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|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
30405429a5b129de7047449eda6c1adcf8febe0da4170516d5c0538a32b4ccfa | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,459 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'bHph', 'dP', 'L', 'F'] | 48 | 4460 | -6.69 | -6.69 | Circle | 4 | -2.09e-16 | -2.708264211 | -1.53e-16 | -2.862162324 | 3.12e-17 | -1.134991628 | 9.07e-16 | -0.249287763 | 2.606349191 | 4819.653284 | 127.0 | null | null | 103.011107 | 96.4882332 | 29.4882332 | 55.40384141 | 48.79543216 | 15.45379138 | 10.35197332 | 10.35197332 | 6.407416578 | 6.407416578 | 4.026885368 | 4.026885368 | null | null | null | null | 327.2776726 | 31.65069736 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 60.31337647 | 841.5101975 | 0.754098361 | 1.37704918 | 2.032786885 | 0.595744681 | 126.0 | PEPTIDE4460{P.[Pr_Gly].[Me_dL].[bHph].[dP].L.F}$PEPTIDE4460,PEPTIDE4460,1:R1-7:R2$$$ | PEPTIDE4460{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4460,PEPTIDE4460,1:R1-7:R2$$$ | -5.27 | 61 | 774.559 | 4460 | null | null | 4.62e+42 | 10.39396068 | 22.00820975 | 12.63834575 | 455.3707472 | null | 16.75885671 | 0.350723941 | 16.75885671 | 0.245675664 | 1.836861455 | 0.245675664 | -7.092780967 | -0.350723941 | 3.4697 | 232.5101 | 842.095 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 16 | 0 | 3 | 3 | 332 | hepta_883 | -6.69 | 3.454343857 | 1.088948869 | 35.52907898 | 30.08946234 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 73.89821756 | 108.2850418 | 31.1705137 | null | -6.69 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 134.0960644 | 32.96326564 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'bHph', 'dP', 'L', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.4060999999999997, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 46.30761009 | 11.78791537 | 184.0983104 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4460 | null | 168.54 | 3.04 | 597.9058085 | 0.0 | 105.4877785 | -7.843733658 | -5.548950413 | -43.50184331 | -62.30174487 | -60.96378348 | -58.56686463 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.329491408 | null |
5f42961a5efc24218849a29d0b32794442906ba40952caca6c46ef8c5ba4ba6c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,460 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'Bn_Gly', 'dP', 'meL', 'F'] | 52 | 4461 | -6.0 | -6 | Circle | 4 | -2.55e-16 | -2.705559521 | -1.65e-16 | -2.846164464 | 5.43e-17 | -1.135203807 | 1.21e-15 | -0.249287762 | 2.668731259 | 4810.143509 | 102.0 | null | null | 103.011107 | 96.4882332 | 29.4882332 | 55.32649114 | 48.84821857 | 15.40100497 | 10.42418691 | 10.42418691 | 6.572824678 | 6.572824678 | 4.124615946 | 4.124615946 | null | null | null | null | 327.6636693 | 35.68080598 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 56.2011008 | 841.5101975 | 0.737704918 | 1.327868852 | 1.950819672 | 0.595744681 | 98.0 | PEPTIDE4461{P.[Pr_Gly].[Me_dL].[Bn_Gly].[dP].[meL].F}$PEPTIDE4461,PEPTIDE4461,1:R1-7:R2$$$ | PEPTIDE4461{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4461,PEPTIDE4461,1:R1-7:R2$$$ | -5.27 | 61 | 774.559 | 4461 | null | null | 6.13e+42 | 10.39396068 | 21.49777345 | 11.7649724 | 455.6745769 | null | 17.08186428 | 0.342180206 | 17.08186428 | 0.245675665 | 1.856668042 | 0.245675665 | -7.218224135 | -0.342180206 | 3.7231 | 232.3027 | 842.095 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 1 | 14 | 0 | 17 | 0 | 3 | 3 | 332 | hepta_884 | -6.0 | 3.806255276 | 1.345051751 | 34.70927174 | 36.58632203 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 107.9961525 | 35.28278936 | null | -6.0 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.4436671 | 41.35025811 | 0.0 | 34.70927174 | 11.78791537 | 121.8291818 | 46.43595222 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'Bn_Gly', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 147.2751311 | 46.43154487 | 11.78791537 | 180.4669026 | 60.42418708 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4461 | null | 150.96 | 13.93 | 599.3136979 | 0.0 | 101.7477785 | -2.65498849 | -5.632058237 | -44.33340617 | -56.59146681 | -48.98121632 | -78.20167375 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.38341763 | null |
1c9ddbc2e0b02ac5e032d3af1f1e120a1eb17404ed1edeaa713282b654d4e20c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,461 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'meL', 'Me_dL', 'dP', 'Bn_Gly', 'F'] | 52 | 4462 | -5.4 | -5.4 | Circle | 5 | -2.86e-16 | -2.726529073 | -1.53e-16 | -2.838069093 | 3.13e-17 | -1.136010056 | 1.41e-15 | -0.249287767 | 2.673539723 | 4810.143509 | 81.0 | null | null | 103.011107 | 96.4882332 | 29.4882332 | 55.32649114 | 48.84821857 | 15.40100497 | 10.42418691 | 10.42418691 | 6.572824678 | 6.572824678 | 4.152566795 | 4.152566795 | null | null | null | null | 327.6636693 | 32.93928887 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.94261792 | 841.5101975 | 0.737704918 | 1.295081967 | 1.868852459 | 0.595744681 | 84.0 | PEPTIDE4462{P.[Pr_Gly].[meL].[Me_dL].[dP].[Bn_Gly].F}$PEPTIDE4462,PEPTIDE4462,1:R1-7:R2$$$ | PEPTIDE4462{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4462,PEPTIDE4462,1:R1-7:R2$$$ | -5.27 | 61 | 774.559 | 4462 | null | null | 9.5e+42 | 10.39396068 | 21.49777345 | 11.7649724 | 455.6745769 | null | 17.09014521 | 0.342431664 | 17.09014521 | 0.245675463 | 1.802039524 | 0.245675463 | -7.401302976 | -0.342431664 | 3.7231 | 232.3027 | 842.095 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 1 | 14 | 0 | 17 | 0 | 3 | 3 | 332 | hepta_885 | -5.4 | 3.773767038 | 1.489536896 | 34.70927174 | 30.08946234 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 107.9961525 | 41.77964905 | null | -5.4 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.4436671 | 41.35025811 | 0.0 | 34.70927174 | 11.78791537 | 121.8291818 | 46.43595222 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'meL', 'Me_dL', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.1616, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 147.2751311 | 46.43154487 | 11.78791537 | 180.4669026 | 60.42418708 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4462 | null | 150.96 | 44.96 | 599.3954641 | 0.0 | 101.5260262 | -2.433236105 | -5.408034504 | -44.58060767 | -56.07532775 | -49.14211161 | -78.61550596 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.38341763 | null |
