A0A077ZKU5_TRITR Loading...

Transcription initiation factor TFIID subunit 11

AlphaFold DB , UniProt , Accession A0A077ZKU5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 340 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
1M48Very low67Low228 Ų228120.2 Ų120.2100%1.12364%0.636SS**  0128.90-73.1179.6175.200107.5
2P57.4Low68.8Low119 Ų119117.1 Ų117.177%0.77362%0.619SS**PPolyproline II helixtrans-56.7140.5170.823.7-30.2000109K4P2-K4 PolarHBondContact O-N 3.31Å
3P60.7Low70.2Confident117 Ų117110.1 Ų110.176%0.7658%0.583SS**PPolyproline II helixtrans-56.9129-17720.9-30.1000109.5L5P3-L5 PolarHBondContact O-N 3.05Å; P3-L5 VanDerWaalsContact O-N 3.13Å
4K60.8Low71.5Confident194 Ų194111.6 Ų111.684%0.84358%0.578SS**PPolyproline II helixtrans-60.1117.2171.7-72.4176.9179.7172.90106.4P2 D6P2-K4 PolarHBondContact O-N 3.31Å; K4-D6 PolarHBondContact O-N 3.21Å
5L58.8Low72.5Confident90 Ų90104.7 Ų104.747%0.47154%0.542SS..PPolyproline II helixtrans-60.3127175.1-87.494.1000109.1P3 K11 L35P3-L5 PolarHBondContact O-N 3.05Å; P3-L5 VanDerWaalsContact O-N 3.13Å; L5-K11 HydrophobicContact CD2-CD 3.92Å; L5-L35 HydrophobicContact CD2-CD2 3.98Å
6D67.9Low73.3Confident116 Ų116111.1 Ų111.162%0.6256%0.558SS**PPolyproline II helixtrans-63.6125.1172.8-70.1-43.2000109.4K4 N8 E9K4-D6 PolarHBondContact O-N 3.21Å; D6-N8 PolarHBondContact O-N 3.02Å; D6-N8 VanDerWaalsContact O-N 3.16Å; D6-E9 HydrophobicContact CB-CB 4.29Å; D6-E9 WeakPolarHBondContact O-CB 3.42Å; D6-E9 PolarHBondContact O-N 3Å; D6-E9 VanDerWaalsContact O-N 3.1Å
7P65.2Low73.9Confident83 Ų83105.3 Ų105.354%0.53953%0.53SS..THydrogen-bonded Turntrans-62.1-26.3-172.618.3-28.6000113.7N66P7-N66 WeakPolarHBondContact CB-OD1 3.29Å; P7-N66 PolarHBondContact O-N 3.06Å; P7-N66 PolarHBondContact O-OD1 3.25Å
8N72.3Confident74.4Confident133 Ų133101.1 Ų101.171%0.71151%0.51SS*.THydrogen-bonded Turntrans-91.6-0.8179.9-71.6-18.3000114.2D6 I10D6-N8 PolarHBondContact O-N 3.02Å; D6-N8 VanDerWaalsContact O-N 3.16Å; N8-I10 PolarHBondContact O-N 3.25Å
9E78.3Confident74.8Confident96 Ų9695.8 Ų95.845%0.44948%0.484SS..  trans-72.7116.4179.6-164-170.7167.800110.3D6 K11D6-E9 HydrophobicContact CB-CB 4.29Å; D6-E9 WeakPolarHBondContact O-CB 3.42Å; D6-E9 PolarHBondContact O-N 3Å; D6-E9 VanDerWaalsContact O-N 3.1Å; E9-K11 HydrophobicContact CG-CG 4.47Å; E9-K11 PolarHBondContact O-N 3.22Å; E9-K11 WeakPolarHBondContact OE1-CE 3.46Å; E9-K11 IonicContact OE1-NZ 2.69Å; E9-K11 WeakPolarHBondContact OE2-CE 3.47Å; E9-K11 IonicContact OE2-NZ 2.85Å; E9-K11 PolarHBondContact OE2-NZ 3.07Å
10I83.2Confident75.1Confident95 Ų9592.3 Ų92.349%0.48747%0.472SS..  trans-76.5109.7176.3-49.2-179.4000108.5N8 I12 T63 Q65N8-I10 PolarHBondContact O-N 3.25Å; I10-I12 HydrophobicContact CG2-CG1 4.39Å; I10-T63 HydrophobicContact CG2-CG2 3.49Å; I10-T63 VanDerWaalsContact CG2-CG2 3.49Å; I10-Q65 HydrophobicContact CB-CG 4.22Å; I10-Q65 HydrophobicContact CG1-CG 3.91Å; I10-Q65 HydrophobicContact CG2-CG 4.04Å
11K84Confident75.4Confident51 Ų5193.2 Ų93.222%0.22248%0.475CS..EExtended strand (participates in β ladder)trans-100.5116.7176-66.4-172.1-179.9-171.40110.3L5 E9 L35 I64L5-K11 HydrophobicContact CD2-CD 3.92Å; E9-K11 HydrophobicContact CG-CG 4.47Å; E9-K11 PolarHBondContact O-N 3.22Å; E9-K11 WeakPolarHBondContact OE1-CE 3.46Å; E9-K11 IonicContact OE1-NZ 2.69Å; E9-K11 WeakPolarHBondContact OE2-CE 3.47Å; E9-K11 IonicContact OE2-NZ 2.85Å; E9-K11 PolarHBondContact OE2-NZ 3.07Å; K11-L35 HydrophobicContact CD-CD2 3.58Å; K11-I64 HydrophobicContact CB-CB 4.4Å; K11-I64 PolarHBondContact N-O 3.31Å; K11-I64 PolarHBondContact O-N 3.1Å
12I88.5Confident77Confident83 Ų8386.4 Ų86.443%0.42645%0.446SS..EExtended strand (participates in β ladder)trans-96117176.1-59.6173.9000108.3I10 Y14 K61 L62I10-I12 HydrophobicContact CG2-CG1 4.39Å; I12-Y14 HydrophobicContact CG2-CD2 4.29Å; I12-Y14 HydrophobicContact CG2-CE2 3.67Å; I12-K61 HydrophobicContact CG2-CD 4.16Å; I12-K61 VanDerWaalsContact CG2-CE 3.46Å; I12-K61 HydrophobicContact CG2-CG 3.7Å; I12-L62 CarbonylContact C-O 3.57Å; I12-L62 WeakPolarHBondContact CA-O 3.26Å
13V87.6Confident77.8Confident26 Ų2681.5 Ų81.516%0.15842%0.417CS..EExtended strand (participates in β ladder)trans-116.6123.9177.4-178.10000109.6L15 K31 L35 L62 I64V13-L15 HydrophobicContact CG1-CD1 4Å; V13-L15 HydrophobicContact CG1-CG 4.5Å; V13-K31 HydrophobicContact CG1-CB 4.35Å; V13-K31 HydrophobicContact CG1-CD 4.37Å; V13-L35 HydrophobicContact CG2-CD1 3.77Å; V13-L62 HydrophobicContact CB-CB 4.39Å; V13-L62 PolarHBondContact N-O 3.16Å; V13-L62 PolarHBondContact O-N 3.27Å; V13-I64 HydrophobicContact CG2-CD1 4.05Å
14Y88.5Confident78.8Confident131 Ų13178.6 Ų78.651%0.51440%0.403SS..EExtended strand (participates in β ladder)trans-93.1127.5171.7-64.4-82.5000110.8I12 K31 K61 V74I12-Y14 HydrophobicContact CG2-CD2 4.29Å; I12-Y14 HydrophobicContact CG2-CE2 3.67Å; Y14-K31 PolarHBondContact O-NZ 2.97Å; Y14-K61 HydrophobicContact CD1-CB 4.04Å; Y14-K61 HydrophobicContact CD1-CG 4.24Å; Y14-K61 HydrophobicContact CE1-CB 3.75Å; Y14-K61 HydrophobicContact CE1-CD 3.96Å; Y14-K61 HydrophobicContact CE1-CG 3.66Å; Y14-V74 HydrophobicContact CD1-CG2 4.32Å; Y14-V74 HydrophobicContact CE1-CG2 4.1Å
15L86.4Confident79.8Confident8 Ų872.8 Ų72.84%0.04238%0.384CS..EExtended strand (participates in β ladder)trans-133.3135.7-177-108.3150.5000110.4V13 L28 K31 I32 T59 V60 L62V13-L15 HydrophobicContact CG1-CD1 4Å; V13-L15 HydrophobicContact CG1-CG 4.5Å; L15-L28 HydrophobicContact CD1-CD2 4.04Å; L15-L28 HydrophobicContact CD2-CD2 3.64Å; L15-L28 HydrophobicContact CG-CD2 4.39Å; L15-K31 HydrophobicContact CD1-CB 4.05Å; L15-K31 HydrophobicContact CD1-CD 3.82Å; L15-K31 HydrophobicContact CD2-CD 3.71Å; L15-K31 HydrophobicContact CG-CD 3.52Å; L15-I32 HydrophobicContact CD1-CG2 4.33Å; L15-T59 CarbonylContact O-C 3.56Å; L15-T59 WeakPolarHBondContact O-CA 3.46Å; L15-V60 PolarHBondContact N-O 2.96Å; L15-V60 PolarHBondContact O-N 2.86Å; L15-L62 HydrophobicContact CD1-CD1 3.87Å
16R85.4Confident81.1Confident208 Ų20873.6 Ų73.679%0.78539%0.392SS*.EExtended strand (participates in β ladder)trans-94.2115171.5-80.3-164.4-88-163.8-4.3108.7I58 T59R16-I58 WeakPolarHBondContact CA-O 3.49Å; R16-T59 HydrophobicContact CG-CG2 3.5Å
17C82.8Confident81.8Confident12 Ų1272 Ų728%0.08139%0.39CS..EExtended strand (participates in β ladder)trans-121158.8178.5-63.90000109.9I46 K57 I58C17-I46 HydrophobicContact CB-CG2 4.08Å; C17-K57 WeakPolarHBondContact O-CA 3.39Å; C17-I58 PolarHBondContact N-O 2.92Å; C17-I58 PolarHBondContact O-N 2.83Å
18V83.7Confident82.7Confident30 Ų3068.2 Ų68.218%0.18237%0.365CS..EExtended strand (participates in β ladder)trans-84.5124.8167.8-177.50000106.8L56 K57V18-L56 CarbonylContact C-O 3.59Å; V18-L56 WeakPolarHBondContact CA-O 3.33Å; V18-K57 HydrophobicContact CG2-CG 4.35Å
19G82.4Confident83.3Confident1 Ų163.7 Ų63.71%0.0135%0.347CS..THydrogen-bonded Turntrans-65.6145.6-18000000111.5E21 T50 W53 K54 G55 L56G19-E21 PolarHBondContact O-N 3.24Å; G19-T50 WeakPolarHBondContact CA-OG1 3.42Å; G19-W53 CarbonylContact C-O 3.55Å; G19-W53 WeakPolarHBondContact CA-O 3.2Å; G19-K54 VanDerWaalsContact O-CA 3.28Å; G19-K54 WeakPolarHBondContact O-CA 3.37Å; G19-G55 PolarHBondContact O-N 3.03Å; G19-L56 PolarHBondContact N-O 3.18Å
20G79.3Confident83.8Confident24 Ų2463.7 Ų63.725%0.24736%0.355CS..THydrogen-bonded Turntrans68-0.4176.700000116.1T50G20-T50 PolarHBondContact N-O 3.3Å; G20-T50 PolarHBondContact N-OG1 3.17Å; G20-T50 VanDerWaalsContact N-OG1 3.17Å
21E81.7Confident83.8Confident113 Ų11363.9 Ų63.953%0.52835%0.352SS..SBendtrans-115.7144172.3-67.9-173.316700109.9G19 G23G19-E21 PolarHBondContact O-N 3.24Å; E21-G23 PolarHBondContact O-N 3.2Å
22V82.7Confident83.9Confident85 Ų8561.5 Ų61.552%0.51534%0.342SS..  trans-67.3110.9173.4-176.40000107.8A47V22-A47 HydrophobicContact CG2-CB 4.11Å
23G74.7Confident83.6Confident16 Ų1659.5 Ų59.517%0.16534%0.342CS..  trans-55.8141.8-178.900000111.6E21 T25E21-G23 PolarHBondContact O-N 3.2Å; G23-T25 PolarHBondContact O-N 3.19Å; G23-T25 VanDerWaalsContact O-N 3.1Å
24A80.9Confident83.5Confident56 Ų5662.8 Ų62.846%0.46336%0.364SS..  trans-54.7121.2178.300000110.1T26 S27 L28A24-T26 PolarHBondContact O-N 3.43Å; A24-T26 VanDerWaalsContact O-N 3.07Å; A24-S27 WeakPolarHBondContact O-CB 3.37Å; A24-S27 PolarHBondContact O-N 3.41Å; A24-L28 PolarHBondContact O-N 2.95Å
25T82.7Confident83.2Confident72 Ų7258 Ų5844%0.44235%0.347SS..Hα-helixtrans-55.3-30.7-178.750.60000111.8G23 S27 L28 A29G23-T25 PolarHBondContact O-N 3.19Å; G23-T25 VanDerWaalsContact O-N 3.1Å; T25-S27 VanDerWaalsContact C-N 3.33Å; T25-S27 PolarHBondContact O-N 2.64Å; T25-L28 PolarHBondContact O-N 3.28Å; T25-A29 WeakPolarHBondContact O-CB 3.48Å; T25-A29 PolarHBondContact O-N 3.43Å
26T85.6Confident82.9Confident107 Ų10760 Ų6066%0.65637%0.369SS*.Hα-helixtrans-63-32.7174.955.10000113.8A24 P30A24-T26 PolarHBondContact O-N 3.43Å; A24-T26 VanDerWaalsContact O-N 3.07Å; T26-P30 WeakPolarHBondContact O-CD 3.14Å
27S81.7Confident82.8Confident82 Ų8251 Ų5157%0.57334%0.337SS*.Hα-helixtrans-82.7-29.2178.8-59.70000112.3A24 T25A24-S27 WeakPolarHBondContact O-CB 3.37Å; A24-S27 PolarHBondContact O-N 3.41Å; T25-S27 VanDerWaalsContact C-N 3.33Å; T25-S27 PolarHBondContact O-N 2.64Å
28L83.7Confident83Confident3 Ų353.3 Ų53.32%0.01635%0.353CS..Hα-helixtrans-82.9-44.4179.2-63.3177000111.7L15 A24 T25 P30 K31 I32 P39 I46L15-L28 HydrophobicContact CD1-CD2 4.04Å; L15-L28 HydrophobicContact CD2-CD2 3.64Å; L15-L28 HydrophobicContact CG-CD2 4.39Å; A24-L28 PolarHBondContact O-N 2.95Å; T25-L28 PolarHBondContact O-N 3.28Å; L28-P30 VanDerWaalsContact C-CD 3.42Å; L28-P30 VanDerWaalsContact C-N 3.34Å; L28-P30 VanDerWaalsContact O-N 3.13Å; L28-K31 PolarHBondContact O-N 2.89Å; L28-I32 HydrophobicContact CB-CD1 3.97Å; L28-I32 HydrophobicContact CB-CG1 4.29Å; L28-I32 VanDerWaalsContact O-CG1 3.29Å; L28-I32 WeakPolarHBondContact O-CG1 3.37Å; L28-I32 PolarHBondContact O-N 3.35Å; L28-P39 HydrophobicContact CB-CB 4.41Å; L28-I46 HydrophobicContact CD2-CD1 4.48Å
29A85.8Confident83.2Confident39 Ų3953.6 Ų53.632%0.32236%0.356SS..Hα-helixtrans-49.7-41.2-171.900000115T25 K31 G33 P39T25-A29 WeakPolarHBondContact O-CB 3.48Å; T25-A29 PolarHBondContact O-N 3.43Å; A29-K31 VanDerWaalsContact C-N 3.26Å; A29-K31 PolarHBondContact O-N 2.93Å; A29-G33 VanDerWaalsContact O-CA 3.26Å; A29-G33 WeakPolarHBondContact O-CA 3.06Å; A29-G33 PolarHBondContact O-N 2.95Å; A29-P39 HydrophobicContact CB-CG 4.48Å
30P88.9Confident83.4Confident96 Ų9660.5 Ų60.562%0.62339%0.385SS*.Hα-helixtrans-62-29.9178.3-2535.4000114.2T26 L28 P34T26-P30 WeakPolarHBondContact O-CD 3.14Å; L28-P30 VanDerWaalsContact C-CD 3.42Å; L28-P30 VanDerWaalsContact C-N 3.34Å; L28-P30 VanDerWaalsContact O-N 3.13Å; P30-P34 WeakPolarHBondContact O-CD 3.32Å
31K83.8Confident83.7Confident99 Ų9966.5 Ų66.543%0.4341%0.405SS..Hα-helixtrans-92.8-39.1-175.6-70.4-175.9172.6-170.70113.6V13 Y14 L15 L28 A29V13-K31 HydrophobicContact CG1-CB 4.35Å; V13-K31 HydrophobicContact CG1-CD 4.37Å; Y14-K31 PolarHBondContact O-NZ 2.97Å; L15-K31 HydrophobicContact CD1-CB 4.05Å; L15-K31 HydrophobicContact CD1-CD 3.82Å; L15-K31 HydrophobicContact CD2-CD 3.71Å; L15-K31 HydrophobicContact CG-CD 3.52Å; L28-K31 PolarHBondContact O-N 2.89Å; A29-K31 VanDerWaalsContact C-N 3.26Å; A29-K31 PolarHBondContact O-N 2.93Å
32I84.7Confident84Confident0 Ų061.4 Ų61.40%038%0.381CS..Hα-helixtrans-100.9-18.9-176.657.5169.1000113.6L15 L28 L35 G36 L37 P39 V42 L62L15-I32 HydrophobicContact CD1-CG2 4.33Å; L28-I32 HydrophobicContact CB-CD1 3.97Å; L28-I32 HydrophobicContact CB-CG1 4.29Å; L28-I32 VanDerWaalsContact O-CG1 3.29Å; L28-I32 WeakPolarHBondContact O-CG1 3.37Å; L28-I32 PolarHBondContact O-N 3.35Å; I32-L35 WeakPolarHBondContact O-CB 3.36Å; I32-L35 PolarHBondContact O-N 3.37Å; I32-L35 VanDerWaalsContact O-N 3.09Å; I32-G36 PolarHBondContact O-N 3.44Å; I32-L37 HydrophobicContact CB-CB 4.27Å; I32-L37 PolarHBondContact O-N 2.69Å; I32-P39 HydrophobicContact CD1-CB 3.72Å; I32-P39 HydrophobicContact CG1-CB 4.34Å; I32-V42 HydrophobicContact CD1-CB 3.83Å; I32-V42 HydrophobicContact CD1-CG1 4.1Å; I32-V42 HydrophobicContact CD1-CG2 4.04Å; I32-L62 HydrophobicContact CG2-CD1 4.15Å
33G83.3Confident84.3Confident41 Ų4157.4 Ų57.442%0.42336%0.357SS..G310 helixtrans-58-48.5177.900000113.2A29 L35 G36A29-G33 VanDerWaalsContact O-CA 3.26Å; A29-G33 WeakPolarHBondContact O-CA 3.06Å; A29-G33 PolarHBondContact O-N 2.95Å; G33-L35 PolarHBondContact O-N 3.19Å; G33-L35 VanDerWaalsContact O-N 3.16Å; G33-G36 PolarHBondContact O-N 3.42Å; G33-G36 VanDerWaalsContact O-N 3.13Å
34P84.7Confident85Confident96 Ų9659.7 Ų59.762%0.62337%0.365SS*.G310 helixtrans-63.1-18.7175.5-24.235.1000114.4P30 G36P30-P34 WeakPolarHBondContact O-CD 3.32Å; P34-G36 VanDerWaalsContact C-N 3.33Å
35L82.7Confident85.3Confident29 Ų2960.6 Ų60.615%0.15236%0.363CS..G310 helixtrans-90.50.9-179.5-57.1178.2000112.6L5 K11 V13 I32 G33 L37 I64L5-L35 HydrophobicContact CD2-CD2 3.98Å; K11-L35 HydrophobicContact CD-CD2 3.58Å; V13-L35 HydrophobicContact CG2-CD1 3.77Å; I32-L35 WeakPolarHBondContact O-CB 3.36Å; I32-L35 PolarHBondContact O-N 3.37Å; I32-L35 VanDerWaalsContact O-N 3.09Å; G33-L35 PolarHBondContact O-N 3.19Å; G33-L35 VanDerWaalsContact O-N 3.16Å; L35-L37 VanDerWaalsContact C-N 3.28Å; L35-L37 PolarHBondContact O-N 2.85Å; L35-I64 HydrophobicContact CB-CD1 4.49Å; L35-I64 HydrophobicContact CD1-CD1 3.31Å
36G80.7Confident85.6Confident50 Ų5057.3 Ų57.352%0.51534%0.342SS..THydrogen-bonded Turntrans74.615.4177.500000114.3I32 G33 P34I32-G36 PolarHBondContact O-N 3.44Å; G33-G36 PolarHBondContact O-N 3.42Å; G33-G36 VanDerWaalsContact O-N 3.13Å; P34-G36 VanDerWaalsContact C-N 3.33Å
37L83.5Confident85.6Confident20 Ų2053.1 Ų53.111%0.10532%0.318CS..  trans-92137.3175.4-74168.9000110.6I32 L35 P39 V42 I64 R67 A69I32-L37 HydrophobicContact CB-CB 4.27Å; I32-L37 PolarHBondContact O-N 2.69Å; L35-L37 VanDerWaalsContact C-N 3.28Å; L35-L37 PolarHBondContact O-N 2.85Å; L37-P39 WeakPolarHBondContact O-CD 3.5Å; L37-V42 HydrophobicContact CB-CG2 3.96Å; L37-V42 HydrophobicContact CD1-CG2 4.22Å; L37-V42 HydrophobicContact CD2-CG2 4.39Å; L37-V42 HydrophobicContact CG-CG2 4.45Å; L37-I64 HydrophobicContact CD1-CB 4.45Å; L37-I64 HydrophobicContact CD1-CD1 3.57Å; L37-I64 HydrophobicContact CD1-CG1 3.74Å; L37-I64 HydrophobicContact CD1-CG2 3.86Å; L37-R67 WeakPolarHBondContact CD2-O 3.28Å; L37-A69 HydrophobicContact CD1-CB 3.98Å
38S85.8Confident85.9Confident60 Ų6057 Ų5742%0.4233%0.325SS..  trans-71.9123.8174.4-1790000110.1K40 K41 V42S38-K40 PolarHBondContact O-N 3.2Å; S38-K41 PolarHBondContact O-N 2.84Å; S38-V42 PolarHBondContact O-N 2.97Å
39P87.1Confident86.1Confident37 Ų3759.2 Ų59.224%0.2434%0.343CS..Hα-helixtrans-64.7-22.5-179.125.7-34.2000114.3L28 A29 I32 L37 G43L28-P39 HydrophobicContact CB-CB 4.41Å; A29-P39 HydrophobicContact CB-CG 4.48Å; I32-P39 HydrophobicContact CD1-CB 3.72Å; I32-P39 HydrophobicContact CG1-CB 4.34Å; L37-P39 WeakPolarHBondContact O-CD 3.5Å; P39-G43 PolarHBondContact O-N 3.36Å
40K87.4Confident86.1Confident145 Ų14557.4 Ų57.463%0.6333%0.328SS*.Hα-helixtrans-70-51175.5-165.2174.5-178.2-179.20111.3S38 G43 D44S38-K40 PolarHBondContact O-N 3.2Å; K40-G43 PolarHBondContact O-N 2.83Å; K40-D44 PolarHBondContact O-N 3.39Å
41K86.5Confident85.8Confident151 Ų15154.9 Ų54.966%0.65732%0.32SS*.Hα-helixtrans-61.3-48.4179.7-68.4-169.9176.5-1750111.9S38 G43 D44 D45S38-K41 PolarHBondContact O-N 2.84Å; K41-G43 VanDerWaalsContact C-N 3.28Å; K41-G43 PolarHBondContact O-N 3.05Å; K41-D44 PolarHBondContact O-N 3.24Å; K41-D45 PolarHBondContact O-N 3.23Å
42V87.5Confident85.8Confident5 Ų556.5 Ų56.53%0.0333%0.329CS..Hα-helixtrans-63.4-36.3178.2178.20000111.2I32 L37 S38 I46 L62I32-V42 HydrophobicContact CD1-CB 3.83Å; I32-V42 HydrophobicContact CD1-CG1 4.1Å; I32-V42 HydrophobicContact CD1-CG2 4.04Å; L37-V42 HydrophobicContact CB-CG2 3.96Å; L37-V42 HydrophobicContact CD1-CG2 4.22Å; L37-V42 HydrophobicContact CD2-CG2 4.39Å; L37-V42 HydrophobicContact CG-CG2 4.45Å; S38-V42 PolarHBondContact O-N 2.97Å; V42-I46 HydrophobicContact CG1-CD1 3.71Å; V42-I46 HydrophobicContact CG1-CG1 4.24Å; V42-I46 WeakPolarHBondContact O-CB 3.19Å; V42-I46 WeakPolarHBondContact O-CD1 3.38Å; V42-I46 WeakPolarHBondContact O-CG1 3.44Å; V42-I46 PolarHBondContact O-N 3.06Å; V42-L62 HydrophobicContact CG1-CD1 4.04Å
43G88.3Confident85.6Confident1 Ų157.5 Ų57.51%0.0133%0.333CS..Hα-helixtrans-62.2-43.9174.600000113.1P39 K40 K41 A47P39-G43 PolarHBondContact O-N 3.36Å; K40-G43 PolarHBondContact O-N 2.83Å; K41-G43 VanDerWaalsContact C-N 3.28Å; K41-G43 PolarHBondContact O-N 3.05Å; G43-A47 WeakPolarHBondContact O-CB 3.46Å; G43-A47 PolarHBondContact O-N 2.87Å
44D88.9Confident85.4Confident64 Ų6460.1 Ų60.134%0.34233%0.332SS..Hα-helixtrans-67.3-40.9177.8-66.1-31.8000111.8K40 K41 A47 K48K40-D44 PolarHBondContact O-N 3.39Å; K41-D44 PolarHBondContact O-N 3.24Å; D44-A47 PolarHBondContact O-N 3.1Å; D44-K48 WeakPolarHBondContact O-CG 3.33Å; D44-K48 PolarHBondContact O-N 3.23Å
45D88.6Confident85Confident76 Ų7656 Ų5641%0.40631%0.307SS..Hα-helixtrans-68.7-38.4178.2-65.6-28.5000111.6K41 K48 A49 I71K41-D45 PolarHBondContact O-N 3.23Å; D45-K48 PolarHBondContact O-N 3.36Å; D45-A49 WeakPolarHBondContact O-CB 3.44Å; D45-A49 PolarHBondContact O-N 3Å; D45-I71 VanDerWaalsContact C-CD1 3.42Å; D45-I71 HydrophobicContact CB-CD1 3.37Å
