A0A077Z5P7_TRITR Loading...

Protein yippee-like

AlphaFold DB , UniProt , Accession A0A077Z5P7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 137 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M43.5Very low66Low242 Ų242121.7 Ų121.7100%1.19264%0.643SS**  01280-67.4174.9177.700107.6T3M1-T3 PolarHBondContact O-N 2.72Å
2K49.2Very low66.8Low213 Ų213113.9 Ų113.993%0.92661%0.613SS**  trans-78.7107.2170.5-77.5179.5176.4-179.70106.6F4K2-F4 PolarHBondContact O-N 3.48Å
3T57.1Low68.6Low85 Ų85114.2 Ų114.252%0.52160%0.6SS.*PPolyproline II helixtrans-59.3136.3170.6-87.50000108.7M1 Q5 E74M1-T3 PolarHBondContact O-N 2.72Å; T3-Q5 PolarHBondContact O-N 2.75Å; T3-Q5 VanDerWaalsContact O-N 3.16Å; T3-E74 HydrophobicContact CG2-CG 4.12Å
4F70.6Confident70.5Confident207 Ų207106.6 Ų106.691%0.90856%0.561SS**PPolyproline II helixtrans-58.6117.3171.7-77.9-91.8000108.7K2K2-F4 PolarHBondContact O-N 3.48Å
5Q71.5Confident72.3Confident73 Ų7399.8 Ų99.834%0.34153%0.525SS..PPolyproline II helixtrans-80.1131.8173.1-69.7-178.2-10.700109T3 Y7 N50 C75T3-Q5 PolarHBondContact O-N 2.75Å; T3-Q5 VanDerWaalsContact O-N 3.16Å; Q5-Y7 HydrophobicContact CB-CE2 4.13Å; Q5-Y7 WeakPolarHBondContact O-CD2 3.5Å; Q5-Y7 PolarHBondContact OE1-OH 3.34Å; Q5-N50 WeakPolarHBondContact CA-OD1 3.15Å; Q5-C75 PolarHBondContact NE2-SG 2.83Å; Q5-C75 VanDerWaalsContact NE2-SG 3.42Å
6A77.4Confident73.8Confident46 Ų4693.6 Ų93.638%0.3849%0.493SS..PPolyproline II helixtrans-78.6122.2168.600000108.8V49 N50A6-V49 HydrophobicContact CB-CB 4.04Å; A6-V49 HydrophobicContact CB-CG1 4.12Å; A6-N50 PolarHBondContact N-OD1 2.8Å; A6-N50 PolarHBondContact O-ND2 2.94Å; A6-N50 VanDerWaalsContact O-ND2 3.14Å
7Y76.1Confident75.2Confident179 Ų17988.1 Ų88.170%0.70246%0.464SS*.PPolyproline II helixtrans-94.3121.9173.4-67.3-85.8000108.9Q5Q5-Y7 HydrophobicContact CB-CE2 4.13Å; Q5-Y7 WeakPolarHBondContact O-CD2 3.5Å; Q5-Y7 PolarHBondContact OE1-OH 3.34Å
8L77.9Confident76.4Confident29 Ų2986.4 Ų86.415%0.15246%0.457CS..PPolyproline II helixtrans-77.2149.9172.1-60.3173000109.6S10 T14 H23 N26 V49L8-S10 PolarHBondContact O-N 2.88Å; L8-T14 HydrophobicContact CB-CG2 4.03Å; L8-T14 HydrophobicContact CD1-CG2 3.94Å; L8-H23 HydrophobicContact CD1-CB 4.07Å; L8-H23 HydrophobicContact CG-CB 4.25Å; L8-H23 PolarHBondContact N-ND1 3.24Å; L8-N26 HydrophobicContact CD1-CB 4.19Å; L8-V49 HydrophobicContact CD1-CG2 4.24Å; L8-V49 HydrophobicContact CD2-CG1 4.44Å; L8-V49 HydrophobicContact CD2-CG2 4.24Å; L8-V49 HydrophobicContact CG-CG2 4.19Å
9P73.3Confident77.5Confident97 Ų9788.1 Ų88.163%0.6346%0.462SS*.PPolyproline II helixtrans-52.6133.3-176.9-24.732.1000113.1G11P9-G11 PolarHBondContact O-N 2.89Å
10S63.6Low78.5Confident124 Ų12485.8 Ų85.887%0.86745%0.453SS*.THydrogen-bonded Turntrans-60.3131.6174.3-41.40000110.4L8L8-S10 PolarHBondContact O-N 2.88Å
11G65.2Low79.3Confident44 Ų4489.4 Ų89.445%0.45446%0.461SS..THydrogen-bonded Turntrans98.5-7.7177.400000115.7P9 S135P9-G11 PolarHBondContact O-N 2.89Å; G11-S135 VanDerWaalsContact CA-OG 3.31Å; G11-S135 WeakPolarHBondContact CA-OG 3.29Å
12G76.7Confident81.7Confident28 Ų2878.2 Ų78.229%0.28941%0.406SS..SBendtrans-77160.6168.900000112.7T14G12-T14 PolarHBondContact O-N 2.93Å
13R90.1Very high83.9Confident117 Ų11770.3 Ų70.344%0.44237%0.373SS..  trans-75.5117165.1-67177.4-66.6-179.42.4107.2N26 H27 D130R13-N26 PolarHBondContact O-OD1 2.81Å; R13-H27 HydrophobicContact CB-CB 3.54Å; R13-H27 PolarHBondContact NH2-CD2 2.91Å; R13-H27 WeakPolarHBondContact O-CB 3.3Å; R13-H27 PolarHBondContact O-N 2.76Å; R13-D130 CarbonylContact C-O 3.58Å; R13-D130 VanDerWaalsContact CA-O 3.26Å; R13-D130 WeakPolarHBondContact CA-O 3.13Å
14T94.7Very high85.9Confident9 Ų966.3 Ų66.36%0.05535%0.348CS..EExtended strand (participates in β ladder)trans-123.1162.3-17855.90000110.7L8 G12 K129 D130L8-T14 HydrophobicContact CB-CG2 4.03Å; L8-T14 HydrophobicContact CD1-CG2 3.94Å; G12-T14 PolarHBondContact O-N 2.93Å; T14-K129 CarbonylContact O-C 3.52Å; T14-K129 WeakPolarHBondContact O-CA 3.5Å; T14-D130 PolarHBondContact N-O 3.42Å; T14-D130 PolarHBondContact O-N 3.3Å
15Y96.9Very high87.1Confident4 Ų456.5 Ų56.52%0.01631%0.305CS..EExtended strand (participates in β ladder)trans-116.3135.6171.8-67.8-78.7000109.4L24 A25 H27 Y43 F45 M127 I128 K129Y15-L24 PolarHBondContact O-N 3.18Å; Y15-A25 HydrophobicContact CD2-CB 4.44Å; Y15-A25 PolarHBondContact N-O 2.87Å; Y15-A25 PolarHBondContact O-N 3.16Å; Y15-H27 HydrophobicContact CE2-CB 4.07Å; Y15-H27 AromaticContact CE2-ND1 3.53Å; Y15-H27 AromaticContact CZ-ND1 3.61Å; Y15-H27 PolarHBondContact OH-CE1 3.12Å; Y15-H27 PolarHBondContact OH-ND1 3.1Å; Y15-Y43 HydrophobicContact CE1-CD2 4.24Å; Y15-Y43 HydrophobicContact CE1-CE2 4.16Å; Y15-F45 HydrophobicContact CD1-CZ 4.49Å; Y15-F45 AromaticContact CD2-CE1 3.52Å; Y15-F45 HydrophobicContact CD2-CE1 3.52Å; Y15-F45 AromaticContact CD2-CZ 3.64Å; Y15-F45 HydrophobicContact CD2-CZ 3.64Å; Y15-F45 AromaticContact CE2-CE1 3.59Å; Y15-F45 HydrophobicContact CE2-CE1 3.59Å; Y15-F45 AromaticContact CE2-CZ 3.76Å; Y15-F45 HydrophobicContact CE2-CZ 3.76Å; Y15-F45 HydrophobicContact CG-CE1 4.33Å; Y15-F45 HydrophobicContact CG-CZ 4.02Å; Y15-M127 WeakPolarHBondContact CB-SD 3.03Å; Y15-M127 HydrophobicContact CD1-CE 3.44Å; Y15-M127 VanDerWaalsContact CD1-CE 3.44Å; Y15-M127 HydrophobicContact CD1-CG 3.96Å; Y15-M127 HydrophobicContact CD1-SD 3.59Å; Y15-M127 VanDerWaalsContact CD1-SD 3.59Å; Y15-M127 HydrophobicContact CE1-CE 3.82Å; Y15-M127 HydrophobicContact CG-CE 4.04Å; Y15-M127 HydrophobicContact CG-CG 4.25Å; Y15-M127 HydrophobicContact CG-SD 3.64Å; Y15-I128 CarbonylContact C-O 3.57Å; Y15-I128 VanDerWaalsContact CA-O 3.25Å; Y15-I128 WeakPolarHBondContact CA-O 2.93Å; Y15-K129 HydrophobicContact CD1-CB 3.85Å; Y15-K129 HydrophobicContact CD1-CG 3.97Å; Y15-K129 HydrophobicContact CE1-CB 3.72Å; Y15-K129 HydrophobicContact CE1-CD 3.91Å; Y15-K129 HydrophobicContact CE1-CG 3.62Å
16S96.3Very high88.2Confident1 Ų154.6 Ų54.61%0.00730%0.297CS..EExtended strand (participates in β ladder)trans-133.5150.6-172.8-560000110.7V18 A22 M127 I128 D130S16-V18 PolarHBondContact O-N 2.81Å; S16-A22 CarbonylContact C-O 3.45Å; S16-A22 VanDerWaalsContact CA-O 3.31Å; S16-A22 WeakPolarHBondContact CA-O 3.36Å; S16-M127 CarbonylContact O-C 3.53Å; S16-M127 WeakPolarHBondContact O-CA 3.29Å; S16-I128 PolarHBondContact N-O 3.36Å; S16-I128 WeakPolarHBondContact O-CG1 3.43Å; S16-I128 PolarHBondContact O-N 3.16Å; S16-D130 PolarHBondContact OG-OD2 3.37Å
17C97.9Very high89Confident0 Ų053.6 Ų53.60%029%0.285CS..EExtended strand (participates in β ladder)trans-61.7131.2175.5178.40000110.1H19 R21 A22 L24 C76C17-H19 PolarHBondContact O-N 2.8Å; C17-R21 VanDerWaalsContact O-CA 3.23Å; C17-R21 WeakPolarHBondContact O-CA 3.47Å; C17-R21 PolarHBondContact O-N 2.67Å; C17-A22 PolarHBondContact N-O 2.81Å; C17-L24 HydrophobicContact CB-CD1 4.03Å; C17-L24 HydrophobicContact CB-CD2 4.3Å; C17-L24 HydrophobicContact CB-CG 4.22Å; C17-C76 VanDerWaalsContact SG-SG 3.66Å
18V97.4Very high89.8Confident57 Ų5751 Ų5135%0.34528%0.283SS..THydrogen-bonded Turntrans-62.3-32.4-179.869.20000112.7S16 H126 I128S16-V18 PolarHBondContact O-N 2.81Å; V18-H126 PolarHBondContact N-O 3.4Å; V18-I128 HydrophobicContact CB-CG2 4.13Å; V18-I128 HydrophobicContact CG2-CG2 3.9Å
19H97.1Very high90.7Very high118 Ų11852.5 Ų52.555%0.54629%0.289SS..THydrogen-bonded Turntrans-83.1-39.7-173-63.4-73.8000114.1C17 T78C17-H19 PolarHBondContact O-N 2.8Å; H19-T78 WeakPolarHBondContact CD2-CG2 3.47Å; H19-T78 PolarHBondContact CD2-OG1 3.01Å; H19-T78 WeakPolarHBondContact NE2-CG2 3.2Å
20C97Very high91.9Very high42 Ų4249.5 Ų49.528%0.28427%0.268SS..THydrogen-bonded Turntrans-124.8-0.1-173.765.40000114.6A22 C73 C76C20-A22 PolarHBondContact O-N 2.64Å; C20-A22 VanDerWaalsContact O-N 3.08Å; C20-C73 PolarHBondContact SG-SG 3.12Å; C20-C76 HydrophobicContact CB-CB 3.83Å; C20-C76 PolarHBondContact SG-SG 3.31Å
21R95.2Very high93.5Very high163 Ų16347.2 Ų47.262%0.61525%0.245SC*.  trans61.98.8-178.7-52.3-59-171.4110.10.8115.6C17 H23C17-R21 VanDerWaalsContact O-CA 3.23Å; C17-R21 WeakPolarHBondContact O-CA 3.47Å; C17-R21 PolarHBondContact O-N 2.67Å; R21-H23 PolarHBondContact O-N 3.22Å
