A0A077ZKZ7_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZKZ7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 236 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
1M48.5Very low59.7Low232 Ų232162.5 Ų162.5100%1.14386%0.861SS**  0106.20-76.7-66.2149.700108.4
2P58.6Low58.9Low127 Ų127165.8 Ų165.883%0.82585%0.852SS**  trans-85.3119.6-179.731.8-26.9000109.2
3R60.9Low58.5Low252 Ų252162.2 Ų162.295%0.95185%0.851SS**  trans-111.6122.9166.7-86.1-168.5172.1-142.6-0.6109.9
4R58.9Low58.3Low240 Ų240162.9 Ų162.991%0.90684%0.844SS**  trans-71.8148.7-168.4-68.2173.5174.6179.2-3.7111.9
5T60.9Low58Low132 Ų132159.7 Ų159.781%0.8184%0.841SS**  trans-65.1139.8165.4390000112.1
6C67.6Low57.7Low126 Ų126156.9 Ų156.985%0.85184%0.839SS**  trans-137.599.6151.1-66.40000108.4
7S58.7Low58.1Low107 Ų107155.6 Ų155.675%0.74884%0.838SS**  trans-80124.8165.9172.90000107.9
8V66.4Low57.6Low131 Ų131153.4 Ų153.479%0.79483%0.833SS**  trans-120.5103.5168.2-178.30000107.6
9R55.3Low57.6Low234 Ų234150.1 Ų150.188%0.88383%0.828SS**  trans-69120.9162.9-68175.3170.5-173.5-3.5107.3
10S65.4Low57.9Low120 Ų120148.4 Ų148.484%0.83983%0.825SS**  trans-104.9114.9163.5-162.80000109
11A55.7Low57.6Low87 Ų87147.4 Ų147.472%0.71983%0.828SS**  trans-84.7126.9-176.900000110.9
12R49.5Very low58.1Low201 Ų201140.2 Ų140.276%0.75881%0.806SS**  43.4110.3120.4-155.1-176.3-151.1-144.79.8118.6
13S54.4Low57.9Low120 Ų120144.3 Ų144.384%0.83980%0.804SS**  trans-156.4105.8145.3-640000106.2
14K55Low57.7Low171 Ų171137.6 Ų137.674%0.74380%0.796SS**  41.39269.9-77-166178.1-168.80114.5
15S54Low57.9Low115 Ų115131.7 Ų131.780%0.80478%0.783SS**  trans-160.1118.5134.168.20000111
16S53.7Low58.1Low115 Ų115129.8 Ų129.880%0.80478%0.775SS**  trans-70.5132.8166.947.40000111.8
17V64Low58Low136 Ų136126.7 Ų126.782%0.82476%0.758SS**  trans-150.9140.2155.4-179.80000107.9
18P49.7Very low58.6Low115 Ų115127.9 Ų127.975%0.74776%0.756SS**  trans-90.5164.6-153.235.6-34000115P20P18-P20 WeakPolarHBondContact O-CD 3.43Å
19A57Low59.2Low91 Ų91129.3 Ų129.375%0.75275%0.752SS**  trans-49.4123.8-179.800000115
20P64Low60.5Low116 Ų116121.6 Ų121.675%0.75373%0.734SS**  trans-89101.7150.930-23.8000108.9P18 A22P18-P20 WeakPolarHBondContact O-CD 3.43Å; P20-A22 VanDerWaalsContact C-N 3.29Å; P20-A22 PolarHBondContact O-N 3.41Å
21S51.5Low61.6Low127 Ų127120.1 Ų120.189%0.88872%0.72SS**  trans-64.991.1160.5-620000108.2
22A58.5Low63.1Low82 Ų82118.5 Ų118.568%0.67871%0.706SS**  trans-138.897.5179.400000110.8P20P20-A22 VanDerWaalsContact C-N 3.29Å; P20-A22 PolarHBondContact O-N 3.41Å
23R54Low65.2Low212 Ų212114.2 Ų114.280%0.870%0.698SS**  trans6189.8141.8-145.6172.7178167.84.2116.2D25R23-D25 IonicContact NE-OD2 2.88Å; R23-D25 PolarHBondContact NE-OD2 2.84Å; R23-D25 PolarHBondContact O-N 3.35Å
24S58Low67.1Low111 Ų111114.1 Ų114.178%0.77669%0.688SS**  trans-68.255.2176.7-41.40000114.1
25D63.1Low69Low117 Ų117109 Ų10963%0.62667%0.674SS**  trans-97.114.8173.7-66.5-28.2000112R23R23-D25 IonicContact NE-OD2 2.88Å; R23-D25 PolarHBondContact NE-OD2 2.84Å; R23-D25 PolarHBondContact O-N 3.35Å
26S63.9Low71Confident92 Ų92111.2 Ų111.264%0.64367%0.665SS**  trans-99.7-10.7-177.763.40000114.9D28S26-D28 VanDerWaalsContact C-N 3.31Å; S26-D28 PolarHBondContact O-N 2.87Å
27A66.4Low73Confident61 Ų61108.9 Ų108.950%0.50465%0.645SS.*Hα-helixtrans-68.2-29.5-177.400000112.8S30A27-S30 PolarHBondContact O-OG 3.43Å
28D71.1Confident74.6Confident131 Ų131105.7 Ų105.770%0.70163%0.628SS**Hα-helixtrans-74.2-29.9-177-66.6-24000112.8S26 T31S26-D28 VanDerWaalsContact C-N 3.31Å; S26-D28 PolarHBondContact O-N 2.87Å; D28-T31 PolarHBondContact O-OG1 3.08Å
29K79.1Confident76.9Confident162 Ų162106.2 Ų106.270%0.70462%0.621SS**Hα-helixtrans-70.1-38.9-178.5-75.8-179.3175.6-178.80113.3T31 A32 D33K29-T31 VanDerWaalsContact C-N 3.28Å; K29-T31 PolarHBondContact O-N 3.42Å; K29-A32 PolarHBondContact O-N 2.68Å; K29-D33 PolarHBondContact O-N 3.26Å
30S83.6Confident78.8Confident72 Ų72105.6 Ų105.650%0.50361%0.605SS.*Hα-helixtrans-69.1-28.3-178.358.50000112.8A27 L34A27-S30 PolarHBondContact O-OG 3.43Å; S30-L34 WeakPolarHBondContact O-CB 3.35Å; S30-L34 PolarHBondContact O-N 3.16Å; S30-L34 VanDerWaalsContact O-N 3.07Å
31T87Confident80.4Confident89 Ų89104.7 Ų104.755%0.54659%0.593SS.*Hα-helixtrans-69.4-40176.465.70000112D28 K29 L34 S35D28-T31 PolarHBondContact O-OG1 3.08Å; K29-T31 VanDerWaalsContact C-N 3.28Å; K29-T31 PolarHBondContact O-N 3.42Å; T31-L34 PolarHBondContact O-N 3.21Å; T31-S35 PolarHBondContact O-N 2.97Å
32A88.2Confident82.6Confident53 Ų53103.2 Ų103.244%0.43858%0.578SS.*Hα-helixtrans-63.5-45174.800000111.4K29 L34 S35 W36K29-A32 PolarHBondContact O-N 2.68Å; A32-L34 PolarHBondContact O-N 3.02Å; A32-S35 PolarHBondContact O-N 3.42Å; A32-S35 PolarHBondContact O-OG 2.95Å; A32-W36 PolarHBondContact O-N 3.39Å; A32-W36 VanDerWaalsContact O-N 3.08Å
33D92.8Very high84.4Confident110 Ų110104.5 Ų104.559%0.58857%0.574SS**Hα-helixtrans-61.6-42.2177.8-70-22.9000112K29 W36 V37K29-D33 PolarHBondContact O-N 3.26Å; D33-W36 PolarHBondContact O-N 3.3Å; D33-V37 WeakPolarHBondContact O-CG2 3.47Å; D33-V37 PolarHBondContact O-N 3.49Å; D33-V37 VanDerWaalsContact O-N 3.1Å
34L94.1Very high86.5Confident118 Ų11898.4 Ų98.462%0.61856%0.557SS**Hα-helixtrans-65.6-40.1178-167.173.1000111.8S30 T31 A32 W36 V37 C38S30-L34 WeakPolarHBondContact O-CB 3.35Å; S30-L34 PolarHBondContact O-N 3.16Å; S30-L34 VanDerWaalsContact O-N 3.07Å; T31-L34 PolarHBondContact O-N 3.21Å; A32-L34 PolarHBondContact O-N 3.02Å; L34-W36 VanDerWaalsContact C-N 3.32Å; L34-W36 PolarHBondContact O-N 3.35Å; L34-V37 PolarHBondContact O-N 3.25Å; L34-C38 PolarHBondContact O-N 2.89Å; L34-C38 PolarHBondContact O-SG 3.49Å; L34-C38 VanDerWaalsContact O-SG 3.4Å
35S95.4Very high88.3Confident65 Ų6596.8 Ų96.846%0.45554%0.542SS..Hα-helixtrans-61.2-41.917773.80000111.9T31 A32 V37 C38 E39T31-S35 PolarHBondContact O-N 2.97Å; A32-S35 PolarHBondContact O-N 3.42Å; A32-S35 PolarHBondContact O-OG 2.95Å; S35-V37 PolarHBondContact O-N 3.1Å; S35-C38 PolarHBondContact O-N 2.96Å; S35-E39 PolarHBondContact O-N 3.3Å
36W96.1Very high89.8Confident161 Ų16192.8 Ų92.861%0.6153%0.528SS*.Hα-helixtrans-64.6-40.5177.3-17778.9000112.3A32 D33 L34 C38 E39 L40A32-W36 PolarHBondContact O-N 3.39Å; A32-W36 VanDerWaalsContact O-N 3.08Å; D33-W36 PolarHBondContact O-N 3.3Å; L34-W36 VanDerWaalsContact C-N 3.32Å; L34-W36 PolarHBondContact O-N 3.35Å; W36-C38 VanDerWaalsContact C-N 3.35Å; W36-C38 PolarHBondContact O-N 3.02Å; W36-E39 PolarHBondContact O-N 3.1Å; W36-L40 HydrophobicContact CH2-CD2 4.16Å; W36-L40 HydrophobicContact CZ3-CD2 4.29Å; W36-L40 WeakPolarHBondContact O-CB 3.37Å; W36-L40 PolarHBondContact O-N 3.03Å
37V96.5Very high91.4Very high65 Ų6596.9 Ų96.939%0.39453%0.53SS..Hα-helixtrans-63.7-40.8175.3173.80000111.3D33 L34 S35 L40 L41D33-V37 WeakPolarHBondContact O-CG2 3.47Å; D33-V37 PolarHBondContact O-N 3.49Å; D33-V37 VanDerWaalsContact O-N 3.1Å; L34-V37 PolarHBondContact O-N 3.25Å; S35-V37 PolarHBondContact O-N 3.1Å; V37-L40 PolarHBondContact O-N 3.07Å; V37-L41 HydrophobicContact CG1-CD1 4.09Å; V37-L41 HydrophobicContact CG1-CG 4.46Å; V37-L41 WeakPolarHBondContact O-CG 3.45Å; V37-L41 PolarHBondContact O-N 3.13Å
38C96.7Very high92.8Very high70 Ų7099.4 Ų99.447%0.47353%0.534SS..Hα-helixtrans-63.8-41.2176.1-72.30000112.5L34 S35 W36 L41 T42L34-C38 PolarHBondContact O-N 2.89Å; L34-C38 PolarHBondContact O-SG 3.49Å; L34-C38 VanDerWaalsContact O-SG 3.4Å; S35-C38 PolarHBondContact O-N 2.96Å; W36-C38 VanDerWaalsContact C-N 3.35Å; W36-C38 PolarHBondContact O-N 3.02Å; C38-L41 PolarHBondContact O-N 3.32Å; C38-T42 WeakPolarHBondContact O-CG2 3.44Å; C38-T42 PolarHBondContact O-N 3.42Å; C38-T42 PolarHBondContact O-OG1 3.22Å
39E97.4Very high93.9Very high125 Ų12597.7 Ų97.758%0.58453%0.525SS*.Hα-helixtrans-64.5-38.3173.8-74.2-172.9170.400112.4S35 W36 T42 N43S35-E39 PolarHBondContact O-N 3.3Å; W36-E39 PolarHBondContact O-N 3.1Å; E39-T42 WeakPolarHBondContact CA-OG1 3.49Å; E39-T42 PolarHBondContact O-OG1 3.46Å; E39-N43 WeakPolarHBondContact O-CB 3.4Å; E39-N43 PolarHBondContact O-N 3.37Å; E39-N43 VanDerWaalsContact O-N 3.1Å; E39-N43 PolarHBondContact O-ND2 3.5Å
40L97.7Very high94.5Very high79 Ų7998.9 Ų98.941%0.41453%0.525SS..Hα-helixtrans-65.4-43.8176.8-171.470.6000111.4W36 V37 N43 L44W36-L40 HydrophobicContact CH2-CD2 4.16Å; W36-L40 HydrophobicContact CZ3-CD2 4.29Å; W36-L40 WeakPolarHBondContact O-CB 3.37Å; W36-L40 PolarHBondContact O-N 3.03Å; V37-L40 PolarHBondContact O-N 3.07Å; L40-N43 PolarHBondContact O-N 3.15Å; L40-L44 HydrophobicContact CG-CD1 4.37Å; L40-L44 WeakPolarHBondContact O-CG 3.42Å; L40-L44 PolarHBondContact O-N 3.05Å
41L97.7Very high95.1Very high97 Ų9799.4 Ų99.451%0.50853%0.525SS..Hα-helixtrans-65.8-43.7179.2-73.1173.2000112V37 C38 N43 L44 T45V37-L41 HydrophobicContact CG1-CD1 4.09Å; V37-L41 HydrophobicContact CG1-CG 4.46Å; V37-L41 WeakPolarHBondContact O-CG 3.45Å; V37-L41 PolarHBondContact O-N 3.13Å; C38-L41 PolarHBondContact O-N 3.32Å; L41-N43 VanDerWaalsContact C-N 3.35Å; L41-N43 PolarHBondContact O-N 3.12Å; L41-L44 PolarHBondContact O-N 3.4Å; L41-T45 PolarHBondContact O-N 3.45Å; L41-T45 PolarHBondContact O-OG1 3.32Å