46I88.4Confident84.8Confident3 Ų355.3 Ų55.32%0.01530%0.304CS..Hα-helixtrans-62.7-43.4172.2-70.7168.7000110.2C17 L28 V42 K48 A49 T50 V60 L62 I71C17-I46 HydrophobicContact CB-CG2 4.08Å; L28-I46 HydrophobicContact CD2-CD1 4.48Å; V42-I46 HydrophobicContact CG1-CD1 3.71Å; V42-I46 HydrophobicContact CG1-CG1 4.24Å; V42-I46 WeakPolarHBondContact O-CB 3.19Å; V42-I46 WeakPolarHBondContact O-CD1 3.38Å; V42-I46 WeakPolarHBondContact O-CG1 3.44Å; V42-I46 PolarHBondContact O-N 3.06Å; I46-K48 VanDerWaalsContact C-N 3.32Å; I46-K48 PolarHBondContact O-N 3Å; I46-A49 PolarHBondContact O-N 3.07Å; I46-T50 HydrophobicContact CG2-CG2 4.17Å; I46-T50 WeakPolarHBondContact O-CB 3.49Å; I46-T50 WeakPolarHBondContact O-CG2 3.45Å; I46-T50 PolarHBondContact O-N 3.33Å; I46-T50 PolarHBondContact O-OG1 2.86Å; I46-V60 HydrophobicContact CG2-CG2 4.38Å; I46-L62 HydrophobicContact CD1-CD1 4.44Å; I46-L62 HydrophobicContact CD1-CD2 4.31Å; I46-L62 HydrophobicContact CG1-CD2 4.33Å; I46-I71 HydrophobicContact CG1-CD1 3.96Å; I46-I71 HydrophobicContact CG1-CG2 4.27Å
47A86.6Confident84.8Confident18 Ų1859 Ų5915%0.14931%0.305CS..Hα-helixtrans-62.5-39.4179.800000111.9V22 G43 D44 G51V22-A47 HydrophobicContact CG2-CB 4.11Å; G43-A47 WeakPolarHBondContact O-CB 3.46Å; G43-A47 PolarHBondContact O-N 2.87Å; D44-A47 PolarHBondContact O-N 3.1Å; A47-G51 PolarHBondContact O-N 2.77Å
48K88.1Confident84.9Confident165 Ų16558.2 Ų58.272%0.71730%0.301SS*.Hα-helixtrans-67.2-47174.5-70.2173.1-174.1170.90112.3D44 D45 I46 T50 G51D44-K48 WeakPolarHBondContact O-CG 3.33Å; D44-K48 PolarHBondContact O-N 3.23Å; D45-K48 PolarHBondContact O-N 3.36Å; I46-K48 VanDerWaalsContact C-N 3.32Å; I46-K48 PolarHBondContact O-N 3Å; K48-T50 VanDerWaalsContact C-N 3.26Å; K48-T50 PolarHBondContact O-N 3.14Å; K48-G51 PolarHBondContact O-N 3.13Å
49A87.7Confident85Confident48 Ų4857.5 Ų57.540%0.39729%0.294SS..Hα-helixtrans-67.4-25.8179.800000113.2D45 I46 I71D45-A49 WeakPolarHBondContact O-CB 3.44Å; D45-A49 PolarHBondContact O-N 3Å; I46-A49 PolarHBondContact O-N 3.07Å; A49-I71 HydrophobicContact CB-CB 4.38Å; A49-I71 HydrophobicContact CB-CG2 3.94Å
50T85.2Confident85.1Confident1 Ų155.7 Ų55.71%0.00628%0.283CS..THydrogen-bonded Turntrans-104.116.8-178.762.30000113.9G19 G20 I46 K48 E52 W53 V60 V73G19-T50 WeakPolarHBondContact CA-OG1 3.42Å; G20-T50 PolarHBondContact N-O 3.3Å; G20-T50 PolarHBondContact N-OG1 3.17Å; G20-T50 VanDerWaalsContact N-OG1 3.17Å; I46-T50 HydrophobicContact CG2-CG2 4.17Å; I46-T50 WeakPolarHBondContact O-CB 3.49Å; I46-T50 WeakPolarHBondContact O-CG2 3.45Å; I46-T50 PolarHBondContact O-N 3.33Å; I46-T50 PolarHBondContact O-OG1 2.86Å; K48-T50 VanDerWaalsContact C-N 3.26Å; K48-T50 PolarHBondContact O-N 3.14Å; T50-E52 VanDerWaalsContact C-N 3.28Å; T50-E52 PolarHBondContact O-N 3.16Å; T50-W53 PolarHBondContact O-N 3.07Å; T50-V60 HydrophobicContact CG2-CG2 4Å; T50-V73 HydrophobicContact CG2-CG2 4.05Å
51G82.3Confident85.2Confident43 Ų4351.7 Ų51.744%0.44327%0.265SS..G310 helixtrans-57.4-36.1-175.900000114.3A47 K48 W53A47-G51 PolarHBondContact O-N 2.77Å; K48-G51 PolarHBondContact O-N 3.13Å; G51-W53 PolarHBondContact O-N 3.49Å
52E83.3Confident85.3Confident134 Ų13444.5 Ų44.563%0.62623%0.234SC*.G310 helixtrans-65.7-17.8177-60.2-172.6152.600113.3T50 R83T50-E52 VanDerWaalsContact C-N 3.28Å; T50-E52 PolarHBondContact O-N 3.16Å; E52-R83 VanDerWaalsContact CD-NH2 3.34Å; E52-R83 IonicContact OE1-NH2 2.67Å; E52-R83 IonicContact OE2-CZ 3.14Å; E52-R83 IonicContact OE2-NH1 2.91Å; E52-R83 PolarHBondContact OE2-NH1 3.09Å; E52-R83 IonicContact OE2-NH2 2.74Å; E52-R83 PolarHBondContact OE2-NH2 3.18Å
53W80.6Confident85.3Confident21 Ų2145.3 Ų45.38%0.0824%0.239CC..G310 helixtrans-111.531.9-170.6-51.898.7000113.5G19 T50 G51 G55 L56 I58 S79 L80 R83G19-W53 CarbonylContact C-O 3.55Å; G19-W53 WeakPolarHBondContact CA-O 3.2Å; T50-W53 PolarHBondContact O-N 3.07Å; G51-W53 PolarHBondContact O-N 3.49Å; W53-G55 PolarHBondContact O-N 2.85Å; W53-L56 HydrophobicContact CB-CD1 4.49Å; W53-L56 HydrophobicContact CE3-CD1 4.12Å; W53-L56 WeakPolarHBondContact O-CB 3.41Å; W53-L56 PolarHBondContact O-N 3.21Å; W53-L56 VanDerWaalsContact O-N 3.07Å; W53-I58 HydrophobicContact CB-CD1 3.02Å; W53-I58 HydrophobicContact CB-CG1 4.44Å; W53-I58 HydrophobicContact CD2-CD1 3.41Å; W53-I58 VanDerWaalsContact CD2-CD1 3.41Å; W53-I58 HydrophobicContact CE3-CD1 3.79Å; W53-I58 HydrophobicContact CG-CD1 3.09Å; W53-S79 WeakPolarHBondContact CZ3-O 3.41Å; W53-L80 HydrophobicContact CH2-CD2 3.72Å; W53-L80 HydrophobicContact CH2-CG 4.23Å; W53-R83 HydrophobicContact CE3-CB 4.3Å; W53-R83 VanDerWaalsContact CZ2-NH1 3.35Å; W53-R83 HydrophobicContact CZ3-CB 3.77Å; W53-R83 HydrophobicContact CZ3-CG 4.27Å
54K79.1Confident85.2Confident96 Ų9645.7 Ų45.742%0.41724%0.241SC..THydrogen-bonded Turntrans-57.1124.2-172-165.1174.9176.1-155.80112G19 L56G19-K54 VanDerWaalsContact O-CA 3.28Å; G19-K54 WeakPolarHBondContact O-CA 3.37Å; K54-L56 VanDerWaalsContact C-N 3.34Å
55G76.8Confident85Confident9 Ų947 Ų479%0.09325%0.245CC..THydrogen-bonded Turntrans84.20.4178.900000115.5G19 W53G19-G55 PolarHBondContact O-N 3.03Å; W53-G55 PolarHBondContact O-N 2.85Å
56L79.1Confident84.8Confident15 Ų1548 Ų488%0.07925%0.25CS..  trans-98.2142.9176.3-66.8161.6000111V18 G19 W53 K54 I58 I82V18-L56 CarbonylContact C-O 3.59Å; V18-L56 WeakPolarHBondContact CA-O 3.33Å; G19-L56 PolarHBondContact N-O 3.18Å; W53-L56 HydrophobicContact CB-CD1 4.49Å; W53-L56 HydrophobicContact CE3-CD1 4.12Å; W53-L56 WeakPolarHBondContact O-CB 3.41Å; W53-L56 PolarHBondContact O-N 3.21Å; W53-L56 VanDerWaalsContact O-N 3.07Å; K54-L56 VanDerWaalsContact C-N 3.34Å; L56-I58 HydrophobicContact CB-CD1 4.24Å; L56-I58 HydrophobicContact CB-CG1 4.34Å; L56-I58 PolarHBondContact O-N 3.13Å; L56-I82 HydrophobicContact CD1-CB 4.46Å; L56-I82 HydrophobicContact CD1-CG2 4.35Å; L56-I82 HydrophobicContact CD2-CB 3.92Å; L56-I82 HydrophobicContact CD2-CD1 3.54Å; L56-I82 HydrophobicContact CD2-CG1 4.33Å; L56-I82 HydrophobicContact CD2-CG2 3.7Å
57K80.7Confident84.2Confident126 Ų12657.1 Ų57.155%0.54828%0.284SS..EExtended strand (participates in β ladder)trans-84.2115.4172-74.2-174.8178.6-179.10109.3C17 V18 R92C17-K57 WeakPolarHBondContact O-CA 3.39Å; V18-K57 HydrophobicContact CG2-CG 4.35Å; K57-R92 VanDerWaalsContact CE-CZ 3.45Å; K57-R92 VanDerWaalsContact CE-NH2 3.35Å
58I84.8Confident84.1Confident4 Ų463.3 Ų63.32%0.02131%0.311CS..EExtended strand (participates in β ladder)trans-124146.4-178.5-65.1163000111.1R16 C17 W53 L56 V73R16-I58 WeakPolarHBondContact CA-O 3.49Å; C17-I58 PolarHBondContact N-O 2.92Å; C17-I58 PolarHBondContact O-N 2.83Å; W53-I58 HydrophobicContact CB-CD1 3.02Å; W53-I58 HydrophobicContact CB-CG1 4.44Å; W53-I58 HydrophobicContact CD2-CD1 3.41Å; W53-I58 VanDerWaalsContact CD2-CD1 3.41Å; W53-I58 HydrophobicContact CE3-CD1 3.79Å; W53-I58 HydrophobicContact CG-CD1 3.09Å; L56-I58 HydrophobicContact CB-CD1 4.24Å; L56-I58 HydrophobicContact CB-CG1 4.34Å; L56-I58 PolarHBondContact O-N 3.13Å; I58-V73 HydrophobicContact CG2-CG1 3.48Å; I58-V73 VanDerWaalsContact CG2-CG1 3.48Å
59T88.1Confident83.9Confident45 Ų4556.9 Ų56.928%0.27629%0.288SS..EExtended strand (participates in β ladder)trans-81.8120.216842.60000110.3L15 R16 V74L15-T59 CarbonylContact O-C 3.56Å; L15-T59 WeakPolarHBondContact O-CA 3.46Å; R16-T59 HydrophobicContact CG-CG2 3.5Å; T59-V74 WeakPolarHBondContact O-CB 3.18Å; T59-V74 PolarHBondContact O-N 2.86Å
60V88.1Confident83.9Confident0 Ų061 Ų610%030%0.297CS..EExtended strand (participates in β ladder)trans-106.6132.4174.7-178.80000108.3L15 I46 T50 L62 I71L15-V60 PolarHBondContact N-O 2.96Å; L15-V60 PolarHBondContact O-N 2.86Å; I46-V60 HydrophobicContact CG2-CG2 4.38Å; T50-V60 HydrophobicContact CG2-CG2 4Å; V60-L62 HydrophobicContact CG1-CD2 3.95Å; V60-L62 HydrophobicContact CG1-CG 4.45Å; V60-I71 HydrophobicContact CG1-CG2 3.29Å
61K89.9Confident84Confident60 Ų6062.5 Ų62.526%0.26131%0.305SS..EExtended strand (participates in β ladder)trans-93.4113171.5-177.3-176.3179.4-176.20107.7I12 Y14 D72 V74I12-K61 HydrophobicContact CG2-CD 4.16Å; I12-K61 VanDerWaalsContact CG2-CE 3.46Å; I12-K61 HydrophobicContact CG2-CG 3.7Å; Y14-K61 HydrophobicContact CD1-CB 4.04Å; Y14-K61 HydrophobicContact CD1-CG 4.24Å; Y14-K61 HydrophobicContact CE1-CB 3.75Å; Y14-K61 HydrophobicContact CE1-CD 3.96Å; Y14-K61 HydrophobicContact CE1-CG 3.66Å; K61-D72 HydrophobicContact CB-CB 4.38Å; K61-D72 PolarHBondContact N-O 2.82Å; K61-D72 PolarHBondContact O-N 3.09Å; K61-V74 HydrophobicContact CB-CG2 3.77Å
62L88.3Confident84.3Confident0 Ų063.3 Ų63.30%030%0.299CS..EExtended strand (participates in β ladder)trans-95.3114.3173-60.7177.5000108.3I12 V13 L15 I32 V42 I46 V60 I64 K70 I71I12-L62 CarbonylContact C-O 3.57Å; I12-L62 WeakPolarHBondContact CA-O 3.26Å; V13-L62 HydrophobicContact CB-CB 4.39Å; V13-L62 PolarHBondContact N-O 3.16Å; V13-L62 PolarHBondContact O-N 3.27Å; L15-L62 HydrophobicContact CD1-CD1 3.87Å; I32-L62 HydrophobicContact CG2-CD1 4.15Å; V42-L62 HydrophobicContact CG1-CD1 4.04Å; I46-L62 HydrophobicContact CD1-CD1 4.44Å; I46-L62 HydrophobicContact CD1-CD2 4.31Å; I46-L62 HydrophobicContact CG1-CD2 4.33Å; V60-L62 HydrophobicContact CG1-CD2 3.95Å; V60-L62 HydrophobicContact CG1-CG 4.45Å; L62-I64 HydrophobicContact CB-CD1 4.43Å; L62-I64 HydrophobicContact CB-CG1 4.33Å; L62-K70 WeakPolarHBondContact CA-O 3.42Å; L62-I71 HydrophobicContact CD2-CB 4.25Å; L62-I71 HydrophobicContact CD2-CD1 4.46Å; L62-I71 HydrophobicContact CD2-CG1 3.73Å; L62-I71 HydrophobicContact CD2-CG2 4.12Å
63T89.3Confident84.5Confident22 Ų2259 Ų5914%0.13528%0.282CS..EExtended strand (participates in β ladder)trans-96107.3171.2-55.80000107.7I10 K70I10-T63 HydrophobicContact CG2-CG2 3.49Å; I10-T63 VanDerWaalsContact CG2-CG2 3.49Å; T63-K70 PolarHBondContact N-O 3.07Å; T63-K70 PolarHBondContact O-N 3.44Å
64I86Confident84.8Confident10 Ų1059 Ų595%0.05128%0.283CS..EExtended strand (participates in β ladder)trans-102.4120.8-173.7-59.6165.9000108.8K11 V13 L35 L37 L62 Q68 A69K11-I64 HydrophobicContact CB-CB 4.4Å; K11-I64 PolarHBondContact N-O 3.31Å; K11-I64 PolarHBondContact O-N 3.1Å; V13-I64 HydrophobicContact CG2-CD1 4.05Å; L35-I64 HydrophobicContact CB-CD1 4.49Å; L35-I64 HydrophobicContact CD1-CD1 3.31Å; L37-I64 HydrophobicContact CD1-CB 4.45Å; L37-I64 HydrophobicContact CD1-CD1 3.57Å; L37-I64 HydrophobicContact CD1-CG1 3.74Å; L37-I64 HydrophobicContact CD1-CG2 3.86Å; L62-I64 HydrophobicContact CB-CD1 4.43Å; L62-I64 HydrophobicContact CB-CG1 4.33Å; I64-Q68 VanDerWaalsContact CA-O 3.32Å; I64-Q68 WeakPolarHBondContact CA-O 3.35Å; I64-A69 HydrophobicContact CG1-CB 4.09Å
65Q84.2Confident84.9Confident90 Ų9056.3 Ų56.342%0.42128%0.276SS..EExtended strand (participates in β ladder)trans-138.8137.4176-65.7179.93.800108.3I10 R67 Q68I10-Q65 HydrophobicContact CB-CG 4.22Å; I10-Q65 HydrophobicContact CG1-CG 3.91Å; I10-Q65 HydrophobicContact CG2-CG 4.04Å; Q65-R67 PolarHBondContact O-N 3.34Å; Q65-Q68 PolarHBondContact N-O 2.88Å; Q65-Q68 PolarHBondContact O-N 2.93Å; Q65-Q68 VanDerWaalsContact O-O 3.08Å
66N84.6Confident85.3Confident97 Ų9758 Ų5852%0.51929%0.287SS..THydrogen-bonded Turntrans4740.6177.1-75.7-41.4000114.9P7 Q68P7-N66 WeakPolarHBondContact CB-OD1 3.29Å; P7-N66 PolarHBondContact O-N 3.06Å; P7-N66 PolarHBondContact O-OD1 3.25Å; N66-Q68 PolarHBondContact O-N 3.08Å
67R76.3Confident85.5Confident195 Ų19558 Ų5874%0.73629%0.289SS*.THydrogen-bonded Turntrans57.824.1-175.8-53.1-180179.5-175.6-0.3114.8L37 Q65L37-R67 WeakPolarHBondContact CD2-O 3.28Å; Q65-R67 PolarHBondContact O-N 3.34Å
68Q83.3Confident85.6Confident149 Ų14954.6 Ų54.670%0.69628%0.284SS*.EExtended strand (participates in β ladder)trans-116139.8169.7-61.5-177.84.800108.4I64 Q65 N66I64-Q68 VanDerWaalsContact CA-O 3.32Å; I64-Q68 WeakPolarHBondContact CA-O 3.35Å; Q65-Q68 PolarHBondContact N-O 2.88Å; Q65-Q68 PolarHBondContact O-N 2.93Å; Q65-Q68 VanDerWaalsContact O-O 3.08Å; N66-Q68 PolarHBondContact O-N 3.08Å
69A84.2Confident85.4Confident29 Ų2954.8 Ų54.824%0.2429%0.286CS..EExtended strand (participates in β ladder)trans-111.8117.4-179.800000109.6L37 I64L37-A69 HydrophobicContact CD1-CB 3.98Å; I64-A69 HydrophobicContact CG1-CB 4.09Å
70K87.8Confident85.2Confident135 Ų13553.6 Ų53.659%0.58728%0.277SS*.EExtended strand (participates in β ladder)trans-83.6132164.1-177.8179.1176.7-177.10108.6L62 T63 D72L62-K70 WeakPolarHBondContact CA-O 3.42Å; T63-K70 PolarHBondContact N-O 3.07Å; T63-K70 PolarHBondContact O-N 3.44Å; K70-D72 WeakPolarHBondContact CE-OD1 3.16Å
71I87.9Confident84.9Confident33 Ų3354.2 Ų54.217%0.16928%0.281CS..EExtended strand (participates in β ladder)trans-110.1110.6-172.2-52.3180000108.2D45 I46 A49 V60 L62D45-I71 VanDerWaalsContact C-CD1 3.42Å; D45-I71 HydrophobicContact CB-CD1 3.37Å; I46-I71 HydrophobicContact CG1-CD1 3.96Å; I46-I71 HydrophobicContact CG1-CG2 4.27Å; A49-I71 HydrophobicContact CB-CB 4.38Å; A49-I71 HydrophobicContact CB-CG2 3.94Å; V60-I71 HydrophobicContact CG1-CG2 3.29Å; L62-I71 HydrophobicContact CD2-CB 4.25Å; L62-I71 HydrophobicContact CD2-CD1 4.46Å; L62-I71 HydrophobicContact CD2-CG1 3.73Å; L62-I71 HydrophobicContact CD2-CG2 4.12Å
72D88.7Confident84.5Confident60 Ų6052.8 Ų52.832%0.32128%0.276SS..EExtended strand (participates in β ladder)trans-112.6128174.3-60.8-47.2000109.1K61 K70K61-D72 HydrophobicContact CB-CB 4.38Å; K61-D72 PolarHBondContact N-O 2.82Å; K61-D72 PolarHBondContact O-N 3.09Å; K70-D72 WeakPolarHBondContact CE-OD1 3.16Å
73V86.9Confident84.1Confident44 Ų4457.6 Ų57.627%0.26729%0.294SS..EExtended strand (participates in β ladder)trans-80.9121.1176.7-1760000108.5T50 I58 P75T50-V73 HydrophobicContact CG2-CG2 4.05Å; I58-V73 HydrophobicContact CG2-CG1 3.48Å; I58-V73 VanDerWaalsContact CG2-CG1 3.48Å; V73-P75 WeakPolarHBondContact O-CD 3.4Å
74V86Confident83.7Confident19 Ų1958.5 Ų58.512%0.11530%0.297CS..PPolyproline II helixtrans-80.2119179177.90000108.5Y14 T59 K61 S76Y14-V74 HydrophobicContact CD1-CG2 4.32Å; Y14-V74 HydrophobicContact CE1-CG2 4.1Å; T59-V74 WeakPolarHBondContact O-CB 3.18Å; T59-V74 PolarHBondContact O-N 2.86Å; K61-V74 HydrophobicContact CB-CG2 3.77Å; V74-S76 PolarHBondContact O-N 2.87Å
75P82.6Confident83.3Confident41 Ų4159.3 Ų59.327%0.26630%0.301SS..PPolyproline II helixtrans-64.7133.2-179.726.1-32.9000110.1V73 L80 M116 R119V73-P75 WeakPolarHBondContact O-CD 3.4Å; P75-L80 HydrophobicContact CB-CD1 4.19Å; P75-M116 HydrophobicContact CB-SD 4.13Å; P75-R119 PolarHBondContact O-NH1 3.26Å; P75-R119 VanDerWaalsContact O-NH1 3.12Å
76S84.9Confident82.7Confident45 Ų4563.5 Ų63.532%0.31532%0.318SS..  trans-126.3133.6177172.90000108V74 A78 S79 L80V74-S76 PolarHBondContact O-N 2.87Å; S76-A78 VanDerWaalsContact C-N 3.31Å; S76-A78 PolarHBondContact O-N 3.19Å; S76-S79 PolarHBondContact O-N 2.94Å; S76-L80 PolarHBondContact O-N 2.93Å
77A83.4Confident81.8Confident15 Ų1561.3 Ų61.312%0.12430%0.304CS..Hα-helixtrans-50.8-51.4-179.200000111.4S79 L80 I81 M116 I132A77-S79 VanDerWaalsContact C-N 3.31Å; A77-S79 PolarHBondContact O-N 3.5Å; A77-L80 PolarHBondContact O-N 2.88Å; A77-I81 WeakPolarHBondContact O-CB 3.46Å; A77-I81 WeakPolarHBondContact O-CD1 3.35Å; A77-I81 WeakPolarHBondContact O-CG1 3.48Å; A77-I81 PolarHBondContact O-N 2.99Å; A77-M116 HydrophobicContact CB-CE 4.31Å; A77-I132 HydrophobicContact CB-CD1 3.85Å
78A81.5Confident81.2Confident54 Ų5457.5 Ų57.545%0.44631%0.305SS..Hα-helixtrans-57.9-41.2178.200000112.8S76 I81 I82S76-A78 VanDerWaalsContact C-N 3.31Å; S76-A78 PolarHBondContact O-N 3.19Å; A78-I81 PolarHBondContact O-N 3.38Å; A78-I82 WeakPolarHBondContact O-CD1 3.38Å; A78-I82 WeakPolarHBondContact O-CG1 3.33Å; A78-I82 PolarHBondContact O-N 3.06Å; A78-I82 VanDerWaalsContact O-N 3.09Å
79S81.1Confident80.3Confident8 Ų856.6 Ų56.66%0.05630%0.3CS..Hα-helixtrans-66.1-44.1-179-57.60000111.2W53 S76 A77 I82 R83W53-S79 WeakPolarHBondContact CZ3-O 3.41Å; S76-S79 PolarHBondContact O-N 2.94Å; A77-S79 VanDerWaalsContact C-N 3.31Å; A77-S79 PolarHBondContact O-N 3.5Å; S79-I82 PolarHBondContact O-N 3.46Å; S79-R83 WeakPolarHBondContact O-CB 3.43Å; S79-R83 PolarHBondContact O-N 3.09Å
80L84.7Confident79.3Confident19 Ų1959 Ų5910%0.09930%0.303CS..Hα-helixtrans-64-43.1177.6-73.8164.9000112W53 P75 S76 A77 I82 R83 E84 I112 T115 M116W53-L80 HydrophobicContact CH2-CD2 3.72Å; W53-L80 HydrophobicContact CH2-CG 4.23Å; P75-L80 HydrophobicContact CB-CD1 4.19Å; S76-L80 PolarHBondContact O-N 2.93Å; A77-L80 PolarHBondContact O-N 2.88Å; L80-I82 PolarHBondContact O-N 3.45Å; L80-R83 WeakPolarHBondContact O-CB 3.28Å; L80-R83 PolarHBondContact O-N 3.48Å; L80-E84 PolarHBondContact O-N 2.95Å; L80-I112 HydrophobicContact CB-CG1 4.2Å; L80-I112 HydrophobicContact CB-CG2 3.88Å; L80-I112 HydrophobicContact CD1-CG2 4.14Å; L80-T115 HydrophobicContact CD1-CG2 4.15Å; L80-T115 HydrophobicContact CD2-CG2 4.34Å; L80-M116 HydrophobicContact CD1-CG 3.71Å; L80-M116 HydrophobicContact CD1-SD 3.76Å
81I82.2Confident78.1Confident14 Ų1457.4 Ų57.47%0.07230%0.301CS..Hα-helixtrans-58.5-48.9177.1-69.7161.9000110.6A77 A78 R83 E84 L85 L104 I112 I132 V136A77-I81 WeakPolarHBondContact O-CB 3.46Å; A77-I81 WeakPolarHBondContact O-CD1 3.35Å; A77-I81 WeakPolarHBondContact O-CG1 3.48Å; A77-I81 PolarHBondContact O-N 2.99Å; A78-I81 PolarHBondContact O-N 3.38Å; I81-R83 VanDerWaalsContact C-N 3.28Å; I81-R83 PolarHBondContact O-N 3.27Å; I81-E84 PolarHBondContact O-N 3.24Å; I81-L85 HydrophobicContact CG2-CD1 3.99Å; I81-L85 WeakPolarHBondContact O-CG 3.35Å; I81-L85 PolarHBondContact O-N 3.01Å; I81-L104 HydrophobicContact CG2-CD1 3.77Å; I81-I112 HydrophobicContact CG1-CD1 4.09Å; I81-I132 HydrophobicContact CD1-CG2 4.32Å; I81-I132 HydrophobicContact CG1-CG2 4.41Å; I81-V136 HydrophobicContact CD1-CG2 3.69Å; I81-V136 HydrophobicContact CG1-CG2 4.22Å; I81-V136 HydrophobicContact CG2-CG2 4.06Å
