A0A087XL61_POEFO Loading...

LIM homeobox transcription factor 1-alpha

Acts as a transcriptional activator by binding to an A/T-rich sequence, the FLAT element, in the insulin gene promoter. Required for development of the roof plate and, in turn, for specification of dorsal cell fates in the CNS and developing vertebrae.

AlphaFold DB , UniProt , Accession A0A087XL61, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 399 aa.

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(Predicted Aligned Error values between residue pairs)
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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
1M33.3Very low30.5Very low239 Ų239134.6 Ų134.6100%1.17782%0.824SS**  01630-77.4-170.9168.400108.6
2L25.8Very low30Very low172 Ų172138.5 Ų138.590%0.90182%0.821SS**  trans75146.3-171.7-60.2176.8000114.8
3P35.3Very low30.1Very low103 Ų103137.3 Ų137.367%0.66982%0.816SS**  -115.9161.6-124.540-33.7000115.2
4T32.1Very low29.8Very low137 Ų137135.4 Ų135.484%0.8481%0.813SS**  trans-84.8112.3169.5-40.90000109.5I6T4-I6 PolarHBondContact O-N 3.16Å
5E28.2Very low29.9Very low158 Ų158134.2 Ų134.274%0.73881%0.814SS**  trans-52.3125.6178.8-69.5-75.9100.700112.7S7E5-S7 PolarHBondContact O-N 3.49Å
6I37.1Very low29.7Very low169 Ų169135.9 Ų135.987%0.86782%0.817SS**  trans-93.883.3174.4-53.7173.2000108.2T4 G8T4-I6 PolarHBondContact O-N 3.16Å; I6-G8 PolarHBondContact O-N 2.98Å
7S30Very low29.9Very low107 Ų107138.2 Ų138.275%0.74882%0.817SS**  trans-81.998.7176.7-56.80000111.6E5 G9E5-S7 PolarHBondContact O-N 3.49Å; S7-G9 PolarHBondContact O-N 3.26Å
8G29Very low29.9Very low70 Ų70138.3 Ų138.372%0.72282%0.819SS**  trans-67.3112.417000000111.7I6 V10I6-G8 PolarHBondContact O-N 2.98Å; G8-V10 PolarHBondContact O-N 2.89Å; G8-V10 VanDerWaalsContact O-N 3.12Å
9G26.7Very low30.3Very low80 Ų80141.6 Ų141.683%0.82583%0.825SS**  trans-79.188.6177.700000112.6S7S7-G9 PolarHBondContact O-N 3.26Å
10V30.3Very low30.1Very low125 Ų125137.6 Ų137.676%0.75882%0.815SS**  trans-69128.8168.1-93.80000111G8G8-V10 PolarHBondContact O-N 2.89Å; G8-V10 VanDerWaalsContact O-N 3.12Å
11C28Very low30.2Very low121 Ų121142.7 Ų142.782%0.81882%0.82SS**  trans-95.297.517847.90000111.4
12F24.6Very low30.1Very low181 Ų181142.6 Ų142.679%0.79481%0.807SS**  trans-77.2128167.3-86.5-91.9000111
13T30.2Very low30.4Very low123 Ų123142.7 Ų142.776%0.75580%0.802SS**  trans-110.5103.8160.553.90000108.6
14S26.4Very low30Very low110 Ų110140.9 Ų140.977%0.76980%0.802SS**  trans-102111.4167.6-62.90000108.7
15S31.6Very low30Very low118 Ų118142 Ų14283%0.82580%0.8SS**  trans-83.3128.7158.5-61.70000107.4
16D27Very low29.9Very low162 Ų162143.2 Ų143.287%0.86680%0.803SS**  trans-150.5151.8146.5-133.9-36.2000112.4
17H32.3Very low29.9Very low175 Ų175137.3 Ų137.381%0.8178%0.775SS**  trans-90121.5-172.3-112.3-99.8000110.7
18T29.8Very low30.5Very low139 Ų139139.4 Ų139.485%0.85377%0.773SS**  trans-136.5135.1152.845.10000110G20T18-G20 PolarHBondContact O-N 3.04Å
19E37.5Very low31.9Very low202 Ų202143.1 Ų143.194%0.94477%0.771SS**  trans-73.4120.9-179.1-67.3-168.3107.800110.9
20G26.6Very low33.4Very low60 Ų60143.3 Ų143.362%0.61975%0.754SS**  trans-146.399.9176.300000108.8T18 R22T18-G20 PolarHBondContact O-N 3.04Å; G20-R22 WeakPolarHBondContact O-CG 3.45Å; G20-R22 PolarHBondContact O-N 3.09Å
21R31.5Very low35.2Very low246 Ų246142.2 Ų142.293%0.92874%0.74SS**  trans-30.691-179.4-171.9180-173.9179.91.5113.4E23R21-E23 PolarHBondContact O-N 3.04Å
22R31.8Very low37.7Very low237 Ų237137.3 Ų137.389%0.89471%0.705SS**  trans-76.7104.8175-65-173.3-172.5-173.23.7108.7G20 G24G20-R22 WeakPolarHBondContact O-CG 3.45Å; G20-R22 PolarHBondContact O-N 3.09Å; R22-G24 PolarHBondContact O-N 2.87Å
23E32.3Very low40.1Very low173 Ų173131.9 Ų131.981%0.80869%0.69SS**  trans-59.9110.7155.9-68.8-167.7141.800107.5R21 M25R21-E23 PolarHBondContact O-N 3.04Å; E23-M25 PolarHBondContact O-N 2.74Å
24G27.7Very low42.3Very low65 Ų65126.8 Ų126.867%0.6766%0.659SS**  trans-61.6111.2179.200000109.1R22 K26R22-G24 PolarHBondContact O-N 2.87Å; G24-K26 VanDerWaalsContact C-N 3.26Å; G24-K26 PolarHBondContact O-N 2.85Å
25M32.3Very low44.9Very low160 Ų160126.4 Ų126.479%0.78865%0.648SS**  trans-63.686.6178.2-73.9-177.2168.900110.4E23 T27E23-M25 PolarHBondContact O-N 2.74Å; M25-T27 PolarHBondContact O-N 3.11Å; M25-T27 PolarHBondContact O-OG1 3.23Å
26K24.9Very low47.1Very low184 Ų184126.7 Ų126.780%0.864%0.636SS**  trans-51.7105.7167.4-75.2-172.9176.6-173.50107.7G24G24-K26 VanDerWaalsContact C-N 3.26Å; G24-K26 PolarHBondContact O-N 2.85Å
27T37.3Very low49.3Very low45 Ų45123 Ų12328%0.27661%0.614SS.*  trans-107.266.3177.727.80000106.8M25 E29 R123M25-T27 PolarHBondContact O-N 3.11Å; M25-T27 PolarHBondContact O-OG1 3.23Å; T27-E29 PolarHBondContact O-N 3.4Å; T27-R123 VanDerWaalsContact CB-CZ 3.48Å; T27-R123 VanDerWaalsContact CB-NH1 3.29Å; T27-R123 PolarHBondContact O-NH1 2.95Å; T27-R123 PolarHBondContact O-NH2 3.31Å; T27-R123 PolarHBondContact OG1-NH1 3.39Å
28E42.1Very low51Low152 Ų152119.1 Ų119.171%0.7160%0.604SS**  trans-64.1120.9169.5-75.5174.5105.300107.9N30E28-N30 PolarHBondContact O-N 3.02Å
29E58.9Low52.6Low147 Ų147115 Ų11569%0.68758%0.58SS**  trans-80.261.4-179.8-167.8168.712800109.2T27 Q31 R123T27-E29 PolarHBondContact O-N 3.4Å; E29-Q31 PolarHBondContact O-N 2.79Å; E29-Q31 VanDerWaalsContact O-N 3.12Å; E29-R123 IonicContact OE2-NH2 2.64Å
30N58.2Low53.7Low85 Ų85110.2 Ų110.246%0.45557%0.569SS.*  trans-89.384.8-170.7-152.7-4.5000109.7E28 Q32E28-N30 PolarHBondContact O-N 3.02Å; N30-Q32 HydrophobicContact CB-CG 4.22Å; N30-Q32 PolarHBondContact ND2-NE2 3.06Å; N30-Q32 WeakPolarHBondContact O-CG 3.47Å; N30-Q32 PolarHBondContact O-N 3.2Å
31Q69.4Low55Low102 Ų102112.7 Ų112.748%0.47758%0.576SS.*EExtended strand (participates in β ladder)trans-63.2112.2160.5175.2177.8100.800107.5E29 Y94E29-Q31 PolarHBondContact O-N 2.79Å; E29-Q31 VanDerWaalsContact O-N 3.12Å; Q31-Y94 HydrophobicContact CB-CE1 4.19Å; Q31-Y94 PolarHBondContact NE2-OH 3.32Å
32Q78.6Confident55.8Low18 Ų18107 Ų1078%0.08457%0.569CS.*EExtended strand (participates in β ladder)trans-105.7135.1-170.9-76.5168.5-8.300111.1N30 V70 N71 T92 C93N30-Q32 HydrophobicContact CB-CG 4.22Å; N30-Q32 PolarHBondContact ND2-NE2 3.06Å; N30-Q32 WeakPolarHBondContact O-CG 3.47Å; N30-Q32 PolarHBondContact O-N 3.2Å; Q32-V70 HydrophobicContact CB-CG1 4.4Å; Q32-N71 PolarHBondContact NE2-OD1 3.05Å; Q32-T92 VanDerWaalsContact O-CA 3.31Å; Q32-T92 WeakPolarHBondContact O-CA 3.34Å; Q32-C93 PolarHBondContact N-O 2.85Å; Q32-C93 PolarHBondContact O-N 3.02Å
33S75.4Confident56.8Low67 Ų67100.8 Ų100.847%0.46956%0.56SS.*EExtended strand (participates in β ladder)trans-76.8132.7170.8-172.80000109.9L35 G91S33-L35 PolarHBondContact O-N 2.79Å; S33-G91 WeakPolarHBondContact CA-O 3.2Å
34C77.8Confident57.6Low16 Ų16103 Ų10311%0.10857%0.567CS.*  trans-8690.9173.9-57.90000108.8L68 V70 G91 C93C34-L68 HydrophobicContact CB-CD2 4.31Å; C34-V70 HydrophobicContact CB-CG2 4.17Å; C34-G91 PolarHBondContact N-O 3.12Å; C34-C93 VanDerWaalsContact SG-SG 3.61Å
35L79.4Confident58.4Low102 Ų102101.7 Ų101.753%0.53455%0.553SS.*EExtended strand (participates in β ladder)trans-86.2130.1178.5-62.7179.4000110.8S33 L68 R69S33-L35 PolarHBondContact O-N 2.79Å; L35-L68 WeakPolarHBondContact O-CA 3.31Å; L35-R69 PolarHBondContact O-N 2.82Å
36Q79.1Confident59.4Low123 Ų123100.5 Ų100.558%0.57556%0.558SS**EExtended strand (participates in β ladder)trans-79.7132168.8-70.8178.5-8.500109.6L67 L68Q36-L67 WeakPolarHBondContact CA-O 3.16Å; Q36-L68 HydrophobicContact CG-CD1 4.22Å; Q36-L68 HydrophobicContact CG-CG 4.1Å
37Q72.3Confident60.7Low85 Ų8598.7 Ų98.740%0.39756%0.557SS.*EExtended strand (participates in β ladder)trans-134.6148.1173.3-69-173.5-2800110.1L67Q37-L67 PolarHBondContact N-O 3.37Å; Q37-L67 PolarHBondContact O-N 3.18Å
38P68.1Low61Low94 Ų94104.5 Ų104.561%0.6158%0.579SS**  trans-64.7147.5164.630.2-33.9000109.4S40P38-S40 PolarHBondContact O-N 3.29Å
39P63.9Low61.6Low52 Ų52109.2 Ų109.234%0.33859%0.59SS.*  trans-59.6138.2170.926.3-33.5000109.9S41 R65 L67P39-S41 PolarHBondContact O-N 3.26Å; P39-R65 WeakPolarHBondContact CD-O 3.37Å; P39-L67 HydrophobicContact CB-CD2 4.27Å
40S60.7Low60.9Low102 Ų102104.6 Ų104.671%0.71358%0.582SS**  trans-70.196.5-177.742.30000111.2P38P38-S40 PolarHBondContact O-N 3.29Å
41S53.8Low61Low112 Ų112104.6 Ų104.678%0.78360%0.601SS**  trans-90.9127174.9510000111.9P39P39-S41 PolarHBondContact O-N 3.26Å
42T47.1Very low61.3Low125 Ų125102.2 Ų102.277%0.76760%0.604SS**  trans-106.6152.9154.639.80000109.1
43P52.5Low61.7Low108 Ų108104.3 Ų104.370%0.70161%0.614SS**  trans-84.8142.9-156.931.9-35.8000114.4
44F49.8Very low62.5Low218 Ų218104.8 Ų104.896%0.95661%0.614SS**  trans25.993.6148.2-65.5-87.2000118
45G45Very low63.3Low38 Ų38104 Ų10439%0.39261%0.609SS.*  trans-152.3140.4159.200000109.9D47G45-D47 VanDerWaalsContact C-N 3.26Å; G45-D47 PolarHBondContact O-N 2.85Å
46P52.8Low63.9Low135 Ų135101 Ų10188%0.87760%0.598SS**THydrogen-bonded Turntrans-75.4-4.6-168.529.6-35.5000115.4
47D51.9Low64.4Low146 Ų14697.3 Ų97.378%0.78159%0.594SS**THydrogen-bonded Turntrans-122.536.8-174.2-85.9-61.4000114.2G45 R49G45-D47 VanDerWaalsContact C-N 3.26Å; G45-D47 PolarHBondContact O-N 2.85Å; D47-R49 PolarHBondContact O-N 3.37Å
48F44.8Very low65.4Low168 Ų16895.8 Ų95.874%0.73759%0.592SS**  trans-93.191.3172.7-94.4-88.6000113.3G50F48-G50 PolarHBondContact O-N 3.36Å
49R54Low66.5Low251 Ų25199.5 Ų99.595%0.94760%0.601SS**  trans-71.962.5150.7-98.4-176.8-83.1-107.6-5.9109.7D47D47-R49 PolarHBondContact O-N 3.37Å
50G44.6Very low67.9Low50 Ų5099.9 Ų99.952%0.51561%0.605SS.*  trans-104.2126.7177.800000110.7F48 G52F48-G50 PolarHBondContact O-N 3.36Å; G50-G52 PolarHBondContact O-N 2.94Å
51G60.4Low69.4Low84 Ų8499.4 Ų99.487%0.86660%0.599SS**PPolyproline II helixtrans-63117.2-172.300000113.3
52G74.6Confident71.2Confident52 Ų5295 Ų9554%0.53657%0.567SS.*PPolyproline II helixtrans-65.9147164.400000110.9G50 V54G50-G52 PolarHBondContact O-N 2.94Å; G52-V54 PolarHBondContact O-N 2.89Å
53E87.1Confident73.2Confident62 Ų6293.8 Ų93.829%0.2957%0.57SS.*PPolyproline II helixtrans-59123.6176.9-70.6-76.7171.100110.4I62 L67 R69 S74E53-I62 HydrophobicContact CB-CD1 4.37Å; E53-I62 WeakPolarHBondContact O-CB 3.44Å; E53-I62 WeakPolarHBondContact O-CG1 3.35Å; E53-I62 PolarHBondContact O-N 3.25Å; E53-L67 HydrophobicContact CB-CD2 4.02Å; E53-L67 HydrophobicContact CG-CD2 3.93Å; E53-R69 IonicContact OE1-CZ 3.36Å; E53-R69 IonicContact OE1-NH2 2.77Å; E53-R69 PolarHBondContact OE1-NH2 2.98Å; E53-R69 IonicContact OE2-NH2 3.43Å; E53-R69 PolarHBondContact OE2-NH2 3.16Å; E53-S74 WeakPolarHBondContact OE2-CB 3.26Å; E53-S74 PolarHBondContact OE2-OG 2.64Å
54V93.3Very high74.8Confident78 Ų7892 Ų9247%0.47355%0.554SS.*BIsolated β-bridgetrans-94.8134.2-179177.90000110G52 A56 E59G52-V54 PolarHBondContact O-N 2.89Å; V54-A56 PolarHBondContact O-N 2.92Å; V54-E59 VanDerWaalsContact CG1-O 3.23Å; V54-E59 WeakPolarHBondContact CG1-O 3.3Å
55C93.7Very high76.6Confident0 Ų091.2 Ų91.20%055%0.545CS..PPolyproline II helixtrans-69.4118.4178.9178.50000111.3G57 C58 E59 S60 I62 S74 H76 C79C55-G57 PolarHBondContact O-N 2.94Å; C55-G57 PolarHBondContact SG-N 3.36Å; C55-G57 VanDerWaalsContact SG-N 3.43Å; C55-C58 PolarHBondContact O-N 3.36Å; C55-E59 WeakPolarHBondContact O-CA 3.5Å; C55-E59 PolarHBondContact O-N 3.1Å; C55-S60 WeakPolarHBondContact CB-O 3.47Å; C55-S60 PolarHBondContact N-O 3.3Å; C55-I62 HydrophobicContact CB-CD1 4.17Å; C55-I62 HydrophobicContact CB-CG1 3.84Å; C55-S74 WeakPolarHBondContact CA-O 3.24Å; C55-H76 VanDerWaalsContact CB-CE1 3.41Å; C55-H76 WeakPolarHBondContact CB-CE1 3.45Å; C55-H76 WeakPolarHBondContact CB-ND1 3.29Å; C55-H76 PolarHBondContact SG-ND1 2.9Å; C55-H76 VanDerWaalsContact SG-ND1 3.36Å; C55-C79 VanDerWaalsContact SG-CB 3.55Å
56A92Very high78.6Confident38 Ų3894 Ų9431%0.31455%0.546SS..THydrogen-bonded Turntrans-66.7-9.5179.200000114.9V54 R73 S74 W75V54-A56 PolarHBondContact O-N 2.92Å; A56-R73 HydrophobicContact CB-CB 3.89Å; A56-R73 HydrophobicContact CB-CG 4.32Å; A56-S74 PolarHBondContact N-O 3.39Å; A56-W75 HydrophobicContact CB-CD2 4.18Å; A56-W75 HydrophobicContact CB-CE3 4.5Å; A56-W75 HydrophobicContact CB-CH2 4.09Å; A56-W75 HydrophobicContact CB-CZ2 3.76Å; A56-W75 HydrophobicContact CB-CZ3 4.47Å
57G90.7Very high80.4Confident46 Ų4687.9 Ų87.947%0.47451%0.506SS..THydrogen-bonded Turntrans-101.6-15.317900000115.9C55 W75C55-G57 PolarHBondContact O-N 2.94Å; C55-G57 PolarHBondContact SG-N 3.36Å; C55-G57 VanDerWaalsContact SG-N 3.43Å; G57-W75 VanDerWaalsContact CA-CZ3 3.41Å
58C92.3Very high82.2Confident53 Ų5381.5 Ų81.536%0.35847%0.472SS..THydrogen-bonded Turntrans-141.83.2178.8670000114.5C55 S60 H76 C79C55-C58 PolarHBondContact O-N 3.36Å; C58-S60 PolarHBondContact O-N 2.91Å; C58-H76 PolarHBondContact SG-CE1 2.95Å; C58-H76 PolarHBondContact SG-ND1 3.42Å; C58-C79 VanDerWaalsContact SG-SG 3.69Å
59E91.8Very high84.4Confident172 Ų17277.5 Ų77.580%0.80445%0.452SS*.  trans62.13.8173.9-54.2-178.1169.300115.5V54 C55V54-E59 VanDerWaalsContact CG1-O 3.23Å; V54-E59 WeakPolarHBondContact CG1-O 3.3Å; C55-E59 WeakPolarHBondContact O-CA 3.5Å; C55-E59 PolarHBondContact O-N 3.1Å
60S92.5Very high86.1Confident60 Ų6065.6 Ų65.642%0.4241%0.407SS..SBendtrans-85.8149.1173.2-59.50000112.6C55 C58C55-S60 WeakPolarHBondContact CB-O 3.47Å; C55-S60 PolarHBondContact N-O 3.3Å; C58-S60 PolarHBondContact O-N 2.91Å
61P93Very high88.1Confident92 Ų9266.6 Ų66.660%0.59740%0.401SS*.BIsolated β-bridgetrans-63.9138.2172.827.7-34.8000111.4A63P61-A63 PolarHBondContact O-N 3.36Å
62I92.3Very high89.3Confident19 Ų1971.3 Ų71.310%0.09740%0.4CS..  trans-81.6109.3-179.7-58.5169.6000109.3E53 C55 D64 L67E53-I62 HydrophobicContact CB-CD1 4.37Å; E53-I62 WeakPolarHBondContact O-CB 3.44Å; E53-I62 WeakPolarHBondContact O-CG1 3.35Å; E53-I62 PolarHBondContact O-N 3.25Å; C55-I62 HydrophobicContact CB-CD1 4.17Å; C55-I62 HydrophobicContact CB-CG1 3.84Å; I62-D64 HydrophobicContact CG2-CB 3.96Å; I62-L67 HydrophobicContact CD1-CB 4.18Å; I62-L67 HydrophobicContact CG2-CB 4.12Å
63A88.9Confident90.1Very high100 Ų10074 Ų7483%0.82639%0.394SS*.  trans-97.70.5172.100000113.1P61P61-A63 PolarHBondContact O-N 3.36Å
64D86.4Confident90.4Very high69 Ų6971.1 Ų71.137%0.36938%0.381SS..SBendtrans-65.5149.7-178.9-69.1-8.9000112I62 F66 H76I62-D64 HydrophobicContact CG2-CB 3.96Å; D64-F66 WeakPolarHBondContact CB-O 3.44Å; D64-F66 PolarHBondContact O-N 2.93Å; D64-H76 IonicContact OD2-CD2 2.7Å; D64-H76 PolarHBondContact OD2-CD2 2.77Å; D64-H76 VanDerWaalsContact OD2-CD2 3.28Å; D64-H76 IonicContact OD2-CG 3.52Å
65R86.9Confident90.4Very high202 Ų20268 Ų6876%0.76236%0.361SS*.SBendtrans-59.7-28.3175.8-179.1177.9175.9-178.30.3113.2P39P39-R65 WeakPolarHBondContact CD-O 3.37Å
66F86.6Confident90.3Very high98 Ų9869 Ų6943%0.4337%0.366SS..SBendtrans-136.5141.5179.2-56.5-71.3000108.8D64D64-F66 WeakPolarHBondContact CB-O 3.44Å; D64-F66 PolarHBondContact O-N 2.93Å
67L90.8Very high90.3Very high5 Ų573.1 Ų73.13%0.02638%0.378CS..EExtended strand (participates in β ladder)trans-114.3153.8171.666.182.9000109.9Q36 Q37 P39 E53 I62 R69Q36-L67 WeakPolarHBondContact CA-O 3.16Å; Q37-L67 PolarHBondContact N-O 3.37Å; Q37-L67 PolarHBondContact O-N 3.18Å; P39-L67 HydrophobicContact CB-CD2 4.27Å; E53-L67 HydrophobicContact CB-CD2 4.02Å; E53-L67 HydrophobicContact CG-CD2 3.93Å; I62-L67 HydrophobicContact CD1-CB 4.18Å; I62-L67 HydrophobicContact CG2-CB 4.12Å; L67-R69 HydrophobicContact CD1-CB 4.25Å
68L90Very high90.3Very high13 Ų1376.4 Ų76.47%0.06839%0.389CS..EExtended strand (participates in β ladder)trans-101.4130.8170.9-73.174.9000108.5C34 L35 Q36 S74 W75 E77 V80C34-L68 HydrophobicContact CB-CD2 4.31Å; L35-L68 WeakPolarHBondContact O-CA 3.31Å; Q36-L68 HydrophobicContact CG-CD1 4.22Å; Q36-L68 HydrophobicContact CG-CG 4.1Å; L68-S74 CarbonylContact O-C 3.58Å; L68-W75 PolarHBondContact N-O 2.7Å; L68-W75 PolarHBondContact O-N 3.22Å; L68-E77 HydrophobicContact CD1-CB 3.84Å; L68-E77 HydrophobicContact CD1-CG 4.3Å; L68-V80 HydrophobicContact CB-CG2 4.01Å; L68-V80 HydrophobicContact CD2-CB 4.29Å; L68-V80 HydrophobicContact CD2-CG1 4.32Å; L68-V80 HydrophobicContact CD2-CG2 4.02Å