42T97.2Very high95.4Very high95 Ų9598.6 Ų98.658%0.58352%0.52SS*.Hα-helixtrans-63-40.3177.247.20000112.1C38 E39 T45 G46C38-T42 WeakPolarHBondContact O-CG2 3.44Å; C38-T42 PolarHBondContact O-N 3.42Å; C38-T42 PolarHBondContact O-OG1 3.22Å; E39-T42 WeakPolarHBondContact CA-OG1 3.49Å; E39-T42 PolarHBondContact O-OG1 3.46Å; T42-T45 PolarHBondContact O-N 2.96Å; T42-G46 PolarHBondContact O-N 2.94Å
43N96.9Very high95.5Very high109 Ų109101 Ų10158%0.58353%0.525SS*.Hα-helixtrans-64-41.1173.5-83.2-57.8000113.1E39 L40 L41 G46 R47E39-N43 WeakPolarHBondContact O-CB 3.4Å; E39-N43 PolarHBondContact O-N 3.37Å; E39-N43 VanDerWaalsContact O-N 3.1Å; E39-N43 PolarHBondContact O-ND2 3.5Å; L40-N43 PolarHBondContact O-N 3.15Å; L41-N43 VanDerWaalsContact C-N 3.35Å; L41-N43 PolarHBondContact O-N 3.12Å; N43-G46 PolarHBondContact O-N 3.46Å; N43-R47 WeakPolarHBondContact O-CG 3.39Å; N43-R47 PolarHBondContact O-N 2.92Å; N43-R47 VanDerWaalsContact O-N 3.15Å
44L96.8Very high95.3Very high85 Ų8599.5 Ų99.545%0.44552%0.52SS..Hα-helixtrans-65.1-45.2177.2-78.9169.9000111.8L40 L41 G46 R47 L48L40-L44 HydrophobicContact CG-CD1 4.37Å; L40-L44 WeakPolarHBondContact O-CG 3.42Å; L40-L44 PolarHBondContact O-N 3.05Å; L41-L44 PolarHBondContact O-N 3.4Å; L44-G46 VanDerWaalsContact C-N 3.34Å; L44-G46 PolarHBondContact O-N 3.46Å; L44-R47 PolarHBondContact O-N 3.02Å; L44-R47 VanDerWaalsContact O-N 3.12Å; L44-L48 PolarHBondContact O-N 3.26Å
45T96.4Very high94.9Very high77 Ų7799 Ų9947%0.47252%0.517SS..Hα-helixtrans-58.8-46.5176.5-56.70000110.9L41 T42 R47 L48 D49L41-T45 PolarHBondContact O-N 3.45Å; L41-T45 PolarHBondContact O-OG1 3.32Å; T42-T45 PolarHBondContact O-N 2.96Å; T45-R47 PolarHBondContact O-N 2.99Å; T45-L48 PolarHBondContact O-N 3.09Å; T45-L48 VanDerWaalsContact O-N 3.09Å; T45-D49 PolarHBondContact O-N 3.5Å
46G95.5Very high94.5Very high32 Ų32101.1 Ų101.133%0.3352%0.52SS..Hα-helixtrans-62.5-27.517700000114.2T42 N43 L44 R50T42-G46 PolarHBondContact O-N 2.94Å; N43-G46 PolarHBondContact O-N 3.46Å; L44-G46 VanDerWaalsContact C-N 3.34Å; L44-G46 PolarHBondContact O-N 3.46Å; G46-R50 WeakPolarHBondContact O-CG 3.35Å
47R96.4Very high93.8Very high179 Ų17997.8 Ų97.868%0.67552%0.517SS*.Hα-helixtrans-76.3-38.6172.8-72.1-178.169.5176.12.1112.2N43 L44 T45 R50 V51N43-R47 WeakPolarHBondContact O-CG 3.39Å; N43-R47 PolarHBondContact O-N 2.92Å; N43-R47 VanDerWaalsContact O-N 3.15Å; L44-R47 PolarHBondContact O-N 3.02Å; L44-R47 VanDerWaalsContact O-N 3.12Å; T45-R47 PolarHBondContact O-N 2.99Å; R47-R50 PolarHBondContact O-N 2.97Å; R47-V51 WeakPolarHBondContact O-CG2 3.41Å; R47-V51 PolarHBondContact O-N 2.99Å
48L95.7Very high92.7Very high114 Ų11499.8 Ų99.860%0.59753%0.526SS*.Hα-helixtrans-65.4-42.5177.1-71.8173.2000111.3L44 T45 R50 V51 V52L44-L48 PolarHBondContact O-N 3.26Å; T45-L48 PolarHBondContact O-N 3.09Å; T45-L48 VanDerWaalsContact O-N 3.09Å; L48-R50 VanDerWaalsContact C-N 3.29Å; L48-R50 PolarHBondContact O-N 3.23Å; L48-V51 WeakPolarHBondContact O-CB 3.35Å; L48-V51 PolarHBondContact O-N 3Å; L48-V52 WeakPolarHBondContact O-CG2 3.34Å; L48-V52 PolarHBondContact O-N 3.18Å
49D94.6Very high91.6Very high94 Ų94102.6 Ų102.650%0.50354%0.536SS..Hα-helixtrans-59.2-39.7176.7-76.7-13.9000112.1T45 V51 V52 L53T45-D49 PolarHBondContact O-N 3.5Å; D49-V51 VanDerWaalsContact C-N 3.34Å; D49-V51 PolarHBondContact O-N 3.43Å; D49-V52 PolarHBondContact O-N 2.97Å; D49-L53 WeakPolarHBondContact O-CB 3.33Å; D49-L53 WeakPolarHBondContact O-CG 3.48Å; D49-L53 PolarHBondContact O-N 2.68Å
50R92.9Very high90.1Very high187 Ų187103.1 Ų103.171%0.70654%0.541SS*.Hα-helixtrans-63.7-38.3174.4-68.5176.8-165.1-138.93.9112.5G46 R47 L48 T54G46-R50 WeakPolarHBondContact O-CG 3.35Å; R47-R50 PolarHBondContact O-N 2.97Å; L48-R50 VanDerWaalsContact C-N 3.29Å; L48-R50 PolarHBondContact O-N 3.23Å; R50-T54 WeakPolarHBondContact O-CB 3.37Å; R50-T54 PolarHBondContact O-N 3.03Å; R50-T54 PolarHBondContact O-OG1 3.33Å
51V94.2Very high88.2Confident83 Ų83104.3 Ų104.350%0.50355%0.551SS.*Hα-helixtrans-67.4-42.3177173.40000110.4R47 L48 D49 T54 L55R47-V51 WeakPolarHBondContact O-CG2 3.41Å; R47-V51 PolarHBondContact O-N 2.99Å; L48-V51 WeakPolarHBondContact O-CB 3.35Å; L48-V51 PolarHBondContact O-N 3Å; D49-V51 VanDerWaalsContact C-N 3.34Å; D49-V51 PolarHBondContact O-N 3.43Å; V51-T54 PolarHBondContact O-N 2.98Å; V51-L55 HydrophobicContact CG1-CD1 4.16Å; V51-L55 WeakPolarHBondContact O-CG 3.45Å; V51-L55 PolarHBondContact O-N 3.38Å
52V94.8Very high86.1Confident72 Ų72104.7 Ų104.744%0.43656%0.56SS.*Hα-helixtrans-62-48.8177174.70000110.7L48 D49 T54 L55 E56L48-V52 WeakPolarHBondContact O-CG2 3.34Å; L48-V52 PolarHBondContact O-N 3.18Å; D49-V52 PolarHBondContact O-N 2.97Å; V52-T54 VanDerWaalsContact C-N 3.27Å; V52-T54 PolarHBondContact O-N 3.45Å; V52-L55 PolarHBondContact O-N 3.39Å; V52-L55 VanDerWaalsContact O-N 3.09Å; V52-E56 PolarHBondContact O-N 3.14Å
53L89.2Confident84Confident104 Ų104106.5 Ų106.555%0.54557%0.566SS.*Hα-helixtrans-61.6-35.5176.3-70.6172.4000112.6D49 T57D49-L53 WeakPolarHBondContact O-CB 3.33Å; D49-L53 WeakPolarHBondContact O-CG 3.48Å; D49-L53 PolarHBondContact O-N 2.68Å; L53-T57 WeakPolarHBondContact O-CB 3.4Å; L53-T57 WeakPolarHBondContact O-CG2 3.41Å; L53-T57 PolarHBondContact O-N 3.17Å; L53-T57 PolarHBondContact O-OG1 3.02Å
54T88.7Confident81.8Confident78 Ų78109 Ų10948%0.47957%0.574SS.*Hα-helixtrans-67.6-38.6175.5-56.60000111.1R50 V51 V52 T57 N58R50-T54 WeakPolarHBondContact O-CB 3.37Å; R50-T54 PolarHBondContact O-N 3.03Å; R50-T54 PolarHBondContact O-OG1 3.33Å; V51-T54 PolarHBondContact O-N 2.98Å; V52-T54 VanDerWaalsContact C-N 3.27Å; V52-T54 PolarHBondContact O-N 3.45Å; T54-T57 WeakPolarHBondContact CA-OG1 3.47Å; T54-T57 PolarHBondContact O-OG1 2.78Å; T54-N58 PolarHBondContact O-N 2.99Å; T54-N58 VanDerWaalsContact O-N 3.17Å; T54-N58 PolarHBondContact O-ND2 2.92Å
55L86.5Confident79.7Confident108 Ų108116.1 Ų116.157%0.56560%0.595SS**Hα-helixtrans-68.8-42.5176.4-73.1170.2000111.5V51 V52 N58 L59V51-L55 HydrophobicContact CG1-CD1 4.16Å; V51-L55 WeakPolarHBondContact O-CG 3.45Å; V51-L55 PolarHBondContact O-N 3.38Å; V52-L55 PolarHBondContact O-N 3.39Å; V52-L55 VanDerWaalsContact O-N 3.09Å; L55-N58 PolarHBondContact O-N 2.73Å; L55-L59 WeakPolarHBondContact O-CG 3.45Å; L55-L59 PolarHBondContact O-N 2.93Å
56E86.6Confident77.5Confident110 Ų110117.9 Ų117.951%0.51461%0.606SS.*Hα-helixtrans-63.4-41.8177-71.6-178.7162.100112.3V52 N58 L59 I60V52-E56 PolarHBondContact O-N 3.14Å; E56-N58 VanDerWaalsContact C-N 3.34Å; E56-N58 PolarHBondContact O-N 3.09Å; E56-L59 PolarHBondContact O-N 3.32Å; E56-L59 VanDerWaalsContact O-N 3.16Å; E56-I60 PolarHBondContact O-N 3.27Å
57T82.4Confident75.5Confident91 Ų91123.2 Ų123.256%0.55862%0.622SS**Hα-helixtrans-67-33.4177.746.20000112.9L53 T54 L59 I60L53-T57 WeakPolarHBondContact O-CB 3.4Å; L53-T57 WeakPolarHBondContact O-CG2 3.41Å; L53-T57 PolarHBondContact O-N 3.17Å; L53-T57 PolarHBondContact O-OG1 3.02Å; T54-T57 WeakPolarHBondContact CA-OG1 3.47Å; T54-T57 PolarHBondContact O-OG1 2.78Å; T57-L59 VanDerWaalsContact C-N 3.26Å; T57-L59 PolarHBondContact O-N 3.45Å; T57-I60 PolarHBondContact O-N 3.34Å
58N73.5Confident73.2Confident107 Ų107122.7 Ų122.757%0.57263%0.628SS**Hα-helixtrans-71.4-17.8174.3-75.1-53.8000113.6T54 L55 E56T54-N58 PolarHBondContact O-N 2.99Å; T54-N58 VanDerWaalsContact O-N 3.17Å; T54-N58 PolarHBondContact O-ND2 2.92Å; L55-N58 PolarHBondContact O-N 2.73Å; E56-N58 VanDerWaalsContact C-N 3.34Å; E56-N58 PolarHBondContact O-N 3.09Å
59L72.6Confident70.9Confident129 Ų129125.5 Ų125.568%0.67564%0.641SS**Hα-helixtrans-84.4-19.7175.8-66.7172.9000113.1L55 E56 T57 T61L55-L59 WeakPolarHBondContact O-CG 3.45Å; L55-L59 PolarHBondContact O-N 2.93Å; E56-L59 PolarHBondContact O-N 3.32Å; E56-L59 VanDerWaalsContact O-N 3.16Å; T57-L59 VanDerWaalsContact C-N 3.26Å; T57-L59 PolarHBondContact O-N 3.45Å; L59-T61 VanDerWaalsContact C-N 3.34Å
60I66.6Low68.7Low136 Ų136127.1 Ų127.170%0.69765%0.65SS**SBendtrans-905.4-175.3-59.9168.5000112.7E56 T57 P62E56-I60 PolarHBondContact O-N 3.27Å; T57-I60 PolarHBondContact O-N 3.34Å; I60-P62 WeakPolarHBondContact O-CD 2.89Å
61T56.9Low66.8Low103 Ų103120 Ų12063%0.63263%0.628SS**  trans-100.373.816056.70000110.4L59 D63L59-T61 VanDerWaalsContact C-N 3.34Å; T61-D63 PolarHBondContact O-N 2.93Å
62P53.1Low64.6Low106 Ų106119.1 Ų119.169%0.68864%0.637SS**  trans-79.76017437.8-37.1000109.2I60I60-P62 WeakPolarHBondContact O-CD 2.89Å
63D53.5Low62.6Low132 Ų132123.6 Ų123.671%0.70665%0.653SS**SBendtrans-141.9105.6157.9-148.31.9000107.3T61T61-D63 PolarHBondContact O-N 2.93Å
64Q50.8Low60.7Low161 Ų161120.2 Ų120.275%0.75264%0.636SS**SBendtrans73.967.2172.3-44.5-179.722.600117.8
65R52.7Low59Low235 Ų235119.9 Ų119.989%0.88763%0.63SS**  trans-17517141.2-107.8173.4-102.5-153-0.7118.2E67R65-E67 VanDerWaalsContact C-N 3.3Å; R65-E67 PolarHBondContact O-N 2.92Å