82I79.9Confident76.8Confident30 Ų3063 Ų6315%0.15432%0.32CS..Hα-helixtrans-68.9-31.4-177.5-58.4154.1000111.6L56 A78 S79 L80 R90L56-I82 HydrophobicContact CD1-CB 4.46Å; L56-I82 HydrophobicContact CD1-CG2 4.35Å; L56-I82 HydrophobicContact CD2-CB 3.92Å; L56-I82 HydrophobicContact CD2-CD1 3.54Å; L56-I82 HydrophobicContact CD2-CG1 4.33Å; L56-I82 HydrophobicContact CD2-CG2 3.7Å; A78-I82 WeakPolarHBondContact O-CD1 3.38Å; A78-I82 WeakPolarHBondContact O-CG1 3.33Å; A78-I82 PolarHBondContact O-N 3.06Å; A78-I82 VanDerWaalsContact O-N 3.09Å; S79-I82 PolarHBondContact O-N 3.46Å; L80-I82 PolarHBondContact O-N 3.45Å; I82-R90 VanDerWaalsContact CG1-NH2 3.29Å
83R79.7Confident75.6Confident100 Ų10070.2 Ų70.238%0.37735%0.349SS..Hα-helixtrans-63.4-44.2172.9176.7-177.4174.2150.97111.5E52 W53 S79 L80 I81 K86E52-R83 VanDerWaalsContact CD-NH2 3.34Å; E52-R83 IonicContact OE1-NH2 2.67Å; E52-R83 IonicContact OE2-CZ 3.14Å; E52-R83 IonicContact OE2-NH1 2.91Å; E52-R83 PolarHBondContact OE2-NH1 3.09Å; E52-R83 IonicContact OE2-NH2 2.74Å; E52-R83 PolarHBondContact OE2-NH2 3.18Å; W53-R83 HydrophobicContact CE3-CB 4.3Å; W53-R83 VanDerWaalsContact CZ2-NH1 3.35Å; W53-R83 HydrophobicContact CZ3-CB 3.77Å; W53-R83 HydrophobicContact CZ3-CG 4.27Å; S79-R83 WeakPolarHBondContact O-CB 3.43Å; S79-R83 PolarHBondContact O-N 3.09Å; L80-R83 WeakPolarHBondContact O-CB 3.28Å; L80-R83 PolarHBondContact O-N 3.48Å; I81-R83 VanDerWaalsContact C-N 3.28Å; I81-R83 PolarHBondContact O-N 3.27Å; R83-K86 PolarHBondContact O-N 2.98Å
84E81.5Confident74.4Confident42 Ų4276.2 Ų76.220%0.19637%0.371CS..Hα-helixtrans-72-29.3179.3-75.4-58.3154.600113.6L80 I81 K86 L104 Q108 I112L80-E84 PolarHBondContact O-N 2.95Å; I81-E84 PolarHBondContact O-N 3.24Å; E84-K86 PolarHBondContact O-N 2.8Å; E84-K86 VanDerWaalsContact O-N 3.14Å; E84-L104 HydrophobicContact CB-CD2 3.75Å; E84-Q108 HydrophobicContact CB-CB 4.48Å; E84-Q108 HydrophobicContact CG-CB 4.38Å; E84-Q108 PolarHBondContact O-NE2 3.05Å; E84-Q108 PolarHBondContact OE2-NE2 3.31Å; E84-I112 HydrophobicContact CB-CD1 4.19Å; E84-I112 HydrophobicContact CG-CD1 3.83Å; E84-I112 HydrophobicContact CG-CG1 4Å
85L77Confident73Confident27 Ų2779.3 Ų79.314%0.14139%0.39CS..THydrogen-bonded Turntrans-64.8-12.3173.4-74.7169.2000113.3I81 E87 G102 L104I81-L85 HydrophobicContact CG2-CD1 3.99Å; I81-L85 WeakPolarHBondContact O-CG 3.35Å; I81-L85 PolarHBondContact O-N 3.01Å; L85-E87 HydrophobicContact CB-CG 4.09Å; L85-E87 PolarHBondContact O-N 3.29Å; L85-G102 VanDerWaalsContact CD2-C 3.47Å; L85-G102 VanDerWaalsContact CD2-O 3.3Å; L85-G102 WeakPolarHBondContact CD2-O 3.38Å; L85-L104 HydrophobicContact CD1-CD1 4.32Å; L85-L104 HydrophobicContact CD2-CD1 3.78Å; L85-L104 HydrophobicContact CD2-CD2 4.3Å; L85-L104 HydrophobicContact CD2-CG 3.61Å; L85-L104 HydrophobicContact CG-CD1 3.98Å; L85-L104 HydrophobicContact CG-CD2 4.21Å; L85-L104 HydrophobicContact CG-CG 3.98Å
86K71.7Confident71.9Confident178 Ų17886.4 Ų86.477%0.77442%0.417SS*.THydrogen-bonded Turntrans48.431.7-178.8-64.7177.7-177.3172.10113.2R83 E84R83-K86 PolarHBondContact O-N 2.98Å; E84-K86 PolarHBondContact O-N 2.8Å; E84-K86 VanDerWaalsContact O-N 3.14Å
87E66Low70.8Confident51 Ų5191.9 Ų91.924%0.23844%0.442CS..PPolyproline II helixtrans-70.2148.2-178-81.5-175.6-170.200111.6L85 H100L85-E87 HydrophobicContact CB-CG 4.09Å; L85-E87 PolarHBondContact O-N 3.29Å; E87-H100 WeakPolarHBondContact OE1-CA 3.38Å; E87-H100 WeakPolarHBondContact OE1-CB 2.83Å; E87-H100 IonicContact OE1-CD2 2.84Å; E87-H100 IonicContact OE1-CG 3.3Å; E87-H100 IonicContact OE2-CD2 2.62Å; E87-H100 PolarHBondContact OE2-CD2 2.99Å; E87-H100 IonicContact OE2-NE2 2.86Å
88P64.8Low69.7Low114 Ų11495.1 Ų95.174%0.7446%0.457SS*.PPolyproline II helixtrans-60.4155.2179.825-33.6000112.1R90P88-R90 PolarHBondContact O-N 2.8Å
89Q63.8Low68.8Low131 Ų131101.9 Ų101.961%0.61248%0.476SS*.PPolyproline II helixtrans-52.5124.9-175.9-67.6-179.98.200111.5D91Q89-D91 PolarHBondContact O-N 3.26Å
90R63.3Low67.9Low79 Ų79106 Ų10630%0.29849%0.494SS..  trans-72.4110-177.5-69.6-179.8173176.10.1111.9I82 P88 R92 H100I82-R90 VanDerWaalsContact CG1-NH2 3.29Å; P88-R90 PolarHBondContact O-N 2.8Å; R90-R92 PolarHBondContact O-N 2.84Å; R90-R92 VanDerWaalsContact O-N 3.08Å; R90-H100 PolarHBondContact NH2-CD2 3.12Å; R90-H100 PolarHBondContact NH2-NE2 3.49Å
91D62.6Low66.8Low102 Ų102108.5 Ų108.555%0.54553%0.525SS..  trans-76.588.4165.6-90.6-13.9000110.7Q89 K93 K94Q89-D91 PolarHBondContact O-N 3.26Å; D91-K93 PolarHBondContact O-N 3.43Å; D91-K94 PolarHBondContact O-N 3.05Å
92R61Low66Low149 Ų149109.5 Ų109.556%0.56254%0.538SS*.THydrogen-bonded Turntrans-54.1-20.8179.8-78.8-171.279-135.6-3.3114.7K57 R90K57-R92 VanDerWaalsContact CE-CZ 3.45Å; K57-R92 VanDerWaalsContact CE-NH2 3.35Å; R90-R92 PolarHBondContact O-N 2.84Å; R90-R92 VanDerWaalsContact O-N 3.08Å
93K63.1Low65.5Low212 Ų212113.5 Ų113.592%0.92256%0.56SS**THydrogen-bonded Turntrans-87.2-23.6-171.4-67.4-177.2-178.3175.30114.2D91D91-K93 PolarHBondContact O-N 3.43Å
94K61.8Low65.2Low170 Ų170110.9 Ų110.974%0.73955%0.553SS**THydrogen-bonded Turntrans-100.9-38-169.9-72.3178.4-179.4167.80114D91D91-K94 PolarHBondContact O-N 3.05Å
95V56.3Low65.1Low85 Ų85111.4 Ų111.452%0.51556%0.561SS.*  trans-137.6117.9-177.6-172.10000109.4I98V95-I98 HydrophobicContact CB-CD1 4.28Å; V95-I98 HydrophobicContact CB-CG1 3.89Å; V95-I98 HydrophobicContact CG1-CG1 3.8Å
96K58.7Low65Low189 Ų189113.7 Ų113.782%0.82257%0.573SS**SBendtrans-81.4140.6166.9-64.2178.6-177174.30107.4
97N62.1Low65.5Low160 Ų160112.8 Ų112.886%0.85657%0.572SS**SBendtrans60.157.9176.9-54.5-7000114.1K99N97-K99 PolarHBondContact O-N 3.25Å
98I61.5Low66.3Low84 Ų84112.2 Ų112.243%0.43157%0.569SS.*PPolyproline II helixtrans-64.8125165-58.2171.8000107V95 H100V95-I98 HydrophobicContact CB-CD1 4.28Å; V95-I98 HydrophobicContact CB-CG1 3.89Å; V95-I98 HydrophobicContact CG1-CG1 3.8Å; I98-H100 PolarHBondContact O-CE1 2.91Å; I98-H100 PolarHBondContact O-N 3.4Å; I98-H100 PolarHBondContact O-ND1 3.16Å
99K63.2Low67.2Low196 Ų196107.2 Ų107.285%0.85254%0.537SS*.PPolyproline II helixtrans-69.1128.3172.4-67.7-173.8177.3-1730108.3N97N97-K99 PolarHBondContact O-N 3.25Å
100H61.8Low68.1Low94 Ų94101.6 Ų101.644%0.43551%0.511SS..PPolyproline II helixtrans-82.7117.2177.5-53.280.8000106.4E87 R90 I98E87-H100 WeakPolarHBondContact OE1-CA 3.38Å; E87-H100 WeakPolarHBondContact OE1-CB 2.83Å; E87-H100 IonicContact OE1-CD2 2.84Å; E87-H100 IonicContact OE1-CG 3.3Å; E87-H100 IonicContact OE2-CD2 2.62Å; E87-H100 PolarHBondContact OE2-CD2 2.99Å; E87-H100 IonicContact OE2-NE2 2.86Å; R90-H100 PolarHBondContact NH2-CD2 3.12Å; R90-H100 PolarHBondContact NH2-NE2 3.49Å; I98-H100 PolarHBondContact O-CE1 2.91Å; I98-H100 PolarHBondContact O-N 3.4Å; I98-H100 PolarHBondContact O-ND1 3.16Å
101G60Low69.2Low71 Ų71103 Ų10373%0.73252%0.521SS*.  trans-109.87.8-177.400000113.2
102G66.4Low70.3Confident35 Ų3598.2 Ų98.236%0.36150%0.496SS..PPolyproline II helixtrans-78.9146.4-178.300000112.4L85L85-G102 VanDerWaalsContact CD2-C 3.47Å; L85-G102 VanDerWaalsContact CD2-O 3.3Å; L85-G102 WeakPolarHBondContact CD2-O 3.38Å
103N69.4Low71.5Confident115 Ų11591.2 Ų91.262%0.61547%0.469SS*.PPolyproline II helixtrans-93130.8174.9-66.9-12.1000109.4Y142N103-Y142 PolarHBondContact OD1-OH 3.47Å
104L73.7Confident72.5Confident45 Ų4586.3 Ų86.324%0.23645%0.448CS..PPolyproline II helixtrans-95.9129.5170.6-76.9140.2000108.8I81 E84 L85 Q108 V109 I112 V136I81-L104 HydrophobicContact CG2-CD1 3.77Å; E84-L104 HydrophobicContact CB-CD2 3.75Å; L85-L104 HydrophobicContact CD1-CD1 4.32Å; L85-L104 HydrophobicContact CD2-CD1 3.78Å; L85-L104 HydrophobicContact CD2-CD2 4.3Å; L85-L104 HydrophobicContact CD2-CG 3.61Å; L85-L104 HydrophobicContact CG-CD1 3.98Å; L85-L104 HydrophobicContact CG-CD2 4.21Å; L85-L104 HydrophobicContact CG-CG 3.98Å; L104-Q108 HydrophobicContact CD2-CB 4.49Å; L104-V109 HydrophobicContact CB-CG2 4.3Å; L104-I112 HydrophobicContact CD2-CD1 4.44Å; L104-V136 HydrophobicContact CD1-CG2 4.25Å
105S79.8Confident73.7Confident52 Ų5281 Ų8136%0.36443%0.43SS..PPolyproline II helixtrans-73.6149.3169.362.70000110.5E107 Q108 V109S105-E107 PolarHBondContact O-N 2.96Å; S105-Q108 WeakPolarHBondContact O-CB 3.37Å; S105-Q108 PolarHBondContact O-N 3.33Å; S105-Q108 VanDerWaalsContact OG-CD 3.31Å; S105-Q108 WeakPolarHBondContact OG-CG 3.41Å; S105-Q108 PolarHBondContact OG-N 3.25Å; S105-Q108 PolarHBondContact OG-OE1 3.46Å; S105-V109 PolarHBondContact O-N 2.97Å; S105-V109 VanDerWaalsContact O-N 3.16Å
106L75Confident75Confident75 Ų7578 Ų7839%0.39341%0.411SS..Hα-helixtrans-61.4-31.3179.2-168.4142.6000112Q108 V109 V110 F152 L155L106-Q108 PolarHBondContact O-N 2.92Å; L106-V109 PolarHBondContact O-N 3.3Å; L106-V110 HydrophobicContact CD2-CG2 4.07Å; L106-V110 WeakPolarHBondContact O-CG2 3.37Å; L106-V110 PolarHBondContact O-N 2.91Å; L106-F152 HydrophobicContact CD1-CD2 3.75Å; L106-F152 HydrophobicContact CD1-CE2 3.83Å; L106-L155 HydrophobicContact CD2-CD1 4.06Å; L106-L155 HydrophobicContact CD2-CD2 3.5Å; L106-L155 HydrophobicContact CD2-CG 4.34Å
107E80.9Confident76Confident160 Ų16073.4 Ų73.475%0.74839%0.388SS*.Hα-helixtrans-61.4-41.7173.2-63.8-177.2176.200112.5S105 V110 H111S105-E107 PolarHBondContact O-N 2.96Å; E107-V110 PolarHBondContact O-N 3.47Å; E107-H111 PolarHBondContact O-N 3.19Å
108Q82.9Confident76.9Confident39 Ų3971.3 Ų71.318%0.18238%0.383CS..Hα-helixtrans-65.4-40175.1-72.6169.7-58.100111.3E84 L104 S105 L106 V110 H111 I112E84-Q108 HydrophobicContact CB-CB 4.48Å; E84-Q108 HydrophobicContact CG-CB 4.38Å; E84-Q108 PolarHBondContact O-NE2 3.05Å; E84-Q108 PolarHBondContact OE2-NE2 3.31Å; L104-Q108 HydrophobicContact CD2-CB 4.49Å; S105-Q108 WeakPolarHBondContact O-CB 3.37Å; S105-Q108 PolarHBondContact O-N 3.33Å; S105-Q108 VanDerWaalsContact OG-CD 3.31Å; S105-Q108 WeakPolarHBondContact OG-CG 3.41Å; S105-Q108 PolarHBondContact OG-N 3.25Å; S105-Q108 PolarHBondContact OG-OE1 3.46Å; L106-Q108 PolarHBondContact O-N 2.92Å; Q108-V110 VanDerWaalsContact C-N 3.33Å; Q108-V110 PolarHBondContact O-N 3.19Å; Q108-H111 WeakPolarHBondContact O-CB 3.3Å; Q108-H111 PolarHBondContact O-N 3.45Å; Q108-I112 VanDerWaalsContact O-CG1 3.28Å; Q108-I112 WeakPolarHBondContact O-CG1 3.03Å; Q108-I112 PolarHBondContact O-N 3.45Å
109V83.8Confident77.8Confident9 Ų974.3 Ų74.36%0.05539%0.389CS..Hα-helixtrans-61.7-43175.8178.90000110.8L104 S105 L106 H111 I112 A113 V129 I132 L133L104-V109 HydrophobicContact CB-CG2 4.3Å; S105-V109 PolarHBondContact O-N 2.97Å; S105-V109 VanDerWaalsContact O-N 3.16Å; L106-V109 PolarHBondContact O-N 3.3Å; V109-H111 VanDerWaalsContact C-N 3.33Å; V109-H111 PolarHBondContact O-N 2.9Å; V109-I112 PolarHBondContact O-N 3.21Å; V109-A113 WeakPolarHBondContact O-CB 3.36Å; V109-A113 PolarHBondContact O-N 2.86Å; V109-V129 HydrophobicContact CG1-CG1 4.11Å; V109-I132 HydrophobicContact CG1-CB 4.41Å; V109-I132 HydrophobicContact CG1-CG2 4.03Å; V109-L133 HydrophobicContact CG1-CD2 4Å; V109-L133 HydrophobicContact CG1-CG 4.18Å; V109-L133 HydrophobicContact CG2-CD2 4.34Å
110V83.6Confident78.5Confident13 Ų1366 Ų668%0.07936%0.356CS..Hα-helixtrans-63.2-39.5175.3173.50000111.2L106 E107 Q108 A113 K114 L155 V159L106-V110 HydrophobicContact CD2-CG2 4.07Å; L106-V110 WeakPolarHBondContact O-CG2 3.37Å; L106-V110 PolarHBondContact O-N 2.91Å; E107-V110 PolarHBondContact O-N 3.47Å; Q108-V110 VanDerWaalsContact C-N 3.33Å; Q108-V110 PolarHBondContact O-N 3.19Å; V110-A113 PolarHBondContact O-N 3.09Å; V110-K114 HydrophobicContact CG1-CD 4.44Å; V110-K114 WeakPolarHBondContact O-CG 3.04Å; V110-K114 PolarHBondContact O-N 3.47Å; V110-L155 HydrophobicContact CG2-CD2 4.45Å; V110-V159 HydrophobicContact CG1-CG1 3.98Å; V110-V159 HydrophobicContact CG1-CG2 4.42Å
111H85.7Confident79.3Confident108 Ų10870.2 Ų70.250%0.538%0.378SS..Hα-helixtrans-62.9-43.3175-174.367.3000112.6E107 Q108 V109 K114 T115E107-H111 PolarHBondContact O-N 3.19Å; Q108-H111 WeakPolarHBondContact O-CB 3.3Å; Q108-H111 PolarHBondContact O-N 3.45Å; V109-H111 VanDerWaalsContact C-N 3.33Å; V109-H111 PolarHBondContact O-N 2.9Å; H111-K114 PolarHBondContact O-N 3.38Å; H111-T115 PolarHBondContact O-N 3.46Å; H111-T115 VanDerWaalsContact O-N 3.09Å; H111-T115 PolarHBondContact O-OG1 3.39Å; H111-T115 VanDerWaalsContact O-OG1 3.06Å
112I85.6Confident80Confident2 Ų267.6 Ų67.61%0.0135%0.349CS..Hα-helixtrans-61.8-45174.2-65.6167.5000110.2L80 I81 E84 L104 Q108 V109 K114 T115 M116 I132L80-I112 HydrophobicContact CB-CG1 4.2Å; L80-I112 HydrophobicContact CB-CG2 3.88Å; L80-I112 HydrophobicContact CD1-CG2 4.14Å; I81-I112 HydrophobicContact CG1-CD1 4.09Å; E84-I112 HydrophobicContact CB-CD1 4.19Å; E84-I112 HydrophobicContact CG-CD1 3.83Å; E84-I112 HydrophobicContact CG-CG1 4Å; L104-I112 HydrophobicContact CD2-CD1 4.44Å; Q108-I112 VanDerWaalsContact O-CG1 3.28Å; Q108-I112 WeakPolarHBondContact O-CG1 3.03Å; Q108-I112 PolarHBondContact O-N 3.45Å; V109-I112 PolarHBondContact O-N 3.21Å; I112-K114 VanDerWaalsContact C-N 3.35Å; I112-K114 PolarHBondContact O-N 3.34Å; I112-T115 PolarHBondContact O-N 3.27Å; I112-M116 HydrophobicContact CG2-CG 4.3Å; I112-M116 WeakPolarHBondContact O-CB 3.46Å; I112-M116 WeakPolarHBondContact O-CG 3.45Å; I112-M116 PolarHBondContact O-N 2.93Å; I112-I132 HydrophobicContact CB-CG2 4.43Å; I112-I132 HydrophobicContact CG2-CD1 4Å; I112-I132 HydrophobicContact CG2-CG1 4.18Å; I112-I132 HydrophobicContact CG2-CG2 3.86Å
113A85.6Confident80.4Confident1 Ų175 Ų751%0.00837%0.367CS..Hα-helixtrans-61.4-41.817900000111.9V109 V110 T115 M116 R117 T128 V129 I132V109-A113 WeakPolarHBondContact O-CB 3.36Å; V109-A113 PolarHBondContact O-N 2.86Å; V110-A113 PolarHBondContact O-N 3.09Å; A113-T115 PolarHBondContact O-N 3.29Å; A113-M116 CarbonylContact O-C 3.56Å; A113-M116 PolarHBondContact O-N 3.08Å; A113-R117 PolarHBondContact O-N 3.25Å; A113-T128 HydrophobicContact CB-CG2 3.96Å; A113-T128 WeakPolarHBondContact O-CG2 3.43Å; A113-V129 HydrophobicContact CB-CG2 3.68Å; A113-I132 HydrophobicContact CB-CG1 4.35Å
114K85.7Confident80.8Confident109 Ų10977.9 Ų77.947%0.47437%0.369SS..Hα-helixtrans-60.6-43.1174-74.6179.7178.6-174.50111.8V110 H111 I112 M116 R117 M125V110-K114 HydrophobicContact CG1-CD 4.44Å; V110-K114 WeakPolarHBondContact O-CG 3.04Å; V110-K114 PolarHBondContact O-N 3.47Å; H111-K114 PolarHBondContact O-N 3.38Å; I112-K114 VanDerWaalsContact C-N 3.35Å; I112-K114 PolarHBondContact O-N 3.34Å; K114-M116 VanDerWaalsContact C-N 3.31Å; K114-M116 PolarHBondContact O-N 3.02Å; K114-R117 VanDerWaalsContact O-CB 3.3Å; K114-R117 WeakPolarHBondContact O-CB 3.37Å; K114-R117 PolarHBondContact O-N 3Å; K114-M125 HydrophobicContact CG-SD 4.22Å
115T85.6Confident80.9Confident58 Ų5876.1 Ų76.136%0.35636%0.359SS..Hα-helixtrans-66.3-34.1176.6-54.90000112.3L80 H111 I112 A113 P118L80-T115 HydrophobicContact CD1-CG2 4.15Å; L80-T115 HydrophobicContact CD2-CG2 4.34Å; H111-T115 PolarHBondContact O-N 3.46Å; H111-T115 VanDerWaalsContact O-N 3.09Å; H111-T115 PolarHBondContact O-OG1 3.39Å; H111-T115 VanDerWaalsContact O-OG1 3.06Å; I112-T115 PolarHBondContact O-N 3.27Å; A113-T115 PolarHBondContact O-N 3.29Å; T115-P118 WeakPolarHBondContact O-CD 3.3Å
116M84.3Confident80.7Confident24 Ų2475.4 Ų75.412%0.11835%0.351CS..Hα-helixtrans-83.6-10.7179.6-73.7-69.4-59.300113.8P75 A77 L80 I112 A113 K114 P118 R119 S120 T128 I132P75-M116 HydrophobicContact CB-SD 4.13Å; A77-M116 HydrophobicContact CB-CE 4.31Å; L80-M116 HydrophobicContact CD1-CG 3.71Å; L80-M116 HydrophobicContact CD1-SD 3.76Å; I112-M116 HydrophobicContact CG2-CG 4.3Å; I112-M116 WeakPolarHBondContact O-CB 3.46Å; I112-M116 WeakPolarHBondContact O-CG 3.45Å; I112-M116 PolarHBondContact O-N 2.93Å; A113-M116 CarbonylContact O-C 3.56Å; A113-M116 PolarHBondContact O-N 3.08Å; K114-M116 VanDerWaalsContact C-N 3.31Å; K114-M116 PolarHBondContact O-N 3.02Å; M116-P118 VanDerWaalsContact C-CD 3.42Å; M116-R119 PolarHBondContact O-N 2.68Å; M116-S120 PolarHBondContact O-N 3.11Å; M116-T128 HydrophobicContact CB-CG2 4.5Å; M116-I132 HydrophobicContact CB-CD1 4.18Å; M116-I132 HydrophobicContact CG-CD1 3.9Å
117R79.3Confident81Confident91 Ų9173 Ų7334%0.34335%0.345SS..THydrogen-bonded Turntrans-52-41.1-177.8-167.867.1174.9152.78.5114.2A113 K114 R119 S120 A122 R123 R124 T128A113-R117 PolarHBondContact O-N 3.25Å; K114-R117 VanDerWaalsContact O-CB 3.3Å; K114-R117 WeakPolarHBondContact O-CB 3.37Å; K114-R117 PolarHBondContact O-N 3Å; R117-R119 PolarHBondContact O-N 3.5Å; R117-R119 VanDerWaalsContact O-N 3.15Å; R117-S120 PolarHBondContact O-N 3.07Å; R117-A122 PolarHBondContact NH1-O 3.34Å; R117-R123 PolarHBondContact NH2-O 3.39Å; R117-R124 PolarHBondContact NH1-O 2.99Å; R117-R124 VanDerWaalsContact NH1-O 3.17Å; R117-T128 PolarHBondContact NH1-OG1 3.02Å
118P81.3Confident81Confident117 Ų11765.4 Ų65.476%0.7631%0.309SS*.THydrogen-bonded Turntrans-68-12.6178.9-20.233.7000114.7T115 M116T115-P118 WeakPolarHBondContact O-CD 3.3Å; M116-P118 VanDerWaalsContact C-CD 3.42Å
119R80.1Confident81.1Confident146 Ų14663.7 Ų63.755%0.55130%0.301SS*.THydrogen-bonded Turntrans-116.4-14.8-178.9-62.8-159.971-154.3-1.2114.1P75 M116 R117P75-R119 PolarHBondContact O-NH1 3.26Å; P75-R119 VanDerWaalsContact O-NH1 3.12Å; M116-R119 PolarHBondContact O-N 2.68Å; R117-R119 PolarHBondContact O-N 3.5Å; R117-R119 VanDerWaalsContact O-N 3.15Å
120S77.2Confident80.9Confident22 Ų2269.7 Ų69.715%0.15433%0.327CS..  trans-77.1138.8-1801720000110M116 R117 A122 T128 E131M116-S120 PolarHBondContact O-N 3.11Å; R117-S120 PolarHBondContact O-N 3.07Å; S120-A122 VanDerWaalsContact C-N 3.28Å; S120-A122 WeakPolarHBondContact OG-CB 3.14Å; S120-A122 PolarHBondContact OG-N 2.83Å; S120-T128 PolarHBondContact OG-OG1 3.01Å; S120-E131 WeakPolarHBondContact CB-OE2 3.44Å; S120-E131 PolarHBondContact OG-OE2 2.89Å
