N 3.44Å; E284-I288 WeakPolarHBondContact O-CG1 3.44Å; E284-I288 PolarHBondContact O-N 2.96Å; E284-I288 VanDerWaalsContact O-N 3.13Å
285H82.1Confident81.6Confident127 Ų127120.9 Ų120.959%0.58857%0.565SS**Hα-helixtrans-63.3-42.7176.7-84.954000112.9E281 N287 I288 Q289E281-H285 PolarHBondContact O-N 3.01Å; E281-H285 PolarHBondContact O-ND1 2.81Å; H285-N287 VanDerWaalsContact C-N 3.3Å; H285-N287 PolarHBondContact O-N 3.28Å; H285-I288 PolarHBondContact O-N 3.36Å; H285-Q289 PolarHBondContact O-N 3.26Å
286A82Confident82.6Confident55 Ų55121.9 Ų121.946%0.45557%0.567SS.*Hα-helixtrans-62.1-38.2176.600000112.2P282 L290P282-A286 PolarHBondContact O-N 3.48Å; P282-A286 VanDerWaalsContact O-N 3.17Å; A286-L290 WeakPolarHBondContact O-CB 3.41Å; A286-L290 PolarHBondContact O-N 3.34Å
287N84.6Confident83.7Confident90 Ų90120.6 Ų120.648%0.48156%0.56SS.*Hα-helixtrans-67.7-36.6177.6-95.2-20.6000113.2L283 E284 H285 N291L283-N287 PolarHBondContact O-N 3.09Å; E284-N287 PolarHBondContact O-N 3.44Å; H285-N287 VanDerWaalsContact C-N 3.3Å; H285-N287 PolarHBondContact O-N 3.28Å; N287-N291 PolarHBondContact O-N 3.08Å; N287-N291 PolarHBondContact O-ND2 3.38Å
288I88.5Confident84.8Confident98 Ų98116.3 Ų116.350%0.50355%0.548SS..Hα-helixtrans-64.4-48.5176.3-67.2167.3000110.2E284 H285 L290 N291 E292E284-I288 WeakPolarHBondContact O-CG1 3.44Å; E284-I288 PolarHBondContact O-N 2.96Å; E284-I288 VanDerWaalsContact O-N 3.13Å; H285-I288 PolarHBondContact O-N 3.36Å; I288-L290 VanDerWaalsContact C-N 3.33Å; I288-L290 PolarHBondContact O-N 2.93Å; I288-N291 PolarHBondContact O-N 3.44Å; I288-N291 VanDerWaalsContact O-N 3.15Å; I288-E292 PolarHBondContact O-N 2.91Å
289Q89.1Confident85.7Confident110 Ų110113.8 Ų113.851%0.51454%0.542SS..Hα-helixtrans-61.5-40.5179.1-69.2-176.2-2.400112.3H285 N291 E292 Y293H285-Q289 PolarHBondContact O-N 3.26Å; Q289-N291 VanDerWaalsContact C-N 3.3Å; Q289-N291 PolarHBondContact O-N 3.24Å; Q289-E292 PolarHBondContact O-N 2.87Å; Q289-Y293 HydrophobicContact CB-CE2 4.4Å; Q289-Y293 WeakPolarHBondContact O-CD2 3.22Å; Q289-Y293 PolarHBondContact O-N 2.92Å
290L87.2Confident86.7Confident82 Ų82115.3 Ų115.343%0.42954%0.541SS..Hα-helixtrans-57.7-43.8175.5-170.190000111.6A286 I288 Y293 R294A286-L290 WeakPolarHBondContact O-CB 3.41Å; A286-L290 PolarHBondContact O-N 3.34Å; I288-L290 VanDerWaalsContact C-N 3.33Å; I288-L290 PolarHBondContact O-N 2.93Å; L290-Y293 PolarHBondContact O-N 3.11Å; L290-R294 WeakPolarHBondContact O-CG 3.45Å; L290-R294 PolarHBondContact O-N 3.07Å
291N88.8Confident87.4Confident93 Ų93114 Ų11450%0.49754%0.537SS..Hα-helixtrans-68.7-37179.3-79.3-28.8000112.7N287 I288 Q289 R294 R295N287-N291 PolarHBondContact O-N 3.08Å; N287-N291 PolarHBondContact O-ND2 3.38Å; I288-N291 PolarHBondContact O-N 3.44Å; I288-N291 VanDerWaalsContact O-N 3.15Å; Q289-N291 VanDerWaalsContact C-N 3.3Å; Q289-N291 PolarHBondContact O-N 3.24Å; N291-R294 PolarHBondContact O-N 2.98Å; N291-R295 PolarHBondContact O-N 2.96Å; N291-R295 VanDerWaalsContact O-N 3.1Å
292E91.3Very high88.3Confident105 Ų105114 Ų11449%0.49153%0.53SS..Hα-helixtrans-63.9-44.6174.1-72.6-169.9165.300112.3I288 Q289 R294 R295 K296I288-E292 PolarHBondContact O-N 2.91Å; Q289-E292 PolarHBondContact O-N 2.87Å; E292-R294 VanDerWaalsContact C-N 3.33Å; E292-R294 PolarHBondContact O-N 3.36Å; E292-R295 PolarHBondContact O-N 3.37Å; E292-K296 PolarHBondContact O-N 3.32Å
293Y89.2Confident88.9Confident152 Ų152114.4 Ų114.460%0.59653%0.528SS*.Hα-helixtrans-65.5-36.8177.7-72.3-52.3000112.2Q289 L290 K296 L297Q289-Y293 HydrophobicContact CB-CE2 4.4Å; Q289-Y293 WeakPolarHBondContact O-CD2 3.22Å; Q289-Y293 PolarHBondContact O-N 2.92Å; L290-Y293 PolarHBondContact O-N 3.11Å; Y293-K296 PolarHBondContact O-N 2.95Å; Y293-L297 WeakPolarHBondContact O-CB 3.34Å; Y293-L297 PolarHBondContact O-N 3.3Å
294R90.2Very high89.6Confident152 Ų152115.5 Ų115.557%0.57453%0.528SS*.Hα-helixtrans-59.7-46.5172.4-77.9179.3175.5-177.2-1.1112L290 N291 E292 K296 L297 E298L290-R294 WeakPolarHBondContact O-CG 3.45Å; L290-R294 PolarHBondContact O-N 3.07Å; N291-R294 PolarHBondContact O-N 2.98Å; E292-R294 VanDerWaalsContact C-N 3.33Å; E292-R294 PolarHBondContact O-N 3.36Å; R294-K296 PolarHBondContact O-N 3.42Å; R294-L297 PolarHBondContact O-N 2.86Å; R294-E298 PolarHBondContact O-N 3.07Å; R294-E298 VanDerWaalsContact O-N 3.08Å
295R90.9Very high90.1Very high180 Ų180116.1 Ų116.168%0.67953%0.531SS*.Hα-helixtrans-60.8-45.2175.7-85.6-175.7175.4176.9-0112.7N291 E292 L297 E298 F299N291-R295 PolarHBondContact O-N 2.96Å; N291-R295 VanDerWaalsContact O-N 3.1Å; E292-R295 PolarHBondContact O-N 3.37Å; R295-L297 VanDerWaalsContact C-N 3.28Å; R295-L297 PolarHBondContact O-N 2.84Å; R295-E298 PolarHBondContact O-N 3.49Å; R295-F299 WeakPolarHBondContact O-CD2 3.37Å; R295-F299 PolarHBondContact O-N 3.25Å; R295-F299 VanDerWaalsContact O-N 3.13Å
296K91.6Very high90.7Very high129 Ų129115.6 Ų115.656%0.56153%0.529SS*.Hα-helixtrans-61.2-38.7178.2-73.7176.5-179.1169.40111.8E292 Y293 R294 F299 Y300E292-K296 PolarHBondContact O-N 3.32Å; Y293-K296 PolarHBondContact O-N 2.95Å; R294-K296 PolarHBondContact O-N 3.42Å; K296-F299 PolarHBondContact O-N 2.95Å; K296-Y300 WeakPolarHBondContact O-CB 3.44Å; K296-Y300 PolarHBondContact O-N 3.34Å
297L90.9Very high91.3Very high101 Ų101117.4 Ų117.453%0.52953%0.53SS..Hα-helixtrans-64.3-43.5176.7-167.170.9000111.6Y293 R294 R295 F299 Y300 E301Y293-L297 WeakPolarHBondContact O-CB 3.34Å; Y293-L297 PolarHBondContact O-N 3.3Å; R294-L297 PolarHBondContact O-N 2.86Å; R295-L297 VanDerWaalsContact C-N 3.28Å; R295-L297 PolarHBondContact O-N 2.84Å; L297-F299 PolarHBondContact O-N 2.92Å; L297-Y300 PolarHBondContact O-N 2.91Å; L297-E301 WeakPolarHBondContact O-CG 3.48Å; L297-E301 PolarHBondContact O-N 3.25Å
298E92.3Very high91.8Very high104 Ų104116.5 Ų116.549%0.48653%0.531SS..Hα-helixtrans-60.2-42176.1-73.1177.7-168.100112.6R294 R295 E301 R302R294-E298 PolarHBondContact O-N 3.07Å; R294-E298 VanDerWaalsContact O-N 3.08Å; R295-E298 PolarHBondContact O-N 3.49Å; E298-E301 PolarHBondContact O-N 3.24Å; E298-R302 WeakPolarHBondContact O-CG 3.31Å; E298-R302 PolarHBondContact O-N 3.14Å; E298-R302 VanDerWaalsContact O-N 3.12Å
299F91.9Very high92.1Very high117 Ų117120.2 Ų120.251%0.51354%0.539SS..Hα-helixtrans-64-45.5175.2-75.3-65.4000111.8R295 K296 L297 E301 R302 D303R295-F299 WeakPolarHBondContact O-CD2 3.37Å; R295-F299 PolarHBondContact O-N 3.25Å; R295-F299 VanDerWaalsContact O-N 3.13Å; K296-F299 PolarHBondContact O-N 2.95Å; L297-F299 PolarHBondContact O-N 2.92Å; F299-E301 VanDerWaalsContact C-N 3.3Å; F299-E301 PolarHBondContact O-N 3.32Å; F299-R302 PolarHBondContact O-N 3.44Å; F299-R302 VanDerWaalsContact O-N 3.15Å; F299-D303 PolarHBondContact O-N 3.15Å
300Y93.2Very high92.4Very high150 Ų150120 Ų12059%0.58854%0.54SS*.Hα-helixtrans-59.2-41.1177.5-178.5-95.4000112.3K296 L297 D303 K304K296-Y300 WeakPolarHBondContact O-CB 3.44Å; K296-Y300 PolarHBondContact O-N 3.34Å; L297-Y300 PolarHBondContact O-N 2.91Å; Y300-D303 PolarHBondContact O-N 3.38Å; Y300-K304 HydrophobicContact CE1-CD 4.48Å; Y300-K304 WeakPolarHBondContact O-CB 3.39Å; Y300-K304 PolarHBondContact O-N 2.77Å
301E92.9Very high92.8Very high106 Ų106122.4 Ų122.450%0.49555%0.548SS..Hα-helixtrans-64.4-40.3175.9-74.1-175.2168.100112.5L297 E298 F299 K304 Q305L297-E301 WeakPolarHBondContact O-CG 3.48Å; L297-E301 PolarHBondContact O-N 3.25Å; E298-E301 PolarHBondContact O-N 3.24Å; F299-E301 VanDerWaalsContact C-N 3.3Å; F299-E301 PolarHBondContact O-N 3.32Å; E301-K304 PolarHBondContact O-N 3.23Å; E301-Q305 WeakPolarHBondContact O-CG 3.46Å; E301-Q305 PolarHBondContact O-N 3.44Å; E301-Q305 VanDerWaalsContact O-N 3.12Å
302R93.5Very high93.2Very high142 Ų142121.4 Ų121.454%0.53655%0.545SS..Hα-helixtrans-63.5-46.3175.1-72.7179-171.8167.67.1111.8E298 F299 K304 Q305 Q306E298-R302 WeakPolarHBondContact O-CG 3.31Å; E298-R302 PolarHBondContact O-N 3.14Å; E298-R302 VanDerWaalsContact O-N 3.12Å; F299-R302 PolarHBondContact O-N 3.44Å; F299-R302 VanDerWaalsContact O-N 3.15Å; R302-K304 VanDerWaalsContact C-N 3.33Å; R302-K304 PolarHBondContact O-N 2.9Å; R302-Q305 PolarHBondContact O-N 3.33Å; R302-Q306 WeakPolarHBondContact O-CG 3.46Å; R302-Q306 PolarHBondContact O-N 2.9Å
303D93.3Very high93.4Very high94 Ų94124.4 Ų124.450%0.50355%0.551SS.*Hα-helixtrans-64-40.4179.9-70.5-12.9000111.4F299 Y300 Q305 Q306 L307F299-D303 PolarHBondContact O-N 3.15Å; Y300-D303 PolarHBondContact O-N 3.38Å; D303-Q305 VanDerWaalsContact C-N 3.31Å; D303-Q305 PolarHBondContact O-N 3.07Å; D303-Q306 PolarHBondContact O-N 3.43Å; D303-L307 WeakPolarHBondContact O-CB 3.48Å; D303-L307 PolarHBondContact O-N 2.87Å
304K94.7Very high93.7Very high139 Ų139121 Ų12160%0.60454%0.544SS*.Hα-helixtrans-59.5-41.1174.4-173.3178.4178.8-178.80111.9Y300 E301 R302 S308Y300-K304 HydrophobicContact CE1-CD 4.48Å; Y300-K304 WeakPolarHBondContact O-CB 3.39Å; Y300-K304 PolarHBondContact O-N 2.77Å; E301-K304 PolarHBondContact O-N 3.23Å; R302-K304 VanDerWaalsContact C-N 3.33Å; R302-K304 PolarHBondContact O-N 2.9Å; K304-S308 PolarHBondContact O-N 3.16Å; K304-S308 VanDerWaalsContact O-N 3.15Å
305Q94.2Very high94Very high113 Ų113117.1 Ų117.153%0.52854%0.537SS..Hα-helixtrans-67.3-42.7175.6-70.5179.417.100112.2E301 R302 D303 S308 R309E301-Q305 WeakPolarHBondContact O-CG 3.46Å; E301-Q305 PolarHBondContact O-N 3.44Å; E301-Q305 VanDerWaalsContact O-N 3.12Å; R302-Q305 PolarHBondContact O-N 3.33Å; D303-Q305 VanDerWaalsContact C-N 3.31Å; D303-Q305 PolarHBondContact O-N 3.07Å; Q305-S308 PolarHBondContact O-N 2.91Å; Q305-R309 WeakPolarHBondContact O-CG 3.49Å; Q305-R309 PolarHBondContact O-N 3.31Å; Q305-R309 VanDerWaalsContact O-N 3.12Å
306Q94.5Very high94.3Very high115 Ų115117.6 Ų117.654%0.53754%0.539SS..Hα-helixtrans-62.5-43.5176.4-70.3-172.913.800111.9R302 D303 S308 R309 L310R302-Q306 WeakPolarHBondContact O-CG 3.46Å; R302-Q306 PolarHBondContact O-N 2.9Å; D303-Q306 PolarHBondContact O-N 3.43Å; Q306-S308 VanDerWaalsContact C-N 3.31Å; Q306-S308 PolarHBondContact O-N 3.09Å; Q306-R309 PolarHBondContact O-N 3.1Å; Q306-L310 WeakPolarHBondContact O-CG 3.33Å; Q306-L310 PolarHBondContact O-N 2.9Å
307L94.7Very high94.5Very high93 Ų93115.5 Ų115.549%0.48753%0.533SS..Hα-helixtrans-59.7-41.5176.8-177.163.4000111.7D303 L310 K311D303-L307 WeakPolarHBondContact O-CB 3.48Å; D303-L307 PolarHBondContact O-N 2.87Å; L307-L310 PolarHBondContact O-N 2.81Å; L307-K311 HydrophobicContact CG-CD 4.47Å; L307-K311 WeakPolarHBondContact O-CB 3.39Å; L307-K311 WeakPolarHBondContact O-CG 3.49Å; L307-K311 PolarHBondContact O-N 3.28Å
308S95.3Very high94.7Very high72 Ų72115.2 Ų115.250%0.50353%0.529SS..Hα-helixtrans-62.8-42.5176-174.90000112.3K304 Q305 Q306 K311 T312K304-S308 PolarHBondContact O-N 3.16Å; K304-S308 VanDerWaalsContact O-N 3.15Å; Q305-S308 PolarHBondContact O-N 2.91Å; Q306-S308 VanDerWaalsContact C-N 3.31Å; Q306-S308 PolarHBondContact O-N 3.09Å; S308-K311 PolarHBondContact O-N 3.45Å; S308-T312 PolarHBondContact O-N 3.12Å; S308-T312 PolarHBondContact O-OG1 3.37Å
309R95.4Very high94.9Very high176 Ų176118 Ų11866%0.66454%0.54SS*.Hα-helixtrans-62.5-44.1175-67.6176-173-1793.9111.7Q305 Q306 T312 R313Q305-R309 WeakPolarHBondContact O-CG 3.49Å; Q305-R309 PolarHBondContact O-N 3.31Å; Q305-R309 VanDerWaalsContact O-N 3.12Å; Q306-R309 PolarHBondContact O-N 3.1Å; R309-T312 PolarHBondContact O-N 2.87Å; R309-R313 PolarHBondContact O-N 3.17Å
310L95.1Very high95.1Very high104 Ų104119 Ų11955%0.54554%0.544SS..Hα-helixtrans-65-42.6177.7-73.2174.7000112.2Q306 L307 T312 R313 N314Q306-L310 WeakPolarHBondContact O-CG 3.33Å; Q306-L310 PolarHBondContact O-N 2.9Å; L307-L310 PolarHBondContact O-N 2.81Å; L310-T312 VanDerWaalsContact C-N 3.32Å; L310-T312 PolarHBondContact O-N 3.2Å; L310-R313 PolarHBondContact O-N 2.91Å; L310-N314 WeakPolarHBondContact O-CB 3.33Å; L310-N314 PolarHBondContact O-N 3.26Å