66T50.2Low57.7Low114 Ų114118.6 Ų118.670%0.69963%0.627SS**  trans-84.160.2-178.6-10.10000113.4
67E53.1Low56.4Low145 Ų145116.6 Ų116.668%0.67862%0.619SS**SBendtrans-136.129.5168.9-81.1-83.6150.400111.2R65R65-E67 VanDerWaalsContact C-N 3.3Å; R65-E67 PolarHBondContact O-N 2.92Å
68E48Very low55.2Low168 Ų168113.7 Ų113.779%0.78560%0.599SS**SBendtrans-138.4144.7163.9-75.1-166.9135.500108.4
69I48.7Very low54.6Low173 Ų173115.7 Ų115.789%0.88760%0.603SS**SBendtrans87.233.9-179.9-32.3161.2000116.4
70D47.7Very low54.1Low127 Ų127116.8 Ų116.868%0.67960%0.598SS**SBendtrans-144.619.8134.3-170.835.4000111.1N74D70-N74 PolarHBondContact O-ND2 3.02Å
71S52.5Low53.9Low37 Ų37110.4 Ų110.426%0.25957%0.565SS.*Hα-helixtrans-84.5-21.2-171.8-174.40000112.1Q73 N74 L75S71-Q73 PolarHBondContact O-N 2.98Å; S71-N74 PolarHBondContact O-N 2.97Å; S71-L75 WeakPolarHBondContact O-CA 3.48Å; S71-L75 WeakPolarHBondContact O-CB 3.42Å; S71-L75 PolarHBondContact O-N 3.27Å; S71-L75 WeakPolarHBondContact OG-CD1 3.42Å
72G48.2Very low54Low66 Ų66108.4 Ų108.468%0.6855%0.55SS**Hα-helixtrans-55.6-44.7-171.600000114.6
73Q52.7Low54.4Low165 Ų165106.4 Ų106.477%0.77154%0.542SS*.Hα-helixtrans-91.4-33.4177.6-63.7-166.11.900112.9S71S71-Q73 PolarHBondContact O-N 2.98Å
74N49.6Very low54.7Low34 Ų34102.4 Ų102.418%0.18253%0.525CS..Hα-helixtrans-69-40.2178.4-82.3-50.8000111.8D70 S71 V76 I77 E78 R154D70-N74 PolarHBondContact O-ND2 3.02Å; S71-N74 PolarHBondContact O-N 2.97Å; N74-V76 VanDerWaalsContact C-N 3.27Å; N74-V76 PolarHBondContact O-N 3.5Å; N74-I77 CarbonylContact O-C 3.47Å; N74-I77 WeakPolarHBondContact O-CA 3.38Å; N74-I77 WeakPolarHBondContact O-CB 3.35Å; N74-I77 PolarHBondContact O-N 3.16Å; N74-E78 VanDerWaalsContact O-CB 3.24Å; N74-E78 WeakPolarHBondContact O-CB 3.03Å; N74-E78 PolarHBondContact O-N 3.3Å; N74-R154 PolarHBondContact OD1-NH2 3.48Å
75L53.6Low54.9Low71 Ų7196.8 Ų96.837%0.37250%0.498SS..Hα-helixtrans-60.3-34.5-179.4-156.785.6000112.4S71 I77 E78 K79S71-L75 WeakPolarHBondContact O-CA 3.48Å; S71-L75 WeakPolarHBondContact O-CB 3.42Å; S71-L75 PolarHBondContact O-N 3.27Å; S71-L75 WeakPolarHBondContact OG-CD1 3.42Å; L75-I77 VanDerWaalsContact C-N 3.34Å; L75-E78 PolarHBondContact O-N 2.96Å; L75-K79 WeakPolarHBondContact O-CB 3.21Å; L75-K79 WeakPolarHBondContact O-CG 3.46Å; L75-K79 PolarHBondContact O-N 3.29Å
76V59.2Low55Low81 Ų8191.2 Ų91.249%0.49149%0.49SS..Hα-helixtrans-67.4-37.9175.21790000111N74 R80N74-V76 VanDerWaalsContact C-N 3.27Å; N74-V76 PolarHBondContact O-N 3.5Å; V76-R80 WeakPolarHBondContact O-CG 3.49Å
77I59Low55Low68 Ų6892.8 Ų92.835%0.34949%0.494SS..Hα-helixtrans-74-35.9174.7-60.1174.1000110.1N74 L75 R80 F81 L160N74-I77 CarbonylContact O-C 3.47Å; N74-I77 WeakPolarHBondContact O-CA 3.38Å; N74-I77 WeakPolarHBondContact O-CB 3.35Å; N74-I77 PolarHBondContact O-N 3.16Å; L75-I77 VanDerWaalsContact C-N 3.34Å; I77-R80 WeakPolarHBondContact O-CB 3.09Å; I77-R80 PolarHBondContact O-N 2.91Å; I77-F81 WeakPolarHBondContact O-CB 3.46Å; I77-F81 PolarHBondContact O-N 2.99Å; I77-L160 HydrophobicContact CG2-CD1 4.37Å
78E57.5Low54.7Low30 Ų3093.5 Ų93.514%0.1449%0.49CS..Hα-helixtrans-68.3-48.4-177.4-161.6177.5173.900112N74 L75 R80 F81 L82 I146 L150N74-E78 VanDerWaalsContact O-CB 3.24Å; N74-E78 WeakPolarHBondContact O-CB 3.03Å; N74-E78 PolarHBondContact O-N 3.3Å; L75-E78 PolarHBondContact O-N 2.96Å; E78-R80 PolarHBondContact O-N 3.02Å; E78-F81 WeakPolarHBondContact O-CA 3.33Å; E78-F81 WeakPolarHBondContact O-CB 3.16Å; E78-F81 PolarHBondContact O-N 3.42Å; E78-L82 PolarHBondContact O-N 2.74Å; E78-I146 HydrophobicContact CG-CB 4.32Å; E78-I146 HydrophobicContact CG-CD1 4.49Å; E78-I146 HydrophobicContact CG-CG2 3.35Å; E78-I146 WeakPolarHBondContact OE1-CB 3.45Å; E78-I146 WeakPolarHBondContact OE1-CD1 3.35Å; E78-I146 WeakPolarHBondContact OE1-CG2 3.18Å; E78-L150 HydrophobicContact CG-CD1 4.45Å
79K60.6Low54.3Low148 Ų14893.5 Ų93.564%0.64349%0.49SS*.Hα-helixtrans-57.9-34.2173.6-76.1-173.4176.31800111.7L75L75-K79 WeakPolarHBondContact O-CB 3.21Å; L75-K79 WeakPolarHBondContact O-CG 3.46Å; L75-K79 PolarHBondContact O-N 3.29Å
80R61.4Low54.1Low152 Ų15290.1 Ų90.157%0.57448%0.48SS*.Hα-helixtrans-75.7-35.4173.9-70.3177.5179.4170.4-0.8112.7V76 I77 E78 S84V76-R80 WeakPolarHBondContact O-CG 3.49Å; I77-R80 WeakPolarHBondContact O-CB 3.09Å; I77-R80 PolarHBondContact O-N 2.91Å; E78-R80 PolarHBondContact O-N 3.02Å; R80-S84 PolarHBondContact O-OG 3.45Å
81F63.1Low53.9Low3 Ų391.5 Ų91.51%0.01349%0.485CS..Hα-helixtrans-64.5-45.6178.9-169.6-104.7000110.4I77 E78 A83 S84 F85 F141 R149 L150 V153 L160I77-F81 WeakPolarHBondContact O-CB 3.46Å; I77-F81 PolarHBondContact O-N 2.99Å; E78-F81 WeakPolarHBondContact O-CA 3.33Å; E78-F81 WeakPolarHBondContact O-CB 3.16Å; E78-F81 PolarHBondContact O-N 3.42Å; F81-A83 PolarHBondContact O-N 3.09Å; F81-S84 WeakPolarHBondContact O-CB 3.24Å; F81-S84 PolarHBondContact O-N 2.6Å; F81-F85 HydrophobicContact CD1-CD2 4.35Å; F81-F85 AromaticContact CD1-CE2 3.8Å; F81-F85 HydrophobicContact CD1-CE2 3.8Å; F81-F85 HydrophobicContact CD2-CE2 4.12Å; F81-F85 HydrophobicContact CE1-CD2 4.21Å; F81-F85 AromaticContact CE1-CE2 3.38Å; F81-F85 HydrophobicContact CE1-CE2 3.38Å; F81-F85 HydrophobicContact CE1-CZ 4.03Å; F81-F85 AromaticContact CE2-CE2 3.73Å; F81-F85 HydrophobicContact CE2-CE2 3.73Å; F81-F85 HydrophobicContact CE2-CZ 4.13Å; F81-F85 HydrophobicContact CG-CE2 4.16Å; F81-F85 AromaticContact CZ-CE2 3.33Å; F81-F85 HydrophobicContact CZ-CE2 3.33Å; F81-F85 AromaticContact CZ-CZ 3.64Å; F81-F85 HydrophobicContact CZ-CZ 3.64Å; F81-F85 VanDerWaalsContact O-CD2 3.22Å; F81-F85 WeakPolarHBondContact O-CD2 3.43Å; F81-F141 HydrophobicContact CZ-CZ 4.17Å; F81-R149 HydrophobicContact CE1-CB 4.04Å; F81-L150 HydrophobicContact CD1-CD2 4.23Å; F81-L150 HydrophobicContact CD2-CD2 4.21Å; F81-L150 HydrophobicContact CE1-CD2 4.47Å; F81-L150 HydrophobicContact CE2-CD2 4.46Å; F81-L150 HydrophobicContact CG-CD2 4.1Å; F81-V153 HydrophobicContact CE2-CG2 3.92Å; F81-V153 HydrophobicContact CZ-CG2 3.7Å; F81-L160 WeakPolarHBondContact CD2-O 3.41Å
82L58.6Low53.1Low61 Ų6193.6 Ų93.632%0.31951%0.505SS..Hα-helixtrans-58.3-45.9176.4-69.9179.3000113.1E78 S84 F85 V86 I146E78-L82 PolarHBondContact O-N 2.74Å; L82-S84 PolarHBondContact O-N 3.17Å; L82-F85 PolarHBondContact O-N 3.35Å; L82-V86 PolarHBondContact O-N 3.33Å; L82-I146 HydrophobicContact CD1-CD1 3.8Å; L82-I146 HydrophobicContact CD2-CD1 3.77Å; L82-I146 HydrophobicContact CD2-CG1 3.88Å; L82-I146 HydrophobicContact CD2-CG2 4.41Å; L82-I146 HydrophobicContact CG-CD1 4.14Å
83A61.1Low52.6Low63 Ų6398.1 Ų98.152%0.52151%0.513SS..Hα-helixtrans-59.9-23.3-179.500000113.3F81F81-A83 PolarHBondContact O-N 3.09Å
84S60.1Low51.9Low49 Ų4995.6 Ų95.634%0.34351%0.511SS..Hα-helixtrans-76.7-21179-57.80000113.4R80 F81 L82R80-S84 PolarHBondContact O-OG 3.45Å; F81-S84 WeakPolarHBondContact O-CB 3.24Å; F81-S84 PolarHBondContact O-N 2.6Å; L82-S84 PolarHBondContact O-N 3.17Å
85F55.3Low51.5Low42 Ų42102.7 Ų102.718%0.18454%0.543CS..Hα-helixtrans-99.8-33.7-179.7-66.2-85.1000113.4F81 L82 N87 T136 F141 R149 P163F81-F85 HydrophobicContact CD1-CD2 4.35Å; F81-F85 AromaticContact CD1-CE2 3.8Å; F81-F85 HydrophobicContact CD1-CE2 3.8Å; F81-F85 HydrophobicContact CD2-CE2 4.12Å; F81-F85 HydrophobicContact CE1-CD2 4.21Å; F81-F85 AromaticContact CE1-CE2 3.38Å; F81-F85 HydrophobicContact CE1-CE2 3.38Å; F81-F85 HydrophobicContact CE1-CZ 4.03Å; F81-F85 AromaticContact CE2-CE2 3.73Å; F81-F85 HydrophobicContact CE2-CE2 3.73Å; F81-F85 HydrophobicContact CE2-CZ 4.13Å; F81-F85 HydrophobicContact CG-CE2 4.16Å; F81-F85 AromaticContact CZ-CE2 3.33Å; F81-F85 HydrophobicContact CZ-CE2 3.33Å; F81-F85 AromaticContact CZ-CZ 3.64Å; F81-F85 HydrophobicContact CZ-CZ 3.64Å; F81-F85 VanDerWaalsContact O-CD2 3.22Å; F81-F85 WeakPolarHBondContact O-CD2 3.43Å; L82-F85 PolarHBondContact O-N 3.35Å; F85-N87 PolarHBondContact O-N 3.42Å; F85-T136 HydrophobicContact CE1-CG2 4.14Å; F85-F141 HydrophobicContact CE1-CD1 4.45Å; F85-F141 AromaticContact CE1-CE1 3.82Å; F85-F141 HydrophobicContact CE1-CE1 3.82Å; F85-F141 AromaticContact CZ-CE1 3.72Å; F85-F141 HydrophobicContact CZ-CE1 3.72Å; F85-F141 HydrophobicContact CZ-CZ 4.43Å; F85-R149 VanDerWaalsContact CE2-NH2 3.32Å; F85-P163 HydrophobicContact CE1-CG 3.95Å; F85-P163 HydrophobicContact CZ-CG 3.78Å
86V55.7Low50.8Low119 Ų119104.2 Ų104.272%0.72156%0.559SS**Hα-helixtrans-67.2-22.3-175.6-178.60000112.6L82L82-V86 PolarHBondContact O-N 3.33Å
87N50.3Low50.2Low146 Ų146105.7 Ų105.778%0.78157%0.573SS**THydrogen-bonded Turntrans-108.621.4-173.5-99.2-19.6000115.7F85F85-N87 PolarHBondContact O-N 3.42Å
88R46.3Very low49.5Very low160 Ų160110.1 Ų110.160%0.60460%0.597SS**  trans-110.978.9169-73.9-168.7177.8-1771.7110.1
89E39.2Very low48.7Very low168 Ų168111.8 Ų111.879%0.78562%0.622SS**  trans-47.4134154.6-162.5179.9-161.700108I91E89-I91 PolarHBondContact O-N 3.01Å
90P44.6Very low47.8Very low103 Ų103114.9 Ų114.967%0.66964%0.635SS**  trans-65.590-179.626.5-32.9000108.3A92P90-A92 PolarHBondContact O-N 3.14Å