121M79Confident80.8Confident182 Ų18273 Ų7390%0.89734%0.342SS*.  trans-87.40.7177.1-64.9-65-69.200112.2
122A74.8Confident80.7Confident16 Ų1668.1 Ų68.113%0.13232%0.319CS..  trans-69.8129.7-178.500000112.9R117 S120 R124 G127 T128R117-A122 PolarHBondContact NH1-O 3.34Å; S120-A122 VanDerWaalsContact C-N 3.28Å; S120-A122 WeakPolarHBondContact OG-CB 3.14Å; S120-A122 PolarHBondContact OG-N 2.83Å; A122-R124 PolarHBondContact O-N 3.31Å; A122-G127 VanDerWaalsContact CB-C 3.46Å; A122-T128 VanDerWaalsContact CB-N 3.32Å
123R74.6Confident80.5Confident192 Ų19270.8 Ų70.873%0.72533%0.333SS*.SBendtrans-55.1-49177.5-67.6-176.8177.9-170-3.5112.6R117R117-R123 PolarHBondContact NH2-O 3.39Å
124R79.2Confident80.2Confident175 Ų17574 Ų7466%0.6637%0.366SS*.SBendtrans-113.1159.9-179-61.4-174.7-175169.91.7111.3R117 A122 N126 G127 T128R117-R124 PolarHBondContact NH1-O 2.99Å; R117-R124 VanDerWaalsContact NH1-O 3.17Å; A122-R124 PolarHBondContact O-N 3.31Å; R124-N126 PolarHBondContact O-N 2.83Å; R124-G127 PolarHBondContact O-N 3.46Å; R124-T128 PolarHBondContact O-N 3.27Å
125M75.2Confident79.9Confident8 Ų872.1 Ų72.14%0.03937%0.367CS..Hα-helixtrans-61.9-30.3176.8-179.5158.440.300111.9K114 G127 T128 V129 V159 S163K114-M125 HydrophobicContact CG-SD 4.22Å; M125-G127 PolarHBondContact O-N 2.96Å; M125-T128 CarbonylContact O-C 3.59Å; M125-T128 WeakPolarHBondContact O-CA 3.36Å; M125-T128 WeakPolarHBondContact O-CB 3.2Å; M125-T128 PolarHBondContact O-N 2.96Å; M125-V129 HydrophobicContact CG-CG2 4.36Å; M125-V129 WeakPolarHBondContact O-CG2 3.49Å; M125-V129 PolarHBondContact O-N 3.03Å; M125-V159 HydrophobicContact CE-CB 3.48Å; M125-V159 VanDerWaalsContact CE-CB 3.48Å; M125-V159 HydrophobicContact CE-CG1 3.13Å; M125-V159 WeakPolarHBondContact CE-O 3.43Å; M125-V159 HydrophobicContact SD-CB 4.28Å; M125-V159 HydrophobicContact SD-CG1 3.5Å; M125-V159 VanDerWaalsContact SD-CG1 3.5Å; M125-S163 WeakPolarHBondContact CE-OG 3.45Å
126N74.9Confident79.2Confident36 Ų3671.4 Ų71.419%0.19336%0.362CS..Hα-helixtrans-56.4-38.2172.2-53.8-8.2000111.9R124 K130 L156 D160R124-N126 PolarHBondContact O-N 2.83Å; N126-K130 WeakPolarHBondContact O-CB 3.35Å; N126-K130 VanDerWaalsContact O-CG 3.29Å; N126-K130 WeakPolarHBondContact O-CG 3.3Å; N126-K130 PolarHBondContact O-N 3.01Å; N126-L156 HydrophobicContact CB-CD1 3.91Å; N126-L156 HydrophobicContact CB-CD2 4.28Å; N126-L156 WeakPolarHBondContact OD1-CB 3.45Å; N126-L156 VanDerWaalsContact OD1-CD2 3.29Å; N126-L156 WeakPolarHBondContact OD1-CD2 3.39Å; N126-D160 VanDerWaalsContact CG-OD2 3.31Å; N126-D160 PolarHBondContact ND2-OD2 3.27Å; N126-D160 PolarHBondContact OD1-OD2 3.29Å
127G81.3Confident78.2Confident25 Ų2579.3 Ų79.326%0.25840%0.399SS..Hα-helixtrans-69.5-41.9174.400000111.8A122 R124 M125 V129 K130 E131A122-G127 VanDerWaalsContact CB-C 3.46Å; R124-G127 PolarHBondContact O-N 3.46Å; M125-G127 PolarHBondContact O-N 2.96Å; G127-V129 PolarHBondContact O-N 3.5Å; G127-K130 PolarHBondContact O-N 3.49Å; G127-E131 WeakPolarHBondContact O-CG 3.19Å; G127-E131 PolarHBondContact O-N 3.16Å
128T81.5Confident77Confident1 Ų177.9 Ų77.91%0.00640%0.4CS..Hα-helixtrans-62.5-41.7176-53.10000111.5A113 M116 R117 S120 A122 R124 M125 E131 I132A113-T128 HydrophobicContact CB-CG2 3.96Å; A113-T128 WeakPolarHBondContact O-CG2 3.43Å; M116-T128 HydrophobicContact CB-CG2 4.5Å; R117-T128 PolarHBondContact NH1-OG1 3.02Å; S120-T128 PolarHBondContact OG-OG1 3.01Å; A122-T128 VanDerWaalsContact CB-N 3.32Å; R124-T128 PolarHBondContact O-N 3.27Å; M125-T128 CarbonylContact O-C 3.59Å; M125-T128 WeakPolarHBondContact O-CA 3.36Å; M125-T128 WeakPolarHBondContact O-CB 3.2Å; M125-T128 PolarHBondContact O-N 2.96Å; T128-E131 WeakPolarHBondContact O-CB 3.29Å; T128-E131 PolarHBondContact O-N 3.41Å; T128-I132 WeakPolarHBondContact O-CG1 3.49Å; T128-I132 PolarHBondContact O-N 2.91Å
129V83.9Confident75.1Confident2 Ų275.5 Ų75.51%0.01239%0.386CS..Hα-helixtrans-62.7-45175.2174.50000110.7V109 A113 M125 G127 E131 I132 L133 F152 L156V109-V129 HydrophobicContact CG1-CG1 4.11Å; A113-V129 HydrophobicContact CB-CG2 3.68Å; M125-V129 HydrophobicContact CG-CG2 4.36Å; M125-V129 WeakPolarHBondContact O-CG2 3.49Å; M125-V129 PolarHBondContact O-N 3.03Å; G127-V129 PolarHBondContact O-N 3.5Å; V129-E131 VanDerWaalsContact C-N 3.33Å; V129-E131 PolarHBondContact O-N 3.15Å; V129-I132 PolarHBondContact O-N 3.13Å; V129-L133 HydrophobicContact CG1-CD1 4.05Å; V129-L133 HydrophobicContact CG1-CG 4.41Å; V129-L133 WeakPolarHBondContact O-CG 3.19Å; V129-L133 PolarHBondContact O-N 2.85Å; V129-F152 HydrophobicContact CG1-CZ 4.17Å; V129-L156 HydrophobicContact CB-CD2 4.35Å; V129-L156 HydrophobicContact CG1-CD2 4.48Å; V129-L156 HydrophobicContact CG2-CD2 4.22Å
130K80.4Confident73.3Confident135 Ų13573 Ų7359%0.58739%0.389SS*.Hα-helixtrans-61.4-37.1175.2-74.2179.9179.7-169.70112.9N126 G127 L133 G134N126-K130 WeakPolarHBondContact O-CB 3.35Å; N126-K130 VanDerWaalsContact O-CG 3.29Å; N126-K130 WeakPolarHBondContact O-CG 3.3Å; N126-K130 PolarHBondContact O-N 3.01Å; G127-K130 PolarHBondContact O-N 3.49Å; K130-L133 PolarHBondContact O-N 2.93Å; K130-G134 PolarHBondContact O-N 2.76Å
131E81.7Confident71.4Confident84 Ų8478.9 Ų78.939%0.39342%0.418SS..Hα-helixtrans-64.1-41.6174.2-74.9174.2-178.100112.2S120 G127 T128 V129 G134 S135S120-E131 WeakPolarHBondContact CB-OE2 3.44Å; S120-E131 PolarHBondContact OG-OE2 2.89Å; G127-E131 WeakPolarHBondContact O-CG 3.19Å; G127-E131 PolarHBondContact O-N 3.16Å; T128-E131 WeakPolarHBondContact O-CB 3.29Å; T128-E131 PolarHBondContact O-N 3.41Å; V129-E131 VanDerWaalsContact C-N 3.33Å; V129-E131 PolarHBondContact O-N 3.15Å; E131-G134 PolarHBondContact O-N 3.29Å; E131-S135 PolarHBondContact O-N 3.31Å; E131-S135 PolarHBondContact O-OG 3.23Å
132I83.4Confident69.7Low5 Ų575 Ų753%0.02639%0.394CS..Hα-helixtrans-67.9-43176.7-61.7-56.2000110.6A77 I81 V109 I112 A113 M116 T128 V129 G134 S135 V136A77-I132 HydrophobicContact CB-CD1 3.85Å; I81-I132 HydrophobicContact CD1-CG2 4.32Å; I81-I132 HydrophobicContact CG1-CG2 4.41Å; V109-I132 HydrophobicContact CG1-CB 4.41Å; V109-I132 HydrophobicContact CG1-CG2 4.03Å; I112-I132 HydrophobicContact CB-CG2 4.43Å; I112-I132 HydrophobicContact CG2-CD1 4Å; I112-I132 HydrophobicContact CG2-CG1 4.18Å; I112-I132 HydrophobicContact CG2-CG2 3.86Å; A113-I132 HydrophobicContact CB-CG1 4.35Å; M116-I132 HydrophobicContact CB-CD1 4.18Å; M116-I132 HydrophobicContact CG-CD1 3.9Å; T128-I132 WeakPolarHBondContact O-CG1 3.49Å; T128-I132 PolarHBondContact O-N 2.91Å; V129-I132 PolarHBondContact O-N 3.13Å; I132-G134 VanDerWaalsContact C-N 3.34Å; I132-G134 PolarHBondContact O-N 3.32Å; I132-S135 WeakPolarHBondContact O-CB 3.49Å; I132-S135 PolarHBondContact O-N 3.15Å; I132-S135 VanDerWaalsContact O-N 3.07Å; I132-V136 PolarHBondContact O-N 3.02Å
133L81Confident68.1Low57 Ų5780.3 Ų80.330%0.29842%0.416SS..Hα-helixtrans-61-42.1175.1-71173.4000111.6V109 V129 K130 S135 V136 F152V109-L133 HydrophobicContact CG1-CD2 4Å; V109-L133 HydrophobicContact CG1-CG 4.18Å; V109-L133 HydrophobicContact CG2-CD2 4.34Å; V129-L133 HydrophobicContact CG1-CD1 4.05Å; V129-L133 HydrophobicContact CG1-CG 4.41Å; V129-L133 WeakPolarHBondContact O-CG 3.19Å; V129-L133 PolarHBondContact O-N 2.85Å; K130-L133 PolarHBondContact O-N 2.93Å; L133-S135 PolarHBondContact O-N 2.86Å; L133-V136 PolarHBondContact O-N 2.8Å; L133-F152 HydrophobicContact CD1-CE2 4.2Å; L133-F152 HydrophobicContact CD1-CZ 3.93Å
134G80Confident66.4Low68 Ų6879.4 Ų79.470%0.70142%0.42SS*.Hα-helixtrans-66.3-17.4174.800000114.5K130 E131 I132K130-G134 PolarHBondContact O-N 2.76Å; E131-G134 PolarHBondContact O-N 3.29Å; I132-G134 VanDerWaalsContact C-N 3.34Å; I132-G134 PolarHBondContact O-N 3.32Å
135S78.9Confident64.3Low71 Ų7178.8 Ų78.850%0.49743%0.427SS..Hα-helixtrans-82-20.4173-58.70000112.9E131 I132 L133E131-S135 PolarHBondContact O-N 3.31Å; E131-S135 PolarHBondContact O-OG 3.23Å; I132-S135 WeakPolarHBondContact O-CB 3.49Å; I132-S135 PolarHBondContact O-N 3.15Å; I132-S135 VanDerWaalsContact O-N 3.07Å; L133-S135 PolarHBondContact O-N 2.86Å
136V72.4Confident62.9Low42 Ų4283.8 Ų83.826%0.25545%0.452SS..SBendtrans-88.9118.6170.9-176.80000105.8I81 L104 I132 L133 V138I81-V136 HydrophobicContact CD1-CG2 3.69Å; I81-V136 HydrophobicContact CG1-CG2 4.22Å; I81-V136 HydrophobicContact CG2-CG2 4.06Å; L104-V136 HydrophobicContact CD1-CG2 4.25Å; I132-V136 PolarHBondContact O-N 3.02Å; L133-V136 PolarHBondContact O-N 2.8Å; V136-V138 VanDerWaalsContact C-N 3.26Å; V136-V138 PolarHBondContact O-N 3.06Å
137E62.7Low61.2Low190 Ų19087 Ų8789%0.88848%0.477SS*.  trans-64.397.4169-170.2177.3177.900106.8S139E137-S139 PolarHBondContact O-N 3.37Å
138V54Low59.1Low62 Ų6287.5 Ų87.538%0.37648%0.483SS..  trans-67.1106.7174.6-176.50000104.8V136 Y142V136-V138 VanDerWaalsContact C-N 3.26Å; V136-V138 PolarHBondContact O-N 3.06Å; V138-Y142 HydrophobicContact CG1-CD2 4.48Å
139S40.9Very low57.5Low66 Ų6695 Ų9546%0.46252%0.518SS..  trans-59133.3166.7-159.70000106.5E137 L141 Y142E137-S139 PolarHBondContact O-N 3.37Å; S139-L141 PolarHBondContact O-N 3.04Å; S139-Y142 PolarHBondContact O-N 3.24Å
140P42.2Very low55.9Low93 Ų93101.3 Ų101.360%0.60455%0.552SS**G310 helixtrans-59.5-2.3-170.918.3-30.8000114.8Y142 E143P140-Y142 PolarHBondContact O-N 3.48Å; P140-E143 WeakPolarHBondContact O-CB 3.49Å; P140-E143 PolarHBondContact O-N 3.47Å
141L38Very low54.7Low146 Ų146101.2 Ų101.276%0.76456%0.557SS**G310 helixtrans-74.1-3.7174.7-61177.8000114.5S139S139-L141 PolarHBondContact O-N 3.04Å
142Y43.1Very low53.3Low102 Ų10299.6 Ų99.640%0.455%0.549SS..G310 helixtrans-107.5-3170.2-58.8-74000113.7N103 V138 S139 P140 E144 M145N103-Y142 PolarHBondContact OD1-OH 3.47Å; V138-Y142 HydrophobicContact CG1-CD2 4.48Å; S139-Y142 PolarHBondContact O-N 3.24Å; P140-Y142 PolarHBondContact O-N 3.48Å; Y142-E144 PolarHBondContact O-N 2.89Å; Y142-M145 PolarHBondContact O-N 3.22Å
143E41.1Very low51.9Low126 Ų126103.1 Ų103.159%0.58957%0.573SS**G310 helixtrans-60.3-29.8175.7-139.1103.4-147.300110.9P140 M145P140-E143 WeakPolarHBondContact O-CB 3.49Å; P140-E143 PolarHBondContact O-N 3.47Å; E143-M145 VanDerWaalsContact C-N 3.35Å; E143-M145 PolarHBondContact O-N 3.46Å
144E37.6Very low50.6Low173 Ų173102.7 Ų102.781%0.80858%0.578SS**G310 helixtrans-79.2-8.1176.7-69-173166.400114.7Y142Y142-E144 PolarHBondContact O-N 2.89Å
145M36.8Very low49.5Very low163 Ų163103 Ų10380%0.80356%0.563SS**G310 helixtrans-98.5-9.1173.3-74.6-170168.300113.4Y142 E143Y142-M145 PolarHBondContact O-N 3.22Å; E143-M145 VanDerWaalsContact C-N 3.35Å; E143-M145 PolarHBondContact O-N 3.46Å
146I44.8Very low48.3Very low112 Ų112100.1 Ų100.157%0.57454%0.542SS*.SBendtrans-96.12.6-179.1-60.2173.7000111.4G148I146-G148 PolarHBondContact O-N 2.9Å
147S39.6Very low47.5Very low104 Ų104101.1 Ų101.173%0.72755%0.554SS**  trans-73.714.2175.979.30000115.1
148G36.6Very low47.2Very low36 Ų3699.4 Ų99.437%0.37154%0.544SS..  trans-103.677.2165.700000109.6I146 D150 D151I146-G148 PolarHBondContact O-N 2.9Å; G148-D150 PolarHBondContact O-N 3.02Å; G148-D151 PolarHBondContact O-N 3.19Å
149E47.9Very low47.3Very low158 Ų15897.2 Ų97.274%0.73853%0.531SS*.Hα-helixtrans-56-22179.2-71.7-174.5137.400112.8C153E149-C153 WeakPolarHBondContact O-CB 3.32Å; E149-C153 PolarHBondContact O-N 3.25Å; E149-C153 PolarHBondContact O-SG 3.07Å
150D50.2Low47.7Very low135 Ų13596.5 Ų96.572%0.72252%0.522SS*.Hα-helixtrans-78.3-37.6-175.7-63.4-34000114G148 A154G148-D150 PolarHBondContact O-N 3.02Å; D150-A154 WeakPolarHBondContact O-CB 3.29Å; D150-A154 PolarHBondContact O-N 3.22Å
151D55.5Low48.3Very low132 Ų13295.4 Ų95.471%0.70652%0.521SS*.Hα-helixtrans-77.7-37-176.3-78.3-22.4000112.2G148 L155G148-D151 PolarHBondContact O-N 3.19Å; D151-L155 VanDerWaalsContact O-CB 3.3Å; D151-L155 WeakPolarHBondContact O-CB 3.47Å; D151-L155 PolarHBondContact O-N 3.01Å
152F53.4Low49Very low50 Ų5095.2 Ų95.222%0.21952%0.52CS..Hα-helixtrans-68.6-42.2177.8-167.2-104.4000111.1L106 V129 L133 L156L106-F152 HydrophobicContact CD1-CD2 3.75Å; L106-F152 HydrophobicContact CD1-CE2 3.83Å; V129-F152 HydrophobicContact CG1-CZ 4.17Å; L133-F152 HydrophobicContact CD1-CE2 4.2Å; L133-F152 HydrophobicContact CD1-CZ 3.93Å; F152-L156 HydrophobicContact CD1-CD1 3.55Å; F152-L156 HydrophobicContact CD1-CG 4.3Å; F152-L156 HydrophobicContact CE1-CD1 3.3Å; F152-L156 HydrophobicContact CE1-CG 4.18Å; F152-L156 HydrophobicContact CG-CD1 4.4Å; F152-L156 HydrophobicContact CZ-CD1 3.96Å; F152-L156 HydrophobicContact CZ-CG 4.47Å; F152-L156 VanDerWaalsContact O-CB 3.26Å; F152-L156 WeakPolarHBondContact O-CB 3.35Å; F152-L156 WeakPolarHBondContact O-CG 3.49Å; F152-L156 PolarHBondContact O-N 3.05Å
153C52.9Low49.1Very low80 Ų8093.2 Ų93.254%0.54152%0.522SS..Hα-helixtrans-67.8-40.3175.7-68.70000112.1E149 A157E149-C153 WeakPolarHBondContact O-CB 3.32Å; E149-C153 PolarHBondContact O-N 3.25Å; E149-C153 PolarHBondContact O-SG 3.07Å; C153-A157 VanDerWaalsContact O-CB 3.28Å; C153-A157 WeakPolarHBondContact O-CB 3.37Å; C153-A157 PolarHBondContact O-N 2.57Å
154A54.8Low49Very low47 Ų4794.4 Ų94.439%0.38853%0.532SS..Hα-helixtrans-66.4-38.4177.400000112.6D150 K158D150-A154 WeakPolarHBondContact O-CB 3.29Å; D150-A154 PolarHBondContact O-N 3.22Å; A154-K158 WeakPolarHBondContact O-CG 3.26Å; A154-K158 PolarHBondContact O-N 3.42Å; A154-K158 VanDerWaalsContact O-N 3.13Å
155L55.6Low49.2Very low76 Ų7694.7 Ų94.740%0.39853%0.533SS..Hα-helixtrans-71.8-43.8178.3-156.7144.8000110.7L106 V110 D151 A157 K158 V159L106-L155 HydrophobicContact CD2-CD1 4.06Å; L106-L155 HydrophobicContact CD2-CD2 3.5Å; L106-L155 HydrophobicContact CD2-CG 4.34Å; V110-L155 HydrophobicContact CG2-CD2 4.45Å; D151-L155 VanDerWaalsContact O-CB 3.3Å; D151-L155 WeakPolarHBondContact O-CB 3.47Å; D151-L155 PolarHBondContact O-N 3.01Å; L155-A157 VanDerWaalsContact C-N 3.33Å; L155-A157 PolarHBondContact O-N 3.3Å; L155-K158 PolarHBondContact O-N 2.87Å; L155-K158 VanDerWaalsContact O-N 3.16Å; L155-V159 HydrophobicContact CD2-CG2 3.96Å; L155-V159 WeakPolarHBondContact O-CG2 3.28Å; L155-V159 PolarHBondContact O-N 3.46Å
156L54.6Low49.5Very low10 Ų1092 Ų925%0.05253%0.526CS..Hα-helixtrans-59.4-39172.4-76-179.5000113.1N126 V129 F152 K158 V159 D160N126-L156 HydrophobicContact CB-CD1 3.91Å; N126-L156 HydrophobicContact CB-CD2 4.28Å; N126-L156 WeakPolarHBondContact OD1-CB 3.45Å; N126-L156 VanDerWaalsContact OD1-CD2 3.29Å; N126-L156 WeakPolarHBondContact OD1-CD2 3.39Å; V129-L156 HydrophobicContact CB-CD2 4.35Å; V129-L156 HydrophobicContact CG1-CD2 4.48Å; V129-L156 HydrophobicContact CG2-CD2 4.22Å; F152-L156 HydrophobicContact CD1-CD1 3.55Å; F152-L156 HydrophobicContact CD1-CG 4.3Å; F152-L156 HydrophobicContact CE1-CD1 3.3Å; F152-L156 HydrophobicContact CE1-CG 4.18Å; F152-L156 HydrophobicContact CG-CD1 4.4Å; F152-L156 HydrophobicContact CZ-CD1 3.96Å; F152-L156 HydrophobicContact CZ-CG 4.47Å; F152-L156 VanDerWaalsContact O-CB 3.26Å; F152-L156 WeakPolarHBondContact O-CB 3.35Å; F152-L156 WeakPolarHBondContact O-CG 3.49Å; F152-L156 PolarHBondContact O-N 3.05Å; L156-K158 PolarHBondContact O-N 3.35Å; L156-V159 PolarHBondContact O-N 3.18Å; L156-D160 WeakPolarHBondContact O-CB 3.36Å; L156-D160 PolarHBondContact O-N 3.06Å
157A55.3Low49.4Very low62 Ų6292 Ų9251%0.51253%0.531SS..Hα-helixtrans-65.9-34.7175.100000113C153 L155 A161C153-A157 VanDerWaalsContact O-CB 3.28Å; C153-A157 WeakPolarHBondContact O-CB 3.37Å; C153-A157 PolarHBondContact O-N 2.57Å; L155-A157 VanDerWaalsContact C-N 3.33Å; L155-A157 PolarHBondContact O-N 3.3Å; A157-A161 PolarHBondContact O-N 3.17Å
158K57.3Low49.8Very low155 Ų15593.3 Ų93.367%0.67453%0.53SS*.Hα-helixtrans-69.3-38.4172.2-73173.9-177.6173.10111.8A154 L155 L156 A161A154-K158 WeakPolarHBondContact O-CG 3.26Å; A154-K158 PolarHBondContact O-N 3.42Å; A154-K158 VanDerWaalsContact O-N 3.13Å; L155-K158 PolarHBondContact O-N 2.87Å; L155-K158 VanDerWaalsContact O-N 3.16Å; L156-K158 PolarHBondContact O-N 3.35Å; K158-A161 PolarHBondContact O-N 3.03Å
159V54.8Low50.1Low15 Ų1599.7 Ų99.79%0.09155%0.548CS..Hα-helixtrans-72.4-39179.6-150.20000111.2V110 M125 L155 L156 A161 D162V110-V159 HydrophobicContact CG1-CG1 3.98Å; V110-V159 HydrophobicContact CG1-CG2 4.42Å; M125-V159 HydrophobicContact CE-CB 3.48Å; M125-V159 VanDerWaalsContact CE-CB 3.48Å; M125-V159 HydrophobicContact CE-CG1 3.13Å; M125-V159 WeakPolarHBondContact CE-O 3.43Å; M125-V159 HydrophobicContact SD-CB 4.28Å; M125-V159 HydrophobicContact SD-CG1 3.5Å; M125-V159 VanDerWaalsContact SD-CG1 3.5Å; L155-V159 HydrophobicContact CD2-CG2 3.96Å; L155-V159 WeakPolarHBondContact O-CG2 3.28Å; L155-V159 PolarHBondContact O-N 3.46Å; L156-V159 PolarHBondContact O-N 3.18Å; V159-A161 PolarHBondContact O-N 3Å; V159-D162 PolarHBondContact O-N 2.97Å
160D50.5Low50Low51 Ų5196.7 Ų96.727%0.27353%0.534SS..Hα-helixtrans-62.9-26.3176.6-83.8-25.3000112.6N126 L156N126-D160 VanDerWaalsContact CG-OD2 3.31Å; N126-D160 PolarHBondContact ND2-OD2 3.27Å; N126-D160 PolarHBondContact OD1-OD2 3.29Å; L156-D160 WeakPolarHBondContact O-CB 3.36Å; L156-D160 PolarHBondContact O-N 3.06Å
161A52.9Low49.9Very low71 Ų7197.3 Ų97.359%0.58753%0.53SS*.Hα-helixtrans-72.4-26.717800000114A157 K158 V159A157-A161 PolarHBondContact O-N 3.17Å; K158-A161 PolarHBondContact O-N 3.03Å; V159-A161 PolarHBondContact O-N 3Å
162D52.7Low49.5Very low141 Ų14193.5 Ų93.575%0.75452%0.517SS*.Hα-helixtrans-90.6-9.1-175.2-75.7-20.9000113.8V159V159-D162 PolarHBondContact O-N 2.97Å
163S45.3Very low49.3Very low61 Ų6195.4 Ų95.443%0.42753%0.529SS..  trans-110.957.8-176.652.70000112.7M125 E165M125-S163 WeakPolarHBondContact CE-OG 3.45Å; S163-E165 PolarHBondContact O-N 3.31Å; S163-E165 VanDerWaalsContact O-N 3.08Å