0927eb8624dc97e2f1021f45254fffa711509f7b1a8af26ffe4c57e4b3b2a762 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,462 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'bHph', 'dP', 'meL', 'F'] | 47 | 4463 | -5.74 | -5.74 | Circle | 2 | -2.35e-16 | -2.702845834 | -1.82e-16 | -2.861579014 | -3.31e-17 | -1.13498946 | 1.42e-15 | -0.249287763 | 2.609337397 | 4819.653284 | 124.0 | null | null | 103.011107 | 96.4882332 | 29.4882332 | 55.40384141 | 48.79543216 | 15.45379138 | 10.35197332 | 10.35197332 | 6.407416578 | 6.407416578 | 4.054836218 | 4.054836218 | null | null | null | null | 327.2776726 | 28.90918025 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.05489358 | 841.5101975 | 0.770491803 | 1.393442623 | 2.032786885 | 0.595744681 | 124.0 | PEPTIDE4463{P.[Pr_Gly].[dL].[bHph].[dP].[meL].F}$PEPTIDE4463,PEPTIDE4463,1:R1-7:R2$$$ | PEPTIDE4463{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4463,PEPTIDE4463,1:R1-7:R2$$$ | -5.27 | 61 | 774.559 | 4463 | null | null | 6.96e+42 | 10.39396068 | 22.00820975 | 12.63834575 | 455.3707472 | null | 16.80443776 | 0.350730367 | 16.80443776 | 0.245675665 | 1.827239805 | 0.245675665 | -7.107724883 | -0.350730367 | 3.4697 | 232.5101 | 842.095 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 16 | 0 | 3 | 3 | 332 | hepta_886 | -5.74 | 3.48404148 | 1.059332156 | 35.52907898 | 30.08946234 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 73.89821756 | 108.2850418 | 31.1705137 | null | -5.74 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 134.0960644 | 32.96326564 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'bHph', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 46.30761009 | 11.78791537 | 184.0983104 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4463 | null | 168.54 | 23.93 | 598.03261 | 0.0 | 105.550266 | -7.890166487 | -5.56096511 | -43.51846359 | -62.50690712 | -61.08658113 | -58.35312584 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.329491408 | null |
9667005555e3b064306479312a1d9b7b922a4f4459291d6f5a939d9f0241a9aa | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,463 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Bn_Gly', 'meL', 'dP', 'Me_dL', 'F'] | 52 | 4464 | -5.34 | -5.34 | Circle | 6 | -2.2e-16 | -2.708209303 | -1.9e-16 | -2.847646938 | 8.22e-17 | -1.135165428 | 1.07e-15 | -0.249287762 | 2.668313638 | 4810.143509 | 106.0 | null | null | 103.011107 | 96.4882332 | 29.4882332 | 55.32649114 | 48.84821857 | 15.40100497 | 10.42418691 | 10.42418691 | 6.572824678 | 6.572824678 | 4.124615946 | 4.124615946 | null | null | null | null | 327.6636693 | 38.42232309 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 53.45958369 | 841.5101975 | 0.737704918 | 1.31147541 | 1.918032787 | 0.595744681 | 105.0 | PEPTIDE4464{P.[Pr_Gly].[Bn_Gly].[meL].[dP].[Me_dL].F}$PEPTIDE4464,PEPTIDE4464,1:R1-7:R2$$$ | PEPTIDE4464{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4464,PEPTIDE4464,1:R1-7:R2$$$ | -5.27 | 61 | 774.559 | 4464 | null | null | 7.94e+42 | 10.39396068 | 21.49777345 | 11.7649724 | 455.6745769 | null | 16.91196093 | 0.342180206 | 16.91196093 | 0.245675665 | 1.83288835 | 0.245675665 | -7.180657409 | -0.342180206 | 3.7231 | 232.3027 | 842.095 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 1 | 14 | 0 | 17 | 0 | 3 | 3 | 332 | hepta_887 | -5.34 | 3.835717058 | 1.361994561 | 34.70927174 | 36.58632203 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 107.9961525 | 35.28278936 | null | -5.34 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(Cc2ccccc2)CC(=O)N(C)[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.4436671 | 41.35025811 | 0.0 | 34.70927174 | 11.78791537 | 121.8291818 | 46.43595222 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Bn_Gly', 'meL', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.3173, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 147.2751311 | 46.43154487 | 11.78791537 | 180.4669026 | 60.42418708 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4464 | null | 150.96 | 49.85 | 599.1569231 | 0.0 | 101.777916 | -2.685125979 | -5.562555243 | -44.35157259 | -56.53453854 | -49.13861952 | -77.99576064 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.38341763 | null |
0a415ba2b8e1841b0692c876aecb93accaf13316272e7b4066b2f3c4b99c98e3 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,465 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'dL', 'Bn_Gly', 'dP', 'Bn_Gly', 'F'] | 52 | 4466 | -6.42 | -6.42 | Circle | 6 | -1.55e-16 | -2.688747129 | -1.86e-17 | -2.834266632 | 3.64e-16 | -1.133168668 | 10.12033337 | -0.24928195 | 2.233258583 | 4875.912689 | 115.0 | null | null | 97.97520861 | 90.9882332 | 29.9882332 | 53.79059275 | 46.32182536 | 15.92739817 | 10.57558011 | 10.57558011 | 6.620944997 | 6.620944997 | 4.213778654 | 4.213778654 | null | null | null | null | 330.9026243 | 30.23885528 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 53.45958369 | 847.4632473 | 0.677419355 | 1.177419355 | 1.758064516 | 0.479166667 | 114.0 | PEPTIDE4466{P.[Pr_Gly].[dL].[Bn_Gly].[dP].[Bn_Gly].F}$PEPTIDE4466,PEPTIDE4466,1:R1-7:R2$$$ | PEPTIDE4466{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4466,PEPTIDE4466,1:R1-7:R2$$$ | -6.05 | 62 | 786.57 | 4466 | null | null | 1.72e+39 | 11.35983112 | 21.65004646 | 11.85634717 | 450.3252227 | null | 16.77030663 | 0.342747692 | 16.77030663 | 0.245675463 | 1.72923071 | 0.245675463 | -6.858295252 | -0.342747692 | 3.5366 | 233.5214 | 848.058 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 2 | 14 | 0 | 13 | 0 | 3 | 3 | 330 | hepta_889 | -6.42 | 4.932984621 | 3.163908236 | 35.11917536 | 30.56842956 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 111.191957 | 60.82186157 | 79.97998001 | 52.7457175 | null | -6.42 | null | null | null | null | null | null | null | null | null | null | 6 | CCCN1CC(=O)N[C@H](CC(C)C)C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 117.2601993 | 41.35025811 | 0.0 | 35.11917536 | 5.893957685 | 102.2314399 | 38.98115811 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'dL', 'Bn_Gly', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.3173, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 128.9025347 | 52.92840456 | 5.893957685 | 156.358335 | 90.63628061 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4466 | null | 159.75 | 5.57 | 545.8645695 | 0.0 | 103.6498007 | -4.921516155 | -7.845578232 | -35.8508189 | -57.09094398 | -40.66642382 | -64.72242239 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.316081701 | null |