91I43.2Very low47.3Very low155 Ų155119 Ų11980%0.79565%0.651SS**  trans-60.9102.6161-59.2173.1000103.7E89 L93E89-I91 PolarHBondContact O-N 3.01Å; I91-L93 PolarHBondContact O-N 3.3Å; I91-L93 VanDerWaalsContact O-N 3.14Å
92A36.6Very low46.5Very low81 Ų81130.4 Ų130.467%0.66969%0.694SS**  trans-36.5123.9169.200000107.2P90P90-A92 PolarHBondContact O-N 3.14Å
93L37.3Very low45.8Very low162 Ų162136.5 Ų136.585%0.84872%0.721SS**  trans-35.6120176.4-79.2155.3000107.7I91 Q95I91-L93 PolarHBondContact O-N 3.3Å; I91-L93 VanDerWaalsContact O-N 3.14Å; L93-Q95 PolarHBondContact O-N 3.44Å
94P36.6Very low45.3Very low111 Ų111141.6 Ų141.672%0.72173%0.731SS**  trans-62102.5176.523.7-29.4000104.9S96P94-S96 PolarHBondContact O-N 2.78Å
95Q42Very low44.8Very low184 Ų184144.9 Ų144.986%0.8675%0.752SS**  trans-50.4107.1155.9-75.4-173.4-34.100102.8L93 S97L93-Q95 PolarHBondContact O-N 3.44Å; Q95-S97 PolarHBondContact O-N 2.7Å
96S39.2Very low44.8Very low102 Ų102150.5 Ų150.571%0.71378%0.778SS**  trans-51.696.6172.447.60000105.6P94 L98P94-S96 PolarHBondContact O-N 2.78Å; S96-L98 PolarHBondContact O-N 3.15Å
97S46.6Very low44.2Very low113 Ų113152.6 Ų152.679%0.7978%0.784SS**  trans-67.394.2172.357.20000104.2Q95 G99Q95-S97 PolarHBondContact O-N 2.7Å; S97-G99 PolarHBondContact O-N 3.44Å
98L45.2Very low44.1Very low161 Ų161150.9 Ų150.984%0.84378%0.781SS**  trans-44.2113.1175.6-144.399.2000106.9S96 K100S96-L98 PolarHBondContact O-N 3.15Å; L98-K100 PolarHBondContact O-N 3.43Å; L98-K100 VanDerWaalsContact O-N 3.14Å
99G39.8Very low44.2Very low65 Ų65149.7 Ų149.767%0.6779%0.792SS**  trans-52.1124.9178.500000109.1S97 R101S97-G99 PolarHBondContact O-N 3.44Å; G99-R101 PolarHBondContact O-N 2.71Å
100K42.5Very low44.7Very low212 Ų212148.7 Ų148.792%0.92279%0.792SS**  trans-62.572.7166.8-71.7176.8176178.80108.7L98L98-K100 PolarHBondContact O-N 3.43Å; L98-K100 VanDerWaalsContact O-N 3.14Å
101R50.1Low45.3Very low239 Ų239147.8 Ų147.890%0.90279%0.786SS**  trans-85.8114.4167.7-160.4174.4-173.3-177.10.8106.7G99 Q103G99-R101 PolarHBondContact O-N 2.71Å; R101-Q103 PolarHBondContact O-N 2.95Å
102R45.9Very low45.9Very low242 Ų242150.4 Ų150.491%0.91379%0.792SS**  trans-45.5134.9-178.4-69.4177.2174.2-177-3.4111.3
103Q43.1Very low46.8Very low190 Ų190153.1 Ų153.189%0.88879%0.794SS**  trans-44133.3171.7-60.9165.23.200111.9R101R101-Q103 PolarHBondContact O-N 2.95Å
104K52.6Low48.1Very low170 Ų170151.2 Ų151.274%0.73979%0.789SS**  trans-151.9107.1133.1-160.7168.6-177177.10108.5
105P49Very low49.3Very low118 Ų118156.9 Ų156.977%0.76680%0.796SS**  trans-78.5122.7-179.828.9-28.3000109.4
106H55.1Low50.3Low159 Ų159153.3 Ų153.374%0.73679%0.787SS**  trans-112.1141163-77.6-78.7000109.3
107L43.2Very low51.6Low163 Ų163153.8 Ų153.885%0.85379%0.786SS**  trans-55.2164.7-159.2-107.272.8000117.3
108P47.2Very low52.5Low111 Ų111154.1 Ų154.172%0.72178%0.783SS**  trans-90.7127.6-166.635.6-29.7000111.5
109T49.5Very low53.5Low134 Ų134154.3 Ų154.382%0.82278%0.781SS**  trans-106.7111.8157.6-46.50000106.9P111T109-P111 WeakPolarHBondContact O-CD 3.5Å
110N50Low54.6Low147 Ų147156.6 Ų156.679%0.78678%0.782SS**  trans-60122.3170.1-94.7-70.5000109.7
111P57.5Low55.9Low85 Ų85152 Ų15255%0.55277%0.774SS**  trans-106.3130.3134.432.6-33.2000107.4T109 L113T109-P111 WeakPolarHBondContact O-CD 3.5Å; P111-L113 HydrophobicContact CB-CD1 3.86Å; P111-L113 HydrophobicContact CG-CD1 3.72Å; P111-L113 PolarHBondContact O-N 3.24Å
112K55.2Low56.8Low209 Ų209144.7 Ų144.791%0.90976%0.756SS**  trans-58.574.2161.8-72.8172.2176.1173.70108V114K112-V114 PolarHBondContact O-N 2.84Å
113L56.2Low58.1Low138 Ų138143.9 Ų143.972%0.72375%0.753SS**  trans-83.4102.9177.8-13088.4000105.2P111 R115P111-L113 HydrophobicContact CB-CD1 3.86Å; P111-L113 HydrophobicContact CG-CD1 3.72Å; P111-L113 PolarHBondContact O-N 3.24Å; L113-R115 PolarHBondContact O-N 2.94Å
114V63.2Low60.2Low122 Ų122139 Ų13974%0.73973%0.732SS**  trans-43.5110.81611750000106.3K112 T116K112-V114 PolarHBondContact O-N 2.84Å; V114-T116 PolarHBondContact O-N 2.98Å
115R62.5Low62Low231 Ų231131 Ų13187%0.87270%0.697SS**  trans-74.677.9-177.1-165.6178.1-176.7174.90.2106.9L113 T117L113-R115 PolarHBondContact O-N 2.94Å; R115-T117 VanDerWaalsContact C-N 3.29Å; R115-T117 PolarHBondContact O-N 3.21Å
116T63.6Low64Low109 Ų109128.3 Ų128.367%0.66968%0.676SS**  trans-67.197.1169.2-46.90000105.9V114 V118V114-T116 PolarHBondContact O-N 2.98Å; T116-V118 PolarHBondContact O-N 3.33Å
117T65.7Low65.7Low112 Ų112122 Ų12269%0.68765%0.649SS**  trans-63.894171.9-49.50000106.4R115 M119R115-T117 VanDerWaalsContact C-N 3.29Å; R115-T117 PolarHBondContact O-N 3.21Å; T117-M119 VanDerWaalsContact C-N 3.29Å; T117-M119 PolarHBondContact O-N 3.3Å
118V66.2Low68.1Low119 Ų119115.9 Ų115.972%0.72162%0.619SS**  trans-61.698.9169.8178.50000105.5T116 T120T116-V118 PolarHBondContact O-N 3.33Å; V118-T120 VanDerWaalsContact C-N 3.32Å; V118-T120 PolarHBondContact O-N 2.83Å
119M65.3Low70Confident165 Ų165117.2 Ų117.281%0.81362%0.616SS**  trans-63.8100.7172.3-65.7-162.97800106.2T117 P121T117-M119 VanDerWaalsContact C-N 3.29Å; T117-M119 PolarHBondContact O-N 3.3Å; M119-P121 VanDerWaalsContact O-N 3.16Å
120T63.4Low71.8Confident114 Ų114113.5 Ų113.570%0.69960%0.596SS**PPolyproline II helixtrans-55.1123.4169.1380000106.8V118 V122V118-T120 VanDerWaalsContact C-N 3.32Å; V118-T120 PolarHBondContact O-N 2.83Å; T120-V122 PolarHBondContact O-N 3.43Å
121P68.8Low73.2Confident114 Ų114111 Ų11174%0.7458%0.582SS**PPolyproline II helixtrans-55.3121.8-177.621-31.7000108M119 R123M119-P121 VanDerWaalsContact O-N 3.16Å; P121-R123 PolarHBondContact O-N 3.3Å
122V69.6Low74.2Confident86 Ų86111.8 Ų111.852%0.52160%0.596SS.*PPolyproline II helixtrans-59.2116.4177.6-178.90000106.1T120 L124 D131T120-V122 PolarHBondContact O-N 3.43Å; V122-L124 HydrophobicContact CG1-CD2 4.25Å; V122-L124 PolarHBondContact O-N 3.11Å; V122-D131 HydrophobicContact CG1-CB 3.72Å
123R74.2Confident75.8Confident226 Ų226104 Ų10485%0.85356%0.563SS**  trans-72.699178.7-66.7-165.7-178.5-149.80.5107.6P121P121-R123 PolarHBondContact O-N 3.3Å
124L87Confident77.3Confident86 Ų86100.2 Ų100.245%0.4555%0.548SS..  trans-67.3144.2172.1-55.2-178.2000109.8V122 I126 D131V122-L124 HydrophobicContact CG1-CD2 4.25Å; V122-L124 PolarHBondContact O-N 3.11Å; L124-I126 PolarHBondContact O-N 3.39Å; L124-D131 HydrophobicContact CD2-CB 4.11Å; L124-D131 VanDerWaalsContact CD2-CG 3.44Å; L124-D131 WeakPolarHBondContact CD2-OD1 3.43Å
125C90.7Very high78.6Confident2 Ų295 Ų951%0.01452%0.515CS..  trans-65.6123.1170.3179.40000109.1V127 E129 S130 H133C125-V127 PolarHBondContact O-N 3.23Å; C125-E129 WeakPolarHBondContact O-CA 3.5Å; C125-E129 PolarHBondContact O-N 3.31Å; C125-S130 WeakPolarHBondContact CB-O 3.41Å; C125-S130 PolarHBondContact N-O 3.4Å; C125-H133 PolarHBondContact SG-NE2 3.3Å; C125-H133 VanDerWaalsContact SG-NE2 3.36Å
126I89.1Confident79.8Confident62 Ų6286.7 Ų86.732%0.31849%0.49SS..THydrogen-bonded Turntrans-65.1-12.8-176.1-59169.4000112.7L124 I135 K156 L158 P165L124-I126 PolarHBondContact O-N 3.39Å; I126-I135 HydrophobicContact CB-CD1 4.08Å; I126-I135 HydrophobicContact CD1-CD1 4.22Å; I126-K156 HydrophobicContact CG2-CB 4.05Å; I126-K156 HydrophobicContact CG2-CD 3.52Å; I126-K156 HydrophobicContact CG2-CG 3.65Å; I126-L158 HydrophobicContact CD1-CD2 4.32Å; I126-P165 HydrophobicContact CD1-CG 4.22Å
127V92.2Very high81.1Confident26 Ų2686.7 Ų86.716%0.15849%0.486CS..THydrogen-bonded Turntrans-97.1-44.4-176.1-176.40000112.8C125 I135 V140 F141 V152C125-V127 PolarHBondContact O-N 3.23Å; V127-I135 HydrophobicContact CG2-CD1 4.46Å; V127-I135 HydrophobicContact CG2-CG1 4.22Å; V127-I135 HydrophobicContact CG2-CG2 4.06Å; V127-V140 HydrophobicContact CG1-CG1 4.2Å; V127-F141 HydrophobicContact CB-CB 4.35Å; V127-F141 HydrophobicContact CG1-CB 4.04Å; V127-F141 HydrophobicContact CG1-CD2 4.28Å; V127-F141 HydrophobicContact CG2-CB 4.11Å; V127-F141 HydrophobicContact CG2-CD2 3.8Å; V127-F141 HydrophobicContact CG2-CG 4.2Å; V127-V152 HydrophobicContact CG2-CG1 3.97Å
128C92.4Very high82.4Confident36 Ų3681.4 Ų81.424%0.24345%0.453CS..THydrogen-bonded Turntrans-114.50.6-178.666.50000113.3S130 H133 V140C128-S130 PolarHBondContact O-N 3.38Å; C128-S130 PolarHBondContact O-OG 3.19Å; C128-S130 PolarHBondContact SG-OG 2.88Å; C128-H133 PolarHBondContact SG-CE1 2.94Å; C128-H133 PolarHBondContact SG-NE2 3.49Å; C128-V140 HydrophobicContact CB-CB 4.25Å; C128-V140 HydrophobicContact CB-CG2 3.92Å
129E88.4Confident83.7Confident138 Ų13879.4 Ų79.465%0.64544%0.442SS*.  trans58.810.4178.7-59.3178.9178.300114.4C125C125-E129 WeakPolarHBondContact O-CA 3.5Å; C125-E129 PolarHBondContact O-N 3.31Å
130S86.4Confident85.2Confident57 Ų5774.8 Ų74.840%0.39942%0.423SS..  trans-83.7142.3175.6-36.40000111C125 C128C125-S130 WeakPolarHBondContact CB-O 3.41Å; C125-S130 PolarHBondContact N-O 3.4Å; C128-S130 PolarHBondContact O-N 3.38Å; C128-S130 PolarHBondContact O-OG 3.19Å; C128-S130 PolarHBondContact SG-OG 2.88Å