164N39.2Very low48.9Very low150 Ų15094.6 Ų94.680%0.80252%0.524SS*.  trans-81.357171.9-116.4-4.9000111.3
165E41.9Very low48.9Very low179 Ų17998.9 Ų98.984%0.83654%0.54SS*.  trans-136.285.4166.7-75.4-169.9168.800108.7S163 T167S163-E165 PolarHBondContact O-N 3.31Å; S163-E165 VanDerWaalsContact O-N 3.08Å; E165-T167 PolarHBondContact O-N 3.38Å
166V44.4Very low48.6Very low107 Ų107101.2 Ų101.265%0.64855%0.551SS**  trans-68.798173.8-179.60000107.8H170V166-H170 HydrophobicContact CG1-CB 3.83Å
167T42.3Very low48.1Very low112 Ų112105.6 Ų105.669%0.68758%0.575SS**  trans-59.8134.9174.751.10000110.9E165 F169 H170E165-T167 PolarHBondContact O-N 3.38Å; T167-F169 PolarHBondContact O-N 3.23Å; T167-H170 PolarHBondContact O-N 3.3Å
168D48.7Very low47.4Very low131 Ų131108.1 Ų108.170%0.70158%0.584SS**THydrogen-bonded Turntrans-50.4-6.4-164.4-62.8-54.7000118.4
169F41.4Very low46.6Very low170 Ų170109.7 Ų109.775%0.74659%0.593SS**Hα-helixtrans-71.7-28.5174.7-109.2-93.7000113.6T167 A172 L173T167-F169 PolarHBondContact O-N 3.23Å; F169-A172 WeakPolarHBondContact O-CB 3.44Å; F169-A172 PolarHBondContact O-N 3.04Å; F169-L173 PolarHBondContact O-N 2.74Å
170H45.9Very low45.9Very low96 Ų96113 Ų11344%0.44462%0.623SS.*Hα-helixtrans-77.3-26.1-176.1-135.7-64.4000113.1V166 T167 A172 S174V166-H170 HydrophobicContact CG1-CB 3.83Å; T167-H170 PolarHBondContact O-N 3.3Å; H170-A172 VanDerWaalsContact C-N 3.3Å; H170-S174 PolarHBondContact O-N 3.25Å; H170-S174 PolarHBondContact O-OG 3.3Å
171K49.2Very low45.1Very low147 Ų147119.4 Ų119.464%0.63965%0.651SS**Hα-helixtrans-67.7-31168.2-89.2178178.9168.40112.1S174K171-S174 PolarHBondContact O-OG 2.89Å; K171-S174 VanDerWaalsContact O-OG 3.04Å
172A46.4Very low43.9Very low52 Ų52125 Ų12543%0.4366%0.662SS.*Hα-helixtrans-73.4-38.1178.900000112.1F169 H170F169-A172 WeakPolarHBondContact O-CB 3.44Å; F169-A172 PolarHBondContact O-N 3.04Å; H170-A172 VanDerWaalsContact C-N 3.3Å
173L50Low42.8Very low91 Ų91123.5 Ų123.548%0.47666%0.659SS.*Hα-helixtrans-72.4-37.3175.4-98.197000113.2F169 L175 I176 D177F169-L173 PolarHBondContact O-N 2.74Å; L173-L175 PolarHBondContact O-N 3.32Å; L173-I176 PolarHBondContact O-N 3.32Å; L173-D177 PolarHBondContact O-N 3.23Å
174S44.8Very low42Very low63 Ų63127.1 Ų127.144%0.44168%0.678SS.*Hα-helixtrans-64.7-24.7179.456.80000113.5H170 K171 I176 T178H170-S174 PolarHBondContact O-N 3.25Å; H170-S174 PolarHBondContact O-OG 3.3Å; K171-S174 PolarHBondContact O-OG 2.89Å; K171-S174 VanDerWaalsContact O-OG 3.04Å; S174-I176 VanDerWaalsContact C-N 3.29Å; S174-T178 PolarHBondContact O-OG1 3.04Å
175L54Low41.4Very low136 Ų136124.9 Ų124.971%0.71267%0.674SS**THydrogen-bonded Turntrans-76.1-16.4175.4-76.2164.3000113.1L173L173-L175 PolarHBondContact O-N 3.32Å
176I49.8Very low41Very low125 Ų125122.7 Ų122.764%0.64167%0.673SS**THydrogen-bonded Turntrans-96.8-30.2-177.2-62.4170.3000111.4L173 S174 T178L173-I176 PolarHBondContact O-N 3.32Å; S174-I176 VanDerWaalsContact C-N 3.29Å; I176-T178 VanDerWaalsContact C-N 3.29Å; I176-T178 PolarHBondContact O-N 3.06Å
177D42.5Very low40.2Very low103 Ų103124.1 Ų124.155%0.55168%0.677SS**G310 helixtrans-75.9-11.3-179.7-73.7-27000114.2L173L173-D177 PolarHBondContact O-N 3.23Å
178T41.5Very low39.6Very low114 Ų114124.4 Ų124.470%0.69967%0.674SS**G310 helixtrans-87-10.7-172.8-33.30000113.6S174 I176S174-T178 PolarHBondContact O-OG1 3.04Å; I176-T178 VanDerWaalsContact C-N 3.29Å; I176-T178 PolarHBondContact O-N 3.06Å
179E39.7Very low38.6Very low188 Ų188125.4 Ų125.488%0.87968%0.675SS**G310 helixtrans-98.2-0.2179.6-69.1-173.616500113.9
180A40.7Very low37.9Very low85 Ų85124 Ų12470%0.70268%0.68SS**SBendtrans-108.110.6-171.300000115.9
181Q33.8Very low37Very low185 Ų185123.1 Ų123.186%0.86470%0.698SS**  trans-116.692.2-179.6-64.4-165.8600112.9
182F28.1Very low35.9Very low189 Ų189121.2 Ų121.283%0.82970%0.702SS**  trans-137.8126.1152.9-164.7-109.6000109.3
183T28.6Very low34.9Very low110 Ų110124.2 Ų124.268%0.67572%0.72SS**SBendtrans76.6124.4178.181.70000114.4
184T30.4Very low33.9Very low136 Ų136123.7 Ų123.783%0.83474%0.737SS**  cis-156.6133.813.137.40000109.3
185S25.5Very low32.8Very low104 Ų104127.6 Ų127.673%0.72775%0.753SS**  trans-76.9146.8162.949.50000111.6
186V34.5Very low31.7Very low133 Ų133128.8 Ų128.881%0.80676%0.759SS**  -177.6134.2113.3166.90000109.5
187D26.6Very low30.6Very low137 Ų137128.5 Ų128.573%0.73376%0.763SS**  trans-61.5170.1-178.6-43.6-69.7000112.4
188N28.9Very low29.9Very low118 Ų118129.3 Ų129.363%0.63177%0.772SS**  cis-175.1149.242.5-152.221000110.6
189E28.5Very low29.3Very low151 Ų151132.5 Ų132.571%0.70678%0.779SS**  trans34.1136.3140.3-67.7167.9174.700120.6
190T26.5Very low29.2Very low140 Ų140128.8 Ų128.886%0.85977%0.769SS**  -179.8148.961.3-2.40000111.2
191G27.3Very low28.7Very low79 Ų79132.1 Ų132.181%0.81478%0.775SS**  trans82.7147.5148.500000118.9
192S24.9Very low28.7Very low106 Ų106129.4 Ų129.474%0.74177%0.766SS**  cis-179.3139.9-22.2171.30000105.5
193S26.2Very low28.9Very low115 Ų115124.4 Ų124.480%0.80476%0.76SS**  trans60.1123.3148.254.70000121
194G28.3Very low28.9Very low80 Ų80127 Ų12783%0.82577%0.77SS**  trans163.874.2159.500000114.9
195D23.7Very low29Very low146 Ų146124.8 Ų124.878%0.78177%0.765SS**  trans-53.2131.1169.2-176.520.4000112.8
196L30.6Very low29.4Very low160 Ų160128.7 Ų128.784%0.83877%0.771SS**  trans-170.299.3157.3-106142.3000110.7T198L196-T198 PolarHBondContact O-N 3.36Å
197T25.3Very low29.4Very low119 Ų119129.9 Ų129.973%0.7377%0.768SS**  trans-45.5124.916453.40000112.4
198T29.4Very low29.6Very low121 Ų121130.5 Ų130.574%0.74277%0.767SS**  trans-154.296.4152.6-12.10000109L196 V200L196-T198 PolarHBondContact O-N 3.36Å; T198-V200 PolarHBondContact O-N 3.03Å
199E28.9Very low29.8Very low181 Ų181134 Ų13485%0.84678%0.776SS**  trans-61.7122.9165-61.5-159.6132.800108.8
200V36.7Very low29.9Very low110 Ų110129.8 Ų129.867%0.66776%0.763SS**  trans-130.2104.7166.3-156.40000107.1T198 L202T198-V200 PolarHBondContact O-N 3.03Å; V200-L202 HydrophobicContact CB-CD1 4.47Å; V200-L202 HydrophobicContact CG1-CD1 4.07Å; V200-L202 PolarHBondContact O-N 2.99Å
201D29.3Very low30Very low155 Ų155132.1 Ų132.183%0.82977%0.765SS**  trans-53.5104170-71.1-50.6000110.4
202L34.9Very low30.2Very low127 Ų127131.7 Ų131.767%0.66575%0.753SS**  trans-11466164.5-100.487000109.3V200V200-L202 HydrophobicContact CB-CD1 4.47Å; V200-L202 HydrophobicContact CG1-CD1 4.07Å; V200-L202 PolarHBondContact O-N 2.99Å
203A31.1Very low30.6Very low85 Ų85133.7 Ų133.770%0.70276%0.756SS**  trans-91.9144.7157.700000109.2
204D29.4Very low30.9Very low165 Ų165136.8 Ų136.888%0.88276%0.757SS**  trans75.785.6170.4-69.3-21.7000119.1
205A33.7Very low31.2Very low89 Ų89140.6 Ų140.674%0.73676%0.759SS**  trans-137.482.6142.200000109.8E207A205-E207 PolarHBondContact O-N 3.27Å
206Q32.7Very low31.8Very low185 Ų185138.2 Ų138.286%0.86475%0.754SS**  trans2986.5155.3-64.2-179.5-43.600116.7E208Q206-E208 PolarHBondContact O-N 3Å; Q206-E208 VanDerWaalsContact O-N 3.14Å
207E35.4Very low32.3Very low158 Ų158136 Ų13674%0.73875%0.747SS**  trans-66.6100.9149.5-84.4-178.9167.300107.9A205 K209A205-E207 PolarHBondContact O-N 3.27Å; E207-K209 VanDerWaalsContact C-N 3.3Å; E207-K209 PolarHBondContact O-N 3.36Å
208E31Very low33.3Very low151 Ų151135 Ų13571%0.70675%0.75SS**  trans-62.596.4160.1-80.1-166.1158.800108.3Q206 S210 K256Q206-E208 PolarHBondContact O-N 3Å; Q206-E208 VanDerWaalsContact O-N 3.14Å; E208-S210 PolarHBondContact O-N 3.37Å; E208-K256 IonicContact OE2-NZ 2.7Å; E208-K256 PolarHBondContact OE2-NZ 3.13Å
209K31.3Very low33.9Very low191 Ų191133.9 Ų133.983%0.8375%0.753SS**  trans-59.396.5164.7-81.5178.9174.3175.80109.1E207E207-K209 VanDerWaalsContact C-N 3.3Å; E207-K209 PolarHBondContact O-N 3.36Å
210S31.6Very low34.9Very low62 Ų62128 Ų12843%0.43473%0.733SS.*  trans-79.7113.5157.355.10000108.4E208 A212E208-S210 PolarHBondContact O-N 3.37Å; S210-A212 PolarHBondContact O-N 3.47Å
211E28.4Very low35.4Very low190 Ų190126 Ų12689%0.88872%0.723SS**  trans-54113.5171.3-61171.915400110.5
212A32.5Very low36.5Very low69 Ų69125 Ų12557%0.5772%0.718SS**  trans-153.8118.2164.300000110.9S210S210-A212 PolarHBondContact O-N 3.47Å
213D31.5Very low37.6Very low149 Ų149121.5 Ų121.580%0.79771%0.707SS**  trans64.196.4156.2-60.5-22.6000120.5N215D213-N215 PolarHBondContact O-N 3.48Å
214Q33.5Very low38.9Very low179 Ų179120.6 Ų120.684%0.83669%0.693SS**SBendtrans-72.424176.2-66.6178.6-5.300115.3
215N34.8Very low40.7Very low160 Ų160116.3 Ų116.386%0.85667%0.67SS**SBendtrans-133.662.3-172.3-87.2-7.8000114D213D213-N215 PolarHBondContact O-N 3.48Å
216S35.9Very low42.4Very low96 Ų96118.4 Ų118.467%0.67166%0.663SS**  trans-160.624.2161.960.20000114.5A218S216-A218 PolarHBondContact O-N 3.11Å
217V41.7Very low44Very low115 Ų115114.1 Ų114.170%0.69765%0.645SS**THydrogen-bonded Turntrans-76.50.8-143.1-170.40000117.6
218A44.7Very low45.7Very low96 Ų96113.3 Ų113.379%0.79364%0.636SS**THydrogen-bonded Turntrans-107.7-28.2-170.800000116.4S216S216-A218 PolarHBondContact O-N 3.11Å
219A42.7Very low47.8Very low98 Ų98111.8 Ų111.881%0.8163%0.632SS**SBendtrans-95.2-4.4-171.700000114.6
220S49.3Very low49.8Very low59 Ų59108.1 Ų108.141%0.41362%0.616SS.*SBendtrans-103.3-12.5-174.155.50000114.7V224S220-V224 WeakPolarHBondContact O-CB 3.25Å; S220-V224 WeakPolarHBondContact O-CG2 3.48Å; S220-V224 PolarHBondContact O-N 3.11Å; S220-V224 VanDerWaalsContact O-N 3.11Å
221S48.1Very low51.5Low66 Ų66108.8 Ų108.846%0.46261%0.613SS.*Hα-helixtrans-65.9-49-172.9-165.50000112.3A223 V224 D225S221-A223 VanDerWaalsContact C-N 3.35Å; S221-A223 PolarHBondContact O-N 3.31Å; S221-V224 PolarHBondContact O-N 3.43Å; S221-D225 PolarHBondContact O-N 3.14Å; S221-D225 VanDerWaalsContact O-N 3.13Å
222D53.1Low53.6Low135 Ų135109.4 Ų109.472%0.72261%0.607SS**Hα-helixtrans-68.7-34.1-176.4-62.6-18.9000112.3D225 F226D222-D225 PolarHBondContact O-N 2.91Å; D222-F226 WeakPolarHBondContact O-CB 3.45Å; D222-F226 PolarHBondContact O-N 3.04Å
223A58.2Low55.6Low54 Ų54111.6 Ų111.645%0.44661%0.609SS.*Hα-helixtrans-68.6-40.3176.100000112S221 D225 F226 D227S221-A223 VanDerWaalsContact C-N 3.35Å; S221-A223 PolarHBondContact O-N 3.31Å; A223-D225 VanDerWaalsContact C-N 3.31Å; A223-D225 PolarHBondContact O-N 2.93Å; A223-F226 PolarHBondContact O-N 3.25Å; A223-D227 PolarHBondContact O-N 3.49Å
224V57Low57.8Low66 Ų66108 Ų10840%0.459%0.589SS.*Hα-helixtrans-64.7-37.7176.8170.50000111S220 S221 R228S220-V224 WeakPolarHBondContact O-CB 3.25Å; S220-V224 WeakPolarHBondContact O-CG2 3.48Å; S220-V224 PolarHBondContact O-N 3.11Å; S220-V224 VanDerWaalsContact O-N 3.11Å; S221-V224 PolarHBondContact O-N 3.43Å; V224-R228 VanDerWaalsContact O-CG 3.25Å; V224-R228 WeakPolarHBondContact O-CG 3.33Å; V224-R228 PolarHBondContact O-N 3.46Å; V224-R228 VanDerWaalsContact O-N 3.11Å
225D67.5Low59.9Low74 Ų74101.9 Ų101.940%0.39656%0.564SS.*Hα-helixtrans-72.3-37.6176.9-71.7-31.3000112.3S221 D222 A223 R228 L229S221-D225 PolarHBondContact O-N 3.14Å; S221-D225 VanDerWaalsContact O-N 3.13Å; D222-D225 PolarHBondContact O-N 2.91Å; A223-D225 VanDerWaalsContact C-N 3.31Å; A223-D225 PolarHBondContact O-N 2.93Å; D225-R228 PolarHBondContact O-N 3.38Å; D225-L229 WeakPolarHBondContact O-CG 3.43Å; D225-L229 PolarHBondContact O-N 2.9Å
226F68.7Low61.8Low134 Ų13498.2 Ų98.259%0.58855%0.551SS**Hα-helixtrans-61.9-45.8172.8-177.2-98.6000112.3D222 A223 R228 L229 K230D222-F226 WeakPolarHBondContact O-CB 3.45Å; D222-F226 PolarHBondContact O-N 3.04Å; A223-F226 PolarHBondContact O-N 3.25Å; F226-R228 VanDerWaalsContact C-N 3.31Å; F226-R228 PolarHBondContact O-N 3.39Å; F226-L229 PolarHBondContact O-N 3.4Å; F226-K230 HydrophobicContact CE1-CD 4.47Å; F226-K230 WeakPolarHBondContact O-CB 3.14Å; F226-K230 PolarHBondContact O-N 3.4Å
227D67.6Low64Low94 Ų9499.3 Ų99.350%0.50355%0.549SS..Hα-helixtrans-63.4-38.3177.7-80.7-25.3000111.8A223 K230 M231A223-D227 PolarHBondContact O-N 3.49Å; D227-K230 PolarHBondContact O-N 3Å; D227-M231 WeakPolarHBondContact O-CB 3.41Å; D227-M231 VanDerWaalsContact O-CG 3.25Å; D227-M231 WeakPolarHBondContact O-CG 3.46Å; D227-M231 PolarHBondContact O-N 3.21Å
228R70.8Confident65.7Low142 Ų14297 Ų9754%0.53653%0.53SS..Hα-helixtrans-63-45.2174.5-76.9171.4172.4-163-5.3112.2V224 D225 F226 M231 R232V224-R228 VanDerWaalsContact O-CG 3.25Å; V224-R228 WeakPolarHBondContact O-CG 3.33Å; V224-R228 PolarHBondContact O-N 3.46Å; V224-R228 VanDerWaalsContact O-N 3.11Å; D225-R228 PolarHBondContact O-N 3.38Å; F226-R228 VanDerWaalsContact C-N 3.31Å; F226-R228 PolarHBondContact O-N 3.39Å; R228-M231 PolarHBondContact O-N 2.97Å; R228-R232 PolarHBondContact O-N 3.01Å
229L74.2Confident67.7Low118 Ų11895 Ų9562%0.61851%0.51SS*.Hα-helixtrans-61.6-45.2176-81.1158.7000111.5D225 F226 M231 R232 L233D225-L229 WeakPolarHBondContact O-CG 3.43Å; D225-L229 PolarHBondContact O-N 2.9Å; F226-L229 PolarHBondContact O-N 3.4Å; L229-M231 VanDerWaalsContact C-N 3.35Å; L229-M231 PolarHBondContact O-N 3.47Å; L229-R232 PolarHBondContact O-N 3.45Å; L229-L233 PolarHBondContact O-N 2.89Å
230K74.4Confident69.6Low114 Ų11499.5 Ų99.550%0.49651%0.512SS..Hα-helixtrans-59.7-44.7176.5-174.5176.4-178.9178.70111.8F226 D227 R232 L233 L234F226-K230 HydrophobicContact CE1-CD 4.47Å; F226-K230 WeakPolarHBondContact O-CB 3.14Å; F226-K230 PolarHBondContact O-N 3.4Å; D227-K230 PolarHBondContact O-N 3Å; K230-R232 VanDerWaalsContact C-N 3.34Å; K230-R232 PolarHBondContact O-N 3.38Å; K230-L233 PolarHBondContact O-N 3.42Å; K230-L234 HydrophobicContact CG-CD1 4.23Å; K230-L234 WeakPolarHBondContact O-CG 3.25Å; K230-L234 PolarHBondContact O-N 3.48Å
231M66.1Low70.9Confident77 Ų77103.7 Ų103.738%0.37952%0.524SS..Hα-helixtrans-65.1-37.4177.2-71.9-52.9-60.500112.3D227 R228 L229 L234 V235 Y246D227-M231 WeakPolarHBondContact O-CB 3.41Å; D227-M231 VanDerWaalsContact O-CG 3.25Å; D227-M231 WeakPolarHBondContact O-CG 3.46Å; D227-M231 PolarHBondContact O-N 3.21Å; R228-M231 PolarHBondContact O-N 2.97Å; L229-M231 VanDerWaalsContact C-N 3.35Å; L229-M231 PolarHBondContact O-N 3.47Å; M231-L234 PolarHBondContact O-N 2.96Å; M231-L234 HydrophobicContact SD-CD1 4.3Å; M231-V235 WeakPolarHBondContact O-CB 3.47Å; M231-V235 VanDerWaalsContact O-CG2 3.23Å; M231-V235 WeakPolarHBondContact O-CG2 2.96Å; M231-V235 PolarHBondContact O-N 2.57Å; M231-Y246 HydrophobicContact CE-CE2 3.79Å; M231-Y246 WeakPolarHBondContact CE-OH 3.45Å
232R74Confident72.4Confident202 Ų202104.3 Ų104.376%0.76252%0.52SS*.Hα-helixtrans-63.9-45.5176.1-169.9175.5-176.6172.21111.7R228 L229 K230 L234 V235 S236R228-R232 PolarHBondContact O-N 3.01Å; L229-R232 PolarHBondContact O-N 3.45Å; K230-R232 VanDerWaalsContact C-N 3.34Å; K230-R232 PolarHBondContact O-N 3.38Å; R232-L234 VanDerWaalsContact C-N 3.33Å; R232-L234 PolarHBondContact O-N 2.91Å; R232-V235 PolarHBondContact O-N 3.41Å; R232-S236 PolarHBondContact O-N 3.04Å; R232-S236 PolarHBondContact O-OG 3.41Å
233L74.9Confident73.7Confident115 Ų115100.5 Ų100.560%0.60250%0.499SS*.Hα-helixtrans-65.1-35.7178.2-173.667.8000112.5L229 K230 S236 N237L229-L233 PolarHBondContact O-N 2.89Å; K230-L233 PolarHBondContact O-N 3.42Å; L233-S236 PolarHBondContact O-OG 3.28Å; L233-N237 PolarHBondContact O-N 2.82Å; L233-N237 PolarHBondContact O-ND2 3.44Å
234L77.5Confident74.8Confident75 Ų75100.8 Ų100.839%0.39350%0.498SS..Hα-helixtrans-69-46.5175.9-73.7169.7000111.3K230 M231 R232 S236 N237 F238K230-L234 HydrophobicContact CG-CD1 4.23Å; K230-L234 WeakPolarHBondContact O-CG 3.25Å; K230-L234 PolarHBondContact O-N 3.48Å; M231-L234 PolarHBondContact O-N 2.96Å; M231-L234 HydrophobicContact SD-CD1 4.3Å; R232-L234 VanDerWaalsContact C-N 3.33Å; R232-L234 PolarHBondContact O-N 2.91Å; L234-S236 VanDerWaalsContact C-N 3.28Å; L234-S236 PolarHBondContact O-N 3.44Å; L234-N237 PolarHBondContact O-N 3.13Å; L234-N237 VanDerWaalsContact O-N 3.13Å; L234-F238 HydrophobicContact CB-CE1 4.11Å; L234-F238 HydrophobicContact CB-CZ 4.29Å; L234-F238 WeakPolarHBondContact O-CD1 3.38Å; L234-F238 WeakPolarHBondContact O-CE1 3.23Å; L234-F238 WeakPolarHBondContact O-CG 2.96Å; L234-F238 PolarHBondContact O-N 3Å
235V76.7Confident75.9Confident49 Ų49105.2 Ų105.230%0.29751%0.508SS..Hα-helixtrans-62.3-36.5179.8171.80000111.5M231 R232 N237 F238 L243 Y246M231-V235 WeakPolarHBondContact O-CB 3.47Å; M231-V235 VanDerWaalsContact O-CG2 3.23Å; M231-V235 WeakPolarHBondContact O-CG2 2.96Å; M231-V235 PolarHBondContact O-N 2.57Å; R232-V235 PolarHBondContact O-N 3.41Å; V235-N237 VanDerWaalsContact C-N 3.28Å; V235-N237 PolarHBondContact O-N 3.39Å; V235-F238 PolarHBondContact O-N 3.36Å; V235-L243 HydrophobicContact CG1-CD1 3.98Å; V235-Y246 HydrophobicContact CG2-CD1 4.2Å; V235-Y246 HydrophobicContact CG2-CE1 3.62Å
236S75.4Confident76.4Confident84 Ų84104 Ų10459%0.58750%0.498SS*.Hα-helixtrans-68.8-24.8177.4640000113.8R232 L233 L234R232-S236 PolarHBondContact O-N 3.04Å; R232-S236 PolarHBondContact O-OG 3.41Å; L233-S236 PolarHBondContact O-OG 3.28Å; L234-S236 VanDerWaalsContact C-N 3.28Å; L234-S236 PolarHBondContact O-N 3.44Å
237N82Confident76.9Confident119 Ų11999.9 Ų99.964%0.63648%0.481SS*.THydrogen-bonded Turntrans-99.55.9-179.3-73.9-68.9000113.4L233 L234 V235L233-N237 PolarHBondContact O-N 2.82Å; L233-N237 PolarHBondContact O-ND2 3.44Å; L234-N237 PolarHBondContact O-N 3.13Å; L234-N237 VanDerWaalsContact O-N 3.13Å; V235-N237 VanDerWaalsContact C-N 3.28Å; V235-N237 PolarHBondContact O-N 3.39Å