311K95.9Very high95.3Very high134 Ų134116.1 Ų116.158%0.58354%0.541SS*.Hα-helixtrans-59.5-42.5174.1-77-178.4176.2-175.60112L307 S308 N314 T315L307-K311 HydrophobicContact CG-CD 4.47Å; L307-K311 WeakPolarHBondContact O-CB 3.39Å; L307-K311 WeakPolarHBondContact O-CG 3.49Å; L307-K311 PolarHBondContact O-N 3.28Å; S308-K311 PolarHBondContact O-N 3.45Å; K311-N314 PolarHBondContact O-N 3.41Å; K311-T315 WeakPolarHBondContact O-CG2 3.45Å; K311-T315 PolarHBondContact O-N 2.87Å; K311-T315 PolarHBondContact O-OG1 3.45Å; K311-T315 VanDerWaalsContact O-OG1 3.06Å
312T95.7Very high95.4Very high71 Ų71118.2 Ų118.244%0.43655%0.549SS..Hα-helixtrans-66.2-39.1177.2-52.10000111.8S308 R309 L310 T315 R316S308-T312 PolarHBondContact O-N 3.12Å; S308-T312 PolarHBondContact O-OG1 3.37Å; R309-T312 PolarHBondContact O-N 2.87Å; L310-T312 VanDerWaalsContact C-N 3.32Å; L310-T312 PolarHBondContact O-N 3.2Å; T312-T315 PolarHBondContact O-OG1 3.38Å; T312-R316 PolarHBondContact O-N 3.26Å
313R96Very high95.6Very high168 Ų168113.3 Ų113.363%0.63454%0.543SS*.Hα-helixtrans-66.2-43.3174.1-177.6177.6173.4-178.1-2.4111.5R309 L310 R316 L317R309-R313 PolarHBondContact O-N 3.17Å; L310-R313 PolarHBondContact O-N 2.91Å; R313-R316 PolarHBondContact O-N 3.48Å; R313-L317 HydrophobicContact CG-CD1 4.1Å; R313-L317 HydrophobicContact CG-CG 4.48Å; R313-L317 WeakPolarHBondContact O-CG 3.29Å; R313-L317 PolarHBondContact O-N 3.42Å
314N95.6Very high95.7Very high82 Ų82113.3 Ų113.344%0.43954%0.542SS..Hα-helixtrans-62.4-47-179-167.553.2000111.3L310 K311 R316 L317 E318L310-N314 WeakPolarHBondContact O-CB 3.33Å; L310-N314 PolarHBondContact O-N 3.26Å; K311-N314 PolarHBondContact O-N 3.41Å; N314-R316 VanDerWaalsContact C-N 3.3Å; N314-R316 PolarHBondContact O-N 3.48Å; N314-L317 PolarHBondContact O-N 3.38Å; N314-L317 VanDerWaalsContact O-N 3.08Å; N314-E318 PolarHBondContact ND2-OE1 3.07Å; N314-E318 WeakPolarHBondContact O-CG 3.27Å; N314-E318 PolarHBondContact O-N 2.91Å
315T96.5Very high95.8Very high69 Ų69109.9 Ų109.942%0.42353%0.533SS..Hα-helixtrans-61.2-34.6176.251.20000113.1K311 T312 K319K311-T315 WeakPolarHBondContact O-CG2 3.45Å; K311-T315 PolarHBondContact O-N 2.87Å; K311-T315 PolarHBondContact O-OG1 3.45Å; K311-T315 VanDerWaalsContact O-OG1 3.06Å; T312-T315 PolarHBondContact O-OG1 3.38Å; T315-K319 WeakPolarHBondContact O-CG 3.36Å; T315-K319 PolarHBondContact O-N 3.19Å
316R96.5Very high95.9Very high190 Ų190112.9 Ų112.972%0.71754%0.54SS*.Hα-helixtrans-66.9-43.7171.2-79.5-173-169.1-177.93.5112.3T312 R313 N314 K319 K320T312-R316 PolarHBondContact O-N 3.26Å; R313-R316 PolarHBondContact O-N 3.48Å; N314-R316 VanDerWaalsContact C-N 3.3Å; N314-R316 PolarHBondContact O-N 3.48Å; R316-K319 PolarHBondContact O-N 3.07Å; R316-K320 PolarHBondContact O-N 3.5Å
317L95.7Very high96Very high85 Ų85112.6 Ų112.645%0.44554%0.538SS..Hα-helixtrans-65.8-42.7179.4-72.7174.1000111.4R313 N314 K319 K320 V321R313-L317 HydrophobicContact CG-CD1 4.1Å; R313-L317 HydrophobicContact CG-CG 4.48Å; R313-L317 WeakPolarHBondContact O-CG 3.29Å; R313-L317 PolarHBondContact O-N 3.42Å; N314-L317 PolarHBondContact O-N 3.38Å; N314-L317 VanDerWaalsContact O-N 3.08Å; L317-K319 VanDerWaalsContact C-N 3.34Å; L317-K319 PolarHBondContact O-N 3Å; L317-K320 CarbonylContact O-C 3.45Å; L317-K320 WeakPolarHBondContact O-CB 3.28Å; L317-K320 PolarHBondContact O-N 2.94Å; L317-K320 VanDerWaalsContact O-N 3.07Å; L317-V321 WeakPolarHBondContact O-CG2 3.49Å; L317-V321 PolarHBondContact O-N 2.98Å
318E96.3Very high96Very high95 Ų95110.3 Ų110.344%0.44453%0.533SS..Hα-helixtrans-58.3-44174.5-76.6173.6-177.100112.1N314 K320 V321 K322N314-E318 PolarHBondContact ND2-OE1 3.07Å; N314-E318 WeakPolarHBondContact O-CG 3.27Å; N314-E318 PolarHBondContact O-N 2.91Å; E318-K320 VanDerWaalsContact C-N 3.32Å; E318-K320 PolarHBondContact O-N 3Å; E318-V321 PolarHBondContact O-N 2.95Å; E318-K322 WeakPolarHBondContact O-CB 3.32Å; E318-K322 WeakPolarHBondContact O-CG 3.34Å; E318-K322 PolarHBondContact O-N 3.07Å
319K96.6Very high96.1Very high163 Ų163112.5 Ų112.571%0.70954%0.535SS*.Hα-helixtrans-61.7-40.7173.9-75-179.6-179.9-174.30111.9T315 R316 L317 K322 G323T315-K319 WeakPolarHBondContact O-CG 3.36Å; T315-K319 PolarHBondContact O-N 3.19Å; R316-K319 PolarHBondContact O-N 3.07Å; L317-K319 VanDerWaalsContact C-N 3.34Å; L317-K319 PolarHBondContact O-N 3Å; K319-K322 PolarHBondContact O-N 3.1Å; K319-G323 PolarHBondContact O-N 2.97Å
320K96.4Very high96.2Very high138 Ų138107 Ų10760%0.652%0.522SS*.Hα-helixtrans-67.1-41.5178.5-168.5170.7-177.5177.60112R316 L317 E318 G323 L324R316-K320 PolarHBondContact O-N 3.5Å; L317-K320 CarbonylContact O-C 3.45Å; L317-K320 WeakPolarHBondContact O-CB 3.28Å; L317-K320 PolarHBondContact O-N 2.94Å; L317-K320 VanDerWaalsContact O-N 3.07Å; E318-K320 VanDerWaalsContact C-N 3.32Å; E318-K320 PolarHBondContact O-N 3Å; K320-G323 PolarHBondContact O-N 3.49Å; K320-L324 HydrophobicContact CG-CD1 4.08Å; K320-L324 HydrophobicContact CG-CG 4.49Å; K320-L324 WeakPolarHBondContact O-CB 3.46Å; K320-L324 WeakPolarHBondContact O-CG 3.37Å; K320-L324 PolarHBondContact O-N 3.31Å
321V95.9Very high96.2Very high89 Ų89107.3 Ų107.354%0.53952%0.523SS..Hα-helixtrans-62.8-45.5175.1171.60000110.5L317 E318 G323 L324 T325L317-V321 WeakPolarHBondContact O-CG2 3.49Å; L317-V321 PolarHBondContact O-N 2.98Å; E318-V321 PolarHBondContact O-N 2.95Å; V321-G323 VanDerWaalsContact C-N 3.35Å; V321-G323 PolarHBondContact O-N 3.17Å; V321-L324 PolarHBondContact O-N 3.45Å; V321-T325 HydrophobicContact CG1-CG2 4.4Å; V321-T325 WeakPolarHBondContact O-CB 3.41Å; V321-T325 WeakPolarHBondContact O-CG2 3.37Å; V321-T325 PolarHBondContact O-N 3.36Å; V321-T325 PolarHBondContact O-OG1 3.34Å
322K96.5Very high96.2Very high150 Ų150105.6 Ų105.665%0.65252%0.519SS*.Hα-helixtrans-61.5-40.1175.3-73.6-179.5179.2-177.10112.9E318 K319 T325 W326E318-K322 WeakPolarHBondContact O-CB 3.32Å; E318-K322 WeakPolarHBondContact O-CG 3.34Å; E318-K322 PolarHBondContact O-N 3.07Å; K319-K322 PolarHBondContact O-N 3.1Å; K322-T325 VanDerWaalsContact CA-OG1 3.28Å; K322-T325 WeakPolarHBondContact CA-OG1 3.4Å; K322-T325 PolarHBondContact O-OG1 2.82Å; K322-W326 PolarHBondContact O-N 2.86Å
323G96.2Very high96.3Very high39 Ų39108.1 Ų108.140%0.40253%0.529SS..Hα-helixtrans-64.7-48.5175.800000112.5K319 K320 V321 T325 W326 E327K319-G323 PolarHBondContact O-N 2.97Å; K320-G323 PolarHBondContact O-N 3.49Å; V321-G323 VanDerWaalsContact C-N 3.35Å; V321-G323 PolarHBondContact O-N 3.17Å; G323-T325 PolarHBondContact O-N 3.02Å; G323-W326 PolarHBondContact O-N 3.41Å; G323-E327 WeakPolarHBondContact O-CB 3.33Å; G323-E327 PolarHBondContact O-N 3.12Å
324L95.7Very high96.3Very high94 Ų94106.8 Ų106.849%0.49252%0.524SS..Hα-helixtrans-66.7-34.6-179.6-72.3171.8000113K320 V321 A328K320-L324 HydrophobicContact CG-CD1 4.08Å; K320-L324 HydrophobicContact CG-CG 4.49Å; K320-L324 WeakPolarHBondContact O-CB 3.46Å; K320-L324 WeakPolarHBondContact O-CG 3.37Å; K320-L324 PolarHBondContact O-N 3.31Å; V321-L324 PolarHBondContact O-N 3.45Å; L324-A328 VanDerWaalsContact O-CB 3.3Å; L324-A328 WeakPolarHBondContact O-CB 3.42Å; L324-A328 PolarHBondContact O-N 3.05Å
325T96.2Very high96.3Very high68 Ų68107.2 Ų107.242%0.41753%0.527SS..Hα-helixtrans-66.8-44.817640.80000111.4V321 K322 G323 E327 A328 E329V321-T325 HydrophobicContact CG1-CG2 4.4Å; V321-T325 WeakPolarHBondContact O-CB 3.41Å; V321-T325 WeakPolarHBondContact O-CG2 3.37Å; V321-T325 PolarHBondContact O-N 3.36Å; V321-T325 PolarHBondContact O-OG1 3.34Å; K322-T325 VanDerWaalsContact CA-OG1 3.28Å; K322-T325 WeakPolarHBondContact CA-OG1 3.4Å; K322-T325 PolarHBondContact O-OG1 2.82Å; G323-T325 PolarHBondContact O-N 3.02Å; T325-E327 PolarHBondContact O-N 3.36Å; T325-A328 PolarHBondContact O-N 3.21Å; T325-E329 WeakPolarHBondContact O-CG 3.25Å; T325-E329 PolarHBondContact O-N 2.81Å
326W97.2Very high96.3Very high175 Ų175108.3 Ų108.366%0.66353%0.53SS*.Hα-helixtrans-64-40175.7-174.978.3000112.9K322 G323 E329 T330K322-W326 PolarHBondContact O-N 2.86Å; G323-W326 PolarHBondContact O-N 3.41Å; W326-E329 PolarHBondContact O-N 3.3Å; W326-T330 WeakPolarHBondContact O-CB 3.49Å; W326-T330 PolarHBondContact O-N 3.33Å; W326-T330 PolarHBondContact O-OG1 2.91Å
327E96.7Very high96.2Very high109 Ų109101.6 Ų101.651%0.50951%0.512SS..Hα-helixtrans-63.8-42.5174.9-171.5174.3-171.100111.4G323 T325 T330 L331G323-E327 WeakPolarHBondContact O-CB 3.33Å; G323-E327 PolarHBondContact O-N 3.12Å; T325-E327 PolarHBondContact O-N 3.36Å; E327-T330 PolarHBondContact O-N 3.41Å; E327-L331 HydrophobicContact CG-CD1 4.37Å; E327-L331 WeakPolarHBondContact O-CG 3.44Å; E327-L331 PolarHBondContact O-N 2.88Å
328A94.9Very high96.2Very high46 Ų46101.2 Ų101.238%0.3851%0.51SS..Hα-helixtrans-62.2-45.7175.500000112.2L324 T325 T330 L331 I332L324-A328 VanDerWaalsContact O-CB 3.3Å; L324-A328 WeakPolarHBondContact O-CB 3.42Å; L324-A328 PolarHBondContact O-N 3.05Å; T325-A328 PolarHBondContact O-N 3.21Å; A328-T330 VanDerWaalsContact C-N 3.32Å; A328-T330 PolarHBondContact O-N 3.2Å; A328-L331 PolarHBondContact O-N 3.4Å; A328-I332 VanDerWaalsContact O-CG1 3.26Å; A328-I332 WeakPolarHBondContact O-CG1 3.44Å; A328-I332 PolarHBondContact O-N 3.17Å
329E97Very high96.2Very high117 Ų11799 Ų9955%0.54750%0.503SS..Hα-helixtrans-59.9-42.5175.8-74.1171.9-176.700111.7T325 W326 L331 I332 L333T325-E329 WeakPolarHBondContact O-CG 3.25Å; T325-E329 PolarHBondContact O-N 2.81Å; W326-E329 PolarHBondContact O-N 3.3Å; E329-L331 PolarHBondContact O-N 2.93Å; E329-I332 PolarHBondContact O-N 3.48Å; E329-L333 WeakPolarHBondContact O-CG 3.17Å; E329-L333 PolarHBondContact O-N 2.93Å
330T96.6Very high96.1Very high62 Ų6294.3 Ų94.338%0.3849%0.494SS..Hα-helixtrans-63.6-42.2177.6-55.80000111.6W326 E327 A328 L333 R334W326-T330 WeakPolarHBondContact O-CB 3.49Å; W326-T330 PolarHBondContact O-N 3.33Å; W326-T330 PolarHBondContact O-OG1 2.91Å; E327-T330 PolarHBondContact O-N 3.41Å; A328-T330 VanDerWaalsContact C-N 3.32Å; A328-T330 PolarHBondContact O-N 3.2Å; T330-L333 PolarHBondContact O-N 3.42Å; T330-R334 WeakPolarHBondContact O-CB 3.39Å; T330-R334 PolarHBondContact O-N 2.91Å
331L96Very high96.1Very high109 Ų10992.7 Ų92.757%0.57149%0.489SS*.Hα-helixtrans-66.7-38.3176.8-73.9172000112.3E327 A328 E329 R334 N335E327-L331 HydrophobicContact CG-CD1 4.37Å; E327-L331 WeakPolarHBondContact O-CG 3.44Å; E327-L331 PolarHBondContact O-N 2.88Å; A328-L331 PolarHBondContact O-N 3.4Å; E329-L331 PolarHBondContact O-N 2.93Å; L331-R334 PolarHBondContact O-N 3.23Å; L331-N335 WeakPolarHBondContact O-CB 3.42Å; L331-N335 PolarHBondContact O-N 3.3Å
332I96.9Very high96.1Very high98 Ų9895.3 Ų95.350%0.50349%0.489SS..Hα-helixtrans-61.6-50.8175.3-70.9164.7000110A328 E329 R334 N335 D336A328-I332 VanDerWaalsContact O-CG1 3.26Å; A328-I332 WeakPolarHBondContact O-CG1 3.44Å; A328-I332 PolarHBondContact O-N 3.17Å; E329-I332 PolarHBondContact O-N 3.48Å; I332-R334 VanDerWaalsContact C-N 3.28Å; I332-R334 PolarHBondContact O-N 3.5Å; I332-N335 WeakPolarHBondContact O-CB 3.31Å; I332-N335 PolarHBondContact O-N 3.47Å; I332-N335 VanDerWaalsContact O-N 3.09Å; I332-D336 PolarHBondContact O-N 3.29Å
333L96Very high96Very high124 Ų12491.9 Ų91.965%0.64948%0.475SS*.Hα-helixtrans-59-39.9177.7-70.9172.6000112.4E329 T330 D336 S337E329-L333 WeakPolarHBondContact O-CG 3.17Å; E329-L333 PolarHBondContact O-N 2.93Å; T330-L333 PolarHBondContact O-N 3.42Å; L333-D336 PolarHBondContact O-N 3.47Å; L333-S337 PolarHBondContact O-N 2.98Å; L333-S337 VanDerWaalsContact O-N 3.13Å