22A95.2Very high95Very high6 Ų646.6 Ų46.65%0.0523%0.233CC..  trans-58.5132.5170.900000110S16 C17 C20 C75S16-A22 CarbonylContact C-O 3.45Å; S16-A22 VanDerWaalsContact CA-O 3.31Å; S16-A22 WeakPolarHBondContact CA-O 3.36Å; C17-A22 PolarHBondContact N-O 2.81Å; C20-A22 PolarHBondContact O-N 2.64Å; C20-A22 VanDerWaalsContact O-N 3.08Å; A22-C75 HydrophobicContact CB-CB 4.04Å
23H95.3Very high96Very high48 Ų4850.3 Ų50.322%0.22224%0.242CC..EExtended strand (participates in β ladder)trans-62.4138.3176.7-68.7-166000109.4L8 R21 V49 N50L8-H23 HydrophobicContact CD1-CB 4.07Å; L8-H23 HydrophobicContact CG-CB 4.25Å; L8-H23 PolarHBondContact N-ND1 3.24Å; R21-H23 PolarHBondContact O-N 3.22Å; H23-V49 HydrophobicContact CB-CG2 4.35Å; H23-N50 WeakPolarHBondContact O-CB 3.19Å; H23-N50 PolarHBondContact O-ND2 3.48Å
24L97.7Very high96.3Very high0 Ų050.1 Ų50.10%026%0.258CS..EExtended strand (participates in β ladder)trans-114.7-40.5-179-63.8179.4000112.1Y15 C17 V48 V49 V51 L80 I122 M127Y15-L24 PolarHBondContact O-N 3.18Å; C17-L24 HydrophobicContact CB-CD1 4.03Å; C17-L24 HydrophobicContact CB-CD2 4.3Å; C17-L24 HydrophobicContact CB-CG 4.22Å; L24-V48 CarbonylContact O-C 3.54Å; L24-V48 WeakPolarHBondContact O-CA 3.49Å; L24-V48 VanDerWaalsContact O-CB 3.27Å; L24-V48 WeakPolarHBondContact O-CB 3.43Å; L24-V49 WeakPolarHBondContact CA-O 3.37Å; L24-V49 PolarHBondContact O-N 3.38Å; L24-V51 HydrophobicContact CD2-CG2 3.92Å; L24-L80 HydrophobicContact CD1-CD1 3.85Å; L24-L80 HydrophobicContact CD1-CD2 4Å; L24-L80 HydrophobicContact CD2-CD1 3.59Å; L24-L80 HydrophobicContact CG-CD1 4.36Å; L24-I122 HydrophobicContact CB-CD1 4.3Å; L24-M127 HydrophobicContact CD1-CB 4.48Å; L24-M127 HydrophobicContact CD1-CG 4.31Å
25A96.9Very high96.3Very high1 Ų150.9 Ų50.91%0.00826%0.261CS..EExtended strand (participates in β ladder)trans-156.4151.6-179.800000111.7Y15 F45 V48Y15-A25 HydrophobicContact CD2-CB 4.44Å; Y15-A25 PolarHBondContact N-O 2.87Å; Y15-A25 PolarHBondContact O-N 3.16Å; A25-F45 HydrophobicContact CB-CD1 3.62Å; A25-F45 HydrophobicContact CB-CE1 3.74Å; A25-F45 HydrophobicContact CB-CG 4.14Å; A25-F45 HydrophobicContact CB-CZ 4.34Å; A25-V48 HydrophobicContact CB-CG1 4.37Å
26N94.3Very high96.3Very high33 Ų3357.3 Ų57.318%0.17629%0.291CS..EExtended strand (participates in β ladder)trans-77.3147.6162.1-171.2-25000108.4L8 R13 D28 E29L8-N26 HydrophobicContact CD1-CB 4.19Å; R13-N26 PolarHBondContact O-OD1 2.81Å; N26-D28 PolarHBondContact O-N 2.97Å; N26-D28 PolarHBondContact OD1-N 2.94Å; N26-E29 HydrophobicContact CB-CG 4.32Å; N26-E29 WeakPolarHBondContact O-CB 3.25Å; N26-E29 PolarHBondContact O-N 3.12Å; N26-E29 VanDerWaalsContact O-N 3.14Å
27H94.5Very high96.1Very high25 Ų2557.8 Ų57.812%0.11630%0.296CS..G310 helixtrans-59.5-27.9170.4-17176.9000113.8R13 Y15 E29 L30R13-H27 HydrophobicContact CB-CB 3.54Å; R13-H27 PolarHBondContact NH2-CD2 2.91Å; R13-H27 WeakPolarHBondContact O-CB 3.3Å; R13-H27 PolarHBondContact O-N 2.76Å; Y15-H27 HydrophobicContact CE2-CB 4.07Å; Y15-H27 AromaticContact CE2-ND1 3.53Å; Y15-H27 AromaticContact CZ-ND1 3.61Å; Y15-H27 PolarHBondContact OH-CE1 3.12Å; Y15-H27 PolarHBondContact OH-ND1 3.1Å; H27-E29 PolarHBondContact O-N 3.16Å; H27-L30 WeakPolarHBondContact O-CB 3.1Å; H27-L30 PolarHBondContact O-N 3.13Å; H27-L30 VanDerWaalsContact O-N 3.09Å
28D93.8Very high95.8Very high124 Ų12462.5 Ų62.566%0.66333%0.329SS*.G310 helixtrans-68.2-19.1177-58.7-25.9000112.5N26 L30N26-D28 PolarHBondContact O-N 2.97Å; N26-D28 PolarHBondContact OD1-N 2.94Å; D28-L30 VanDerWaalsContact C-N 3.29Å
29E96.2Very high95.6Very high61 Ų6166.5 Ų66.529%0.28534%0.344SS..G310 helixtrans-83.7-3.1174-62.1-62.2142.200112.9N26 H27 I31 F45 N46 S47N26-E29 HydrophobicContact CB-CG 4.32Å; N26-E29 WeakPolarHBondContact O-CB 3.25Å; N26-E29 PolarHBondContact O-N 3.12Å; N26-E29 VanDerWaalsContact O-N 3.14Å; H27-E29 PolarHBondContact O-N 3.16Å; E29-I31 PolarHBondContact O-N 3.1Å; E29-F45 HydrophobicContact CB-CD1 4.39Å; E29-F45 CarbonylContact O-C 3.46Å; E29-F45 VanDerWaalsContact O-CA 3.27Å; E29-F45 WeakPolarHBondContact O-CA 3.11Å; E29-N46 PolarHBondContact O-N 2.85Å; E29-N46 WeakPolarHBondContact OE2-CB 3.49Å; E29-N46 PolarHBondContact OE2-ND2 3.38Å; E29-S47 WeakPolarHBondContact CB-O 3.34Å; E29-S47 WeakPolarHBondContact OE2-CB 3.38Å; E29-S47 PolarHBondContact OE2-N 3.4Å; E29-S47 VanDerWaalsContact OE2-N 3.12Å
30L97.2Very high95.5Very high34 Ų3462.2 Ų62.218%0.17833%0.332CS..EExtended strand (participates in β ladder)trans-74.4117.8-179.1-179.169000111H27 D28 K33 Y43 F45H27-L30 WeakPolarHBondContact O-CB 3.1Å; H27-L30 PolarHBondContact O-N 3.13Å; H27-L30 VanDerWaalsContact O-N 3.09Å; D28-L30 VanDerWaalsContact C-N 3.29Å; L30-K33 HydrophobicContact CD1-CG 4.42Å; L30-K33 HydrophobicContact CD2-CD 4.28Å; L30-K33 HydrophobicContact CD2-CG 3.9Å; L30-Y43 HydrophobicContact CD1-CD2 3.87Å; L30-Y43 HydrophobicContact CD1-CG 3.88Å; L30-F45 HydrophobicContact CB-CD1 4.19Å; L30-F45 HydrophobicContact CB-CE1 3.94Å; L30-F45 HydrophobicContact CD1-CD1 4.16Å; L30-F45 HydrophobicContact CD1-CE1 3.71Å; L30-F45 HydrophobicContact CD1-CE2 4.36Å; L30-F45 HydrophobicContact CD1-CZ 3.83Å; L30-F45 HydrophobicContact CG-CE1 4.42Å
31I97.6Very high95.6Very high77 Ų7767.5 Ų67.540%0.39535%0.35SS..EExtended strand (participates in β ladder)trans-89.1-47.7176.9-62.9170.7000110.9E29 L44 N46 K119E29-I31 PolarHBondContact O-N 3.1Å; I31-L44 HydrophobicContact CB-CB 4.47Å; I31-L44 HydrophobicContact CB-CD2 4.09Å; I31-L44 HydrophobicContact CB-CG 4.32Å; I31-L44 HydrophobicContact CD1-CD2 4.16Å; I31-L44 HydrophobicContact CD1-CG 4.35Å; I31-L44 HydrophobicContact CG2-CD2 3.95Å; I31-L44 PolarHBondContact N-O 3.2Å; I31-N46 HydrophobicContact CD1-CB 3.81Å; I31-N46 HydrophobicContact CG1-CB 4.07Å; I31-K119 HydrophobicContact CD1-CD 3.64Å; I31-K119 HydrophobicContact CD1-CG 4.09Å
32S97.5Very high95.7Very high30 Ų3059.7 Ų59.721%0.2132%0.321CS..EExtended strand (participates in β ladder)trans-155148.5-173.3179.10000112.6S34 Y43 L44S32-S34 PolarHBondContact OG-N 3.02Å; S32-Y43 WeakPolarHBondContact O-CA 3.48Å; S32-L44 PolarHBondContact N-O 3.02Å; S32-L44 PolarHBondContact O-N 3.36Å
33K97.2Very high95.9Very high106 Ų10661.2 Ų61.246%0.46133%0.325SS..EExtended strand (participates in β ladder)trans-105.42.2176.9-63.4-176.4-176.6170.70113.8L30 F35 Y43L30-K33 HydrophobicContact CD1-CG 4.42Å; L30-K33 HydrophobicContact CD2-CD 4.28Å; L30-K33 HydrophobicContact CD2-CG 3.9Å; K33-F35 VanDerWaalsContact C-N 3.3Å; K33-F35 PolarHBondContact O-N 2.79Å; K33-Y43 VanDerWaalsContact CA-CD1 3.45Å; K33-Y43 HydrophobicContact CB-CD1 3.69Å; K33-Y43 HydrophobicContact CB-CE1 3.43Å; K33-Y43 VanDerWaalsContact CB-CE1 3.43Å; K33-Y43 HydrophobicContact CD-CE1 3.98Å; K33-Y43 HydrophobicContact CD-CE2 4.31Å; K33-Y43 HydrophobicContact CG-CD1 3.75Å; K33-Y43 HydrophobicContact CG-CD2 4.36Å; K33-Y43 HydrophobicContact CG-CE1 3.51Å; K33-Y43 HydrophobicContact CG-CE2 4.17Å; K33-Y43 HydrophobicContact CG-CG 4.19Å
34S95.9Very high96Very high113 Ų11359 Ų5979%0.7932%0.315SS*.EExtended strand (participates in β ladder)trans-94.427.6-169.7-52.30000113.1S32S32-S34 PolarHBondContact OG-N 3.02Å
35F96.3Very high96.1Very high26 Ų2659 Ų5911%0.11432%0.315CS..EExtended strand (participates in β ladder)trans-106.1156.6-178.7-75.8-99000111.5K33 A42 L44 Y115 K116 I121K33-F35 VanDerWaalsContact C-N 3.3Å; K33-F35 PolarHBondContact O-N 2.79Å; F35-A42 CarbonylContact C-O 3.48Å; F35-A42 HydrophobicContact CB-CB 4.4Å; F35-A42 WeakPolarHBondContact CB-O 3.16Å; F35-A42 PolarHBondContact N-O 3.08Å; F35-A42 PolarHBondContact O-N 2.82Å; F35-L44 HydrophobicContact CD2-CB 3.78Å; F35-L44 HydrophobicContact CE2-CB 3.65Å; F35-L44 HydrophobicContact CE2-CD2 3.85Å; F35-L44 HydrophobicContact CE2-CG 4.26Å; F35-L44 HydrophobicContact CG-CB 4.47Å; F35-L44 HydrophobicContact CZ-CB 4.22Å; F35-L44 HydrophobicContact CZ-CD1 4.4Å; F35-L44 HydrophobicContact CZ-CD2 3.84Å; F35-L44 HydrophobicContact CZ-CG 4.4Å; F35-Y115 HydrophobicContact CE2-CE2 4.45Å; F35-Y115 AromaticContact CZ-CE2 3.99Å; F35-Y115 HydrophobicContact CZ-CE2 3.99Å; F35-Y115 WeakPolarHBondContact CZ-OH 3.27Å; F35-K116 HydrophobicContact CE1-CD 4.39Å; F35-K116 HydrophobicContact CZ-CG 4.44Å; F35-I121 HydrophobicContact CB-CD1 3.83Å; F35-I121 HydrophobicContact CD1-CD1 3.34Å; F35-I121 HydrophobicContact CD2-CD1 4.24Å; F35-I121 HydrophobicContact CE1-CD1 3.87Å; F35-I121 HydrophobicContact CG-CD1 3.54Å