69R90.4Very high90.4Very high83 Ų8374.6 Ų74.631%0.31338%0.377SS..EExtended strand (participates in β ladder)trans-106.4119.8176.9-171.7156.5-89.7177.1-11.6110.2L35 E53 L67 R73 S74L35-R69 PolarHBondContact O-N 2.82Å; E53-R69 IonicContact OE1-CZ 3.36Å; E53-R69 IonicContact OE1-NH2 2.77Å; E53-R69 PolarHBondContact OE1-NH2 2.98Å; E53-R69 IonicContact OE2-NH2 3.43Å; E53-R69 PolarHBondContact OE2-NH2 3.16Å; L67-R69 HydrophobicContact CD1-CB 4.25Å; R69-R73 CarbonylContact C-O 3.53Å; R69-R73 VanDerWaalsContact CA-O 3.32Å; R69-R73 WeakPolarHBondContact CA-O 3.13Å; R69-S74 PolarHBondContact NH2-OG 3.07Å
70V89.8Confident90.4Very high2 Ų266.5 Ų66.51%0.01234%0.339CS..EExtended strand (participates in β ladder)trans-139.5127.7-175.8-176.60000108.7Q32 C34 E72 R73 W75 C93 L100Q32-V70 HydrophobicContact CB-CG1 4.4Å; C34-V70 HydrophobicContact CB-CG2 4.17Å; V70-E72 VanDerWaalsContact C-N 3.29Å; V70-E72 PolarHBondContact O-N 3.34Å; V70-R73 PolarHBondContact N-O 2.89Å; V70-R73 WeakPolarHBondContact O-CB 3.45Å; V70-R73 PolarHBondContact O-N 2.88Å; V70-W75 PolarHBondContact O-NE1 3.33Å; V70-C93 VanDerWaalsContact CG1-SG 3.5Å; V70-L100 HydrophobicContact CG1-CD2 3.75Å
71N87.3Confident90.6Very high71 Ų7168.4 Ų68.438%0.3834%0.34SS..THydrogen-bonded Turntrans49.546.1-173-149.520.3000113.5Q32 R73 C95Q32-N71 PolarHBondContact NE2-OD1 3.05Å; N71-R73 PolarHBondContact O-N 2.96Å; N71-C95 HydrophobicContact CB-CB 4.14Å; N71-C95 PolarHBondContact ND2-SG 3.18Å
72E86.1Confident90.7Very high182 Ų18264 Ų6485%0.8531%0.312SS*.THydrogen-bonded Turntrans59.88-175-52.6-175.1130.500115.2V70V70-E72 VanDerWaalsContact C-N 3.29Å; V70-E72 PolarHBondContact O-N 3.34Å
73R90.1Very high90.8Very high108 Ų10865.3 Ų65.341%0.40833%0.325SS..EExtended strand (participates in β ladder)trans-106.1147.8178.7-68.1168.2178.6-90.4-13.2111.1A56 R69 V70 N71 W75A56-R73 HydrophobicContact CB-CB 3.89Å; A56-R73 HydrophobicContact CB-CG 4.32Å; R69-R73 CarbonylContact C-O 3.53Å; R69-R73 VanDerWaalsContact CA-O 3.32Å; R69-R73 WeakPolarHBondContact CA-O 3.13Å; V70-R73 PolarHBondContact N-O 2.89Å; V70-R73 WeakPolarHBondContact O-CB 3.45Å; V70-R73 PolarHBondContact O-N 2.88Å; N71-R73 PolarHBondContact O-N 2.96Å; R73-W75 PolarHBondContact O-NE1 3.39Å
74S93.1Very high91.1Very high3 Ų364 Ų642%0.02131%0.306CS..EExtended strand (participates in β ladder)trans-93.9142.9179-55.10000110.9E53 C55 A56 L68 R69E53-S74 WeakPolarHBondContact OE2-CB 3.26Å; E53-S74 PolarHBondContact OE2-OG 2.64Å; C55-S74 WeakPolarHBondContact CA-O 3.24Å; A56-S74 PolarHBondContact N-O 3.39Å; L68-S74 CarbonylContact O-C 3.58Å; R69-S74 PolarHBondContact NH2-OG 3.07Å
75W93.1Very high91.5Very high13 Ų1363.3 Ų63.35%0.04931%0.307CS..EExtended strand (participates in β ladder)trans-143.4144.4-176.1-55.677.3000110.8A56 G57 L68 V70 R73 C79 V80 L100A56-W75 HydrophobicContact CB-CD2 4.18Å; A56-W75 HydrophobicContact CB-CE3 4.5Å; A56-W75 HydrophobicContact CB-CH2 4.09Å; A56-W75 HydrophobicContact CB-CZ2 3.76Å; A56-W75 HydrophobicContact CB-CZ3 4.47Å; G57-W75 VanDerWaalsContact CA-CZ3 3.41Å; L68-W75 PolarHBondContact N-O 2.7Å; L68-W75 PolarHBondContact O-N 3.22Å; V70-W75 PolarHBondContact O-NE1 3.33Å; R73-W75 PolarHBondContact O-NE1 3.39Å; W75-C79 HydrophobicContact CE3-CB 4.45Å; W75-V80 HydrophobicContact CB-CG2 3.36Å; W75-V80 HydrophobicContact CD2-CG2 4.41Å; W75-V80 HydrophobicContact CG-CG2 3.88Å; W75-L100 HydrophobicContact CD2-CD1 4.08Å; W75-L100 HydrophobicContact CE3-CD1 4.07Å; W75-L100 HydrophobicContact CH2-CD1 3.97Å; W75-L100 HydrophobicContact CH2-CD2 4.46Å; W75-L100 HydrophobicContact CH2-CG 3.85Å; W75-L100 HydrophobicContact CZ2-CD1 3.94Å; W75-L100 HydrophobicContact CZ2-CD2 4.1Å; W75-L100 HydrophobicContact CZ2-CG 3.93Å; W75-L100 HydrophobicContact CZ3-CD1 4.01Å; W75-L100 HydrophobicContact CZ3-CG 4.29Å
76H92.9Very high91.9Very high21 Ų2159.5 Ų59.510%0.09730%0.3CS..  trans-64.9149.6161.9-54.8114000110.3C55 C58 D64 T78 C79 V80C55-H76 VanDerWaalsContact CB-CE1 3.41Å; C55-H76 WeakPolarHBondContact CB-CE1 3.45Å; C55-H76 WeakPolarHBondContact CB-ND1 3.29Å; C55-H76 PolarHBondContact SG-ND1 2.9Å; C55-H76 VanDerWaalsContact SG-ND1 3.36Å; C58-H76 PolarHBondContact SG-CE1 2.95Å; C58-H76 PolarHBondContact SG-ND1 3.42Å; D64-H76 IonicContact OD2-CD2 2.7Å; D64-H76 PolarHBondContact OD2-CD2 2.77Å; D64-H76 VanDerWaalsContact OD2-CD2 3.28Å; D64-H76 IonicContact OD2-CG 3.52Å; H76-T78 PolarHBondContact O-N 3.18Å; H76-C79 HydrophobicContact CB-CB 4.02Å; H76-C79 PolarHBondContact O-N 3.06Å; H76-V80 PolarHBondContact O-N 3.07Å
77E91.1Very high92.3Very high123 Ų12358 Ų5858%0.57530%0.302SS*.G310 helixtrans-54.5-40.3174.6-174.2171.8-157.300112.1L68 C79 V80L68-E77 HydrophobicContact CD1-CB 3.84Å; L68-E77 HydrophobicContact CD1-CG 4.3Å; E77-C79 VanDerWaalsContact C-N 3.29Å; E77-C79 PolarHBondContact O-N 2.9Å; E77-V80 PolarHBondContact O-N 3.13Å
78T91.9Very high92.4Very high115 Ų11561.5 Ų61.571%0.70633%0.332SS*.G310 helixtrans-72.9-16.7177.359.20000114.4H76H76-T78 PolarHBondContact O-N 3.18Å
79C93.1Very high92.5Very high16 Ų1661.6 Ų61.611%0.10833%0.332CS..G310 helixtrans-93.5-16.2179.4-68.90000112.9C55 C58 W75 H76 E77 K81C55-C79 VanDerWaalsContact SG-CB 3.55Å; C58-C79 VanDerWaalsContact SG-SG 3.69Å; W75-C79 HydrophobicContact CE3-CB 4.45Å; H76-C79 HydrophobicContact CB-CB 4.02Å; H76-C79 PolarHBondContact O-N 3.06Å; E77-C79 VanDerWaalsContact C-N 3.29Å; E77-C79 PolarHBondContact O-N 2.9Å; C79-K81 VanDerWaalsContact C-N 3.3Å; C79-K81 PolarHBondContact O-N 3.02Å
80V93.3Very high92.3Very high2 Ų263.5 Ų63.51%0.01235%0.354CS..  trans-78.180.3175.1177.40000109.4L68 W75 H76 E77 A88 L89 L100L68-V80 HydrophobicContact CB-CG2 4.01Å; L68-V80 HydrophobicContact CD2-CB 4.29Å; L68-V80 HydrophobicContact CD2-CG1 4.32Å; L68-V80 HydrophobicContact CD2-CG2 4.02Å; W75-V80 HydrophobicContact CB-CG2 3.36Å; W75-V80 HydrophobicContact CD2-CG2 4.41Å; W75-V80 HydrophobicContact CG-CG2 3.88Å; H76-V80 PolarHBondContact O-N 3.07Å; E77-V80 PolarHBondContact O-N 3.13Å; V80-A88 WeakPolarHBondContact O-CA 3.44Å; V80-L89 HydrophobicContact CG1-CB 3.91Å; V80-L89 WeakPolarHBondContact CG1-O 3.19Å; V80-L89 PolarHBondContact O-N 3.36Å; V80-L100 HydrophobicContact CG1-CD1 4.21Å
81K95.1Very high92Very high100 Ų10065.7 Ų65.744%0.43538%0.376SS..BIsolated β-bridgetrans-136.3154.5-176.967.2-166.8173.8-167.80112.1C79 A83 S87C79-K81 VanDerWaalsContact C-N 3.3Å; C79-K81 PolarHBondContact O-N 3.02Å; K81-A83 PolarHBondContact O-N 2.85Å; K81-S87 CarbonylContact C-O 3.52Å; K81-S87 VanDerWaalsContact CA-O 3.29Å; K81-S87 WeakPolarHBondContact CA-O 3.46Å
82C95.3Very high92Very high0 Ų065.7 Ų65.70%038%0.379CS..  trans-68130.8177.8-175.40000111.5V84 C85 L86 S87 L89 L100 C102 D105C82-V84 PolarHBondContact O-N 3.48Å; C82-V84 PolarHBondContact SG-N 2.84Å; C82-V84 VanDerWaalsContact SG-N 3.43Å; C82-C85 WeakPolarHBondContact CB-SG 3.4Å; C82-L86 WeakPolarHBondContact O-CA 3.24Å; C82-L86 PolarHBondContact O-N 3.42Å; C82-S87 PolarHBondContact N-O 2.83Å; C82-L89 HydrophobicContact CB-CD1 4.5Å; C82-L89 HydrophobicContact CB-CD2 4.11Å; C82-L89 HydrophobicContact CB-CG 4.47Å; C82-L100 CarbonylContact C-O 3.53Å; C82-L100 WeakPolarHBondContact CA-O 3.33Å; C82-C102 HydrophobicContact CB-CB 4.19Å; C82-C102 PolarHBondContact SG-N 3.01Å; C82-D105 PolarHBondContact SG-OD2 3.2Å
83A94.8Very high92.3Very high45 Ų4557 Ų5737%0.37234%0.338SS..THydrogen-bonded Turntrans-62.9-12.4175.800000114.7K81 L99 L100 Y101K81-A83 PolarHBondContact O-N 2.85Å; A83-L99 HydrophobicContact CB-CB 4.08Å; A83-L99 HydrophobicContact CB-CD1 4.31Å; A83-L99 HydrophobicContact CB-CD2 4.33Å; A83-L99 HydrophobicContact CB-CG 4.48Å; A83-L100 PolarHBondContact N-O 2.86Å; A83-Y101 HydrophobicContact CB-CE1 4.26Å
84V95.3Very high92.4Very high73 Ų7353 Ų5344%0.44232%0.323SS..THydrogen-bonded Turntrans-106.9-62.2-175.8-178.10000111.1C82 Y101 D105 L109C82-V84 PolarHBondContact O-N 3.48Å; C82-V84 PolarHBondContact SG-N 2.84Å; C82-V84 VanDerWaalsContact SG-N 3.43Å; V84-Y101 HydrophobicContact CG2-CD1 3.82Å; V84-Y101 HydrophobicContact CG2-CE1 3.78Å; V84-D105 HydrophobicContact CB-CB 3.94Å; V84-D105 HydrophobicContact CG1-CB 4.17Å; V84-D105 HydrophobicContact CG2-CB 4.13Å; V84-L109 HydrophobicContact CG2-CD1 3.6Å
85C95.3Very high92.4Very high55 Ų5554 Ų5437%0.37233%0.33SS..THydrogen-bonded Turntrans-91.40.2-178.668.80000114.6C82 S87 D105C82-C85 WeakPolarHBondContact CB-SG 3.4Å; C85-S87 PolarHBondContact O-N 3.07Å; C85-S87 PolarHBondContact O-OG 2.86Å; C85-D105 WeakPolarHBondContact CB-OD2 3.44Å; C85-D105 PolarHBondContact SG-OD2 3.04Å
86L94.4Very high92.2Very high121 Ų12156.7 Ų56.763%0.63434%0.34SS*.  trans55.66.5-179.4-56.3178.2000115.9C82C82-L86 WeakPolarHBondContact O-CA 3.24Å; C82-L86 PolarHBondContact O-N 3.42Å
87S94.4Very high92Very high67 Ų6761.1 Ų61.147%0.46937%0.365SS..  trans-70.6140177.8-61.80000110.7K81 C82 C85K81-S87 CarbonylContact C-O 3.52Å; K81-S87 VanDerWaalsContact CA-O 3.29Å; K81-S87 WeakPolarHBondContact CA-O 3.46Å; C82-S87 PolarHBondContact N-O 2.83Å; C85-S87 PolarHBondContact O-N 3.07Å; C85-S87 PolarHBondContact O-OG 2.86Å
88A93.1Very high91.8Very high78 Ų7863.8 Ų63.865%0.64537%0.369SS*.BIsolated β-bridgetrans-59.1137.7173.900000110.7V80V80-A88 WeakPolarHBondContact O-CA 3.44Å
89L92.7Very high91.8Very high15 Ų1562.4 Ų62.48%0.07936%0.357CS..  trans-102.9111.3-175.6-61.8169.3000109.9V80 C82 C93 L100 C102V80-L89 HydrophobicContact CG1-CB 3.91Å; V80-L89 WeakPolarHBondContact CG1-O 3.19Å; V80-L89 PolarHBondContact O-N 3.36Å; C82-L89 HydrophobicContact CB-CD1 4.5Å; C82-L89 HydrophobicContact CB-CD2 4.11Å; C82-L89 HydrophobicContact CB-CG 4.47Å; L89-C93 HydrophobicContact CB-CB 4.28Å; L89-C93 HydrophobicContact CD1-CB 3.84Å; L89-L100 HydrophobicContact CD1-CB 3.63Å; L89-C102 HydrophobicContact CD2-CB 3.51Å
90T85.6Confident91.8Very high124 Ų12461.8 Ų61.876%0.76135%0.353SS*.  trans-107.5140.1-179.654.70000111.4T92T90-T92 VanDerWaalsContact C-N 3.31Å; T90-T92 PolarHBondContact O-N 3.11Å
91G83.4Confident91.8Very high47 Ų4762.6 Ų62.649%0.48536%0.356SS..SBendtrans75-69.1177.400000114.5S33 C34S33-G91 WeakPolarHBondContact CA-O 3.2Å; C34-G91 PolarHBondContact N-O 3.12Å
92T88.3Confident91.8Very high71 Ų7159 Ų5944%0.43634%0.343SS..EExtended strand (participates in β ladder)trans-134.3148.8-178.158.40000112.9Q32 T90Q32-T92 VanDerWaalsContact O-CA 3.31Å; Q32-T92 WeakPolarHBondContact O-CA 3.34Å; T90-T92 VanDerWaalsContact C-N 3.31Å; T90-T92 PolarHBondContact O-N 3.11Å
93C92.3Very high91.6Very high0 Ų064.9 Ų64.90%037%0.369CS..EExtended strand (participates in β ladder)trans-144.1170.3173.865.40000112Q32 C34 V70 L89Q32-C93 PolarHBondContact N-O 2.85Å; Q32-C93 PolarHBondContact O-N 3.02Å; C34-C93 VanDerWaalsContact SG-SG 3.61Å; V70-C93 VanDerWaalsContact CG1-SG 3.5Å; L89-C93 HydrophobicContact CB-CB 4.28Å; L89-C93 HydrophobicContact CD1-CB 3.84Å
94Y92.9Very high91.4Very high25 Ų2569 Ų6910%0.09838%0.38CS..EExtended strand (participates in β ladder)trans-108.3125.7170.6-67.3-94.1000108.9Q31 Y101 K103 Y106Q31-Y94 HydrophobicContact CB-CE1 4.19Å; Q31-Y94 PolarHBondContact NE2-OH 3.32Å; Y94-Y101 PolarHBondContact N-O 2.84Å; Y94-Y101 PolarHBondContact O-N 3.05Å; Y94-K103 HydrophobicContact CE2-CB 3.88Å; Y94-K103 HydrophobicContact CE2-CG 4.02Å; Y94-Y106 AromaticContact CD1-CD1 3.43Å; Y94-Y106 HydrophobicContact CD1-CD1 3.43Å; Y94-Y106 VanDerWaalsContact CD1-CD1 3.43Å; Y94-Y106 HydrophobicContact CD1-CD2 4.28Å; Y94-Y106 AromaticContact CD1-CE1 3.48Å; Y94-Y106 HydrophobicContact CD1-CE1 3.48Å; Y94-Y106 VanDerWaalsContact CD1-CE1 3.48Å; Y94-Y106 HydrophobicContact CD1-CE2 4.33Å; Y94-Y106 AromaticContact CD1-CG 3.86Å; Y94-Y106 HydrophobicContact CD1-CG 3.86Å; Y94-Y106 AromaticContact CD1-CZ 3.95Å; Y94-Y106 HydrophobicContact CD2-CD1 4.14Å; Y94-Y106 HydrophobicContact CD2-CG 4.03Å; Y94-Y106 AromaticContact CE1-CD1 3.85Å; Y94-Y106 HydrophobicContact CE1-CD1 3.85Å; Y94-Y106 AromaticContact CE1-CE1 3.93Å; Y94-Y106 HydrophobicContact CE1-CE1 3.93Å; Y94-Y106 AromaticContact CG-CD1 3.59Å; Y94-Y106 HydrophobicContact CG-CD1 3.59Å; Y94-Y106 AromaticContact CG-CD2 3.92Å; Y94-Y106 HydrophobicContact CG-CD2 3.92Å; Y94-Y106 HydrophobicContact CG-CE1 4.05Å; Y94-Y106 HydrophobicContact CG-CE2 4.36Å; Y94-Y106 AromaticContact CG-CG 3.52Å; Y94-Y106 HydrophobicContact CG-CG 3.52Å
95C91.6Very high91.3Very high23 Ų2366 Ų6616%0.15536%0.361CS..EExtended strand (participates in β ladder)trans-101.3127.8174.8-169.90000109.8N71 L99 L100N71-C95 HydrophobicContact CB-CB 4.14Å; N71-C95 PolarHBondContact ND2-SG 3.18Å; C95-L99 WeakPolarHBondContact CA-O 3.34Å; C95-L100 HydrophobicContact CB-CD2 3.95Å
96R90Very high91.2Very high69 Ų6964.7 Ų64.726%0.2635%0.349SS..EExtended strand (participates in β ladder)trans-147.8133.4175.6-165.9-165.9169.390.79.2109.8R98 L99 Y101 Y106R96-R98 PolarHBondContact O-N 3.43Å; R96-R98 VanDerWaalsContact O-N 3.13Å; R96-L99 PolarHBondContact N-O 2.91Å; R96-L99 WeakPolarHBondContact O-CA 3.42Å; R96-L99 PolarHBondContact O-N 3.26Å; R96-L99 VanDerWaalsContact O-O 3.14Å; R96-Y101 HydrophobicContact CB-CD2 4.28Å; R96-Y101 HydrophobicContact CB-CE2 3.91Å; R96-Y106 HydrophobicContact CB-CE2 4.2Å
97D88.6Confident91Very high115 Ų11561.5 Ų61.562%0.61533%0.33SS*.THydrogen-bonded Turntrans5435.7176.9-52.4-41.1000113.1L99D97-L99 PolarHBondContact O-N 2.82Å
98R86.8Confident90.6Very high179 Ų17965.4 Ų65.468%0.67534%0.339SS*.THydrogen-bonded Turntrans66.52.3-172.1-56.8-177.6-71.2-106.72.8116.2R96R96-R98 PolarHBondContact O-N 3.43Å; R96-R98 VanDerWaalsContact O-N 3.13Å
99L91.6Very high90.3Very high85 Ų8566.3 Ų66.345%0.44533%0.332SS..EExtended strand (participates in β ladder)trans-96.9147175.5-62.6175.7000111.4A83 C95 R96 D97 Y101A83-L99 HydrophobicContact CB-CB 4.08Å; A83-L99 HydrophobicContact CB-CD1 4.31Å; A83-L99 HydrophobicContact CB-CD2 4.33Å; A83-L99 HydrophobicContact CB-CG 4.48Å; C95-L99 WeakPolarHBondContact CA-O 3.34Å; R96-L99 PolarHBondContact N-O 2.91Å; R96-L99 WeakPolarHBondContact O-CA 3.42Å; R96-L99 PolarHBondContact O-N 3.26Å; R96-L99 VanDerWaalsContact O-O 3.14Å; D97-L99 PolarHBondContact O-N 2.82Å; L99-Y101 HydrophobicContact CB-CE2 3.67Å; L99-Y101 WeakPolarHBondContact CD1-OH 3.37Å
100L93.4Very high90Very high4 Ų468.8 Ų68.82%0.02134%0.343CS..EExtended strand (participates in β ladder)trans-98.6138.7176.4-56.4-177000110.8V70 W75 V80 C82 A83 L89 C95V70-L100 HydrophobicContact CG1-CD2 3.75Å; W75-L100 HydrophobicContact CD2-CD1 4.08Å; W75-L100 HydrophobicContact CE3-CD1 4.07Å; W75-L100 HydrophobicContact CH2-CD1 3.97Å; W75-L100 HydrophobicContact CH2-CD2 4.46Å; W75-L100 HydrophobicContact CH2-CG 3.85Å; W75-L100 HydrophobicContact CZ2-CD1 3.94Å; W75-L100 HydrophobicContact CZ2-CD2 4.1Å; W75-L100 HydrophobicContact CZ2-CG 3.93Å; W75-L100 HydrophobicContact CZ3-CD1 4.01Å; W75-L100 HydrophobicContact CZ3-CG 4.29Å; V80-L100 HydrophobicContact CG1-CD1 4.21Å; C82-L100 CarbonylContact C-O 3.53Å; C82-L100 WeakPolarHBondContact CA-O 3.33Å; A83-L100 PolarHBondContact N-O 2.86Å; L89-L100 HydrophobicContact CD1-CB 3.63Å; C95-L100 HydrophobicContact CB-CD2 3.95Å
101Y94Very high90.2Very high19 Ų1964.8 Ų64.88%0.07532%0.316CS..EExtended strand (participates in β ladder)trans-129142.5-178.5-60-91.3000111.3A83 V84 Y94 R96 L99 Y106 L109 F110A83-Y101 HydrophobicContact CB-CE1 4.26Å; V84-Y101 HydrophobicContact CG2-CD1 3.82Å; V84-Y101 HydrophobicContact CG2-CE1 3.78Å; Y94-Y101 PolarHBondContact N-O 2.84Å; Y94-Y101 PolarHBondContact O-N 3.05Å; R96-Y101 HydrophobicContact CB-CD2 4.28Å; R96-Y101 HydrophobicContact CB-CE2 3.91Å; L99-Y101 HydrophobicContact CB-CE2 3.67Å; L99-Y101 WeakPolarHBondContact CD1-OH 3.37Å; Y101-Y106 HydrophobicContact CD2-CD2 4.28Å; Y101-Y106 HydrophobicContact CG-CD2 4.29Å; Y101-L109 HydrophobicContact CE1-CD1 4.39Å; Y101-F110 AromaticContact CD1-CE2 3.92Å; Y101-F110 HydrophobicContact CD1-CE2 3.92Å; Y101-F110 HydrophobicContact CD2-CE2 4.17Å; Y101-F110 AromaticContact CE1-CE2 3.73Å; Y101-F110 HydrophobicContact CE1-CE2 3.73Å; Y101-F110 AromaticContact CE1-CZ 3.89Å; Y101-F110 HydrophobicContact CE1-CZ 3.89Å; Y101-F110 AromaticContact CE2-CE2 4Å; Y101-F110 HydrophobicContact CE2-CE2 4Å; Y101-F110 HydrophobicContact CE2-CZ 4.18Å; Y101-F110 HydrophobicContact CG-CE2 4.14Å; Y101-F110 AromaticContact CZ-CE2 3.77Å; Y101-F110 AromaticContact CZ-CZ 3.69Å
102C93.5Very high90.4Very high25 Ų2568.5 Ų68.517%0.16932%0.316CS..  trans-72158.1165.7850000109.6C82 L89 H104 D105 Y106C82-C102 HydrophobicContact CB-CB 4.19Å; C82-C102 PolarHBondContact SG-N 3.01Å; L89-C102 HydrophobicContact CD2-CB 3.51Å; C102-H104 VanDerWaalsContact C-N 3.26Å; C102-H104 PolarHBondContact O-N 2.91Å; C102-D105 PolarHBondContact O-N 3.36Å; C102-D105 PolarHBondContact SG-N 2.77Å; C102-D105 PolarHBondContact SG-OD2 2.86Å; C102-Y106 VanDerWaalsContact O-CB 3.31Å; C102-Y106 WeakPolarHBondContact O-CB 3.49Å; C102-Y106 PolarHBondContact O-N 3.41Å