238F77.7Confident77.4Confident66 Ų66100.7 Ų100.729%0.28948%0.482SS..  trans-77.2138.7-179.6-812.3000112.3L234 V235 Q242 L243 Y246L234-F238 HydrophobicContact CB-CE1 4.11Å; L234-F238 HydrophobicContact CB-CZ 4.29Å; L234-F238 WeakPolarHBondContact O-CD1 3.38Å; L234-F238 WeakPolarHBondContact O-CE1 3.23Å; L234-F238 WeakPolarHBondContact O-CG 2.96Å; L234-F238 PolarHBondContact O-N 3Å; V235-F238 PolarHBondContact O-N 3.36Å; F238-Q242 HydrophobicContact CB-CB 3.95Å; F238-Q242 HydrophobicContact CD1-CB 4.49Å; F238-Q242 HydrophobicContact CD2-CB 4.23Å; F238-Q242 HydrophobicContact CG-CB 3.99Å; F238-L243 HydrophobicContact CB-CB 4.32Å; F238-Y246 HydrophobicContact CD2-CG 4.45Å; F238-Y246 HydrophobicContact CE2-CD1 4.32Å; F238-Y246 HydrophobicContact CE2-CD2 4.19Å; F238-Y246 AromaticContact CE2-CG 3.87Å; F238-Y246 HydrophobicContact CE2-CG 3.87Å
239S85.1Confident77.9Confident55 Ų5599.7 Ų99.739%0.38548%0.48SS..  trans-62.8157.5165.480.50000110.5E241 Q242 L243S239-E241 PolarHBondContact O-N 3.42Å; S239-E241 VanDerWaalsContact O-N 3.14Å; S239-Q242 WeakPolarHBondContact O-CB 3.38Å; S239-Q242 PolarHBondContact O-N 2.8Å; S239-Q242 WeakPolarHBondContact OG-CG 3.29Å; S239-Q242 PolarHBondContact OG-N 2.74Å; S239-Q242 PolarHBondContact OG-OE1 3.49Å; S239-L243 PolarHBondContact O-N 2.91Å
240K82.6Confident78.2Confident192 Ų192101 Ų10184%0.83548%0.477SS*.Hα-helixtrans-54.1-36.9178.7-66-176.7179.6-179.80112.7S244K240-S244 WeakPolarHBondContact O-CB 3.42Å; K240-S244 PolarHBondContact O-N 3.28Å
241E76.7Confident78.4Confident146 Ų146103 Ų10368%0.68248%0.481SS*.Hα-helixtrans-71.7-37.6176.7-64.4-175.317300112.9S239 R245S239-E241 PolarHBondContact O-N 3.42Å; S239-E241 VanDerWaalsContact O-N 3.14Å; E241-R245 WeakPolarHBondContact O-CG 3.5Å; E241-R245 PolarHBondContact O-N 3.48Å; E241-R245 VanDerWaalsContact O-N 3.08Å; E241-R245 PolarHBondContact O-NE 3.13Å
242Q80.3Confident79.1Confident79 Ų79102 Ų10237%0.36948%0.481SS..Hα-helixtrans-67.8-42.2175.3-74.5171.7-35.500111.1F238 S239 R245 Y246F238-Q242 HydrophobicContact CB-CB 3.95Å; F238-Q242 HydrophobicContact CD1-CB 4.49Å; F238-Q242 HydrophobicContact CD2-CB 4.23Å; F238-Q242 HydrophobicContact CG-CB 3.99Å; S239-Q242 WeakPolarHBondContact O-CB 3.38Å; S239-Q242 PolarHBondContact O-N 2.8Å; S239-Q242 WeakPolarHBondContact OG-CG 3.29Å; S239-Q242 PolarHBondContact OG-N 2.74Å; S239-Q242 PolarHBondContact OG-OE1 3.49Å; Q242-R245 PolarHBondContact O-N 3.32Å; Q242-Y246 VanDerWaalsContact O-CB 3.32Å; Q242-Y246 WeakPolarHBondContact O-CB 3.4Å; Q242-Y246 PolarHBondContact O-N 3.21Å
243L79.9Confident79.5Confident55 Ų5597.7 Ų97.729%0.28848%0.477SS..Hα-helixtrans-61-48.5176.1-174.764.8000110.8V235 F238 S239 R245 Y246 E247V235-L243 HydrophobicContact CG1-CD1 3.98Å; F238-L243 HydrophobicContact CB-CB 4.32Å; S239-L243 PolarHBondContact O-N 2.91Å; L243-R245 VanDerWaalsContact C-N 3.32Å; L243-R245 PolarHBondContact O-N 2.89Å; L243-Y246 PolarHBondContact O-N 3.34Å; L243-E247 HydrophobicContact CD1-CG 4.42Å; L243-E247 HydrophobicContact CG-CG 4.42Å; L243-E247 WeakPolarHBondContact O-CB 3.43Å; L243-E247 WeakPolarHBondContact O-CG 3.48Å; L243-E247 PolarHBondContact O-N 3.38Å
244S81.3Confident80Confident60 Ų6095.4 Ų95.442%0.4246%0.462SS..Hα-helixtrans-58.1-42.7176.2-178.20000112.2K240 M248K240-S244 WeakPolarHBondContact O-CB 3.42Å; K240-S244 PolarHBondContact O-N 3.28Å; S244-M248 WeakPolarHBondContact O-CB 3.36Å; S244-M248 WeakPolarHBondContact O-CG 3.48Å; S244-M248 PolarHBondContact O-N 3.03Å
245R79.6Confident80.5Confident160 Ų16095.4 Ų95.460%0.60447%0.467SS*.Hα-helixtrans-63.6-45.1176.5-77.6-174.8-74.8165.8-9.8111.8E241 Q242 L243 M248 Y249E241-R245 WeakPolarHBondContact O-CG 3.5Å; E241-R245 PolarHBondContact O-N 3.48Å; E241-R245 VanDerWaalsContact O-N 3.08Å; E241-R245 PolarHBondContact O-NE 3.13Å; Q242-R245 PolarHBondContact O-N 3.32Å; L243-R245 VanDerWaalsContact C-N 3.32Å; L243-R245 PolarHBondContact O-N 2.89Å; R245-M248 PolarHBondContact O-N 3.31Å; R245-Y249 WeakPolarHBondContact O-CB 3.28Å; R245-Y249 PolarHBondContact O-N 2.98Å
246Y79Confident81Confident49 Ų4996.9 Ų96.919%0.19247%0.47CS..Hα-helixtrans-64-43.8179.2176.2-108.5000112M231 V235 F238 Q242 L243 Y249 R250M231-Y246 HydrophobicContact CE-CE2 3.79Å; M231-Y246 WeakPolarHBondContact CE-OH 3.45Å; V235-Y246 HydrophobicContact CG2-CD1 4.2Å; V235-Y246 HydrophobicContact CG2-CE1 3.62Å; F238-Y246 HydrophobicContact CD2-CG 4.45Å; F238-Y246 HydrophobicContact CE2-CD1 4.32Å; F238-Y246 HydrophobicContact CE2-CD2 4.19Å; F238-Y246 AromaticContact CE2-CG 3.87Å; F238-Y246 HydrophobicContact CE2-CG 3.87Å; Q242-Y246 VanDerWaalsContact O-CB 3.32Å; Q242-Y246 WeakPolarHBondContact O-CB 3.4Å; Q242-Y246 PolarHBondContact O-N 3.21Å; L243-Y246 PolarHBondContact O-N 3.34Å; Y246-Y249 PolarHBondContact O-N 3.39Å; Y246-R250 VanDerWaalsContact CE1-CD 3.47Å; Y246-R250 HydrophobicContact CE1-CG 4.25Å; Y246-R250 HydrophobicContact CE2-CG 4.15Å; Y246-R250 WeakPolarHBondContact O-CG 3.35Å; Y246-R250 PolarHBondContact O-N 3.3Å; Y246-R250 WeakPolarHBondContact OH-CD 3.32Å
247E79.2Confident81.6Confident47 Ų4797.2 Ų97.222%0.2247%0.472CS..Hα-helixtrans-62.6-44175.6-73.3-171.9-176.300112.1L243 Y249 R250 R251L243-E247 HydrophobicContact CD1-CG 4.42Å; L243-E247 HydrophobicContact CG-CG 4.42Å; L243-E247 WeakPolarHBondContact O-CB 3.43Å; L243-E247 WeakPolarHBondContact O-CG 3.48Å; L243-E247 PolarHBondContact O-N 3.38Å; E247-Y249 VanDerWaalsContact C-N 3.34Å; E247-Y249 PolarHBondContact O-N 3.04Å; E247-R250 PolarHBondContact O-N 3.34Å; E247-R251 WeakPolarHBondContact O-CB 3.48Å; E247-R251 VanDerWaalsContact O-CG 3.29Å; E247-R251 WeakPolarHBondContact O-CG 3.41Å; E247-R251 PolarHBondContact O-N 2.81Å; E247-R251 IonicContact OE2-CZ 3.92Å; E247-R251 VanDerWaalsContact OE2-CZ 3.28Å; E247-R251 IonicContact OE2-NH1 3.42Å; E247-R251 PolarHBondContact OE2-NH1 3.19Å; E247-R251 IonicContact OE2-NH2 3.92Å; E247-R251 PolarHBondContact OE2-NH2 3.38Å
248M78.2Confident81.9Confident110 Ų11097.4 Ų97.454%0.54247%0.467SS..Hα-helixtrans-63.3-41176.1-69.1-60157.300111.5S244 R245 R250 R251 S252S244-M248 WeakPolarHBondContact O-CB 3.36Å; S244-M248 WeakPolarHBondContact O-CG 3.48Å; S244-M248 PolarHBondContact O-N 3.03Å; R245-M248 PolarHBondContact O-N 3.31Å; M248-R250 PolarHBondContact O-N 2.89Å; M248-R251 PolarHBondContact O-N 2.76Å; M248-S252 WeakPolarHBondContact O-CB 3.5Å; M248-S252 PolarHBondContact O-N 2.94Å
249Y81.1Confident82.5Confident121 Ų12195 Ų9548%0.47546%0.457SS..Hα-helixtrans-60.6-45.2174.3176.3-99.1000111.5R245 Y246 E247 S252 K284R245-Y249 WeakPolarHBondContact O-CB 3.28Å; R245-Y249 PolarHBondContact O-N 2.98Å; Y246-Y249 PolarHBondContact O-N 3.39Å; E247-Y249 VanDerWaalsContact C-N 3.34Å; E247-Y249 PolarHBondContact O-N 3.04Å; Y249-S252 PolarHBondContact O-N 3.28Å; Y249-S252 PolarHBondContact O-OG 2.86Å; Y249-K284 HydrophobicContact CE2-CD 4.49Å; Y249-K284 HydrophobicContact CE2-CG 4.35Å; Y249-K284 WeakPolarHBondContact O-CE 3.49Å; Y249-K284 PolarHBondContact O-NZ 2.77Å
250R81.1Confident82.6Confident147 Ų14796.8 Ų96.856%0.55546%0.455SS*.Hα-helixtrans-65-40.8177.4-76.8-168.969.5179.60.2113.1Y246 E247 M248 S252Y246-R250 VanDerWaalsContact CE1-CD 3.47Å; Y246-R250 HydrophobicContact CE1-CG 4.25Å; Y246-R250 HydrophobicContact CE2-CG 4.15Å; Y246-R250 WeakPolarHBondContact O-CG 3.35Å; Y246-R250 PolarHBondContact O-N 3.3Å; Y246-R250 WeakPolarHBondContact OH-CD 3.32Å; E247-R250 PolarHBondContact O-N 3.34Å; M248-R250 PolarHBondContact O-N 2.89Å; R250-S252 VanDerWaalsContact C-N 3.33Å
251R78.6Confident83Confident155 Ų15593.6 Ų93.659%0.58544%0.442SS*.Hα-helixtrans-70.5-28.2178.3-71179.8-173.7117.27.8112.8E247 M248 V253E247-R251 WeakPolarHBondContact O-CB 3.48Å; E247-R251 VanDerWaalsContact O-CG 3.29Å; E247-R251 WeakPolarHBondContact O-CG 3.41Å; E247-R251 PolarHBondContact O-N 2.81Å; E247-R251 IonicContact OE2-CZ 3.92Å; E247-R251 VanDerWaalsContact OE2-CZ 3.28Å; E247-R251 IonicContact OE2-NH1 3.42Å; E247-R251 PolarHBondContact OE2-NH1 3.19Å; E247-R251 IonicContact OE2-NH2 3.92Å; E247-R251 PolarHBondContact OE2-NH2 3.38Å; M248-R251 PolarHBondContact O-N 2.76Å; R251-V253 PolarHBondContact O-N 3.43Å
252S79.4Confident83.7Confident56 Ų5689.5 Ų89.539%0.39243%0.426SS..  trans-69121.9178.372.20000111.3M248 Y249 R250 K284M248-S252 WeakPolarHBondContact O-CB 3.5Å; M248-S252 PolarHBondContact O-N 2.94Å; Y249-S252 PolarHBondContact O-N 3.28Å; Y249-S252 PolarHBondContact O-OG 2.86Å; R250-S252 VanDerWaalsContact C-N 3.33Å; S252-K284 WeakPolarHBondContact O-CE 3.45Å; S252-K284 PolarHBondContact O-NZ 3.44Å; S252-K284 WeakPolarHBondContact OG-CE 3.5Å
253V83.1Confident84.2Confident111 Ų11186.6 Ų86.667%0.67341%0.413SS*.  trans-141.5135.5177.4-179.10000108.4R251 P255R251-V253 PolarHBondContact O-N 3.43Å; V253-P255 WeakPolarHBondContact O-CD 3.35Å
254F85.2Confident84.7Confident67 Ų6788.7 Ų88.729%0.29442%0.422SS..  trans-74.2127.4170.2-72.2-62000110.1K256 I259 A283 K284 V287F254-K256 PolarHBondContact O-N 2.85Å; F254-I259 HydrophobicContact CB-CD1 3.88Å; F254-I259 HydrophobicContact CB-CG1 3.79Å; F254-I259 HydrophobicContact CG-CD1 4.18Å; F254-A283 HydrophobicContact CD2-CB 4.23Å; F254-A283 HydrophobicContact CE2-CB 4.09Å; F254-K284 HydrophobicContact CD2-CB 4.33Å; F254-K284 HydrophobicContact CE2-CB 4.15Å; F254-V287 HydrophobicContact CZ-CB 4.5Å; F254-V287 HydrophobicContact CZ-CG2 4.04Å
255P88.4Confident85.2Confident76 Ų7692.5 Ų92.549%0.49443%0.433SS..  trans-56.5125176.3-25.334.1000111V253 S257 F258 I259V253-P255 WeakPolarHBondContact O-CD 3.35Å; P255-S257 PolarHBondContact O-N 2.98Å; P255-S257 VanDerWaalsContact O-N 3.15Å; P255-F258 HydrophobicContact CB-CB 4.22Å; P255-F258 WeakPolarHBondContact O-CB 3.27Å; P255-F258 PolarHBondContact O-N 3.14Å; P255-I259 PolarHBondContact O-N 2.98Å
256K86.3Confident85.7Confident80 Ų8090.3 Ų90.335%0.34844%0.437SS..Hα-helixtrans-56.5-34.3-178-62.3178.8-173.4171.90112.2E208 F254 R260 V276E208-K256 IonicContact OE2-NZ 2.7Å; E208-K256 PolarHBondContact OE2-NZ 3.13Å; F254-K256 PolarHBondContact O-N 2.85Å; K256-R260 VanDerWaalsContact O-CB 3.27Å; K256-R260 WeakPolarHBondContact O-CB 3.22Å; K256-R260 PolarHBondContact O-N 3.15Å; K256-V276 HydrophobicContact CB-CG1 4.09Å; K256-V276 WeakPolarHBondContact O-CG1 3.48Å
257S88Confident86.1Confident90 Ų9092.6 Ų92.663%0.62946%0.456SS*.Hα-helixtrans-63.3-40.3176.453.20000112.7P255 K261P255-S257 PolarHBondContact O-N 2.98Å; P255-S257 VanDerWaalsContact O-N 3.15Å; S257-K261 PolarHBondContact O-N 3.19Å; S257-K261 VanDerWaalsContact O-N 3.11Å
258F89.1Confident86.5Confident124 Ų12493.5 Ų93.554%0.54448%0.479SS..Hα-helixtrans-69.4-48.2179.1-175.3-98.9000111.2P255 R260 K261 V262P255-F258 HydrophobicContact CB-CB 4.22Å; P255-F258 WeakPolarHBondContact O-CB 3.27Å; P255-F258 PolarHBondContact O-N 3.14Å; F258-R260 VanDerWaalsContact C-N 3.33Å; F258-R260 PolarHBondContact O-N 3.02Å; F258-K261 WeakPolarHBondContact O-CB 3.29Å; F258-K261 PolarHBondContact O-N 3.19Å; F258-K261 VanDerWaalsContact O-N 3.11Å; F258-V262 HydrophobicContact CD1-CG2 4.28Å; F258-V262 HydrophobicContact CE1-CG2 3.9Å; F258-V262 HydrophobicContact CZ-CG2 4.13Å; F258-V262 WeakPolarHBondContact O-CG2 3.46Å; F258-V262 PolarHBondContact O-N 2.92Å
259I89.6Confident86.8Confident14 Ų1490.6 Ų90.67%0.07247%0.472CS..Hα-helixtrans-59.8-44.5177.8-62.7-62.1000111F254 P255 K261 V262 I263 V276 M279 A280F254-I259 HydrophobicContact CB-CD1 3.88Å; F254-I259 HydrophobicContact CB-CG1 3.79Å; F254-I259 HydrophobicContact CG-CD1 4.18Å; P255-I259 PolarHBondContact O-N 2.98Å; I259-K261 VanDerWaalsContact C-N 3.31Å; I259-K261 PolarHBondContact O-N 3.45Å; I259-V262 PolarHBondContact O-N 3.4Å; I259-I263 HydrophobicContact CG2-CD1 3.75Å; I259-I263 HydrophobicContact CG2-CG1 4.37Å; I259-I263 VanDerWaalsContact O-CG1 3.3Å; I259-I263 WeakPolarHBondContact O-CG1 3.39Å; I259-I263 PolarHBondContact O-N 2.98Å; I259-V276 HydrophobicContact CB-CG1 4.18Å; I259-V276 HydrophobicContact CG2-CG1 4.04Å; I259-M279 HydrophobicContact CG2-CB 4.08Å; I259-M279 HydrophobicContact CG2-CG 4.09Å; I259-A280 HydrophobicContact CG1-CB 4.21Å
260R88.6Confident86.9Confident93 Ų9389.3 Ų89.335%0.35149%0.486SS..Hα-helixtrans-56.4-44.6174.9-177.3-176.3-65.7-87.2-2111.9K256 F258 I263 Q264 T271 V276K256-R260 VanDerWaalsContact O-CB 3.27Å; K256-R260 WeakPolarHBondContact O-CB 3.22Å; K256-R260 PolarHBondContact O-N 3.15Å; F258-R260 VanDerWaalsContact C-N 3.33Å; F258-R260 PolarHBondContact O-N 3.02Å; R260-I263 PolarHBondContact O-N 3.41Å; R260-Q264 WeakPolarHBondContact O-CB 3.37Å; R260-Q264 PolarHBondContact O-N 3.11Å; R260-T271 PolarHBondContact NH1-O 2.97Å; R260-V276 HydrophobicContact CB-CG2 4.1Å; R260-V276 HydrophobicContact CG-CG2 4.43Å
261K90Very high87Confident126 Ų12683.4 Ų83.455%0.54847%0.466SS..Hα-helixtrans-62.4-44178.5-171.6177.8-179.4179.30111.8S257 F258 I259 Q264 Q265S257-K261 PolarHBondContact O-N 3.19Å; S257-K261 VanDerWaalsContact O-N 3.11Å; F258-K261 WeakPolarHBondContact O-CB 3.29Å; F258-K261 PolarHBondContact O-N 3.19Å; F258-K261 VanDerWaalsContact O-N 3.11Å; I259-K261 VanDerWaalsContact C-N 3.31Å; I259-K261 PolarHBondContact O-N 3.45Å; K261-Q264 PolarHBondContact O-N 2.9Å; K261-Q265 WeakPolarHBondContact O-CB 3.29Å; K261-Q265 VanDerWaalsContact O-CG 3.25Å; K261-Q265 WeakPolarHBondContact O-CG 3.42Å; K261-Q265 PolarHBondContact O-N 3.19Å
262V91.4Very high87.5Confident60 Ų6080.3 Ų80.336%0.36447%0.465SS..Hα-helixtrans-64.1-44.2178.51740000111.7F258 I259 Q265 T266F258-V262 HydrophobicContact CD1-CG2 4.28Å; F258-V262 HydrophobicContact CE1-CG2 3.9Å; F258-V262 HydrophobicContact CZ-CG2 4.13Å; F258-V262 WeakPolarHBondContact O-CG2 3.46Å; F258-V262 PolarHBondContact O-N 2.92Å; I259-V262 PolarHBondContact O-N 3.4Å; V262-Q265 PolarHBondContact O-N 3.48Å; V262-T266 WeakPolarHBondContact O-CB 3.47Å; V262-T266 PolarHBondContact O-N 3.49Å; V262-T266 PolarHBondContact O-OG1 2.72Å
263I90.2Very high87.8Confident18 Ų1882 Ų829%0.09247%0.468CS..Hα-helixtrans-62-46.8177.1-63.6165000109.9I259 R260 Q265 T266 T267 T271 V276 M279I259-I263 HydrophobicContact CG2-CD1 3.75Å; I259-I263 HydrophobicContact CG2-CG1 4.37Å; I259-I263 VanDerWaalsContact O-CG1 3.3Å; I259-I263 WeakPolarHBondContact O-CG1 3.39Å; I259-I263 PolarHBondContact O-N 2.98Å; R260-I263 PolarHBondContact O-N 3.41Å; I263-Q265 VanDerWaalsContact C-N 3.33Å; I263-Q265 PolarHBondContact O-N 2.87Å; I263-T266 PolarHBondContact O-N 2.92Å; I263-T267 WeakPolarHBondContact O-CB 3.32Å; I263-T267 PolarHBondContact O-N 3.08Å; I263-T267 PolarHBondContact O-OG1 3.28Å; I263-T271 HydrophobicContact CD1-CG2 4.4Å; I263-T271 HydrophobicContact CG2-CG2 3.76Å; I263-T271 VanDerWaalsContact CG2-OG1 3.29Å; I263-T271 WeakPolarHBondContact CG2-OG1 3.28Å; I263-V276 HydrophobicContact CD1-CG2 4.35Å; I263-M279 HydrophobicContact CD1-CB 3.92Å; I263-M279 HydrophobicContact CD1-CG 3.92Å; I263-M279 HydrophobicContact CG1-CG 4.2Å
264Q90.5Very high88Confident99 Ų9981.1 Ų81.146%0.46346%0.46SS..Hα-helixtrans-64.6-37.1-179.8-169.6172.612.400112.4R260 K261 T266 G268R260-Q264 WeakPolarHBondContact O-CB 3.37Å; R260-Q264 PolarHBondContact O-N 3.11Å; K261-Q264 PolarHBondContact O-N 2.9Å; Q264-T266 VanDerWaalsContact C-N 3.32Å; Q264-T266 PolarHBondContact O-N 2.99Å; Q264-G268 WeakPolarHBondContact O-CA 3.22Å; Q264-G268 PolarHBondContact O-N 3.35Å
265Q91.7Very high88.1Confident139 Ų13981 Ų8165%0.6546%0.464SS*.Hα-helixtrans-67-31.3175.1-77.1177.1-29.700113K261 V262 I263K261-Q265 WeakPolarHBondContact O-CB 3.29Å; K261-Q265 VanDerWaalsContact O-CG 3.25Å; K261-Q265 WeakPolarHBondContact O-CG 3.42Å; K261-Q265 PolarHBondContact O-N 3.19Å; V262-Q265 PolarHBondContact O-N 3.48Å; I263-Q265 VanDerWaalsContact C-N 3.33Å; I263-Q265 PolarHBondContact O-N 2.87Å
266T90.3Very high88.1Confident114 Ų11477.4 Ų77.470%0.69944%0.441SS*.Hα-helixtrans-89.1-41.9-176-52.60000112.2V262 I263 Q264V262-T266 WeakPolarHBondContact O-CB 3.47Å; V262-T266 PolarHBondContact O-N 3.49Å; V262-T266 PolarHBondContact O-OG1 2.72Å; I263-T266 PolarHBondContact O-N 2.92Å; Q264-T266 VanDerWaalsContact C-N 3.32Å; Q264-T266 PolarHBondContact O-N 2.99Å
267T88.7Confident88.1Confident97 Ų9776.7 Ų76.760%0.59544%0.44SS*.Hα-helixtrans-96.5-21-174.9-49.40000112.6I263 A269I263-T267 WeakPolarHBondContact O-CB 3.32Å; I263-T267 PolarHBondContact O-N 3.08Å; I263-T267 PolarHBondContact O-OG1 3.28Å; T267-A269 HydrophobicContact CG2-CB 4.13Å; T267-A269 PolarHBondContact O-N 3.5Å
268G86.9Confident88.1Confident67 Ų6775 Ų7569%0.69143%0.431SS*.  trans73.6-3.1-174.200000114.7Q264Q264-G268 WeakPolarHBondContact O-CA 3.22Å; Q264-G268 PolarHBondContact O-N 3.35Å
269A84.7Confident88Confident49 Ų4973 Ų7341%0.40543%0.425SS..SBendtrans-107.2147.6-176.800000112.5T267T267-A269 HydrophobicContact CG2-CB 4.13Å; T267-A269 PolarHBondContact O-N 3.5Å
270A83.6Confident87.9Confident93 Ų9373.1 Ų73.177%0.76943%0.427SS*.  trans-70.4132.1170.900000110.5
271T83.3Confident87.7Confident23 Ų2370.4 Ų70.414%0.14143%0.429CS..  trans-104.6142.4-173.9-10.90000112.6R260 I263 V275R260-T271 PolarHBondContact NH1-O 2.97Å; I263-T271 HydrophobicContact CD1-CG2 4.4Å; I263-T271 HydrophobicContact CG2-CG2 3.76Å; I263-T271 VanDerWaalsContact CG2-OG1 3.29Å; I263-T271 WeakPolarHBondContact CG2-OG1 3.28Å; T271-V275 HydrophobicContact CG2-CB 3.73Å; T271-V275 HydrophobicContact CG2-CG1 3.44Å; T271-V275 VanDerWaalsContact CG2-CG1 3.44Å; T271-V275 HydrophobicContact CG2-CG2 4.49Å
272T88.1Confident87.6Confident91 Ų9169.2 Ų69.256%0.55843%0.428SS*.  trans-71.6157.5173.461.50000111.3N274 V275 V276T272-N274 VanDerWaalsContact C-N 3.33Å; T272-N274 PolarHBondContact O-N 3.44Å; T272-V275 PolarHBondContact O-N 3.24Å; T272-V275 VanDerWaalsContact OG1-CG2 3.28Å; T272-V275 WeakPolarHBondContact OG1-CG2 3.33Å; T272-V276 WeakPolarHBondContact O-CG2 3.36Å; T272-V276 PolarHBondContact O-N 2.88Å