36Q95.3Very high96.1Very high138 Ų13862.5 Ų62.565%0.64533%0.334SS*.EExtended strand (participates in β ladder)trans-126.5126.8177.5-170.6166.2-72.500109.7G40 W82Q36-G40 CarbonylContact C-O 3.46Å; Q36-G40 WeakPolarHBondContact CA-O 3.37Å; Q36-G40 WeakPolarHBondContact CG-O 3.34Å; Q36-W82 WeakPolarHBondContact O-CH2 3.41Å
37G92.5Very high96.2Very high11 Ų1163.5 Ų63.511%0.11334%0.343CS..EExtended strand (participates in β ladder)trans-87.6-178.5170.400000113.2Q39 G40 E123G37-Q39 VanDerWaalsContact C-N 3.27Å; G37-Q39 PolarHBondContact O-N 3.16Å; G37-G40 WeakPolarHBondContact CA-O 3.15Å; G37-G40 PolarHBondContact N-O 3.1Å; G37-E123 VanDerWaalsContact CA-CD 3.43Å; G37-E123 WeakPolarHBondContact CA-OE2 3.47Å
38S91.7Very high96.3Very high99 Ų9963.3 Ų63.369%0.69234%0.344SS*.THydrogen-bonded Turntrans-65.5-32.2174.261.10000112.4E123S38-E123 VanDerWaalsContact N-CD 3.35Å; S38-E123 PolarHBondContact N-OE1 3.04Å; S38-E123 PolarHBondContact N-OE2 3.26Å; S38-E123 PolarHBondContact OG-OE1 3.19Å
39Q93.9Very high96.5Very high141 Ų14159.1 Ų59.166%0.65932%0.323SS*.THydrogen-bonded Turntrans-10718.4-177-53.9-74.545.700112.7G37 E123 A125G37-Q39 VanDerWaalsContact C-N 3.27Å; G37-Q39 PolarHBondContact O-N 3.16Å; Q39-E123 VanDerWaalsContact CA-OE2 3.31Å; Q39-E123 WeakPolarHBondContact CA-OE2 3.23Å; Q39-E123 VanDerWaalsContact CB-OE2 3.27Å; Q39-E123 WeakPolarHBondContact CB-OE2 3.43Å; Q39-E123 PolarHBondContact N-OE2 3.17Å; Q39-A125 HydrophobicContact CB-CB 4.2Å
40G95.6Very high96.6Very high28 Ų2857.3 Ų57.329%0.28932%0.315SS..EExtended strand (participates in β ladder)trans115.5-136.517400000113.6Q36 G37Q36-G40 CarbonylContact C-O 3.46Å; Q36-G40 WeakPolarHBondContact CA-O 3.37Å; Q36-G40 WeakPolarHBondContact CG-O 3.34Å; G37-G40 WeakPolarHBondContact CA-O 3.15Å; G37-G40 PolarHBondContact N-O 3.1Å
41K97.8Very high96.6Very high153 Ų15357.2 Ų57.267%0.66532%0.316SS*.EExtended strand (participates in β ladder)trans-65.5139.1-172.2-69.8-176.2-179.6179.30111.7L124K41-L124 HydrophobicContact CB-CD1 4.47Å; K41-L124 HydrophobicContact CB-CD2 4.07Å; K41-L124 PolarHBondContact O-N 2.83Å
42A98.2Very high96.6Very high0 Ų054 Ų540%030%0.301CS..EExtended strand (participates in β ladder)trans-138.1155.1176.300000111.2F35 I121 I122 E123F35-A42 CarbonylContact C-O 3.48Å; F35-A42 HydrophobicContact CB-CB 4.4Å; F35-A42 WeakPolarHBondContact CB-O 3.16Å; F35-A42 PolarHBondContact N-O 3.08Å; F35-A42 PolarHBondContact O-N 2.82Å; A42-I121 HydrophobicContact CB-CG2 3.64Å; A42-I122 WeakPolarHBondContact CA-O 3.34Å; A42-E123 HydrophobicContact CB-CG 4.2Å
43Y98.5Very high96.6Very high38 Ų3855.2 Ų55.215%0.14931%0.309CS..EExtended strand (participates in β ladder)trans-116.3145.4-179.3-71.3-5.9000110.8Y15 L30 S32 K33 F45 I121 I122 L124 M127Y15-Y43 HydrophobicContact CE1-CD2 4.24Å; Y15-Y43 HydrophobicContact CE1-CE2 4.16Å; L30-Y43 HydrophobicContact CD1-CD2 3.87Å; L30-Y43 HydrophobicContact CD1-CG 3.88Å; S32-Y43 WeakPolarHBondContact O-CA 3.48Å; K33-Y43 VanDerWaalsContact CA-CD1 3.45Å; K33-Y43 HydrophobicContact CB-CD1 3.69Å; K33-Y43 HydrophobicContact CB-CE1 3.43Å; K33-Y43 VanDerWaalsContact CB-CE1 3.43Å; K33-Y43 HydrophobicContact CD-CE1 3.98Å; K33-Y43 HydrophobicContact CD-CE2 4.31Å; K33-Y43 HydrophobicContact CG-CD1 3.75Å; K33-Y43 HydrophobicContact CG-CD2 4.36Å; K33-Y43 HydrophobicContact CG-CE1 3.51Å; K33-Y43 HydrophobicContact CG-CE2 4.17Å; K33-Y43 HydrophobicContact CG-CG 4.19Å; Y43-F45 HydrophobicContact CD2-CZ 4.24Å; Y43-I121 WeakPolarHBondContact O-CA 3.45Å; Y43-I122 PolarHBondContact N-O 2.96Å; Y43-I122 PolarHBondContact O-N 3.41Å; Y43-L124 HydrophobicContact CD1-CD1 3.61Å; Y43-L124 HydrophobicContact CD2-CD1 3.89Å; Y43-L124 HydrophobicContact CE1-CD1 3.63Å; Y43-L124 HydrophobicContact CE1-CD2 4.13Å; Y43-L124 HydrophobicContact CE1-CG 4.48Å; Y43-L124 HydrophobicContact CE2-CD1 3.88Å; Y43-L124 HydrophobicContact CE2-CD2 4.46Å; Y43-L124 HydrophobicContact CE2-CG 4.43Å; Y43-L124 HydrophobicContact CG-CD1 3.74Å; Y43-M127 HydrophobicContact CD2-CE 3.89Å; Y43-M127 HydrophobicContact CE2-CE 4.48Å
44L98.3Very high96.6Very high0 Ų051.4 Ų51.40%030%0.299CS..EExtended strand (participates in β ladder)trans-96.3125.6174.7-172.976.4000110.2I31 S32 F35 Y84 Y115 K119 Y120 I121I31-L44 HydrophobicContact CB-CB 4.47Å; I31-L44 HydrophobicContact CB-CD2 4.09Å; I31-L44 HydrophobicContact CB-CG 4.32Å; I31-L44 HydrophobicContact CD1-CD2 4.16Å; I31-L44 HydrophobicContact CD1-CG 4.35Å; I31-L44 HydrophobicContact CG2-CD2 3.95Å; I31-L44 PolarHBondContact N-O 3.2Å; S32-L44 PolarHBondContact N-O 3.02Å; S32-L44 PolarHBondContact O-N 3.36Å; F35-L44 HydrophobicContact CD2-CB 3.78Å; F35-L44 HydrophobicContact CE2-CB 3.65Å; F35-L44 HydrophobicContact CE2-CD2 3.85Å; F35-L44 HydrophobicContact CE2-CG 4.26Å; F35-L44 HydrophobicContact CG-CB 4.47Å; F35-L44 HydrophobicContact CZ-CB 4.22Å; F35-L44 HydrophobicContact CZ-CD1 4.4Å; F35-L44 HydrophobicContact CZ-CD2 3.84Å; F35-L44 HydrophobicContact CZ-CG 4.4Å; L44-Y84 HydrophobicContact CD1-CD2 4.44Å; L44-Y84 HydrophobicContact CD1-CE2 4.33Å; L44-Y115 HydrophobicContact CD2-CD2 3.85Å; L44-Y115 HydrophobicContact CD2-CE2 3.59Å; L44-K119 HydrophobicContact CD1-CB 3.64Å; L44-K119 HydrophobicContact CD2-CB 4.44Å; L44-K119 HydrophobicContact CG-CB 4.12Å; L44-Y120 CarbonylContact C-O 3.52Å; L44-Y120 WeakPolarHBondContact CA-O 3.43Å; L44-I121 HydrophobicContact CB-CD1 3.99Å; L44-I121 HydrophobicContact CD1-CD1 3.46Å; L44-I121 VanDerWaalsContact CD1-CD1 3.46Å; L44-I121 HydrophobicContact CD1-CG1 3.96Å; L44-I121 HydrophobicContact CG-CD1 4.36Å
45F98.4Very high96.6Very high0 Ų050.6 Ų50.60%029%0.292CS..EExtended strand (participates in β ladder)trans-117.5144.7178.5-65.5-86.3000111.7Y15 A25 E29 L30 Y43 V48 K119 Y120 I122 M127Y15-F45 HydrophobicContact CD1-CZ 4.49Å; Y15-F45 AromaticContact CD2-CE1 3.52Å; Y15-F45 HydrophobicContact CD2-CE1 3.52Å; Y15-F45 AromaticContact CD2-CZ 3.64Å; Y15-F45 HydrophobicContact CD2-CZ 3.64Å; Y15-F45 AromaticContact CE2-CE1 3.59Å; Y15-F45 HydrophobicContact CE2-CE1 3.59Å; Y15-F45 AromaticContact CE2-CZ 3.76Å; Y15-F45 HydrophobicContact CE2-CZ 3.76Å; Y15-F45 HydrophobicContact CG-CE1 4.33Å; Y15-F45 HydrophobicContact CG-CZ 4.02Å; A25-F45 HydrophobicContact CB-CD1 3.62Å; A25-F45 HydrophobicContact CB-CE1 3.74Å; A25-F45 HydrophobicContact CB-CG 4.14Å; A25-F45 HydrophobicContact CB-CZ 4.34Å; E29-F45 HydrophobicContact CB-CD1 4.39Å; E29-F45 CarbonylContact O-C 3.46Å; E29-F45 VanDerWaalsContact O-CA 3.27Å; E29-F45 WeakPolarHBondContact O-CA 3.11Å; L30-F45 HydrophobicContact CB-CD1 4.19Å; L30-F45 HydrophobicContact CB-CE1 3.94Å; L30-F45 HydrophobicContact CD1-CD1 4.16Å; L30-F45 HydrophobicContact CD1-CE1 3.71Å; L30-F45 HydrophobicContact CD1-CE2 4.36Å; L30-F45 HydrophobicContact CD1-CZ 3.83Å; L30-F45 HydrophobicContact CG-CE1 4.42Å; Y43-F45 HydrophobicContact CD2-CZ 4.24Å; F45-V48 HydrophobicContact CB-CG1 3.95Å; F45-K119 WeakPolarHBondContact O-CB 3.42Å; F45-Y120 PolarHBondContact N-O 3.37Å; F45-Y120 PolarHBondContact O-N 3.49Å; F45-I122 HydrophobicContact CD2-CB 4.37Å; F45-I122 HydrophobicContact CD2-CD1 4.2Å; F45-I122 HydrophobicContact CD2-CG1 4.36Å; F45-I122 HydrophobicContact CE2-CB 4.17Å; F45-I122 HydrophobicContact CE2-CD1 4.37Å; F45-M127 HydrophobicContact CE2-CE 4.05Å; F45-M127 HydrophobicContact CE2-SD 3.98Å; F45-M127 HydrophobicContact CZ-CE 3.95Å; F45-M127 HydrophobicContact CZ-SD 3.95Å
46N97.3Very high96.5Very high76 Ų7652.4 Ų52.441%0.40631%0.312SS..SBendtrans-72.6-51.4173.8-179.965.8000112E29 I31 K119E29-N46 PolarHBondContact O-N 2.85Å; E29-N46 WeakPolarHBondContact OE2-CB 3.49Å; E29-N46 PolarHBondContact OE2-ND2 3.38Å; I31-N46 HydrophobicContact CD1-CB 3.81Å; I31-N46 HydrophobicContact CG1-CB 4.07Å; N46-K119 HydrophobicContact CB-CD 4.48Å; N46-K119 WeakPolarHBondContact OD1-CE 3.4Å