c25ee4d815bd1b419f83af614a1c05c1b12555d1a9244a0875bfe0f753432d90 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,466 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Bn_Gly', 'dL', 'dP', 'Bn_Gly', 'F'] | 52 | 4467 | -5.64 | -5.64 | Circle | 4 | -1.16e-16 | -2.684262666 | -2.74e-17 | -2.826702863 | 4.3e-16 | -1.1331883 | 10.11988499 | -0.249281951 | 2.233585097 | 4875.912689 | 114.0 | null | null | 97.97520861 | 90.9882332 | 29.9882332 | 53.79059275 | 46.32182536 | 15.92739817 | 10.57558011 | 10.57558011 | 6.620944997 | 6.620944997 | 4.213778654 | 4.213778654 | null | null | null | null | 330.9026243 | 32.98037239 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 50.71806658 | 847.4632473 | 0.677419355 | 1.161290323 | 1.709677419 | 0.479166667 | 115.0 | PEPTIDE4467{P.[Pr_Gly].[Bn_Gly].[dL].[dP].[Bn_Gly].F}$PEPTIDE4467,PEPTIDE4467,1:R1-7:R2$$$ | PEPTIDE4467{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4467,PEPTIDE4467,1:R1-7:R2$$$ | -6.05 | 62 | 786.57 | 4467 | null | null | 1e+41 | 11.35983112 | 21.65004646 | 11.85634717 | 450.3252227 | null | 16.68100982 | 0.342747538 | 16.68100982 | 0.245675463 | 1.743579013 | 0.245675463 | -6.763416248 | -0.342747538 | 3.5366 | 233.5214 | 848.058 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 2 | 14 | 0 | 13 | 0 | 3 | 3 | 330 | hepta_890 | -5.64 | 5.097736626 | 3.333827097 | 35.11917536 | 24.07156987 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 111.191957 | 60.82186157 | 79.97998001 | 59.24257718 | null | -5.64 | null | null | null | null | null | null | null | null | null | null | 6 | CCCN1CC(=O)N(Cc2ccccc2)CC(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 117.2601993 | 41.35025811 | 0.0 | 35.11917536 | 5.893957685 | 102.2314399 | 38.98115811 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Bn_Gly', 'dL', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.3173, 0.8193999999999995, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 128.9025347 | 52.92840456 | 5.893957685 | 156.358335 | 90.63628061 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4467 | null | 159.75 | 28.83 | 545.8223907 | 0.0 | 103.6084037 | -4.880119145 | -7.835704917 | -35.79690117 | -57.12033049 | -40.75933822 | -64.62173376 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.316081701 | null |
d51248df660d30471fa5e0cba00ad5a9b73d4bc7b13fa2572649e661cbcab084 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,467 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'meL', 'Bn_Gly', 'dP', 'meL', 'F'] | 50 | 4468 | -5.21 | -5.21 | Circle | 1 | -2.55e-16 | -2.705559521 | -1.65e-16 | -2.846164464 | 5.43e-17 | -1.135203807 | 1.21e-15 | -0.249287762 | 2.668731259 | 4810.143509 | 103.0 | null | null | 103.011107 | 96.4882332 | 29.4882332 | 55.32649114 | 48.84821857 | 15.40100497 | 10.42418691 | 10.42418691 | 6.572824678 | 6.572824678 | 4.124615946 | 4.124615946 | null | null | null | null | 327.6636693 | 35.68080598 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 56.2011008 | 841.5101975 | 0.737704918 | 1.327868852 | 1.950819672 | 0.595744681 | 104.0 | PEPTIDE4468{P.[Pr_Gly].[meL].[Bn_Gly].[dP].[meL].F}$PEPTIDE4468,PEPTIDE4468,1:R1-7:R2$$$ | PEPTIDE4468{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4468,PEPTIDE4468,1:R1-7:R2$$$ | -5.27 | 61 | 774.559 | 4468 | null | null | 6.13e+42 | 10.39396068 | 21.49777345 | 11.7649724 | 455.6745769 | null | 17.08186428 | 0.342180206 | 17.08186428 | 0.245675665 | 1.856668042 | 0.245675665 | -7.218224135 | -0.342180206 | 3.7231 | 232.3027 | 842.095 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 1 | 14 | 0 | 17 | 0 | 3 | 3 | 332 | hepta_891 | -5.21 | 3.806255276 | 1.345051751 | 34.70927174 | 36.58632203 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 107.9961525 | 35.28278936 | null | -5.21 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(C)[C@@H](CC(C)C)C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.4436671 | 41.35025811 | 0.0 | 34.70927174 | 11.78791537 | 121.8291818 | 46.43595222 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'meL', 'Bn_Gly', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 147.2751311 | 46.43154487 | 11.78791537 | 180.4669026 | 60.42418708 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4468 | null | 150.96 | 60.04 | 599.3136979 | 0.0 | 101.7477785 | -2.65498849 | -5.632058237 | -44.33340617 | -56.59146681 | -48.98121632 | -78.20167375 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.38341763 | null |
118bbffd7a3a1ef8edf47e84d815448b3b96ca44b0ec3fe0fd2345e6cbe83ef1 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,468 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'bHph', 'dP', 'meL', 'F'] | 46 | 4469 | -5.7 | -5.7 | Circle | 6 | -2.35e-16 | -2.702845834 | -1.82e-16 | -2.861579014 | -3.31e-17 | -1.13498946 | 1.42e-15 | -0.249287763 | 2.609337397 | 4819.653284 | 141.0 | null | null | 103.011107 | 96.4882332 | 29.4882332 | 55.40384141 | 48.79543216 | 15.45379138 | 10.35197332 | 10.35197332 | 6.407416578 | 6.407416578 | 4.054836218 | 4.054836218 | null | null | null | null | 327.2776726 | 28.90918025 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.05489358 | 841.5101975 | 0.770491803 | 1.393442623 | 2.032786885 | 0.595744681 | 122.0 | PEPTIDE4469{P.[Pr_Gly].L.[bHph].[dP].[meL].F}$PEPTIDE4469,PEPTIDE4469,1:R1-7:R2$$$ | PEPTIDE4469{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4469,PEPTIDE4469,1:R1-7:R2$$$ | -5.27 | 61 | 774.559 | 4469 | null | null | 6.96e+42 | 10.39396068 | 22.00820975 | 12.63834575 | 455.3707472 | null | 16.80443776 | 0.350730367 | 16.80443776 | 0.245675665 | 1.827239805 | 0.245675665 | -7.107724883 | -0.350730367 | 3.4697 | 232.5101 | 842.095 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 16 | 0 | 3 | 3 | 332 | hepta_892 | -5.7 | 3.48404148 | 1.059332156 | 35.52907898 | 30.08946234 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 73.89821756 | 108.2850418 | 31.1705137 | null | -5.7 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.5258341 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 134.0960644 | 32.96326564 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'bHph', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 29.1, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 46.30761009 | 11.78791537 | 184.0983104 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4469 | null | 168.54 | 25.93 | 598.03261 | 0.0 | 105.550266 | -7.890166487 | -5.56096511 | -43.51846359 | -62.50690712 | -61.08658113 | -58.35312584 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.329491408 | null |