334R96.2Very high96Very high140 Ų14091.1 Ų91.153%0.52847%0.468SS..Hα-helixtrans-66.4-40.7176.2-177.257.2176.9169.74111.8T330 L331 I332 S337 L338T330-R334 WeakPolarHBondContact O-CB 3.39Å; T330-R334 PolarHBondContact O-N 2.91Å; L331-R334 PolarHBondContact O-N 3.23Å; I332-R334 VanDerWaalsContact C-N 3.28Å; I332-R334 PolarHBondContact O-N 3.5Å; R334-S337 PolarHBondContact O-N 3Å; R334-L338 HydrophobicContact CG-CD1 4.31Å; R334-L338 WeakPolarHBondContact O-CG 3.21Å; R334-L338 PolarHBondContact O-N 3.27Å
335N95.8Very high95.9Very high92 Ų9291.6 Ų91.649%0.49247%0.47SS..Hα-helixtrans-63.8-43.9177-17761.4000111.4L331 I332 S337 L338 V339L331-N335 WeakPolarHBondContact O-CB 3.42Å; L331-N335 PolarHBondContact O-N 3.3Å; I332-N335 WeakPolarHBondContact O-CB 3.31Å; I332-N335 PolarHBondContact O-N 3.47Å; I332-N335 VanDerWaalsContact O-N 3.09Å; N335-S337 VanDerWaalsContact C-N 3.31Å; N335-S337 PolarHBondContact O-N 2.92Å; N335-L338 PolarHBondContact O-N 3.36Å; N335-L338 VanDerWaalsContact O-N 3.12Å; N335-V339 WeakPolarHBondContact O-CG2 3.37Å; N335-V339 PolarHBondContact O-N 2.87Å
336D96.3Very high95.8Very high91 Ų9194 Ų9449%0.48748%0.475SS..Hα-helixtrans-60.2-42.1177.5-67.3-16000111.4I332 L333 L338 V339 A340I332-D336 PolarHBondContact O-N 3.29Å; L333-D336 PolarHBondContact O-N 3.47Å; D336-L338 PolarHBondContact O-N 2.88Å; D336-V339 PolarHBondContact O-N 2.94Å; D336-A340 WeakPolarHBondContact O-CB 3.44Å; D336-A340 PolarHBondContact O-N 3.43Å
337S95.6Very high95.7Very high49 Ų4991.9 Ų91.934%0.34347%0.473SS..Hα-helixtrans-61.2-43.3173.5-176.90000112.6L333 R334 N335 A340 E341L333-S337 PolarHBondContact O-N 2.98Å; L333-S337 VanDerWaalsContact O-N 3.13Å; R334-S337 PolarHBondContact O-N 3Å; N335-S337 VanDerWaalsContact C-N 3.31Å; N335-S337 PolarHBondContact O-N 2.92Å; S337-A340 PolarHBondContact O-N 2.94Å; S337-E341 WeakPolarHBondContact O-CG 3.28Å; S337-E341 PolarHBondContact O-N 3.02Å
338L95.7Very high95.6Very high77 Ų7793.9 Ų93.940%0.40348%0.476SS..Hα-helixtrans-69.3-36.3179.4-73.2172.3000112.2R334 N335 D336 E341 R342R334-L338 HydrophobicContact CG-CD1 4.31Å; R334-L338 WeakPolarHBondContact O-CG 3.21Å; R334-L338 PolarHBondContact O-N 3.27Å; N335-L338 PolarHBondContact O-N 3.36Å; N335-L338 VanDerWaalsContact O-N 3.12Å; D336-L338 PolarHBondContact O-N 2.88Å; L338-E341 PolarHBondContact O-N 3.44Å; L338-R342 WeakPolarHBondContact O-CB 3.4Å; L338-R342 PolarHBondContact O-N 2.8Å
339V96.5Very high95.5Very high50 Ų5098 Ų9830%0.30349%0.485SS..Hα-helixtrans-64.3-43.9174171.30000110.2N335 D336 R342 E343N335-V339 WeakPolarHBondContact O-CG2 3.37Å; N335-V339 PolarHBondContact O-N 2.87Å; D336-V339 PolarHBondContact O-N 2.94Å; V339-R342 WeakPolarHBondContact O-CB 3.28Å; V339-R342 PolarHBondContact O-N 3.24Å; V339-E343 WeakPolarHBondContact O-CG 3.38Å; V339-E343 PolarHBondContact O-N 3.37Å
340A95Very high95.4Very high63 Ų6396.4 Ų96.452%0.52148%0.48SS..Hα-helixtrans-61.7-43.5175.500000112.3D336 S337 R342 E343 G344D336-A340 WeakPolarHBondContact O-CB 3.44Å; D336-A340 PolarHBondContact O-N 3.43Å; S337-A340 PolarHBondContact O-N 2.94Å; A340-R342 PolarHBondContact O-N 3.4Å; A340-E343 PolarHBondContact O-N 3.03Å; A340-G344 PolarHBondContact O-N 3.27Å
341E95.4Very high95.3Very high104 Ų10498.1 Ų98.149%0.48649%0.487SS..Hα-helixtrans-61.5-42.1174.6-77.9179.7-171.700112.3S337 L338 G344 L345S337-E341 WeakPolarHBondContact O-CG 3.28Å; S337-E341 PolarHBondContact O-N 3.02Å; L338-E341 PolarHBondContact O-N 3.44Å; E341-G344 PolarHBondContact O-N 2.95Å; E341-L345 WeakPolarHBondContact O-CB 3.3Å; E341-L345 WeakPolarHBondContact O-CG 3.48Å; E341-L345 PolarHBondContact O-N 2.91Å
342R96Very high95.2Very high144 Ų14497.3 Ų97.354%0.54349%0.486SS..Hα-helixtrans-61.6-48.9177.2-175.4-165.974.1-155.61.7111.4L338 V339 A340 G344 L345 K346L338-R342 WeakPolarHBondContact O-CB 3.4Å; L338-R342 PolarHBondContact O-N 2.8Å; V339-R342 WeakPolarHBondContact O-CB 3.28Å; V339-R342 PolarHBondContact O-N 3.24Å; A340-R342 PolarHBondContact O-N 3.4Å; R342-G344 VanDerWaalsContact C-N 3.35Å; R342-L345 PolarHBondContact O-N 2.73Å; R342-K346 WeakPolarHBondContact O-CB 3.42Å; R342-K346 PolarHBondContact O-N 2.9Å
343E95.1Very high95Very high78 Ų7895.5 Ų95.536%0.36448%0.477SS..Hα-helixtrans-63.3-42.4178.7-67.4-50.813300111.1V339 A340 L345 K346 E347V339-E343 WeakPolarHBondContact O-CG 3.38Å; V339-E343 PolarHBondContact O-N 3.37Å; A340-E343 PolarHBondContact O-N 3.03Å; E343-L345 VanDerWaalsContact C-N 3.33Å; E343-L345 PolarHBondContact O-N 3.1Å; E343-K346 WeakPolarHBondContact O-CB 3.42Å; E343-K346 PolarHBondContact O-N 2.93Å; E343-K346 VanDerWaalsContact O-N 3.16Å; E343-E347 PolarHBondContact O-N 3.06Å
344G94.6Very high94.9Very high24 Ų2492.9 Ų92.925%0.24747%0.466CS..Hα-helixtrans-66.3-28.9175.800000114.3A340 E341 R342 R348A340-G344 PolarHBondContact O-N 3.27Å; E341-G344 PolarHBondContact O-N 2.95Å; R342-G344 VanDerWaalsContact C-N 3.35Å; G344-R348 WeakPolarHBondContact O-CG 3.37Å; G344-R348 PolarHBondContact O-N 3.47Å; G344-R348 PolarHBondContact O-NE 3.24Å
345L94.7Very high94.7Very high103 Ų10390.7 Ų90.754%0.53946%0.462SS..Hα-helixtrans-72.5-39.6170.8-83.3164.8000111.8E341 R342 E343 R348 F349E341-L345 WeakPolarHBondContact O-CB 3.3Å; E341-L345 WeakPolarHBondContact O-CG 3.48Å; E341-L345 PolarHBondContact O-N 2.91Å; R342-L345 PolarHBondContact O-N 2.73Å; E343-L345 VanDerWaalsContact C-N 3.33Å; E343-L345 PolarHBondContact O-N 3.1Å; L345-R348 PolarHBondContact O-N 3.07Å; L345-F349 WeakPolarHBondContact O-CB 3.41Å; L345-F349 PolarHBondContact O-N 3.37Å
346K94.4Very high94.6Very high120 Ų12091.5 Ų91.552%0.52247%0.466SS..Hα-helixtrans-65.5-40.6178.6-172.4-178.5176.1-170.80111.9R342 E343 F349 N350R342-K346 WeakPolarHBondContact O-CB 3.42Å; R342-K346 PolarHBondContact O-N 2.9Å; E343-K346 WeakPolarHBondContact O-CB 3.42Å; E343-K346 PolarHBondContact O-N 2.93Å; E343-K346 VanDerWaalsContact O-N 3.16Å; K346-F349 PolarHBondContact O-N 2.94Å; K346-N350 PolarHBondContact O-N 3.47Å; K346-N350 VanDerWaalsContact O-N 3.09Å; K346-N350 PolarHBondContact O-ND2 3.4Å
347E94.4Very high94.4Very high130 Ų13093.2 Ų93.261%0.60747%0.471SS*.Hα-helixtrans-61.8-52174.3-170.6173.5-16300111E343 F349 N350 D351E343-E347 PolarHBondContact O-N 3.06Å; E347-F349 VanDerWaalsContact C-N 3.28Å; E347-F349 PolarHBondContact O-N 3.26Å; E347-N350 WeakPolarHBondContact O-CB 3.31Å; E347-N350 PolarHBondContact O-N 3.04Å; E347-D351 PolarHBondContact O-N 2.93Å
348R94.9Very high94.2Very high151 Ų15196.6 Ų96.657%0.5748%0.481SS*.Hα-helixtrans-57.9-38.8176.3-75.3-177.8-77.1-178.6-4.3113.3G344 L345 D351 V352G344-R348 WeakPolarHBondContact O-CG 3.37Å; G344-R348 PolarHBondContact O-N 3.47Å; G344-R348 PolarHBondContact O-NE 3.24Å; L345-R348 PolarHBondContact O-N 3.07Å; R348-D351 PolarHBondContact O-N 3.25Å; R348-V352 VanDerWaalsContact O-CG2 3.32Å; R348-V352 WeakPolarHBondContact O-CG2 3.42Å; R348-V352 PolarHBondContact O-N 3.02Å
349F93.2Very high94.1Very high133 Ų13398.9 Ų98.958%0.58349%0.488SS*.Hα-helixtrans-62.9-43.6176.3177.3-101.9000111.7L345 K346 E347 V352 I353L345-F349 WeakPolarHBondContact O-CB 3.41Å; L345-F349 PolarHBondContact O-N 3.37Å; K346-F349 PolarHBondContact O-N 2.94Å; E347-F349 VanDerWaalsContact C-N 3.28Å; E347-F349 PolarHBondContact O-N 3.26Å; F349-V352 PolarHBondContact O-N 3.48Å; F349-I353 HydrophobicContact CD1-CD1 3.77Å; F349-I353 HydrophobicContact CE1-CD1 3.18Å; F349-I353 HydrophobicContact CE1-CG1 4.27Å; F349-I353 HydrophobicContact CE2-CD1 4.11Å; F349-I353 HydrophobicContact CG-CD1 4.46Å; F349-I353 HydrophobicContact CZ-CD1 3.4Å; F349-I353 HydrophobicContact CZ-CG1 4.27Å; F349-I353 WeakPolarHBondContact O-CG1 3.49Å; F349-I353 PolarHBondContact O-N 2.94Å
350N94.3Very high93.9Very high82 Ų8299.7 Ų99.744%0.43949%0.493SS..Hα-helixtrans-63.5-42.2175.9-72.2-24.6000111.6K346 E347 V352 I353 V354K346-N350 PolarHBondContact O-N 3.47Å; K346-N350 VanDerWaalsContact O-N 3.09Å; K346-N350 PolarHBondContact O-ND2 3.4Å; E347-N350 WeakPolarHBondContact O-CB 3.31Å; E347-N350 PolarHBondContact O-N 3.04Å; N350-V352 PolarHBondContact O-N 2.9Å; N350-I353 PolarHBondContact O-N 3.43Å; N350-V354 WeakPolarHBondContact O-CG2 3.35Å; N350-V354 PolarHBondContact O-N 3.49Å
351D94.2Very high93.7Very high99 Ų9998.1 Ų98.153%0.52948%0.483SS..Hα-helixtrans-59.2-46.6177-68.3-22000111.6E347 R348 I353 V354 E355E347-D351 PolarHBondContact O-N 2.93Å; R348-D351 PolarHBondContact O-N 3.25Å; D351-I353 VanDerWaalsContact C-N 3.34Å; D351-I353 PolarHBondContact O-N 2.95Å; D351-V354 PolarHBondContact O-N 3.35Å; D351-E355 WeakPolarHBondContact O-CB 3.46Å; D351-E355 PolarHBondContact O-N 3.36Å
352V93.4Very high93.6Very high91 Ų9198.8 Ų98.855%0.55249%0.489SS*.Hα-helixtrans-63.4-39.4178.2171.60000111.6R348 F349 N350 E355 L356R348-V352 VanDerWaalsContact O-CG2 3.32Å; R348-V352 WeakPolarHBondContact O-CG2 3.42Å; R348-V352 PolarHBondContact O-N 3.02Å; F349-V352 PolarHBondContact O-N 3.48Å; N350-V352 PolarHBondContact O-N 2.9Å; V352-E355 PolarHBondContact O-N 2.88Å; V352-L356 VanDerWaalsContact O-CB 3.3Å; V352-L356 WeakPolarHBondContact O-CB 3.32Å; V352-L356 PolarHBondContact O-N 2.88Å
353I92.7Very high93.5Very high60 Ų6098.5 Ų98.531%0.30849%0.492SS..Hα-helixtrans-62.7-48.4175.5-75.3178.4000110.8F349 N350 D351 E355 L356 Q357F349-I353 HydrophobicContact CD1-CD1 3.77Å; F349-I353 HydrophobicContact CE1-CD1 3.18Å; F349-I353 HydrophobicContact CE1-CG1 4.27Å; F349-I353 HydrophobicContact CE2-CD1 4.11Å; F349-I353 HydrophobicContact CG-CD1 4.46Å; F349-I353 HydrophobicContact CZ-CD1 3.4Å; F349-I353 HydrophobicContact CZ-CG1 4.27Å; F349-I353 WeakPolarHBondContact O-CG1 3.49Å; F349-I353 PolarHBondContact O-N 2.94Å; N350-I353 PolarHBondContact O-N 3.43Å; D351-I353 VanDerWaalsContact C-N 3.34Å; D351-I353 PolarHBondContact O-N 2.95Å; I353-E355 VanDerWaalsContact C-N 3.32Å; I353-E355 PolarHBondContact O-N 3.4Å; I353-L356 PolarHBondContact O-N 3.36Å; I353-Q357 HydrophobicContact CG2-CG 4.35Å; I353-Q357 WeakPolarHBondContact O-CB 3.45Å; I353-Q357 WeakPolarHBondContact O-CG 3.48Å; I353-Q357 PolarHBondContact O-N 3.3Å
354V94.1Very high93.4Very high70 Ų7099.1 Ų99.142%0.42450%0.498SS..Hα-helixtrans-62.3-43.4-179.51720000110.1N350 D351 L356 Q357 Q358N350-V354 WeakPolarHBondContact O-CG2 3.35Å; N350-V354 PolarHBondContact O-N 3.49Å; D351-V354 PolarHBondContact O-N 3.35Å; V354-L356 PolarHBondContact O-N 3.5Å; V354-Q357 PolarHBondContact O-N 3.01Å; V354-Q358 HydrophobicContact CG1-CG 4.47Å; V354-Q358 WeakPolarHBondContact O-CB 3.33Å; V354-Q358 VanDerWaalsContact O-CG 3.29Å; V354-Q358 WeakPolarHBondContact O-CG 3.49Å; V354-Q358 PolarHBondContact O-N 3.48Å
355E93.3Very high93.4Very high93 Ų93101.5 Ų101.544%0.43551%0.507SS..Hα-helixtrans-62.1-43176.6-165.8-171.6166.600111.8D351 V352 I353 Q358 K359D351-E355 WeakPolarHBondContact O-CB 3.46Å; D351-E355 PolarHBondContact O-N 3.36Å; V352-E355 PolarHBondContact O-N 2.88Å; I353-E355 VanDerWaalsContact C-N 3.32Å; I353-E355 PolarHBondContact O-N 3.4Å; E355-Q358 PolarHBondContact O-N 2.79Å; E355-K359 WeakPolarHBondContact O-CG 3.5Å; E355-K359 PolarHBondContact O-N 2.97Å; E355-K359 WeakPolarHBondContact OE1-CE 3.34Å; E355-K359 IonicContact OE1-NZ 2.84Å; E355-K359 PolarHBondContact OE1-NZ 3.12Å
356L93.4Very high93.4Very high110 Ų110102.1 Ų102.158%0.57651%0.511SS*.Hα-helixtrans-64.4-42.3176.9-176.866.7000111.8V352 I353 V354 K359 T360V352-L356 VanDerWaalsContact O-CB 3.3Å; V352-L356 WeakPolarHBondContact O-CB 3.32Å; V352-L356 PolarHBondContact O-N 2.88Å; I353-L356 PolarHBondContact O-N 3.36Å; V354-L356 PolarHBondContact O-N 3.5Å; L356-K359 PolarHBondContact O-N 3.03Å; L356-T360 HydrophobicContact CD1-CG2 4.39Å; L356-T360 WeakPolarHBondContact O-CB 3.43Å; L356-T360 WeakPolarHBondContact O-CG2 3.48Å; L356-T360 PolarHBondContact O-N 2.94Å; L356-T360 PolarHBondContact O-OG1 2.95Å