47S96.6Very high96.4Very high54 Ų5450.6 Ų50.638%0.37830%0.303SS..  trans-132.7151.9177.2-169.20000111.4E29E29-S47 WeakPolarHBondContact CB-O 3.34Å; E29-S47 WeakPolarHBondContact OE2-CB 3.38Å; E29-S47 PolarHBondContact OE2-N 3.4Å; E29-S47 VanDerWaalsContact OE2-N 3.12Å
48V97.8Very high96.4Very high20 Ų2055.3 Ų55.312%0.12132%0.322CS..  trans-139.9157.8179.8-59.40000110.1L24 A25 F45 V51 Y120 I122L24-V48 CarbonylContact O-C 3.54Å; L24-V48 WeakPolarHBondContact O-CA 3.49Å; L24-V48 VanDerWaalsContact O-CB 3.27Å; L24-V48 WeakPolarHBondContact O-CB 3.43Å; A25-V48 HydrophobicContact CB-CG1 4.37Å; F45-V48 HydrophobicContact CB-CG1 3.95Å; V48-V51 HydrophobicContact CB-CG2 4.08Å; V48-V51 HydrophobicContact CG2-CB 3.82Å; V48-V51 HydrophobicContact CG2-CG1 4.18Å; V48-V51 HydrophobicContact CG2-CG2 3.86Å; V48-Y120 HydrophobicContact CB-CD1 4.49Å; V48-Y120 HydrophobicContact CB-CG 4.41Å; V48-Y120 HydrophobicContact CG1-CD1 4.28Å; V48-Y120 HydrophobicContact CG1-CD2 4.15Å; V48-Y120 HydrophobicContact CG1-CG 3.8Å; V48-Y120 HydrophobicContact CG2-CD1 3.38Å; V48-Y120 HydrophobicContact CG2-CD2 4.01Å; V48-Y120 HydrophobicContact CG2-CE1 3.43Å; V48-Y120 VanDerWaalsContact CG2-CE1 3.43Å; V48-Y120 HydrophobicContact CG2-CE2 4.11Å; V48-Y120 HydrophobicContact CG2-CG 3.67Å; V48-I122 HydrophobicContact CG1-CD1 3.92Å
49V96.9Very high96.4Very high37 Ų3754.1 Ų54.122%0.22430%0.303CS..SBendtrans-127.3156.2179.4-65.40000110.7A6 L8 H23 L24 V51A6-V49 HydrophobicContact CB-CB 4.04Å; A6-V49 HydrophobicContact CB-CG1 4.12Å; L8-V49 HydrophobicContact CD1-CG2 4.24Å; L8-V49 HydrophobicContact CD2-CG1 4.44Å; L8-V49 HydrophobicContact CD2-CG2 4.24Å; L8-V49 HydrophobicContact CG-CG2 4.19Å; H23-V49 HydrophobicContact CB-CG2 4.35Å; L24-V49 WeakPolarHBondContact CA-O 3.37Å; L24-V49 PolarHBondContact O-N 3.38Å; V49-V51 PolarHBondContact O-N 3.23Å
50N97.5Very high96.2Very high22 Ų2253 Ų5312%0.11831%0.305CS..SBendtrans56.331.8-179.1-48.6-54.6000113.4Q5 A6 H23 E74Q5-N50 WeakPolarHBondContact CA-OD1 3.15Å; A6-N50 PolarHBondContact N-OD1 2.8Å; A6-N50 PolarHBondContact O-ND2 2.94Å; A6-N50 VanDerWaalsContact O-ND2 3.14Å; H23-N50 WeakPolarHBondContact O-CB 3.19Å; H23-N50 PolarHBondContact O-ND2 3.48Å; N50-E74 WeakPolarHBondContact O-CB 3.44Å; N50-E74 PolarHBondContact O-N 2.79Å
51V98.2Very high95.9Very high33 Ų3353.4 Ų53.420%0.230%0.3CS..EExtended strand (participates in β ladder)trans-117.5125.5179.6172.40000109.6L24 V48 V49 I71 Y72 L80L24-V51 HydrophobicContact CD2-CG2 3.92Å; V48-V51 HydrophobicContact CB-CG2 4.08Å; V48-V51 HydrophobicContact CG2-CB 3.82Å; V48-V51 HydrophobicContact CG2-CG1 4.18Å; V48-V51 HydrophobicContact CG2-CG2 3.86Å; V49-V51 PolarHBondContact O-N 3.23Å; V51-I71 HydrophobicContact CG1-CB 3.61Å; V51-I71 HydrophobicContact CG1-CD1 4.05Å; V51-I71 HydrophobicContact CG1-CG1 4.33Å; V51-I71 HydrophobicContact CG1-CG2 4Å; V51-Y72 WeakPolarHBondContact CA-O 3.49Å; V51-L80 HydrophobicContact CG2-CD1 3.91Å
52G97.5Very high95.4Very high8 Ų854 Ų548%0.08231%0.31CS..EExtended strand (participates in β ladder)trans-89.7154.2167.200000111I71 Y72 E74G52-I71 VanDerWaalsContact O-CA 3.31Å; G52-I71 WeakPolarHBondContact O-CA 3.39Å; G52-Y72 PolarHBondContact N-O 2.93Å; G52-Y72 PolarHBondContact O-N 2.88Å; G52-E74 WeakPolarHBondContact CA-OE2 3.27Å
53C97.2Very high94.7Very high57 Ų5757.1 Ų57.139%0.38533%0.329SS..EExtended strand (participates in β ladder)trans-122.2131.1-179.2-163.70000109.4A69 I71C53-A69 WeakPolarHBondContact SG-CB 3.48Å; C53-I71 HydrophobicContact CB-CG2 4.44Å
54G96.8Very high94.1Very high25 Ų2556.9 Ų56.926%0.25834%0.338SS..  trans-75.4-173.417300000113A69 D70G54-A69 WeakPolarHBondContact O-CB 3.36Å; G54-D70 PolarHBondContact N-O 2.87Å
55P96.1Very high93.6Very high96 Ų9660.3 Ų60.362%0.62336%0.356SS*.  trans-63.4153.9173.329.5-34.8000111.3A69P55-A69 VanDerWaalsContact O-CB 3.24Å; P55-A69 WeakPolarHBondContact O-CB 3.47Å
56A94.8Very high93.1Very high65 Ų6561.6 Ų61.654%0.53736%0.362SS..  trans-74.8138.2171.500000110.7V68 Q85A56-V68 CarbonylContact C-O 3.52Å; A56-V68 WeakPolarHBondContact CA-O 3.33Å; A56-Q85 HydrophobicContact CB-CG 3.81Å
57E93.8Very high92.9Very high99 Ų9959.8 Ų59.846%0.46336%0.358SS..EExtended strand (participates in β ladder)trans-140148.3179.9-64.4178.517800109.7R59 A67 V68E57-R59 IonicContact OE2-NH2 3.46Å; E57-A67 WeakPolarHBondContact O-CA 3.46Å; E57-V68 PolarHBondContact N-O 2.77Å; E57-V68 PolarHBondContact O-N 2.87Å; E57-V68 VanDerWaalsContact O-O 3.1Å
58E91.7Very high92.8Very high111 Ų11157.2 Ų57.252%0.51934%0.34SS..EExtended strand (participates in β ladder)trans-85127.9171.1-67.6-177.8-179.600110L65 I94E58-L65 HydrophobicContact CB-CD1 4.19Å; E58-I94 WeakPolarHBondContact OE1-CD1 3.36Å
59R92.1Very high92.8Very high74 Ų7456.3 Ų56.328%0.27933%0.334SS..EExtended strand (participates in β ladder)trans-135.1130.2-178.4-163.1177.3-66.6170.51.4110.4E57 L61 H66 V68 D70E57-R59 IonicContact OE2-NH2 3.46Å; R59-L61 HydrophobicContact CG-CD2 4.06Å; R59-L61 PolarHBondContact O-N 2.95Å; R59-H66 PolarHBondContact N-O 2.82Å; R59-H66 PolarHBondContact O-N 3.36Å; R59-V68 HydrophobicContact CB-CG2 3.72Å; R59-D70 IonicContact CZ-OD1 3.7Å; R59-D70 IonicContact NH1-OD1 2.87Å; R59-D70 PolarHBondContact NH1-OD1 2.92Å; R59-D70 VanDerWaalsContact NH1-OD1 3.15Å; R59-D70 IonicContact NH2-OD1 3.6Å; R59-D70 PolarHBondContact NH2-OD1 2.81Å; R59-D70 IonicContact NH2-OD2 3.48Å
60V89.2Confident92.9Very high116 Ų11657.7 Ų57.770%0.70334%0.341SS*.EExtended strand (participates in β ladder)trans-75.9116.2169.6-178.60000108.4L65V60-L65 HydrophobicContact CG2-CD1 3.83Å
61L88.9Confident92.9Very high37 Ų3756.7 Ų56.719%0.19434%0.335CS..EExtended strand (participates in β ladder)trans-109.9178.3175.6-58.6-180000109.8R59 T63 G64 H66 V68 Y84R59-L61 HydrophobicContact CG-CD2 4.06Å; R59-L61 PolarHBondContact O-N 2.95Å; L61-T63 PolarHBondContact O-N 2.92Å; L61-T63 VanDerWaalsContact O-N 3.08Å; L61-G64 PolarHBondContact N-O 2.82Å; L61-G64 PolarHBondContact O-N 2.9Å; L61-H66 HydrophobicContact CD1-CB 4.06Å; L61-V68 HydrophobicContact CD1-CG1 4.22Å; L61-Y84 HydrophobicContact CD1-CE1 3.96Å
62L87Confident92.9Very high167 Ų16758.7 Ų58.787%0.87434%0.339SS*.THydrogen-bonded Turntrans-54.6-31.3179-66175.6000113.5
63T84.1Confident93Very high65 Ų6558.3 Ų58.340%0.39934%0.335SS..THydrogen-bonded Turntrans-100.225.5-179.255.20000112.9L61 H66 K116L61-T63 PolarHBondContact O-N 2.92Å; L61-T63 VanDerWaalsContact O-N 3.08Å; T63-H66 PolarHBondContact O-NE2 3.35Å; T63-H66 VanDerWaalsContact O-NE2 3.1Å; T63-H66 PolarHBondContact OG1-NE2 2.75Å; T63-H66 VanDerWaalsContact OG1-NE2 3.16Å; T63-K116 PolarHBondContact OG1-NZ 3.41Å; T63-K116 VanDerWaalsContact OG1-NZ 3.12Å
64G86.2Confident93Very high33 Ų3358.3 Ų58.334%0.3433%0.33SS..EExtended strand (participates in β ladder)trans100-159.7178.500000114.2L61 H66L61-G64 PolarHBondContact N-O 2.82Å; L61-G64 PolarHBondContact O-N 2.9Å; G64-H66 PolarHBondContact O-CD2 2.78Å
65L87.2Confident92.9Very high71 Ų7160.3 Ų60.337%0.37234%0.339SS..EExtended strand (participates in β ladder)trans-81.1129.9-179.5-172.967000110.8E58 V60E58-L65 HydrophobicContact CB-CD1 4.19Å; V60-L65 HydrophobicContact CG2-CD1 3.83Å
66H89.1Confident93Very high28 Ų2857.9 Ų57.913%0.1332%0.324CS..EExtended strand (participates in β ladder)trans-134.1142.3178-66.5-92.4000110.5R59 L61 T63 G64 V68 Y84R59-H66 PolarHBondContact N-O 2.82Å; R59-H66 PolarHBondContact O-N 3.36Å; L61-H66 HydrophobicContact CD1-CB 4.06Å; T63-H66 PolarHBondContact O-NE2 3.35Å; T63-H66 VanDerWaalsContact O-NE2 3.1Å; T63-H66 PolarHBondContact OG1-NE2 2.75Å; T63-H66 VanDerWaalsContact OG1-NE2 3.16Å; G64-H66 PolarHBondContact O-CD2 2.78Å; H66-V68 HydrophobicContact CB-CG1 4.03Å; H66-Y84 HydrophobicContact CB-CD1 4.23Å; H66-Y84 HydrophobicContact CB-CE1 4.15Å; H66-Y84 AromaticContact CG-CE1 3.82Å; H66-Y84 AromaticContact ND1-CD1 3.86Å; H66-Y84 AromaticContact ND1-CE1 3.6Å
67A92.8Very high93.1Very high38 Ų3860 Ų6031%0.31432%0.321SS..EExtended strand (participates in β ladder)trans-80.2121.8163.600000109.1E57 Q85E57-A67 WeakPolarHBondContact O-CA 3.46Å; A67-Q85 HydrophobicContact CB-CB 3.93Å; A67-Q85 HydrophobicContact CB-CG 4.31Å; A67-Q85 WeakPolarHBondContact O-CB 3.35Å; A67-Q85 PolarHBondContact O-N 3.2Å