103K91.4Very high90.6Very high123 Ų12368.9 Ų68.954%0.53531%0.311SS..Hα-helixtrans-53-43178.2-178.6173.6176.11750112.8Y94 E107Y94-K103 HydrophobicContact CE2-CB 3.88Å; Y94-K103 HydrophobicContact CE2-CG 4.02Å; K103-E107 WeakPolarHBondContact CE-OE1 3.47Å; K103-E107 HydrophobicContact CG-CG 4.43Å; K103-E107 WeakPolarHBondContact CG-OE1 3.36Å; K103-E107 IonicContact NZ-OE1 2.69Å; K103-E107 WeakPolarHBondContact O-CB 3.31Å; K103-E107 WeakPolarHBondContact O-CG 3.32Å; K103-E107 PolarHBondContact O-N 3.45Å
104H91.7Very high90.6Very high131 Ų13169 Ų6961%0.60631%0.312SS*.Hα-helixtrans-62.3-52.1-178.1-178.584.6000112.3C102 E107 K108C102-H104 VanDerWaalsContact C-N 3.26Å; C102-H104 PolarHBondContact O-N 2.91Å; H104-E107 PolarHBondContact O-N 2.89Å; H104-K108 VanDerWaalsContact O-CB 3.28Å; H104-K108 WeakPolarHBondContact O-CB 3.48Å; H104-K108 PolarHBondContact O-N 3.15Å
105D93.1Very high90.6Very high11 Ų1169.6 Ų69.66%0.05932%0.32CS..Hα-helixtrans-70.3-36.7-178.2-63.8-45.7000111.6C82 V84 C85 C102 K108 L109C82-D105 PolarHBondContact SG-OD2 3.2Å; V84-D105 HydrophobicContact CB-CB 3.94Å; V84-D105 HydrophobicContact CG1-CB 4.17Å; V84-D105 HydrophobicContact CG2-CB 4.13Å; C85-D105 WeakPolarHBondContact CB-OD2 3.44Å; C85-D105 PolarHBondContact SG-OD2 3.04Å; C102-D105 PolarHBondContact O-N 3.36Å; C102-D105 PolarHBondContact SG-N 2.77Å; C102-D105 PolarHBondContact SG-OD2 2.86Å; D105-K108 PolarHBondContact O-N 2.92Å; D105-L109 WeakPolarHBondContact O-CB 3.32Å; D105-L109 VanDerWaalsContact O-CG 3.32Å; D105-L109 WeakPolarHBondContact O-CG 3.23Å; D105-L109 PolarHBondContact O-N 2.85Å
106Y92.1Very high90.6Very high27 Ų2771.3 Ų71.311%0.10634%0.336CS..Hα-helixtrans-62.3-47.9175.2-171-95.1000111.8Y94 R96 Y101 C102 K108 L109 F110 I111Y94-Y106 AromaticContact CD1-CD1 3.43Å; Y94-Y106 HydrophobicContact CD1-CD1 3.43Å; Y94-Y106 VanDerWaalsContact CD1-CD1 3.43Å; Y94-Y106 HydrophobicContact CD1-CD2 4.28Å; Y94-Y106 AromaticContact CD1-CE1 3.48Å; Y94-Y106 HydrophobicContact CD1-CE1 3.48Å; Y94-Y106 VanDerWaalsContact CD1-CE1 3.48Å; Y94-Y106 HydrophobicContact CD1-CE2 4.33Å; Y94-Y106 AromaticContact CD1-CG 3.86Å; Y94-Y106 HydrophobicContact CD1-CG 3.86Å; Y94-Y106 AromaticContact CD1-CZ 3.95Å; Y94-Y106 HydrophobicContact CD2-CD1 4.14Å; Y94-Y106 HydrophobicContact CD2-CG 4.03Å; Y94-Y106 AromaticContact CE1-CD1 3.85Å; Y94-Y106 HydrophobicContact CE1-CD1 3.85Å; Y94-Y106 AromaticContact CE1-CE1 3.93Å; Y94-Y106 HydrophobicContact CE1-CE1 3.93Å; Y94-Y106 AromaticContact CG-CD1 3.59Å; Y94-Y106 HydrophobicContact CG-CD1 3.59Å; Y94-Y106 AromaticContact CG-CD2 3.92Å; Y94-Y106 HydrophobicContact CG-CD2 3.92Å; Y94-Y106 HydrophobicContact CG-CE1 4.05Å; Y94-Y106 HydrophobicContact CG-CE2 4.36Å; Y94-Y106 AromaticContact CG-CG 3.52Å; Y94-Y106 HydrophobicContact CG-CG 3.52Å; R96-Y106 HydrophobicContact CB-CE2 4.2Å; Y101-Y106 HydrophobicContact CD2-CD2 4.28Å; Y101-Y106 HydrophobicContact CG-CD2 4.29Å; C102-Y106 VanDerWaalsContact O-CB 3.31Å; C102-Y106 WeakPolarHBondContact O-CB 3.49Å; C102-Y106 PolarHBondContact O-N 3.41Å; Y106-K108 VanDerWaalsContact C-N 3.29Å; Y106-K108 PolarHBondContact O-N 3.43Å; Y106-L109 PolarHBondContact O-N 3.14Å; Y106-F110 AromaticContact CD2-CD2 3.37Å; Y106-F110 HydrophobicContact CD2-CD2 3.37Å; Y106-F110 AromaticContact CD2-CE2 3.86Å; Y106-F110 HydrophobicContact CD2-CE2 3.86Å; Y106-F110 HydrophobicContact CD2-CG 4.37Å; Y106-F110 HydrophobicContact CE2-CB 4.37Å; Y106-F110 AromaticContact CE2-CD2 3.58Å; Y106-F110 HydrophobicContact CE2-CD2 3.58Å; Y106-F110 HydrophobicContact CE2-CE2 4.21Å; Y106-F110 HydrophobicContact CE2-CG 4.21Å; Y106-F110 AromaticContact CG-CD2 3.99Å; Y106-F110 HydrophobicContact CG-CD2 3.99Å; Y106-F110 PolarHBondContact O-N 3.43Å; Y106-I111 HydrophobicContact CD1-CD1 4.05Å; Y106-I111 HydrophobicContact CD1-CG1 4.39Å; Y106-I111 HydrophobicContact CE1-CD1 4.03Å; Y106-I111 HydrophobicContact CE1-CG1 4.24Å
107E89.6Confident90.8Very high53 Ų5370.3 Ų70.325%0.24834%0.339CS..Hα-helixtrans-61-37.1174.8-79.1-173.4-148.800112.5K103 H104 I111 K113K103-E107 WeakPolarHBondContact CE-OE1 3.47Å; K103-E107 HydrophobicContact CG-CG 4.43Å; K103-E107 WeakPolarHBondContact CG-OE1 3.36Å; K103-E107 IonicContact NZ-OE1 2.69Å; K103-E107 WeakPolarHBondContact O-CB 3.31Å; K103-E107 WeakPolarHBondContact O-CG 3.32Å; K103-E107 PolarHBondContact O-N 3.45Å; H104-E107 PolarHBondContact O-N 2.89Å; E107-I111 HydrophobicContact CG-CD1 3.98Å; E107-I111 WeakPolarHBondContact O-CB 3.47Å; E107-I111 PolarHBondContact O-N 3.04Å; E107-K113 IonicContact OE2-NZ 3.8Å; E107-K113 PolarHBondContact OE2-NZ 3.2Å
108K86.3Confident90.9Very high149 Ų14970.8 Ų70.865%0.64834%0.341SS*.Hα-helixtrans-73.5-38-177.8-177.3-178.5175.9-172.80112.9H104 D105 Y106H104-K108 VanDerWaalsContact O-CB 3.28Å; H104-K108 WeakPolarHBondContact O-CB 3.48Å; H104-K108 PolarHBondContact O-N 3.15Å; D105-K108 PolarHBondContact O-N 2.92Å; Y106-K108 VanDerWaalsContact C-N 3.29Å; Y106-K108 PolarHBondContact O-N 3.43Å
109L87.2Confident91.1Very high97 Ų9768.3 Ų68.351%0.50834%0.337SS..Hα-helixtrans-90.2-41.4-174.1-67.1176.2000113.2V84 Y101 D105 Y106V84-L109 HydrophobicContact CG2-CD1 3.6Å; Y101-L109 HydrophobicContact CE1-CD1 4.39Å; D105-L109 WeakPolarHBondContact O-CB 3.32Å; D105-L109 VanDerWaalsContact O-CG 3.32Å; D105-L109 WeakPolarHBondContact O-CG 3.23Å; D105-L109 PolarHBondContact O-N 2.85Å; Y106-L109 PolarHBondContact O-N 3.14Å
110F86.9Confident91Very high68 Ų6868.1 Ų68.130%0.29834%0.339SS..Hα-helixtrans-110.4-20.8-167.6-52.8-66.8000114.1Y101 Y106Y101-F110 AromaticContact CD1-CE2 3.92Å; Y101-F110 HydrophobicContact CD1-CE2 3.92Å; Y101-F110 HydrophobicContact CD2-CE2 4.17Å; Y101-F110 AromaticContact CE1-CE2 3.73Å; Y101-F110 HydrophobicContact CE1-CE2 3.73Å; Y101-F110 AromaticContact CE1-CZ 3.89Å; Y101-F110 HydrophobicContact CE1-CZ 3.89Å; Y101-F110 AromaticContact CE2-CE2 4Å; Y101-F110 HydrophobicContact CE2-CE2 4Å; Y101-F110 HydrophobicContact CE2-CZ 4.18Å; Y101-F110 HydrophobicContact CG-CE2 4.14Å; Y101-F110 AromaticContact CZ-CE2 3.77Å; Y101-F110 AromaticContact CZ-CZ 3.69Å; Y106-F110 AromaticContact CD2-CD2 3.37Å; Y106-F110 HydrophobicContact CD2-CD2 3.37Å; Y106-F110 AromaticContact CD2-CE2 3.86Å; Y106-F110 HydrophobicContact CD2-CE2 3.86Å; Y106-F110 HydrophobicContact CD2-CG 4.37Å; Y106-F110 HydrophobicContact CE2-CB 4.37Å; Y106-F110 AromaticContact CE2-CD2 3.58Å; Y106-F110 HydrophobicContact CE2-CD2 3.58Å; Y106-F110 HydrophobicContact CE2-CE2 4.21Å; Y106-F110 HydrophobicContact CE2-CG 4.21Å; Y106-F110 AromaticContact CG-CD2 3.99Å; Y106-F110 HydrophobicContact CG-CD2 3.99Å; Y106-F110 PolarHBondContact O-N 3.43Å
111I88.8Confident91Very high39 Ų3968.9 Ų68.920%0.234%0.343CS..  trans-97.2111.8-175.5-62.6-175.8000110.7Y106 E107 K113 V120Y106-I111 HydrophobicContact CD1-CD1 4.05Å; Y106-I111 HydrophobicContact CD1-CG1 4.39Å; Y106-I111 HydrophobicContact CE1-CD1 4.03Å; Y106-I111 HydrophobicContact CE1-CG1 4.24Å; E107-I111 HydrophobicContact CG-CD1 3.98Å; E107-I111 WeakPolarHBondContact O-CB 3.47Å; E107-I111 PolarHBondContact O-N 3.04Å; I111-K113 HydrophobicContact CG2-CG 4.08Å; I111-K113 PolarHBondContact O-N 2.8Å; I111-V120 HydrophobicContact CG2-CB 4.12Å; I111-V120 HydrophobicContact CG2-CG1 3.65Å; I111-V120 HydrophobicContact CG2-CG2 3.51Å
112R88.8Confident90.6Very high125 Ų12569.4 Ų69.447%0.47235%0.354SS..  trans-78.3119.2172.2-62.3-60.3-62.3-157.22.6109.5I121 G132 V134R112-I121 HydrophobicContact CB-CD1 4.49Å; R112-I121 PolarHBondContact O-N 3.41Å; R112-G132 PolarHBondContact NH2-O 3.42Å; R112-V134 VanDerWaalsContact NH2-CG1 3.32Å
113K91.7Very high90Very high80 Ų8075.9 Ų75.935%0.34838%0.375SS..BIsolated β-bridgetrans-108.1138.9177.5-60.3-178.4-176.5-1790110.7E107 I111 S115 Q119 V134E107-K113 IonicContact OE2-NZ 3.8Å; E107-K113 PolarHBondContact OE2-NZ 3.2Å; I111-K113 HydrophobicContact CG2-CG 4.08Å; I111-K113 PolarHBondContact O-N 2.8Å; K113-S115 PolarHBondContact O-N 2.92Å; K113-Q119 CarbonylContact C-O 3.55Å; K113-Q119 VanDerWaalsContact CA-O 3.29Å; K113-Q119 WeakPolarHBondContact CA-O 3.47Å; K113-V134 WeakPolarHBondContact O-CG2 3.44Å
114C93.6Very high89.6Confident1 Ų175.9 Ų75.91%0.00739%0.39CS..  trans-63.9128.8177.3168.70000110.8A116 C117 L118 Q119 I121 V134 H136C114-A116 PolarHBondContact O-N 3.05Å; C114-A116 PolarHBondContact SG-N 3.43Å; C114-C117 VanDerWaalsContact SG-SG 3.66Å; C114-L118 WeakPolarHBondContact O-CA 3.36Å; C114-L118 PolarHBondContact O-N 2.89Å; C114-Q119 PolarHBondContact N-O 3.06Å; C114-I121 HydrophobicContact CB-CD1 4.23Å; C114-I121 HydrophobicContact CB-CG1 4.11Å; C114-V134 CarbonylContact C-O 3.52Å; C114-V134 WeakPolarHBondContact CA-O 3.22Å; C114-H136 WeakPolarHBondContact CB-CE1 3.36Å; C114-H136 WeakPolarHBondContact CB-ND1 3.27Å
115S92.3Very high89.6Confident38 Ų3874.3 Ų74.327%0.26638%0.383SS..THydrogen-bonded Turntrans-71-10.3-175.6-57.40000114.4K113 Q133 V134K113-S115 PolarHBondContact O-N 2.92Å; S115-Q133 PolarHBondContact OG-NE2 3.44Å; S115-V134 PolarHBondContact N-O 3.32Å; S115-V134 PolarHBondContact OG-O 2.93Å
116A92.1Very high89.6Confident59 Ų5980 Ų8049%0.48841%0.413SS..THydrogen-bonded Turntrans-99-51.5175.200000113.4C114 Y135 C139C114-A116 PolarHBondContact O-N 3.05Å; C114-A116 PolarHBondContact SG-N 3.43Å; A116-Y135 HydrophobicContact CB-CD1 3.75Å; A116-Y135 HydrophobicContact CB-CE1 4.02Å; A116-C139 HydrophobicContact CB-CB 3.89Å
117C92.8Very high89.7Confident48 Ų4881 Ų8132%0.32442%0.419SS..THydrogen-bonded Turntrans-98.9-5.9-177.571.30000114.8C114 Q119 H136C114-C117 VanDerWaalsContact SG-SG 3.66Å; C117-Q119 PolarHBondContact O-N 3.09Å; C117-H136 PolarHBondContact SG-CE1 3.33Å; C117-H136 PolarHBondContact SG-ND1 2.94Å
118L90.6Very high89.9Confident125 Ų12580 Ų8065%0.65442%0.416SS*.  trans60.84.1-178.7-53178.7000116.2C114C114-L118 WeakPolarHBondContact O-CA 3.36Å; C114-L118 PolarHBondContact O-N 2.89Å
119Q91.6Very high90.2Very high128 Ų12881 Ų8160%0.59842%0.415SS*.PPolyproline II helixtrans-73.6155.8173.5-57.9-53.3-36.800111.7K113 C114 C117K113-Q119 CarbonylContact C-O 3.55Å; K113-Q119 VanDerWaalsContact CA-O 3.29Å; K113-Q119 WeakPolarHBondContact CA-O 3.47Å; C114-Q119 PolarHBondContact N-O 3.06Å; C117-Q119 PolarHBondContact O-N 3.09Å
120V90.5Very high90.4Very high81 Ų8177.4 Ų77.449%0.49140%0.397SS..BIsolated β-bridgetrans-65.6134.2173.81790000109.6I111I111-V120 HydrophobicContact CG2-CB 4.12Å; I111-V120 HydrophobicContact CG2-CG1 3.65Å; I111-V120 HydrophobicContact CG2-CG2 3.51Å
121I91.6Very high90.5Very high20 Ų2081.2 Ų81.210%0.10342%0.42CS..PPolyproline II helixtrans-84.5126.9173.9-67.2161.7000108.5R112 C114 E125 I127 V134 H136R112-I121 HydrophobicContact CB-CD1 4.49Å; R112-I121 PolarHBondContact O-N 3.41Å; C114-I121 HydrophobicContact CB-CD1 4.23Å; C114-I121 HydrophobicContact CB-CG1 4.11Å; I121-E125 HydrophobicContact CG2-CB 4.42Å; I121-I127 HydrophobicContact CD1-CG2 4.14Å; I121-I127 HydrophobicContact CG1-CG2 4.32Å; I121-I127 HydrophobicContact CG2-CG2 3.45Å; I121-I127 VanDerWaalsContact CG2-CG2 3.45Å; I121-V134 HydrophobicContact CD1-CB 3.71Å; I121-V134 HydrophobicContact CD1-CG2 3.49Å; I121-V134 VanDerWaalsContact CD1-CG2 3.49Å; I121-H136 WeakPolarHBondContact CG1-NE2 3.42Å
122G86.7Confident90.4Very high30 Ų3082.2 Ų82.231%0.30944%0.44SS..PPolyproline II helixtrans-67.6150.9175.200000112.9S124 E125G122-S124 VanDerWaalsContact C-N 3.28Å; G122-S124 PolarHBondContact O-N 3.46Å; G122-E125 PolarHBondContact N-OE2 2.93Å; G122-E125 WeakPolarHBondContact O-CB 3.2Å; G122-E125 PolarHBondContact O-N 3.49Å; G122-E125 VanDerWaalsContact O-N 3.09Å
123R79.8Confident90.4Very high160 Ų16080.5 Ų80.560%0.60444%0.437SS*.THydrogen-bonded Turntrans-65-30-172.6-58.7178.3-156.2144.27.4114T27 E29T27-R123 VanDerWaalsContact CB-CZ 3.48Å; T27-R123 VanDerWaalsContact CB-NH1 3.29Å; T27-R123 PolarHBondContact O-NH1 2.95Å; T27-R123 PolarHBondContact O-NH2 3.31Å; T27-R123 PolarHBondContact OG1-NH1 3.39Å; E29-R123 IonicContact OE2-NH2 2.64Å
124S84.1Confident90.5Very high123 Ų12376.8 Ų76.886%0.8642%0.421SS*.THydrogen-bonded Turntrans-101.53.7177.2-50.10000112.8G122G122-S124 VanDerWaalsContact C-N 3.28Å; G122-S124 PolarHBondContact O-N 3.46Å
125E92.1Very high90.5Very high99 Ų9977 Ų7746%0.46342%0.422SS..  trans-78.3132.3179.6-67.9-175.2158.600111I121 G122 H136I121-E125 HydrophobicContact CG2-CB 4.42Å; G122-E125 PolarHBondContact N-OE2 2.93Å; G122-E125 WeakPolarHBondContact O-CB 3.2Å; G122-E125 PolarHBondContact O-N 3.49Å; G122-E125 VanDerWaalsContact O-N 3.09Å; E125-H136 IonicContact OE2-CD2 3.41Å; E125-H136 PolarHBondContact OE2-CD2 3.43Å; E125-H136 IonicContact OE2-NE2 3.83Å
126L91.8Very high90.7Very high130 Ų13076.6 Ų76.668%0.68142%0.416SS*.  trans-70138.2173.2-64177.2000110.3L137L126-L137 HydrophobicContact CB-CD1 3.6Å; L126-L137 HydrophobicContact CB-CD2 4.47Å; L126-L137 HydrophobicContact CB-CG 3.94Å; L126-L137 HydrophobicContact CD1-CD1 4.13Å
127I94.1Very high90.7Very high47 Ų4777 Ų7724%0.24141%0.41CS..EExtended strand (participates in β ladder)trans-135.9151.4-175.154.4172.6000112.7I121 R129 V134 Y135I121-I127 HydrophobicContact CD1-CG2 4.14Å; I121-I127 HydrophobicContact CG1-CG2 4.32Å; I121-I127 HydrophobicContact CG2-CG2 3.45Å; I121-I127 VanDerWaalsContact CG2-CG2 3.45Å; I127-R129 HydrophobicContact CD1-CG 4.21Å; I127-R129 HydrophobicContact CG1-CG 4.46Å; I127-V134 HydrophobicContact CD1-CG1 4.19Å; I127-Y135 CarbonylContact C-O 3.57Å; I127-Y135 VanDerWaalsContact CA-O 3.23Å; I127-Y135 WeakPolarHBondContact CA-O 3.36Å; I127-Y135 VanDerWaalsContact CB-O 3.32Å; I127-Y135 WeakPolarHBondContact CB-O 3.42Å
128M94.1Very high90.7Very high34 Ų3476.9 Ų76.917%0.16742%0.416CS..EExtended strand (participates in β ladder)trans-90.9139.3164.1-62.6-61.7-81.600109.4V134 Y135 L137 F140M128-V134 WeakPolarHBondContact O-CA 3.32Å; M128-Y135 PolarHBondContact N-O 3.47Å; M128-Y135 PolarHBondContact O-N 3.02Å; M128-L137 HydrophobicContact CG-CD2 3.84Å; M128-L137 HydrophobicContact SD-CD2 3.94Å; M128-F140 HydrophobicContact CB-CB 3.96Å; M128-F140 HydrophobicContact CB-CD1 3.93Å; M128-F140 HydrophobicContact CB-CD2 3.63Å; M128-F140 HydrophobicContact CB-CE1 4.36Å; M128-F140 HydrophobicContact CB-CE2 4.1Å; M128-F140 HydrophobicContact CB-CG 3.55Å; M128-F140 HydrophobicContact CB-CZ 4.46Å; M128-F140 HydrophobicContact CE-CD1 3.66Å; M128-F140 HydrophobicContact CE-CE1 3.52Å; M128-F140 HydrophobicContact CE-CG 4.5Å; M128-F140 HydrophobicContact CE-CZ 4.27Å; M128-F140 HydrophobicContact CG-CB 3.72Å; M128-F140 HydrophobicContact CG-CD1 3.58Å; M128-F140 HydrophobicContact CG-CD2 4.17Å; M128-F140 HydrophobicContact CG-CE1 4.25Å; M128-F140 HydrophobicContact CG-CG 3.54Å; M128-F140 HydrophobicContact SD-CD1 4.47Å
129R93.4Very high91Very high169 Ų16972.6 Ų72.664%0.63840%0.396SS*.EExtended strand (participates in β ladder)trans-123.1126.4176.8-62.4-165.6173.1-124.34.1109.5I127 Q133 V134I127-R129 HydrophobicContact CD1-CG 4.21Å; I127-R129 HydrophobicContact CG1-CG 4.46Å; R129-Q133 WeakPolarHBondContact CA-O 3.33Å; R129-V134 HydrophobicContact CG-CG1 4.16Å
130V91.3Very high91.2Very high22 Ų2266.5 Ų66.513%0.13337%0.367CS..EExtended strand (participates in β ladder)trans-144.6125-179.6179.10000108.6G132 Q133 F140 F155 L157V130-G132 VanDerWaalsContact C-N 3.26Å; V130-G132 PolarHBondContact O-N 3.42Å; V130-G132 VanDerWaalsContact O-N 3.13Å; V130-Q133 PolarHBondContact N-O 3.24Å; V130-Q133 WeakPolarHBondContact O-CA 3.16Å; V130-Q133 WeakPolarHBondContact O-CB 3.36Å; V130-Q133 PolarHBondContact O-N 2.85Å; V130-F140 HydrophobicContact CB-CE2 4.49Å; V130-F140 HydrophobicContact CG2-CE2 3.51Å; V130-F140 HydrophobicContact CG2-CZ 3.61Å; V130-F155 HydrophobicContact CB-CZ 4.43Å; V130-F155 HydrophobicContact CG1-CE2 3.84Å; V130-F155 HydrophobicContact CG1-CZ 3.89Å; V130-F155 HydrophobicContact CG2-CE2 4.06Å; V130-F155 HydrophobicContact CG2-CZ 3.61Å; V130-L157 HydrophobicContact CG1-CD2 4.11Å
131L88.6Confident91.5Very high147 Ų14764.2 Ų64.277%0.7736%0.355SS*.THydrogen-bonded Turntrans46.346.1174.8-59.9176.5000113.5Q133 L157L131-Q133 PolarHBondContact O-N 3.17Å; L131-L157 HydrophobicContact CB-CD2 4.36Å; L131-L157 HydrophobicContact CD1-CD2 4.19Å