d2f433e0ec5e57b94bdd3fd173ed057f87704f793e55f36e2867f568f857c4c0 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,469 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Bn_Gly', 'meL', 'dP', 'meL', 'F'] | 50 | 4470 | -5.25 | -5.25 | Circle | 4 | -2.2e-16 | -2.708209303 | -1.9e-16 | -2.847646938 | 8.22e-17 | -1.135165428 | 1.07e-15 | -0.249287762 | 2.668313638 | 4810.143509 | 105.0 | null | null | 103.011107 | 96.4882332 | 29.4882332 | 55.32649114 | 48.84821857 | 15.40100497 | 10.42418691 | 10.42418691 | 6.572824678 | 6.572824678 | 4.124615946 | 4.124615946 | null | null | null | null | 327.6636693 | 38.42232309 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 53.45958369 | 841.5101975 | 0.737704918 | 1.31147541 | 1.918032787 | 0.595744681 | 103.0 | PEPTIDE4470{P.[Pr_Gly].[Bn_Gly].[meL].[dP].[meL].F}$PEPTIDE4470,PEPTIDE4470,1:R1-7:R2$$$ | PEPTIDE4470{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4470,PEPTIDE4470,1:R1-7:R2$$$ | -5.27 | 61 | 774.559 | 4470 | null | null | 7.94e+42 | 10.39396068 | 21.49777345 | 11.7649724 | 455.6745769 | null | 16.91196093 | 0.342180206 | 16.91196093 | 0.245675665 | 1.83288835 | 0.245675665 | -7.180657409 | -0.342180206 | 3.7231 | 232.3027 | 842.095 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 1 | 14 | 0 | 17 | 0 | 3 | 3 | 332 | hepta_893 | -5.25 | 3.835717058 | 1.361994561 | 34.70927174 | 36.58632203 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 67.52529266 | 107.9961525 | 35.28278936 | null | -5.25 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(Cc2ccccc2)CC(=O)N(C)[C@@H](CC(C)C)C(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 125.4436671 | 41.35025811 | 0.0 | 34.70927174 | 11.78791537 | 121.8291818 | 46.43595222 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Bn_Gly', 'meL', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.3173, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 147.2751311 | 46.43154487 | 11.78791537 | 180.4669026 | 60.42418708 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4470 | null | 150.96 | 57.04 | 599.1569231 | 0.0 | 101.777916 | -2.685125979 | -5.562555243 | -44.35157259 | -56.53453854 | -49.13861952 | -77.99576064 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.38341763 | null |
5a7a50430a7fff499afa60174119038936262bac2f4987677d5d7a90c33154ae | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,470 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'L', 'Bn_Gly', 'dP', 'Bn_Gly', 'F'] | 51 | 4471 | -6.21 | -6.21 | Circle | 6 | -1.55e-16 | -2.688747129 | -1.86e-17 | -2.834266632 | 3.64e-16 | -1.133168668 | 10.12033337 | -0.24928195 | 2.233258583 | 4875.912689 | 113.0 | null | null | 97.97520861 | 90.9882332 | 29.9882332 | 53.79059275 | 46.32182536 | 15.92739817 | 10.57558011 | 10.57558011 | 6.620944997 | 6.620944997 | 4.213778654 | 4.213778654 | null | null | null | null | 330.9026243 | 30.23885528 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 53.45958369 | 847.4632473 | 0.677419355 | 1.177419355 | 1.758064516 | 0.479166667 | 109.0 | PEPTIDE4471{P.[Pr_Gly].L.[Bn_Gly].[dP].[Bn_Gly].F}$PEPTIDE4471,PEPTIDE4471,1:R1-7:R2$$$ | PEPTIDE4471{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4471,PEPTIDE4471,1:R1-7:R2$$$ | -6.05 | 62 | 786.57 | 4471 | null | null | 1.72e+39 | 11.35983112 | 21.65004646 | 11.85634717 | 450.3252227 | null | 16.77030663 | 0.342747692 | 16.77030663 | 0.245675463 | 1.72923071 | 0.245675463 | -6.858295252 | -0.342747692 | 3.5366 | 233.5214 | 848.058 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 2 | 14 | 0 | 13 | 0 | 3 | 3 | 330 | hepta_894 | -6.21 | 4.932984621 | 3.163908236 | 35.11917536 | 30.56842956 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 111.191957 | 60.82186157 | 79.97998001 | 52.7457175 | null | -6.21 | null | null | null | null | null | null | null | null | null | null | 6 | CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 117.2601993 | 41.35025811 | 0.0 | 35.11917536 | 5.893957685 | 102.2314399 | 38.98115811 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'L', 'Bn_Gly', 'dP', 'Bn_Gly', 'F'] | [0.2794999999999998, 0.5271000000000001, 0.8193999999999995, 1.3173, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 128.9025347 | 52.92840456 | 5.893957685 | 156.358335 | 90.63628061 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4471 | null | 159.75 | 8.77 | 545.8645695 | 0.0 | 103.6498007 | -4.921516155 | -7.845578232 | -35.8508189 | -57.09094398 | -40.66642382 | -64.72242239 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.316081701 | null |
6727bd287d5624ed3ec07abcc0aa0c4c93bd71b1b35809e5abf678ee676eee35 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,471 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Me_dL', 'bHph', 'dP', 'Me_dL', 'F'] | 52 | 4472 | -5.63 | -5.63 | Circle | 5 | -2.88e-16 | -2.709845339 | -2.58e-16 | -2.855769465 | 3.41e-17 | -1.135200382 | 1.08e-15 | -0.249287763 | 2.661357277 | 4929.593412 | 108.0 | null | null | 105.511107 | 98.9882332 | 29.9882332 | 56.61516627 | 50.07182536 | 15.67739817 | 10.57558011 | 10.57558011 | 6.620765223 | 6.620765223 | 4.155608841 | 4.155608841 | null | null | null | null | 333.8435958 | 35.7218895 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.94261792 | 855.5258475 | 0.741935484 | 1.306451613 | 1.903225806 | 0.604166667 | 113.0 | PEPTIDE4472{P.[Pr_Gly].[Me_dL].[bHph].[dP].[Me_dL].F}$PEPTIDE4472,PEPTIDE4472,1:R1-7:R2$$$ | PEPTIDE4472{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4472,PEPTIDE4472,1:R1-7:R2$$$ | -5.27 | 62 | 786.57 | 4472 | null | null | 8.93e+43 | 10.46911652 | 22.19224542 | 12.2154382 | 464.6975452 | null | 16.89152454 | 0.350723941 | 16.89152454 | 0.245675665 | 1.865692514 | 0.245675665 | -7.142933493 | -0.350723941 | 3.8119 | 237.1374 | 856.122 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 17 | 0 | 3 | 3 | 338 | hepta_895 | -5.63 | 3.351982163 | 1.250856169 | 35.11917536 | 30.08946234 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 94.68364766 | 73.89821756 | 119.3731444 | 31.1705137 | null | -5.63 | null | null | null | null | null | null | null | null | null | null | 5 | CCCN1CC(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 128.2262677 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 134.0960644 | 39.93909254 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Me_dL', 'bHph', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.1616, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 46.30761009 | 11.78791537 | 188.210586 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4472 | null | 159.75 | 29.84 | 618.2936776 | 0.0 | 103.886646 | -5.374936998 | -5.658958081 | -44.37226492 | -63.53103119 | -61.91872403 | -65.40774167 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.368012479 | null |