357Q90.7Very high93.4Very high126 Ų126100.5 Ų100.559%0.58951%0.507SS*.Hα-helixtrans-63.7-40.9175.6-75.8179.6-12.300111.5I353 V354 T360 G361I353-Q357 HydrophobicContact CG2-CG 4.35Å; I353-Q357 WeakPolarHBondContact O-CB 3.45Å; I353-Q357 WeakPolarHBondContact O-CG 3.48Å; I353-Q357 PolarHBondContact O-N 3.3Å; V354-Q357 PolarHBondContact O-N 3.01Å; Q357-T360 WeakPolarHBondContact CA-OG1 3.32Å; Q357-T360 PolarHBondContact O-OG1 3.47Å; Q357-T360 VanDerWaalsContact O-OG1 3.11Å; Q357-G361 WeakPolarHBondContact O-CA 3.37Å; Q357-G361 PolarHBondContact O-N 2.99Å
358Q91.8Very high93.4Very high121 Ų121100.4 Ų100.457%0.56551%0.506SS*.Hα-helixtrans-64.3-45.8175.4-73.9176.28.800111.8V354 E355 G361 L362V354-Q358 HydrophobicContact CG1-CG 4.47Å; V354-Q358 WeakPolarHBondContact O-CB 3.33Å; V354-Q358 VanDerWaalsContact O-CG 3.29Å; V354-Q358 WeakPolarHBondContact O-CG 3.49Å; V354-Q358 PolarHBondContact O-N 3.48Å; E355-Q358 PolarHBondContact O-N 2.79Å; Q358-G361 PolarHBondContact O-N 2.99Å; Q358-L362 WeakPolarHBondContact O-CB 3.43Å; Q358-L362 WeakPolarHBondContact O-CG 3.37Å; Q358-L362 PolarHBondContact O-N 3.34Å
359K93.1Very high93.4Very high125 Ų125102.1 Ų102.154%0.54351%0.513SS..Hα-helixtrans-63.3-44.5178.7-75.3179.1-176.3168.20112.2E355 L356 K363E355-K359 WeakPolarHBondContact O-CG 3.5Å; E355-K359 PolarHBondContact O-N 2.97Å; E355-K359 WeakPolarHBondContact OE1-CE 3.34Å; E355-K359 IonicContact OE1-NZ 2.84Å; E355-K359 PolarHBondContact OE1-NZ 3.12Å; L356-K359 PolarHBondContact O-N 3.03Å; K359-K363 WeakPolarHBondContact O-CB 3.39Å; K359-K363 PolarHBondContact O-N 3.08Å; K359-K363 VanDerWaalsContact O-N 3.1Å
360T92.6Very high93.5Very high67 Ų67102.4 Ų102.441%0.41151%0.514SS..Hα-helixtrans-69-40.8177.2510000111.4L356 Q357 K363 N364L356-T360 HydrophobicContact CD1-CG2 4.39Å; L356-T360 WeakPolarHBondContact O-CB 3.43Å; L356-T360 WeakPolarHBondContact O-CG2 3.48Å; L356-T360 PolarHBondContact O-N 2.94Å; L356-T360 PolarHBondContact O-OG1 2.95Å; Q357-T360 WeakPolarHBondContact CA-OG1 3.32Å; Q357-T360 PolarHBondContact O-OG1 3.47Å; Q357-T360 VanDerWaalsContact O-OG1 3.11Å; T360-K363 PolarHBondContact O-N 3.36Å; T360-N364 VanDerWaalsContact O-CG 3.29Å; T360-N364 PolarHBondContact O-N 2.86Å; T360-N364 PolarHBondContact O-OD1 3.38Å
361G91.1Very high93.5Very high30 Ų30103.2 Ų103.231%0.30952%0.517SS..Hα-helixtrans-58.5-48.217400000112.9Q357 Q358 K363 N364 V365Q357-G361 WeakPolarHBondContact O-CA 3.37Å; Q357-G361 PolarHBondContact O-N 2.99Å; Q358-G361 PolarHBondContact O-N 2.99Å; G361-K363 VanDerWaalsContact C-N 3.35Å; G361-K363 PolarHBondContact O-N 3.3Å; G361-N364 PolarHBondContact O-N 3.45Å; G361-V365 WeakPolarHBondContact O-CG2 3.32Å; G361-V365 PolarHBondContact O-N 3.06Å
362L93.4Very high93.5Very high118 Ų118100.1 Ų100.162%0.61851%0.505SS*.Hα-helixtrans-59.8-43.6175.1-77.3164.6000112Q358 N364 V365 L366Q358-L362 WeakPolarHBondContact O-CB 3.43Å; Q358-L362 WeakPolarHBondContact O-CG 3.37Å; Q358-L362 PolarHBondContact O-N 3.34Å; L362-N364 VanDerWaalsContact C-N 3.35Å; L362-N364 PolarHBondContact O-N 3.4Å; L362-V365 PolarHBondContact O-N 2.94Å; L362-L366 WeakPolarHBondContact O-CB 3.41Å; L362-L366 WeakPolarHBondContact O-CG 3.19Å; L362-L366 PolarHBondContact O-N 3.39Å
363K94.4Very high93.6Very high138 Ų13898.3 Ų98.360%0.650%0.5SS*.Hα-helixtrans-61.9-42.8177-171.3178.5-179.2-177.70111.4K359 T360 G361 L366 L367K359-K363 WeakPolarHBondContact O-CB 3.39Å; K359-K363 PolarHBondContact O-N 3.08Å; K359-K363 VanDerWaalsContact O-N 3.1Å; T360-K363 PolarHBondContact O-N 3.36Å; G361-K363 VanDerWaalsContact C-N 3.35Å; G361-K363 PolarHBondContact O-N 3.3Å; K363-L366 PolarHBondContact O-N 2.95Å; K363-L367 HydrophobicContact CG-CD1 4.25Å; K363-L367 VanDerWaalsContact O-CG 3.31Å; K363-L367 WeakPolarHBondContact O-CG 3.43Å; K363-L367 PolarHBondContact O-N 3.23Å
364N93.7Very high93.7Very high90 Ų90100.7 Ų100.748%0.48151%0.513SS..Hα-helixtrans-63.7-47.7178-72-7.3000111.4T360 G361 L362 L366 L367 E368T360-N364 VanDerWaalsContact O-CG 3.29Å; T360-N364 PolarHBondContact O-N 2.86Å; T360-N364 PolarHBondContact O-OD1 3.38Å; G361-N364 PolarHBondContact O-N 3.45Å; L362-N364 VanDerWaalsContact C-N 3.35Å; L362-N364 PolarHBondContact O-N 3.4Å; N364-L366 VanDerWaalsContact C-N 3.29Å; N364-L366 PolarHBondContact O-N 3.42Å; N364-L367 PolarHBondContact O-N 3.4Å; N364-L367 VanDerWaalsContact O-N 3.09Å; N364-E368 WeakPolarHBondContact O-CG 3.37Å; N364-E368 PolarHBondContact O-N 3.47Å
365V94.3Very high93.8Very high74 Ų74102.4 Ų102.445%0.44852%0.518SS..Hα-helixtrans-59.4-40.4176.9171.90000111.5G361 L362 E368 R369G361-V365 WeakPolarHBondContact O-CG2 3.32Å; G361-V365 PolarHBondContact O-N 3.06Å; L362-V365 PolarHBondContact O-N 2.94Å; V365-E368 PolarHBondContact O-N 2.87Å; V365-R369 WeakPolarHBondContact O-CB 3.45Å; V365-R369 VanDerWaalsContact O-CG 3.3Å; V365-R369 WeakPolarHBondContact O-CG 3.24Å; V365-R369 PolarHBondContact O-N 2.86Å
366L93.6Very high93.9Very high117 Ų117105.6 Ų105.661%0.61353%0.526SS*.Hα-helixtrans-64.7-41.4175.6-74.5171.7000112.2L362 K363 N364 R369 K370L362-L366 WeakPolarHBondContact O-CB 3.41Å; L362-L366 WeakPolarHBondContact O-CG 3.19Å; L362-L366 PolarHBondContact O-N 3.39Å; K363-L366 PolarHBondContact O-N 2.95Å; N364-L366 VanDerWaalsContact C-N 3.29Å; N364-L366 PolarHBondContact O-N 3.42Å; L366-R369 PolarHBondContact O-N 2.94Å; L366-K370 WeakPolarHBondContact O-CB 3.49Å; L366-K370 PolarHBondContact O-N 2.99Å
367L94.5Very high93.9Very high85 Ų85104 Ų10445%0.44552%0.515SS..Hα-helixtrans-65.8-43.9176.3-71.9172.3000111.6K363 N364 R369 K370 I371K363-L367 HydrophobicContact CG-CD1 4.25Å; K363-L367 VanDerWaalsContact O-CG 3.31Å; K363-L367 WeakPolarHBondContact O-CG 3.43Å; K363-L367 PolarHBondContact O-N 3.23Å; N364-L367 PolarHBondContact O-N 3.4Å; N364-L367 VanDerWaalsContact O-N 3.09Å; L367-R369 PolarHBondContact O-N 3.4Å; L367-K370 WeakPolarHBondContact O-CB 3.03Å; L367-K370 PolarHBondContact O-N 3.26Å; L367-I371 WeakPolarHBondContact O-CG1 3.38Å; L367-I371 PolarHBondContact O-N 2.91Å
368E94.5Very high94.1Very high128 Ų128103.3 Ų103.360%0.59852%0.515SS*.Hα-helixtrans-59.3-45.8174.8-74.6175.2-177.400111.5N364 V365 K370 I371 A372N364-E368 WeakPolarHBondContact O-CG 3.37Å; N364-E368 PolarHBondContact O-N 3.47Å; V365-E368 PolarHBondContact O-N 2.87Å; E368-K370 VanDerWaalsContact C-N 3.31Å; E368-K370 PolarHBondContact O-N 3.35Å; E368-I371 PolarHBondContact O-N 2.61Å; E368-A372 WeakPolarHBondContact O-CB 3.34Å; E368-A372 PolarHBondContact O-N 2.91Å
369R94.5Very high94.2Very high187 Ų187102.8 Ų102.871%0.70651%0.513SS*.Hα-helixtrans-62.7-38.7175.8-73.1-179.479.1164.86112V365 L366 L367 A373V365-R369 WeakPolarHBondContact O-CB 3.45Å; V365-R369 VanDerWaalsContact O-CG 3.3Å; V365-R369 WeakPolarHBondContact O-CG 3.24Å; V365-R369 PolarHBondContact O-N 2.86Å; L366-R369 PolarHBondContact O-N 2.94Å; L367-R369 PolarHBondContact O-N 3.4Å; R369-A373 WeakPolarHBondContact O-CB 3.47Å; R369-A373 PolarHBondContact O-N 3.38Å
370K95.8Very high94.2Very high139 Ų139103 Ų10360%0.60451%0.514SS*.Hα-helixtrans-65.8-44.2176.3-174.3174.6-179.8-1800111.3L366 L367 E368 A373 L374L366-K370 WeakPolarHBondContact O-CB 3.49Å; L366-K370 PolarHBondContact O-N 2.99Å; L367-K370 WeakPolarHBondContact O-CB 3.03Å; L367-K370 PolarHBondContact O-N 3.26Å; E368-K370 VanDerWaalsContact C-N 3.31Å; E368-K370 PolarHBondContact O-N 3.35Å; K370-A373 PolarHBondContact O-N 2.95Å; K370-L374 HydrophobicContact CG-CD1 4.24Å; K370-L374 WeakPolarHBondContact O-CG 3.48Å; K370-L374 PolarHBondContact O-N 2.91Å
371I94.7Very high94.2Very high99 Ų99107.5 Ų107.551%0.50852%0.523SS..Hα-helixtrans-60.3-50.1175.3-69.6166.9000109.9L367 E368 A373 L374 M375L367-I371 WeakPolarHBondContact O-CG1 3.38Å; L367-I371 PolarHBondContact O-N 2.91Å; E368-I371 PolarHBondContact O-N 2.61Å; I371-A373 VanDerWaalsContact C-N 3.29Å; I371-A373 PolarHBondContact O-N 2.94Å; I371-L374 PolarHBondContact O-N 3.5Å; I371-L374 VanDerWaalsContact O-N 3.12Å; I371-M375 HydrophobicContact CG2-CG 4.26Å; I371-M375 HydrophobicContact CG2-SD 3.93Å; I371-M375 WeakPolarHBondContact O-CG 3.47Å; I371-M375 PolarHBondContact O-N 3.22Å
372A94.9Very high94.1Very high34 Ų34108.3 Ų108.328%0.28152%0.524SS..Hα-helixtrans-60.2-38179.200000112.7E368 R376E368-A372 WeakPolarHBondContact O-CB 3.34Å; E368-A372 PolarHBondContact O-N 2.91Å; A372-R376 WeakPolarHBondContact O-CG 3.46Å; A372-R376 PolarHBondContact O-N 2.72Å; A372-R376 VanDerWaalsContact O-N 3.1Å
373A95Very high94Very high53 Ų53107.9 Ų107.944%0.43852%0.522SS..Hα-helixtrans-66.5-42.5175.200000112.1R369 K370 I371 R376 E377R369-A373 WeakPolarHBondContact O-CB 3.47Å; R369-A373 PolarHBondContact O-N 3.38Å; K370-A373 PolarHBondContact O-N 2.95Å; I371-A373 VanDerWaalsContact C-N 3.29Å; I371-A373 PolarHBondContact O-N 2.94Å; A373-R376 PolarHBondContact O-N 3.4Å; A373-E377 PolarHBondContact O-N 3.45Å; A373-E377 VanDerWaalsContact O-N 3.09Å
374L95.4Very high93.8Very high110 Ų110105.4 Ų105.458%0.57652%0.518SS*.Hα-helixtrans-65.2-40.7176.2-71.3172000111.8K370 I371 E377 D378K370-L374 HydrophobicContact CG-CD1 4.24Å; K370-L374 WeakPolarHBondContact O-CG 3.48Å; K370-L374 PolarHBondContact O-N 2.91Å; I371-L374 PolarHBondContact O-N 3.5Å; I371-L374 VanDerWaalsContact O-N 3.12Å; L374-E377 PolarHBondContact O-N 3.04Å; L374-D378 WeakPolarHBondContact O-CB 3.34Å; L374-D378 PolarHBondContact O-N 2.97Å
375M95.6Very high93.5Very high107 Ų107105.1 Ų105.153%0.52752%0.516SS..Hα-helixtrans-61.7-44.6175.6-71.6-18071.600111.9I371 E377 D378 E379I371-M375 HydrophobicContact CG2-CG 4.26Å; I371-M375 HydrophobicContact CG2-SD 3.93Å; I371-M375 WeakPolarHBondContact O-CG 3.47Å; I371-M375 PolarHBondContact O-N 3.22Å; M375-E377 VanDerWaalsContact C-N 3.3Å; M375-E377 PolarHBondContact O-N 3.46Å; M375-D378 WeakPolarHBondContact O-CB 3.49Å; M375-D378 PolarHBondContact O-N 2.95Å; M375-E379 WeakPolarHBondContact O-CG 3.44Å; M375-E379 PolarHBondContact O-N 3.25Å
376R94.4Very high93.1Very high160 Ų160107.4 Ų107.460%0.60452%0.522SS*.Hα-helixtrans-63.8-36.9176.2-71.5-178.8-141.6150.51.4112.8A372 A373 K380A372-R376 WeakPolarHBondContact O-CG 3.46Å; A372-R376 PolarHBondContact O-N 2.72Å; A372-R376 VanDerWaalsContact O-N 3.1Å; A373-R376 PolarHBondContact O-N 3.4Å; R376-K380 VanDerWaalsContact O-CG 3.27Å; R376-K380 WeakPolarHBondContact O-CG 3.28Å; R376-K380 PolarHBondContact O-N 3.4Å
377E94.8Very high92.7Very high75 Ų75107.8 Ų107.835%0.3552%0.52SS..Hα-helixtrans-68.2-39.3177-178.160.7-162.700111.2A373 L374 M375 K380 R381A373-E377 PolarHBondContact O-N 3.45Å; A373-E377 VanDerWaalsContact O-N 3.09Å; L374-E377 PolarHBondContact O-N 3.04Å; M375-E377 VanDerWaalsContact C-N 3.3Å; M375-E377 PolarHBondContact O-N 3.46Å; E377-K380 PolarHBondContact O-N 3.48Å; E377-R381 WeakPolarHBondContact O-CG 3.48Å; E377-R381 PolarHBondContact O-N 2.89Å; E377-R381 IonicContact OE1-CZ 3.22Å; E377-R381 IonicContact OE1-NE 2.71Å; E377-R381 PolarHBondContact OE1-NE 3.45Å; E377-R381 IonicContact OE1-NH2 3.88Å; E377-R381 PolarHBondContact OE1-NH2 3.23Å; E377-R381 VanDerWaalsContact OE1-NH2 3.1Å
378D93.7Very high92.4Very high112 Ų112106.9 Ų106.960%0.59952%0.518SS*.Hα-helixtrans-63.3-47.6173.6-171.163.7000111.8L374 M375 K380 R381 S382L374-D378 WeakPolarHBondContact O-CB 3.34Å; L374-D378 PolarHBondContact O-N 2.97Å; M375-D378 WeakPolarHBondContact O-CB 3.49Å; M375-D378 PolarHBondContact O-N 2.95Å; D378-K380 VanDerWaalsContact C-N 3.33Å; D378-K380 PolarHBondContact O-N 3.26Å; D378-R381 PolarHBondContact O-N 2.92Å; D378-S382 WeakPolarHBondContact O-CB 3.39Å; D378-S382 PolarHBondContact O-N 2.94Å