273M85.7Confident87.4Confident90 Ų9067.6 Ų67.644%0.44342%0.42SS..Hα-helixtrans-61.3-39.8-177.4-175168.467.300112.7V275 V276 I277M273-V275 VanDerWaalsContact C-N 3.31Å; M273-V275 PolarHBondContact O-N 3.48Å; M273-V276 WeakPolarHBondContact O-CB 3.37Å; M273-V276 PolarHBondContact O-N 2.97Å; M273-V276 VanDerWaalsContact O-N 3.13Å; M273-I277 HydrophobicContact CG-CD1 4.05Å; M273-I277 WeakPolarHBondContact O-CG1 3.48Å; M273-I277 PolarHBondContact O-N 3.25Å
274N87.7Confident87.2Confident94 Ų9468.8 Ų68.850%0.50343%0.425SS..Hα-helixtrans-62.3-39.2-179.8-61.7-1.2000111.6T272 I277 A278T272-N274 VanDerWaalsContact C-N 3.33Å; T272-N274 PolarHBondContact O-N 3.44Å; N274-I277 PolarHBondContact O-N 3.43Å; N274-A278 WeakPolarHBondContact O-CB 3.48Å; N274-A278 PolarHBondContact O-N 3.11Å
275V87.1Confident86.9Confident64 Ų6467.7 Ų67.739%0.38843%0.425SS..Hα-helixtrans-67.5-38.1176.11780000111.1T271 T272 M273 I277 A278 M279T271-V275 HydrophobicContact CG2-CB 3.73Å; T271-V275 HydrophobicContact CG2-CG1 3.44Å; T271-V275 VanDerWaalsContact CG2-CG1 3.44Å; T271-V275 HydrophobicContact CG2-CG2 4.49Å; T272-V275 PolarHBondContact O-N 3.24Å; T272-V275 VanDerWaalsContact OG1-CG2 3.28Å; T272-V275 WeakPolarHBondContact OG1-CG2 3.33Å; M273-V275 VanDerWaalsContact C-N 3.31Å; M273-V275 PolarHBondContact O-N 3.48Å; V275-I277 VanDerWaalsContact C-N 3.33Å; V275-I277 PolarHBondContact O-N 3.32Å; V275-A278 PolarHBondContact O-N 2.91Å; V275-M279 VanDerWaalsContact O-CB 3.28Å; V275-M279 WeakPolarHBondContact O-CB 3.25Å; V275-M279 PolarHBondContact O-N 3.37Å
276V88.7Confident86.7Confident1 Ų164 Ų641%0.00641%0.406CS..Hα-helixtrans-62.5-41.6175175.30000111K256 I259 R260 I263 T272 M273 A280K256-V276 HydrophobicContact CB-CG1 4.09Å; K256-V276 WeakPolarHBondContact O-CG1 3.48Å; I259-V276 HydrophobicContact CB-CG1 4.18Å; I259-V276 HydrophobicContact CG2-CG1 4.04Å; R260-V276 HydrophobicContact CB-CG2 4.1Å; R260-V276 HydrophobicContact CG-CG2 4.43Å; I263-V276 HydrophobicContact CD1-CG2 4.35Å; T272-V276 WeakPolarHBondContact O-CG2 3.36Å; T272-V276 PolarHBondContact O-N 2.88Å; M273-V276 WeakPolarHBondContact O-CB 3.37Å; M273-V276 PolarHBondContact O-N 2.97Å; M273-V276 VanDerWaalsContact O-N 3.13Å; V276-A280 VanDerWaalsContact O-CB 3.29Å; V276-A280 WeakPolarHBondContact O-CB 3.21Å; V276-A280 PolarHBondContact O-N 3.39Å
277I86.1Confident86.5Confident65 Ų6561.5 Ų61.533%0.33339%0.391SS..Hα-helixtrans-65.3-48.1177.4-66.2166.8000110.6M273 N274 V275 M279 A280 G281M273-I277 HydrophobicContact CG-CD1 4.05Å; M273-I277 WeakPolarHBondContact O-CG1 3.48Å; M273-I277 PolarHBondContact O-N 3.25Å; N274-I277 PolarHBondContact O-N 3.43Å; V275-I277 VanDerWaalsContact C-N 3.33Å; V275-I277 PolarHBondContact O-N 3.32Å; I277-M279 VanDerWaalsContact C-N 3.35Å; I277-M279 PolarHBondContact O-N 3.05Å; I277-A280 PolarHBondContact O-N 3.03Å; I277-G281 PolarHBondContact O-N 3.24Å
278A87.9Confident86.3Confident53 Ų5358.1 Ų58.144%0.43838%0.375SS..Hα-helixtrans-59.4-45.7177.700000111.6N274 V275 A280 G281 I282N274-A278 WeakPolarHBondContact O-CB 3.48Å; N274-A278 PolarHBondContact O-N 3.11Å; V275-A278 PolarHBondContact O-N 2.91Å; A278-A280 PolarHBondContact O-N 3.37Å; A278-G281 PolarHBondContact O-N 2.92Å; A278-I282 WeakPolarHBondContact O-CG1 3.43Å; A278-I282 PolarHBondContact O-N 3.42Å
279M87.7Confident86.2Confident83 Ų8358 Ų5841%0.40936%0.357SS..Hα-helixtrans-65.4-38.9178.6-168.961.965.900112.2I259 I263 V275 I277 G281 I282 A283I259-M279 HydrophobicContact CG2-CB 4.08Å; I259-M279 HydrophobicContact CG2-CG 4.09Å; I263-M279 HydrophobicContact CD1-CB 3.92Å; I263-M279 HydrophobicContact CD1-CG 3.92Å; I263-M279 HydrophobicContact CG1-CG 4.2Å; V275-M279 VanDerWaalsContact O-CB 3.28Å; V275-M279 WeakPolarHBondContact O-CB 3.25Å; V275-M279 PolarHBondContact O-N 3.37Å; I277-M279 VanDerWaalsContact C-N 3.35Å; I277-M279 PolarHBondContact O-N 3.05Å; M279-G281 VanDerWaalsContact C-N 3.33Å; M279-G281 PolarHBondContact O-N 3.49Å; M279-I282 PolarHBondContact O-N 3.39Å; M279-A283 VanDerWaalsContact O-CB 3.22Å; M279-A283 WeakPolarHBondContact O-CB 3.39Å; M279-A283 PolarHBondContact O-N 2.99Å
280A86.9Confident86.3Confident16 Ų1657 Ų5713%0.13235%0.345CS..Hα-helixtrans-62.8-40.5174.900000111.7I259 V276 I277 A278 K284I259-A280 HydrophobicContact CG1-CB 4.21Å; V276-A280 VanDerWaalsContact O-CB 3.29Å; V276-A280 WeakPolarHBondContact O-CB 3.21Å; V276-A280 PolarHBondContact O-N 3.39Å; I277-A280 PolarHBondContact O-N 3.03Å; A278-A280 PolarHBondContact O-N 3.37Å; A280-K284 WeakPolarHBondContact O-CB 3.3Å; A280-K284 PolarHBondContact O-N 2.84Å
281G85.3Confident86.6Confident37 Ų3755.6 Ų55.638%0.38133%0.326SS..Hα-helixtrans-62.5-49.4174.700000112.5I277 A278 M279 A283 K284 V285I277-G281 PolarHBondContact O-N 3.24Å; A278-G281 PolarHBondContact O-N 2.92Å; M279-G281 VanDerWaalsContact C-N 3.33Å; M279-G281 PolarHBondContact O-N 3.49Å; G281-A283 PolarHBondContact O-N 3.17Å; G281-K284 WeakPolarHBondContact O-CB 3.43Å; G281-K284 PolarHBondContact O-N 3.06Å; G281-V285 WeakPolarHBondContact O-CG2 3.46Å; G281-V285 PolarHBondContact O-N 3.46Å
282I86.5Confident86.6Confident101 Ų10160.5 Ų60.552%0.51835%0.348SS..Hα-helixtrans-62.1-45.3178.3-64.9164.4000110.9A278 M279 K284 V285 F286A278-I282 WeakPolarHBondContact O-CG1 3.43Å; A278-I282 PolarHBondContact O-N 3.42Å; M279-I282 PolarHBondContact O-N 3.39Å; I282-K284 VanDerWaalsContact C-N 3.26Å; I282-K284 PolarHBondContact O-N 3.22Å; I282-V285 PolarHBondContact O-N 2.96Å; I282-F286 WeakPolarHBondContact O-CB 3.35Å; I282-F286 PolarHBondContact O-N 2.91Å
283A88.3Confident86.5Confident26 Ų2657.1 Ų57.122%0.21533%0.326CS..Hα-helixtrans-61.1-36.9177.100000111.9F254 M279 G281 F286 V287F254-A283 HydrophobicContact CD2-CB 4.23Å; F254-A283 HydrophobicContact CE2-CB 4.09Å; M279-A283 VanDerWaalsContact O-CB 3.22Å; M279-A283 WeakPolarHBondContact O-CB 3.39Å; M279-A283 PolarHBondContact O-N 2.99Å; G281-A283 PolarHBondContact O-N 3.17Å; A283-F286 PolarHBondContact O-N 3.34Å; A283-V287 WeakPolarHBondContact O-CG2 3.4Å; A283-V287 PolarHBondContact O-N 2.84Å
284K85.8Confident86.6Confident43 Ų4352.9 Ų52.919%0.18731%0.305CS..Hα-helixtrans-66.1-45.2177.4-174.7174.5178.7175.50112.2Y249 S252 F254 A280 G281 I282 F286 G288Y249-K284 HydrophobicContact CE2-CD 4.49Å; Y249-K284 HydrophobicContact CE2-CG 4.35Å; Y249-K284 WeakPolarHBondContact O-CE 3.49Å; Y249-K284 PolarHBondContact O-NZ 2.77Å; S252-K284 WeakPolarHBondContact O-CE 3.45Å; S252-K284 PolarHBondContact O-NZ 3.44Å; S252-K284 WeakPolarHBondContact OG-CE 3.5Å; F254-K284 HydrophobicContact CD2-CB 4.33Å; F254-K284 HydrophobicContact CE2-CB 4.15Å; A280-K284 WeakPolarHBondContact O-CB 3.3Å; A280-K284 PolarHBondContact O-N 2.84Å; G281-K284 WeakPolarHBondContact O-CB 3.43Å; G281-K284 PolarHBondContact O-N 3.06Å; I282-K284 VanDerWaalsContact C-N 3.26Å; I282-K284 PolarHBondContact O-N 3.22Å; K284-F286 VanDerWaalsContact C-N 3.34Å; K284-G288 PolarHBondContact O-N 3.1Å; K284-G288 VanDerWaalsContact O-N 3.1Å
285V84.4Confident86.6Confident76 Ų7651.3 Ų51.346%0.46130%0.296SS..Hα-helixtrans-62.1-45.7175.1177.20000110.2G281 I282 V287 G288 E289G281-V285 WeakPolarHBondContact O-CG2 3.46Å; G281-V285 PolarHBondContact O-N 3.46Å; I282-V285 PolarHBondContact O-N 2.96Å; V285-V287 PolarHBondContact O-N 3.19Å; V285-G288 WeakPolarHBondContact O-CA 3.46Å; V285-G288 PolarHBondContact O-N 3.41Å; V285-G288 VanDerWaalsContact O-N 3.11Å; V285-E289 HydrophobicContact CG1-CG 4.46Å; V285-E289 PolarHBondContact O-N 3.42Å
286F86.1Confident86.6Confident60 Ų6052.1 Ų52.126%0.26330%0.298SS..Hα-helixtrans-60.4-44.4179.9178.2-108.4000113.4I282 A283 K284 G288 E289 L290 Y317 V326I282-F286 WeakPolarHBondContact O-CB 3.35Å; I282-F286 PolarHBondContact O-N 2.91Å; A283-F286 PolarHBondContact O-N 3.34Å; K284-F286 VanDerWaalsContact C-N 3.34Å; F286-G288 VanDerWaalsContact C-N 3.29Å; F286-G288 PolarHBondContact O-N 3.11Å; F286-E289 PolarHBondContact O-N 2.94Å; F286-L290 HydrophobicContact CE1-CD2 4.43Å; F286-L290 VanDerWaalsContact O-CB 3.31Å; F286-L290 WeakPolarHBondContact O-CB 3.41Å; F286-L290 PolarHBondContact O-N 2.9Å; F286-Y317 HydrophobicContact CZ-CE2 4.48Å; F286-V326 HydrophobicContact CE2-CB 4.35Å; F286-V326 HydrophobicContact CE2-CG1 3.77Å; F286-V326 HydrophobicContact CE2-CG2 4.1Å; F286-V326 HydrophobicContact CZ-CG1 4.01Å
287V87.5Confident86.5Confident62 Ų6252.1 Ų52.138%0.37630%0.298SS..Hα-helixtrans-65.7-35.9176.7171.80000111F254 A283 V285 L290 V291F254-V287 HydrophobicContact CZ-CB 4.5Å; F254-V287 HydrophobicContact CZ-CG2 4.04Å; A283-V287 WeakPolarHBondContact O-CG2 3.4Å; A283-V287 PolarHBondContact O-N 2.84Å; V285-V287 PolarHBondContact O-N 3.19Å; V287-L290 PolarHBondContact O-N 3.34Å; V287-V291 HydrophobicContact CG1-CG2 4.28Å; V287-V291 WeakPolarHBondContact O-CB 3.42Å; V287-V291 VanDerWaalsContact O-CG2 3.22Å; V287-V291 WeakPolarHBondContact O-CG2 3.31Å; V287-V291 PolarHBondContact O-N 2.96Å
288G85Confident86.5Confident26 Ų2651.3 Ų51.327%0.26829%0.291SS..Hα-helixtrans-57.5-56.217200000112K284 V285 F286 L290 V291 E292K284-G288 PolarHBondContact O-N 3.1Å; K284-G288 VanDerWaalsContact O-N 3.1Å; V285-G288 WeakPolarHBondContact O-CA 3.46Å; V285-G288 PolarHBondContact O-N 3.41Å; V285-G288 VanDerWaalsContact O-N 3.11Å; F286-G288 VanDerWaalsContact C-N 3.29Å; F286-G288 PolarHBondContact O-N 3.11Å; G288-L290 VanDerWaalsContact C-N 3.3Å; G288-L290 PolarHBondContact O-N 3.47Å; G288-V291 PolarHBondContact O-N 3.49Å; G288-E292 WeakPolarHBondContact O-CG 3.45Å; G288-E292 PolarHBondContact O-N 2.98Å
289E84.1Confident86.4Confident66 Ų6652.4 Ų52.431%0.30829%0.289SS..Hα-helixtrans-59.8-39.3179.2-66.4-176.2146.600112.6V285 F286 E292 E293V285-E289 HydrophobicContact CG1-CG 4.46Å; V285-E289 PolarHBondContact O-N 3.42Å; F286-E289 PolarHBondContact O-N 2.94Å; E289-E292 PolarHBondContact O-N 3.03Å; E289-E293 PolarHBondContact O-N 3.48Å
290L87.3Confident86.4Confident27 Ų2753.5 Ų53.514%0.14130%0.297CS..Hα-helixtrans-64.8-42.3177.7-178.964.1000112.1F286 V287 G288 A294 I313 A316 L320F286-L290 HydrophobicContact CE1-CD2 4.43Å; F286-L290 VanDerWaalsContact O-CB 3.31Å; F286-L290 WeakPolarHBondContact O-CB 3.41Å; F286-L290 PolarHBondContact O-N 2.9Å; V287-L290 PolarHBondContact O-N 3.34Å; G288-L290 VanDerWaalsContact C-N 3.3Å; G288-L290 PolarHBondContact O-N 3.47Å; L290-A294 VanDerWaalsContact O-CB 3.25Å; L290-A294 WeakPolarHBondContact O-CB 3.22Å; L290-A294 PolarHBondContact O-N 3.24Å; L290-A294 VanDerWaalsContact O-N 3.08Å; L290-I313 HydrophobicContact CD1-CG2 4.39Å; L290-I313 HydrophobicContact CD2-CG2 4.08Å; L290-I313 HydrophobicContact CG-CG2 4.32Å; L290-A316 HydrophobicContact CD1-CB 3.88Å; L290-L320 HydrophobicContact CB-CD1 4.27Å; L290-L320 HydrophobicContact CD1-CD1 3.78Å
291V88Confident86.5Confident63 Ų6358.2 Ų58.238%0.38231%0.311SS..Hα-helixtrans-70.1-40.6178.3171.30000110.6V287 G288 A294 L295V287-V291 HydrophobicContact CG1-CG2 4.28Å; V287-V291 WeakPolarHBondContact O-CB 3.42Å; V287-V291 VanDerWaalsContact O-CG2 3.22Å; V287-V291 WeakPolarHBondContact O-CG2 3.31Å; V287-V291 PolarHBondContact O-N 2.96Å; G288-V291 PolarHBondContact O-N 3.49Å; V291-A294 PolarHBondContact O-N 3.08Å; V291-L295 HydrophobicContact CG1-CD1 4.1Å; V291-L295 HydrophobicContact CG1-CG 4.42Å; V291-L295 VanDerWaalsContact O-CG 3.31Å; V291-L295 WeakPolarHBondContact O-CG 3.31Å; V291-L295 PolarHBondContact O-N 2.93Å
292E85.1Confident86.2Confident127 Ų12765.6 Ų65.659%0.59333%0.333SS*.Hα-helixtrans-59.2-51.4175.8-75.4177.3-176.400111.8G288 E289 A294 L295 D296G288-E292 WeakPolarHBondContact O-CG 3.45Å; G288-E292 PolarHBondContact O-N 2.98Å; E289-E292 PolarHBondContact O-N 3.03Å; E292-A294 VanDerWaalsContact C-N 3.25Å; E292-A294 PolarHBondContact O-N 3.07Å; E292-L295 WeakPolarHBondContact O-CB 3.25Å; E292-L295 PolarHBondContact O-N 3.22Å; E292-L295 VanDerWaalsContact O-N 3.11Å; E292-D296 PolarHBondContact O-N 2.95Å
293E85.7Confident85.9Confident20 Ų2062.9 Ų62.99%0.09332%0.318CS..Hα-helixtrans-64.2-32177.1-73.4-84.9-179.800112.3E289 D296 I297 A316 L320 K323E289-E293 PolarHBondContact O-N 3.48Å; E293-D296 PolarHBondContact O-N 3.05Å; E293-I297 WeakPolarHBondContact O-CD1 3.37Å; E293-I297 VanDerWaalsContact O-CG1 3.27Å; E293-I297 WeakPolarHBondContact O-CG1 3.42Å; E293-I297 PolarHBondContact O-N 3.05Å; E293-A316 HydrophobicContact CB-CB 4.07Å; E293-L320 HydrophobicContact CB-CD1 4.47Å; E293-L320 HydrophobicContact CB-CG 4.48Å; E293-L320 HydrophobicContact CG-CD1 4.38Å; E293-L320 HydrophobicContact CG-CD2 3.92Å; E293-L320 HydrophobicContact CG-CG 4.07Å; E293-K323 IonicContact OE1-NZ 2.78Å; E293-K323 PolarHBondContact OE1-NZ 2.67Å; E293-K323 IonicContact OE2-NZ 3.19Å; E293-K323 PolarHBondContact OE2-NZ 2.78Å
294A88.3Confident85.1Confident0 Ų064.9 Ų64.90%033%0.33CS..Hα-helixtrans-70-34.1176.100000112L290 V291 E292 R298 L308 H312 I313 A316L290-A294 VanDerWaalsContact O-CB 3.25Å; L290-A294 WeakPolarHBondContact O-CB 3.22Å; L290-A294 PolarHBondContact O-N 3.24Å; L290-A294 VanDerWaalsContact O-N 3.08Å; V291-A294 PolarHBondContact O-N 3.08Å; E292-A294 VanDerWaalsContact C-N 3.25Å; E292-A294 PolarHBondContact O-N 3.07Å; A294-R298 WeakPolarHBondContact O-CB 3.47Å; A294-R298 PolarHBondContact O-N 2.9Å; A294-L308 HydrophobicContact CB-CD1 3.76Å; A294-L308 HydrophobicContact CB-CD2 4.07Å; A294-L308 HydrophobicContact CB-CG 4.38Å; A294-H312 HydrophobicContact CB-CB 4.36Å; A294-I313 HydrophobicContact CB-CG1 4.35Å; A294-A316 HydrophobicContact CB-CB 3.77Å
295L86.5Confident84.4Confident61 Ų6172.6 Ų72.632%0.31936%0.364SS..Hα-helixtrans-67.8-43.2171.6-70.7169.4000111.1V291 E292 I297 R298 D299 L308V291-L295 HydrophobicContact CG1-CD1 4.1Å; V291-L295 HydrophobicContact CG1-CG 4.42Å; V291-L295 VanDerWaalsContact O-CG 3.31Å; V291-L295 WeakPolarHBondContact O-CG 3.31Å; V291-L295 PolarHBondContact O-N 2.93Å; E292-L295 WeakPolarHBondContact O-CB 3.25Å; E292-L295 PolarHBondContact O-N 3.22Å; E292-L295 VanDerWaalsContact O-N 3.11Å; L295-I297 VanDerWaalsContact C-N 3.31Å; L295-I297 PolarHBondContact O-N 2.93Å; L295-R298 WeakPolarHBondContact O-CB 3.43Å; L295-R298 PolarHBondContact O-N 3.37Å; L295-R298 VanDerWaalsContact O-N 3.14Å; L295-D299 VanDerWaalsContact O-CG 3.29Å; L295-D299 PolarHBondContact O-N 3.06Å; L295-L308 HydrophobicContact CD2-CD1 4.47Å
296D86.9Confident84.1Confident82 Ų8272.5 Ų72.544%0.43936%0.358SS..Hα-helixtrans-60.3-40.4175.1-71.9-15.8000111.8E292 E293 D299 N300E292-D296 PolarHBondContact O-N 2.95Å; E293-D296 PolarHBondContact O-N 3.05Å; D296-D299 PolarHBondContact O-N 2.89Å; D296-N300 VanDerWaalsContact O-CB 3.3Å; D296-N300 WeakPolarHBondContact O-CB 3.37Å; D296-N300 PolarHBondContact O-N 3.37Å; D296-N300 PolarHBondContact O-ND2 3.14Å
297I87.5Confident84.1Confident0 Ų074.5 Ų74.50%038%0.378CS..Hα-helixtrans-64.3-43.9175.3-71.7159.5000111.1E293 L295 D299 N300 W301 E315 A316E293-I297 WeakPolarHBondContact O-CD1 3.37Å; E293-I297 VanDerWaalsContact O-CG1 3.27Å; E293-I297 WeakPolarHBondContact O-CG1 3.42Å; E293-I297 PolarHBondContact O-N 3.05Å; L295-I297 VanDerWaalsContact C-N 3.31Å; L295-I297 PolarHBondContact O-N 2.93Å; I297-D299 VanDerWaalsContact C-N 3.31Å; I297-D299 PolarHBondContact O-N 3.47Å; I297-N300 PolarHBondContact O-N 3.49Å; I297-W301 HydrophobicContact CG2-CD2 4.02Å; I297-W301 HydrophobicContact CG2-CE3 4.38Å; I297-W301 HydrophobicContact CG2-CG 4.46Å; I297-W301 HydrophobicContact CG2-CH2 4.48Å; I297-W301 HydrophobicContact CG2-CZ2 4.13Å; I297-W301 WeakPolarHBondContact O-CB 3.47Å; I297-W301 PolarHBondContact O-N 3.35Å; I297-E315 HydrophobicContact CD1-CB 3.98Å; I297-E315 HydrophobicContact CD1-CG 3.84Å; I297-E315 HydrophobicContact CG1-CG 4.46Å; I297-E315 HydrophobicContact CG2-CB 4.49Å; I297-E315 HydrophobicContact CG2-CG 4.36Å; I297-A316 HydrophobicContact CD1-CB 3.76Å
298R85.4Confident83.9Confident48 Ų4874.4 Ų74.418%0.18137%0.374CS..Hα-helixtrans-59.6-44.8177.7179.8-16067.9173.4-0.3110.9A294 L295 W301 K302 E303 S304 E306A294-R298 WeakPolarHBondContact O-CB 3.47Å; A294-R298 PolarHBondContact O-N 2.9Å; L295-R298 WeakPolarHBondContact O-CB 3.43Å; L295-R298 PolarHBondContact O-N 3.37Å; L295-R298 VanDerWaalsContact O-N 3.14Å; R298-W301 PolarHBondContact O-N 3.11Å; R298-K302 PolarHBondContact O-N 3.29Å; R298-E303 WeakPolarHBondContact CD-O 3.39Å; R298-E303 HydrophobicContact CG-CB 4.06Å; R298-E303 VanDerWaalsContact CG-O 3.25Å; R298-E303 WeakPolarHBondContact CG-O 3.25Å; R298-E303 PolarHBondContact O-N 2.98Å; R298-S304 PolarHBondContact NH1-O 2.79Å; R298-E306 WeakPolarHBondContact CD-O 3.5Å
299D86.5Confident84Confident77 Ų7776.4 Ų76.441%0.41238%0.376SS..Hα-helixtrans-69-39.8-178.8-67.3-3.5000110.8L295 D296 I297 W301 K302L295-D299 VanDerWaalsContact O-CG 3.29Å; L295-D299 PolarHBondContact O-N 3.06Å; D296-D299 PolarHBondContact O-N 2.89Å; I297-D299 VanDerWaalsContact C-N 3.31Å; I297-D299 PolarHBondContact O-N 3.47Å; D299-W301 VanDerWaalsContact C-N 3.29Å; D299-W301 PolarHBondContact O-N 3.31Å; D299-K302 PolarHBondContact O-N 3.46Å; D299-K302 VanDerWaalsContact O-N 3.08Å
300N88.2Confident84.3Confident106 Ų10677.5 Ų77.557%0.56739%0.389SS*.Hα-helixtrans-61.3-34.5171.9-77.3-46.1000113.3D296 I297 K302D296-N300 VanDerWaalsContact O-CB 3.3Å; D296-N300 WeakPolarHBondContact O-CB 3.37Å; D296-N300 PolarHBondContact O-N 3.37Å; D296-N300 PolarHBondContact O-ND2 3.14Å; I297-N300 PolarHBondContact O-N 3.49Å; N300-K302 PolarHBondContact O-N 3.47Å