527c0173beb766eb343a1c53fd5fad28aee4093d0bd925376e5087a913b57c9e | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,472 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Bn_Gly', 'bHph', 'dP', 'dL', 'F'] | 50 | 4473 | -6.44 | -6.44 | Circle | 5 | -1.54e-16 | -2.684804616 | -6.7e-18 | -2.858325278 | 2.34e-16 | -1.13323109 | 7.17e-15 | -0.249281951 | 2.22675028 | 4995.642667 | 129.0 | null | null | 100.4752086 | 93.4882332 | 30.4882332 | 55.07926789 | 47.54543216 | 16.20379138 | 10.72697332 | 10.72697332 | 6.668885542 | 6.668885542 | 4.2168207 | 4.2168207 | null | null | null | null | 337.0825508 | 38.50449014 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 47.97654947 | 861.4788974 | 0.714285714 | 1.317460317 | 1.968253968 | 0.489795918 | 127.0 | PEPTIDE4473{P.[Pr_Gly].[Bn_Gly].[bHph].[dP].[dL].F}$PEPTIDE4473,PEPTIDE4473,1:R1-7:R2$$$ | PEPTIDE4473{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4473,PEPTIDE4473,1:R1-7:R2$$$ | -6.05 | 63 | 798.581 | 4473 | null | null | 2.35e+41 | 11.41882426 | 22.3458208 | 12.76469724 | 459.348191 | null | 16.76396573 | 0.350975418 | 16.76396573 | 0.245675664 | 1.740520176 | 0.245675664 | -6.777221843 | -0.350975418 | 3.6254 | 238.3561 | 862.085 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 3 | 14 | 0 | 13 | 0 | 3 | 3 | 336 | hepta_896 | -6.44 | 4.252275088 | 2.626642738 | 35.52907898 | 24.07156987 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 111.191957 | 67.19478647 | 91.35697192 | 48.63344183 | null | -6.44 | null | null | null | null | null | null | null | null | null | null | 6 | CCCN1CC(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 120.0427999 | 41.35025811 | 0.0 | 35.52907898 | 5.893957685 | 114.4983225 | 32.48429842 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Bn_Gly', 'bHph', 'dP', 'dL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.3173, 1.4060999999999997, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 52.80446978 | 5.893957685 | 164.1020185 | 90.63628061 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4473 | null | 168.54 | 5.26 | 564.9053112 | 0.0 | 105.6054898 | -7.407450058 | -7.913689174 | -35.95521325 | -63.96130099 | -53.124799 | -52.48168185 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.280040332 | null |
c8be99f65933cb577c9ab210c54a6c61e169f0cde7f662c44ce5206e10c940ec | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,473 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Bn_Gly', 'bHph', 'dP', 'L', 'F'] | 49 | 4474 | -10.0 | -10 | Circle | 2 | -1.54e-16 | -2.684804616 | -6.7e-18 | -2.858325278 | 2.34e-16 | -1.13323109 | 7.17e-15 | -0.249281951 | 2.22675028 | 4995.642667 | 118.0 | null | null | 100.4752086 | 93.4882332 | 30.4882332 | 55.07926789 | 47.54543216 | 16.20379138 | 10.72697332 | 10.72697332 | 6.668885542 | 6.668885542 | 4.2168207 | 4.2168207 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 337.0825508 | 38.50449014 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 47.97654947 | 861.4788974 | 0.714285714 | 1.317460317 | 1.968253968 | 0.489795918 | 118.0 | PEPTIDE4474{P.[Pr_Gly].[Bn_Gly].[bHph].[dP].L.F}$PEPTIDE4474,PEPTIDE4474,1:R1-7:R2$$$ | PEPTIDE4474{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4474,PEPTIDE4474,1:R1-7:R2$$$ | -6.05 | 63 | 798.581 | 4474 | null | null | 2.35e+41 | 11.41882426 | 22.3458208 | 12.76469724 | 459.348191 | null | 16.76396573 | 0.350975418 | 16.76396573 | 0.245675664 | 1.740520176 | 0.245675664 | -6.777221843 | -0.350975418 | 3.6254 | 238.3561 | 862.085 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 3 | 14 | 0 | 13 | 0 | 3 | 3 | 336 | hepta_897 | -10.0 | 4.252275088 | 2.626642738 | 35.52907898 | 24.07156987 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 111.191957 | 67.19478647 | 91.35697192 | 48.63344183 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 6 | CCCN1CC(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 120.0427999 | 41.35025811 | 0.0 | 35.52907898 | 5.893957685 | 114.4983225 | 32.48429842 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Bn_Gly', 'bHph', 'dP', 'L', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.3173, 1.4060999999999997, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 20.31, 20.31, 29.1, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 52.80446978 | 5.893957685 | 164.1020185 | 90.63628061 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4474 | null | 168.54 | 0.0 | 564.9053112 | 0.0 | 105.6054898 | -7.407450058 | -7.913689174 | -35.95521325 | -63.96130099 | -53.124799 | -52.48168185 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.280040332 | null |
6cbd7117561dea04c7ecf288fcc05d85a910c8d087e09c0b0932f0bddedceab5 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,474 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'Pr_Gly', 'Bn_Gly', 'Bn_Gly', 'dP', 'meL', 'F'] | 53 | 4475 | -6.59 | -6.59 | Circle | 3 | -2.15e-16 | -2.700298186 | -8.96e-17 | -2.846061865 | 1.69e-16 | -1.133996915 | 5.04e-15 | -0.249281958 | 2.278647538 | 4986.132892 | 125.0 | null | null | 100.4752086 | 93.4882332 | 30.4882332 | 55.00191762 | 47.59821857 | 16.15100497 | 10.79918691 | 10.79918691 | 6.834293642 | 6.834293642 | 4.286600427 | 4.286600427 | null | null | null | null | 337.4685475 | 34.31004743 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 52.08882513 | 861.4788974 | 0.714285714 | 1.238095238 | 1.793650794 | 0.489795918 | 123.0 | PEPTIDE4475{P.[Pr_Gly].[Bn_Gly].[Bn_Gly].[dP].[meL].F}$PEPTIDE4475,PEPTIDE4475,1:R1-7:R2$$$ | PEPTIDE4475{<a href="/monomers/P/">P</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4475,PEPTIDE4475,1:R1-7:R2$$$ | -6.05 | 63 | 798.581 | 4475 | null | null | 2.1800000000000002e+42 | 11.41882426 | 21.84056137 | 11.90645669 | 459.6520207 | null | 16.86780004 | 0.342180206 | 16.86780004 | 0.245675665 | 1.755340618 | 0.245675665 | -7.020609077 | -0.342180206 | 3.8788 | 238.1487 | 862.085 | Circle | 7 | 7 | null | 1 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 1 | 14 | 0 | 14 | 0 | 3 | 3 | 336 | hepta_898 | -6.59 | 4.426311403 | 2.684233969 | 34.70927174 | 37.06528924 | 1.411842078 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 111.191957 | 60.82186157 | 91.06808258 | 46.24885781 | null | -6.59 | null | null | null | null | null | null | null | null | null | null | 6 | CCCN1CC(=O)N(Cc2ccccc2)CC(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C1=O | 119.9606328 | 41.35025811 | 0.0 | 34.70927174 | 5.893957685 | 102.2314399 | 45.95698501 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['P', 'Pr_Gly', 'Bn_Gly', 'Bn_Gly', 'dP', 'meL', 'F'] | [0.2794999999999998, 0.5271000000000001, 1.3173, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1] | 5.309813353 | 0.0 | 0.0 | 0.0 | 140.7782714 | 52.92840456 | 5.893957685 | 160.4706107 | 90.63628061 | 1.411842078 | 0.0 | 0 | 2020_Townsend | 4475 | null | 150.96 | 3.75 | 565.9304521 | 0.0 | 102.2036041 | -2.599333905 | -7.992761337 | -36.62672257 | -58.42006466 | -41.49598939 | -71.33251765 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 6 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.325375015 | null |