132G86.1Confident91.7Very high60 Ų6063.3 Ų63.362%0.61935%0.351SS*.THydrogen-bonded Turntrans80.9-20.1-178.100000115.8R112 V130R112-G132 PolarHBondContact NH2-O 3.42Å; V130-G132 VanDerWaalsContact C-N 3.26Å; V130-G132 PolarHBondContact O-N 3.42Å; V130-G132 VanDerWaalsContact O-N 3.13Å
133Q90.6Very high92Very high89 Ų8964.5 Ų64.542%0.41635%0.354SS..EExtended strand (participates in β ladder)trans-78.6154.5177.2-56-45.9127.400112.4S115 R129 V130 L131 Y135S115-Q133 PolarHBondContact OG-NE2 3.44Å; R129-Q133 WeakPolarHBondContact CA-O 3.33Å; V130-Q133 PolarHBondContact N-O 3.24Å; V130-Q133 WeakPolarHBondContact O-CA 3.16Å; V130-Q133 WeakPolarHBondContact O-CB 3.36Å; V130-Q133 PolarHBondContact O-N 2.85Å; L131-Q133 PolarHBondContact O-N 3.17Å; Q133-Y135 HydrophobicContact CB-CE2 3.62Å
134V93.1Very high92.6Very high3 Ų362.1 Ų62.12%0.01835%0.349CS..EExtended strand (participates in β ladder)trans-128.5137.5-175.8-71.70000110.4R112 K113 C114 S115 I121 I127 M128 R129R112-V134 VanDerWaalsContact NH2-CG1 3.32Å; K113-V134 WeakPolarHBondContact O-CG2 3.44Å; C114-V134 CarbonylContact C-O 3.52Å; C114-V134 WeakPolarHBondContact CA-O 3.22Å; S115-V134 PolarHBondContact N-O 3.32Å; S115-V134 PolarHBondContact OG-O 2.93Å; I121-V134 HydrophobicContact CD1-CB 3.71Å; I121-V134 HydrophobicContact CD1-CG2 3.49Å; I121-V134 VanDerWaalsContact CD1-CG2 3.49Å; I127-V134 HydrophobicContact CD1-CG1 4.19Å; M128-V134 WeakPolarHBondContact O-CA 3.32Å; R129-V134 HydrophobicContact CG-CG1 4.16Å
135Y94.3Very high93.1Very high4 Ų458.4 Ų58.42%0.01632%0.323CS..EExtended strand (participates in β ladder)trans-138.7141-177.2-56.9-100.1000110.7A116 I127 M128 Q133 F140 L157 L162A116-Y135 HydrophobicContact CB-CD1 3.75Å; A116-Y135 HydrophobicContact CB-CE1 4.02Å; I127-Y135 CarbonylContact C-O 3.57Å; I127-Y135 VanDerWaalsContact CA-O 3.23Å; I127-Y135 WeakPolarHBondContact CA-O 3.36Å; I127-Y135 VanDerWaalsContact CB-O 3.32Å; I127-Y135 WeakPolarHBondContact CB-O 3.42Å; M128-Y135 PolarHBondContact N-O 3.47Å; M128-Y135 PolarHBondContact O-N 3.02Å; Q133-Y135 HydrophobicContact CB-CE2 3.62Å; Y135-F140 HydrophobicContact CD1-CD2 4.41Å; Y135-F140 AromaticContact CD2-CD2 3.78Å; Y135-F140 HydrophobicContact CD2-CD2 3.78Å; Y135-F140 HydrophobicContact CD2-CE2 4.13Å; Y135-F140 HydrophobicContact CE2-CD2 4.42Å; Y135-F140 HydrophobicContact CE2-CE2 4.44Å; Y135-F140 AromaticContact CG-CD2 3.79Å; Y135-F140 HydrophobicContact CG-CD2 3.79Å; Y135-L157 WeakPolarHBondContact OH-CD1 3.32Å; Y135-L162 HydrophobicContact CD1-CD1 4.16Å; Y135-L162 HydrophobicContact CE1-CD1 3.95Å
136H95.3Very high93.2Very high31 Ų3160.1 Ų60.114%0.14433%0.331CS..EExtended strand (participates in β ladder)trans-61.6149.8165.1-52.3114.8000109.9C114 C117 I121 E125 G138 C139 F140C114-H136 WeakPolarHBondContact CB-CE1 3.36Å; C114-H136 WeakPolarHBondContact CB-ND1 3.27Å; C117-H136 PolarHBondContact SG-CE1 3.33Å; C117-H136 PolarHBondContact SG-ND1 2.94Å; I121-H136 WeakPolarHBondContact CG1-NE2 3.42Å; E125-H136 IonicContact OE2-CD2 3.41Å; E125-H136 PolarHBondContact OE2-CD2 3.43Å; E125-H136 IonicContact OE2-NE2 3.83Å; H136-G138 PolarHBondContact O-N 3.11Å; H136-C139 HydrophobicContact CB-CB 4.3Å; H136-C139 PolarHBondContact O-N 2.89Å; H136-F140 PolarHBondContact O-N 3.25Å; H136-F140 VanDerWaalsContact O-N 3.09Å
137L93.4Very high93.3Very high68 Ų6860 Ų6036%0.35632%0.321SS..THydrogen-bonded Turntrans-55.5-26.4175.1-64.5-174.9000113.9L126 M128 R148L126-L137 HydrophobicContact CB-CD1 3.6Å; L126-L137 HydrophobicContact CB-CD2 4.47Å; L126-L137 HydrophobicContact CB-CG 3.94Å; L126-L137 HydrophobicContact CD1-CD1 4.13Å; M128-L137 HydrophobicContact CG-CD2 3.84Å; M128-L137 HydrophobicContact SD-CD2 3.94Å; L137-R148 VanDerWaalsContact C-NH2 3.31Å; L137-R148 PolarHBondContact O-NE 2.98Å; L137-R148 PolarHBondContact O-NH2 2.89Å
138G92.8Very high93.4Very high44 Ų4464.3 Ų64.345%0.45434%0.335SS..THydrogen-bonded Turntrans-81.2-25.7175.500000114.1H136H136-G138 PolarHBondContact O-N 3.11Å
139C94.8Very high93.4Very high35 Ų3563 Ų6324%0.23633%0.329CS..THydrogen-bonded Turntrans-99.6-1.2-177.2-51.90000113.3A116 H136 S141A116-C139 HydrophobicContact CB-CB 3.89Å; H136-C139 HydrophobicContact CB-CB 4.3Å; H136-C139 PolarHBondContact O-N 2.89Å; C139-S141 VanDerWaalsContact C-N 3.35Å; C139-S141 PolarHBondContact O-N 3.49Å
140F96.6Very high93.4Very high0 Ų061.5 Ų61.50%033%0.329CS..  trans-88.876.1174-165.3-105000109.2M128 V130 Y135 H136 L149 F155 L162M128-F140 HydrophobicContact CB-CB 3.96Å; M128-F140 HydrophobicContact CB-CD1 3.93Å; M128-F140 HydrophobicContact CB-CD2 3.63Å; M128-F140 HydrophobicContact CB-CE1 4.36Å; M128-F140 HydrophobicContact CB-CE2 4.1Å; M128-F140 HydrophobicContact CB-CG 3.55Å; M128-F140 HydrophobicContact CB-CZ 4.46Å; M128-F140 HydrophobicContact CE-CD1 3.66Å; M128-F140 HydrophobicContact CE-CE1 3.52Å; M128-F140 HydrophobicContact CE-CG 4.5Å; M128-F140 HydrophobicContact CE-CZ 4.27Å; M128-F140 HydrophobicContact CG-CB 3.72Å; M128-F140 HydrophobicContact CG-CD1 3.58Å; M128-F140 HydrophobicContact CG-CD2 4.17Å; M128-F140 HydrophobicContact CG-CE1 4.25Å; M128-F140 HydrophobicContact CG-CG 3.54Å; M128-F140 HydrophobicContact SD-CD1 4.47Å; V130-F140 HydrophobicContact CB-CE2 4.49Å; V130-F140 HydrophobicContact CG2-CE2 3.51Å; V130-F140 HydrophobicContact CG2-CZ 3.61Å; Y135-F140 HydrophobicContact CD1-CD2 4.41Å; Y135-F140 AromaticContact CD2-CD2 3.78Å; Y135-F140 HydrophobicContact CD2-CD2 3.78Å; Y135-F140 HydrophobicContact CD2-CE2 4.13Å; Y135-F140 HydrophobicContact CE2-CD2 4.42Å; Y135-F140 HydrophobicContact CE2-CE2 4.44Å; Y135-F140 AromaticContact CG-CD2 3.79Å; Y135-F140 HydrophobicContact CG-CD2 3.79Å; H136-F140 PolarHBondContact O-N 3.25Å; H136-F140 VanDerWaalsContact O-N 3.09Å; F140-L149 HydrophobicContact CD1-CB 3.63Å; F140-L149 WeakPolarHBondContact CD1-O 3.4Å; F140-L149 HydrophobicContact CE1-CB 3.54Å; F140-L149 HydrophobicContact CE1-CD1 4.15Å; F140-L149 HydrophobicContact CE1-CG 4.5Å; F140-L149 HydrophobicContact CZ-CD1 4.48Å; F140-L149 PolarHBondContact O-N 2.97Å; F140-F155 HydrophobicContact CE1-CE1 4.39Å; F140-F155 HydrophobicContact CZ-CD1 4.33Å; F140-F155 HydrophobicContact CZ-CD2 4.34Å; F140-F155 AromaticContact CZ-CE1 3.94Å; F140-F155 HydrophobicContact CZ-CE1 3.94Å; F140-F155 AromaticContact CZ-CE2 3.96Å; F140-F155 HydrophobicContact CZ-CE2 3.96Å; F140-F155 AromaticContact CZ-CZ 3.77Å; F140-F155 HydrophobicContact CZ-CZ 3.77Å; F140-L162 HydrophobicContact CD2-CD1 3.39Å; F140-L162 HydrophobicContact CD2-CD2 4.31Å; F140-L162 HydrophobicContact CE2-CD1 3.57Å; F140-L162 HydrophobicContact CE2-CD2 3.58Å; F140-L162 HydrophobicContact CE2-CG 4.25Å; F140-L162 HydrophobicContact CG-CD1 4.11Å; F140-L162 HydrophobicContact CZ-CD1 4.4Å; F140-L162 HydrophobicContact CZ-CD2 4Å
141S96.4Very high93.4Very high34 Ų3471.3 Ų71.324%0.23836%0.363CS..BIsolated β-bridgetrans-136155.3-174.5530000111.9C139 E146 R147 L162C139-S141 VanDerWaalsContact C-N 3.35Å; C139-S141 PolarHBondContact O-N 3.49Å; S141-E146 WeakPolarHBondContact CB-O 3.37Å; S141-R147 CarbonylContact C-O 3.22Å; S141-R147 WeakPolarHBondContact CA-O 3.38Å; S141-R147 WeakPolarHBondContact CB-O 3.37Å; S141-L162 WeakPolarHBondContact O-CB 3.47Å
142C95.5Very high93.5Very high1 Ų168.2 Ų68.21%0.00737%0.367CS..  trans-61.8135.7173.4-1760000110.8E144 C145 E146 R147 L162 C164 D167C142-E144 VanDerWaalsContact C-N 3.3Å; C142-E144 PolarHBondContact O-N 3Å; C142-C145 VanDerWaalsContact CB-SG 3.55Å; C142-E146 WeakPolarHBondContact O-CA 3.31Å; C142-E146 PolarHBondContact O-N 3.19Å; C142-R147 PolarHBondContact N-O 3.4Å; C142-L162 CarbonylContact C-O 3.58Å; C142-L162 WeakPolarHBondContact CA-O 3.48Å; C142-C164 HydrophobicContact CB-CB 4.17Å; C142-C164 PolarHBondContact SG-N 2.99Å; C142-D167 PolarHBondContact SG-OD2 3.16Å
143C93.4Very high93.9Very high55 Ų5568.6 Ų68.637%0.37236%0.355SS..THydrogen-bonded Turntrans-74.9-15.517965.30000114.7L162 L163C143-L162 PolarHBondContact N-O 3.19Å; C143-L162 PolarHBondContact SG-O 3.38Å; C143-L163 VanDerWaalsContact SG-CD2 3.55Å
144E93.6Very high94.1Very high109 Ų10970 Ų7051%0.50936%0.361SS..THydrogen-bonded Turntrans-97.9-48.7-179.4-59.8-58.7131.800112.5C142 L163 D167C142-E144 VanDerWaalsContact C-N 3.3Å; C142-E144 PolarHBondContact O-N 3Å; E144-L163 HydrophobicContact CG-CD2 3.58Å; E144-D167 HydrophobicContact CB-CB 4.15Å; E144-D167 HydrophobicContact CG-CB 4.47Å
145C94.3Very high94.3Very high46 Ų4673 Ų7331%0.31137%0.374SS..THydrogen-bonded Turntrans-101.5-0.7-179.574.60000115.1C142 R147 D167C142-C145 VanDerWaalsContact CB-SG 3.55Å; C145-R147 PolarHBondContact O-N 3.05Å; C145-R147 VanDerWaalsContact SG-CB 3.52Å; C145-D167 VanDerWaalsContact CB-OD2 3.32Å; C145-D167 WeakPolarHBondContact CB-OD2 3.36Å; C145-D167 PolarHBondContact SG-OD2 3.26Å
146E93.3Very high94.3Very high134 Ų13475 Ų7563%0.62639%0.387SS*.  trans59.11-179.8-60.2178.7-161.100115.5S141 C142 R148S141-E146 WeakPolarHBondContact CB-O 3.37Å; C142-E146 WeakPolarHBondContact O-CA 3.31Å; C142-E146 PolarHBondContact O-N 3.19Å; E146-R148 PolarHBondContact O-N 3.24Å
147R94.7Very high94.2Very high127 Ų12775.6 Ų75.648%0.47939%0.391SS..PPolyproline II helixtrans-59.7127.2176.1-165.4-170.8-50.6110.612.6110.4S141 C142 C145 C164S141-R147 CarbonylContact C-O 3.22Å; S141-R147 WeakPolarHBondContact CA-O 3.38Å; S141-R147 WeakPolarHBondContact CB-O 3.37Å; C142-R147 PolarHBondContact N-O 3.4Å; C145-R147 PolarHBondContact O-N 3.05Å; C145-R147 VanDerWaalsContact SG-CB 3.52Å; R147-C164 PolarHBondContact NH1-SG 3.32Å
148R95Very high94Very high138 Ų13875.5 Ų75.552%0.52139%0.388SS..BIsolated β-bridgetrans-66.8129.9171.8-65.9175.365.4-178.3-3109.3L137 E146L137-R148 VanDerWaalsContact C-NH2 3.31Å; L137-R148 PolarHBondContact O-NE 2.98Å; L137-R148 PolarHBondContact O-NH2 2.89Å; E146-R148 PolarHBondContact O-N 3.24Å
149L94.6Very high93.7Very high8 Ų881.9 Ų81.94%0.04241%0.405CS..PPolyproline II helixtrans-90.2132.4-179.8-61.7166.3000109F140 D153 F155 L162 C164F140-L149 HydrophobicContact CD1-CB 3.63Å; F140-L149 WeakPolarHBondContact CD1-O 3.4Å; F140-L149 HydrophobicContact CE1-CB 3.54Å; F140-L149 HydrophobicContact CE1-CD1 4.15Å; F140-L149 HydrophobicContact CE1-CG 4.5Å; F140-L149 HydrophobicContact CZ-CD1 4.48Å; F140-L149 PolarHBondContact O-N 2.97Å; L149-D153 WeakPolarHBondContact CA-OD2 3.28Å; L149-D153 HydrophobicContact CD2-CB 4.29Å; L149-F155 HydrophobicContact CD1-CB 3.67Å; L149-F155 HydrophobicContact CD1-CD2 4.44Å; L149-F155 HydrophobicContact CD1-CG 3.98Å; L149-F155 HydrophobicContact CD2-CB 4.16Å; L149-F155 HydrophobicContact CG-CB 4.5Å; L149-L162 HydrophobicContact CD1-CB 4.22Å; L149-C164 HydrophobicContact CD2-CB 3.74Å
150Q92.9Very high93.3Very high137 Ų13782.5 Ų82.564%0.6442%0.418SS*.  trans-110.5178-177.7-59.7-161.41.900112.2G152 D153Q150-G152 PolarHBondContact O-N 3.33Å; Q150-D153 PolarHBondContact N-OD2 3.31Å; Q150-D153 PolarHBondContact O-N 3.44Å
151R91.8Very high93Very high228 Ų22886 Ų8686%0.8643%0.434SS*.THydrogen-bonded Turntrans-67.9125.3172.6-65.1-179.1-175.2161.50.5108.6
152G91.8Very high92.9Very high82 Ų8284.7 Ų84.785%0.84543%0.425SS*.THydrogen-bonded Turntrans100.2-15.9-174.100000114.1Q150Q150-G152 PolarHBondContact O-N 3.33Å
153D94.3Very high92.9Very high68 Ų6884.9 Ų84.936%0.36443%0.426SS..  trans-73.1134174.8-74.8-17.5000111.4L149 Q150L149-D153 WeakPolarHBondContact CA-OD2 3.28Å; L149-D153 HydrophobicContact CD2-CB 4.29Å; Q150-D153 PolarHBondContact N-OD2 3.31Å; Q150-D153 PolarHBondContact O-N 3.44Å
154E95.2Very high93Very high117 Ų11782.5 Ų82.555%0.54741%0.409SS..  trans-79.7128.9169.3-70.8178-150.500111.4R165E154-R165 HydrophobicContact CB-CB 3.94Å; E154-R165 HydrophobicContact CB-CG 4.43Å; E154-R165 VanDerWaalsContact CD-NH1 3.28Å; E154-R165 PolarHBondContact O-N 2.9Å; E154-R165 IonicContact OE1-NH1 3.11Å; E154-R165 PolarHBondContact OE1-NH1 3.07Å; E154-R165 VanDerWaalsContact OE1-NH1 3.11Å; E154-R165 WeakPolarHBondContact OE2-CD 3.36Å; E154-R165 IonicContact OE2-CZ 2.67Å; E154-R165 IonicContact OE2-NE 3.98Å; E154-R165 IonicContact OE2-NH1 2.74Å; E154-R165 PolarHBondContact OE2-NH1 3.02Å
155F95.7Very high93.1Very high67 Ų6783 Ų8329%0.29441%0.407SS..EExtended strand (participates in β ladder)trans-149.5162.9-179.373.7-87.2000111.5V130 F140 L149 L162 L163V130-F155 HydrophobicContact CB-CZ 4.43Å; V130-F155 HydrophobicContact CG1-CE2 3.84Å; V130-F155 HydrophobicContact CG1-CZ 3.89Å; V130-F155 HydrophobicContact CG2-CE2 4.06Å; V130-F155 HydrophobicContact CG2-CZ 3.61Å; F140-F155 HydrophobicContact CE1-CE1 4.39Å; F140-F155 HydrophobicContact CZ-CD1 4.33Å; F140-F155 HydrophobicContact CZ-CD2 4.34Å; F140-F155 AromaticContact CZ-CE1 3.94Å; F140-F155 HydrophobicContact CZ-CE1 3.94Å; F140-F155 AromaticContact CZ-CE2 3.96Å; F140-F155 HydrophobicContact CZ-CE2 3.96Å; F140-F155 AromaticContact CZ-CZ 3.77Å; F140-F155 HydrophobicContact CZ-CZ 3.77Å; L149-F155 HydrophobicContact CD1-CB 3.67Å; L149-F155 HydrophobicContact CD1-CD2 4.44Å; L149-F155 HydrophobicContact CD1-CG 3.98Å; L149-F155 HydrophobicContact CD2-CB 4.16Å; L149-F155 HydrophobicContact CG-CB 4.5Å; F155-L162 HydrophobicContact CD2-CD2 3.72Å; F155-L162 HydrophobicContact CE2-CD2 3.83Å; F155-L163 CarbonylContact C-O 3.48Å; F155-L163 WeakPolarHBondContact CA-O 3.31Å; F155-L163 VanDerWaalsContact CB-O 3.29Å; F155-L163 WeakPolarHBondContact CB-O 3.39Å
156V94.6Very high93.1Very high45 Ų4585.4 Ų85.427%0.27342%0.415SS..EExtended strand (participates in β ladder)trans-122.3136.4176.2179.50000109.5L163 Y168V156-L163 PolarHBondContact N-O 2.6Å; V156-L163 PolarHBondContact O-N 3.43Å; V156-Y168 HydrophobicContact CB-CD2 3.89Å; V156-Y168 HydrophobicContact CB-CE2 4.24Å; V156-Y168 HydrophobicContact CB-CG 4.09Å; V156-Y168 HydrophobicContact CG1-CD2 3.96Å; V156-Y168 HydrophobicContact CG1-CE2 3.85Å; V156-Y168 HydrophobicContact CG2-CD1 3.72Å; V156-Y168 HydrophobicContact CG2-CD2 3.88Å; V156-Y168 HydrophobicContact CG2-CE1 3.99Å; V156-Y168 HydrophobicContact CG2-CE2 4.14Å; V156-Y168 HydrophobicContact CG2-CG 3.66Å
157L94.2Very high93.2Very high44 Ų4480.1 Ų80.123%0.2339%0.39CS..EExtended strand (participates in β ladder)trans-102.1105.1170.7-175.170.1000109.5V130 L131 Y135 Q161 L162V130-L157 HydrophobicContact CG1-CD2 4.11Å; L131-L157 HydrophobicContact CB-CD2 4.36Å; L131-L157 HydrophobicContact CD1-CD2 4.19Å; Y135-L157 WeakPolarHBondContact OH-CD1 3.32Å; L157-Q161 CarbonylContact C-O 3.55Å; L157-Q161 WeakPolarHBondContact CA-O 3.14Å; L157-L162 HydrophobicContact CB-CD2 4.44Å; L157-L162 HydrophobicContact CD1-CD2 3.66Å; L157-L162 HydrophobicContact CD1-CG 3.96Å
158K88.9Confident93.2Very high67 Ų6777.7 Ų77.729%0.29138%0.382SS..EExtended strand (participates in β ladder)trans-116.7116.2-175.9-177.6-173.5-177.1-176.50109.5G160 Q161 L163 E171K158-G160 PolarHBondContact O-N 3.37Å; K158-Q161 PolarHBondContact N-O 2.86Å; K158-Q161 WeakPolarHBondContact O-CA 3.49Å; K158-Q161 VanDerWaalsContact O-CB 3.31Å; K158-Q161 WeakPolarHBondContact O-CB 3.48Å; K158-Q161 PolarHBondContact O-N 3.03Å; K158-L163 HydrophobicContact CD-CD1 4.22Å; K158-E171 IonicContact NZ-OE1 3.85Å; K158-E171 PolarHBondContact NZ-OE1 3Å; K158-E171 IonicContact NZ-OE2 3.28Å; K158-E171 PolarHBondContact NZ-OE2 2.96Å
159E86.8Confident93.1Very high177 Ų17774 Ų7483%0.82737%0.37SS*.THydrogen-bonded Turntrans53.329.8-179.4-58.2179.2177.400113.8Q161E159-Q161 VanDerWaalsContact C-N 3.33Å
160G84.9Confident93Very high49 Ų4978.6 Ų78.651%0.50539%0.39SS..THydrogen-bonded Turntrans85-3.2-175.400000115.3K158K158-G160 PolarHBondContact O-N 3.37Å
161Q91.2Very high92.8Very high72 Ų7275 Ų7534%0.33637%0.373SS..EExtended strand (participates in β ladder)trans-91132.9174.9-48.8-166.8-59.300110.5L157 K158 E159L157-Q161 CarbonylContact C-O 3.55Å; L157-Q161 WeakPolarHBondContact CA-O 3.14Å; K158-Q161 PolarHBondContact N-O 2.86Å; K158-Q161 WeakPolarHBondContact O-CA 3.49Å; K158-Q161 VanDerWaalsContact O-CB 3.31Å; K158-Q161 WeakPolarHBondContact O-CB 3.48Å; K158-Q161 PolarHBondContact O-N 3.03Å; E159-Q161 VanDerWaalsContact C-N 3.33Å