131D78.8Confident86.7Confident95 Ų9569.4 Ų69.451%0.50839%0.39SS..THydrogen-bonded Turntrans-61.3155.5172.6-47.829.6000109.8V122 L124V122-D131 HydrophobicContact CG1-CB 3.72Å; L124-D131 HydrophobicContact CD2-CB 4.11Å; L124-D131 VanDerWaalsContact CD2-CG 3.44Å; L124-D131 WeakPolarHBondContact CD2-OD1 3.43Å
132A80.5Confident87.8Confident100 Ų10067.5 Ų67.583%0.82638%0.38SS*.THydrogen-bonded Turntrans89.4-0.416400000119.9
133H88.6Confident89.1Confident47 Ų4770 Ų7022%0.21839%0.39CS..  trans-145.7155174.167.7-84.8000116.1C125 C128 L137 C138C125-H133 PolarHBondContact SG-NE2 3.3Å; C125-H133 VanDerWaalsContact SG-NE2 3.36Å; C128-H133 PolarHBondContact SG-CE1 2.94Å; C128-H133 PolarHBondContact SG-NE2 3.49Å; H133-L137 HydrophobicContact CB-CB 4.24Å; H133-C138 WeakPolarHBondContact CD2-CA 3.49Å; H133-C138 VanDerWaalsContact CD2-CB 3.46Å; H133-C138 WeakPolarHBondContact CD2-CB 3.33Å; H133-C138 VanDerWaalsContact NE2-CA 3.31Å; H133-C138 WeakPolarHBondContact NE2-CA 3.33Å; H133-C138 VanDerWaalsContact NE2-CB 3.26Å; H133-C138 WeakPolarHBondContact NE2-CB 3.38Å; H133-C138 PolarHBondContact NE2-SG 3.2Å
134S87.8Confident90Very high58 Ų5863 Ų6341%0.40637%0.366SS..  trans-81.2156.5172.864.30000110.8T136 L137 C138S134-T136 PolarHBondContact O-N 3.29Å; S134-T136 PolarHBondContact OG-OG1 3.29Å; S134-L137 CarbonylContact O-C 3.54Å; S134-L137 WeakPolarHBondContact O-CA 3.35Å; S134-L137 PolarHBondContact O-N 2.88Å; S134-C138 PolarHBondContact O-N 3.48Å
135I90.2Very high90.4Very high12 Ų1263 Ų636%0.06237%0.366CS..G310 helixtrans-52.5-33178.5-60.8177.2000112.4I126 V127 L137 C138 F141 L158 P163I126-I135 HydrophobicContact CB-CD1 4.08Å; I126-I135 HydrophobicContact CD1-CD1 4.22Å; V127-I135 HydrophobicContact CG2-CD1 4.46Å; V127-I135 HydrophobicContact CG2-CG1 4.22Å; V127-I135 HydrophobicContact CG2-CG2 4.06Å; I135-L137 PolarHBondContact O-N 2.75Å; I135-C138 WeakPolarHBondContact O-CB 3.28Å; I135-C138 PolarHBondContact O-N 2.9Å; I135-F141 HydrophobicContact CG2-CB 4.33Å; I135-F141 HydrophobicContact CG2-CD1 3.57Å; I135-F141 HydrophobicContact CG2-CD2 4.09Å; I135-F141 HydrophobicContact CG2-CE1 3.79Å; I135-F141 HydrophobicContact CG2-CE2 4.28Å; I135-F141 HydrophobicContact CG2-CG 3.72Å; I135-F141 HydrophobicContact CG2-CZ 4.14Å; I135-L158 HydrophobicContact CD1-CD1 3.4Å; I135-L158 HydrophobicContact CD1-CD2 4.17Å; I135-L158 HydrophobicContact CD1-CG 4.44Å; I135-P163 HydrophobicContact CG2-CB 4.44Å
136T87.1Confident90.5Very high56 Ų5665.1 Ų65.134%0.34438%0.377SS..G310 helixtrans-67.6-21.2177.647.50000113.9F85 S134 P163F85-T136 HydrophobicContact CE1-CG2 4.14Å; S134-T136 PolarHBondContact O-N 3.29Å; S134-T136 PolarHBondContact OG-OG1 3.29Å; T136-P163 HydrophobicContact CG2-CG 3.76Å
137L90.5Very high90.8Very high110 Ų11064.7 Ų64.758%0.57638%0.377SS*.G310 helixtrans-107.36.7177.5-59.8176.1000111.7H133 S134 I135 P139H133-L137 HydrophobicContact CB-CB 4.24Å; S134-L137 CarbonylContact O-C 3.54Å; S134-L137 WeakPolarHBondContact O-CA 3.35Å; S134-L137 PolarHBondContact O-N 2.88Å; I135-L137 PolarHBondContact O-N 2.75Å; L137-P139 WeakPolarHBondContact O-CD 3.33Å
138C93.9Very high90.9Very high1 Ų165.8 Ų65.81%0.00738%0.382CS..  trans-80.6116.3-177.4-178.40000110.5H133 S134 I135 V140 F141 S142H133-C138 WeakPolarHBondContact CD2-CA 3.49Å; H133-C138 VanDerWaalsContact CD2-CB 3.46Å; H133-C138 WeakPolarHBondContact CD2-CB 3.33Å; H133-C138 VanDerWaalsContact NE2-CA 3.31Å; H133-C138 WeakPolarHBondContact NE2-CA 3.33Å; H133-C138 VanDerWaalsContact NE2-CB 3.26Å; H133-C138 WeakPolarHBondContact NE2-CB 3.38Å; H133-C138 PolarHBondContact NE2-SG 3.2Å; S134-C138 PolarHBondContact O-N 3.48Å; I135-C138 WeakPolarHBondContact O-CB 3.28Å; I135-C138 PolarHBondContact O-N 2.9Å; C138-V140 VanDerWaalsContact C-N 3.3Å; C138-V140 PolarHBondContact O-N 3.28Å; C138-F141 HydrophobicContact CB-CB 3.78Å; C138-F141 PolarHBondContact O-N 3.22Å; C138-F141 VanDerWaalsContact O-N 3.16Å; C138-F141 PolarHBondContact SG-N 3.02Å; C138-S142 WeakPolarHBondContact O-CB 3.47Å; C138-S142 PolarHBondContact O-N 3.06Å
139P94Very high91Very high76 Ų7665 Ų6549%0.49437%0.374SS..Hα-helixtrans-64.6-37.6-18025.5-33000111.3L137 F141 S142 N143L137-P139 WeakPolarHBondContact O-CD 3.33Å; P139-F141 VanDerWaalsContact C-N 3.28Å; P139-F141 PolarHBondContact O-N 2.96Å; P139-S142 PolarHBondContact O-N 2.89Å; P139-N143 WeakPolarHBondContact O-CB 3.45Å; P139-N143 VanDerWaalsContact O-CG 3.25Å; P139-N143 PolarHBondContact O-N 3.25Å
140V95Very high91.2Very high68 Ų6858.9 Ų58.941%0.41235%0.346SS..Hα-helixtrans-61-38.6175.8-177.90000111.2V127 C128 C138 K144V127-V140 HydrophobicContact CG1-CG1 4.2Å; C128-V140 HydrophobicContact CB-CB 4.25Å; C128-V140 HydrophobicContact CB-CG2 3.92Å; C138-V140 VanDerWaalsContact C-N 3.3Å; C138-V140 PolarHBondContact O-N 3.28Å; V140-K144 WeakPolarHBondContact O-CG 3.22Å
141F94.9Very high91.7Very high2 Ų261.9 Ų61.91%0.00935%0.352CS..Hα-helixtrans-74.5-38.5175.9-172.7-107.6000112.3F81 F85 V127 I135 C138 P139 K144 R149 V152 V153F81-F141 HydrophobicContact CZ-CZ 4.17Å; F85-F141 HydrophobicContact CE1-CD1 4.45Å; F85-F141 AromaticContact CE1-CE1 3.82Å; F85-F141 HydrophobicContact CE1-CE1 3.82Å; F85-F141 AromaticContact CZ-CE1 3.72Å; F85-F141 HydrophobicContact CZ-CE1 3.72Å; F85-F141 HydrophobicContact CZ-CZ 4.43Å; V127-F141 HydrophobicContact CB-CB 4.35Å; V127-F141 HydrophobicContact CG1-CB 4.04Å; V127-F141 HydrophobicContact CG1-CD2 4.28Å; V127-F141 HydrophobicContact CG2-CB 4.11Å; V127-F141 HydrophobicContact CG2-CD2 3.8Å; V127-F141 HydrophobicContact CG2-CG 4.2Å; I135-F141 HydrophobicContact CG2-CB 4.33Å; I135-F141 HydrophobicContact CG2-CD1 3.57Å; I135-F141 HydrophobicContact CG2-CD2 4.09Å; I135-F141 HydrophobicContact CG2-CE1 3.79Å; I135-F141 HydrophobicContact CG2-CE2 4.28Å; I135-F141 HydrophobicContact CG2-CG 3.72Å; I135-F141 HydrophobicContact CG2-CZ 4.14Å; C138-F141 HydrophobicContact CB-CB 3.78Å; C138-F141 PolarHBondContact O-N 3.22Å; C138-F141 VanDerWaalsContact O-N 3.16Å; C138-F141 PolarHBondContact SG-N 3.02Å; P139-F141 VanDerWaalsContact C-N 3.28Å; P139-F141 PolarHBondContact O-N 2.96Å; F141-K144 PolarHBondContact O-N 3.17Å; F141-R149 HydrophobicContact CD2-CG 4.28Å; F141-R149 HydrophobicContact CE1-CG 4.43Å; F141-R149 HydrophobicContact CE2-CB 3.9Å; F141-R149 HydrophobicContact CE2-CG 3.95Å; F141-R149 HydrophobicContact CZ-CB 3.84Å; F141-R149 HydrophobicContact CZ-CG 4.03Å; F141-R149 WeakPolarHBondContact O-CD 3.3Å; F141-R149 WeakPolarHBondContact O-CG 3.39Å; F141-V152 HydrophobicContact CD2-CG1 4.19Å; F141-V152 HydrophobicContact CE2-CB 4.06Å; F141-V152 HydrophobicContact CE2-CG1 3.9Å; F141-V153 HydrophobicContact CZ-CG2 4.21Å
142S93.4Very high92.3Very high73 Ų7358.5 Ų58.551%0.5133%0.334SS..Hα-helixtrans-66.6-37.7-179-1680000112.3C138 P139 K144C138-S142 WeakPolarHBondContact O-CB 3.47Å; C138-S142 PolarHBondContact O-N 3.06Å; P139-S142 PolarHBondContact O-N 2.89Å; S142-K144 VanDerWaalsContact C-N 3.33Å
143N95.3Very high92.9Very high138 Ų13853.8 Ų53.874%0.73830%0.295SS*.THydrogen-bonded Turntrans-82.8-6.2-177.6-65.8-7.5000113.6P139P139-N143 WeakPolarHBondContact O-CB 3.45Å; P139-N143 VanDerWaalsContact O-CG 3.25Å; P139-N143 PolarHBondContact O-N 3.25Å
144K94.5Very high93Very high81 Ų8158.6 Ų58.635%0.35231%0.312SS..SBendtrans-73.5147.4175-82.8177.7-179-159.90111.3V140 F141 S142 D148 R149V140-K144 WeakPolarHBondContact O-CG 3.22Å; F141-K144 PolarHBondContact O-N 3.17Å; S142-K144 VanDerWaalsContact C-N 3.33Å; K144-D148 HydrophobicContact CB-CB 4.36Å; K144-D148 HydrophobicContact CD-CB 4.44Å; K144-R149 HydrophobicContact CB-CG 3.74Å; K144-R149 VanDerWaalsContact O-CD 3.28Å; K144-R149 WeakPolarHBondContact O-CD 3.45Å
145N95.5Very high93.3Very high86 Ų8662.9 Ų62.946%0.4633%0.325SS..  trans-59.3160.2168.768.144.4000110.4T147 D148 R149N145-T147 VanDerWaalsContact C-N 3.33Å; N145-T147 PolarHBondContact O-N 3.29Å; N145-T147 PolarHBondContact OD1-N 3.18Å; N145-D148 VanDerWaalsContact CG-OD2 3.3Å; N145-D148 PolarHBondContact ND2-OD2 3.22Å; N145-D148 PolarHBondContact O-N 3.43Å; N145-D148 WeakPolarHBondContact OD1-CA 3.42Å; N145-D148 WeakPolarHBondContact OD1-CB 3.43Å; N145-D148 PolarHBondContact OD1-N 3.27Å; N145-D148 PolarHBondContact OD1-OD2 3.04Å; N145-R149 VanDerWaalsContact O-CG 3.3Å; N145-R149 WeakPolarHBondContact O-CG 3.44Å; N145-R149 PolarHBondContact O-N 2.81Å
146I92.3Very high93.3Very high46 Ų4666.4 Ų66.424%0.23634%0.34CS..Hα-helixtrans-67.7-39.5-170.2-52.2164.9000111E78 L82 D148 R149 L150E78-I146 HydrophobicContact CG-CB 4.32Å; E78-I146 HydrophobicContact CG-CD1 4.49Å; E78-I146 HydrophobicContact CG-CG2 3.35Å; E78-I146 WeakPolarHBondContact OE1-CB 3.45Å; E78-I146 WeakPolarHBondContact OE1-CD1 3.35Å; E78-I146 WeakPolarHBondContact OE1-CG2 3.18Å; L82-I146 HydrophobicContact CD1-CD1 3.8Å; L82-I146 HydrophobicContact CD2-CD1 3.77Å; L82-I146 HydrophobicContact CD2-CG1 3.88Å; L82-I146 HydrophobicContact CD2-CG2 4.41Å; L82-I146 HydrophobicContact CG-CD1 4.14Å; I146-D148 VanDerWaalsContact C-N 3.33Å; I146-D148 PolarHBondContact O-N 3.18Å; I146-R149 WeakPolarHBondContact O-CB 3.24Å; I146-R149 PolarHBondContact O-N 3.43Å; I146-L150 HydrophobicContact CG2-CD1 4.5Å; I146-L150 WeakPolarHBondContact O-CG 3.21Å; I146-L150 PolarHBondContact O-N 2.93Å