c3cb19b1e4654859ea328dce9ab05dd833f8f3ee71f69affbc8d42001d1192fc | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,475 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'dL', 'P', 'dL', 'F'] | 39 | 4476 | -10.0 | -10 | Circle | 6 | -2.19e-16 | -2.703775545 | -1.88e-16 | -2.868550446 | -7.78e-17 | -1.135354484 | 7.86e-16 | -0.249287767 | 2.927614811 | 4086.295672 | 165.0 | null | null | 93.04700538 | 86.9882332 | 25.9882332 | 49.5557652 | 43.74264576 | 13.50657778 | 9.15475972 | 9.15475972 | 5.508992172 | 5.508992172 | 3.447737573 | 3.447737573 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 285.2221731 | 20.68462891 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 751.4632473 | 0.685185185 | 1.12962963 | 1.648148148 | 0.675 | 160.0 | PEPTIDE4476{P.[dA].[dL].[dL].P.[dL].F}$PEPTIDE4476,PEPTIDE4476,1:R1-7:R2$$$ | PEPTIDE4476{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4476,PEPTIDE4476,1:R1-7:R2$$$ | -4.49 | 54 | 690.482 | 4476 | null | null | 1.56e+36 | 9.042473157 | 19.20403085 | 11.26626648 | 405.2150582 | null | 16.36228882 | 0.342800051 | 16.36228882 | 0.245675543 | 1.761202119 | 0.245675543 | -6.903059693 | -0.342800051 | 1.8069 | 203.3085 | 751.97 | Circle | 7 | 7 | null | 5 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 5 | 14 | 0 | 15 | 0 | 3 | 3 | 298 | hepta_899 | -10.0 | 3.334617113 | -0.672073818 | 36.34888623 | 42.12524728 | 7.059210392 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 79.68002074 | 16.44910267 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 117.3834498 | 41.35025811 | 0.0 | 36.34888623 | 17.68187306 | 141.0718913 | 12.99371937 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'dL', 'P', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 29.1, 29.1] | 26.54906677 | 0.0 | 0.0 | 0.0 | 106.2690442 | 39.93468519 | 17.68187306 | 174.8996498 | 30.21209354 | 7.059210392 | 0.0 | 0 | 2020_Townsend | 4476 | null | 186.12 | 0.0 | 533.5850221 | 0.0 | 107.7483742 | -12.77259244 | -2.653830334 | -48.24117052 | -56.38575167 | -47.91502434 | -49.94836025 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 2 | 5 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.268210792 | null |
24ba26a48e98c84d9831bc2084d2e2ed8c8c9032c919222628a9283db4cb2861 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,476 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'L', 'P', 'dL', 'F'] | 38 | 4477 | -6.69 | -6.69 | Circle | 8 | -1.59e-16 | -2.703775545 | -1.29e-16 | -2.868550446 | -3.87e-17 | -1.135354484 | 1.07e-15 | -0.249287767 | 2.927614811 | 4086.295672 | 151.0 | null | null | 93.04700538 | 86.9882332 | 25.9882332 | 49.5557652 | 43.74264576 | 13.50657778 | 9.15475972 | 9.15475972 | 5.508992172 | 5.508992172 | 3.447737573 | 3.447737573 | null | null | null | null | 285.2221731 | 20.68462891 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 751.4632473 | 0.685185185 | 1.12962963 | 1.648148148 | 0.675 | 148.0 | PEPTIDE4477{P.[dA].[dL].L.P.[dL].F}$PEPTIDE4477,PEPTIDE4477,1:R1-7:R2$$$ | PEPTIDE4477{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4477,PEPTIDE4477,1:R1-7:R2$$$ | -4.49 | 54 | 690.482 | 4477 | null | null | 1.53e+36 | 9.042473157 | 19.20403085 | 11.26626648 | 405.2150582 | null | 16.36228882 | 0.342800051 | 16.36228882 | 0.245675543 | 1.761202119 | 0.245675543 | -6.903059693 | -0.342800051 | 1.8069 | 203.3085 | 751.97 | Circle | 7 | 7 | null | 5 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 5 | 14 | 0 | 15 | 0 | 3 | 3 | 298 | hepta_900 | -6.69 | 3.334617113 | -0.672073818 | 36.34888623 | 42.12524728 | 7.059210392 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 79.68002074 | 16.44910267 | null | -6.69 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H]2CCCN2C1=O | 117.3834498 | 41.35025811 | 0.0 | 36.34888623 | 17.68187306 | 141.0718913 | 12.99371937 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'L', 'P', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 29.1, 29.1] | 26.54906677 | 0.0 | 0.0 | 0.0 | 106.2690442 | 39.93468519 | 17.68187306 | 174.8996498 | 30.21209354 | 7.059210392 | 0.0 | 0 | 2020_Townsend | 4477 | null | 186.12 | 3.02 | 533.5850221 | 0.0 | 107.7483742 | -12.77259244 | -2.653830334 | -48.24117052 | -56.38575167 | -47.91502434 | -49.94836025 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 2 | 5 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.268210792 | null |
cfb03872b76993069ae4f87b1340eb3bc308d075495a9456c1ec58d3c2c796bd | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,478 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'dL', 'P', 'L', 'F'] | 38 | 4479 | -5.84 | -5.84 | Circle | 3 | -2.19e-16 | -2.703775545 | -1.88e-16 | -2.868550446 | -7.78e-17 | -1.135354484 | 7.86e-16 | -0.249287767 | 2.927614811 | 4086.295672 | 155.0 | null | null | 93.04700538 | 86.9882332 | 25.9882332 | 49.5557652 | 43.74264576 | 13.50657778 | 9.15475972 | 9.15475972 | 5.508992172 | 5.508992172 | 3.447737573 | 3.447737573 | null | null | null | null | 285.2221731 | 20.68462891 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 751.4632473 | 0.685185185 | 1.12962963 | 1.648148148 | 0.675 | 157.0 | PEPTIDE4479{P.[dA].[dL].[dL].P.L.F}$PEPTIDE4479,PEPTIDE4479,1:R1-7:R2$$$ | PEPTIDE4479{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4479,PEPTIDE4479,1:R1-7:R2$$$ | -4.49 | 54 | 690.482 | 4479 | null | null | 1.56e+36 | 9.042473157 | 19.20403085 | 11.26626648 | 405.2150582 | null | 16.36228882 | 0.342800051 | 16.36228882 | 0.245675543 | 1.761202119 | 0.245675543 | -6.903059693 | -0.342800051 | 1.8069 | 203.3085 | 751.97 | Circle | 7 | 7 | null | 5 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 5 | 14 | 0 | 15 | 0 | 3 | 3 | 298 | hepta_902 | -5.84 | 3.334617113 | -0.672073818 | 36.34888623 | 42.12524728 | 7.059210392 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 79.68002074 | 16.44910267 | null | -5.84 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 117.3834498 | 41.35025811 | 0.0 | 36.34888623 | 17.68187306 | 141.0718913 | 12.99371937 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'dL', 'P', 'L', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 29.1, 29.1] | 26.54906677 | 0.0 | 0.0 | 0.0 | 106.2690442 | 39.93468519 | 17.68187306 | 174.8996498 | 30.21209354 | 7.059210392 | 0.0 | 0 | 2020_Townsend | 4479 | null | 186.12 | 19.37 | 533.5850221 | 0.0 | 107.7483742 | -12.77259244 | -2.653830334 | -48.24117052 | -56.38575167 | -47.91502434 | -49.94836025 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 2 | 5 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.268210792 | null |