162L94.5Very high92.7Very high8 Ų870.9 Ų70.94%0.04236%0.358CS..EExtended strand (participates in β ladder)trans-89.7127.6175.6-69.8164.4000109.3Y135 F140 S141 C142 C143 L149 F155 L157Y135-L162 HydrophobicContact CD1-CD1 4.16Å; Y135-L162 HydrophobicContact CE1-CD1 3.95Å; F140-L162 HydrophobicContact CD2-CD1 3.39Å; F140-L162 HydrophobicContact CD2-CD2 4.31Å; F140-L162 HydrophobicContact CE2-CD1 3.57Å; F140-L162 HydrophobicContact CE2-CD2 3.58Å; F140-L162 HydrophobicContact CE2-CG 4.25Å; F140-L162 HydrophobicContact CG-CD1 4.11Å; F140-L162 HydrophobicContact CZ-CD1 4.4Å; F140-L162 HydrophobicContact CZ-CD2 4Å; S141-L162 WeakPolarHBondContact O-CB 3.47Å; C142-L162 CarbonylContact C-O 3.58Å; C142-L162 WeakPolarHBondContact CA-O 3.48Å; C143-L162 PolarHBondContact N-O 3.19Å; C143-L162 PolarHBondContact SG-O 3.38Å; L149-L162 HydrophobicContact CD1-CB 4.22Å; F155-L162 HydrophobicContact CD2-CD2 3.72Å; F155-L162 HydrophobicContact CE2-CD2 3.83Å; L157-L162 HydrophobicContact CB-CD2 4.44Å; L157-L162 HydrophobicContact CD1-CD2 3.66Å; L157-L162 HydrophobicContact CD1-CG 3.96Å
163L95.3Very high92.6Very high5 Ų573.7 Ų73.73%0.02635%0.349CS..EExtended strand (participates in β ladder)trans-122129.9174.6-69.8168000109C143 E144 F155 V156 K158 Y168C143-L163 VanDerWaalsContact SG-CD2 3.55Å; E144-L163 HydrophobicContact CG-CD2 3.58Å; F155-L163 CarbonylContact C-O 3.48Å; F155-L163 WeakPolarHBondContact CA-O 3.31Å; F155-L163 VanDerWaalsContact CB-O 3.29Å; F155-L163 WeakPolarHBondContact CB-O 3.39Å; V156-L163 PolarHBondContact N-O 2.6Å; V156-L163 PolarHBondContact O-N 3.43Å; K158-L163 HydrophobicContact CD-CD1 4.22Å; L163-Y168 HydrophobicContact CD1-CD2 4.08Å
164C96.2Very high92.2Very high4 Ų476.7 Ų76.73%0.02736%0.362CS..EExtended strand (participates in β ladder)trans-69154.4168.483.30000110C142 R147 L149 M166 D167 Y168C142-C164 HydrophobicContact CB-CB 4.17Å; C142-C164 PolarHBondContact SG-N 2.99Å; R147-C164 PolarHBondContact NH1-SG 3.32Å; L149-C164 HydrophobicContact CD2-CB 3.74Å; C164-M166 VanDerWaalsContact C-N 3.27Å; C164-M166 PolarHBondContact O-N 2.74Å; C164-M166 VanDerWaalsContact O-N 3.16Å; C164-D167 PolarHBondContact O-N 2.68Å; C164-D167 VanDerWaalsContact SG-CG 3.57Å; C164-D167 PolarHBondContact SG-OD2 3.49Å; C164-Y168 PolarHBondContact O-N 3.06Å
165R94.9Very high91.6Very high120 Ų12075.1 Ų75.145%0.45336%0.357SS..Hα-helixtrans-42.7-52178.2-175.1-163.1178.6146.9-13.5113.2E154 D167 Y168 E169E154-R165 HydrophobicContact CB-CB 3.94Å; E154-R165 HydrophobicContact CB-CG 4.43Å; E154-R165 VanDerWaalsContact CD-NH1 3.28Å; E154-R165 PolarHBondContact O-N 2.9Å; E154-R165 IonicContact OE1-NH1 3.11Å; E154-R165 PolarHBondContact OE1-NH1 3.07Å; E154-R165 VanDerWaalsContact OE1-NH1 3.11Å; E154-R165 WeakPolarHBondContact OE2-CD 3.36Å; E154-R165 IonicContact OE2-CZ 2.67Å; E154-R165 IonicContact OE2-NE 3.98Å; E154-R165 IonicContact OE2-NH1 2.74Å; E154-R165 PolarHBondContact OE2-NH1 3.02Å; R165-D167 PolarHBondContact O-N 3.21Å; R165-Y168 PolarHBondContact O-N 3.19Å; R165-E169 HydrophobicContact CG-CG 4.37Å; R165-E169 IonicContact CZ-OE1 3.58Å; R165-E169 IonicContact NE-OE1 3.51Å; R165-E169 PolarHBondContact NE-OE1 2.84Å; R165-E169 IonicContact NE-OE2 3.64Å; R165-E169 IonicContact NH2-OE1 2.65Å; R165-E169 WeakPolarHBondContact O-CB 3.33Å; R165-E169 WeakPolarHBondContact O-CG 3.35Å; R165-E169 PolarHBondContact O-N 3.47Å
166M95Very high91.1Very high97 Ų9775 Ų7548%0.47837%0.369SS..Hα-helixtrans-57.6-41.9-178.2-179.763.856.100113.6C164 K170C164-M166 VanDerWaalsContact C-N 3.27Å; C164-M166 PolarHBondContact O-N 2.74Å; C164-M166 VanDerWaalsContact O-N 3.16Å; M166-K170 WeakPolarHBondContact O-CD 3.44Å; M166-K170 VanDerWaalsContact O-CG 3.24Å; M166-K170 WeakPolarHBondContact O-CG 3.46Å; M166-K170 PolarHBondContact O-N 3.4Å
167D94.6Very high90.4Very high22 Ų2277.1 Ų77.112%0.11839%0.391CS..Hα-helixtrans-82.5-29.8-178.9-57.3-39.1000111.6C142 E144 C145 C164 R165 E171C142-D167 PolarHBondContact SG-OD2 3.16Å; E144-D167 HydrophobicContact CB-CB 4.15Å; E144-D167 HydrophobicContact CG-CB 4.47Å; C145-D167 VanDerWaalsContact CB-OD2 3.32Å; C145-D167 WeakPolarHBondContact CB-OD2 3.36Å; C145-D167 PolarHBondContact SG-OD2 3.26Å; C164-D167 PolarHBondContact O-N 2.68Å; C164-D167 VanDerWaalsContact SG-CG 3.57Å; C164-D167 PolarHBondContact SG-OD2 3.49Å; R165-D167 PolarHBondContact O-N 3.21Å; D167-E171 WeakPolarHBondContact O-CB 3.37Å; D167-E171 PolarHBondContact O-N 2.9Å
168Y94.4Very high89.2Confident76 Ų7681.1 Ų81.130%0.29841%0.411SS..Hα-helixtrans-66-44.1171.6176.9-101.9000112.1V156 L163 C164 R165 E171 R172V156-Y168 HydrophobicContact CB-CD2 3.89Å; V156-Y168 HydrophobicContact CB-CE2 4.24Å; V156-Y168 HydrophobicContact CB-CG 4.09Å; V156-Y168 HydrophobicContact CG1-CD2 3.96Å; V156-Y168 HydrophobicContact CG1-CE2 3.85Å; V156-Y168 HydrophobicContact CG2-CD1 3.72Å; V156-Y168 HydrophobicContact CG2-CD2 3.88Å; V156-Y168 HydrophobicContact CG2-CE1 3.99Å; V156-Y168 HydrophobicContact CG2-CE2 4.14Å; V156-Y168 HydrophobicContact CG2-CG 3.66Å; L163-Y168 HydrophobicContact CD1-CD2 4.08Å; C164-Y168 PolarHBondContact O-N 3.06Å; R165-Y168 PolarHBondContact O-N 3.19Å; Y168-E171 PolarHBondContact O-N 3.09Å; Y168-R172 WeakPolarHBondContact O-CB 3.3Å; Y168-R172 PolarHBondContact O-N 2.89Å
169E93.6Very high87.5Confident60 Ų6081.9 Ų81.928%0.2843%0.425SS..Hα-helixtrans-61.4-44.1175.3-75.3172.6167.700111R165 R172 E173R165-E169 HydrophobicContact CG-CG 4.37Å; R165-E169 IonicContact CZ-OE1 3.58Å; R165-E169 IonicContact NE-OE1 3.51Å; R165-E169 PolarHBondContact NE-OE1 2.84Å; R165-E169 IonicContact NE-OE2 3.64Å; R165-E169 IonicContact NH2-OE1 2.65Å; R165-E169 WeakPolarHBondContact O-CB 3.33Å; R165-E169 WeakPolarHBondContact O-CG 3.35Å; R165-E169 PolarHBondContact O-N 3.47Å; E169-R172 WeakPolarHBondContact O-CB 3.39Å; E169-R172 PolarHBondContact O-N 2.82Å; E169-E173 WeakPolarHBondContact O-CB 3.38Å; E169-E173 PolarHBondContact O-N 3.3Å
170K91.6Very high85.8Confident105 Ų10579 Ų7946%0.45742%0.421SS..Hα-helixtrans-62.4-44.9173.5-72.4169.6-172.9173.10113.2M166 R172 E173 M174M166-K170 WeakPolarHBondContact O-CD 3.44Å; M166-K170 VanDerWaalsContact O-CG 3.24Å; M166-K170 WeakPolarHBondContact O-CG 3.46Å; M166-K170 PolarHBondContact O-N 3.4Å; K170-R172 VanDerWaalsContact C-N 3.28Å; K170-R172 PolarHBondContact O-N 3.49Å; K170-E173 PolarHBondContact O-N 3.06Å; K170-M174 VanDerWaalsContact O-CB 3.3Å; K170-M174 WeakPolarHBondContact O-CB 3.34Å; K170-M174 WeakPolarHBondContact O-CG 3.31Å; K170-M174 PolarHBondContact O-N 3.01Å
171E89.1Confident84Confident61 Ų6180.7 Ų80.729%0.28543%0.431SS..Hα-helixtrans-60.6-41.8176.4-163.9-156.3-176.500110.3K158 D167 Y168 L175K158-E171 IonicContact NZ-OE1 3.85Å; K158-E171 PolarHBondContact NZ-OE1 3Å; K158-E171 IonicContact NZ-OE2 3.28Å; K158-E171 PolarHBondContact NZ-OE2 2.96Å; D167-E171 WeakPolarHBondContact O-CB 3.37Å; D167-E171 PolarHBondContact O-N 2.9Å; Y168-E171 PolarHBondContact O-N 3.09Å; E171-L175 HydrophobicContact CG-CD1 4.03Å; E171-L175 VanDerWaalsContact O-CB 3.31Å; E171-L175 WeakPolarHBondContact O-CB 3.29Å; E171-L175 WeakPolarHBondContact O-CD1 3.44Å; E171-L175 WeakPolarHBondContact O-CG 3.47Å; E171-L175 PolarHBondContact O-N 3.5Å
172R89.4Confident81.8Confident143 Ų14382.8 Ų82.854%0.5445%0.45SS..Hα-helixtrans-64.9-44.9178.1-174.3-174.267.1-173.1-3.1112.2Y168 E169 K170 L175 A176Y168-R172 WeakPolarHBondContact O-CB 3.3Å; Y168-R172 PolarHBondContact O-N 2.89Å; E169-R172 WeakPolarHBondContact O-CB 3.39Å; E169-R172 PolarHBondContact O-N 2.82Å; K170-R172 VanDerWaalsContact C-N 3.28Å; K170-R172 PolarHBondContact O-N 3.49Å; R172-L175 PolarHBondContact O-N 3.4Å; R172-A176 WeakPolarHBondContact O-CB 3.28Å; R172-A176 PolarHBondContact O-N 3.03Å
173E89.9Confident79.5Confident140 Ų14087.8 Ų87.865%0.65448%0.481SS*.Hα-helixtrans-64.7-46.5177.9-176173.9-157.300111.6E169 K170 L175 A176 A177E169-E173 WeakPolarHBondContact O-CB 3.38Å; E169-E173 PolarHBondContact O-N 3.3Å; K170-E173 PolarHBondContact O-N 3.06Å; E173-L175 VanDerWaalsContact C-N 3.3Å; E173-L175 PolarHBondContact O-N 3.43Å; E173-A176 WeakPolarHBondContact O-CB 3.34Å; E173-A176 PolarHBondContact O-N 2.94Å; E173-A176 VanDerWaalsContact O-N 3.1Å; E173-A177 PolarHBondContact O-N 3.28Å
174M85.3Confident77.1Confident132 Ų13296.7 Ų96.765%0.6552%0.523SS*.Hα-helixtrans-57.8-41.6173.5-71-89.8-76.700111.8K170 I178K170-M174 VanDerWaalsContact O-CB 3.3Å; K170-M174 WeakPolarHBondContact O-CB 3.34Å; K170-M174 WeakPolarHBondContact O-CG 3.31Å; K170-M174 PolarHBondContact O-N 3.01Å; M174-I178 VanDerWaalsContact O-CD1 3.26Å; M174-I178 WeakPolarHBondContact O-CD1 3.5Å; M174-I178 VanDerWaalsContact O-CG1 3.24Å; M174-I178 WeakPolarHBondContact O-CG1 3.31Å; M174-I178 PolarHBondContact O-N 3.35Å
175L83.6Confident74.6Confident84 Ų84100.8 Ų100.844%0.4455%0.552SS.*Hα-helixtrans-70.1-31.6176.4-73.9169.3000113E171 R172 E173E171-L175 HydrophobicContact CG-CD1 4.03Å; E171-L175 VanDerWaalsContact O-CB 3.31Å; E171-L175 WeakPolarHBondContact O-CB 3.29Å; E171-L175 WeakPolarHBondContact O-CD1 3.44Å; E171-L175 WeakPolarHBondContact O-CG 3.47Å; E171-L175 PolarHBondContact O-N 3.5Å; R172-L175 PolarHBondContact O-N 3.4Å; E173-L175 VanDerWaalsContact C-N 3.3Å; E173-L175 PolarHBondContact O-N 3.43Å
176A85.3Confident72.3Confident65 Ų65101.9 Ų101.954%0.53757%0.571SS.*Hα-helixtrans-69.4-44.8174.700000111.4R172 E173 I178 S179R172-A176 WeakPolarHBondContact O-CB 3.28Å; R172-A176 PolarHBondContact O-N 3.03Å; E173-A176 WeakPolarHBondContact O-CB 3.34Å; E173-A176 PolarHBondContact O-N 2.94Å; E173-A176 VanDerWaalsContact O-N 3.1Å; A176-I178 PolarHBondContact O-N 3.33Å; A176-S179 WeakPolarHBondContact O-CB 3.33Å; A176-S179 PolarHBondContact O-N 2.65Å
177A78.8Confident69.7Low88 Ų88106.7 Ų106.773%0.72759%0.59SS**Hα-helixtrans-63-21.8177.600000114.1E173E173-A177 PolarHBondContact O-N 3.28Å
178I70.9Confident67Low128 Ų128110.1 Ų110.166%0.65662%0.616SS**THydrogen-bonded Turntrans-88-10.6177-64.6164.3000111.9M174 A176 P180M174-I178 VanDerWaalsContact O-CD1 3.26Å; M174-I178 WeakPolarHBondContact O-CD1 3.5Å; M174-I178 VanDerWaalsContact O-CG1 3.24Å; M174-I178 WeakPolarHBondContact O-CG1 3.31Å; M174-I178 PolarHBondContact O-N 3.35Å; A176-I178 PolarHBondContact O-N 3.33Å; I178-P180 WeakPolarHBondContact O-CD 3.32Å
179S52.7Low64.4Low84 Ų84115.3 Ų115.359%0.58764%0.643SS**SBendtrans-86.5112.8171.7-1690000109.5A176 A181A176-S179 WeakPolarHBondContact O-CB 3.33Å; A176-S179 PolarHBondContact O-N 2.65Å; S179-A181 PolarHBondContact O-N 3.48Å; S179-A181 VanDerWaalsContact O-N 3.09Å
180P50.2Low61.8Low115 Ų115120.4 Ų120.475%0.74767%0.671SS**  trans-64.3117.3170.327.4-32.1000108.1I178I178-P180 WeakPolarHBondContact O-CD 3.32Å
181A48.4Very low59.7Low85 Ų85124.5 Ų124.570%0.70269%0.692SS**  trans-60.2135.8161.500000107.6S179 T183S179-A181 PolarHBondContact O-N 3.48Å; S179-A181 VanDerWaalsContact O-N 3.09Å; A181-T183 PolarHBondContact O-N 3.17Å
182P44.7Very low57.2Low116 Ų116129.7 Ų129.775%0.75372%0.722SS**  trans-64.7112.8172.627.4-31.9000108.4E184P182-E184 PolarHBondContact O-N 3.32Å
183T46.2Very low54.6Low113 Ų113125.8 Ų125.869%0.69373%0.726SS**  trans-3.2101164.556.10000116.9A181 S185A181-T183 PolarHBondContact O-N 3.17Å; T183-S185 WeakPolarHBondContact CB-OG 3.27Å; T183-S185 PolarHBondContact O-N 2.94Å
184E43.6Very low51.9Low193 Ų193123.2 Ų123.290%0.90274%0.737SS**  trans-70.486.8148.2-75-63.814100107P182 V186P182-E184 PolarHBondContact O-N 3.32Å; E184-V186 PolarHBondContact O-N 3.11Å
185S45.2Very low49.4Very low90 Ų90121.1 Ų121.163%0.62975%0.749SS**  trans-77.3120-178.1-65.40000110.2T183 K187T183-S185 WeakPolarHBondContact CB-OG 3.27Å; T183-S185 PolarHBondContact O-N 2.94Å; S185-K187 PolarHBondContact O-N 3.09Å; S185-K187 VanDerWaalsContact O-N 3.16Å
186V46.2Very low47Very low143 Ų143121 Ų12187%0.86777%0.769SS**  trans-61.7110.7172.4-76.10000112.2E184E184-V186 PolarHBondContact O-N 3.11Å
187K40.3Very low44.7Very low197 Ų197124.3 Ų124.386%0.85779%0.788SS**  trans175.6144.2159.1-104.8-174.1175.4-169.30108S185S185-K187 PolarHBondContact O-N 3.09Å; S185-K187 VanDerWaalsContact O-N 3.16Å
188S37Very low42.5Very low95 Ų95124 Ų12466%0.66479%0.794SS**  cis-160.1157-18.733.30000106.8
189E41.6Very low40.7Very low185 Ų185124.3 Ų124.386%0.86481%0.807SS**  trans-65.1128.4173.1-57.2159.716200109.6
190D38.9Very low39.8Very low166 Ų166123.8 Ų123.889%0.88882%0.815SS**  trans-170147.6159.5-90.8-43.4000109.3
191E47Very low39Very low191 Ų191128.6 Ų128.689%0.89382%0.824SS**  trans-102165.7-166.4-68.9-132.4135.800116.3
192D36.7Very low38.1Very low170 Ų170128.5 Ų128.591%0.90983%0.832SS**  trans71.6149.6153.1-164.241.8000120.8
193G35.1Very low37.5Very low61 Ų61126.4 Ų126.463%0.62983%0.831SS**  trans118.589.1148.700000118.8
194G32.4Very low37Very low86 Ų86128.6 Ų128.689%0.88784%0.839SS**  trans85.7132.4137.700000119.2
195G33Very low36.8Very low88 Ų88126.6 Ų126.691%0.90783%0.829SS**  trans-100.1176174.300000114.2
196G32.8Very low37.1Very low83 Ų83126.1 Ų126.186%0.85684%0.838SS**  trans172.3118.1172.500000113.4
197S36.7Very low36.9Very low134 Ų134127.1 Ų127.194%0.93783%0.831SS**  trans-81.9150.2175.6-50.10000112.2
198G33.2Very low37.1Very low82 Ų82125.5 Ų125.585%0.84583%0.826SS**  trans-173115.5171.100000114.7
199S33.6Very low37.4Very low134 Ų134129.4 Ų129.494%0.93783%0.834SS**  trans-77.5153.5177.2-49.70000113.1
200G32.5Very low37.8Very low73 Ų73128.8 Ų128.875%0.75383%0.828SS**  trans-17636.9178.800000123.4
201K34.2Very low38.4Very low215 Ų215131.9 Ų131.994%0.93583%0.828SS**  trans41.9110.6137.2-159.9177.8-173-1800121.3
202G30Very low38.5Very low84 Ų84128.4 Ų128.487%0.86682%0.824SS**  trans84.7149.6154.700000116.2
203G31.1Very low39.6Very low72 Ų72129.5 Ų129.574%0.74282%0.821SS**  cis179.6165.3-4.600000110.5
204D36.3Very low41.2Very low158 Ų158137 Ų13785%0.84583%0.831SS**  trans56.8133.8171.5-158.832.3000120.1
205E40Very low42.8Very low152 Ų152139 Ų13971%0.7183%0.827SS**  trans160.294.2152.1-89.2-105.6115.100108.6K207E205-K207 PolarHBondContact O-N 3.1Å
206G50.4Low44.9Very low79 Ų79145.8 Ų145.881%0.81483%0.826SS**  trans-69.981.3179.800000113.8E208G206-E208 PolarHBondContact O-N 2.79Å
207K41.8Very low47.1Very low165 Ų165145.9 Ų145.972%0.71781%0.81SS**  trans-73.496.2174-94.1173.8-179.9158.40112.7E205 H209E205-K207 PolarHBondContact O-N 3.1Å; K207-H209 PolarHBondContact O-N 3.48Å; K207-H209 PolarHBondContact O-ND1 3.33Å
208E44.8Very low49.4Very low162 Ų162146.7 Ų146.776%0.75780%0.802SS**  trans-49.5105.9166.2-167-163.2154.400110.4G206 K210G206-E208 PolarHBondContact O-N 2.79Å; E208-K210 PolarHBondContact O-N 2.97Å
209H43.3Very low52.1Low178 Ų178144 Ų14482%0.82477%0.768SS**  trans-7478.3-180-84.358.7000110.9K207 R211K207-H209 PolarHBondContact O-N 3.48Å; K207-H209 PolarHBondContact O-ND1 3.33Å; H209-R211 VanDerWaalsContact C-N 3.25Å; H209-R211 PolarHBondContact O-N 3.45Å
210K49.7Very low54.9Low171 Ų171141 Ų14174%0.74375%0.745SS**  trans-67.381177.5-163.5171.4-168.4165.10110.4E208 S212E208-K210 PolarHBondContact O-N 2.97Å; K210-S212 PolarHBondContact O-N 3.29Å
211R51.7Low57.7Low231 Ų231141.5 Ų141.587%0.87273%0.733SS**  trans-38.8113.7178-138179.3-171.1-171.13.3109.8H209 K213H209-R211 VanDerWaalsContact C-N 3.25Å; H209-R211 PolarHBondContact O-N 3.45Å; R211-K213 PolarHBondContact O-N 3.45Å
212S50.3Low60.4Low118 Ų118139 Ų13983%0.82573%0.725SS**  trans-60.1104.3-17536.90000110K210 R214K210-S212 PolarHBondContact O-N 3.29Å; S212-R214 PolarHBondContact O-N 3.1Å
213K59.3Low63.3Low193 Ų193136.3 Ų136.384%0.83969%0.69SS**PPolyproline II helixtrans-66.5116.5179.3-71.3167.1-178169.40107.5R211R211-K213 PolarHBondContact O-N 3.45Å
214R69.2Low66.4Low220 Ų220138 Ų13883%0.8367%0.674SS**PPolyproline II helixtrans-47.5134.6178.6-64.9178.3-179.7176.6-2.4109.9S212 R216S212-R214 PolarHBondContact O-N 3.1Å; R214-R216 PolarHBondContact O-N 3Å
215P65.7Low69.1Low126 Ų126139.6 Ų139.682%0.81867%0.668SS**PPolyproline II helixtrans-58.1131.7-178.623.4-33000109.9
216R75.9Confident71.6Confident231 Ų231133.9 Ų133.987%0.87265%0.646SS**PPolyproline II helixtrans-72.8131179-70.8-174.7178.7125.8-5.5109.5R214 I218R214-R216 PolarHBondContact O-N 3Å; R216-I218 PolarHBondContact O-N 3.31Å; R216-I218 VanDerWaalsContact O-N 3.11Å
217T80Confident73.9Confident86 Ų86130.1 Ų130.153%0.52861%0.608SS.*  trans-62.2111.2168.6-45.40000109.7L219 L251T217-L219 HydrophobicContact CG2-CD1 4.5Å; T217-L251 HydrophobicContact CG2-CD2 4.05Å
218I84.4Confident76.4Confident151 Ų151127.9 Ų127.977%0.77460%0.598SS**  trans-89.5112.4174.5-58.7175.9000107.6R216R216-I218 PolarHBondContact O-N 3.31Å; R216-I218 VanDerWaalsContact O-N 3.11Å