379E93.7Very high91.9Very high110 Ų110102.7 Ų102.751%0.51450%0.499SS..Hα-helixtrans-55.6-46.5174.4-76.6171.7-174.700111.8M375 R381 S382 I383M375-E379 WeakPolarHBondContact O-CG 3.44Å; M375-E379 PolarHBondContact O-N 3.25Å; E379-R381 PolarHBondContact O-N 2.91Å; E379-S382 PolarHBondContact O-N 2.88Å; E379-I383 VanDerWaalsContact O-CG1 3.28Å; E379-I383 WeakPolarHBondContact O-CG1 3.48Å; E379-I383 PolarHBondContact O-N 3.16Å
380K93.2Very high91.4Very high130 Ų13096.9 Ų96.957%0.56549%0.491SS*.Hα-helixtrans-59.8-47.3176.7-76.5174.9-176.8-176.90112R376 E377 D378 S382 I383 V384R376-K380 VanDerWaalsContact O-CG 3.27Å; R376-K380 WeakPolarHBondContact O-CG 3.28Å; R376-K380 PolarHBondContact O-N 3.4Å; E377-K380 PolarHBondContact O-N 3.48Å; D378-K380 VanDerWaalsContact C-N 3.33Å; D378-K380 PolarHBondContact O-N 3.26Å; K380-S382 VanDerWaalsContact C-N 3.32Å; K380-I383 PolarHBondContact O-N 2.92Å; K380-V384 WeakPolarHBondContact O-CG2 3.34Å; K380-V384 PolarHBondContact O-N 3.32Å
381R93Very high90.9Very high161 Ų16195.2 Ų95.261%0.60849%0.493SS*.Hα-helixtrans-63.6-41.5179-73.1174.2-171.2-170.71.9111.3E377 D378 E379 V384 L385E377-R381 WeakPolarHBondContact O-CG 3.48Å; E377-R381 PolarHBondContact O-N 2.89Å; E377-R381 IonicContact OE1-CZ 3.22Å; E377-R381 IonicContact OE1-NE 2.71Å; E377-R381 PolarHBondContact OE1-NE 3.45Å; E377-R381 IonicContact OE1-NH2 3.88Å; E377-R381 PolarHBondContact OE1-NH2 3.23Å; E377-R381 VanDerWaalsContact OE1-NH2 3.1Å; D378-R381 PolarHBondContact O-N 2.92Å; E379-R381 PolarHBondContact O-N 2.91Å; R381-V384 PolarHBondContact O-N 3Å; R381-L385 VanDerWaalsContact O-CB 3.29Å; R381-L385 WeakPolarHBondContact O-CB 3.34Å; R381-L385 PolarHBondContact O-N 3.15Å
382S89.5Confident90.4Very high47 Ų4795.7 Ų95.733%0.32950%0.504SS..Hα-helixtrans-60.3-47.5175.9-174.10000111D378 E379 K380 V384 L385 H386D378-S382 WeakPolarHBondContact O-CB 3.39Å; D378-S382 PolarHBondContact O-N 2.94Å; E379-S382 PolarHBondContact O-N 2.88Å; K380-S382 VanDerWaalsContact C-N 3.32Å; S382-V384 PolarHBondContact O-N 3.03Å; S382-L385 PolarHBondContact O-N 3.2Å; S382-H386 PolarHBondContact O-N 3.44Å; S382-H386 PolarHBondContact O-ND1 3.4Å; S382-H386 PolarHBondContact OG-CE1 3.38Å; S382-H386 VanDerWaalsContact OG-CE1 3.3Å; S382-H386 PolarHBondContact OG-ND1 3.39Å
383I91.3Very high89.7Confident110 Ų11095.4 Ų95.456%0.56450%0.502SS*.Hα-helixtrans-59-50.2177-68.3163.9000111.1E379 K380 L385 H386 E387E379-I383 VanDerWaalsContact O-CG1 3.28Å; E379-I383 WeakPolarHBondContact O-CG1 3.48Å; E379-I383 PolarHBondContact O-N 3.16Å; K380-I383 PolarHBondContact O-N 2.92Å; I383-L385 VanDerWaalsContact C-N 3.29Å; I383-L385 PolarHBondContact O-N 2.9Å; I383-H386 PolarHBondContact O-N 3.18Å; I383-E387 WeakPolarHBondContact O-CB 3.42Å; I383-E387 PolarHBondContact O-N 3.17Å
384V90.7Very high88.7Confident85 Ų8596.9 Ų96.952%0.51551%0.507SS..Hα-helixtrans-60.1-41.2179.3172.30000111.2K380 R381 S382 T388K380-V384 WeakPolarHBondContact O-CG2 3.34Å; K380-V384 PolarHBondContact O-N 3.32Å; R381-V384 PolarHBondContact O-N 3Å; S382-V384 PolarHBondContact O-N 3.03Å; V384-T388 HydrophobicContact CG1-CG2 4.32Å; V384-T388 WeakPolarHBondContact O-CB 3.44Å; V384-T388 VanDerWaalsContact O-CG2 3.25Å; V384-T388 WeakPolarHBondContact O-CG2 3.43Å; V384-T388 PolarHBondContact O-N 3.4Å; V384-T388 PolarHBondContact O-OG1 3.48Å
385L86.1Confident88Confident85 Ų8599 Ų9945%0.44552%0.519SS..Hα-helixtrans-63.2-48.6176.9-176.963.9000111.1R381 S382 I383 E387 T388 I389R381-L385 VanDerWaalsContact O-CB 3.29Å; R381-L385 WeakPolarHBondContact O-CB 3.34Å; R381-L385 PolarHBondContact O-N 3.15Å; S382-L385 PolarHBondContact O-N 3.2Å; I383-L385 VanDerWaalsContact C-N 3.29Å; I383-L385 PolarHBondContact O-N 2.9Å; L385-E387 PolarHBondContact O-N 3.45Å; L385-T388 WeakPolarHBondContact CA-OG1 3.21Å; L385-T388 PolarHBondContact O-N 3.06Å; L385-T388 PolarHBondContact O-OG1 2.98Å; L385-I389 HydrophobicContact CD1-CD1 4.05Å; L385-I389 HydrophobicContact CD1-CG1 4.43Å; L385-I389 HydrophobicContact CG-CD1 3.88Å; L385-I389 WeakPolarHBondContact O-CD1 3.42Å; L385-I389 WeakPolarHBondContact O-CG1 3.44Å; L385-I389 PolarHBondContact O-N 3.21Å
386H85.4Confident87.2Confident122 Ų12299.7 Ų99.757%0.56552%0.519SS*.Hα-helixtrans-62.4-42.2179-73.989.2000112.3S382 I383 I389 A390S382-H386 PolarHBondContact O-N 3.44Å; S382-H386 PolarHBondContact O-ND1 3.4Å; S382-H386 PolarHBondContact OG-CE1 3.38Å; S382-H386 VanDerWaalsContact OG-CE1 3.3Å; S382-H386 PolarHBondContact OG-ND1 3.39Å; I383-H386 PolarHBondContact O-N 3.18Å; H386-I389 PolarHBondContact O-N 2.89Å; H386-A390 WeakPolarHBondContact O-CB 3.37Å; H386-A390 PolarHBondContact O-N 3.34Å
387E86.9Confident86.2Confident125 Ų12594.3 Ų94.358%0.58451%0.509SS*.Hα-helixtrans-65.9-42.9178.5-173.3177.5-174.600112.2I383 L385 I389 A390 T391I383-E387 WeakPolarHBondContact O-CB 3.42Å; I383-E387 PolarHBondContact O-N 3.17Å; L385-E387 PolarHBondContact O-N 3.45Å; E387-I389 PolarHBondContact O-N 2.92Å; E387-A390 PolarHBondContact O-N 3.29Å; E387-T391 WeakPolarHBondContact O-CB 3.42Å; E387-T391 PolarHBondContact O-N 3.05Å; E387-T391 PolarHBondContact O-OG1 2.97Å
388T87Confident85.3Confident65 Ų6599.1 Ų99.140%0.39953%0.531SS..Hα-helixtrans-65-39.4177.549.70000112.1V384 L385 T391 C392V384-T388 HydrophobicContact CG1-CG2 4.32Å; V384-T388 WeakPolarHBondContact O-CB 3.44Å; V384-T388 VanDerWaalsContact O-CG2 3.25Å; V384-T388 WeakPolarHBondContact O-CG2 3.43Å; V384-T388 PolarHBondContact O-N 3.4Å; V384-T388 PolarHBondContact O-OG1 3.48Å; L385-T388 WeakPolarHBondContact CA-OG1 3.21Å; L385-T388 PolarHBondContact O-N 3.06Å; L385-T388 PolarHBondContact O-OG1 2.98Å; T388-T391 PolarHBondContact O-N 3Å; T388-C392 VanDerWaalsContact O-CB 3.3Å; T388-C392 WeakPolarHBondContact O-CB 3.45Å; T388-C392 PolarHBondContact O-N 2.87Å; T388-C392 PolarHBondContact O-SG 2.98Å
389I84.2Confident84.7Confident40 Ų40100.8 Ų100.821%0.20553%0.533CS..Hα-helixtrans-62.8-48.9174.4-66.1167.1000110.6L385 H386 E387 T391 A393 L400L385-I389 HydrophobicContact CD1-CD1 4.05Å; L385-I389 HydrophobicContact CD1-CG1 4.43Å; L385-I389 HydrophobicContact CG-CD1 3.88Å; L385-I389 WeakPolarHBondContact O-CD1 3.42Å; L385-I389 WeakPolarHBondContact O-CG1 3.44Å; L385-I389 PolarHBondContact O-N 3.21Å; H386-I389 PolarHBondContact O-N 2.89Å; E387-I389 PolarHBondContact O-N 2.92Å; I389-T391 PolarHBondContact O-N 3.14Å; I389-A393 CarbonylContact O-C 3.6Å; I389-A393 VanDerWaalsContact O-C 3.24Å; I389-A393 WeakPolarHBondContact O-CA 3.4Å; I389-A393 PolarHBondContact O-N 3.5Å; I389-L400 HydrophobicContact CB-CD2 4.36Å; I389-L400 HydrophobicContact CD1-CD2 3.41Å; I389-L400 VanDerWaalsContact CD1-CD2 3.41Å; I389-L400 HydrophobicContact CD1-CG 4.48Å; I389-L400 HydrophobicContact CG1-CD2 3.4Å; I389-L400 VanDerWaalsContact CG1-CD2 3.4Å; I389-L400 HydrophobicContact CG2-CD2 4.07Å
390A83.8Confident84.1Confident65 Ų6598.6 Ų98.654%0.53752%0.524SS..Hα-helixtrans-59.1-37.5179.400000112.1H386 E387H386-A390 WeakPolarHBondContact O-CB 3.37Å; H386-A390 PolarHBondContact O-N 3.34Å; E387-A390 PolarHBondContact O-N 3.29Å
391T85.7Confident83.5Confident105 Ų10596.2 Ų96.264%0.64452%0.521SS*.Hα-helixtrans-80.4-46.5-177.3-52.20000112.8E387 T388 I389E387-T391 WeakPolarHBondContact O-CB 3.42Å; E387-T391 PolarHBondContact O-N 3.05Å; E387-T391 PolarHBondContact O-OG1 2.97Å; T388-T391 PolarHBondContact O-N 3Å; I389-T391 PolarHBondContact O-N 3.14Å
392C83.7Confident83.1Confident108 Ų10891.8 Ų91.873%0.7352%0.515SS*.Hα-helixtrans-93.9-24.8-168.9-60.10000113.4T388T388-C392 VanDerWaalsContact O-CB 3.3Å; T388-C392 WeakPolarHBondContact O-CB 3.45Å; T388-C392 PolarHBondContact O-N 2.87Å; T388-C392 PolarHBondContact O-SG 2.98Å
393A79.8Confident82.9Confident29 Ų2992.9 Ų92.924%0.2452%0.517CS..  trans-14952.2-170.400000113.6I389 N395 F396I389-A393 CarbonylContact O-C 3.6Å; I389-A393 VanDerWaalsContact O-C 3.24Å; I389-A393 WeakPolarHBondContact O-CA 3.4Å; I389-A393 PolarHBondContact O-N 3.5Å; A393-N395 PolarHBondContact O-N 3.18Å; A393-N395 VanDerWaalsContact O-N 3.12Å; A393-F396 HydrophobicContact CB-CB 4.19Å; A393-F396 PolarHBondContact O-N 3.38Å
394P75.2Confident82.6Confident84 Ų8492.6 Ų92.655%0.54552%0.516SS..G310 helixtrans-60.1-30-173.623.4-34000113.7
395N80.4Confident82.5Confident154 Ų15494.5 Ų94.582%0.82452%0.519SS*.G310 helixtrans-89.82.2-178.6-61.1-19.1000113.9A393A393-N395 PolarHBondContact O-N 3.18Å; A393-N395 VanDerWaalsContact O-N 3.12Å
396F77.8Confident82.8Confident122 Ų12298 Ų9854%0.53553%0.527SS..G310 helixtrans-114.14.9-176.9-76.9-87.7000113.8A393 E398 K399 L400A393-F396 HydrophobicContact CB-CB 4.19Å; A393-F396 PolarHBondContact O-N 3.38Å; F396-E398 PolarHBondContact O-N 3.44Å; F396-K399 HydrophobicContact CD1-CD 4.01Å; F396-K399 HydrophobicContact CE1-CD 4.32Å; F396-K399 PolarHBondContact O-N 3.31Å; F396-L400 PolarHBondContact O-N 3.01Å
397A74Confident83Confident47 Ų4795.2 Ų95.239%0.38852%0.518SS..Hα-helixtrans-49.8-50.1-175.200000113.1K399 L400 T401A397-K399 PolarHBondContact O-N 3.43Å; A397-L400 PolarHBondContact O-N 3.35Å; A397-L400 VanDerWaalsContact O-N 3.1Å; A397-T401 PolarHBondContact O-N 3.18Å; A397-T401 PolarHBondContact O-OG1 3.42Å; A397-T401 VanDerWaalsContact O-OG1 3.06Å
398E76.6Confident83.3Confident176 Ų17690.6 Ų90.682%0.82250%0.504SS*.Hα-helixtrans-62.1-40.2179.6-67.9-177.2169.200113.5F396 L400 T401 S402F396-E398 PolarHBondContact O-N 3.44Å; E398-L400 VanDerWaalsContact C-N 3.29Å; E398-L400 PolarHBondContact O-N 2.95Å; E398-T401 PolarHBondContact O-N 2.76Å; E398-S402 PolarHBondContact O-N 3.46Å; E398-S402 PolarHBondContact O-OG 3.21Å
399K80.8Confident83.6Confident147 Ų14792.1 Ų92.164%0.63951%0.51SS*.Hα-helixtrans-68.4-32.2176.2-73-176.8-179.5175.40111.4F396 A397 S402 L403F396-K399 HydrophobicContact CD1-CD 4.01Å; F396-K399 HydrophobicContact CE1-CD 4.32Å; F396-K399 PolarHBondContact O-N 3.31Å; A397-K399 PolarHBondContact O-N 3.43Å; K399-S402 PolarHBondContact O-OG 2.89Å; K399-L403 WeakPolarHBondContact O-CB 3.17Å; K399-L403 PolarHBondContact O-N 2.93Å; K399-L403 VanDerWaalsContact O-N 3.12Å
400L80.9Confident84.1Confident63 Ų6393.8 Ų93.833%0.3352%0.519SS..Hα-helixtrans-74.4-38.2178.1-168.462000111.6I389 F396 A397 E398 L403 D404I389-L400 HydrophobicContact CB-CD2 4.36Å; I389-L400 HydrophobicContact CD1-CD2 3.41Å; I389-L400 VanDerWaalsContact CD1-CD2 3.41Å; I389-L400 HydrophobicContact CD1-CG 4.48Å; I389-L400 HydrophobicContact CG1-CD2 3.4Å; I389-L400 VanDerWaalsContact CG1-CD2 3.4Å; I389-L400 HydrophobicContact CG2-CD2 4.07Å; F396-L400 PolarHBondContact O-N 3.01Å; A397-L400 PolarHBondContact O-N 3.35Å; A397-L400 VanDerWaalsContact O-N 3.1Å; E398-L400 VanDerWaalsContact C-N 3.29Å; E398-L400 PolarHBondContact O-N 2.95Å; L400-L403 HydrophobicContact CD1-CD2 4.32Å; L400-L403 PolarHBondContact O-N 3.21Å; L400-D404 WeakPolarHBondContact O-CB 3.48Å; L400-D404 PolarHBondContact O-N 3.2Å
401T80.7Confident84.5Confident80 Ų8094.8 Ų94.849%0.49151%0.514SS..Hα-helixtrans-59-48172.9-50.40000111.4A397 E398 L403 D404 E405A397-T401 PolarHBondContact O-N 3.18Å; A397-T401 PolarHBondContact O-OG1 3.42Å; A397-T401 VanDerWaalsContact O-OG1 3.06Å; E398-T401 PolarHBondContact O-N 2.76Å; T401-L403 VanDerWaalsContact C-N 3.29Å; T401-L403 PolarHBondContact O-N 3Å; T401-D404 PolarHBondContact O-N 2.71Å; T401-E405 WeakPolarHBondContact O-CG 3.38Å; T401-E405 PolarHBondContact O-N 2.93Å
402S84.4Confident84.9Confident68 Ų6894.7 Ų94.748%0.47651%0.51SS..Hα-helixtrans-64.6-32.317760.70000113.2E398 K399 R406E398-S402 PolarHBondContact O-N 3.46Å; E398-S402 PolarHBondContact O-OG 3.21Å; K399-S402 PolarHBondContact O-OG 2.89Å; S402-R406 WeakPolarHBondContact O-CB 3.41Å; S402-R406 PolarHBondContact O-N 3.41Å; S402-R406 VanDerWaalsContact O-N 3.17Å