301W87.3Confident84.4Confident114 Ų11479.5 Ų79.543%0.43240%0.396SS..THydrogen-bonded Turntrans-83.85.9177.6-704.4000113.2I297 R298 D299 E303 K311 H312 E315I297-W301 HydrophobicContact CG2-CD2 4.02Å; I297-W301 HydrophobicContact CG2-CE3 4.38Å; I297-W301 HydrophobicContact CG2-CG 4.46Å; I297-W301 HydrophobicContact CG2-CH2 4.48Å; I297-W301 HydrophobicContact CG2-CZ2 4.13Å; I297-W301 WeakPolarHBondContact O-CB 3.47Å; I297-W301 PolarHBondContact O-N 3.35Å; R298-W301 PolarHBondContact O-N 3.11Å; D299-W301 VanDerWaalsContact C-N 3.29Å; D299-W301 PolarHBondContact O-N 3.31Å; W301-E303 HydrophobicContact CB-CG 4.44Å; W301-E303 PolarHBondContact O-N 2.93Å; W301-K311 HydrophobicContact CZ3-CD 4.13Å; W301-K311 HydrophobicContact CZ3-CG 4.24Å; W301-H312 AromaticContact CE3-CD2 3.85Å; W301-E315 HydrophobicContact CZ2-CG 4.34Å
302K79.9Confident84.5Confident193 Ų19376.5 Ų76.584%0.83938%0.378SS*.THydrogen-bonded Turntrans58.923.9-178.4-54.8-179.6-179.9179.80113.5R298 D299 N300 S304R298-K302 PolarHBondContact O-N 3.29Å; D299-K302 PolarHBondContact O-N 3.46Å; D299-K302 VanDerWaalsContact O-N 3.08Å; N300-K302 PolarHBondContact O-N 3.47Å; K302-S304 VanDerWaalsContact C-N 3.31Å
303E79.6Confident84.7Confident44 Ų4473.7 Ų73.721%0.20637%0.367CS..  trans-97.328.1176.5-66.2-177.7169.300111.2R298 W301 K305 E306 K311 H312R298-E303 WeakPolarHBondContact CD-O 3.39Å; R298-E303 HydrophobicContact CG-CB 4.06Å; R298-E303 VanDerWaalsContact CG-O 3.25Å; R298-E303 WeakPolarHBondContact CG-O 3.25Å; R298-E303 PolarHBondContact O-N 2.98Å; W301-E303 HydrophobicContact CB-CG 4.44Å; W301-E303 PolarHBondContact O-N 2.93Å; E303-K305 PolarHBondContact O-N 3.44Å; E303-E306 HydrophobicContact CB-CB 4.49Å; E303-E306 PolarHBondContact O-N 2.86Å; E303-K311 IonicContact OE1-NZ 3.9Å; E303-K311 PolarHBondContact OE1-NZ 3.01Å; E303-K311 WeakPolarHBondContact OE2-CE 3.07Å; E303-K311 IonicContact OE2-NZ 3.83Å; E303-K311 PolarHBondContact OE2-NZ 3.37Å; E303-H312 IonicContact OE2-CD2 3.09Å; E303-H312 IonicContact OE2-CE1 3.53Å; E303-H312 PolarHBondContact OE2-CE1 3.09Å; E303-H312 VanDerWaalsContact OE2-CE1 3.3Å; E303-H312 IonicContact OE2-NE2 3.95Å; E303-H312 PolarHBondContact OE2-NE2 2.92Å
304S71.1Confident84.9Confident67 Ų6781.2 Ų81.247%0.46939%0.394SS..THydrogen-bonded Turntrans-58.9-25.1-169560000114.9R298 K302R298-S304 PolarHBondContact NH1-O 2.79Å; K302-S304 VanDerWaalsContact C-N 3.31Å
305K72.8Confident84.8Confident206 Ų20683 Ų8390%0.89640%0.402SS*.THydrogen-bonded Turntrans-86.7-13.8176.7-76.3-174.9176.7-179.40114.4E303E303-K305 PolarHBondContact O-N 3.44Å
306E78.2Confident84.8Confident73 Ų7380 Ų8034%0.34139%0.387SS..SBendtrans-86.2149.5-178-63.5-168.2127.700111.5R298 E303 K309R298-E306 WeakPolarHBondContact CD-O 3.5Å; E303-E306 HydrophobicContact CB-CB 4.49Å; E303-E306 PolarHBondContact O-N 2.86Å; E306-K309 IonicContact OE1-NZ 2.84Å; E306-K309 PolarHBondContact OE1-NZ 2.83Å; E306-K309 WeakPolarHBondContact OE2-CE 3.35Å; E306-K309 IonicContact OE2-NZ 2.63Å; E306-K309 PolarHBondContact OE2-NZ 3.25Å
307P84.3Confident84.8Confident103 Ų10381.6 Ų81.667%0.66939%0.387SS*.  trans-62.7156.1172.228.2-35.2000110.6K309P307-K309 PolarHBondContact O-N 3.47Å
308L84.3Confident84.7Confident59 Ų5989 Ų8931%0.30942%0.416SS..  trans-60.5113.7179.6-162.270.3000110.3A294 L295 H312 I313A294-L308 HydrophobicContact CB-CD1 3.76Å; A294-L308 HydrophobicContact CB-CD2 4.07Å; A294-L308 HydrophobicContact CB-CG 4.38Å; L295-L308 HydrophobicContact CD2-CD1 4.47Å; L308-H312 HydrophobicContact CD1-CB 3.88Å; L308-H312 HydrophobicContact CG-CB 4.48Å; L308-I313 HydrophobicContact CD2-CD1 3.94Å; L308-I313 HydrophobicContact CD2-CG1 3.77Å; L308-I313 HydrophobicContact CG-CD1 4.43Å; L308-I313 HydrophobicContact CG-CG1 4.12Å
309K88Confident84.7Confident68 Ų6890.2 Ų90.230%0.29642%0.42SS..  trans-89.4150.8-179.5-72.2170.6178.9171.20109.6E306 P307 K311 H312E306-K309 IonicContact OE1-NZ 2.84Å; E306-K309 PolarHBondContact OE1-NZ 2.83Å; E306-K309 WeakPolarHBondContact OE2-CE 3.35Å; E306-K309 IonicContact OE2-NZ 2.63Å; E306-K309 PolarHBondContact OE2-NZ 3.25Å; P307-K309 PolarHBondContact O-N 3.47Å; K309-K311 HydrophobicContact CB-CD 4.34Å; K309-K311 HydrophobicContact CB-CG 3.81Å; K309-K311 HydrophobicContact CD-CD 4.41Å; K309-K311 PolarHBondContact O-N 3.14Å; K309-H312 PolarHBondContact N-ND1 2.85Å; K309-H312 WeakPolarHBondContact O-CB 3.44Å; K309-H312 PolarHBondContact O-N 3.24Å
310P89.3Confident84.4Confident90 Ų9086.6 Ų86.658%0.58440%0.401SS*.Hα-helixtrans-56.4-19.7175.9-27.434.9000114.8R314P310-R314 WeakPolarHBondContact O-CG 3.3Å; P310-R314 PolarHBondContact O-N 2.62Å; P310-R314 PolarHBondContact O-NE 3.12Å
311K90.1Very high83.8Confident68 Ų6885 Ų8530%0.29639%0.392SS..Hα-helixtrans-66.1-39.1172.267-176.2-173.1172.80112.5W301 E303 K309 E315W301-K311 HydrophobicContact CZ3-CD 4.13Å; W301-K311 HydrophobicContact CZ3-CG 4.24Å; E303-K311 IonicContact OE1-NZ 3.9Å; E303-K311 PolarHBondContact OE1-NZ 3.01Å; E303-K311 WeakPolarHBondContact OE2-CE 3.07Å; E303-K311 IonicContact OE2-NZ 3.83Å; E303-K311 PolarHBondContact OE2-NZ 3.37Å; K309-K311 HydrophobicContact CB-CD 4.34Å; K309-K311 HydrophobicContact CB-CG 3.81Å; K309-K311 HydrophobicContact CD-CD 4.41Å; K309-K311 PolarHBondContact O-N 3.14Å; K311-E315 PolarHBondContact O-N 3.44Å; K311-E315 VanDerWaalsContact O-N 3.13Å
312H89.7Confident83.2Confident0 Ų084.6 Ų84.60%040%0.402CS..Hα-helixtrans-68.3-44-179.6-52.8136.7000110.8A294 W301 E303 L308 K309 R314 E315 A316A294-H312 HydrophobicContact CB-CB 4.36Å; W301-H312 AromaticContact CE3-CD2 3.85Å; E303-H312 IonicContact OE2-CD2 3.09Å; E303-H312 IonicContact OE2-CE1 3.53Å; E303-H312 PolarHBondContact OE2-CE1 3.09Å; E303-H312 VanDerWaalsContact OE2-CE1 3.3Å; E303-H312 IonicContact OE2-NE2 3.95Å; E303-H312 PolarHBondContact OE2-NE2 2.92Å; L308-H312 HydrophobicContact CD1-CB 3.88Å; L308-H312 HydrophobicContact CG-CB 4.48Å; K309-H312 PolarHBondContact N-ND1 2.85Å; K309-H312 WeakPolarHBondContact O-CB 3.44Å; K309-H312 PolarHBondContact O-N 3.24Å; H312-R314 PolarHBondContact O-N 2.84Å; H312-E315 PolarHBondContact O-N 3.34Å; H312-A316 WeakPolarHBondContact O-CB 3.27Å; H312-A316 PolarHBondContact O-N 3.15Å
313I89.1Confident82.8Confident69 Ų6980.3 Ų80.335%0.35438%0.384SS..Hα-helixtrans-64.2-41.6178.6-58.6174.8000111.3L290 A294 L308 E315 A316 Y317L290-I313 HydrophobicContact CD1-CG2 4.39Å; L290-I313 HydrophobicContact CD2-CG2 4.08Å; L290-I313 HydrophobicContact CG-CG2 4.32Å; A294-I313 HydrophobicContact CB-CG1 4.35Å; L308-I313 HydrophobicContact CD2-CD1 3.94Å; L308-I313 HydrophobicContact CD2-CG1 3.77Å; L308-I313 HydrophobicContact CG-CD1 4.43Å; L308-I313 HydrophobicContact CG-CG1 4.12Å; I313-E315 VanDerWaalsContact C-N 3.34Å; I313-E315 PolarHBondContact O-N 3.31Å; I313-A316 WeakPolarHBondContact O-CB 3.35Å; I313-A316 PolarHBondContact O-N 3.26Å; I313-Y317 WeakPolarHBondContact O-CB 3.49Å; I313-Y317 PolarHBondContact O-N 3.22Å
314R89.4Confident81.8Confident178 Ų17886.8 Ų86.867%0.67241%0.406SS*.Hα-helixtrans-63.1-41.6177.2-78-176.6-71-169.12.3112P310 H312 R318P310-R314 WeakPolarHBondContact O-CG 3.3Å; P310-R314 PolarHBondContact O-N 2.62Å; P310-R314 PolarHBondContact O-NE 3.12Å; H312-R314 PolarHBondContact O-N 2.84Å; R314-R318 PolarHBondContact O-N 3.3Å
315E86.2Confident81.3Confident36 Ų3688.8 Ų88.817%0.16841%0.407CS..Hα-helixtrans-70.6-36.9175.9-174.859.5-163.900111.7I297 W301 K311 H312 I313 Y317 R318 R319I297-E315 HydrophobicContact CD1-CB 3.98Å; I297-E315 HydrophobicContact CD1-CG 3.84Å; I297-E315 HydrophobicContact CG1-CG 4.46Å; I297-E315 HydrophobicContact CG2-CB 4.49Å; I297-E315 HydrophobicContact CG2-CG 4.36Å; W301-E315 HydrophobicContact CZ2-CG 4.34Å; K311-E315 PolarHBondContact O-N 3.44Å; K311-E315 VanDerWaalsContact O-N 3.13Å; H312-E315 PolarHBondContact O-N 3.34Å; I313-E315 VanDerWaalsContact C-N 3.34Å; I313-E315 PolarHBondContact O-N 3.31Å; E315-Y317 VanDerWaalsContact C-N 3.35Å; E315-Y317 PolarHBondContact O-N 3.48Å; E315-R318 WeakPolarHBondContact O-CB 3.39Å; E315-R318 PolarHBondContact O-N 3.19Å; E315-R318 VanDerWaalsContact O-N 3.14Å; E315-R318 IonicContact OE1-CZ 3.6Å; E315-R318 IonicContact OE1-NE 2.86Å; E315-R318 PolarHBondContact OE1-NE 3.01Å; E315-R318 IonicContact OE1-NH2 3.63Å; E315-R318 PolarHBondContact OE1-NH2 2.89Å; E315-R318 IonicContact OE2-CZ 2.91Å; E315-R318 IonicContact OE2-NE 3.28Å; E315-R318 PolarHBondContact OE2-NE 2.7Å; E315-R318 IonicContact OE2-NH2 2.57Å; E315-R319 WeakPolarHBondContact O-CG 3.39Å; E315-R319 PolarHBondContact O-N 3.25Å; E315-R319 IonicContact OE1-NE 3.66Å
316A87Confident80.6Confident0 Ų080 Ų800%037%0.37CS..Hα-helixtrans-59.6-46.717400000111L290 E293 A294 I297 H312 I313 R318 R319 L320L290-A316 HydrophobicContact CD1-CB 3.88Å; E293-A316 HydrophobicContact CB-CB 4.07Å; A294-A316 HydrophobicContact CB-CB 3.77Å; I297-A316 HydrophobicContact CD1-CB 3.76Å; H312-A316 WeakPolarHBondContact O-CB 3.27Å; H312-A316 PolarHBondContact O-N 3.15Å; I313-A316 WeakPolarHBondContact O-CB 3.35Å; I313-A316 PolarHBondContact O-N 3.26Å; A316-R318 VanDerWaalsContact C-N 3.31Å; A316-R318 PolarHBondContact O-N 3.22Å; A316-R319 PolarHBondContact O-N 2.94Å; A316-L320 WeakPolarHBondContact O-CB 3.37Å; A316-L320 WeakPolarHBondContact O-CG 3.46Å; A316-L320 PolarHBondContact O-N 2.82Å
317Y86.8Confident79.5Confident114 Ų11484.9 Ų84.945%0.44739%0.39SS..Hα-helixtrans-61.2-38.6174.6-175.3-104.4000112.3F286 I313 E315 N321 V326F286-Y317 HydrophobicContact CZ-CE2 4.48Å; I313-Y317 WeakPolarHBondContact O-CB 3.49Å; I313-Y317 PolarHBondContact O-N 3.22Å; E315-Y317 VanDerWaalsContact C-N 3.35Å; E315-Y317 PolarHBondContact O-N 3.48Å; Y317-N321 WeakPolarHBondContact CD1-ND2 3.45Å; Y317-N321 WeakPolarHBondContact CE1-ND2 3.47Å; Y317-N321 WeakPolarHBondContact O-CB 3.34Å; Y317-N321 PolarHBondContact O-N 3.14Å; Y317-N321 PolarHBondContact O-ND2 3.42Å; Y317-V326 HydrophobicContact CE2-CG1 4.02Å
318R85.9Confident78.1Confident157 Ų15785 Ų8559%0.59239%0.391SS*.Hα-helixtrans-63.2-47.8174.7-166.3179.579.1117.65.4111.4R314 E315 A316 N321 T322R314-R318 PolarHBondContact O-N 3.3Å; E315-R318 WeakPolarHBondContact O-CB 3.39Å; E315-R318 PolarHBondContact O-N 3.19Å; E315-R318 VanDerWaalsContact O-N 3.14Å; E315-R318 IonicContact OE1-CZ 3.6Å; E315-R318 IonicContact OE1-NE 2.86Å; E315-R318 PolarHBondContact OE1-NE 3.01Å; E315-R318 IonicContact OE1-NH2 3.63Å; E315-R318 PolarHBondContact OE1-NH2 2.89Å; E315-R318 IonicContact OE2-CZ 2.91Å; E315-R318 IonicContact OE2-NE 3.28Å; E315-R318 PolarHBondContact OE2-NE 2.7Å; E315-R318 IonicContact OE2-NH2 2.57Å; A316-R318 VanDerWaalsContact C-N 3.31Å; A316-R318 PolarHBondContact O-N 3.22Å; R318-N321 PolarHBondContact O-N 3.39Å; R318-T322 PolarHBondContact O-N 3.36Å; R318-T322 VanDerWaalsContact O-N 3.14Å; R318-T322 PolarHBondContact O-OG1 3.06Å
319R84.3Confident76.1Confident73 Ų7390.3 Ų90.328%0.27542%0.417SS..Hα-helixtrans-63.5-44.3177.8-71.6-169.2-174.6-175.9-3.6112.2E315 A316 N321 T322 K323E315-R319 WeakPolarHBondContact O-CG 3.39Å; E315-R319 PolarHBondContact O-N 3.25Å; E315-R319 IonicContact OE1-NE 3.66Å; A316-R319 PolarHBondContact O-N 2.94Å; R319-N321 VanDerWaalsContact C-N 3.31Å; R319-N321 PolarHBondContact O-N 3.08Å; R319-T322 PolarHBondContact O-N 2.95Å; R319-T322 VanDerWaalsContact O-N 3.12Å; R319-K323 WeakPolarHBondContact O-CB 3.43Å; R319-K323 WeakPolarHBondContact O-CG 3.39Å; R319-K323 PolarHBondContact O-N 3.3Å
320L81Confident74Confident1 Ų190.2 Ų90.21%0.00543%0.425CS..Hα-helixtrans-63.1-37.7177.9-77.3168.4000111.8L290 E293 A316 T322 K323 W324 K325 V326L290-L320 HydrophobicContact CB-CD1 4.27Å; L290-L320 HydrophobicContact CD1-CD1 3.78Å; E293-L320 HydrophobicContact CB-CD1 4.47Å; E293-L320 HydrophobicContact CB-CG 4.48Å; E293-L320 HydrophobicContact CG-CD1 4.38Å; E293-L320 HydrophobicContact CG-CD2 3.92Å; E293-L320 HydrophobicContact CG-CG 4.07Å; A316-L320 WeakPolarHBondContact O-CB 3.37Å; A316-L320 WeakPolarHBondContact O-CG 3.46Å; A316-L320 PolarHBondContact O-N 2.82Å; L320-T322 VanDerWaalsContact C-N 3.32Å; L320-T322 PolarHBondContact O-N 3.37Å; L320-K323 PolarHBondContact O-N 3.31Å; L320-W324 PolarHBondContact O-N 3.13Å; L320-K325 HydrophobicContact CD2-CB 3.8Å; L320-K325 HydrophobicContact CD2-CD 4.1Å; L320-K325 PolarHBondContact O-N 3.04Å; L320-K325 VanDerWaalsContact O-N 3.15Å; L320-V326 HydrophobicContact CB-CG2 3.41Å; L320-V326 VanDerWaalsContact CB-CG2 3.41Å
321N76.4Confident71.7Confident72 Ų7290.7 Ų90.739%0.38543%0.43SS..Hα-helixtrans-64.6-34.3173.3-83.3-24000112.8Y317 R318 R319 V326Y317-N321 WeakPolarHBondContact CD1-ND2 3.45Å; Y317-N321 WeakPolarHBondContact CE1-ND2 3.47Å; Y317-N321 WeakPolarHBondContact O-CB 3.34Å; Y317-N321 PolarHBondContact O-N 3.14Å; Y317-N321 PolarHBondContact O-ND2 3.42Å; R318-N321 PolarHBondContact O-N 3.39Å; R319-N321 VanDerWaalsContact C-N 3.31Å; R319-N321 PolarHBondContact O-N 3.08Å; N321-V326 WeakPolarHBondContact OD1-CB 3.39Å; N321-V326 WeakPolarHBondContact OD1-CG2 3.04Å
322T73.9Confident69.6Low105 Ų10596.3 Ų96.364%0.64445%0.454SS*.Hα-helixtrans-76.4-34.8175.1-53.50000112.1R318 R319 L320 W324R318-T322 PolarHBondContact O-N 3.36Å; R318-T322 VanDerWaalsContact O-N 3.14Å; R318-T322 PolarHBondContact O-OG1 3.06Å; R319-T322 PolarHBondContact O-N 2.95Å; R319-T322 VanDerWaalsContact O-N 3.12Å; L320-T322 VanDerWaalsContact C-N 3.32Å; L320-T322 PolarHBondContact O-N 3.37Å; T322-W324 VanDerWaalsContact O-CD1 3.25Å; T322-W324 PolarHBondContact O-N 2.86Å
323K71.2Confident67.5Low104 Ų104103.9 Ų103.945%0.45249%0.487SS..THydrogen-bonded Turntrans-773.2177.2-72.2177.6176.9174.20113.8E293 R319 L320 K325E293-K323 IonicContact OE1-NZ 2.78Å; E293-K323 PolarHBondContact OE1-NZ 2.67Å; E293-K323 IonicContact OE2-NZ 3.19Å; E293-K323 PolarHBondContact OE2-NZ 2.78Å; R319-K323 WeakPolarHBondContact O-CB 3.43Å; R319-K323 WeakPolarHBondContact O-CG 3.39Å; R319-K323 PolarHBondContact O-N 3.3Å; L320-K323 PolarHBondContact O-N 3.31Å; K323-K325 HydrophobicContact CB-CG 4.46Å; K323-K325 PolarHBondContact O-N 2.78Å
324W58Low65.4Low180 Ų180105.2 Ų105.268%0.68249%0.494SS*.THydrogen-bonded Turntrans60.620.1-178.7-57.283.2000115.3L320 T322 I334L320-W324 PolarHBondContact O-N 3.13Å; T322-W324 VanDerWaalsContact O-CD1 3.25Å; T322-W324 PolarHBondContact O-N 2.86Å; W324-I334 HydrophobicContact CH2-CG1 3.94Å; W324-I334 HydrophobicContact CZ3-CG1 4.01Å
325K61Low63.2Low109 Ų109101.3 Ų101.347%0.47449%0.494SS..  trans-91.1-7.7-177.9-72.6-170.2175.1-171.50114.4L320 K323L320-K325 HydrophobicContact CD2-CB 3.8Å; L320-K325 HydrophobicContact CD2-CD 4.1Å; L320-K325 PolarHBondContact O-N 3.04Å; L320-K325 VanDerWaalsContact O-N 3.15Å; K323-K325 HydrophobicContact CB-CG 4.46Å; K323-K325 PolarHBondContact O-N 2.78Å
326V58.3Low61.2Low21 Ų21110.3 Ų110.313%0.12753%0.527CS..SBendtrans-97.8117.6178.3-167.70000109.7F286 Y317 L320 N321F286-V326 HydrophobicContact CE2-CB 4.35Å; F286-V326 HydrophobicContact CE2-CG1 3.77Å; F286-V326 HydrophobicContact CE2-CG2 4.1Å; F286-V326 HydrophobicContact CZ-CG1 4.01Å; Y317-V326 HydrophobicContact CE2-CG1 4.02Å; L320-V326 HydrophobicContact CB-CG2 3.41Å; L320-V326 VanDerWaalsContact CB-CG2 3.41Å; N321-V326 WeakPolarHBondContact OD1-CB 3.39Å; N321-V326 WeakPolarHBondContact OD1-CG2 3.04Å
327F56Low59.3Low175 Ų175114.7 Ų114.777%0.76856%0.557SS**SBendtrans-64.9128.7163.9-76.1-91.9000108.4
328P53.5Low57.1Low106 Ų106118.8 Ų118.869%0.68858%0.578SS**  cis-116151.335.636.7-26.6000115.2S330P328-S330 VanDerWaalsContact C-N 3.26Å; P328-S330 PolarHBondContact O-N 3.19Å
329M44Very low54.8Low170 Ų170118.6 Ų118.684%0.83759%0.587SS**  trans-58.884.5162.5-80.1-172.6-8600110.3S331M329-S331 PolarHBondContact O-N 3.16Å
330S42.1Very low52.6Low67 Ų67127.6 Ų127.647%0.46964%0.636SS.*  trans-74.2100.2164.7-169.50000108.1P328 K332 K333P328-S330 VanDerWaalsContact C-N 3.26Å; P328-S330 PolarHBondContact O-N 3.19Å; S330-K332 PolarHBondContact O-N 3.42Å; S330-K333 PolarHBondContact O-N 3.27Å; S330-K333 VanDerWaalsContact O-N 3.09Å
331S42.5Very low51.2Low99 Ų99134 Ų13469%0.69267%0.668SS**G310 helixtrans-46.9-25.6173.3173.50000113M329 K333M329-S331 PolarHBondContact O-N 3.16Å; S331-K333 VanDerWaalsContact C-N 3.29Å; S331-K333 PolarHBondContact O-N 3.35Å
332K46.3Very low49.9Very low186 Ų186137.2 Ų137.281%0.80968%0.682SS**G310 helixtrans-71.1-12-178.4-66.1-175.1178.7179.70115.3S330S330-K332 PolarHBondContact O-N 3.42Å
333K45Very low48.6Very low160 Ų160139 Ų13970%0.69669%0.685SS**G310 helixtrans-101.9-17.3178.9-82.6-172.3177.1-179.80115.3S330 S331 S335 R336S330-K333 PolarHBondContact O-N 3.27Å; S330-K333 VanDerWaalsContact O-N 3.09Å; S331-K333 VanDerWaalsContact C-N 3.29Å; S331-K333 PolarHBondContact O-N 3.35Å; K333-S335 PolarHBondContact O-N 2.63Å; K333-R336 PolarHBondContact O-N 2.84Å
334I44.6Very low47.2Very low96 Ų96141.1 Ų141.149%0.49270%0.698SS.*G310 helixtrans-64.8-26.7179.4-70.3162.9000111.7W324 R336W324-I334 HydrophobicContact CH2-CG1 3.94Å; W324-I334 HydrophobicContact CZ3-CG1 4.01Å; I334-R336 VanDerWaalsContact C-N 3.34Å; I334-R336 PolarHBondContact O-N 2.86Å
335S42.3Very low46.6Very low96 Ų96138.6 Ų138.667%0.67170%0.699SS**G310 helixtrans-77.6-8-176.7-175.50000115.4K333K333-S335 PolarHBondContact O-N 2.63Å
336R45.9Very low45.6Very low226 Ų226140.6 Ų140.685%0.85371%0.714SS**G310 helixtrans-109.3-7.1-170.7-73.5-167.5176.1-168.5-1.3115.9K333 I334K333-R336 PolarHBondContact O-N 2.84Å; I334-R336 VanDerWaalsContact C-N 3.34Å; I334-R336 PolarHBondContact O-N 2.86Å
337S45.8Very low44.7Very low92 Ų92149.1 Ų149.164%0.64376%0.756SS**SBendtrans-104.73.1-179.2620000114.7
338F41.6Very low43.8Very low199 Ų199147.2 Ų147.287%0.87376%0.755SS**SBendtrans-100.213.4178.7-164.9-102.6000113.1
339L37.2Very low43Very low153 Ų153150.6 Ų150.680%0.80176%0.761SS**  trans-13224.6-169.7-113.1159.7000114.7
340M38.9Very low42.9Very low263 Ų263148.8 Ų148.8100%1.29675%0.754SS**  trans-134.10165.1-96-173.5168.500110.8

Retrieved 340 of 340 residues in 1144.4 ms (Link to these results)