219L90.7Very high78.7Confident26 Ų26122.8 Ų122.814%0.13658%0.583CS.*  trans-68.5148175-78.163.6000110.2T217 Q223 R224 F227 L251 V255 W259T217-L219 HydrophobicContact CG2-CD1 4.5Å; L219-Q223 VanDerWaalsContact CA-OE1 3.3Å; L219-Q223 HydrophobicContact CB-CB 4.48Å; L219-R224 HydrophobicContact CB-CG 4.21Å; L219-R224 HydrophobicContact CD2-CG 4.4Å; L219-R224 VanDerWaalsContact O-CZ 3.26Å; L219-R224 PolarHBondContact O-NH1 3.33Å; L219-R224 PolarHBondContact O-NH2 3.07Å; L219-F227 HydrophobicContact CD2-CD2 3.77Å; L219-F227 HydrophobicContact CD2-CE2 3.62Å; L219-F227 HydrophobicContact CG-CE2 4.43Å; L219-L251 HydrophobicContact CG-CD1 4.2Å; L219-V255 HydrophobicContact CD1-CG1 4.41Å; L219-W259 HydrophobicContact CD2-CG 4.35Å
220T92.6Very high81.2Confident71 Ų71115.8 Ų115.844%0.43656%0.555SS.*  trans-79.1167.8169.778.10000111.2Q222 Q223 R224T220-Q222 VanDerWaalsContact C-N 3.32Å; T220-Q222 PolarHBondContact OG1-N 3.33Å; T220-Q223 PolarHBondContact O-N 3.29Å; T220-Q223 VanDerWaalsContact OG1-CG 3.31Å; T220-Q223 WeakPolarHBondContact OG1-CG 3.45Å; T220-Q223 PolarHBondContact OG1-N 3.28Å; T220-R224 VanDerWaalsContact C-NH2 3.33Å; T220-R224 PolarHBondContact O-N 3.05Å
221T90.2Very high83.4Confident83 Ų83109.1 Ų109.151%0.50953%0.526SS..Hα-helixtrans-69.2-31.4177.2-62.60000112.1R224 R225T221-R224 PolarHBondContact OG1-NH2 2.89Å; T221-R224 VanDerWaalsContact OG1-NH2 3.07Å; T221-R225 WeakPolarHBondContact O-CG 3.28Å; T221-R225 PolarHBondContact O-N 3.06Å; T221-R225 VanDerWaalsContact O-N 3.08Å
222Q90.8Very high85.4Confident163 Ų163104.3 Ų104.376%0.76251%0.513SS*.Hα-helixtrans-67.1-47.6173.3-174.7174.6-1.800111.5T220 R224 R225 A226T220-Q222 VanDerWaalsContact C-N 3.32Å; T220-Q222 PolarHBondContact OG1-N 3.33Å; Q222-R224 VanDerWaalsContact C-N 3.32Å; Q222-R224 PolarHBondContact O-N 3.02Å; Q222-R225 PolarHBondContact O-N 3.45Å; Q222-R225 VanDerWaalsContact O-N 3.08Å; Q222-A226 PolarHBondContact O-N 3.23Å
223Q92.4Very high87.5Confident27 Ų27105 Ų10513%0.12651%0.512CS..Hα-helixtrans-58.5-42.5175.9-66.9170.5-22.200111.8L219 T220 R225 A226 F227 T249 L251L219-Q223 VanDerWaalsContact CA-OE1 3.3Å; L219-Q223 HydrophobicContact CB-CB 4.48Å; T220-Q223 PolarHBondContact O-N 3.29Å; T220-Q223 VanDerWaalsContact OG1-CG 3.31Å; T220-Q223 WeakPolarHBondContact OG1-CG 3.45Å; T220-Q223 PolarHBondContact OG1-N 3.28Å; Q223-R225 PolarHBondContact O-N 3.01Å; Q223-A226 PolarHBondContact O-N 3.05Å; Q223-F227 WeakPolarHBondContact O-CD2 3.41Å; Q223-F227 WeakPolarHBondContact O-CG 3.45Å; Q223-F227 PolarHBondContact O-N 3.08Å; Q223-T249 HydrophobicContact CB-CG2 4.33Å; Q223-T249 HydrophobicContact CG-CG2 4.16Å; Q223-T249 PolarHBondContact NE2-O 2.99Å; Q223-L251 HydrophobicContact CB-CD1 4.4Å; Q223-L251 HydrophobicContact CG-CD1 4.24Å
224R94.6Very high88.9Confident108 Ų10898 Ų9841%0.40849%0.487SS..Hα-helixtrans-61.2-39.5173.8-80.4-174.6-75.4-86.1-6.7113.4L219 T220 T221 Q222 K228L219-R224 HydrophobicContact CB-CG 4.21Å; L219-R224 HydrophobicContact CD2-CG 4.4Å; L219-R224 VanDerWaalsContact O-CZ 3.26Å; L219-R224 PolarHBondContact O-NH1 3.33Å; L219-R224 PolarHBondContact O-NH2 3.07Å; T220-R224 VanDerWaalsContact C-NH2 3.33Å; T220-R224 PolarHBondContact O-N 3.05Å; T221-R224 PolarHBondContact OG1-NH2 2.89Å; T221-R224 VanDerWaalsContact OG1-NH2 3.07Å; Q222-R224 VanDerWaalsContact C-N 3.32Å; Q222-R224 PolarHBondContact O-N 3.02Å; R224-K228 WeakPolarHBondContact O-CB 3.49Å; R224-K228 PolarHBondContact O-N 3.08Å
225R93.9Very high90Very high191 Ų19189.5 Ų89.572%0.72146%0.464SS*.Hα-helixtrans-66.2-46.9177.5-76.5177.1179.6-174.90.2111.1T221 Q222 Q223 K228 A229T221-R225 WeakPolarHBondContact O-CG 3.28Å; T221-R225 PolarHBondContact O-N 3.06Å; T221-R225 VanDerWaalsContact O-N 3.08Å; Q222-R225 PolarHBondContact O-N 3.45Å; Q222-R225 VanDerWaalsContact O-N 3.08Å; Q223-R225 PolarHBondContact O-N 3.01Å; R225-K228 PolarHBondContact O-N 2.88Å; R225-A229 PolarHBondContact O-N 2.91Å
226A93.1Very high91.3Very high32 Ų3291.3 Ų91.326%0.26446%0.459SS..Hα-helixtrans-56.9-51.8176.600000111.6Q222 Q223 K228 A229 S230 T249Q222-A226 PolarHBondContact O-N 3.23Å; Q223-A226 PolarHBondContact O-N 3.05Å; A226-K228 VanDerWaalsContact C-N 3.32Å; A226-K228 PolarHBondContact O-N 3.44Å; A226-A229 PolarHBondContact O-N 2.99Å; A226-S230 PolarHBondContact O-N 3.47Å; A226-S230 PolarHBondContact O-OG 2.92Å; A226-T249 HydrophobicContact CB-CG2 4.29Å
227F96.8Very high92Very high0 Ų080.8 Ų80.80%042%0.421CS..Hα-helixtrans-62.4-35177.7-63.8-29.2000113.7L219 Q223 F231 L245 T249 L251 V256 W259 F260L219-F227 HydrophobicContact CD2-CD2 3.77Å; L219-F227 HydrophobicContact CD2-CE2 3.62Å; L219-F227 HydrophobicContact CG-CE2 4.43Å; Q223-F227 WeakPolarHBondContact O-CD2 3.41Å; Q223-F227 WeakPolarHBondContact O-CG 3.45Å; Q223-F227 PolarHBondContact O-N 3.08Å; F227-F231 VanDerWaalsContact O-CB 3.28Å; F227-F231 WeakPolarHBondContact O-CB 3.42Å; F227-F231 PolarHBondContact O-N 3.37Å; F227-L245 HydrophobicContact CD1-CD1 4.3Å; F227-L245 HydrophobicContact CD1-CD2 4.15Å; F227-L245 HydrophobicContact CE1-CB 4.19Å; F227-L245 HydrophobicContact CE1-CD2 4.42Å; F227-T249 HydrophobicContact CD1-CG2 4.36Å; F227-T249 HydrophobicContact CE1-CG2 3.68Å; F227-T249 HydrophobicContact CZ-CG2 3.87Å; F227-L251 HydrophobicContact CE2-CD1 3.78Å; F227-L251 HydrophobicContact CZ-CD1 3.69Å; F227-V256 HydrophobicContact CD1-CG1 4.45Å; F227-V256 HydrophobicContact CE1-CB 4.36Å; F227-V256 HydrophobicContact CE1-CG1 3.94Å; F227-V256 HydrophobicContact CE1-CG2 3.85Å; F227-V256 HydrophobicContact CZ-CB 4.45Å; F227-V256 HydrophobicContact CZ-CG1 4.48Å; F227-V256 HydrophobicContact CZ-CG2 3.84Å; F227-W259 HydrophobicContact CB-CD2 3.78Å; F227-W259 HydrophobicContact CB-CE3 3.7Å; F227-W259 HydrophobicContact CB-CH2 3.62Å; F227-W259 HydrophobicContact CB-CZ2 3.68Å; F227-W259 HydrophobicContact CB-CZ3 3.63Å; F227-W259 HydrophobicContact CD2-CB 4.42Å; F227-W259 AromaticContact CD2-CD1 3.9Å; F227-W259 AromaticContact CD2-CD2 3.84Å; F227-W259 HydrophobicContact CD2-CD2 3.84Å; F227-W259 AromaticContact CD2-CE2 3.99Å; F227-W259 HydrophobicContact CD2-CE3 4.43Å; F227-W259 AromaticContact CD2-CG 3.8Å; F227-W259 HydrophobicContact CD2-CG 3.8Å; F227-W259 AromaticContact CD2-NE1 3.98Å; F227-W259 HydrophobicContact CE2-CG 4.34Å; F227-W259 HydrophobicContact CG-CD2 4.08Å; F227-W259 HydrophobicContact CG-CE3 4.23Å; F227-W259 HydrophobicContact CG-CG 4.45Å; F227-W259 WeakPolarHBondContact O-CZ3 3.28Å; F227-F260 HydrophobicContact CD1-CE2 4.33Å
228K94.4Very high92.7Very high118 Ų11880.4 Ų80.451%0.51342%0.421SS..Hα-helixtrans-67.2-46.5175.8-166-176.5-176.9-104.20111.7R224 R225 A226 S230 F231 E232R224-K228 WeakPolarHBondContact O-CB 3.49Å; R224-K228 PolarHBondContact O-N 3.08Å; R225-K228 PolarHBondContact O-N 2.88Å; A226-K228 VanDerWaalsContact C-N 3.32Å; A226-K228 PolarHBondContact O-N 3.44Å; K228-S230 VanDerWaalsContact C-N 3.35Å; K228-S230 PolarHBondContact O-N 3.21Å; K228-F231 WeakPolarHBondContact O-CB 3.39Å; K228-F231 PolarHBondContact O-N 2.85Å; K228-F231 VanDerWaalsContact O-N 3.09Å; K228-E232 VanDerWaalsContact CE-OE1 3.28Å; K228-E232 WeakPolarHBondContact CE-OE1 3.49Å; K228-E232 IonicContact NZ-OE1 2.92Å; K228-E232 PolarHBondContact NZ-OE1 3.48Å; K228-E232 WeakPolarHBondContact O-CG 3.43Å; K228-E232 PolarHBondContact O-N 2.93Å
229A94.7Very high93.1Very high54 Ų5480 Ų8045%0.44641%0.409SS..Hα-helixtrans-58.5-45.5177.900000111.6R225 A226 F231 E232 V233R225-A229 PolarHBondContact O-N 2.91Å; A226-A229 PolarHBondContact O-N 2.99Å; A229-F231 VanDerWaalsContact C-N 3.33Å; A229-F231 PolarHBondContact O-N 2.82Å; A229-E232 PolarHBondContact O-N 2.84Å; A229-V233 PolarHBondContact O-N 2.66Å
230S95Very high93.2Very high32 Ų3286.3 Ų86.322%0.22444%0.436CS..Hα-helixtrans-69-27.9175.8-54.30000113.8A226 K228 V233 S234A226-S230 PolarHBondContact O-N 3.47Å; A226-S230 PolarHBondContact O-OG 2.92Å; K228-S230 VanDerWaalsContact C-N 3.35Å; K228-S230 PolarHBondContact O-N 3.21Å; S230-V233 PolarHBondContact O-N 3.13Å; S230-S234 PolarHBondContact O-N 3.25Å
231F96.3Very high93.4Very high31 Ų3185.8 Ų85.814%0.13643%0.432CS..Hα-helixtrans-70.6-34.7174.8-171.9-84.8000112.7F227 K228 A229 V233 S234 A235 W259 F260 Q263 R264 M267F227-F231 VanDerWaalsContact O-CB 3.28Å; F227-F231 WeakPolarHBondContact O-CB 3.42Å; F227-F231 PolarHBondContact O-N 3.37Å; K228-F231 WeakPolarHBondContact O-CB 3.39Å; K228-F231 PolarHBondContact O-N 2.85Å; K228-F231 VanDerWaalsContact O-N 3.09Å; A229-F231 VanDerWaalsContact C-N 3.33Å; A229-F231 PolarHBondContact O-N 2.82Å; F231-V233 VanDerWaalsContact C-N 3.31Å; F231-S234 CarbonylContact O-C 3.6Å; F231-S234 PolarHBondContact O-N 3.32Å; F231-A235 HydrophobicContact CE1-CB 4.21Å; F231-A235 HydrophobicContact CE2-CB 3.94Å; F231-A235 HydrophobicContact CZ-CB 3.75Å; F231-A235 PolarHBondContact O-N 3.3Å; F231-W259 HydrophobicContact CB-CH2 4.32Å; F231-W259 HydrophobicContact CB-CZ3 4.1Å; F231-W259 HydrophobicContact CD2-CZ3 4.09Å; F231-W259 HydrophobicContact CG-CZ3 4.39Å; F231-F260 HydrophobicContact CB-CE1 3.86Å; F231-F260 HydrophobicContact CB-CZ 4.39Å; F231-F260 AromaticContact CD2-CD1 3.6Å; F231-F260 HydrophobicContact CD2-CD1 3.6Å; F231-F260 AromaticContact CD2-CE1 3.71Å; F231-F260 HydrophobicContact CD2-CE1 3.71Å; F231-F260 HydrophobicContact CE2-CD1 4.3Å; F231-F260 HydrophobicContact CG-CE1 4.26Å; F231-Q263 HydrophobicContact CD1-CG 4.25Å; F231-Q263 HydrophobicContact CD2-CB 4.2Å; F231-Q263 HydrophobicContact CD2-CG 3.67Å; F231-Q263 HydrophobicContact CE1-CG 4.1Å; F231-Q263 HydrophobicContact CE2-CB 3.92Å; F231-Q263 HydrophobicContact CE2-CG 3.5Å; F231-Q263 HydrophobicContact CG-CG 4.07Å; F231-Q263 HydrophobicContact CZ-CB 4.49Å; F231-Q263 HydrophobicContact CZ-CG 3.73Å; F231-R264 HydrophobicContact CE2-CG 3.91Å; F231-R264 HydrophobicContact CZ-CG 4.17Å; F231-M267 HydrophobicContact CE1-CG 4.29Å; F231-M267 HydrophobicContact CZ-CG 4.2Å
232E94.1Very high93.7Very high129 Ų12984.7 Ų84.760%0.60342%0.419SS*.Hα-helixtrans-65.5-35.4174.6-71.7165-174.400111.2K228 A229K228-E232 VanDerWaalsContact CE-OE1 3.28Å; K228-E232 WeakPolarHBondContact CE-OE1 3.49Å; K228-E232 IonicContact NZ-OE1 2.92Å; K228-E232 PolarHBondContact NZ-OE1 3.48Å; K228-E232 WeakPolarHBondContact O-CG 3.43Å; K228-E232 PolarHBondContact O-N 2.93Å; A229-E232 PolarHBondContact O-N 2.84Å
233V93.4Very high93.9Very high132 Ų13280.6 Ų80.680%0.840%0.4SS*.Hα-helixtrans-74.2-42.3171.6-179.40000112A229 S230 F231A229-V233 PolarHBondContact O-N 2.66Å; S230-V233 PolarHBondContact O-N 3.13Å; F231-V233 VanDerWaalsContact C-N 3.31Å
234S89.6Confident94.1Very high47 Ų4782.4 Ų82.433%0.32941%0.413SS..  trans-153118.9175.5-179.80000113.3S230 F231 K236 P237S230-S234 PolarHBondContact O-N 3.25Å; F231-S234 CarbonylContact O-C 3.6Å; F231-S234 PolarHBondContact O-N 3.32Å; S234-K236 PolarHBondContact O-N 2.9Å; S234-K236 PolarHBondContact OG-N 2.86Å; S234-K236 PolarHBondContact OG-O 3.21Å; S234-P237 WeakPolarHBondContact O-CD 3.44Å
235A90.5Very high94.1Very high42 Ų4277.4 Ų77.435%0.34739%0.394SS..SBendtrans-66.4-12.9171.300000113.6F231 R264F231-A235 HydrophobicContact CE1-CB 4.21Å; F231-A235 HydrophobicContact CE2-CB 3.94Å; F231-A235 HydrophobicContact CZ-CB 3.75Å; F231-A235 PolarHBondContact O-N 3.3Å; A235-R264 VanDerWaalsContact O-CD 3.31Å; A235-R264 WeakPolarHBondContact O-CD 3.36Å; A235-R264 PolarHBondContact O-NH1 2.91Å
236K93.4Very high94.3Very high163 Ų16368.8 Ų68.871%0.70936%0.364SS*.SBendtrans-133.172.1178-67.7-178.2-177.3175.10109.7S234 C238S234-K236 PolarHBondContact O-N 2.9Å; S234-K236 PolarHBondContact OG-N 2.86Å; S234-K236 PolarHBondContact OG-O 3.21Å; K236-C238 PolarHBondContact O-N 3.17Å
237P91.5Very high94.4Very high10 Ų1071.2 Ų71.27%0.06538%0.384CS..  trans-62.2137.1-178.327.7-37.1000111.4S234 V241 R242 F260S234-P237 WeakPolarHBondContact O-CD 3.44Å; P237-V241 HydrophobicContact CB-CB 4.09Å; P237-V241 HydrophobicContact CB-CG1 3.73Å; P237-R242 HydrophobicContact CB-CG 4.02Å; P237-R242 HydrophobicContact CG-CG 3.71Å; P237-R242 PolarHBondContact O-NE 3.31Å; P237-F260 HydrophobicContact CB-CE1 4.4Å; P237-F260 HydrophobicContact CG-CD1 3.53Å; P237-F260 HydrophobicContact CG-CD2 4.08Å; P237-F260 HydrophobicContact CG-CE1 3.51Å; P237-F260 HydrophobicContact CG-CE2 4.08Å; P237-F260 HydrophobicContact CG-CG 3.84Å; P237-F260 HydrophobicContact CG-CZ 3.81Å
238C94.6Very high94.2Very high78 Ų7877.9 Ų77.953%0.52742%0.415SS..  trans-65.3170.2175.870.70000111.3K236 K240 V241 R242K236-C238 PolarHBondContact O-N 3.17Å; C238-K240 PolarHBondContact O-N 3.09Å; C238-V241 PolarHBondContact O-N 3.06Å; C238-R242 PolarHBondContact O-N 3.32Å; C238-R242 VanDerWaalsContact O-N 3.11Å
239R92.6Very high94.2Very high142 Ų14273 Ų7354%0.53640%0.395SS..Hα-helixtrans-54.3-52.3-177.2179.9172.5176.41522.8112.3V241 R242 E243R239-V241 PolarHBondContact O-N 3.39Å; R239-R242 WeakPolarHBondContact O-CB 3.31Å; R239-R242 PolarHBondContact O-N 2.91Å; R239-E243 HydrophobicContact CG-CG 4.39Å; R239-E243 WeakPolarHBondContact CG-OE1 2.84Å; R239-E243 IonicContact CZ-OE1 3.57Å; R239-E243 IonicContact NE-OE1 3.5Å; R239-E243 PolarHBondContact NE-OE1 3.01Å; R239-E243 IonicContact NH2-OE1 2.85Å; R239-E243 PolarHBondContact NH2-OE1 3.35Å; R239-E243 WeakPolarHBondContact O-CG 3.35Å; R239-E243 PolarHBondContact O-N 3.44Å
240K93.8Very high94.1Very high159 Ų15973.7 Ų73.769%0.69141%0.408SS*.Hα-helixtrans-54.8-46179.3-170.3173.4-176.81770112.7C238 R242 E243 T244C238-K240 PolarHBondContact O-N 3.09Å; K240-R242 VanDerWaalsContact C-N 3.34Å; K240-R242 PolarHBondContact O-N 3.42Å; K240-E243 PolarHBondContact O-N 3.48Å; K240-T244 PolarHBondContact O-N 3.43Å; K240-T244 PolarHBondContact O-OG1 3.35Å; K240-T244 VanDerWaalsContact O-OG1 3.11Å
241V95.8Very high94.1Very high60 Ų6073.4 Ų73.436%0.36440%0.404SS..Hα-helixtrans-64.4-36.8177.7172.90000111.9P237 C238 R239 L245P237-V241 HydrophobicContact CB-CB 4.09Å; P237-V241 HydrophobicContact CB-CG1 3.73Å; C238-V241 PolarHBondContact O-N 3.06Å; R239-V241 PolarHBondContact O-N 3.39Å; V241-L245 HydrophobicContact CG1-CD1 4.09Å; V241-L245 VanDerWaalsContact O-CB 3.32Å; V241-L245 WeakPolarHBondContact O-CB 3.38Å; V241-L245 WeakPolarHBondContact O-CG 3.41Å; V241-L245 PolarHBondContact O-N 3.01Å
242R96.3Very high94Very high60 Ų6076.2 Ų76.223%0.22642%0.424CS..Hα-helixtrans-69.8-35.2175.4-70.9-174.1-77.9141.4-2.2112.7P237 C238 R239 K240 A246 V253 V256P237-R242 HydrophobicContact CB-CG 4.02Å; P237-R242 HydrophobicContact CG-CG 3.71Å; P237-R242 PolarHBondContact O-NE 3.31Å; C238-R242 PolarHBondContact O-N 3.32Å; C238-R242 VanDerWaalsContact O-N 3.11Å; R239-R242 WeakPolarHBondContact O-CB 3.31Å; R239-R242 PolarHBondContact O-N 2.91Å; K240-R242 VanDerWaalsContact C-N 3.34Å; K240-R242 PolarHBondContact O-N 3.42Å; R242-A246 WeakPolarHBondContact O-CB 3.49Å; R242-A246 PolarHBondContact O-N 3.06Å; R242-V253 HydrophobicContact CB-CG1 4.37Å; R242-V256 HydrophobicContact CB-CG1 4.41Å; R242-V256 HydrophobicContact CG-CG1 4.33Å
243E96.1Very high93.9Very high77 Ų7772.8 Ų72.836%0.3641%0.411SS..Hα-helixtrans-69.9-44.9175.5-71.5164.9163.600111.2R239 K240 A246 A247 V253R239-E243 HydrophobicContact CG-CG 4.39Å; R239-E243 WeakPolarHBondContact CG-OE1 2.84Å; R239-E243 IonicContact CZ-OE1 3.57Å; R239-E243 IonicContact NE-OE1 3.5Å; R239-E243 PolarHBondContact NE-OE1 3.01Å; R239-E243 IonicContact NH2-OE1 2.85Å; R239-E243 PolarHBondContact NH2-OE1 3.35Å; R239-E243 WeakPolarHBondContact O-CG 3.35Å; R239-E243 PolarHBondContact O-N 3.44Å; K240-E243 PolarHBondContact O-N 3.48Å; E243-A246 WeakPolarHBondContact O-CB 3.46Å; E243-A246 PolarHBondContact O-N 3.36Å; E243-A247 PolarHBondContact O-N 2.9Å; E243-V253 HydrophobicContact CG-CG2 4.31Å
244T94.9Very high94Very high65 Ų6573.2 Ų73.240%0.39940%0.399SS..Hα-helixtrans-57.7-50.2171.9-610000111.4K240 A246 A247 E248K240-T244 PolarHBondContact O-N 3.43Å; K240-T244 PolarHBondContact O-OG1 3.35Å; K240-T244 VanDerWaalsContact O-OG1 3.11Å; T244-A246 VanDerWaalsContact C-N 3.29Å; T244-A246 PolarHBondContact O-N 3.05Å; T244-A247 PolarHBondContact O-N 3.42Å; T244-E248 HydrophobicContact CG2-CG 4.29Å; T244-E248 VanDerWaalsContact CG2-OE1 3.27Å; T244-E248 WeakPolarHBondContact CG2-OE1 3.13Å; T244-E248 WeakPolarHBondContact O-CG 3.29Å; T244-E248 PolarHBondContact O-N 3.25Å