68V95.1Very high93.3Very high0 Ų057 Ų570%031%0.309CS..EExtended strand (participates in β ladder)trans-135.6163.3-176.7-61.70000110.7A56 E57 R59 L61 H66 W82 K83 Y84A56-V68 CarbonylContact C-O 3.52Å; A56-V68 WeakPolarHBondContact CA-O 3.33Å; E57-V68 PolarHBondContact N-O 2.77Å; E57-V68 PolarHBondContact O-N 2.87Å; E57-V68 VanDerWaalsContact O-O 3.1Å; R59-V68 HydrophobicContact CB-CG2 3.72Å; L61-V68 HydrophobicContact CD1-CG1 4.22Å; H66-V68 HydrophobicContact CB-CG1 4.03Å; V68-W82 HydrophobicContact CB-CB 4.5Å; V68-K83 CarbonylContact C-O 3.54Å; V68-K83 WeakPolarHBondContact CA-O 3.15Å; V68-Y84 HydrophobicContact CG1-CD1 4.16Å; V68-Y84 HydrophobicContact CG1-CE1 4.48Å
69A97.2Very high93.6Very high1 Ų155.5 Ų55.51%0.00831%0.308CS..EExtended strand (participates in β ladder)trans-135.8137.3166.800000109.8C53 G54 P55 W82 K83C53-A69 WeakPolarHBondContact SG-CB 3.48Å; G54-A69 WeakPolarHBondContact O-CB 3.36Å; P55-A69 VanDerWaalsContact O-CB 3.24Å; P55-A69 WeakPolarHBondContact O-CB 3.47Å; A69-W82 CarbonylContact O-C 3.55Å; A69-W82 WeakPolarHBondContact O-CA 3.32Å; A69-W82 WeakPolarHBondContact O-CB 3.47Å; A69-K83 PolarHBondContact N-O 2.89Å; A69-K83 PolarHBondContact O-N 3Å
70D97.7Very high93.9Very high66 Ų6652 Ų5235%0.35330%0.295SS..EExtended strand (participates in β ladder)trans-62.4143.8173.8-69.2-17.8000110G54 R59G54-D70 PolarHBondContact N-O 2.87Å; R59-D70 IonicContact CZ-OD1 3.7Å; R59-D70 IonicContact NH1-OD1 2.87Å; R59-D70 PolarHBondContact NH1-OD1 2.92Å; R59-D70 VanDerWaalsContact NH1-OD1 3.15Å; R59-D70 IonicContact NH2-OD1 3.6Å; R59-D70 PolarHBondContact NH2-OD1 2.81Å; R59-D70 IonicContact NH2-OD2 3.48Å
71I98.5Very high94.3Very high0 Ų046.7 Ų46.70%026%0.263CS..EExtended strand (participates in β ladder)trans-120.6146.217860.1165000110.8V51 G52 C53 L80 G81 K83 Y120 I122V51-I71 HydrophobicContact CG1-CB 3.61Å; V51-I71 HydrophobicContact CG1-CD1 4.05Å; V51-I71 HydrophobicContact CG1-CG1 4.33Å; V51-I71 HydrophobicContact CG1-CG2 4Å; G52-I71 VanDerWaalsContact O-CA 3.31Å; G52-I71 WeakPolarHBondContact O-CA 3.39Å; C53-I71 HydrophobicContact CB-CG2 4.44Å; I71-L80 HydrophobicContact CD1-CB 4.36Å; I71-L80 HydrophobicContact CG1-CB 4.27Å; I71-L80 PolarHBondContact O-N 3.49Å; I71-G81 WeakPolarHBondContact CG1-O 3.47Å; I71-G81 PolarHBondContact N-O 3.15Å; I71-K83 HydrophobicContact CG2-CB 3.87Å; I71-Y120 HydrophobicContact CD1-CD1 4.3Å; I71-Y120 HydrophobicContact CG2-CD1 4.44Å; I71-I122 HydrophobicContact CD1-CG1 3.87Å
72Y98.4Very high94.8Very high75 Ų7545.9 Ų45.929%0.29426%0.258SS..EExtended strand (participates in β ladder)trans-137.6154.7-178.454.8-94.7000111.2V51 G52 E74 K77 T78V51-Y72 WeakPolarHBondContact CA-O 3.49Å; G52-Y72 PolarHBondContact N-O 2.93Å; G52-Y72 PolarHBondContact O-N 2.88Å; Y72-E74 WeakPolarHBondContact CE2-OE2 3.48Å; Y72-E74 PolarHBondContact O-N 2.7Å; Y72-K77 HydrophobicContact CD2-CD 3.92Å; Y72-K77 HydrophobicContact CE2-CD 3.98Å; Y72-T78 CarbonylContact C-O 3.55Å; Y72-T78 VanDerWaalsContact CA-O 3.27Å; Y72-T78 WeakPolarHBondContact CA-O 3.4Å; Y72-T78 WeakPolarHBondContact CB-O 3.41Å
73C98.4Very high95.3Very high0 Ų040.1 Ų40.10%023%0.226CC..EExtended strand (participates in β ladder)trans-65.1122.7173.1179.30000109.4C20 C75 C76 K77 T78 L80C20-C73 PolarHBondContact SG-SG 3.12Å; C73-C75 PolarHBondContact O-N 3.47Å; C73-C75 VanDerWaalsContact O-N 3.15Å; C73-C76 PolarHBondContact O-N 3.09Å; C73-K77 WeakPolarHBondContact O-CA 3.19Å; C73-K77 PolarHBondContact O-N 3.14Å; C73-T78 PolarHBondContact N-O 2.93Å; C73-L80 HydrophobicContact CB-CD1 4.04Å; C73-L80 HydrophobicContact CB-CD2 4.32Å; C73-L80 HydrophobicContact CB-CG 4.33Å
74E97.4Very high95.8Very high58 Ų5837.6 Ų37.627%0.27121%0.209SC..THydrogen-bonded Turntrans-63.3-26.4-178.2-167.654.2-138.400111.7T3 N50 G52 Y72 K77T3-E74 HydrophobicContact CG2-CG 4.12Å; N50-E74 WeakPolarHBondContact O-CB 3.44Å; N50-E74 PolarHBondContact O-N 2.79Å; G52-E74 WeakPolarHBondContact CA-OE2 3.27Å; Y72-E74 WeakPolarHBondContact CE2-OE2 3.48Å; Y72-E74 PolarHBondContact O-N 2.7Å; E74-K77 WeakPolarHBondContact O-CE 3.24Å; E74-K77 PolarHBondContact O-NZ 3.03Å; E74-K77 VanDerWaalsContact O-NZ 3.15Å; E74-K77 IonicContact OE1-NZ 3.15Å; E74-K77 PolarHBondContact OE1-NZ 3.31Å; E74-K77 IonicContact OE2-NZ 2.69Å; E74-K77 PolarHBondContact OE2-NZ 2.91Å
75C96.1Very high96.2Very high66 Ų6638.6 Ų38.645%0.44621%0.205SC..THydrogen-bonded Turntrans-79.5-47.7-178.4-171.30000113.9Q5 A22 C73Q5-C75 PolarHBondContact NE2-SG 2.83Å; Q5-C75 VanDerWaalsContact NE2-SG 3.42Å; A22-C75 HydrophobicContact CB-CB 4.04Å; C73-C75 PolarHBondContact O-N 3.47Å; C73-C75 VanDerWaalsContact O-N 3.15Å
76C97.4Very high96Very high45 Ų4537.6 Ų37.630%0.30421%0.207SC..THydrogen-bonded Turntrans-117.20.2-173.568.10000114.5C17 C20 C73 T78C17-C76 VanDerWaalsContact SG-SG 3.66Å; C20-C76 HydrophobicContact CB-CB 3.83Å; C20-C76 PolarHBondContact SG-SG 3.31Å; C73-C76 PolarHBondContact O-N 3.09Å; C76-T78 PolarHBondContact O-N 3.09Å; C76-T78 PolarHBondContact SG-OG1 3.07Å
77K97.6Very high95.1Very high111 Ų11141.2 Ų41.248%0.48323%0.227SC..  trans626.8178.4-51.1-56-178.3-176.20115.7Y72 C73 E74 T79Y72-K77 HydrophobicContact CD2-CD 3.92Å; Y72-K77 HydrophobicContact CE2-CD 3.98Å; C73-K77 WeakPolarHBondContact O-CA 3.19Å; C73-K77 PolarHBondContact O-N 3.14Å; E74-K77 WeakPolarHBondContact O-CE 3.24Å; E74-K77 PolarHBondContact O-NZ 3.03Å; E74-K77 VanDerWaalsContact O-NZ 3.15Å; E74-K77 IonicContact OE1-NZ 3.15Å; E74-K77 PolarHBondContact OE1-NZ 3.31Å; E74-K77 IonicContact OE2-NZ 2.69Å; E74-K77 PolarHBondContact OE2-NZ 2.91Å; K77-T79 PolarHBondContact O-N 3.21Å
78T97.7Very high93.2Very high35 Ų3545.4 Ų45.422%0.21525%0.248CC..  trans-61.7131170.3-48.80000110.1H19 Y72 C73 C76H19-T78 WeakPolarHBondContact CD2-CG2 3.47Å; H19-T78 PolarHBondContact CD2-OG1 3.01Å; H19-T78 WeakPolarHBondContact NE2-CG2 3.2Å; Y72-T78 CarbonylContact C-O 3.55Å; Y72-T78 VanDerWaalsContact CA-O 3.27Å; Y72-T78 WeakPolarHBondContact CA-O 3.4Å; Y72-T78 WeakPolarHBondContact CB-O 3.41Å; C73-T78 PolarHBondContact N-O 2.93Å; C76-T78 PolarHBondContact O-N 3.09Å; C76-T78 PolarHBondContact SG-OG1 3.07Å
79T98Very high90.9Very high80 Ų8052.2 Ų52.249%0.49129%0.285SS..EExtended strand (participates in β ladder)trans-58.5138.2168.6-51.40000110.8K77 H126K77-T79 PolarHBondContact O-N 3.21Å; T79-H126 PolarHBondContact O-CD2 3.05Å
80L98.5Very high88.5Confident0 Ų056.5 Ų56.50%033%0.329CS..EExtended strand (participates in β ladder)trans-116.6-27.8-177.1-61.5176.5000112.9L24 V51 I71 C73 I122 E123 H126L24-L80 HydrophobicContact CD1-CD1 3.85Å; L24-L80 HydrophobicContact CD1-CD2 4Å; L24-L80 HydrophobicContact CD2-CD1 3.59Å; L24-L80 HydrophobicContact CG-CD1 4.36Å; V51-L80 HydrophobicContact CG2-CD1 3.91Å; I71-L80 HydrophobicContact CD1-CB 4.36Å; I71-L80 HydrophobicContact CG1-CB 4.27Å; I71-L80 PolarHBondContact O-N 3.49Å; C73-L80 HydrophobicContact CB-CD1 4.04Å; C73-L80 HydrophobicContact CB-CD2 4.32Å; C73-L80 HydrophobicContact CB-CG 4.33Å; L80-I122 HydrophobicContact CB-CG2 4.32Å; L80-I122 WeakPolarHBondContact O-CA 3.31Å; L80-E123 PolarHBondContact O-N 3.36Å; L80-H126 HydrophobicContact CD2-CB 3.79Å
81G98.1Very high85.9Confident4 Ų460.7 Ų60.74%0.04135%0.352CS..EExtended strand (participates in β ladder)trans155.2-138.8-174.700000110.4I71 I121I71-G81 WeakPolarHBondContact CG1-O 3.47Å; I71-G81 PolarHBondContact N-O 3.15Å; G81-I121 WeakPolarHBondContact CA-O 3.31Å
82W98Very high83.1Confident21 Ų2164.1 Ų64.18%0.0839%0.386CS..EExtended strand (participates in β ladder)trans-143.7158.8179.662.393.4000113.2Q36 V68 A69 Y84 I121Q36-W82 WeakPolarHBondContact O-CH2 3.41Å; V68-W82 HydrophobicContact CB-CB 4.5Å; A69-W82 CarbonylContact O-C 3.55Å; A69-W82 WeakPolarHBondContact O-CA 3.32Å; A69-W82 WeakPolarHBondContact O-CB 3.47Å; W82-Y84 AromaticContact NE1-CE2 3.92Å; W82-Y84 AromaticContact NE1-CZ 3.98Å; W82-I121 HydrophobicContact CD2-CB 4Å; W82-I121 HydrophobicContact CD2-CG2 4.05Å; W82-I121 HydrophobicContact CE3-CG2 4.15Å; W82-I121 HydrophobicContact CG-CB 4.32Å; W82-I121 HydrophobicContact CH2-CG2 3.92Å; W82-I121 HydrophobicContact CZ2-CB 4.21Å; W82-I121 HydrophobicContact CZ2-CG1 4.21Å; W82-I121 HydrophobicContact CZ2-CG2 3.76Å; W82-I121 HydrophobicContact CZ3-CG2 4.08Å; W82-I121 PolarHBondContact N-O 2.87Å; W82-I121 VanDerWaalsContact N-O 3.07Å; W82-I121 WeakPolarHBondContact O-CA 3.38Å; W82-I121 WeakPolarHBondContact O-CB 3.19Å; W82-I121 PolarHBondContact O-N 3.47Å