147T95Very high93.4Very high52 Ų5274.1 Ų74.132%0.31936%0.362SS..Hα-helixtrans-55.9-46175.5-48.60000111.4N145 L150 K151N145-T147 VanDerWaalsContact C-N 3.33Å; N145-T147 PolarHBondContact O-N 3.29Å; N145-T147 PolarHBondContact OD1-N 3.18Å; T147-L150 PolarHBondContact O-N 3.37Å; T147-K151 WeakPolarHBondContact O-CG 3.47Å; T147-K151 PolarHBondContact O-N 3.47Å
148D95.3Very high93.4Very high49 Ų4969.4 Ų69.426%0.26234%0.338SS..Hα-helixtrans-72.8-34.1179-68.8-24.2000112K144 N145 I146 L150 K151 V152K144-D148 HydrophobicContact CB-CB 4.36Å; K144-D148 HydrophobicContact CD-CB 4.44Å; N145-D148 VanDerWaalsContact CG-OD2 3.3Å; N145-D148 PolarHBondContact ND2-OD2 3.22Å; N145-D148 PolarHBondContact O-N 3.43Å; N145-D148 WeakPolarHBondContact OD1-CA 3.42Å; N145-D148 WeakPolarHBondContact OD1-CB 3.43Å; N145-D148 PolarHBondContact OD1-N 3.27Å; N145-D148 PolarHBondContact OD1-OD2 3.04Å; I146-D148 VanDerWaalsContact C-N 3.33Å; I146-D148 PolarHBondContact O-N 3.18Å; D148-L150 VanDerWaalsContact C-N 3.31Å; D148-L150 PolarHBondContact O-N 3.02Å; D148-K151 PolarHBondContact O-N 3.32Å; D148-K151 IonicContact OD1-NZ 3.41Å; D148-K151 PolarHBondContact OD1-NZ 3.4Å; D148-V152 WeakPolarHBondContact O-CG2 3.5Å; D148-V152 PolarHBondContact O-N 3.08Å
149R94Very high93.2Very high19 Ų1969.5 Ų69.57%0.07234%0.339CS..Hα-helixtrans-62-41.7170.8-69.8173.368.8175.43.3111F81 F85 F141 K144 N145 I146 V152 V153F81-R149 HydrophobicContact CE1-CB 4.04Å; F85-R149 VanDerWaalsContact CE2-NH2 3.32Å; F141-R149 HydrophobicContact CD2-CG 4.28Å; F141-R149 HydrophobicContact CE1-CG 4.43Å; F141-R149 HydrophobicContact CE2-CB 3.9Å; F141-R149 HydrophobicContact CE2-CG 3.95Å; F141-R149 HydrophobicContact CZ-CB 3.84Å; F141-R149 HydrophobicContact CZ-CG 4.03Å; F141-R149 WeakPolarHBondContact O-CD 3.3Å; F141-R149 WeakPolarHBondContact O-CG 3.39Å; K144-R149 HydrophobicContact CB-CG 3.74Å; K144-R149 VanDerWaalsContact O-CD 3.28Å; K144-R149 WeakPolarHBondContact O-CD 3.45Å; N145-R149 VanDerWaalsContact O-CG 3.3Å; N145-R149 WeakPolarHBondContact O-CG 3.44Å; N145-R149 PolarHBondContact O-N 2.81Å; I146-R149 WeakPolarHBondContact O-CB 3.24Å; I146-R149 PolarHBondContact O-N 3.43Å; R149-V152 PolarHBondContact O-N 3.47Å; R149-V153 VanDerWaalsContact O-CG2 3.24Å; R149-V153 WeakPolarHBondContact O-CG2 3.41Å; R149-V153 PolarHBondContact O-N 3.33Å
150L93Very high92.8Very high10 Ų1068.8 Ų68.85%0.05233%0.33CS..Hα-helixtrans-67.1-40.4174.8-71.7175.3000112E78 F81 I146 T147 D148 V152 V153 R154 L160E78-L150 HydrophobicContact CG-CD1 4.45Å; F81-L150 HydrophobicContact CD1-CD2 4.23Å; F81-L150 HydrophobicContact CD2-CD2 4.21Å; F81-L150 HydrophobicContact CE1-CD2 4.47Å; F81-L150 HydrophobicContact CE2-CD2 4.46Å; F81-L150 HydrophobicContact CG-CD2 4.1Å; I146-L150 HydrophobicContact CG2-CD1 4.5Å; I146-L150 WeakPolarHBondContact O-CG 3.21Å; I146-L150 PolarHBondContact O-N 2.93Å; T147-L150 PolarHBondContact O-N 3.37Å; D148-L150 VanDerWaalsContact C-N 3.31Å; D148-L150 PolarHBondContact O-N 3.02Å; L150-V152 VanDerWaalsContact C-N 3.32Å; L150-V152 PolarHBondContact O-N 3.22Å; L150-V153 PolarHBondContact O-N 2.89Å; L150-R154 WeakPolarHBondContact O-CB 3.4Å; L150-R154 WeakPolarHBondContact O-CG 3.49Å; L150-R154 PolarHBondContact O-N 3.41Å; L150-L160 HydrophobicContact CD2-CD2 3.98Å
151K95.4Very high92.3Very high121 Ų12168.6 Ų68.653%0.52632%0.322SS..Hα-helixtrans-56.5-46.7172.5-72.4175.8-167.3157.40111.1T147 D148 V153 R154 H155T147-K151 WeakPolarHBondContact O-CG 3.47Å; T147-K151 PolarHBondContact O-N 3.47Å; D148-K151 PolarHBondContact O-N 3.32Å; D148-K151 IonicContact OD1-NZ 3.41Å; D148-K151 PolarHBondContact OD1-NZ 3.4Å; K151-V153 PolarHBondContact O-N 3.44Å; K151-R154 PolarHBondContact O-N 3.19Å; K151-H155 WeakPolarHBondContact O-CB 3.33Å; K151-H155 PolarHBondContact O-N 3.16Å
152V93Very high91.8Very high23 Ų2369.3 Ų69.314%0.13933%0.327CS..Hα-helixtrans-60.8-45176.61700000111.4V127 F141 D148 R149 L150 R154 H155 K156V127-V152 HydrophobicContact CG2-CG1 3.97Å; F141-V152 HydrophobicContact CD2-CG1 4.19Å; F141-V152 HydrophobicContact CE2-CB 4.06Å; F141-V152 HydrophobicContact CE2-CG1 3.9Å; D148-V152 WeakPolarHBondContact O-CG2 3.5Å; D148-V152 PolarHBondContact O-N 3.08Å; R149-V152 PolarHBondContact O-N 3.47Å; L150-V152 VanDerWaalsContact C-N 3.32Å; L150-V152 PolarHBondContact O-N 3.22Å; V152-R154 PolarHBondContact O-N 3.35Å; V152-H155 PolarHBondContact O-N 3.01Å; V152-K156 HydrophobicContact CG1-CG 4.37Å; V152-K156 WeakPolarHBondContact O-CB 3.31Å; V152-K156 WeakPolarHBondContact O-CG 3.46Å; V152-K156 PolarHBondContact O-N 2.88Å
153V91.9Very high91.2Very high2 Ų266.4 Ų66.41%0.01231%0.306CS..Hα-helixtrans-61.4-43178.41690000111.6F81 F141 R149 L150 K151 R157 L158 L160F81-V153 HydrophobicContact CE2-CG2 3.92Å; F81-V153 HydrophobicContact CZ-CG2 3.7Å; F141-V153 HydrophobicContact CZ-CG2 4.21Å; R149-V153 VanDerWaalsContact O-CG2 3.24Å; R149-V153 WeakPolarHBondContact O-CG2 3.41Å; R149-V153 PolarHBondContact O-N 3.33Å; L150-V153 PolarHBondContact O-N 2.89Å; K151-V153 PolarHBondContact O-N 3.44Å; V153-R157 WeakPolarHBondContact O-CA 3.36Å; V153-R157 PolarHBondContact O-N 2.98Å; V153-R157 VanDerWaalsContact O-N 3.13Å; V153-L158 HydrophobicContact CG1-CB 4.12Å; V153-L158 WeakPolarHBondContact CG1-O 3.26Å; V153-L158 HydrophobicContact CG2-CD1 4.46Å; V153-L158 PolarHBondContact O-N 3.35Å; V153-L160 HydrophobicContact CG1-CD2 3.58Å; V153-L160 HydrophobicContact CG1-CG 4.14Å
154R91.3Very high90.6Very high148 Ų14866.3 Ų66.356%0.55830%0.299SS*.Hα-helixtrans-67-49.6176.6-70.7176.2-177.7173.52.9111.4N74 L150 K151 V152 K156 R157N74-R154 PolarHBondContact OD1-NH2 3.48Å; L150-R154 WeakPolarHBondContact O-CB 3.4Å; L150-R154 WeakPolarHBondContact O-CG 3.49Å; L150-R154 PolarHBondContact O-N 3.41Å; K151-R154 PolarHBondContact O-N 3.19Å; V152-R154 PolarHBondContact O-N 3.35Å; R154-K156 PolarHBondContact O-N 3.32Å; R154-R157 PolarHBondContact O-N 3.47Å
155H93Very high89.9Confident148 Ų14865.1 Ų65.169%0.68530%0.3SS*.Hα-helixtrans-62.8-44.9-177.1-178.871.9000112K151 V152 R157K151-H155 WeakPolarHBondContact O-CB 3.33Å; K151-H155 PolarHBondContact O-N 3.16Å; V152-H155 PolarHBondContact O-N 3.01Å; H155-R157 VanDerWaalsContact C-N 3.27Å; H155-R157 PolarHBondContact O-N 2.73Å
156K90.1Very high89.2Confident85 Ų8567.9 Ų67.937%0.3732%0.32SS..THydrogen-bonded Turntrans-87.38.8178.7-58.3-67.4-166.6-179.50113.2I126 V152 R154 L158I126-K156 HydrophobicContact CG2-CB 4.05Å; I126-K156 HydrophobicContact CG2-CD 3.52Å; I126-K156 HydrophobicContact CG2-CG 3.65Å; V152-K156 HydrophobicContact CG1-CG 4.37Å; V152-K156 WeakPolarHBondContact O-CB 3.31Å; V152-K156 WeakPolarHBondContact O-CG 3.46Å; V152-K156 PolarHBondContact O-N 2.88Å; R154-K156 PolarHBondContact O-N 3.32Å; K156-L158 VanDerWaalsContact C-N 3.25Å; K156-L158 HydrophobicContact CB-CD1 4.27Å; K156-L158 HydrophobicContact CB-CD2 4.34Å; K156-L158 HydrophobicContact CB-CG 3.95Å; K156-L158 PolarHBondContact O-N 3.42Å
157R90.7Very high88.8Confident218 Ų21867.9 Ų67.982%0.82332%0.319SS*.THydrogen-bonded Turntrans48.644.1178.9-57.7-175.2178.8-154.90113.4V153 R154 H155V153-R157 WeakPolarHBondContact O-CA 3.36Å; V153-R157 PolarHBondContact O-N 2.98Å; V153-R157 VanDerWaalsContact O-N 3.13Å; R154-R157 PolarHBondContact O-N 3.47Å; H155-R157 VanDerWaalsContact C-N 3.27Å; H155-R157 PolarHBondContact O-N 2.73Å
158L91Very high88Confident11 Ų1169.7 Ų69.76%0.05833%0.33CS..  trans-83149.4178.8-54.6174.4000110.1I126 I135 V153 K156 L160 P165I126-L158 HydrophobicContact CD1-CD2 4.32Å; I135-L158 HydrophobicContact CD1-CD1 3.4Å; I135-L158 HydrophobicContact CD1-CD2 4.17Å; I135-L158 HydrophobicContact CD1-CG 4.44Å; V153-L158 HydrophobicContact CG1-CB 4.12Å; V153-L158 WeakPolarHBondContact CG1-O 3.26Å; V153-L158 HydrophobicContact CG2-CD1 4.46Å; V153-L158 PolarHBondContact O-N 3.35Å; K156-L158 VanDerWaalsContact C-N 3.25Å; K156-L158 HydrophobicContact CB-CD1 4.27Å; K156-L158 HydrophobicContact CB-CD2 4.34Å; K156-L158 HydrophobicContact CB-CG 3.95Å; K156-L158 PolarHBondContact O-N 3.42Å; L158-L160 PolarHBondContact O-N 3.13Å; L158-P165 HydrophobicContact CD2-CB 3.91Å
159C88Confident87.1Confident4 Ų472.2 Ų72.23%0.02734%0.338CS..  trans-66.9123.9171.5176.50000110.5R161 C162 P163 K164 H167C159-R161 PolarHBondContact O-N 3.17Å; C159-R161 PolarHBondContact SG-N 3.3Å; C159-C162 PolarHBondContact O-N 2.87Å; C159-P163 WeakPolarHBondContact O-CA 3.41Å; C159-K164 PolarHBondContact N-O 3.37Å; C159-K164 VanDerWaalsContact N-O 3.07Å; C159-H167 VanDerWaalsContact CB-CE1 3.43Å; C159-H167 WeakPolarHBondContact CB-CE1 3.29Å; C159-H167 VanDerWaalsContact CB-NE2 3.29Å; C159-H167 WeakPolarHBondContact CB-NE2 3.3Å; C159-H167 PolarHBondContact SG-NE2 3.49Å