245L95.7Very high94.2Very high4 Ų472.5 Ų72.52%0.02139%0.392CS..Hα-helixtrans-61.2-35177.2-81.7172000113.3F227 V241 T249 V256 F260F227-L245 HydrophobicContact CD1-CD1 4.3Å; F227-L245 HydrophobicContact CD1-CD2 4.15Å; F227-L245 HydrophobicContact CE1-CB 4.19Å; F227-L245 HydrophobicContact CE1-CD2 4.42Å; V241-L245 HydrophobicContact CG1-CD1 4.09Å; V241-L245 VanDerWaalsContact O-CB 3.32Å; V241-L245 WeakPolarHBondContact O-CB 3.38Å; V241-L245 WeakPolarHBondContact O-CG 3.41Å; V241-L245 PolarHBondContact O-N 3.01Å; L245-T249 VanDerWaalsContact O-CB 3.3Å; L245-T249 WeakPolarHBondContact O-CB 3.43Å; L245-T249 WeakPolarHBondContact O-CG2 3.41Å; L245-T249 PolarHBondContact O-N 2.98Å; L245-T249 PolarHBondContact O-OG1 3.33Å; L245-V256 HydrophobicContact CB-CG1 4.14Å; L245-V256 HydrophobicContact CD1-CG1 4.36Å; L245-F260 HydrophobicContact CD1-CE2 3.96Å; L245-F260 HydrophobicContact CD1-CZ 4.11Å
246A97.1Very high94.4Very high9 Ų970.5 Ų70.57%0.07438%0.376CS..Hα-helixtrans-64.3-46.5175.400000111.3R242 E243 T244 G250 L251 V253 V256R242-A246 WeakPolarHBondContact O-CB 3.49Å; R242-A246 PolarHBondContact O-N 3.06Å; E243-A246 WeakPolarHBondContact O-CB 3.46Å; E243-A246 PolarHBondContact O-N 3.36Å; T244-A246 VanDerWaalsContact C-N 3.29Å; T244-A246 PolarHBondContact O-N 3.05Å; A246-G250 PolarHBondContact O-N 2.84Å; A246-L251 CarbonylContact C-O 3.53Å; A246-L251 VanDerWaalsContact CA-O 3.31Å; A246-L251 WeakPolarHBondContact CA-O 3.46Å; A246-L251 VanDerWaalsContact CB-O 3.22Å; A246-L251 WeakPolarHBondContact CB-O 3.43Å; A246-L251 PolarHBondContact O-N 3.23Å; A246-L251 VanDerWaalsContact O-N 3.14Å; A246-V253 HydrophobicContact CB-CB 4.36Å; A246-V253 HydrophobicContact CB-CG2 3.61Å; A246-V256 HydrophobicContact CB-CG2 3.96Å
247A95.5Very high94.5Very high84 Ų8465.6 Ų65.669%0.69436%0.355SS*.Hα-helixtrans-62.5-49176.100000112.2E243 T244 T249 G250E243-A247 PolarHBondContact O-N 2.9Å; T244-A247 PolarHBondContact O-N 3.42Å; A247-T249 VanDerWaalsContact C-N 3.35Å; A247-T249 PolarHBondContact O-N 3.32Å; A247-G250 PolarHBondContact O-N 3.05Å
248E93.4Very high94.7Very high139 Ų13967.6 Ų67.665%0.6537%0.367SS*.Hα-helixtrans-64.9-33.9180-72174.2177.700113.5T244T244-E248 HydrophobicContact CG2-CG 4.29Å; T244-E248 VanDerWaalsContact CG2-OE1 3.27Å; T244-E248 WeakPolarHBondContact CG2-OE1 3.13Å; T244-E248 WeakPolarHBondContact O-CG 3.29Å; T244-E248 PolarHBondContact O-N 3.25Å
249T93.2Very high94.8Very high15 Ų1566 Ų669%0.09235%0.35CS..Hα-helixtrans-91.6-9.2-178.959.50000114.2Q223 A226 F227 L245 A247 L251Q223-T249 HydrophobicContact CB-CG2 4.33Å; Q223-T249 HydrophobicContact CG-CG2 4.16Å; Q223-T249 PolarHBondContact NE2-O 2.99Å; A226-T249 HydrophobicContact CB-CG2 4.29Å; F227-T249 HydrophobicContact CD1-CG2 4.36Å; F227-T249 HydrophobicContact CE1-CG2 3.68Å; F227-T249 HydrophobicContact CZ-CG2 3.87Å; L245-T249 VanDerWaalsContact O-CB 3.3Å; L245-T249 WeakPolarHBondContact O-CB 3.43Å; L245-T249 WeakPolarHBondContact O-CG2 3.41Å; L245-T249 PolarHBondContact O-N 2.98Å; L245-T249 PolarHBondContact O-OG1 3.33Å; A247-T249 VanDerWaalsContact C-N 3.35Å; A247-T249 PolarHBondContact O-N 3.32Å; T249-L251 PolarHBondContact O-N 3.12Å
250G93.5Very high95Very high70 Ų7059.3 Ų59.372%0.72233%0.325SS*.THydrogen-bonded Turntrans64.327.3-172.800000113.2A246 A247A246-G250 PolarHBondContact O-N 2.84Å; A247-G250 PolarHBondContact O-N 3.05Å
251L95.1Very high95.1Very high25 Ų2555.6 Ų55.613%0.13131%0.31CS..  trans-116.2151.6-177.7-66.8173.5000110.2T217 L219 Q223 F227 A246 T249 V255T217-L251 HydrophobicContact CG2-CD2 4.05Å; L219-L251 HydrophobicContact CG-CD1 4.2Å; Q223-L251 HydrophobicContact CB-CD1 4.4Å; Q223-L251 HydrophobicContact CG-CD1 4.24Å; F227-L251 HydrophobicContact CE2-CD1 3.78Å; F227-L251 HydrophobicContact CZ-CD1 3.69Å; A246-L251 CarbonylContact C-O 3.53Å; A246-L251 VanDerWaalsContact CA-O 3.31Å; A246-L251 WeakPolarHBondContact CA-O 3.46Å; A246-L251 VanDerWaalsContact CB-O 3.22Å; A246-L251 WeakPolarHBondContact CB-O 3.43Å; A246-L251 PolarHBondContact O-N 3.23Å; A246-L251 VanDerWaalsContact O-N 3.14Å; T249-L251 PolarHBondContact O-N 3.12Å; L251-V255 HydrophobicContact CB-CB 4.34Å; L251-V255 HydrophobicContact CB-CG1 4.27Å; L251-V255 HydrophobicContact CD1-CG1 4.05Å; L251-V255 HydrophobicContact CD2-CG1 4.36Å; L251-V255 HydrophobicContact CG-CG1 4.47Å
252T94.1Very high95.1Very high91 Ų9157.8 Ų57.856%0.55832%0.32SS*.  trans-66.1147.3176.568.60000110.9R254 V255 V256T252-R254 PolarHBondContact O-N 3.07Å; T252-V255 WeakPolarHBondContact O-CA 3.42Å; T252-V255 WeakPolarHBondContact O-CB 3.49Å; T252-V255 PolarHBondContact O-N 3.35Å; T252-V255 WeakPolarHBondContact OG1-CG2 3.5Å; T252-V255 PolarHBondContact OG1-N 2.89Å; T252-V256 PolarHBondContact O-N 3.42Å; T252-V256 VanDerWaalsContact O-N 3.15Å
253V93Very high95Very high57 Ų5756.8 Ų56.835%0.34532%0.318SS..Hα-helixtrans-53.1-31.3176-176.70000111.5R242 E243 A246 V256 Q257R242-V253 HydrophobicContact CB-CG1 4.37Å; E243-V253 HydrophobicContact CG-CG2 4.31Å; A246-V253 HydrophobicContact CB-CB 4.36Å; A246-V253 HydrophobicContact CB-CG2 3.61Å; V253-V256 PolarHBondContact O-N 2.93Å; V253-Q257 WeakPolarHBondContact O-CB 3.48Å; V253-Q257 PolarHBondContact O-N 3.3Å
254R93.7Very high94.9Very high141 Ų14157.1 Ų57.153%0.53232%0.315SS..Hα-helixtrans-65.7-40.5173.7-170172.4-179.191.2-1.3112.9T252 Q257 V258T252-R254 PolarHBondContact O-N 3.07Å; R254-Q257 PolarHBondContact O-N 3.44Å; R254-V258 HydrophobicContact CG-CG2 4.39Å; R254-V258 WeakPolarHBondContact O-CB 3.36Å; R254-V258 VanDerWaalsContact O-CG2 3.27Å; R254-V258 WeakPolarHBondContact O-CG2 3.45Å; R254-V258 PolarHBondContact O-N 3.43Å
255V94.7Very high94.9Very high32 Ų3256.8 Ų56.819%0.19432%0.32CS..Hα-helixtrans-64.4-43.1174.3171.80000110.6L219 L251 T252 V258 W259L219-V255 HydrophobicContact CD1-CG1 4.41Å; L251-V255 HydrophobicContact CB-CB 4.34Å; L251-V255 HydrophobicContact CB-CG1 4.27Å; L251-V255 HydrophobicContact CD1-CG1 4.05Å; L251-V255 HydrophobicContact CD2-CG1 4.36Å; L251-V255 HydrophobicContact CG-CG1 4.47Å; T252-V255 WeakPolarHBondContact O-CA 3.42Å; T252-V255 WeakPolarHBondContact O-CB 3.49Å; T252-V255 PolarHBondContact O-N 3.35Å; T252-V255 WeakPolarHBondContact OG1-CG2 3.5Å; T252-V255 PolarHBondContact OG1-N 2.89Å; V255-V258 PolarHBondContact O-N 3.32Å; V255-W259 WeakPolarHBondContact O-CB 3.23Å; V255-W259 PolarHBondContact O-N 2.82Å
256V95.6Very high94.7Very high0 Ų062.5 Ų62.50%034%0.344CS..Hα-helixtrans-58.3-51.2173.6-174.30000110.2F227 R242 L245 A246 T252 V253 V258 W259 F260F227-V256 HydrophobicContact CD1-CG1 4.45Å; F227-V256 HydrophobicContact CE1-CB 4.36Å; F227-V256 HydrophobicContact CE1-CG1 3.94Å; F227-V256 HydrophobicContact CE1-CG2 3.85Å; F227-V256 HydrophobicContact CZ-CB 4.45Å; F227-V256 HydrophobicContact CZ-CG1 4.48Å; F227-V256 HydrophobicContact CZ-CG2 3.84Å; R242-V256 HydrophobicContact CB-CG1 4.41Å; R242-V256 HydrophobicContact CG-CG1 4.33Å; L245-V256 HydrophobicContact CB-CG1 4.14Å; L245-V256 HydrophobicContact CD1-CG1 4.36Å; A246-V256 HydrophobicContact CB-CG2 3.96Å; T252-V256 PolarHBondContact O-N 3.42Å; T252-V256 VanDerWaalsContact O-N 3.15Å; V253-V256 PolarHBondContact O-N 2.93Å; V256-V258 PolarHBondContact O-N 3.36Å; V256-W259 WeakPolarHBondContact O-CB 3.49Å; V256-W259 PolarHBondContact O-N 2.96Å; V256-F260 HydrophobicContact CG1-CD2 3.97Å; V256-F260 HydrophobicContact CG1-CE2 3.98Å; V256-F260 WeakPolarHBondContact O-CD2 3.35Å; V256-F260 PolarHBondContact O-N 3.23Å
257Q95.4Very high94.3Very high59 Ų5965.9 Ų65.928%0.27636%0.36SS..Hα-helixtrans-58.3-47179.4174.6168.7-32.500113V253 R254 W259 F260 Q261V253-Q257 WeakPolarHBondContact O-CB 3.48Å; V253-Q257 PolarHBondContact O-N 3.3Å; R254-Q257 PolarHBondContact O-N 3.44Å; Q257-W259 VanDerWaalsContact C-N 3.32Å; Q257-W259 PolarHBondContact O-N 3.05Å; Q257-F260 PolarHBondContact O-N 2.97Å; Q257-Q261 VanDerWaalsContact O-CG 3.31Å; Q257-Q261 WeakPolarHBondContact O-CG 3.37Å; Q257-Q261 PolarHBondContact O-N 3.01Å
258V95.5Very high94.2Very high52 Ų5269 Ų6932%0.31536%0.357SS..Hα-helixtrans-64.6-37.3177.8169.20000111R254 V255 V256 Q261 N262R254-V258 HydrophobicContact CG-CG2 4.39Å; R254-V258 WeakPolarHBondContact O-CB 3.36Å; R254-V258 VanDerWaalsContact O-CG2 3.27Å; R254-V258 WeakPolarHBondContact O-CG2 3.45Å; R254-V258 PolarHBondContact O-N 3.43Å; V255-V258 PolarHBondContact O-N 3.32Å; V256-V258 PolarHBondContact O-N 3.36Å; V258-Q261 PolarHBondContact O-N 3.39Å; V258-N262 WeakPolarHBondContact O-CB 3.41Å; V258-N262 VanDerWaalsContact O-CG 3.23Å; V258-N262 PolarHBondContact O-N 3.35Å; V258-N262 PolarHBondContact O-ND2 3.43Å
259W95.7Very high94.1Very high44 Ų4469.5 Ų69.517%0.16736%0.357CS..Hα-helixtrans-60.2-49.6174-171.696.3000111.5L219 F227 F231 V255 V256 Q257 Q261 N262 Q263L219-W259 HydrophobicContact CD2-CG 4.35Å; F227-W259 HydrophobicContact CB-CD2 3.78Å; F227-W259 HydrophobicContact CB-CE3 3.7Å; F227-W259 HydrophobicContact CB-CH2 3.62Å; F227-W259 HydrophobicContact CB-CZ2 3.68Å; F227-W259 HydrophobicContact CB-CZ3 3.63Å; F227-W259 HydrophobicContact CD2-CB 4.42Å; F227-W259 AromaticContact CD2-CD1 3.9Å; F227-W259 AromaticContact CD2-CD2 3.84Å; F227-W259 HydrophobicContact CD2-CD2 3.84Å; F227-W259 AromaticContact CD2-CE2 3.99Å; F227-W259 HydrophobicContact CD2-CE3 4.43Å; F227-W259 AromaticContact CD2-CG 3.8Å; F227-W259 HydrophobicContact CD2-CG 3.8Å; F227-W259 AromaticContact CD2-NE1 3.98Å; F227-W259 HydrophobicContact CE2-CG 4.34Å; F227-W259 HydrophobicContact CG-CD2 4.08Å; F227-W259 HydrophobicContact CG-CE3 4.23Å; F227-W259 HydrophobicContact CG-CG 4.45Å; F227-W259 WeakPolarHBondContact O-CZ3 3.28Å; F231-W259 HydrophobicContact CB-CH2 4.32Å; F231-W259 HydrophobicContact CB-CZ3 4.1Å; F231-W259 HydrophobicContact CD2-CZ3 4.09Å; F231-W259 HydrophobicContact CG-CZ3 4.39Å; V255-W259 WeakPolarHBondContact O-CB 3.23Å; V255-W259 PolarHBondContact O-N 2.82Å; V256-W259 WeakPolarHBondContact O-CB 3.49Å; V256-W259 PolarHBondContact O-N 2.96Å; Q257-W259 VanDerWaalsContact C-N 3.32Å; Q257-W259 PolarHBondContact O-N 3.05Å; W259-Q261 VanDerWaalsContact C-N 3.35Å; W259-Q261 PolarHBondContact O-N 2.93Å; W259-N262 PolarHBondContact O-N 3.41Å; W259-Q263 HydrophobicContact CE3-CB 4.2Å; W259-Q263 HydrophobicContact CH2-CB 4.25Å; W259-Q263 HydrophobicContact CH2-CG 3.95Å; W259-Q263 HydrophobicContact CZ3-CB 3.98Å; W259-Q263 HydrophobicContact CZ3-CG 4.02Å; W259-Q263 WeakPolarHBondContact O-CB 3.45Å; W259-Q263 PolarHBondContact O-N 3.47Å
260F97.1Very high93.8Very high2 Ų271.7 Ų71.71%0.00937%0.368CS..Hα-helixtrans-65.4-34.6178.1-86.2-93.4000112.9F227 F231 P237 L245 V256 Q257 R264F227-F260 HydrophobicContact CD1-CE2 4.33Å; F231-F260 HydrophobicContact CB-CE1 3.86Å; F231-F260 HydrophobicContact CB-CZ 4.39Å; F231-F260 AromaticContact CD2-CD1 3.6Å; F231-F260 HydrophobicContact CD2-CD1 3.6Å; F231-F260 AromaticContact CD2-CE1 3.71Å; F231-F260 HydrophobicContact CD2-CE1 3.71Å; F231-F260 HydrophobicContact CE2-CD1 4.3Å; F231-F260 HydrophobicContact CG-CE1 4.26Å; P237-F260 HydrophobicContact CB-CE1 4.4Å; P237-F260 HydrophobicContact CG-CD1 3.53Å; P237-F260 HydrophobicContact CG-CD2 4.08Å; P237-F260 HydrophobicContact CG-CE1 3.51Å; P237-F260 HydrophobicContact CG-CE2 4.08Å; P237-F260 HydrophobicContact CG-CG 3.84Å; P237-F260 HydrophobicContact CG-CZ 3.81Å; L245-F260 HydrophobicContact CD1-CE2 3.96Å; L245-F260 HydrophobicContact CD1-CZ 4.11Å; V256-F260 HydrophobicContact CG1-CD2 3.97Å; V256-F260 HydrophobicContact CG1-CE2 3.98Å; V256-F260 WeakPolarHBondContact O-CD2 3.35Å; V256-F260 PolarHBondContact O-N 3.23Å; Q257-F260 PolarHBondContact O-N 2.97Å; F260-R264 WeakPolarHBondContact O-CG 3.37Å; F260-R264 PolarHBondContact O-N 2.67Å; F260-R264 VanDerWaalsContact O-N 3.1Å; F260-R264 PolarHBondContact O-NH1 2.98Å
261Q95.1Very high93.4Very high81 Ų8170.3 Ų70.338%0.37935%0.35SS..Hα-helixtrans-63.9-50.2172.6-74.3172.5-12.200111.5Q257 V258 W259 Q263 R264 A265Q257-Q261 VanDerWaalsContact O-CG 3.31Å; Q257-Q261 WeakPolarHBondContact O-CG 3.37Å; Q257-Q261 PolarHBondContact O-N 3.01Å; V258-Q261 PolarHBondContact O-N 3.39Å; W259-Q261 VanDerWaalsContact C-N 3.35Å; W259-Q261 PolarHBondContact O-N 2.93Å; Q261-Q263 VanDerWaalsContact C-N 3.34Å; Q261-Q263 PolarHBondContact O-N 2.86Å; Q261-R264 PolarHBondContact O-N 2.85Å; Q261-A265 PolarHBondContact O-N 3.47Å
262N95.7Very high92.7Very high106 Ų10674.3 Ų74.357%0.56737%0.368SS*.Hα-helixtrans-63.2-38.7178.7-71.9-18.5000112.1V258 W259 A265 K266V258-N262 WeakPolarHBondContact O-CB 3.41Å; V258-N262 VanDerWaalsContact O-CG 3.23Å; V258-N262 PolarHBondContact O-N 3.35Å; V258-N262 PolarHBondContact O-ND2 3.43Å; W259-N262 PolarHBondContact O-N 3.41Å; N262-A265 PolarHBondContact O-N 3.37Å; N262-K266 WeakPolarHBondContact O-CB 3.32Å; N262-K266 PolarHBondContact O-N 3.3Å
263Q94.2Very high92Very high40 Ų4076.3 Ų76.319%0.18737%0.371CS..Hα-helixtrans-66.2-41.9177.5-174.961.514.700111.7F231 W259 Q261 K266 M267F231-Q263 HydrophobicContact CD1-CG 4.25Å; F231-Q263 HydrophobicContact CD2-CB 4.2Å; F231-Q263 HydrophobicContact CD2-CG 3.67Å; F231-Q263 HydrophobicContact CE1-CG 4.1Å; F231-Q263 HydrophobicContact CE2-CB 3.92Å; F231-Q263 HydrophobicContact CE2-CG 3.5Å; F231-Q263 HydrophobicContact CG-CG 4.07Å; F231-Q263 HydrophobicContact CZ-CB 4.49Å; F231-Q263 HydrophobicContact CZ-CG 3.73Å; W259-Q263 HydrophobicContact CE3-CB 4.2Å; W259-Q263 HydrophobicContact CH2-CB 4.25Å; W259-Q263 HydrophobicContact CH2-CG 3.95Å; W259-Q263 HydrophobicContact CZ3-CB 3.98Å; W259-Q263 HydrophobicContact CZ3-CG 4.02Å; W259-Q263 WeakPolarHBondContact O-CB 3.45Å; W259-Q263 PolarHBondContact O-N 3.47Å; Q261-Q263 VanDerWaalsContact C-N 3.34Å; Q261-Q263 PolarHBondContact O-N 2.86Å; Q263-K266 PolarHBondContact O-N 2.82Å; Q263-M267 WeakPolarHBondContact O-CG 3.36Å; Q263-M267 PolarHBondContact O-N 2.89Å
264R95.3Very high91.2Very high83 Ų8380.1 Ų80.131%0.31339%0.385SS..Hα-helixtrans-63.6-41.6171.6-73.9-167.4-60.2-83.5-3.4112.5F231 A235 F260 Q261 K266 M267 K268F231-R264 HydrophobicContact CE2-CG 3.91Å; F231-R264 HydrophobicContact CZ-CG 4.17Å; A235-R264 VanDerWaalsContact O-CD 3.31Å; A235-R264 WeakPolarHBondContact O-CD 3.36Å; A235-R264 PolarHBondContact O-NH1 2.91Å; F260-R264 WeakPolarHBondContact O-CG 3.37Å; F260-R264 PolarHBondContact O-N 2.67Å; F260-R264 VanDerWaalsContact O-N 3.1Å; F260-R264 PolarHBondContact O-NH1 2.98Å; Q261-R264 PolarHBondContact O-N 2.85Å; R264-K266 VanDerWaalsContact C-N 3.3Å; R264-K266 PolarHBondContact O-N 3.37Å; R264-M267 PolarHBondContact O-N 3.39Å; R264-K268 PolarHBondContact O-N 3.33Å
265A93.6Very high90.1Very high59 Ų5980.8 Ų80.849%0.48839%0.394SS..Hα-helixtrans-61.7-39.3176.100000111.8Q261 N262 K268 K269Q261-A265 PolarHBondContact O-N 3.47Å; N262-A265 PolarHBondContact O-N 3.37Å; A265-K268 PolarHBondContact O-N 2.88Å; A265-K269 PolarHBondContact O-N 3.3Å
266K92.7Very high88.7Confident123 Ų12385.5 Ų85.554%0.53542%0.417SS..Hα-helixtrans-62.9-46.1173.7-175.6177.9178-179.50112.2N262 Q263 R264 K269 I270N262-K266 WeakPolarHBondContact O-CB 3.32Å; N262-K266 PolarHBondContact O-N 3.3Å; Q263-K266 PolarHBondContact O-N 2.82Å; R264-K266 VanDerWaalsContact C-N 3.3Å; R264-K266 PolarHBondContact O-N 3.37Å; K266-K269 PolarHBondContact O-N 2.87Å; K266-I270 HydrophobicContact CG-CD1 4.07Å; K266-I270 WeakPolarHBondContact O-CG1 3.44Å; K266-I270 PolarHBondContact O-N 2.54Å
267M88.9Confident86.9Confident81 Ų8188.3 Ų88.340%0.39945%0.446SS..Hα-helixtrans-60.8-43.6176.2-67.4-64.696.200111.8F231 Q263 R264 K269 I270 A271F231-M267 HydrophobicContact CE1-CG 4.29Å; F231-M267 HydrophobicContact CZ-CG 4.2Å; Q263-M267 WeakPolarHBondContact O-CG 3.36Å; Q263-M267 PolarHBondContact O-N 2.89Å; R264-M267 PolarHBondContact O-N 3.39Å; M267-K269 PolarHBondContact O-N 2.97Å; M267-I270 HydrophobicContact CE-CD1 3.87Å; M267-I270 PolarHBondContact O-N 3.36Å; M267-A271 PolarHBondContact O-N 3.28Å
268K92.8Very high84.7Confident149 Ų14988.7 Ų88.765%0.64847%0.466SS*.Hα-helixtrans-58.4-46.7174.8-172.8-174174.3-1700111.7R264 A265 I270 A271 E272R264-K268 PolarHBondContact O-N 3.33Å; A265-K268 PolarHBondContact O-N 2.88Å; K268-I270 VanDerWaalsContact C-N 3.33Å; K268-I270 PolarHBondContact O-N 2.99Å; K268-A271 PolarHBondContact O-N 3.23Å; K268-E272 WeakPolarHBondContact O-CB 3.38Å; K268-E272 PolarHBondContact O-N 2.94Å
269K91.8Very high82.4Confident149 Ų14991.5 Ų91.565%0.64849%0.488SS*.Hα-helixtrans-63-37-179.7-174.2173.6-179.6176.90112.8A265 K266 M267 Q273A265-K269 PolarHBondContact O-N 3.3Å; K266-K269 PolarHBondContact O-N 2.87Å; M267-K269 PolarHBondContact O-N 2.97Å; K269-Q273 WeakPolarHBondContact O-CB 3.31Å; K269-Q273 PolarHBondContact O-N 3.06Å