fb20e5cc76238af9be029d8b36fa7f6ee226952697953fd871bcc3e080bdeea0 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,479 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'L', 'P', 'L', 'F'] | 37 | 4480 | -10.0 | -10 | Circle | 4 | -2.19e-16 | -2.703775545 | -1.88e-16 | -2.868550446 | -7.78e-17 | -1.135354484 | 7.86e-16 | -0.249287767 | 2.927614811 | 4086.295672 | 149.0 | null | null | 93.04700538 | 86.9882332 | 25.9882332 | 49.5557652 | 43.74264576 | 13.50657778 | 9.15475972 | 9.15475972 | 5.508992172 | 5.508992172 | 3.447737573 | 3.447737573 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 285.2221731 | 20.68462891 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 751.4632473 | 0.685185185 | 1.12962963 | 1.648148148 | 0.675 | 147.0 | PEPTIDE4480{P.[dA].[dL].L.P.L.F}$PEPTIDE4480,PEPTIDE4480,1:R1-7:R2$$$ | PEPTIDE4480{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4480,PEPTIDE4480,1:R1-7:R2$$$ | -4.49 | 54 | 690.482 | 4480 | null | null | 1.56e+36 | 9.042473157 | 19.20403085 | 11.26626648 | 405.2150582 | null | 16.36228882 | 0.342800051 | 16.36228882 | 0.245675543 | 1.761202119 | 0.245675543 | -6.903059693 | -0.342800051 | 1.8069 | 203.3085 | 751.97 | Circle | 7 | 7 | null | 5 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 5 | 14 | 0 | 15 | 0 | 3 | 3 | 298 | hepta_903 | -10.0 | 3.334617113 | -0.672073818 | 36.34888623 | 42.12524728 | 7.059210392 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 79.68002074 | 16.44910267 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 117.3834498 | 41.35025811 | 0.0 | 36.34888623 | 17.68187306 | 141.0718913 | 12.99371937 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'L', 'P', 'L', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 29.1, 29.1] | 26.54906677 | 0.0 | 0.0 | 0.0 | 106.2690442 | 39.93468519 | 17.68187306 | 174.8996498 | 30.21209354 | 7.059210392 | 0.0 | 0 | 2020_Townsend | 4480 | null | 186.12 | 0.0 | 533.5850221 | 0.0 | 107.7483742 | -12.77259244 | -2.653830334 | -48.24117052 | -56.38575167 | -47.91502434 | -49.94836025 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 2 | 5 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.268210792 | null |
159a1933b8a0580c4b4a2712def9d44e30c53b91d70c1eb6c81f8c54fea05d5d | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,480 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'L', 'P', 'dL', 'F'] | 37 | 4481 | -10.0 | -10 | Circle | 1 | -1.71e-16 | -2.703775545 | -1.63e-16 | -2.868550446 | -3.46e-17 | -1.135354484 | 9.33e-16 | -0.249287767 | 2.927614811 | 4086.295672 | 144.0 | null | null | 93.04700538 | 86.9882332 | 25.9882332 | 49.5557652 | 43.74264576 | 13.50657778 | 9.15475972 | 9.15475972 | 5.508992172 | 5.508992172 | 3.447737573 | 3.447737573 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 285.2221731 | 20.68462891 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 751.4632473 | 0.685185185 | 1.12962963 | 1.648148148 | 0.675 | 139.0 | PEPTIDE4481{P.[dA].L.L.P.[dL].F}$PEPTIDE4481,PEPTIDE4481,1:R1-7:R2$$$ | PEPTIDE4481{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4481,PEPTIDE4481,1:R1-7:R2$$$ | -4.49 | 54 | 690.482 | 4481 | null | null | 7.15e+36 | 9.042473157 | 19.20403085 | 11.26626648 | 405.2150582 | null | 16.36228882 | 0.342800051 | 16.36228882 | 0.245675543 | 1.761202119 | 0.245675543 | -6.903059693 | -0.342800051 | 1.8069 | 203.3085 | 751.97 | Circle | 7 | 7 | null | 5 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 5 | 14 | 0 | 15 | 0 | 3 | 3 | 298 | hepta_904 | -10.0 | 3.334617113 | -0.672073818 | 36.34888623 | 42.12524728 | 7.059210392 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 79.68002074 | 16.44910267 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC1=O | 117.3834498 | 41.35025811 | 0.0 | 36.34888623 | 17.68187306 | 141.0718913 | 12.99371937 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'L', 'P', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 29.1, 29.1] | 26.54906677 | 0.0 | 0.0 | 0.0 | 106.2690442 | 39.93468519 | 17.68187306 | 174.8996498 | 30.21209354 | 7.059210392 | 0.0 | 0 | 2020_Townsend | 4481 | null | 186.12 | 0.0 | 533.5850221 | 0.0 | 107.7483742 | -12.77259244 | -2.653830334 | -48.24117052 | -56.38575167 | -47.91502434 | -49.94836025 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 2 | 5 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.268210792 | null |
16045b3b1180242d9db7576c5c04637d794931a45eae013cb77d072de3d66d62 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,481 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'dL', 'P', 'L', 'F'] | 37 | 4482 | -6.33 | -6.33 | Circle | 8 | -2.19e-16 | -2.703775545 | -1.88e-16 | -2.868550446 | -7.78e-17 | -1.135354484 | 7.86e-16 | -0.249287767 | 2.927614811 | 4086.295672 | 146.0 | null | null | 93.04700538 | 86.9882332 | 25.9882332 | 49.5557652 | 43.74264576 | 13.50657778 | 9.15475972 | 9.15475972 | 5.508992172 | 5.508992172 | 3.447737573 | 3.447737573 | null | null | null | null | 285.2221731 | 20.68462891 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 751.4632473 | 0.685185185 | 1.12962963 | 1.648148148 | 0.675 | 144.0 | PEPTIDE4482{P.[dA].L.[dL].P.L.F}$PEPTIDE4482,PEPTIDE4482,1:R1-7:R2$$$ | PEPTIDE4482{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4482,PEPTIDE4482,1:R1-7:R2$$$ | -4.49 | 54 | 690.482 | 4482 | null | null | 1.56e+36 | 9.042473157 | 19.20403085 | 11.26626648 | 405.2150582 | null | 16.36228882 | 0.342800051 | 16.36228882 | 0.245675543 | 1.761202119 | 0.245675543 | -6.903059693 | -0.342800051 | 1.8069 | 203.3085 | 751.97 | Circle | 7 | 7 | null | 5 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 5 | 14 | 0 | 15 | 0 | 3 | 3 | 298 | hepta_905 | -6.33 | 3.334617113 | -0.672073818 | 36.34888623 | 42.12524728 | 7.059210392 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 79.68002074 | 16.44910267 | null | -6.33 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 117.3834498 | 41.35025811 | 0.0 | 36.34888623 | 17.68187306 | 141.0718913 | 12.99371937 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'dL', 'P', 'L', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 29.1, 29.1] | 26.54906677 | 0.0 | 0.0 | 0.0 | 106.2690442 | 39.93468519 | 17.68187306 | 174.8996498 | 30.21209354 | 7.059210392 | 0.0 | 0 | 2020_Townsend | 4482 | null | 186.12 | 6.75 | 533.5850221 | 0.0 | 107.7483742 | -12.77259244 | -2.653830334 | -48.24117052 | -56.38575167 | -47.91502434 | -49.94836025 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 2 | 5 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.268210792 | null |