160L85.3Confident86.3Confident61 Ų6179.2 Ų79.232%0.31937%0.372SS..THydrogen-bonded Turntrans-55.4-20.3177.6-71.2164.6000113.8I77 F81 L150 V153 L158I77-L160 HydrophobicContact CG2-CD1 4.37Å; F81-L160 WeakPolarHBondContact CD2-O 3.41Å; L150-L160 HydrophobicContact CD2-CD2 3.98Å; V153-L160 HydrophobicContact CG1-CD2 3.58Å; V153-L160 HydrophobicContact CG1-CG 4.14Å; L158-L160 PolarHBondContact O-N 3.13Å
161R84.5Confident85.6Confident64 Ų6484.3 Ų84.324%0.24240%0.399CS..THydrogen-bonded Turntrans-95.4-32.1-178.2-77.8-167.9174.3-1638115.5C159C159-R161 PolarHBondContact O-N 3.17Å; C159-R161 PolarHBondContact SG-N 3.3Å
162C84.9Confident85.1Confident16 Ų1678.7 Ų78.711%0.10838%0.375CS..SBendtrans-134.424.6-171.270.10000114.5C159 K164 H167 C172C159-C162 PolarHBondContact O-N 2.87Å; C162-K164 WeakPolarHBondContact O-CG 3.47Å; C162-K164 PolarHBondContact O-N 3.49Å; C162-H167 PolarHBondContact SG-CE1 3.32Å; C162-H167 PolarHBondContact SG-NE2 2.99Å; C162-C172 PolarHBondContact SG-SG 3.21Å
163P81.1Confident84.5Confident12 Ų1287 Ų878%0.07840%0.404CS..  trans16.832.8-162.55.8-30.5000118.5F85 I135 T136 C159F85-P163 HydrophobicContact CE1-CG 3.95Å; F85-P163 HydrophobicContact CZ-CG 3.78Å; I135-P163 HydrophobicContact CG2-CB 4.44Å; T136-P163 HydrophobicContact CG2-CG 3.76Å; C159-P163 WeakPolarHBondContact O-CA 3.41Å
164K83Confident83.6Confident136 Ų13688.9 Ų88.959%0.59142%0.417SS*.  trans-92.4140.2177.7-78.6172.7-175.2-1730108.7C159 C162C159-K164 PolarHBondContact N-O 3.37Å; C159-K164 VanDerWaalsContact N-O 3.07Å; C162-K164 WeakPolarHBondContact O-CG 3.47Å; C162-K164 PolarHBondContact O-N 3.49Å
165P79.5Confident82.5Confident57 Ų5784.5 Ų84.537%0.3740%0.402SS..SBendtrans-63.4170.1168.128.6-33.4000110I126 L158I126-P165 HydrophobicContact CD1-CG 4.22Å; L158-P165 HydrophobicContact CD2-CB 3.91Å
166V80.3Confident81.1Confident144 Ų14488.4 Ų88.487%0.87341%0.411SS*.SBendtrans91.9-14.2162.2-1690000117.4
167H83.9Confident79.6Confident46 Ų4690.9 Ų90.921%0.21342%0.422CS..  trans-139.5150.1-17768.2-72.7000114.8C159 C162 D171 C172C159-H167 VanDerWaalsContact CB-CE1 3.43Å; C159-H167 WeakPolarHBondContact CB-CE1 3.29Å; C159-H167 VanDerWaalsContact CB-NE2 3.29Å; C159-H167 WeakPolarHBondContact CB-NE2 3.3Å; C159-H167 PolarHBondContact SG-NE2 3.49Å; C162-H167 PolarHBondContact SG-CE1 3.32Å; C162-H167 PolarHBondContact SG-NE2 2.99Å; H167-D171 HydrophobicContact CB-CB 4.24Å; H167-C172 WeakPolarHBondContact CD2-CA 3.43Å; H167-C172 WeakPolarHBondContact NE2-CA 3.19Å; H167-C172 WeakPolarHBondContact NE2-CB 3.45Å; H167-C172 PolarHBondContact NE2-SG 3.32Å
168V79.4Confident77.8Confident90 Ų9087.8 Ų87.855%0.54541%0.414SS..  trans-76.7161.2172.2-65.20000110.9Q170 D171 C172V168-Q170 HydrophobicContact CG2-CB 4.41Å; V168-Q170 PolarHBondContact O-N 2.86Å; V168-D171 HydrophobicContact CG2-CB 4.38Å; V168-D171 WeakPolarHBondContact CG2-OD2 3.4Å; V168-D171 PolarHBondContact O-N 3.36Å; V168-C172 PolarHBondContact O-N 3.21Å
169K76.7Confident75.6Confident101 Ų10191.9 Ų91.944%0.43944%0.444SS..G310 helixtrans-52.5-33-178.2-177.9-178.8173.6-171.80113.6C172K169-C172 VanDerWaalsContact O-CB 3.27Å; K169-C172 WeakPolarHBondContact O-CB 3.27Å; K169-C172 PolarHBondContact O-N 3.27Å
170Q76.2Confident73.8Confident166 Ų16696.6 Ų96.678%0.77647%0.472SS*.G310 helixtrans-70.6-34.3-178.6-65.5-177.2-6.200112.8V168 C172V168-Q170 HydrophobicContact CG2-CB 4.41Å; V168-Q170 PolarHBondContact O-N 2.86Å; Q170-C172 VanDerWaalsContact C-N 3.27Å; Q170-C172 PolarHBondContact O-N 3.22Å
171D79Confident72.2Confident117 Ų117104.9 Ų104.963%0.62650%0.499SS*.G310 helixtrans-90.26179.7-58.8-37.2000112.7H167 V168 R173H167-D171 HydrophobicContact CB-CB 4.24Å; V168-D171 HydrophobicContact CG2-CB 4.38Å; V168-D171 WeakPolarHBondContact CG2-OD2 3.4Å; V168-D171 PolarHBondContact O-N 3.36Å; D171-R173 PolarHBondContact O-N 2.83Å; D171-R173 VanDerWaalsContact O-N 3.08Å
172C83.8Confident70.6Confident3 Ų3105.5 Ų105.52%0.0253%0.525CS..  trans-67.7114.5-176.9-170.10000110C162 H167 V168 K169 Q170 S174 F175C162-C172 PolarHBondContact SG-SG 3.21Å; H167-C172 WeakPolarHBondContact CD2-CA 3.43Å; H167-C172 WeakPolarHBondContact NE2-CA 3.19Å; H167-C172 WeakPolarHBondContact NE2-CB 3.45Å; H167-C172 PolarHBondContact NE2-SG 3.32Å; V168-C172 PolarHBondContact O-N 3.21Å; K169-C172 VanDerWaalsContact O-CB 3.27Å; K169-C172 WeakPolarHBondContact O-CB 3.27Å; K169-C172 PolarHBondContact O-N 3.27Å; Q170-C172 VanDerWaalsContact C-N 3.27Å; Q170-C172 PolarHBondContact O-N 3.22Å; C172-S174 PolarHBondContact O-N 3.04Å; C172-S174 VanDerWaalsContact O-N 3.12Å; C172-S174 PolarHBondContact SG-OG 3.07Å; C172-F175 HydrophobicContact CB-CB 4.25Å; C172-F175 WeakPolarHBondContact O-CA 3.46Å; C172-F175 WeakPolarHBondContact O-CB 3.3Å; C172-F175 PolarHBondContact O-N 2.76Å
173R80.4Confident68.7Low199 Ų199112 Ų11275%0.75155%0.552SS**G310 helixtrans-59.4-27178.3-165.2176.9-172.9-162.72.2112.6D171 F175D171-R173 PolarHBondContact O-N 2.83Å; D171-R173 VanDerWaalsContact O-N 3.08Å; R173-F175 PolarHBondContact O-N 3.23Å
174S72.8Confident67.3Low40 Ų40115.7 Ų115.728%0.2858%0.578SS.*G310 helixtrans-75.9-4.7172.869.40000113.4C172C172-S174 PolarHBondContact O-N 3.04Å; C172-S174 VanDerWaalsContact O-N 3.12Å; C172-S174 PolarHBondContact SG-OG 3.07Å
175F69.2Low65.5Low57 Ų57112.2 Ų112.225%0.2557%0.57CS.*G310 helixtrans-66.4-36.7175.4-171.4-91.4000112.8C172 R173 L187C172-F175 HydrophobicContact CB-CB 4.25Å; C172-F175 WeakPolarHBondContact O-CA 3.46Å; C172-F175 WeakPolarHBondContact O-CB 3.3Å; C172-F175 PolarHBondContact O-N 2.76Å; R173-F175 PolarHBondContact O-N 3.23Å; F175-L187 HydrophobicContact CE1-CD2 3.93Å; F175-L187 HydrophobicContact CE2-CD2 3.95Å; F175-L187 HydrophobicContact CZ-CD1 4.35Å; F175-L187 HydrophobicContact CZ-CD2 3.3Å; F175-L187 HydrophobicContact CZ-CG 4.39Å
176R64.1Low64.2Low229 Ų229113.5 Ų113.586%0.86458%0.58SS**SBendtrans-98.90.5-170.2-65.3-167.7-178.5-163.11.4115.4
177K57.9Low62.9Low138 Ų138110.2 Ų110.260%0.656%0.558SS**  trans-12575.1-169.5-64.3-171.5178.7-166.80112.5
178F52.3Low61.2Low152 Ų152116.1 Ų116.167%0.66759%0.585SS**  trans-109.688.8149.2-69.9-79.6000107.1
179S44.4Very low59.4Low97 Ų97114.3 Ų114.368%0.67858%0.576SS**EExtended strand (participates in β ladder)trans-93.888161.6-70.20000106.7R181S179-R181 PolarHBondContact O-N 3.29Å
180V51.1Low58.1Low104 Ų104113.2 Ų113.263%0.6358%0.578SS**EExtended strand (participates in β ladder)trans-80.1110.3167-1800000106.1G182 F183V180-G182 PolarHBondContact O-N 3.06Å; V180-F183 PolarHBondContact O-N 3.4Å
181R50.9Low56.8Low235 Ų235110.7 Ų110.789%0.88757%0.573SS**THydrogen-bonded Turntrans36.362.7172.9-69.1-173.7-178.7-153.91.2114.9S179 F183S179-R181 PolarHBondContact O-N 3.29Å; R181-F183 VanDerWaalsContact C-N 3.33Å; R181-F183 WeakPolarHBondContact O-CD2 2.93Å; R181-F183 WeakPolarHBondContact O-CE2 3.1Å; R181-F183 PolarHBondContact O-N 3.05Å
182G50.9Low55Low76 Ų76112.5 Ų112.578%0.78458%0.583SS**THydrogen-bonded Turntrans82.91.417200000115.8V180V180-G182 PolarHBondContact O-N 3.06Å
183F46Very low53Low153 Ų153120.4 Ų120.467%0.67161%0.613SS**EExtended strand (participates in β ladder)trans-108.3113.6175.2-60-82.2000110.1V180 R181 C185V180-F183 PolarHBondContact O-N 3.4Å; R181-F183 VanDerWaalsContact C-N 3.33Å; R181-F183 WeakPolarHBondContact O-CD2 2.93Å; R181-F183 WeakPolarHBondContact O-CE2 3.1Å; R181-F183 PolarHBondContact O-N 3.05Å; F183-C185 PolarHBondContact O-N 2.93Å
184S50.9Low51.2Low89 Ų89119.3 Ų119.362%0.62262%0.616SS**EExtended strand (participates in β ladder)trans-85.188.1165.354.70000108.4S186S184-S186 PolarHBondContact O-N 3.04Å
185C45.2Very low49.9Very low63 Ų63125.6 Ų125.643%0.42664%0.641SS.*  trans-74.2110.9162.3-91.30000107.7F183 C189F183-C185 PolarHBondContact O-N 2.93Å; C185-C189 HydrophobicContact CB-CB 4.25Å
186S52.2Low48.6Very low84 Ų84130.9 Ų130.959%0.58767%0.666SS**  trans-60146.4165-66.90000109.1S184 E188 C189S184-S186 PolarHBondContact O-N 3.04Å; S186-E188 PolarHBondContact O-N 3.41Å; S186-C189 WeakPolarHBondContact O-CB 3.36Å; S186-C189 PolarHBondContact O-N 3.28Å; S186-C189 PolarHBondContact O-SG 3.44Å
187L53Low47.6Very low76 Ų76124.5 Ų124.540%0.39865%0.654SS.*G310 helixtrans-52.2-25.8-170.1-164.887000114.6F175 C189 V190F175-L187 HydrophobicContact CE1-CD2 3.93Å; F175-L187 HydrophobicContact CE2-CD2 3.95Å; F175-L187 HydrophobicContact CZ-CD1 4.35Å; F175-L187 HydrophobicContact CZ-CD2 3.3Å; F175-L187 HydrophobicContact CZ-CG 4.39Å; L187-C189 PolarHBondContact O-N 3.08Å; L187-V190 PolarHBondContact O-N 3.26Å
188E47.9Very low47Very low169 Ų169124.8 Ų124.879%0.7966%0.656SS**G310 helixtrans-59.3-28.6178.8-68.5-179.5162.600112.6S186 V190 V191S186-E188 PolarHBondContact O-N 3.41Å; E188-V190 PolarHBondContact O-N 3.46Å; E188-V190 VanDerWaalsContact O-N 3.11Å; E188-V191 PolarHBondContact O-N 3.39Å
189C42.3Very low46.6Very low52 Ų52125 Ų12535%0.35166%0.658SS.*G310 helixtrans-65.8-15.3179-53.90000114.5C185 S186 L187C185-C189 HydrophobicContact CB-CB 4.25Å; S186-C189 WeakPolarHBondContact O-CB 3.36Å; S186-C189 PolarHBondContact O-N 3.28Å; S186-C189 PolarHBondContact O-SG 3.44Å; L187-C189 PolarHBondContact O-N 3.08Å