83K97.7Very high80.3Confident46 Ų4665 Ų6520%0.240%0.403CS..EExtended strand (participates in β ladder)trans-104.8133.8170.3-175.9-171.3178.41710109.1V68 A69 I71 Q85 G118 K119 Y120V68-K83 CarbonylContact C-O 3.54Å; V68-K83 WeakPolarHBondContact CA-O 3.15Å; A69-K83 PolarHBondContact N-O 2.89Å; A69-K83 PolarHBondContact O-N 3Å; I71-K83 HydrophobicContact CG2-CB 3.87Å; K83-Q85 PolarHBondContact O-N 2.73Å; K83-G118 WeakPolarHBondContact CE-O 3.08Å; K83-K119 WeakPolarHBondContact CA-O 3.25Å; K83-K119 WeakPolarHBondContact CG-O 3.38Å; K83-Y120 HydrophobicContact CB-CD1 3.97Å; K83-Y120 HydrophobicContact CB-CE1 4.14Å; K83-Y120 HydrophobicContact CD-CD1 4.18Å; K83-Y120 HydrophobicContact CD-CE1 3.55Å; K83-Y120 HydrophobicContact CD-CE2 4.43Å; K83-Y120 WeakPolarHBondContact CE-OH 3.49Å; K83-Y120 HydrophobicContact CG-CD1 3.9Å; K83-Y120 HydrophobicContact CG-CE1 3.8Å; K83-Y120 HydrophobicContact CG-CG 4.37Å; K83-Y120 PolarHBondContact NZ-OH 2.82Å; K83-Y120 VanDerWaalsContact NZ-OH 3.09Å
84Y95.6Very high77.8Confident11 Ų1168.9 Ų68.94%0.04342%0.423CS..EExtended strand (participates in β ladder)trans-71.1126.2164.9-72.3-88.3000108.9L44 L61 H66 V68 W82 K116 G118 K119 I121L44-Y84 HydrophobicContact CD1-CD2 4.44Å; L44-Y84 HydrophobicContact CD1-CE2 4.33Å; L61-Y84 HydrophobicContact CD1-CE1 3.96Å; H66-Y84 HydrophobicContact CB-CD1 4.23Å; H66-Y84 HydrophobicContact CB-CE1 4.15Å; H66-Y84 AromaticContact CG-CE1 3.82Å; H66-Y84 AromaticContact ND1-CD1 3.86Å; H66-Y84 AromaticContact ND1-CE1 3.6Å; V68-Y84 HydrophobicContact CG1-CD1 4.16Å; V68-Y84 HydrophobicContact CG1-CE1 4.48Å; W82-Y84 AromaticContact NE1-CE2 3.92Å; W82-Y84 AromaticContact NE1-CZ 3.98Å; Y84-K116 WeakPolarHBondContact CB-O 3.17Å; Y84-K116 HydrophobicContact CD1-CB 4.12Å; Y84-K116 HydrophobicContact CD2-CB 3.87Å; Y84-K116 HydrophobicContact CE1-CB 4.27Å; Y84-K116 HydrophobicContact CE1-CD 3.97Å; Y84-K116 HydrophobicContact CE2-CB 4.03Å; Y84-K116 HydrophobicContact CE2-CD 4.17Å; Y84-K116 HydrophobicContact CE2-CG 4.32Å; Y84-K116 HydrophobicContact CG-CB 3.92Å; Y84-G118 WeakPolarHBondContact O-CA 3.31Å; Y84-G118 PolarHBondContact O-N 2.8Å; Y84-K119 PolarHBondContact N-O 3.15Å; Y84-I121 HydrophobicContact CD2-CG1 4.33Å; Y84-I121 HydrophobicContact CE2-CD1 4.24Å; Y84-I121 HydrophobicContact CE2-CG1 3.71Å
85Q93.6Very high74.8Confident55 Ų5570.9 Ų70.926%0.25744%0.44SS..PPolyproline II helixtrans-67.6142.4174.3-66-64.3-1800109.5A56 A67 K83A56-Q85 HydrophobicContact CB-CG 3.81Å; A67-Q85 HydrophobicContact CB-CB 3.93Å; A67-Q85 HydrophobicContact CB-CG 4.31Å; A67-Q85 WeakPolarHBondContact O-CB 3.35Å; A67-Q85 PolarHBondContact O-N 3.2Å; K83-Q85 PolarHBondContact O-N 2.73Å
86A83.4Confident71.9Confident50 Ų5072.2 Ų72.241%0.41345%0.446SS..PPolyproline II helixtrans-73.8135.3167.800000107.6V88A86-V88 PolarHBondContact O-N 2.9Å; A86-V88 VanDerWaalsContact O-N 3.1Å
87N70.9Confident68.8Low104 Ų10475.6 Ų75.656%0.55647%0.469SS*.  trans-66.3111.8168.2-70.1-57000107.4D89 E117N87-D89 PolarHBondContact O-N 2.77Å; N87-D89 VanDerWaalsContact O-N 3.16Å; N87-E117 PolarHBondContact ND2-OE1 2.84Å
88V52.3Low65.7Low126 Ų12675.2 Ų75.276%0.76448%0.479SS*.  trans-76.3103173.2-174.80000106.8A86A86-V88 PolarHBondContact O-N 2.9Å; A86-V88 VanDerWaalsContact O-N 3.1Å
89D47.3Very low62.9Low143 Ų14377.1 Ų77.177%0.76551%0.506SS*.THydrogen-bonded Turntrans35.8102.7158.2-57.7-32.8000118N87 N91N87-D89 PolarHBondContact O-N 2.77Å; N87-D89 VanDerWaalsContact O-N 3.16Å; D89-N91 VanDerWaalsContact C-N 3.3Å; D89-N91 PolarHBondContact O-N 2.9Å
90G45.7Very low60.4Low91 Ų9183.4 Ų83.494%0.93853%0.529SS*.THydrogen-bonded Turntrans67-5.3133.900000120.9
91N42.6Very low57.5Low154 Ų15486.2 Ų86.282%0.82456%0.559SS**  trans-148.734.5178.9-143.819.4000114.8D89 S93D89-N91 VanDerWaalsContact C-N 3.3Å; D89-N91 PolarHBondContact O-N 2.9Å; N91-S93 VanDerWaalsContact C-N 3.35Å; N91-S93 PolarHBondContact O-N 2.82Å
92G41.4Very low54.7Low71 Ų7197.1 Ų97.173%0.73260%0.599SS**  trans-87.369.7172.800000112I94G92-I94 PolarHBondContact O-N 3.2Å
93S39.8Very low51.8Low93 Ų93104.9 Ų104.965%0.6563%0.633SS**  trans-59.390.6156.3-179.70000107.5N91 T95N91-S93 VanDerWaalsContact C-N 3.35Å; N91-S93 PolarHBondContact O-N 2.82Å; S93-T95 PolarHBondContact O-N 2.81Å; S93-T95 PolarHBondContact OG-OG1 3.28Å
94I45.7Very low49Very low82 Ų82110.7 Ų110.742%0.42166%0.659SS.*  trans-68.888.4155.6-68.8164.6000104.2E58 G92 T96E58-I94 WeakPolarHBondContact OE1-CD1 3.36Å; G92-I94 PolarHBondContact O-N 3.2Å; I94-T96 PolarHBondContact O-N 3.04Å
95T33.9Very low46.4Very low100 Ų100116.6 Ų116.661%0.61369%0.687SS**  trans-6196165.5-58.70000105.6S93 C97S93-T95 PolarHBondContact O-N 2.81Å; S93-T95 PolarHBondContact OG-OG1 3.28Å; T95-C97 PolarHBondContact O-N 2.87Å
96T35.3Very low43.9Very low94 Ų94122.4 Ų122.458%0.57771%0.714SS**  trans-55.9101.3157.8-58.50000105.9I94 C98I94-T96 PolarHBondContact O-N 3.04Å; T96-C98 PolarHBondContact O-N 2.87Å
97C30.9Very low42.2Very low117 Ų117125.2 Ų125.279%0.79172%0.718SS**  trans-73.875.1178.744.40000108.8T95T95-C97 PolarHBondContact O-N 2.87Å
98C33.4Very low40.8Very low102 Ų102124.7 Ų124.769%0.68973%0.728SS**  trans-133.8126.1164.6-55.10000107.9T96T96-C98 PolarHBondContact O-N 2.87Å
99G39.6Very low41Very low75 Ų75124.4 Ų124.477%0.77372%0.717SS**  trans-53.9153.2-172.700000114.6G101G99-G101 PolarHBondContact O-N 3.26Å
100E45.3Very low41.9Very low212 Ų212122.9 Ų122.999%0.99171%0.706SS**SBendtrans44.564.4154-55.4-166.5133.500116.4
101G37.8Very low43.3Very low60 Ų60123.6 Ų123.662%0.61970%0.696SS**  trans177.2107.9166.500000110.5G99 F103G99-G101 PolarHBondContact O-N 3.26Å; G101-F103 PolarHBondContact O-N 2.82Å
102R39.6Very low45.1Very low232 Ų232118.4 Ų118.488%0.87567%0.672SS**  trans-63.478175.7-62.2-177.3-172.7-158.31.4110.4F104R102-F104 PolarHBondContact O-N 3.24Å
103F36Very low47.2Very low184 Ų184116.8 Ų116.881%0.80765%0.645SS**  trans-88.296.8157.4-121.1-97.4000106G101 Q105G101-F103 PolarHBondContact O-N 2.82Å; F103-Q105 PolarHBondContact O-N 2.75Å
104F38.5Very low49.5Very low169 Ų169118.2 Ų118.274%0.74164%0.64SS**  trans-61.287.7156.4-73.6-93.6000105.8R102 E106R102-F104 PolarHBondContact O-N 3.24Å; F104-E106 PolarHBondContact O-N 2.87Å
105Q40.9Very low51.7Low135 Ų135119.7 Ų119.763%0.63164%0.641SS**  trans-68.391.4150.3-84.6-177.435.800103.8F103 H107F103-Q105 PolarHBondContact O-N 2.75Å; Q105-H107 PolarHBondContact O-N 3.39Å
106E42.7Very low54.6Low176 Ų176115.3 Ų115.382%0.82261%0.613SS**  trans-50.496.2153.8-65.1-174.1149.200104.6F104 A108F104-E106 PolarHBondContact O-N 2.87Å; E106-A108 VanDerWaalsContact C-N 3.25Å; E106-A108 PolarHBondContact O-N 2.95Å
107H47.1Very low57.3Low109 Ų109113 Ų11351%0.50560%0.596SS.*  trans-58.9104.4172.8-127.1-158.5000103.1Q105 F109Q105-H107 PolarHBondContact O-N 3.39Å; H107-F109 PolarHBondContact O-N 2.86Å
108A42.2Very low60.3Low93 Ų93108.3 Ų108.377%0.76957%0.567SS**  trans-6485.7179.300000106.5E106 E110E106-A108 VanDerWaalsContact C-N 3.25Å; E106-A108 PolarHBondContact O-N 2.95Å; A108-E110 PolarHBondContact O-N 2.89Å
109F55.1Low63.3Low120 Ų120105.7 Ų105.753%0.52654%0.544SS..  trans-7175.1163.1-172.6-97.8000105.8H107 S111 K114 E117H107-F109 PolarHBondContact O-N 2.86Å; F109-S111 PolarHBondContact O-N 3.06Å; F109-K114 HydrophobicContact CE1-CB 4.4Å; F109-K114 HydrophobicContact CE1-CD 4.29Å; F109-K114 HydrophobicContact CZ-CB 3.99Å; F109-K114 HydrophobicContact CZ-CD 4.12Å; F109-K114 HydrophobicContact CZ-CG 4.01Å; F109-E117 VanDerWaalsContact CE2-OE1 3.29Å; F109-E117 WeakPolarHBondContact CE2-OE1 3.27Å