403L85.8Confident85.5Confident71 Ų7195.7 Ų95.737%0.37250%0.503SS..Hα-helixtrans-69.4-42.1172.7-177.462.2000111.5K399 L400 T401 R406 V407K399-L403 WeakPolarHBondContact O-CB 3.17Å; K399-L403 PolarHBondContact O-N 2.93Å; K399-L403 VanDerWaalsContact O-N 3.12Å; L400-L403 HydrophobicContact CD1-CD2 4.32Å; L400-L403 PolarHBondContact O-N 3.21Å; T401-L403 VanDerWaalsContact C-N 3.29Å; T401-L403 PolarHBondContact O-N 3Å; L403-R406 VanDerWaalsContact CD1-NH2 3.29Å; L403-R406 PolarHBondContact O-N 3Å; L403-V407 HydrophobicContact CD1-CG2 4.36Å; L403-V407 HydrophobicContact CG-CG2 4.46Å; L403-V407 VanDerWaalsContact O-CG2 3.31Å; L403-V407 WeakPolarHBondContact O-CG2 3.33Å; L403-V407 PolarHBondContact O-N 2.97Å
404D84.7Confident86.2Confident104 Ų104100.6 Ų100.656%0.55652%0.519SS*.Hα-helixtrans-63-45.9178.5-165.948.7000111.1L400 T401 R406 V407 G408L400-D404 WeakPolarHBondContact O-CB 3.48Å; L400-D404 PolarHBondContact O-N 3.2Å; T401-D404 PolarHBondContact O-N 2.71Å; D404-R406 VanDerWaalsContact C-N 3.33Å; D404-R406 PolarHBondContact O-N 3.18Å; D404-V407 PolarHBondContact O-N 2.99Å; D404-G408 PolarHBondContact O-N 3.25Å
405E88.5Confident87.1Confident124 Ų124100.2 Ų100.258%0.57951%0.513SS*.Hα-helixtrans-57.5-44.1172.2-73.8179.317700112T401 G408 N409T401-E405 WeakPolarHBondContact O-CG 3.38Å; T401-E405 PolarHBondContact O-N 2.93Å; E405-G408 PolarHBondContact O-N 3.4Å; E405-N409 VanDerWaalsContact O-CG 3.25Å; E405-N409 PolarHBondContact O-N 3.46Å; E405-N409 PolarHBondContact O-ND2 3.47Å
406R91.4Very high87.7Confident158 Ų15899.4 Ų99.460%0.59650%0.502SS*.Hα-helixtrans-65.3-41.2178-172.4176.568.2164.20.7111.8S402 L403 D404 I410S402-R406 WeakPolarHBondContact O-CB 3.41Å; S402-R406 PolarHBondContact O-N 3.41Å; S402-R406 VanDerWaalsContact O-N 3.17Å; L403-R406 VanDerWaalsContact CD1-NH2 3.29Å; L403-R406 PolarHBondContact O-N 3Å; D404-R406 VanDerWaalsContact C-N 3.33Å; D404-R406 PolarHBondContact O-N 3.18Å; R406-I410 HydrophobicContact CG-CD1 4.34Å; R406-I410 WeakPolarHBondContact O-CG1 3.49Å; R406-I410 PolarHBondContact O-N 2.72Å; R406-I410 VanDerWaalsContact O-N 3.15Å
407V91.4Very high88.4Confident64 Ų6498.1 Ų98.139%0.38850%0.499SS..Hα-helixtrans-66.6-42.4176.6170.60000110.4L403 D404 I410 I411L403-V407 HydrophobicContact CD1-CG2 4.36Å; L403-V407 HydrophobicContact CG-CG2 4.46Å; L403-V407 VanDerWaalsContact O-CG2 3.31Å; L403-V407 WeakPolarHBondContact O-CG2 3.33Å; L403-V407 PolarHBondContact O-N 2.97Å; D404-V407 PolarHBondContact O-N 2.99Å; V407-I410 PolarHBondContact O-N 3.15Å; V407-I411 HydrophobicContact CG1-CD1 3.79Å; V407-I411 HydrophobicContact CG1-CG1 4.39Å; V407-I411 VanDerWaalsContact O-CG1 3.31Å; V407-I411 WeakPolarHBondContact O-CG1 3.44Å; V407-I411 PolarHBondContact O-N 3.02Å
408G91.8Very high89.3Confident28 Ų2899.5 Ų99.529%0.28950%0.5SS..Hα-helixtrans-55.7-50.6173.600000112.1D404 E405 I410 I411 D412D404-G408 PolarHBondContact O-N 3.25Å; E405-G408 PolarHBondContact O-N 3.4Å; G408-I410 VanDerWaalsContact C-N 3.33Å; G408-I410 PolarHBondContact O-N 3.02Å; G408-I411 WeakPolarHBondContact O-CB 3.46Å; G408-I411 PolarHBondContact O-N 3.09Å; G408-I411 VanDerWaalsContact O-N 3.07Å; G408-D412 PolarHBondContact O-N 3.1Å
409N93.2Very high89.8Confident98 Ų9895.2 Ų95.252%0.52448%0.482SS..Hα-helixtrans-57.9-42.8176.7-71.1-28000112.5E405 I411 D412 E413E405-N409 VanDerWaalsContact O-CG 3.25Å; E405-N409 PolarHBondContact O-N 3.46Å; E405-N409 PolarHBondContact O-ND2 3.47Å; N409-I411 VanDerWaalsContact C-N 3.34Å; N409-I411 PolarHBondContact O-N 3.27Å; N409-D412 PolarHBondContact O-N 3.49Å; N409-E413 WeakPolarHBondContact O-CB 3.49Å; N409-E413 WeakPolarHBondContact O-CG 3.47Å; N409-E413 PolarHBondContact O-N 2.77Å
410I94.8Very high90.2Very high75 Ų7591.6 Ų91.639%0.38547%0.469SS..Hα-helixtrans-65.6-38.6176.9-67.7166.6000111.2R406 V407 G408 K414R406-I410 HydrophobicContact CG-CD1 4.34Å; R406-I410 WeakPolarHBondContact O-CG1 3.49Å; R406-I410 PolarHBondContact O-N 2.72Å; R406-I410 VanDerWaalsContact O-N 3.15Å; V407-I410 PolarHBondContact O-N 3.15Å; G408-I410 VanDerWaalsContact C-N 3.33Å; G408-I410 PolarHBondContact O-N 3.02Å; I410-K414 HydrophobicContact CG2-CD 4.3Å; I410-K414 WeakPolarHBondContact O-CB 3.08Å; I410-K414 VanDerWaalsContact O-CG 3.31Å; I410-K414 WeakPolarHBondContact O-CG 3.43Å; I410-K414 PolarHBondContact O-N 3.36Å
411I93.7Very high90.7Very high85 Ų8593.7 Ų93.744%0.43648%0.48SS..Hα-helixtrans-64.7-43.8176.6-71.6169.5000110V407 G408 N409 K414 N415V407-I411 HydrophobicContact CG1-CD1 3.79Å; V407-I411 HydrophobicContact CG1-CG1 4.39Å; V407-I411 VanDerWaalsContact O-CG1 3.31Å; V407-I411 WeakPolarHBondContact O-CG1 3.44Å; V407-I411 PolarHBondContact O-N 3.02Å; G408-I411 WeakPolarHBondContact O-CB 3.46Å; G408-I411 PolarHBondContact O-N 3.09Å; G408-I411 VanDerWaalsContact O-N 3.07Å; N409-I411 VanDerWaalsContact C-N 3.34Å; N409-I411 PolarHBondContact O-N 3.27Å; I411-K414 PolarHBondContact O-N 3.49Å; I411-N415 WeakPolarHBondContact CG2-ND2 3.48Å; I411-N415 WeakPolarHBondContact O-CB 3.37Å; I411-N415 VanDerWaalsContact O-CG 3.27Å; I411-N415 PolarHBondContact O-N 3.18Å; I411-N415 PolarHBondContact O-ND2 2.94Å
412D93.7Very high91Very high104 Ų10496.7 Ų96.756%0.55648%0.483SS*.Hα-helixtrans-65.1-43.6178.6-74.2-18.8000112.2G408 N409 K414 N415 K416G408-D412 PolarHBondContact O-N 3.1Å; N409-D412 PolarHBondContact O-N 3.49Å; D412-K414 VanDerWaalsContact C-N 3.33Å; D412-K414 PolarHBondContact O-N 2.92Å; D412-N415 PolarHBondContact O-N 2.87Å; D412-K416 WeakPolarHBondContact O-CB 3.5Å; D412-K416 PolarHBondContact O-N 2.92Å
413E94.8Very high91Very high128 Ų12896 Ų9660%0.59847%0.47SS*.Hα-helixtrans-57.9-45.8172.7-76.4177.5-177.200111.4N409 K416 I417N409-E413 WeakPolarHBondContact O-CB 3.49Å; N409-E413 WeakPolarHBondContact O-CG 3.47Å; N409-E413 PolarHBondContact O-N 2.77Å; E413-K416 PolarHBondContact O-N 2.86Å; E413-I417 VanDerWaalsContact O-CG1 3.31Å; E413-I417 WeakPolarHBondContact O-CG1 3.33Å; E413-I417 PolarHBondContact O-N 2.88Å
414K95.4Very high91Very high132 Ų13297.1 Ų97.157%0.57447%0.473SS*.Hα-helixtrans-64.6-42.2176.6-76.2-178.9178-1760112.4I410 I411 D412 K416 I417 I418I410-K414 HydrophobicContact CG2-CD 4.3Å; I410-K414 WeakPolarHBondContact O-CB 3.08Å; I410-K414 VanDerWaalsContact O-CG 3.31Å; I410-K414 WeakPolarHBondContact O-CG 3.43Å; I410-K414 PolarHBondContact O-N 3.36Å; I411-K414 PolarHBondContact O-N 3.49Å; D412-K414 VanDerWaalsContact C-N 3.33Å; D412-K414 PolarHBondContact O-N 2.92Å; K414-K416 VanDerWaalsContact C-N 3.3Å; K414-K416 PolarHBondContact O-N 2.92Å; K414-I417 PolarHBondContact O-N 3.17Å; K414-I418 VanDerWaalsContact O-CG1 3.28Å; K414-I418 WeakPolarHBondContact O-CG1 3.42Å; K414-I418 PolarHBondContact O-N 3.3Å
415N93.1Very high91.1Very high77 Ų7795.7 Ų95.741%0.41247%0.468SS..Hα-helixtrans-62.2-40.7177.3-77.7-26.3000111.2I411 D412 I418 L419I411-N415 WeakPolarHBondContact CG2-ND2 3.48Å; I411-N415 WeakPolarHBondContact O-CB 3.37Å; I411-N415 VanDerWaalsContact O-CG 3.27Å; I411-N415 PolarHBondContact O-N 3.18Å; I411-N415 PolarHBondContact O-ND2 2.94Å; D412-N415 PolarHBondContact O-N 2.87Å; N415-I418 WeakPolarHBondContact O-CB 3.47Å; N415-I418 PolarHBondContact O-N 2.95Å; N415-L419 WeakPolarHBondContact O-CG 3.15Å; N415-L419 PolarHBondContact O-N 3.4Å
416K93.4Very high90.8Very high136 Ų13690.7 Ų90.759%0.59145%0.446SS*.Hα-helixtrans-61.5-47.9173.7-172.4178.5178.1-178.10111.6D412 E413 K414 I418 L419 D420D412-K416 WeakPolarHBondContact O-CB 3.5Å; D412-K416 PolarHBondContact O-N 2.92Å; E413-K416 PolarHBondContact O-N 2.86Å; K414-K416 VanDerWaalsContact C-N 3.3Å; K414-K416 PolarHBondContact O-N 2.92Å; K416-I418 VanDerWaalsContact C-N 3.26Å; K416-I418 PolarHBondContact O-N 3.36Å; K416-L419 WeakPolarHBondContact O-CB 3.43Å; K416-L419 PolarHBondContact O-N 3.24Å; K416-L419 VanDerWaalsContact O-N 3.09Å; K416-D420 VanDerWaalsContact O-CG 3.29Å; K416-D420 PolarHBondContact O-N 2.92Å
417I94.1Very high90.4Very high95 Ų9587.7 Ų87.749%0.48744%0.438SS..Hα-helixtrans-58.1-40.3175.2-67.4164.5000111E413 K414 D420 L421E413-I417 VanDerWaalsContact O-CG1 3.31Å; E413-I417 WeakPolarHBondContact O-CG1 3.33Å; E413-I417 PolarHBondContact O-N 2.88Å; K414-I417 PolarHBondContact O-N 3.17Å; I417-D420 PolarHBondContact O-N 3.44Å; I417-L421 HydrophobicContact CG2-CD1 3.79Å; I417-L421 HydrophobicContact CG2-CG 4.22Å; I417-L421 WeakPolarHBondContact O-CB 3.34Å; I417-L421 VanDerWaalsContact O-CG 3.24Å; I417-L421 WeakPolarHBondContact O-CG 3.39Å; I417-L421 PolarHBondContact O-N 3.29Å
418I90.9Very high90.2Very high76 Ų7687.6 Ų87.639%0.3944%0.443SS..Hα-helixtrans-63.1-43176.7-70.7165.3000111.1K414 N415 K416 R422K414-I418 VanDerWaalsContact O-CG1 3.28Å; K414-I418 WeakPolarHBondContact O-CG1 3.42Å; K414-I418 PolarHBondContact O-N 3.3Å; N415-I418 WeakPolarHBondContact O-CB 3.47Å; N415-I418 PolarHBondContact O-N 2.95Å; K416-I418 VanDerWaalsContact C-N 3.26Å; K416-I418 PolarHBondContact O-N 3.36Å; I418-R422 HydrophobicContact CG2-CG 4.5Å; I418-R422 WeakPolarHBondContact O-CB 3.43Å; I418-R422 VanDerWaalsContact O-CG 3.23Å; I418-R422 WeakPolarHBondContact O-CG 3.39Å; I418-R422 PolarHBondContact O-N 3.45Å
419L89.2Confident89.8Confident87 Ų8790 Ų9046%0.45544%0.444SS..Hα-helixtrans-63.1-48176.4-72.2170.3000111.2N415 K416 L421 R422 Y423N415-L419 WeakPolarHBondContact O-CG 3.15Å; N415-L419 PolarHBondContact O-N 3.4Å; K416-L419 WeakPolarHBondContact O-CB 3.43Å; K416-L419 PolarHBondContact O-N 3.24Å; K416-L419 VanDerWaalsContact O-N 3.09Å; L419-L421 PolarHBondContact O-N 3.33Å; L419-R422 PolarHBondContact O-N 3.44Å; L419-Y423 WeakPolarHBondContact O-CB 3.24Å; L419-Y423 PolarHBondContact O-N 3.37Å
420D88.7Confident89.2Confident70 Ų7086.4 Ų86.437%0.37442%0.424SS..Hα-helixtrans-59.9-45.5179-66.4-15.6000111K416 I417 R422 Y423 E424K416-D420 VanDerWaalsContact O-CG 3.29Å; K416-D420 PolarHBondContact O-N 2.92Å; I417-D420 PolarHBondContact O-N 3.44Å; D420-R422 PolarHBondContact O-N 2.92Å; D420-Y423 PolarHBondContact O-N 3.23Å; D420-E424 PolarHBondContact O-N 2.94Å
421L91.4Very high88.7Confident107 Ų10785.7 Ų85.756%0.5643%0.428SS*.Hα-helixtrans-64.8-39.5176.8-73.5174.1000112.3I417 L419 Y423 E424 V425I417-L421 HydrophobicContact CG2-CD1 3.79Å; I417-L421 HydrophobicContact CG2-CG 4.22Å; I417-L421 WeakPolarHBondContact O-CB 3.34Å; I417-L421 VanDerWaalsContact O-CG 3.24Å; I417-L421 WeakPolarHBondContact O-CG 3.39Å; I417-L421 PolarHBondContact O-N 3.29Å; L419-L421 PolarHBondContact O-N 3.33Å; L421-Y423 VanDerWaalsContact C-N 3.34Å; L421-E424 PolarHBondContact O-N 3.38Å; L421-V425 WeakPolarHBondContact O-CB 3.22Å; L421-V425 VanDerWaalsContact O-CG2 3.24Å; L421-V425 WeakPolarHBondContact O-CG2 3.26Å; L421-V425 PolarHBondContact O-N 3.46Å
422R86Confident88.4Confident144 Ų14485.8 Ų85.854%0.54343%0.427SS..Hα-helixtrans-65-40.2175.6-77.7175.4179-165.52.2111.6I418 L419 D420 T426I418-R422 HydrophobicContact CG2-CG 4.5Å; I418-R422 WeakPolarHBondContact O-CB 3.43Å; I418-R422 VanDerWaalsContact O-CG 3.23Å; I418-R422 WeakPolarHBondContact O-CG 3.39Å; I418-R422 PolarHBondContact O-N 3.45Å; L419-R422 PolarHBondContact O-N 3.44Å; D420-R422 PolarHBondContact O-N 2.92Å; R422-T426 WeakPolarHBondContact O-CB 3.36Å; R422-T426 PolarHBondContact O-N 2.89Å; R422-T426 PolarHBondContact O-OG1 2.97Å