190V50Low46.6Very low79 Ų79123.6 Ų123.648%0.47965%0.653SS.*G310 helixtrans-95.8-8.6-176.1-172.70000112.2L187 E188L187-V190 PolarHBondContact O-N 3.26Å; E188-V190 PolarHBondContact O-N 3.46Å; E188-V190 VanDerWaalsContact O-N 3.11Å
191V48.5Very low46.5Very low112 Ų112121.2 Ų121.268%0.67964%0.64SS**THydrogen-bonded Turntrans-85.6-26.2-169.9-1720000113.2E188 R193E188-V191 PolarHBondContact O-N 3.39Å; V191-R193 PolarHBondContact O-N 2.76Å; V191-R193 VanDerWaalsContact O-N 3.09Å
192D41.3Very low46.3Very low156 Ų156114.2 Ų114.283%0.83463%0.626SS**  trans-86.284175.2-86.7-39000111.8
193R42.6Very low46.2Very low169 Ų169117 Ų11764%0.63862%0.617SS**  trans-10973.2159.9-70.1-165.2-160.5176.511.7109.7V191V191-R193 PolarHBondContact O-N 2.76Å; V191-R193 VanDerWaalsContact O-N 3.09Å
194H42.8Very low46.4Very low176 Ų176112.9 Ų112.982%0.81561%0.612SS**SBendtrans-9092.7142.4-136.6-78000106.4Q196H194-Q196 PolarHBondContact O-N 3.12Å
195E43.8Very low46.4Very low172 Ų172114.5 Ų114.580%0.80461%0.611SS**SBendtrans44.443.5150.8-135.4179.3167.200119.3
196Q41.8Very low46.6Very low167 Ų167120.3 Ų120.378%0.7862%0.624SS**SBendtrans-149137.8147.7-80.9-151-2.900111.9H194H194-Q196 PolarHBondContact O-N 3.12Å
197P43.6Very low46.4Very low95 Ų95122.1 Ų122.162%0.61763%0.631SS**  trans-86137-153.632.7-33.4000112.6H199P197-H199 PolarHBondContact O-N 2.82Å
198F45Very low46.3Very low144 Ų144122.9 Ų122.963%0.63264%0.643SS**THydrogen-bonded Turntrans29.9-30.8153.8-64.2-86.5000122.3
199H44.3Very low46.2Very low156 Ų156121.1 Ų121.172%0.72264%0.639SS**Hα-helixtrans-79.3-30.8-178.6-106-107.7000114.1P197 C201 C202P197-H199 PolarHBondContact O-N 2.82Å; H199-C201 PolarHBondContact O-N 2.85Å; H199-C202 PolarHBondContact O-N 3.14Å
200A45.2Very low46.3Very low69 Ų69129.7 Ų129.757%0.5766%0.664SS**Hα-helixtrans-67.6-36.5-175.200000112.7C202 F203 A204A200-C202 VanDerWaalsContact C-N 3.27Å; A200-C202 PolarHBondContact O-N 3.2Å; A200-F203 PolarHBondContact O-N 2.91Å; A200-A204 PolarHBondContact O-N 2.77Å
201C49.4Very low46Very low54 Ų54137.2 Ų137.237%0.36568%0.684SS.*Hα-helixtrans-65-33.6179.8-1600000111.9H199 F203H199-C201 PolarHBondContact O-N 2.85Å; C201-F203 PolarHBondContact O-N 3.33Å
202C46.2Very low45.7Very low87 Ų87136.8 Ų136.859%0.58868%0.682SS**Hα-helixtrans-65.9-23.6174-68.10000113.3H199 A200H199-C202 PolarHBondContact O-N 3.14Å; A200-C202 VanDerWaalsContact C-N 3.27Å; A200-C202 PolarHBondContact O-N 3.2Å
203F49.4Very low45.6Very low134 Ų134138 Ų13859%0.58868%0.682SS**Hα-helixtrans-82.8-34.8-179-115.2-87.2000113.2A200 C201 M205 R206A200-F203 PolarHBondContact O-N 2.91Å; C201-F203 PolarHBondContact O-N 3.33Å; F203-M205 VanDerWaalsContact C-N 3.31Å; F203-M205 PolarHBondContact O-N 2.71Å; F203-R206 WeakPolarHBondContact O-CB 2.97Å; F203-R206 PolarHBondContact O-N 2.95Å; F203-R206 VanDerWaalsContact O-N 3.14Å
204A50.2Low45.4Very low68 Ų68141.4 Ų141.456%0.56270%0.695SS**Hα-helixtrans-63.6-32.8-17600000113.4A200 R206 T207A200-A204 PolarHBondContact O-N 2.77Å; A204-R206 VanDerWaalsContact C-N 3.3Å; A204-R206 PolarHBondContact O-N 3.05Å; A204-T207 PolarHBondContact O-OG1 2.83Å
205M50Low45.3Very low123 Ų123140.4 Ų140.461%0.60670%0.702SS**Hα-helixtrans-76.8-11.4178.7-74-88.9-113.600113.9F203 T207F203-M205 VanDerWaalsContact C-N 3.31Å; F203-M205 PolarHBondContact O-N 2.71Å; M205-T207 VanDerWaalsContact C-N 3.26Å; M205-T207 PolarHBondContact O-N 2.69Å
206R48.6Very low45.3Very low185 Ų185136.1 Ų136.170%0.69870%0.695SS**Hα-helixtrans-68.2-23.7176.1-85.5-174.6173.5-175.3-1.6113.1F203 A204F203-R206 WeakPolarHBondContact O-CB 2.97Å; F203-R206 PolarHBondContact O-N 2.95Å; F203-R206 VanDerWaalsContact O-N 3.14Å; A204-R206 VanDerWaalsContact C-N 3.3Å; A204-R206 PolarHBondContact O-N 3.05Å
207T49.7Very low45.2Very low121 Ų121136.7 Ų136.774%0.74270%0.698SS**Hα-helixtrans-92.5-20.4-176.657.60000113.6A204 M205A204-T207 PolarHBondContact O-OG1 2.83Å; M205-T207 VanDerWaalsContact C-N 3.26Å; M205-T207 PolarHBondContact O-N 2.69Å
208S49.8Very low44.9Very low92 Ų92142 Ų14264%0.64371%0.711SS**Hα-helixtrans-80.2-27.2-177.1165.70000113.7R210S208-R210 PolarHBondContact O-N 3.04Å
209N45.6Very low44.7Very low132 Ų132144.5 Ų144.571%0.70672%0.722SS**THydrogen-bonded Turntrans-94.226-171.1-138-6.8000115.1
210R44.3Very low44.4Very low233 Ų233140.7 Ų140.788%0.87973%0.725SS**  trans-97.519.1174.2-88.2-166-176.9-1651.7114.5S208S208-R210 PolarHBondContact O-N 3.04Å
211R43.7Very low44.3Very low236 Ų236148.1 Ų148.189%0.89174%0.738SS**  trans-121.558.5172.4-83.9-170.3-177.9175.21.5112.6
212T42.1Very low43.9Very low104 Ų104154.8 Ų154.864%0.63876%0.764SS**SBendtrans-149.3107.215348.30000109.5
213H39Very low43.8Very low181 Ų181159 Ų15984%0.83878%0.775SS**  trans43.6102.2151.5-64.4-90.9000118
214R39.6Very low43.6Very low240 Ų240157.7 Ų157.791%0.90678%0.782SS**  -177.7112.9117.6-99.3165.1-176.2-1670.5110.3A216R214-A216 PolarHBondContact O-N 2.79Å; R214-A216 VanDerWaalsContact O-N 3.08Å
215T40.1Very low43.5Very low156 Ų156159.2 Ų159.296%0.95779%0.789SS**  trans-49.1104.4154.5-42.40000108.2
216A42.7Very low43.1Very low81 Ų81160.4 Ų160.467%0.66980%0.796SS**  trans-149.4101.9169.400000107.9R214R214-A216 PolarHBondContact O-N 2.79Å; R214-A216 VanDerWaalsContact O-N 3.08Å
217H41.6Very low42.8Very low180 Ų180161.9 Ų161.983%0.83380%0.802SS**  trans22.3110156.1-82.7-98.4000118F219H217-F219 PolarHBondContact O-N 3.03Å
218F37.4Very low42.5Very low205 Ų205160.9 Ų160.990%0.89980%0.8SS**  trans-35.1113.3150.2-100.8-107.6000111.8
219F39.7Very low41.9Very low198 Ų198167.7 Ų167.787%0.86881%0.811SS**  trans-136.5115.3141.1-97-79.8000108.1H217 R221H217-F219 PolarHBondContact O-N 3.03Å; F219-R221 PolarHBondContact O-N 3.14Å
220G38.6Very low41.7Very low75 Ų75167 Ų16777%0.77382%0.816SS**  trans-59.8129.9-178.200000111.2
221R41.7Very low41.3Very low225 Ų225163 Ų16385%0.84981%0.81SS**  trans-131102.1159.4-134176.5-164.2-145.12.6107.4F219 Q223F219-R221 PolarHBondContact O-N 3.14Å; R221-Q223 PolarHBondContact O-N 2.88Å
222Q42.4Very low41.3Very low195 Ų195157.3 Ų157.391%0.91180%0.803SS**  trans-51108.2166.5-73.3177.311.300107.9
223Q44Very low41.5Very low176 Ų176159.2 Ų159.282%0.82282%0.815SS**  trans-102.6105.6160.8-71.8-17044.200106R221 S225R221-Q223 PolarHBondContact O-N 2.88Å; Q223-S225 PolarHBondContact O-N 2.86Å
224S45Very low41.6Very low105 Ų105155.2 Ų155.273%0.73481%0.808SS**  trans-49.4119.7173.930.80000110I226S224-I226 PolarHBondContact O-N 3.48Å
225S47.1Very low41.4Very low101 Ų101155.3 Ų155.371%0.70681%0.808SS**  trans-67.390.4176.8-176.60000109.5Q223 R227Q223-S225 PolarHBondContact O-N 2.86Å; S225-R227 PolarHBondContact O-N 2.73Å
226I43.1Very low42Very low148 Ų148160.9 Ų160.976%0.75982%0.82SS**  trans-74.885.3165-58.8174.8000106.3S224 S228S224-I226 PolarHBondContact O-N 3.48Å; I226-S228 VanDerWaalsContact C-N 3.28Å; I226-S228 PolarHBondContact O-N 2.82Å
227R42.5Very low42Very low216 Ų216164.9 Ų164.982%0.81583%0.827SS**  trans-69.789.5163.9-80.3-178170.5-174.2-2107.5S225 R229S225-R227 PolarHBondContact O-N 2.73Å; R227-R229 PolarHBondContact O-N 2.92Å
228S43Very low42Very low99 Ų99164.1 Ų164.169%0.69283%0.827SS**  trans-63100.6164.546.40000108.2I226 C230I226-S228 VanDerWaalsContact C-N 3.28Å; I226-S228 PolarHBondContact O-N 2.82Å; S228-C230 PolarHBondContact O-N 2.93Å; S228-C230 VanDerWaalsContact O-N 3.14Å
229R37.7Very low42.3Very low235 Ų235161.8 Ų161.889%0.88782%0.823SS**  trans-65.3106.2170-70.9-177.8-174.4-168.41.3107.5R227 I231R227-R229 PolarHBondContact O-N 2.92Å; R229-I231 PolarHBondContact O-N 2.8Å
230C40Very low42.4Very low118 Ų118159.7 Ų159.780%0.79782%0.82SS**  trans-66.8109.5166.1-60.90000107.7S228 P232S228-C230 PolarHBondContact O-N 2.93Å; S228-C230 VanDerWaalsContact O-N 3.14Å; C230-P232 WeakPolarHBondContact O-CD 2.95Å
231I36Very low42.7Very low150 Ų150165 Ų16577%0.76982%0.823SS**  trans-75.6119.7170.8-60.7173.8000106.7R229 T233R229-I231 PolarHBondContact O-N 2.8Å; I231-T233 PolarHBondContact O-N 3.28Å
232P43.1Very low42.8Very low115 Ų115161 Ų16175%0.74782%0.821SS**  trans-69.4120.8175.426.5-29.6000109.1C230 S234C230-P232 WeakPolarHBondContact O-CD 2.95Å; P232-S234 PolarHBondContact O-N 2.66Å; P232-S234 VanDerWaalsContact O-N 3.13Å
233T48Very low42.8Very low145 Ų145158.6 Ų158.689%0.8982%0.815SS**  trans-61.6111.2172.745.20000108.9I231I231-T233 PolarHBondContact O-N 3.28Å
234S41.1Very low42.7Very low97 Ų97157.2 Ų157.268%0.67881%0.814SS**  trans-68.7136.3175.155.60000110.6P232P232-S234 PolarHBondContact O-N 2.66Å; P232-S234 VanDerWaalsContact O-N 3.13Å
235R34Very low42.5Very low241 Ų241161.6 Ų161.691%0.90982%0.821SS**  trans-45.5132.9168.7-67.2173.9176174.9-3111.9
236F54.6Low42.1Very low274 Ų274167.1 Ų167.1100%1.20283%0.831SS**  trans-134.40142.7-79.6-77.3000107.1

Retrieved 236 of 236 residues in 802.6 ms (Link to these results)