110E66Low66.1Low112 Ų112104.1 Ų104.152%0.52352%0.515SS..  trans-66.8119.7176.3-159.4-175.4-165.800106.1A108 S112 Q113A108-E110 PolarHBondContact O-N 2.89Å; E110-S112 WeakPolarHBondContact CB-OG 3.33Å; E110-S112 WeakPolarHBondContact CG-OG 3.27Å; E110-S112 PolarHBondContact O-N 3.35Å; E110-S112 PolarHBondContact OE2-OG 2.79Å; E110-Q113 HydrophobicContact CB-CG 4.27Å; E110-Q113 PolarHBondContact O-N 3.31Å
111S74.7Confident68.7Low105 Ų10594 Ų9473%0.73447%0.468SS*.G310 helixtrans-52.8-23.4177.253.90000112.2F109 Q113 K114F109-S111 PolarHBondContact O-N 3.06Å; S111-Q113 PolarHBondContact O-N 3.14Å; S111-K114 PolarHBondContact O-N 3.22Å
112S81.4Confident71.5Confident45 Ų4591.2 Ų91.232%0.31544%0.438SS..G310 helixtrans-58.8-25.1172.178.60000113.6E110 Y115E110-S112 WeakPolarHBondContact CB-OG 3.33Å; E110-S112 WeakPolarHBondContact CG-OG 3.27Å; E110-S112 PolarHBondContact O-N 3.35Å; E110-S112 PolarHBondContact OE2-OG 2.79Å; S112-Y115 WeakPolarHBondContact O-CD1 3.4Å; S112-Y115 WeakPolarHBondContact O-CE1 3.47Å
113Q85.4Confident74.3Confident38 Ų3880.4 Ų80.418%0.17840%0.398CS..G310 helixtrans-97.6-14.8-176.1-54.3-56.8-43.100113.1E110 S111 Y115 K116E110-Q113 HydrophobicContact CB-CG 4.27Å; E110-Q113 PolarHBondContact O-N 3.31Å; S111-Q113 PolarHBondContact O-N 3.14Å; Q113-Y115 PolarHBondContact O-N 3.15Å; Q113-Y115 VanDerWaalsContact O-N 3.13Å; Q113-K116 VanDerWaalsContact O-CB 3.3Å; Q113-K116 WeakPolarHBondContact O-CB 3.31Å; Q113-K116 PolarHBondContact O-N 3.02Å
114K87.8Confident77.3Confident122 Ų12274.4 Ų74.453%0.5337%0.374SS..G310 helixtrans-56.8-33-175.7-174.1173.7-177.3174.80113.3F109 S111 K116 E117F109-K114 HydrophobicContact CE1-CB 4.4Å; F109-K114 HydrophobicContact CE1-CD 4.29Å; F109-K114 HydrophobicContact CZ-CB 3.99Å; F109-K114 HydrophobicContact CZ-CD 4.12Å; F109-K114 HydrophobicContact CZ-CG 4.01Å; S111-K114 PolarHBondContact O-N 3.22Å; K114-K116 PolarHBondContact O-N 3.46Å; K114-K116 VanDerWaalsContact O-N 3.1Å; K114-E117 WeakPolarHBondContact O-CB 3.46Å; K114-E117 PolarHBondContact O-N 2.69Å; K114-E117 VanDerWaalsContact O-N 3.12Å
115Y92.1Very high80.1Confident114 Ų11469 Ų6945%0.44736%0.361SS..G310 helixtrans-62.5-19.417976.7-95.1000113.3F35 L44 S112 Q113 K119F35-Y115 HydrophobicContact CE2-CE2 4.45Å; F35-Y115 AromaticContact CZ-CE2 3.99Å; F35-Y115 HydrophobicContact CZ-CE2 3.99Å; F35-Y115 WeakPolarHBondContact CZ-OH 3.27Å; L44-Y115 HydrophobicContact CD2-CD2 3.85Å; L44-Y115 HydrophobicContact CD2-CE2 3.59Å; S112-Y115 WeakPolarHBondContact O-CD1 3.4Å; S112-Y115 WeakPolarHBondContact O-CE1 3.47Å; Q113-Y115 PolarHBondContact O-N 3.15Å; Q113-Y115 VanDerWaalsContact O-N 3.13Å; Y115-K119 WeakPolarHBondContact O-CG 3.34Å
116K94.1Very high82.8Confident8 Ų864.2 Ų64.24%0.03534%0.338CS..G310 helixtrans-79-21.8178.7-60.7175.7175.1-176.30112.6F35 T63 Y84 Q113 K114 G118 K119F35-K116 HydrophobicContact CE1-CD 4.39Å; F35-K116 HydrophobicContact CZ-CG 4.44Å; T63-K116 PolarHBondContact OG1-NZ 3.41Å; T63-K116 VanDerWaalsContact OG1-NZ 3.12Å; Y84-K116 WeakPolarHBondContact CB-O 3.17Å; Y84-K116 HydrophobicContact CD1-CB 4.12Å; Y84-K116 HydrophobicContact CD2-CB 3.87Å; Y84-K116 HydrophobicContact CE1-CB 4.27Å; Y84-K116 HydrophobicContact CE1-CD 3.97Å; Y84-K116 HydrophobicContact CE2-CB 4.03Å; Y84-K116 HydrophobicContact CE2-CD 4.17Å; Y84-K116 HydrophobicContact CE2-CG 4.32Å; Y84-K116 HydrophobicContact CG-CB 3.92Å; Q113-K116 VanDerWaalsContact O-CB 3.3Å; Q113-K116 WeakPolarHBondContact O-CB 3.31Å; Q113-K116 PolarHBondContact O-N 3.02Å; K114-K116 PolarHBondContact O-N 3.46Å; K114-K116 VanDerWaalsContact O-N 3.1Å; K116-G118 PolarHBondContact O-N 3.5Å; K116-K119 WeakPolarHBondContact O-CB 3.4Å; K116-K119 VanDerWaalsContact O-CG 3.25Å; K116-K119 WeakPolarHBondContact O-CG 3.13Å; K116-K119 PolarHBondContact O-N 3.39Å
117E91.9Very high85.4Confident45 Ų4556.5 Ų56.521%0.2130%0.302CS..THydrogen-bonded Turntrans-58.4130.5-175.3-68-178.7160.600112.6N87 F109 K114 K119N87-E117 PolarHBondContact ND2-OE1 2.84Å; F109-E117 VanDerWaalsContact CE2-OE1 3.29Å; F109-E117 WeakPolarHBondContact CE2-OE1 3.27Å; K114-E117 WeakPolarHBondContact O-CB 3.46Å; K114-E117 PolarHBondContact O-N 2.69Å; K114-E117 VanDerWaalsContact O-N 3.12Å; E117-K119 PolarHBondContact O-N 3.14Å; E117-K119 VanDerWaalsContact O-N 3.16Å; E117-K119 PolarHBondContact O-NZ 2.78Å
118G94.4Very high87.7Confident18 Ų1853.4 Ų53.419%0.18629%0.289CS..THydrogen-bonded Turntrans694.5-178.800000114.7K83 Y84 K116 Y120K83-G118 WeakPolarHBondContact CE-O 3.08Å; Y84-G118 WeakPolarHBondContact O-CA 3.31Å; Y84-G118 PolarHBondContact O-N 2.8Å; K116-G118 PolarHBondContact O-N 3.5Å; G118-Y120 WeakPolarHBondContact O-CE2 3.26Å
119K97.4Very high90.2Very high47 Ų4752.9 Ų52.920%0.20427%0.269CS..  trans-93.2163.5-177.5-51.5-60174-86.30112I31 L44 F45 N46 K83 Y84 Y115 K116 E117I31-K119 HydrophobicContact CD1-CD 3.64Å; I31-K119 HydrophobicContact CD1-CG 4.09Å; L44-K119 HydrophobicContact CD1-CB 3.64Å; L44-K119 HydrophobicContact CD2-CB 4.44Å; L44-K119 HydrophobicContact CG-CB 4.12Å; F45-K119 WeakPolarHBondContact O-CB 3.42Å; N46-K119 HydrophobicContact CB-CD 4.48Å; N46-K119 WeakPolarHBondContact OD1-CE 3.4Å; K83-K119 WeakPolarHBondContact CA-O 3.25Å; K83-K119 WeakPolarHBondContact CG-O 3.38Å; Y84-K119 PolarHBondContact N-O 3.15Å; Y115-K119 WeakPolarHBondContact O-CG 3.34Å; K116-K119 WeakPolarHBondContact O-CB 3.4Å; K116-K119 VanDerWaalsContact O-CG 3.25Å; K116-K119 WeakPolarHBondContact O-CG 3.13Å; K116-K119 PolarHBondContact O-N 3.39Å; E117-K119 PolarHBondContact O-N 3.14Å; E117-K119 VanDerWaalsContact O-N 3.16Å; E117-K119 PolarHBondContact O-NZ 2.78Å
120Y98.5Very high91.8Very high43 Ų4350.1 Ų50.117%0.16926%0.26CS..EExtended strand (participates in β ladder)trans-115.7129-169.4-60-98.4000111.1L44 F45 V48 I71 K83 G118L44-Y120 CarbonylContact C-O 3.52Å; L44-Y120 WeakPolarHBondContact CA-O 3.43Å; F45-Y120 PolarHBondContact N-O 3.37Å; F45-Y120 PolarHBondContact O-N 3.49Å; V48-Y120 HydrophobicContact CB-CD1 4.49Å; V48-Y120 HydrophobicContact CB-CG 4.41Å; V48-Y120 HydrophobicContact CG1-CD1 4.28Å; V48-Y120 HydrophobicContact CG1-CD2 4.15Å; V48-Y120 HydrophobicContact CG1-CG 3.8Å; V48-Y120 HydrophobicContact CG2-CD1 3.38Å; V48-Y120 HydrophobicContact CG2-CD2 4.01Å; V48-Y120 HydrophobicContact CG2-CE1 3.43Å; V48-Y120 VanDerWaalsContact CG2-CE1 3.43Å; V48-Y120 HydrophobicContact CG2-CE2 4.11Å; V48-Y120 HydrophobicContact CG2-CG 3.67Å; I71-Y120 HydrophobicContact CD1-CD1 4.3Å; I71-Y120 HydrophobicContact CG2-CD1 4.44Å; K83-Y120 HydrophobicContact CB-CD1 3.97Å; K83-Y120 HydrophobicContact CB-CE1 4.14Å; K83-Y120 HydrophobicContact CD-CD1 4.18Å; K83-Y120 HydrophobicContact CD-CE1 3.55Å; K83-Y120 HydrophobicContact CD-CE2 4.43Å; K83-Y120 WeakPolarHBondContact CE-OH 3.49Å; K83-Y120 HydrophobicContact CG-CD1 3.9Å; K83-Y120 HydrophobicContact CG-CE1 3.8Å; K83-Y120 HydrophobicContact CG-CG 4.37Å; K83-Y120 PolarHBondContact NZ-OH 2.82Å; K83-Y120 VanDerWaalsContact NZ-OH 3.09Å; G118-Y120 WeakPolarHBondContact O-CE2 3.26Å
121I98.2Very high92.7Very high0 Ų047.9 Ų47.90%025%0.252CS..EExtended strand (participates in β ladder)trans-99.5122.4169.5-65.1-71.4000108.2F35 A42 Y43 L44 G81 W82 Y84F35-I121 HydrophobicContact CB-CD1 3.83Å; F35-I121 HydrophobicContact CD1-CD1 3.34Å; F35-I121 HydrophobicContact CD2-CD1 4.24Å; F35-I121 HydrophobicContact CE1-CD1 3.87Å; F35-I121 HydrophobicContact CG-CD1 3.54Å; A42-I121 HydrophobicContact CB-CG2 3.64Å; Y43-I121 WeakPolarHBondContact O-CA 3.45Å; L44-I121 HydrophobicContact CB-CD1 3.99Å; L44-I121 HydrophobicContact CD1-CD1 3.46Å; L44-I121 VanDerWaalsContact CD1-CD1 3.46Å; L44-I121 HydrophobicContact CD1-CG1 3.96Å; L44-I121 HydrophobicContact CG-CD1 4.36Å; G81-I121 WeakPolarHBondContact CA-O 3.31Å; W82-I121 HydrophobicContact CD2-CB 4Å; W82-I121 HydrophobicContact CD2-CG2 4.05Å; W82-I121 HydrophobicContact CE3-CG2 4.15Å; W82-I121 HydrophobicContact CG-CB 4.32Å; W82-I121 HydrophobicContact CH2-CG2 3.92Å; W82-I121 HydrophobicContact CZ2-CB 4.21Å; W82-I121 HydrophobicContact CZ2-CG1 4.21Å; W82-I121 HydrophobicContact CZ2-CG2 3.76Å; W82-I121 HydrophobicContact CZ3-CG2 4.08Å; W82-I121 PolarHBondContact N-O 2.87Å; W82-I121 VanDerWaalsContact N-O 3.07Å; W82-I121 WeakPolarHBondContact O-CA 3.38Å; W82-I121 WeakPolarHBondContact O-CB 3.19Å; W82-I121 PolarHBondContact O-N 3.47Å; Y84-I121 HydrophobicContact CD2-CG1 4.33Å; Y84-I121 HydrophobicContact CE2-CD1 4.24Å; Y84-I121 HydrophobicContact CE2-CG1 3.71Å