423Y84.8Confident87.9Confident53 Ų5382.5 Ų82.521%0.20841%0.409CS..Hα-helixtrans-62.8-49.4174.8176.1-100.8000111L419 D420 L421 V425 T426 K427 I475 E477L419-Y423 WeakPolarHBondContact O-CB 3.24Å; L419-Y423 PolarHBondContact O-N 3.37Å; D420-Y423 PolarHBondContact O-N 3.23Å; L421-Y423 VanDerWaalsContact C-N 3.34Å; Y423-V425 PolarHBondContact O-N 3.34Å; Y423-T426 WeakPolarHBondContact O-CB 3.42Å; Y423-T426 PolarHBondContact O-N 2.86Å; Y423-T426 VanDerWaalsContact O-N 3.09Å; Y423-K427 HydrophobicContact CE1-CD 4.17Å; Y423-K427 WeakPolarHBondContact O-CB 3.45Å; Y423-K427 PolarHBondContact O-N 3.37Å; Y423-I475 HydrophobicContact CD2-CG2 4.08Å; Y423-I475 HydrophobicContact CE2-CB 4.36Å; Y423-I475 HydrophobicContact CE2-CG2 3.74Å; Y423-I475 PolarHBondContact OH-O 2.92Å; Y423-E477 HydrophobicContact CD2-CG 3.86Å; Y423-E477 HydrophobicContact CE2-CG 4.07Å; Y423-E477 HydrophobicContact CG-CG 4.45Å
424E86.6Confident87.4Confident94 Ų9479.8 Ų79.844%0.43940%0.399SS..Hα-helixtrans-63.1-38178.2-75.5-6114400112.6D420 L421 T426 K427 A428D420-E424 PolarHBondContact O-N 2.94Å; L421-E424 PolarHBondContact O-N 3.38Å; E424-T426 VanDerWaalsContact C-N 3.35Å; E424-T426 PolarHBondContact O-N 3.37Å; E424-K427 PolarHBondContact O-N 2.9Å; E424-K427 IonicContact OE1-NZ 3.66Å; E424-K427 PolarHBondContact OE1-NZ 3.29Å; E424-K427 IonicContact OE2-NZ 2.65Å; E424-A428 WeakPolarHBondContact O-CB 3.43Å; E424-A428 PolarHBondContact O-N 2.9Å
425V85.6Confident87Confident74 Ų7477.5 Ų77.545%0.44839%0.393SS..Hα-helixtrans-62.3-43172.3168.10000111.2L421 Y423 K427 A428 R429L421-V425 WeakPolarHBondContact O-CB 3.22Å; L421-V425 VanDerWaalsContact O-CG2 3.24Å; L421-V425 WeakPolarHBondContact O-CG2 3.26Å; L421-V425 PolarHBondContact O-N 3.46Å; Y423-V425 PolarHBondContact O-N 3.34Å; V425-K427 VanDerWaalsContact C-N 3.33Å; V425-A428 PolarHBondContact O-N 2.9Å; V425-R429 WeakPolarHBondContact O-CB 3.45Å; V425-R429 WeakPolarHBondContact O-CG 3.38Å; V425-R429 PolarHBondContact O-N 2.91Å
426T83.2Confident86.6Confident19 Ų1975.2 Ų75.212%0.11738%0.38CS..Hα-helixtrans-64.8-41.8178.4-54.40000110.6R422 Y423 E424 R429 K430 Y467 I475R422-T426 WeakPolarHBondContact O-CB 3.36Å; R422-T426 PolarHBondContact O-N 2.89Å; R422-T426 PolarHBondContact O-OG1 2.97Å; Y423-T426 WeakPolarHBondContact O-CB 3.42Å; Y423-T426 PolarHBondContact O-N 2.86Å; Y423-T426 VanDerWaalsContact O-N 3.09Å; E424-T426 VanDerWaalsContact C-N 3.35Å; E424-T426 PolarHBondContact O-N 3.37Å; T426-R429 PolarHBondContact O-N 2.94Å; T426-K430 PolarHBondContact O-N 3.34Å; T426-Y467 HydrophobicContact CG2-CD2 4.49Å; T426-I475 VanDerWaalsContact C-CD1 3.49Å; T426-I475 HydrophobicContact CG2-CD1 3.88Å; T426-I475 HydrophobicContact CG2-CG1 4.42Å; T426-I475 HydrophobicContact CG2-CG2 4.09Å; T426-I475 VanDerWaalsContact O-CD1 3.25Å; T426-I475 WeakPolarHBondContact O-CD1 3.45Å
427K83.4Confident86.2Confident96 Ų9673.9 Ų73.942%0.41738%0.376SS..Hα-helixtrans-61.3-47.1175.4-172.4-179.6168.7-163.50112.7Y423 E424 V425 K430 A431 I475Y423-K427 HydrophobicContact CE1-CD 4.17Å; Y423-K427 WeakPolarHBondContact O-CB 3.45Å; Y423-K427 PolarHBondContact O-N 3.37Å; E424-K427 PolarHBondContact O-N 2.9Å; E424-K427 IonicContact OE1-NZ 3.66Å; E424-K427 PolarHBondContact OE1-NZ 3.29Å; E424-K427 IonicContact OE2-NZ 2.65Å; V425-K427 VanDerWaalsContact C-N 3.33Å; K427-K430 PolarHBondContact O-N 3.45Å; K427-A431 PolarHBondContact O-N 3.32Å; K427-I475 VanDerWaalsContact CA-CD1 3.4Å; K427-I475 HydrophobicContact CB-CD1 4.27Å
428A85.8Confident85.9Confident61 Ų6173.3 Ų73.350%0.50438%0.377SS..Hα-helixtrans-63.1-42.2176.100000112E424 V425 K430 A431 H432E424-A428 WeakPolarHBondContact O-CB 3.43Å; E424-A428 PolarHBondContact O-N 2.9Å; V425-A428 PolarHBondContact O-N 2.9Å; A428-K430 VanDerWaalsContact C-N 3.32Å; A428-K430 PolarHBondContact O-N 2.88Å; A428-A431 PolarHBondContact O-N 3.03Å; A428-H432 WeakPolarHBondContact O-CB 3.31Å; A428-H432 PolarHBondContact O-N 3.34Å
429R84.2Confident85.7Confident79 Ų7976.5 Ų76.530%0.29839%0.385SS..Hα-helixtrans-60.7-41.3175.9-78.5179.4-176.9-179.42.7112.3V425 T426 H432 D433V425-R429 WeakPolarHBondContact O-CB 3.45Å; V425-R429 WeakPolarHBondContact O-CG 3.38Å; V425-R429 PolarHBondContact O-N 2.91Å; T426-R429 PolarHBondContact O-N 2.94Å; R429-H432 WeakPolarHBondContact O-CB 3.4Å; R429-H432 PolarHBondContact O-N 3.08Å; R429-D433 PolarHBondContact O-N 3.38Å
430K81.1Confident85.5Confident23 Ų2374.6 Ų74.610%0.137%0.374CS..Hα-helixtrans-68.3-46.4176.8-178173.9-159.3165.40112.9T426 K427 A428 H432 D433 D434 C469 G473 I474 I475T426-K430 PolarHBondContact O-N 3.34Å; K427-K430 PolarHBondContact O-N 3.45Å; A428-K430 VanDerWaalsContact C-N 3.32Å; A428-K430 PolarHBondContact O-N 2.88Å; K430-H432 PolarHBondContact O-N 2.89Å; K430-D433 PolarHBondContact O-N 2.93Å; K430-D434 WeakPolarHBondContact O-CB 3.43Å; K430-D434 VanDerWaalsContact O-CG 3.31Å; K430-D434 PolarHBondContact O-N 3.3Å; K430-C469 PolarHBondContact NZ-SG 3.4Å; K430-G473 WeakPolarHBondContact CD-O 3.4Å; K430-G473 WeakPolarHBondContact CE-O 3.3Å; K430-G473 PolarHBondContact NZ-O 3.01Å; K430-I474 PolarHBondContact NZ-O 3.29Å; K430-I475 HydrophobicContact CB-CD1 3.46Å; K430-I475 VanDerWaalsContact CB-CD1 3.46Å; K430-I475 HydrophobicContact CB-CG1 4.37Å; K430-I475 HydrophobicContact CD-CD1 3.39Å; K430-I475 HydrophobicContact CD-CG1 3.42Å; K430-I475 VanDerWaalsContact CD-CG1 3.42Å; K430-I475 HydrophobicContact CG-CD1 4.12Å
431A84.3Confident85.3Confident59 Ų5974.9 Ų74.949%0.48838%0.38SS..Hα-helixtrans-56.6-37.5175.500000111.3K427 A428 L435K427-A431 PolarHBondContact O-N 3.32Å; A428-A431 PolarHBondContact O-N 3.03Å; A431-L435 WeakPolarHBondContact O-CB 3.48Å; A431-L435 PolarHBondContact O-N 3.22Å
432H86.2Confident85.2Confident88 Ų8874.4 Ų74.441%0.40737%0.374SS..Hα-helixtrans-63.2-48.5171.8169.6-86.1000112.7A428 R429 K430 L435 L436A428-H432 WeakPolarHBondContact O-CB 3.31Å; A428-H432 PolarHBondContact O-N 3.34Å; R429-H432 WeakPolarHBondContact O-CB 3.4Å; R429-H432 PolarHBondContact O-N 3.08Å; K430-H432 PolarHBondContact O-N 2.89Å; H432-L435 PolarHBondContact O-N 3.07Å; H432-L436 WeakPolarHBondContact CE1-CD1 3.15Å; H432-L436 WeakPolarHBondContact O-CG 3.03Å; H432-L436 PolarHBondContact O-N 3.1Å
433D83.9Confident85.2Confident34 Ų3469.9 Ų69.918%0.18236%0.36CS..Hα-helixtrans-64.3-42.4179.3-77.61.5000112.4R429 K430 L435 L436 E437R429-D433 PolarHBondContact O-N 3.38Å; K430-D433 PolarHBondContact O-N 2.93Å; D433-L435 VanDerWaalsContact C-N 3.32Å; D433-L435 PolarHBondContact O-N 2.84Å; D433-L436 WeakPolarHBondContact O-CB 3.47Å; D433-L436 PolarHBondContact O-N 2.91Å; D433-E437 PolarHBondContact O-N 2.93Å
434D84.1Confident85.2Confident72 Ų7273.7 Ų73.739%0.38538%0.378SS..Hα-helixtrans-63.9-38.8176.6-66.8-14.8000111K430 E437 T438K430-D434 WeakPolarHBondContact O-CB 3.43Å; K430-D434 VanDerWaalsContact O-CG 3.31Å; K430-D434 PolarHBondContact O-N 3.3Å; D434-E437 PolarHBondContact O-N 3.5Å; D434-T438 WeakPolarHBondContact O-CB 3.45Å; D434-T438 PolarHBondContact O-N 3.48Å; D434-T438 PolarHBondContact O-OG1 2.83Å
435L86.2Confident85.3Confident84 Ų8475.5 Ų75.544%0.4439%0.386SS..Hα-helixtrans-68.6-39.8176.3176.2136000111.8A431 H432 D433 T438 Y439A431-L435 WeakPolarHBondContact O-CB 3.48Å; A431-L435 PolarHBondContact O-N 3.22Å; H432-L435 PolarHBondContact O-N 3.07Å; D433-L435 VanDerWaalsContact C-N 3.32Å; D433-L435 PolarHBondContact O-N 2.84Å; L435-T438 PolarHBondContact O-N 3.27Å; L435-Y439 HydrophobicContact CD1-CE2 4.2Å; L435-Y439 HydrophobicContact CD2-CD2 3.69Å; L435-Y439 HydrophobicContact CD2-CE2 3.41Å; L435-Y439 VanDerWaalsContact CD2-CE2 3.41Å; L435-Y439 HydrophobicContact CG-CD2 3.94Å; L435-Y439 HydrophobicContact CG-CE2 3.63Å; L435-Y439 VanDerWaalsContact O-CD2 3.28Å; L435-Y439 WeakPolarHBondContact O-CD2 3.34Å; L435-Y439 PolarHBondContact O-N 3.13Å
436L85.4Confident85.5Confident28 Ų2880.6 Ų80.615%0.14740%0.399CS..Hα-helixtrans-60.8-46.6171.6-76.4177.3000111.6H432 D433 T438 Y439 E440 P457 R459H432-L436 WeakPolarHBondContact CE1-CD1 3.15Å; H432-L436 WeakPolarHBondContact O-CG 3.03Å; H432-L436 PolarHBondContact O-N 3.1Å; D433-L436 WeakPolarHBondContact O-CB 3.47Å; D433-L436 PolarHBondContact O-N 2.91Å; L436-T438 VanDerWaalsContact C-N 3.31Å; L436-T438 PolarHBondContact O-N 3.42Å; L436-Y439 PolarHBondContact O-N 3.25Å; L436-E440 WeakPolarHBondContact O-CB 3.48Å; L436-E440 WeakPolarHBondContact O-CG 3.42Å; L436-E440 PolarHBondContact O-N 2.92Å; L436-P457 HydrophobicContact CD1-CB 3.74Å; L436-P457 HydrophobicContact CD1-CG 4.29Å; L436-P457 HydrophobicContact CD2-CB 3.7Å; L436-P457 HydrophobicContact CD2-CG 4.14Å; L436-P457 HydrophobicContact CG-CB 4.39Å; L436-R459 HydrophobicContact CD1-CG 4.36Å
437E85.3Confident85.6Confident108 Ų10882.6 Ų82.651%0.50542%0.423SS..Hα-helixtrans-62.9-39.5177.9-173.9164-161.100111.6D433 D434 E440 C441D433-E437 PolarHBondContact O-N 2.93Å; D434-E437 PolarHBondContact O-N 3.5Å; E437-E440 PolarHBondContact O-N 2.92Å; E437-C441 WeakPolarHBondContact O-CB 3.32Å; E437-C441 PolarHBondContact O-N 3.29Å; E437-C441 PolarHBondContact O-SG 3.43Å
438T87Confident85.5Confident83 Ų8380.6 Ų80.651%0.50942%0.419SS..Hα-helixtrans-62.9-44.1174.5-56.60000111.6D434 L435 L436 C441 K442D434-T438 WeakPolarHBondContact O-CB 3.45Å; D434-T438 PolarHBondContact O-N 3.48Å; D434-T438 PolarHBondContact O-OG1 2.83Å; L435-T438 PolarHBondContact O-N 3.27Å; L436-T438 VanDerWaalsContact C-N 3.31Å; L436-T438 PolarHBondContact O-N 3.42Å; T438-C441 PolarHBondContact O-N 3.02Å; T438-K442 WeakPolarHBondContact O-CG 3.26Å; T438-K442 PolarHBondContact O-N 2.93Å
439Y86.1Confident85.2Confident144 Ų14480.5 Ų80.557%0.56541%0.413SS*.Hα-helixtrans-66.6-42176.6-78.6-48000112.5L435 L436 C441 K442 L443L435-Y439 HydrophobicContact CD1-CE2 4.2Å; L435-Y439 HydrophobicContact CD2-CD2 3.69Å; L435-Y439 HydrophobicContact CD2-CE2 3.41Å; L435-Y439 VanDerWaalsContact CD2-CE2 3.41Å; L435-Y439 HydrophobicContact CG-CD2 3.94Å; L435-Y439 HydrophobicContact CG-CE2 3.63Å; L435-Y439 VanDerWaalsContact O-CD2 3.28Å; L435-Y439 WeakPolarHBondContact O-CD2 3.34Å; L435-Y439 PolarHBondContact O-N 3.13Å; L436-Y439 PolarHBondContact O-N 3.25Å; Y439-C441 VanDerWaalsContact C-N 3.3Å; Y439-C441 PolarHBondContact O-N 2.97Å; Y439-K442 PolarHBondContact O-N 3Å; Y439-K442 VanDerWaalsContact O-N 3.16Å; Y439-L443 WeakPolarHBondContact O-CB 3.49Å; Y439-L443 WeakPolarHBondContact O-CG 3.27Å; Y439-L443 PolarHBondContact O-N 3.49Å
440E85.2Confident84.5Confident47 Ų4779.1 Ų79.122%0.2241%0.414CS..Hα-helixtrans-59.2-42.9174.3-76.4172.8-171.600111.3L436 E437 K444 T450 R459L436-E440 WeakPolarHBondContact O-CB 3.48Å; L436-E440 WeakPolarHBondContact O-CG 3.42Å; L436-E440 PolarHBondContact O-N 2.92Å; E437-E440 PolarHBondContact O-N 2.92Å; E440-K444 WeakPolarHBondContact O-CB 3.36Å; E440-K444 WeakPolarHBondContact O-CG 3.35Å; E440-K444 PolarHBondContact O-N 3.46Å; E440-T450 HydrophobicContact CB-CG2 4.5Å; E440-T450 HydrophobicContact CG-CG2 4.25Å; E440-R459 IonicContact OE1-CZ 3.25Å; E440-R459 IonicContact OE1-NH2 3.47Å; E440-R459 PolarHBondContact OE1-NH2 3.26Å; E440-R459 IonicContact OE2-NH2 3.95Å; E440-R459 PolarHBondContact OE2-NH2 3.26Å
441C86Confident84.2Confident75 Ų7585.1 Ų85.151%0.50745%0.447SS..Hα-helixtrans-63.4-41.1174.8-69.90000112E437 T438 Y439 Q445E437-C441 WeakPolarHBondContact O-CB 3.32Å; E437-C441 PolarHBondContact O-N 3.29Å; E437-C441 PolarHBondContact O-SG 3.43Å; T438-C441 PolarHBondContact O-N 3.02Å; Y439-C441 VanDerWaalsContact C-N 3.3Å; Y439-C441 PolarHBondContact O-N 2.97Å; C441-Q445 WeakPolarHBondContact O-CB 3.42Å; C441-Q445 PolarHBondContact O-N 3.36Å
442K88.1Confident83.5Confident97 Ų9789.1 Ų89.142%0.42246%0.455SS..Hα-helixtrans-68.3-41.4177.5-76.4-69.2175.1-167.80112.9T438 Y439 Q445 Y446T438-K442 WeakPolarHBondContact O-CG 3.26Å; T438-K442 PolarHBondContact O-N 2.93Å; Y439-K442 PolarHBondContact O-N 3Å; Y439-K442 VanDerWaalsContact O-N 3.16Å; K442-Q445 WeakPolarHBondContact O-CB 3.29Å; K442-Q445 PolarHBondContact O-N 3.02Å; K442-Q445 VanDerWaalsContact O-N 3.15Å; K442-Y446 HydrophobicContact CD-CE2 4.49Å; K442-Y446 WeakPolarHBondContact O-CD2 3.48Å; K442-Y446 PolarHBondContact O-N 2.94Å