270I85.7Confident79.8Confident62 Ų62100.6 Ų100.632%0.31852%0.522SS..Hα-helixtrans-67.8-48.5176.7-69.5168.8000110.4K266 M267 K268 E272 Q273 E274K266-I270 HydrophobicContact CG-CD1 4.07Å; K266-I270 WeakPolarHBondContact O-CG1 3.44Å; K266-I270 PolarHBondContact O-N 2.54Å; M267-I270 HydrophobicContact CE-CD1 3.87Å; M267-I270 PolarHBondContact O-N 3.36Å; K268-I270 VanDerWaalsContact C-N 3.33Å; K268-I270 PolarHBondContact O-N 2.99Å; I270-E272 PolarHBondContact O-N 3.43Å; I270-Q273 PolarHBondContact O-N 2.92Å; I270-E274 HydrophobicContact CG2-CG 4.36Å; I270-E274 WeakPolarHBondContact CG2-OE1 3.5Å; I270-E274 WeakPolarHBondContact O-CG 3.47Å; I270-E274 PolarHBondContact O-N 2.9Å
271A86.7Confident77.4Confident41 Ų41112.6 Ų112.634%0.33957%0.568SS.*Hα-helixtrans-61.2-31.3177.700000113.4M267 K268 Q275M267-A271 PolarHBondContact O-N 3.28Å; K268-A271 PolarHBondContact O-N 3.23Å; A271-Q275 WeakPolarHBondContact O-CG 3.17Å; A271-Q275 PolarHBondContact O-N 3.22Å; A271-Q275 PolarHBondContact O-NE2 3.07Å
272E80.3Confident74.4Confident109 Ų109112.2 Ų112.251%0.50959%0.585SS.*Hα-helixtrans-72.4-38.9173.9-167.6174155.900111.8K268 I270 L276K268-E272 WeakPolarHBondContact O-CB 3.38Å; K268-E272 PolarHBondContact O-N 2.94Å; I270-E272 PolarHBondContact O-N 3.43Å; E272-L276 PolarHBondContact O-N 2.69Å
273Q79.6Confident72.2Confident133 Ų133113.3 Ų113.362%0.62160%0.598SS**Hα-helixtrans-70.1-36.3176.4-176.5171.9-12.500112.8K269 I270 L276 G277K269-Q273 WeakPolarHBondContact O-CB 3.31Å; K269-Q273 PolarHBondContact O-N 3.06Å; I270-Q273 PolarHBondContact O-N 2.92Å; Q273-L276 PolarHBondContact O-N 2.93Å; Q273-G277 PolarHBondContact O-N 3.2Å
274E76.1Confident69.7Low136 Ų136116.7 Ų116.764%0.63663%0.626SS**Hα-helixtrans-65.5-40.1176.6-73.8170.2167.300111.9I270 L276 G277 G278I270-E274 HydrophobicContact CG2-CG 4.36Å; I270-E274 WeakPolarHBondContact CG2-OE1 3.5Å; I270-E274 WeakPolarHBondContact O-CG 3.47Å; I270-E274 PolarHBondContact O-N 2.9Å; E274-L276 VanDerWaalsContact C-N 3.35Å; E274-L276 PolarHBondContact O-N 2.93Å; E274-G277 PolarHBondContact O-N 3.22Å; E274-G278 PolarHBondContact O-N 3.48Å
275Q70.5Confident66.9Low156 Ų156124.6 Ų124.673%0.72966%0.656SS**Hα-helixtrans-63.8-36.8174.3-76.3170.180.700112.9A271A271-Q275 WeakPolarHBondContact O-CG 3.17Å; A271-Q275 PolarHBondContact O-N 3.22Å; A271-Q275 PolarHBondContact O-NE2 3.07Å
276L64.9Low64Low131 Ų131125.5 Ų125.569%0.68667%0.671SS**Hα-helixtrans-78.6-27.1176.7-73.6162.9000113.3E272 Q273 E274E272-L276 PolarHBondContact O-N 2.69Å; Q273-L276 PolarHBondContact O-N 2.93Å; E274-L276 VanDerWaalsContact C-N 3.35Å; E274-L276 PolarHBondContact O-N 2.93Å
277G57.7Low61.2Low58 Ų58123.2 Ų123.260%0.59868%0.683SS**Hα-helixtrans-72.8-24.8179.200000114.7Q273 E274 S279Q273-G277 PolarHBondContact O-N 3.2Å; E274-G277 PolarHBondContact O-N 3.22Å; G277-S279 VanDerWaalsContact C-N 3.32Å; G277-S279 PolarHBondContact O-N 2.97Å
278G49.3Very low58.6Low68 Ų68131.1 Ų131.170%0.70171%0.708SS**THydrogen-bonded Turntrans-70.5-19-177.100000115.6E274E274-G278 PolarHBondContact O-N 3.48Å
279S46.1Very low56.1Low110 Ų110132.4 Ų132.477%0.76972%0.716SS**THydrogen-bonded Turntrans-100.813.3-167.8-155.40000115.2G277G277-S279 VanDerWaalsContact C-N 3.32Å; G277-S279 PolarHBondContact O-N 2.97Å
280R42.7Very low53.4Low236 Ų236130.9 Ų130.989%0.89173%0.725SS**  trans-121.763.4177.7-73.7-168.3175-121.70.3113.8
281R44.7Very low51.2Low254 Ų254135.3 Ų135.396%0.95875%0.749SS**  trans-137.6102.1156.1-67.3-168-176.8-158.82.4109.9
282G33.3Very low48.7Very low73 Ų73141.3 Ų141.375%0.75378%0.775SS**  trans-174.3149.9179.500000110.4
283P49.3Very low46.6Very low129 Ų129143.1 Ų143.184%0.83879%0.788SS**  trans-103145.7-139.236.5-35.7000118
284S41.4Very low44.8Very low110 Ų110140.8 Ų140.877%0.76979%0.787SS**  trans35.1118.6143.3-160.30000121.9
285R37.3Very low42.9Very low249 Ų249143 Ų14394%0.9480%0.797SS**  174.6148.6118.5-99174.4172.1-173.7-2.2112.6
286G32.7Very low41.1Very low79 Ų79143.6 Ų143.681%0.81481%0.805SS**  trans125.652.114500000121.6
287G32.9Very low39.7Very low75 Ų75140.6 Ų140.677%0.77381%0.806SS**  trans37.2145.5143.200000125.2
288R33.8Very low38.4Very low247 Ų247143 Ų14393%0.93281%0.813SS**  -169.2154.9112.5-102.8174.7-179.8-157.5-2.2112.2
289Q41.3Very low37.6Very low176 Ų176144.8 Ų144.882%0.82282%0.815SS**  trans-86.3157.5-176.7-56.7113.8-47.800113.4
290S35.6Very low37Very low117 Ų117145.9 Ų145.982%0.81882%0.817SS**  trans-159.2125138.854.10000109.6
291N38.8Very low36.6Very low154 Ų154143.7 Ų143.782%0.82482%0.817SS**  trans-75.2157.6168.8-54.8-13.8000109.7
292D33.5Very low36Very low168 Ų168135.1 Ų135.190%0.89881%0.807SS**  -159.2168.6120.9-146.6-145.4000110.5
293D36.7Very low36.1Very low146 Ų146141.2 Ų141.278%0.78182%0.819SS**  trans-115.4-168.3-153.9-133.9-65.7000114.6
294S41.7Very low35.4Very low85 Ų85142 Ų14259%0.59482%0.816SS**  trans97110.8155.6-66.90000122.3
295E37.1Very low34.8Very low181 Ų181142 Ų14285%0.84682%0.816SS**  61.9120.6123-59.9170.415200119.1
296D32.5Very low34.7Very low170 Ų170137.6 Ų137.691%0.90981%0.808SS**  cis93.6138.538.8-164.135.6000115.7
297G34.2Very low34.9Very low68 Ų68141.6 Ų141.670%0.70181%0.81SS**  trans86.1130.9171.400000117.3
298S31.5Very low34.8Very low107 Ų107141.2 Ų141.275%0.74881%0.806SS**  cis161.3150.7-27.8172.20000107.4
299S33.2Very low34.7Very low106 Ų106140.8 Ų140.874%0.74181%0.806SS**  trans74.5133166.3-53.20000117
300T33.1Very low34.6Very low133 Ų133137.9 Ų137.982%0.81680%0.802SS**  -150.6165.253.447.70000115.5
301H33.6Very low34.7Very low191 Ų191137.9 Ų137.988%0.88480%0.802SS**  trans-46.5158.9170.2-60.3-112.3000114.8
302G31.6Very low34.7Very low73 Ų73138.1 Ų138.175%0.75380%0.803SS**  cis143.5134.6-3.200000112.5
303M35.8Very low35.2Very low202 Ų202135.3 Ų135.3100%0.99579%0.793SS**  trans-169.3156152.758.4178.8179.200112
304D34.8Very low35.5Very low146 Ų146139 Ų13978%0.78180%0.797SS**  trans-97.3142.8-165.7-174.6-81.3000113.8
305S29.7Very low35.1Very low109 Ų109143.9 Ų143.976%0.76281%0.81SS**  trans-172.8113.7141.5-86.60000114.8
306M34Very low35Very low156 Ų156142.8 Ų142.877%0.76881%0.805SS**  trans70.1114.4139.9-76.9-71179.700122.6
307L37.9Very low34.9Very low164 Ų164141.6 Ų141.686%0.85980%0.798SS**  trans73.796.8147.5-52.8-176.2000119.4
308G30Very low34.7Very low67 Ų67146.1 Ų146.169%0.69181%0.805SS**  trans-116.3150.116000000112.8
309Y32.8Very low35.2Very low238 Ų238146.2 Ų146.293%0.93381%0.806SS**  trans-140.7110157.4-106.9-77.8000108.6
310P37.9Very low35.1Very low114 Ų114149.7 Ų149.774%0.7482%0.815SS**  trans-93.8150.7174.85.313.7000112.3
311S39Very low35.4Very low118 Ų118149.5 Ų149.583%0.82581%0.809SS**  trans-73.3134.4165.954.50000112
312L38.5Very low35.7Very low158 Ų158146.1 Ų146.183%0.82780%0.804SS**  trans-140.6167.5173.4-92.3-178.2000111.1
313P43.5Very low35.8Very low109 Ų109149.5 Ų149.571%0.70881%0.805SS**  -128.7-177.8-125.444.1-30.2000116.3
314R43.7Very low35.6Very low225 Ų225146.9 Ų146.985%0.84979%0.793SS**  trans-44.8135169.3171.4-176.1174.8173-0.9115.2
315Q31.9Very low35.6Very low187 Ų187150.7 Ų150.787%0.87480%0.798SS**  trans-135.4172.9155.6-80.1-152.2-19.700112.6
316Q35.7Very low35.6Very low158 Ų158149 Ų14974%0.73880%0.798SS**  trans-105.7166.4-171.1-58.2163.4-11.600110.8
317L30.7Very low35.4Very low145 Ų145145.5 Ų145.576%0.75980%0.802SS**  165.9134.6117.6-85164.4000114.2
318L30.5Very low35.2Very low162 Ų162145.1 Ų145.185%0.84880%0.796SS**  trans58.8153.8140.6-63.4175.3000124.8
319S40.9Very low36Very low110 Ų110146.9 Ų146.977%0.76980%0.796SS**  trans-99.3161.3-168.6-33.60000113.8
320L32.6Very low36Very low179 Ų179142.8 Ų142.894%0.93778%0.783SS**  trans-160141.3146.1-103.8147.6000109.7
321D38.8Very low35.8Very low128 Ų128149 Ų14968%0.68479%0.791SS**  trans-129.7138.6173.7-157.3-40.3000105.4N323D321-N323 PolarHBondContact OD1-N 3.13Å; D321-N323 VanDerWaalsContact OD1-N 3.13Å
322P39.9Very low35.7Very low120 Ų120151.1 Ų151.178%0.77979%0.788SS**  -146.9138.3108.434.2-16.8000116.3
323N33.8Very low35.5Very low145 Ų145147 Ų14778%0.77578%0.784SS**  trans-9.4164.6148.9-92.6-73.7000122.2D321D321-N323 PolarHBondContact OD1-N 3.13Å; D321-N323 VanDerWaalsContact OD1-N 3.13Å
324I31.1Very low34.9Very low147 Ų147150.4 Ų150.475%0.75480%0.795SS**  trans97.5113.2179.6-56.1-133000111.6
325Y34.2Very low34.6Very low225 Ų225146.2 Ų146.288%0.88280%0.795SS**  cis-134165.6-4.3-97.8-80.7000108.1
326G30.9Very low35Very low74 Ų74142.8 Ų142.876%0.76379%0.789SS**  cis135.781.5-7.300000115
327G29.8Very low35.4Very low83 Ų83141.2 Ų141.286%0.85679%0.792SS**  trans173.7100.5176.100000115.9
328E33.4Very low35.5Very low156 Ų156143.1 Ų143.173%0.72980%0.797SS**  trans-78.9-178.7167.4-93.5-81.811900111.6F330E328-F330 WeakPolarHBondContact OE2-CD2 3.49Å; E328-F330 WeakPolarHBondContact OE2-CE2 3.32Å
329P47.2Very low35.7Very low104 Ų104143 Ų14368%0.67580%0.797SS**  cis-137.2164.60.819.96.6000118.4
330F32.9Very low35.2Very low151 Ų151144.7 Ų144.766%0.66280%0.797SS**  trans38.5124.2145.4-76.8-99.4000124E328 H332E328-F330 WeakPolarHBondContact OE2-CD2 3.49Å; E328-F330 WeakPolarHBondContact OE2-CE2 3.32Å; F330-H332 AromaticContact CD1-ND1 3.88Å
331R33.3Very low35.1Very low244 Ų244141.8 Ų141.892%0.92179%0.792SS**  trans-137.8124.1148.1-81.1-86.897.6177.25.8111.2
332H36.8Very low34.9Very low164 Ų164143.7 Ų143.776%0.75980%0.797SS**  trans-108.6153.7166.8-87.891000110.1F330F330-H332 AromaticContact CD1-ND1 3.88Å
333G33Very low34.6Very low72 Ų72145.2 Ų145.274%0.74279%0.793SS**  trans92.2131.215200000117.2
334L32Very low34.6Very low180 Ų180145.7 Ų145.794%0.94279%0.794SS**  trans-127.1127.7164.3-71.1176000109.1
335T38Very low34.7Very low136 Ų136147 Ų14783%0.83480%0.797SS**  trans-144.4159.1173.230.30000109.4
336P38.5Very low34.4Very low116 Ų116141.7 Ų141.775%0.75379%0.792SS**  trans-82.8173.2-149.1-13.731.6000116.3
337P45.8Very low34.4Very low125 Ų125147.5 Ų147.581%0.81279%0.793SS**  trans-82.1159.1-170.134.7-35.8000113.9
338Q32.4Very low34.4Very low185 Ų185148.5 Ų148.586%0.86478%0.778SS**  trans-118.5149.4171.1-81.6-72.114.200111.4
339L34Very low34.2Very low159 Ų159144.9 Ų144.983%0.83277%0.77SS**  trans-72.6159.4174-105.589000112.1
340N30.1Very low33.4Very low146 Ų146147.8 Ų147.878%0.78178%0.775SS**  trans-91.6146.7171.652.4-21.1000112.1
341S31.6Very low33.3Very low118 Ų118146.3 Ų146.383%0.82578%0.778SS**  trans-142.5112.4171.8-75.90000110.9
342E33.8Very low33.5Very low168 Ų168140.4 Ų140.479%0.78577%0.769SS**  trans-138.2140.8156-72-166.882.100104.4
343Q34.5Very low33.2Very low152 Ų152140.7 Ų140.771%0.7177%0.768SS**  cis-163.3166.217-130.7166.222.600110.6
344I32.9Very low33.4Very low154 Ų154145.2 Ų145.279%0.7977%0.77SS**  trans85.2128.6160.6-57.2150.6000118.6
345H33.6Very low33.7Very low176 Ų176143.1 Ų143.182%0.81576%0.76SS**  trans-106149171.7-65.1-99.1000111.9
346S27.8Very low33.7Very low112 Ų112144.7 Ų144.778%0.78376%0.762SS**  162.6134.9122.6-76.60000113.8
347Y32.1Very low33.4Very low197 Ų197146.2 Ų146.277%0.77376%0.764SS**  trans22.4124.4131.5159.2-91.5000117.6
348D28.5Very low33Very low103 Ų103145.8 Ų145.855%0.55176%0.764SS**  -173.5165.866.2-161.78.3000114.7
349S29.2Very low33.2Very low81 Ų81144.9 Ų144.957%0.56677%0.765SS**  trans47.6127.2141.6-75.70000126.5
350E30.9Very low33.1Very low164 Ų164140.8 Ų140.877%0.76676%0.762SS**  76.3123.8124.4-70-155120.300125.2
351T31.1Very low33.4Very low121 Ų121138.7 Ų138.774%0.74276%0.758SS**  trans70.9157.414667.20000117.4
352V36.3Very low33.5Very low120 Ų120140.7 Ų140.773%0.72776%0.759SS**  cis-143.4160.422.2179.90000111.4
353F31Very low33.6Very low169 Ų169138 Ų13874%0.74176%0.759SS**  trans-39.6160.3162.6-71.8-102000115.8
354H36.4Very low33.5Very low167 Ų167138.3 Ų138.377%0.77376%0.76SS**  -166152.159.9-96.9-82.1000115.4
355D39.4Very low33.4Very low136 Ų136138.5 Ų138.573%0.72776%0.761SS**  trans-64.3156.4157.6-55-100.7000113.6
356L37.5Very low33.4Very low170 Ų170133.9 Ų133.989%0.8976%0.762SS**  -173142.2128.1-114.5134000114.4
357D33.1Very low33.5Very low148 Ų148136.1 Ų136.179%0.79177%0.765SS**  trans-69.5150.1169.6-87.1-60.3000113.6
358S36.3Very low33.5Very low115 Ų115132.4 Ų132.480%0.80477%0.766SS**  165.2128.6120.3-73.70000114.6
359D36.8Very low33.7Very low166 Ų166134.6 Ų134.689%0.88878%0.777SS**  trans25.2140.4143.7-138.1-20.6000122.8
360G32Very low33.9Very low74 Ų74138.4 Ų138.476%0.76379%0.79SS**  trans171.259.6-178.100000118.2
361S36.3Very low33.9Very low101 Ų101134.7 Ų134.771%0.70679%0.788SS**  trans-26.3160.4174.4-160.20000122.6
362L34.7Very low33.9Very low160 Ų160136.1 Ų136.184%0.83880%0.796SS**  trans82.8133.7165.2-52.9-177.1000117.4
363S35.9Very low33.6Very low112 Ų112134.1 Ų134.178%0.78380%0.801SS**  cis-164.9174.1150.40000112.1
364H30.8Very low33.6Very low158 Ų158135.4 Ų135.473%0.73181%0.809SS**  trans120.281.3149.7-160.4-76.7000119.5
365L32.8Very low33.3Very low158 Ų158132.6 Ų132.683%0.82782%0.815SS**  trans58.1131.1138.5-50.3-177.3000121.4
366G31.6Very low32.9Very low80 Ų80129.7 Ų129.783%0.82582%0.816SS**  trans168.41.4154.700000123.2
367D31.1Very low32.6Very low159 Ų159129.1 Ų129.185%0.8581%0.813SS**  trans-59.4163.2176.6-74.1-47.6000113.9
368C31.3Very low32.7Very low118 Ų118129.7 Ų129.780%0.79782%0.816SS**  cis-160179.17.2-136.10000112.4
369L32.9Very low32.5Very low150 Ų150128.6 Ų128.679%0.78581%0.814SS**  trans-106144.2169.9-77.3166.2000113.1
370L34.6Very low32.2Very low160 Ų160124.3 Ų124.384%0.83881%0.808SS**  trans39.9122.2146.4-57.4172.4000121.2
371A30.8Very low32.3Very low87 Ų87132.3 Ų132.372%0.71982%0.816SS**  171.6137.8103.500000116
372T30.9Very low32.2Very low150 Ų150134.3 Ų134.392%0.9282%0.823SS**  trans54.3128.3148.452.30000123.5
373G30Very low32Very low79 Ų79130 Ų13081%0.81482%0.817SS**  trans172.4140.9162.800000111.9
374E31Very low32.2Very low196 Ų196132 Ų13292%0.91682%0.819SS**  trans-91.9163.8-165-67.5-173.9105.800117.5
375A30.6Very low32.5Very low108 Ų108129.9 Ų129.989%0.89382%0.82SS**  trans76.7123.1146.300000122
376G29Very low32.9Very low74 Ų74129.8 Ų129.876%0.76382%0.818SS**  trans137.794.1141.600000120.2
377L32.2Very low33Very low158 Ų158133 Ų13383%0.82782%0.817SS**  trans72111.4142.7-58.9172.2000123.1
378L35.3Very low33.5Very low161 Ų161136.9 Ų136.984%0.84382%0.82SS**  trans67.2141.5133.4-54.6-179.7000120.6
379A32.3Very low33.6Very low92 Ų92138.6 Ų138.676%0.7682%0.82SS**  cis-165.9153.8-8.700000113.7
380G30.1Very low33.6Very low75 Ų75141.5 Ų141.577%0.77382%0.822SS**  trans77.9151.2163.900000116.2
381R33.4Very low33.7Very low243 Ų243138.5 Ų138.592%0.91781%0.814SS**  cis-159.3157.9-4.8-76.5-176.3176.5177.8-1.6105.9
382V35.1Very low33.7Very low142 Ų142141.6 Ų141.686%0.86182%0.815SS**  cis-162.3151.5-7.8126.70000106.5
383G30.8Very low33.9Very low70 Ų70142.2 Ų142.272%0.72281%0.808SS**  trans-177.7132.9178.100000115
384N39.1Very low34.1Very low153 Ų153145 Ų14582%0.81880%0.804SS**  trans-79.1129.6-169.9-162.836.1000113.3
385P37.8Very low34.2Very low115 Ų115140.4 Ų140.475%0.74779%0.793SS**  trans-100.9110175.834.6-28.2000112.9
386I41.4Very low34.5Very low156 Ų156144.8 Ų144.880%0.879%0.788SS**  trans-92.4101.8156.4-63.3174000106.8
387D33.5Very low34.8Very low148 Ų148151.3 Ų151.379%0.79180%0.796SS**  trans-161.2104.4151.5-124.6-34.1000112.1
388R41.3Very low35.1Very low240 Ų240149 Ų14991%0.90679%0.789SS**  trans-144.189.8161-82.2-163.3176.3174.2-0.1109.5
389L33.6Very low35.4Very low153 Ų153150.8 Ų150.880%0.80182%0.815SS**  trans10.6119.6140-65.1164.9000115.9
390Y32.8Very low35.6Very low212 Ų212153.7 Ų153.783%0.83182%0.817SS**  trans-126.2113.9138-106.5-84.3000110.4
391S35.9Very low35.9Very low96 Ų96157.8 Ų157.867%0.67182%0.82SS**  trans-83159.4168.1-172.50000110
392M31.9Very low36Very low152 Ų152153.1 Ų153.175%0.74981%0.814SS**  trans-18.2125166.8-69.4-81.8-71.800116
393Q33.8Very low36.1Very low163 Ų163153.8 Ų153.876%0.76281%0.811SS**  trans-120.9108.6154.3-76.7-173.9-14.200109.9
394N35.3Very low36.4Very low139 Ų139159 Ų15974%0.74382%0.817SS**  trans-81136.2157.1-82.2-13.4000108.6
395S33.9Very low36.2Very low98 Ų98159.4 Ų159.469%0.68582%0.817SS**  trans160.8157.4134.948.70000112.4
396Y35.6Very low36.1Very low200 Ų200162.6 Ų162.678%0.78482%0.822SS**  trans69.8117.2-177.4-57.2-87000114.2
397F36.5Very low35.7Very low212 Ų212163.1 Ų163.193%0.9382%0.824SS**  cis-108.1155.131.9-91.3-102.8000117
398T38.5Very low35.9Very low109 Ų109164.3 Ų164.367%0.66983%0.826SS**  trans-115.4136.3177.6-29.70000109.7
399S41.7Very low35.4Very low198 Ų198157.5 Ų157.5100%1.38582%0.819SS**  trans175.30138.9-74.30000109.6

Retrieved 399 of 399 residues in 205.6 ms (Link to these results)