122I98.5Very high92.5Very high0 Ų044.1 Ų44.10%023%0.229CC..EExtended strand (participates in β ladder)trans-121.2127.7172.6-61.4174.8000109.2L24 A42 Y43 F45 V48 I71 L80 M127L24-I122 HydrophobicContact CB-CD1 4.3Å; A42-I122 WeakPolarHBondContact CA-O 3.34Å; Y43-I122 PolarHBondContact N-O 2.96Å; Y43-I122 PolarHBondContact O-N 3.41Å; F45-I122 HydrophobicContact CD2-CB 4.37Å; F45-I122 HydrophobicContact CD2-CD1 4.2Å; F45-I122 HydrophobicContact CD2-CG1 4.36Å; F45-I122 HydrophobicContact CE2-CB 4.17Å; F45-I122 HydrophobicContact CE2-CD1 4.37Å; V48-I122 HydrophobicContact CG1-CD1 3.92Å; I71-I122 HydrophobicContact CD1-CG1 3.87Å; L80-I122 HydrophobicContact CB-CG2 4.32Å; L80-I122 WeakPolarHBondContact O-CA 3.31Å; I122-M127 HydrophobicContact CB-SD 4.24Å; I122-M127 HydrophobicContact CG2-CB 3.88Å; I122-M127 HydrophobicContact CG2-CE 4.42Å; I122-M127 HydrophobicContact CG2-CG 4.32Å; I122-M127 HydrophobicContact CG2-SD 3.69Å
123E98.4Very high91.7Very high6 Ų651.9 Ų51.93%0.02825%0.252CS..EExtended strand (participates in β ladder)trans-77138.7178.2-54.2-157.1-148.900111.5G37 S38 Q39 A42 L80 A125 H126G37-E123 VanDerWaalsContact CA-CD 3.43Å; G37-E123 WeakPolarHBondContact CA-OE2 3.47Å; S38-E123 VanDerWaalsContact N-CD 3.35Å; S38-E123 PolarHBondContact N-OE1 3.04Å; S38-E123 PolarHBondContact N-OE2 3.26Å; S38-E123 PolarHBondContact OG-OE1 3.19Å; Q39-E123 VanDerWaalsContact CA-OE2 3.31Å; Q39-E123 WeakPolarHBondContact CA-OE2 3.23Å; Q39-E123 VanDerWaalsContact CB-OE2 3.27Å; Q39-E123 WeakPolarHBondContact CB-OE2 3.43Å; Q39-E123 PolarHBondContact N-OE2 3.17Å; A42-E123 HydrophobicContact CB-CG 4.2Å; L80-E123 PolarHBondContact O-N 3.36Å; E123-A125 PolarHBondContact O-N 3.18Å; E123-H126 PolarHBondContact O-N 2.91Å
124L97.6Very high90.5Very high57 Ų5756.4 Ų56.430%0.29828%0.277SS..G310 helixtrans-64.2-25.6-179.4-9162.4000112.4K41 Y43 H126 M127K41-L124 HydrophobicContact CB-CD1 4.47Å; K41-L124 HydrophobicContact CB-CD2 4.07Å; K41-L124 PolarHBondContact O-N 2.83Å; Y43-L124 HydrophobicContact CD1-CD1 3.61Å; Y43-L124 HydrophobicContact CD2-CD1 3.89Å; Y43-L124 HydrophobicContact CE1-CD1 3.63Å; Y43-L124 HydrophobicContact CE1-CD2 4.13Å; Y43-L124 HydrophobicContact CE1-CG 4.48Å; Y43-L124 HydrophobicContact CE2-CD1 3.88Å; Y43-L124 HydrophobicContact CE2-CD2 4.46Å; Y43-L124 HydrophobicContact CE2-CG 4.43Å; Y43-L124 HydrophobicContact CG-CD1 3.74Å; L124-H126 PolarHBondContact O-N 3.29Å; L124-H126 VanDerWaalsContact O-N 3.14Å; L124-M127 HydrophobicContact CD1-CE 4.27Å; L124-M127 PolarHBondContact O-N 3.32Å; L124-M127 VanDerWaalsContact O-O 3.06Å
125A97.8Very high88.8Confident56 Ų5654.2 Ų54.246%0.46328%0.277SS..G310 helixtrans-59.1-23.417500000112.9Q39 E123Q39-A125 HydrophobicContact CB-CB 4.2Å; E123-A125 PolarHBondContact O-N 3.18Å
126H97.8Very high86.8Confident35 Ų3558.1 Ų58.116%0.16230%0.297CS..G310 helixtrans-111.94.1-175.3-57.3-54.1000113.8V18 T79 L80 E123 L124V18-H126 PolarHBondContact N-O 3.4Å; T79-H126 PolarHBondContact O-CD2 3.05Å; L80-H126 HydrophobicContact CD2-CB 3.79Å; E123-H126 PolarHBondContact O-N 2.91Å; L124-H126 PolarHBondContact O-N 3.29Å; L124-H126 VanDerWaalsContact O-N 3.14Å
127M97Very high84.4Confident13 Ų1371.3 Ų71.36%0.06435%0.346CS..EExtended strand (participates in β ladder)trans-139.3132.8-170-176.7-178.470.500111.9Y15 S16 L24 Y43 F45 I122 L124Y15-M127 WeakPolarHBondContact CB-SD 3.03Å; Y15-M127 HydrophobicContact CD1-CE 3.44Å; Y15-M127 VanDerWaalsContact CD1-CE 3.44Å; Y15-M127 HydrophobicContact CD1-CG 3.96Å; Y15-M127 HydrophobicContact CD1-SD 3.59Å; Y15-M127 VanDerWaalsContact CD1-SD 3.59Å; Y15-M127 HydrophobicContact CE1-CE 3.82Å; Y15-M127 HydrophobicContact CG-CE 4.04Å; Y15-M127 HydrophobicContact CG-CG 4.25Å; Y15-M127 HydrophobicContact CG-SD 3.64Å; S16-M127 CarbonylContact O-C 3.53Å; S16-M127 WeakPolarHBondContact O-CA 3.29Å; L24-M127 HydrophobicContact CD1-CB 4.48Å; L24-M127 HydrophobicContact CD1-CG 4.31Å; Y43-M127 HydrophobicContact CD2-CE 3.89Å; Y43-M127 HydrophobicContact CE2-CE 4.48Å; F45-M127 HydrophobicContact CE2-CE 4.05Å; F45-M127 HydrophobicContact CE2-SD 3.98Å; F45-M127 HydrophobicContact CZ-CE 3.95Å; F45-M127 HydrophobicContact CZ-SD 3.95Å; I122-M127 HydrophobicContact CB-SD 4.24Å; I122-M127 HydrophobicContact CG2-CB 3.88Å; I122-M127 HydrophobicContact CG2-CE 4.42Å; I122-M127 HydrophobicContact CG2-CG 4.32Å; I122-M127 HydrophobicContact CG2-SD 3.69Å; L124-M127 HydrophobicContact CD1-CE 4.27Å; L124-M127 PolarHBondContact O-N 3.32Å; L124-M127 VanDerWaalsContact O-O 3.06Å
128I95.9Very high84Confident44 Ų4472.6 Ų72.623%0.22635%0.353CS..EExtended strand (participates in β ladder)trans-106.1158.1171.258.9167.8000110.1Y15 S16 V18Y15-I128 CarbonylContact C-O 3.57Å; Y15-I128 VanDerWaalsContact CA-O 3.25Å; Y15-I128 WeakPolarHBondContact CA-O 2.93Å; S16-I128 PolarHBondContact N-O 3.36Å; S16-I128 WeakPolarHBondContact O-CG1 3.43Å; S16-I128 PolarHBondContact O-N 3.16Å; V18-I128 HydrophobicContact CB-CG2 4.13Å; V18-I128 HydrophobicContact CG2-CG2 3.9Å
129K94.3Very high83.5Confident83 Ų8375.5 Ų75.536%0.36136%0.362SS..EExtended strand (participates in β ladder)trans-115.2121.8177.7-172-169.4-177.3-147.50110.2T14 Y15 N131T14-K129 CarbonylContact O-C 3.52Å; T14-K129 WeakPolarHBondContact O-CA 3.5Å; Y15-K129 HydrophobicContact CD1-CB 3.85Å; Y15-K129 HydrophobicContact CD1-CG 3.97Å; Y15-K129 HydrophobicContact CE1-CB 3.72Å; Y15-K129 HydrophobicContact CE1-CD 3.91Å; Y15-K129 HydrophobicContact CE1-CG 3.62Å; K129-N131 WeakPolarHBondContact CD-OD1 3.34Å; K129-N131 WeakPolarHBondContact CE-OD1 3.37Å; K129-N131 PolarHBondContact NZ-OD1 3.42Å
130D89.1Confident82.7Confident62 Ų6277.1 Ų77.133%0.33237%0.37SS..EExtended strand (participates in β ladder)trans-95.1121.7171.2-60.9-49.8000108.2R13 T14 S16R13-D130 CarbonylContact C-O 3.58Å; R13-D130 VanDerWaalsContact CA-O 3.26Å; R13-D130 WeakPolarHBondContact CA-O 3.13Å; T14-D130 PolarHBondContact N-O 3.42Å; T14-D130 PolarHBondContact O-N 3.3Å; S16-D130 PolarHBondContact OG-OD2 3.37Å
131N83.6Confident81.8Confident65 Ų6579.1 Ų79.135%0.34838%0.382SS..  trans-88.4-0.3-176.9-71.1-39.5000113.9K129 W133K129-N131 WeakPolarHBondContact CD-OD1 3.34Å; K129-N131 WeakPolarHBondContact CE-OD1 3.37Å; K129-N131 PolarHBondContact NZ-OD1 3.42Å; N131-W133 HydrophobicContact CB-CG 4.14Å; N131-W133 VanDerWaalsContact CB-NE1 3.31Å; N131-W133 VanDerWaalsContact O-CD1 3.27Å; N131-W133 PolarHBondContact O-N 3.25Å
132G71.4Confident80.7Confident25 Ų2584 Ų8426%0.25841%0.406SS..  trans67.318.7-178.500000114.7D134 S135G132-D134 PolarHBondContact O-N 3.08Å; G132-S135 PolarHBondContact O-N 3.5Å
133W65.4Low79.5Confident209 Ų20989.6 Ų89.679%0.79243%0.433SS*.G310 helixtrans-65.3-25.3-176-69.413.4000112.8N131 S135N131-W133 HydrophobicContact CB-CG 4.14Å; N131-W133 VanDerWaalsContact CB-NE1 3.31Å; N131-W133 VanDerWaalsContact O-CD1 3.27Å; N131-W133 PolarHBondContact O-N 3.25Å; W133-S135 VanDerWaalsContact C-N 3.29Å; W133-S135 PolarHBondContact O-N 3.44Å
134D59.3Low78.2Confident132 Ų13295.6 Ų95.671%0.70646%0.462SS*.G310 helixtrans-75.7-13.1178.2-67.2-39.6000113.8G132 K136G132-D134 PolarHBondContact O-N 3.08Å; D134-K136 PolarHBondContact O-N 3.49Å
135S52.8Low76.7Confident76 Ų7698.5 Ų98.553%0.53148%0.475SS..G310 helixtrans-78.94.4178.8-570000114.2G11 G132 W133G11-S135 VanDerWaalsContact CA-OG 3.31Å; G11-S135 WeakPolarHBondContact CA-OG 3.29Å; G132-S135 PolarHBondContact O-N 3.5Å; W133-S135 VanDerWaalsContact C-N 3.29Å; W133-S135 PolarHBondContact O-N 3.44Å
136K49.3Very low74.9Confident197 Ų197102.1 Ų102.186%0.85748%0.476SS*.G310 helixtrans-101.312.8177.1-79.5-164.3178-173.40114.5D134D134-K136 PolarHBondContact O-N 3.49Å
137R43.6Very low72.9Confident284 Ų284108.2 Ų108.2100%1.07250%0.504SS*.  trans-97.60173.1-73.5-168.4179.6131.60.4111.9

Retrieved 137 of 137 residues in 71.9 ms (Link to these results)

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