443L85.8Confident82.9Confident49 Ų4987.9 Ų87.926%0.25745%0.451SS..Hα-helixtrans-61.2-45.8175.5-72.9170.5000111Y439 Q445 Y446 G447 V448 L453Y439-L443 WeakPolarHBondContact O-CB 3.49Å; Y439-L443 WeakPolarHBondContact O-CG 3.27Å; Y439-L443 PolarHBondContact O-N 3.49Å; L443-Q445 VanDerWaalsContact C-N 3.3Å; L443-Q445 PolarHBondContact O-N 3.44Å; L443-Y446 CarbonylContact O-C 3.24Å; L443-Y446 PolarHBondContact O-N 3Å; L443-Y446 VanDerWaalsContact O-N 3.15Å; L443-G447 PolarHBondContact O-N 3.4Å; L443-G447 VanDerWaalsContact O-N 3.1Å; L443-V448 CarbonylContact C-O 3.6Å; L443-V448 HydrophobicContact CB-CB 4.29Å; L443-V448 HydrophobicContact CD2-CB 4.05Å; L443-V448 HydrophobicContact CD2-CG1 4.15Å; L443-V448 HydrophobicContact CD2-CG2 4.43Å; L443-V448 PolarHBondContact O-N 3.4Å; L443-L453 HydrophobicContact CD1-CD1 3.79Å; L443-L453 HydrophobicContact CD1-CD2 3.96Å; L443-L453 HydrophobicContact CD1-CG 4.25Å
444K85.7Confident82.5Confident134 Ų13490.1 Ų90.158%0.58348%0.482SS*.Hα-helixtrans-58.8-41.1172.4-73.2176.4-177.5175.70112.1E440 Y446 G447E440-K444 WeakPolarHBondContact O-CB 3.36Å; E440-K444 WeakPolarHBondContact O-CG 3.35Å; E440-K444 PolarHBondContact O-N 3.46Å; K444-Y446 VanDerWaalsContact C-N 3.3Å; K444-Y446 PolarHBondContact O-N 3.26Å; K444-G447 PolarHBondContact O-N 3.03Å; K444-G447 VanDerWaalsContact O-N 3.12Å
445Q89.6Confident82.3Confident131 Ų13193.3 Ų93.361%0.61249%0.493SS*.Hα-helixtrans-61.5-36.4177-173.4178.713.700112.6C441 K442 L443 G447C441-Q445 WeakPolarHBondContact O-CB 3.42Å; C441-Q445 PolarHBondContact O-N 3.36Å; K442-Q445 WeakPolarHBondContact O-CB 3.29Å; K442-Q445 PolarHBondContact O-N 3.02Å; K442-Q445 VanDerWaalsContact O-N 3.15Å; L443-Q445 VanDerWaalsContact C-N 3.3Å; L443-Q445 PolarHBondContact O-N 3.44Å; Q445-G447 VanDerWaalsContact C-N 3.31Å
446Y88.7Confident81.9Confident182 Ų18298.7 Ų98.771%0.71451%0.513SS*.THydrogen-bonded Turntrans-89.27.8176.5-71.4-70.7000113.9K442 L443 K444 V448K442-Y446 HydrophobicContact CD-CE2 4.49Å; K442-Y446 WeakPolarHBondContact O-CD2 3.48Å; K442-Y446 PolarHBondContact O-N 2.94Å; L443-Y446 CarbonylContact O-C 3.24Å; L443-Y446 PolarHBondContact O-N 3Å; L443-Y446 VanDerWaalsContact O-N 3.15Å; K444-Y446 VanDerWaalsContact C-N 3.3Å; K444-Y446 PolarHBondContact O-N 3.26Å; Y446-V448 VanDerWaalsContact C-N 3.34Å; Y446-V448 PolarHBondContact O-N 3Å
447G84.3Confident81.5Confident61 Ų6199.3 Ų99.363%0.62952%0.519SS*.THydrogen-bonded Turntrans76.216.217600000114.9L443 K444 Q445 P449L443-G447 PolarHBondContact O-N 3.4Å; L443-G447 VanDerWaalsContact O-N 3.1Å; K444-G447 PolarHBondContact O-N 3.03Å; K444-G447 VanDerWaalsContact O-N 3.12Å; Q445-G447 VanDerWaalsContact C-N 3.31Å; G447-P449 WeakPolarHBondContact O-CD 3.39Å
448V83Confident81.3Confident53 Ų53100.7 Ų100.732%0.32153%0.528SS..  trans-89.6112.3174.6-176.60000108.7L443 Y446L443-V448 CarbonylContact C-O 3.6Å; L443-V448 HydrophobicContact CB-CB 4.29Å; L443-V448 HydrophobicContact CD2-CB 4.05Å; L443-V448 HydrophobicContact CD2-CG1 4.15Å; L443-V448 HydrophobicContact CD2-CG2 4.43Å; L443-V448 PolarHBondContact O-N 3.4Å; Y446-V448 VanDerWaalsContact C-N 3.34Å; Y446-V448 PolarHBondContact O-N 3Å
449P78.7Confident80.6Confident59 Ų59100.6 Ų100.638%0.38352%0.518SS..  trans-63.9139.7176.6-17.531.2000110.8G447 D451 E452G447-P449 WeakPolarHBondContact O-CD 3.39Å; P449-D451 PolarHBondContact O-N 2.96Å; P449-E452 HydrophobicContact CB-CG 4.41Å; P449-E452 HydrophobicContact CG-CG 4.35Å; P449-E452 PolarHBondContact O-N 3.32Å
450T70Confident79.5Confident51 Ų5198.3 Ų98.331%0.31352%0.516SS..G310 helixtrans-60.4-18.1178.846.10000113.5E440 E452E440-T450 HydrophobicContact CB-CG2 4.5Å; E440-T450 HydrophobicContact CG-CG2 4.25Å; T450-E452 VanDerWaalsContact C-N 3.34Å
451D73.5Confident78.3Confident148 Ų148104 Ų10479%0.79154%0.536SS*.G310 helixtrans-77.2-18.8179.3-57.4-28.9000112.9P449 L453P449-D451 PolarHBondContact O-N 2.96Å; D451-L453 VanDerWaalsContact C-N 3.31Å; D451-L453 PolarHBondContact O-N 2.88Å
452E71.6Confident76.8Confident143 Ų143108 Ų10867%0.66855%0.552SS**G310 helixtrans-81-8.5179.3-66.7-172.9174.600113.6P449 T450 G454P449-E452 HydrophobicContact CB-CG 4.41Å; P449-E452 HydrophobicContact CG-CG 4.35Å; P449-E452 PolarHBondContact O-N 3.32Å; T450-E452 VanDerWaalsContact C-N 3.34Å; E452-G454 PolarHBondContact O-N 2.92Å
453L71.9Confident75.2Confident62 Ų62109 Ų10933%0.32556%0.558SS.*G310 helixtrans-68.1-19.5-179.2-75.7162.1000113.3L443 D451 F455L443-L453 HydrophobicContact CD1-CD1 3.79Å; L443-L453 HydrophobicContact CD1-CD2 3.96Å; L443-L453 HydrophobicContact CD1-CG 4.25Å; D451-L453 VanDerWaalsContact C-N 3.31Å; D451-L453 PolarHBondContact O-N 2.88Å; L453-F455 HydrophobicContact CB-CE1 4.39Å; L453-F455 HydrophobicContact CD2-CE1 4.5Å; L453-F455 WeakPolarHBondContact O-CD1 3.28Å; L453-F455 WeakPolarHBondContact O-CE1 3.41Å; L453-F455 PolarHBondContact O-N 2.64Å
454G76Confident73.6Confident81 Ų81115.8 Ų115.884%0.83559%0.588SS**SBendtrans70.2-3.8177.600000115.5E452E452-G454 PolarHBondContact O-N 2.92Å
455F79.9Confident72.2Confident139 Ų139113.5 Ų113.561%0.6158%0.58SS**SBendtrans-141.5153.1173.566.6-87.7000111.2L453L453-F455 HydrophobicContact CB-CE1 4.39Å; L453-F455 HydrophobicContact CD2-CE1 4.5Å; L453-F455 WeakPolarHBondContact O-CD1 3.28Å; L453-F455 WeakPolarHBondContact O-CE1 3.41Å; L453-F455 PolarHBondContact O-N 2.64Å
456K78.6Confident70.4Confident198 Ų198113.6 Ų113.686%0.86158%0.584SS**PPolyproline II helixtrans-101118.7172.5-70.6-176.3179-179.80109.2I458K456-I458 PolarHBondContact O-N 3.18Å
457P77.2Confident68.9Low41 Ų41106.2 Ų106.227%0.26656%0.555SS.*PPolyproline II helixtrans-63.6134.2177.324.6-31.4000110.3L436 R459L436-P457 HydrophobicContact CD1-CB 3.74Å; L436-P457 HydrophobicContact CD1-CG 4.29Å; L436-P457 HydrophobicContact CD2-CB 3.7Å; L436-P457 HydrophobicContact CD2-CG 4.14Å; L436-P457 HydrophobicContact CG-CB 4.39Å; P457-R459 PolarHBondContact O-N 2.8Å
458I79.3Confident67.6Low136 Ų136107.7 Ų107.770%0.69755%0.551SS**PPolyproline II helixtrans-72.6118.6-178.2-62.1171.8000108.8K456K456-I458 PolarHBondContact O-N 3.18Å
459R72.6Confident66.4Low81 Ų81108.3 Ų108.331%0.30656%0.557SS.*  trans-110.5102.5170.6-62.5-173.8-173.1-169.13.2108.7L436 E440 P457 R461L436-R459 HydrophobicContact CD1-CG 4.36Å; E440-R459 IonicContact OE1-CZ 3.25Å; E440-R459 IonicContact OE1-NH2 3.47Å; E440-R459 PolarHBondContact OE1-NH2 3.26Å; E440-R459 IonicContact OE2-NH2 3.95Å; E440-R459 PolarHBondContact OE2-NH2 3.26Å; P457-R459 PolarHBondContact O-N 2.8Å; R459-R461 VanDerWaalsContact C-N 3.32Å; R459-R461 HydrophobicContact CB-CG 4.46Å; R459-R461 PolarHBondContact O-N 3.36Å
460N63.2Low65.4Low97 Ų97106.6 Ų106.652%0.51955%0.55SS..  trans-77.780.2178.7-100-22.5000110.5
461R60.7Low64.5Low167 Ų167110.2 Ų110.263%0.6357%0.574SS**  trans-91.3-6.5178.1-69.4-169.6172.4-169-2.1114.5R459 Q463R459-R461 VanDerWaalsContact C-N 3.32Å; R459-R461 HydrophobicContact CB-CG 4.46Å; R459-R461 PolarHBondContact O-N 3.36Å; R461-Q463 PolarHBondContact O-N 3.35Å
462D53.6Low63.6Low159 Ų159108.2 Ų108.285%0.8558%0.579SS**  trans-85.6-5.9-169-66.7-21.4000115.6
463Q54.6Low63.1Low116 Ų116102.9 Ų102.954%0.54256%0.562SS.*SBendtrans-83.2123.7173.3-73.3-178.5-15.300109.1R461 Q465R461-Q463 PolarHBondContact O-N 3.35Å; Q463-Q465 VanDerWaalsContact C-N 3.26Å; Q463-Q465 WeakPolarHBondContact O-CG 3.39Å; Q463-Q465 PolarHBondContact O-N 3.49Å
464Q53.7Low62.6Low192 Ų192105 Ų10590%0.89757%0.572SS**  trans-53.891.4167.9-74.4176.2-9.800108.7L466Q464-L466 PolarHBondContact O-N 2.86Å
465Q54.6Low62.1Low87 Ų87101.7 Ų101.741%0.40754%0.536SS..  trans-68.6122.5-177.7-71-178.7-2.800108Q463 Y467Q463-Q465 VanDerWaalsContact C-N 3.26Å; Q463-Q465 WeakPolarHBondContact O-CG 3.39Å; Q463-Q465 PolarHBondContact O-N 3.49Å; Q465-Y467 PolarHBondContact O-N 3.24Å
466L53.5Low61.3Low132 Ų13298.2 Ų98.269%0.69153%0.526SS*.SBendtrans-64.2-15.9170.5-96.5101000112.5Q464Q464-L466 PolarHBondContact O-N 2.86Å
467Y57.2Low60.4Low28 Ų2893.8 Ų93.811%0.1151%0.508CS..SBendtrans-110.4124.1-174.7-56.9-78.6000109.8T426 Q465T426-Y467 HydrophobicContact CG2-CD2 4.49Å; Q465-Y467 PolarHBondContact O-N 3.24Å
468V56.9Low59.2Low92 Ų9296.6 Ų96.656%0.55852%0.521SS*.  trans-87.1133.4179.2-178.60000108.5G470V468-G470 PolarHBondContact O-N 3.47Å
469C56.5Low57.6Low66 Ų66102.8 Ų102.845%0.44654%0.543SS..BIsolated β-bridgetrans-72.6113169-740000109.1K430K430-C469 PolarHBondContact NZ-SG 3.4Å
470G58.9Low56.8Low22 Ų22103.9 Ų103.923%0.22756%0.555CS.*  trans-68.3169.3172.800000112.6V468 A472 G473 I474V468-G470 PolarHBondContact O-N 3.47Å; G470-A472 PolarHBondContact O-N 3.12Å; G470-G473 PolarHBondContact O-N 3.13Å; G470-G473 VanDerWaalsContact O-N 3.12Å; G470-I474 PolarHBondContact N-O 3.09Å
471P51.1Low56.5Low127 Ų127104.2 Ų104.283%0.82556%0.556SS**THydrogen-bonded Turntrans-54.9138.6174.310.8-13.3000110.4
472A54.4Low56.2Low107 Ų107100.7 Ų100.788%0.88455%0.552SS**THydrogen-bonded Turntrans69.218.9-173.300000116.9G470G470-A472 PolarHBondContact O-N 3.12Å
473G59.9Low56.4Low31 Ų3197.3 Ų97.332%0.3254%0.535SS..SBendtrans78.929.716900000113.7K430 G470K430-G473 WeakPolarHBondContact CD-O 3.4Å; K430-G473 WeakPolarHBondContact CE-O 3.3Å; K430-G473 PolarHBondContact NZ-O 3.01Å; G470-G473 PolarHBondContact O-N 3.13Å; G470-G473 VanDerWaalsContact O-N 3.12Å
474I62.7Low56.5Low105 Ų10596.1 Ų96.154%0.53853%0.534SS..  trans-88.1132.4170.3-56.5174.3000109.4K430 G470 T476K430-I474 PolarHBondContact NZ-O 3.29Å; G470-I474 PolarHBondContact N-O 3.09Å; I474-T476 HydrophobicContact CG2-CG2 3.84Å
475I65.1Low56.7Low13 Ų1389.7 Ų89.77%0.06751%0.51CS..BIsolated β-bridgetrans-93118.8167.1-65.6161.3000106.3Y423 T426 K427 K430Y423-I475 HydrophobicContact CD2-CG2 4.08Å; Y423-I475 HydrophobicContact CE2-CB 4.36Å; Y423-I475 HydrophobicContact CE2-CG2 3.74Å; Y423-I475 PolarHBondContact OH-O 2.92Å; T426-I475 VanDerWaalsContact C-CD1 3.49Å; T426-I475 HydrophobicContact CG2-CD1 3.88Å; T426-I475 HydrophobicContact CG2-CG1 4.42Å; T426-I475 HydrophobicContact CG2-CG2 4.09Å; T426-I475 VanDerWaalsContact O-CD1 3.25Å; T426-I475 WeakPolarHBondContact O-CD1 3.45Å; K427-I475 VanDerWaalsContact CA-CD1 3.4Å; K427-I475 HydrophobicContact CB-CD1 4.27Å; K430-I475 HydrophobicContact CB-CD1 3.46Å; K430-I475 VanDerWaalsContact CB-CD1 3.46Å; K430-I475 HydrophobicContact CB-CG1 4.37Å; K430-I475 HydrophobicContact CD-CD1 3.39Å; K430-I475 HydrophobicContact CD-CG1 3.42Å; K430-I475 VanDerWaalsContact CD-CG1 3.42Å; K430-I475 HydrophobicContact CG-CD1 4.12Å
476T63.7Low56.9Low65 Ų6589.9 Ų89.940%0.39952%0.518SS..  trans-109.4139.1177.351.90000109.1I474 N478I474-T476 HydrophobicContact CG2-CG2 3.84Å; T476-N478 PolarHBondContact O-N 3.21Å; T476-N478 VanDerWaalsContact O-N 3.14Å
477E59.7Low57.1Low105 Ų10586.7 Ų86.749%0.49150%0.504SS..  trans-60.8113.9163-69.6179.3175.300108Y423 K479Y423-E477 HydrophobicContact CD2-CG 3.86Å; Y423-E477 HydrophobicContact CE2-CG 4.07Å; Y423-E477 HydrophobicContact CG-CG 4.45Å; E477-K479 PolarHBondContact O-N 3.11Å
478N51.9Low57.1Low100 Ų10091.6 Ų91.654%0.53554%0.537SS..  trans-70.7113.4163.7-97.3-17.7000106.5T476T476-N478 PolarHBondContact O-N 3.21Å; T476-N478 VanDerWaalsContact O-N 3.14Å
479K44.7Very low57.1Low266 Ų26691.5 Ų91.5100%1.15754%0.535SS*.  trans-74.90165.3-83.2-171.8175-177.90110.7E477E477-K479 PolarHBondContact O-N 3.11Å

Retrieved 479 of 479 residues in 249.8 ms (Link to these results)