5655612b76cbf7005b3b0cf52f8d8f8a7429cc5d4bd19d63903f94cd76395a4e | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,482 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'L', 'P', 'L', 'F'] | 36 | 4483 | -7.03 | -7.03 | Circle | 6 | -2.19e-16 | -2.703775545 | -1.88e-16 | -2.868550446 | -7.78e-17 | -1.135354484 | 7.86e-16 | -0.249287767 | 2.927614811 | 4086.295672 | 160.0 | null | null | 93.04700538 | 86.9882332 | 25.9882332 | 49.5557652 | 43.74264576 | 13.50657778 | 9.15475972 | 9.15475972 | 5.508992172 | 5.508992172 | 3.447737573 | 3.447737573 | null | null | null | null | 285.2221731 | 20.68462891 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 751.4632473 | 0.685185185 | 1.12962963 | 1.648148148 | 0.675 | 152.0 | PEPTIDE4483{P.[dA].L.L.P.L.F}$PEPTIDE4483,PEPTIDE4483,1:R1-7:R2$$$ | PEPTIDE4483{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4483,PEPTIDE4483,1:R1-7:R2$$$ | -4.49 | 54 | 690.482 | 4483 | null | null | 1.56e+36 | 9.042473157 | 19.20403085 | 11.26626648 | 405.2150582 | null | 16.36228882 | 0.342800051 | 16.36228882 | 0.245675543 | 1.761202119 | 0.245675543 | -6.903059693 | -0.342800051 | 1.8069 | 203.3085 | 751.97 | Circle | 7 | 7 | null | 5 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 5 | 14 | 0 | 15 | 0 | 3 | 3 | 298 | hepta_906 | -7.03 | 3.334617113 | -0.672073818 | 36.34888623 | 42.12524728 | 7.059210392 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 79.68002074 | 16.44910267 | null | -7.03 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 117.3834498 | 41.35025811 | 0.0 | 36.34888623 | 17.68187306 | 141.0718913 | 12.99371937 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'L', 'P', 'L', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 29.1, 29.1] | 26.54906677 | 0.0 | 0.0 | 0.0 | 106.2690442 | 39.93468519 | 17.68187306 | 174.8996498 | 30.21209354 | 7.059210392 | 0.0 | 0 | 2020_Townsend | 4483 | null | 186.12 | 1.4 | 533.5850221 | 0.0 | 107.7483742 | -12.77259244 | -2.653830334 | -48.24117052 | -56.38575167 | -47.91502434 | -49.94836025 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 2 | 5 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.268210792 | null |
3ccde515ab5636021b4f2d8e99dd4cfc840c09ed9f7837c18c35e5a617ef376d | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,483 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'Me_dL', 'P', 'dL', 'F'] | 42 | 4484 | -6.28 | -6.28 | Circle | 9 | -1.6e-16 | -2.71822073 | -1.69e-16 | -2.85880215 | -4.13e-17 | -1.135756562 | 1.02e-15 | -0.249287767 | 2.995363505 | 4193.826765 | 138.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 765.4788974 | 0.727272727 | 1.272727273 | 1.872727273 | 0.682926829 | 130.0 | PEPTIDE4484{P.[dA].[dL].[Me_dL].P.[dL].F}$PEPTIDE4484,PEPTIDE4484,1:R1-7:R2$$$ | PEPTIDE4484{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4484,PEPTIDE4484,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4484 | null | null | 2.69e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.67895549 | 0.342800051 | 16.67895549 | 0.245675543 | 1.779090538 | 0.245675543 | -7.189518026 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_907 | -6.28 | 3.308584281 | -0.576066595 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -6.28 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'Me_dL', 'P', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4484 | null | 177.33 | 7.52 | 553.7509136 | 0.0 | 106.1505978 | -10.29883042 | -2.679142125 | -49.2617999 | -57.37730347 | -48.66999408 | -56.94777475 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
451e10f67ab87f7f06093c8b10b15641efeec0bc14574ea2800c393d0e12c222 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,484 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'dL', 'P', 'Me_dL', 'F'] | 42 | 4485 | -5.77 | -5.77 | Circle | 6 | -1.66e-16 | -2.707729398 | -1.77e-16 | -2.867758643 | -7.07e-17 | -1.135354896 | 8.92e-16 | -0.249287767 | 3.001926314 | 4193.826765 | 140.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 20.64354539 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.87857774 | 765.4788974 | 0.727272727 | 1.290909091 | 1.927272727 | 0.682926829 | 138.0 | PEPTIDE4485{P.[dA].[dL].[dL].P.[Me_dL].F}$PEPTIDE4485,PEPTIDE4485,1:R1-7:R2$$$ | PEPTIDE4485{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4485,PEPTIDE4485,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4485 | null | null | 1.89e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.57926341 | 0.342800051 | 16.57926341 | 0.245675544 | 1.799654828 | 0.245675544 | -7.070537473 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_908 | -5.77 | 3.354277628 | -0.648005228 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -5.77 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(C)C)NC1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'dL', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 20.31, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4485 | null | 177.33 | 22.66 | 553.7509106 | 0.0 | 106.2357284 | -10.38396106 | -2.718693374 | -49.19597155 | -57.51086548 | -48.75620396 | -56.75427693 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
f28d484b6b50c6944586da9999fcae1f3cc35497f9362a586d5baeabdc154673 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,485 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'dL', 'P', 'meL', 'F'] | 40 | 4486 | -10.0 | -10 | Circle | 7 | -2.57e-16 | -2.707729398 | -2.15e-16 | -2.867758643 | -9.38e-17 | -1.135354896 | 1.44e-15 | -0.249287767 | 3.001926314 | 4193.826765 | 129.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 291.7880964 | 20.64354539 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.87857774 | 765.4788974 | 0.727272727 | 1.290909091 | 1.927272727 | 0.682926829 | 129.0 | PEPTIDE4486{P.[dA].[dL].[dL].P.[meL].F}$PEPTIDE4486,PEPTIDE4486,1:R1-7:R2$$$ | PEPTIDE4486{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4486,PEPTIDE4486,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4486 | null | null | 1.58e+36 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.57926341 | 0.342800051 | 16.57926341 | 0.245675544 | 1.799654828 | 0.245675544 | -7.070537473 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_909 | -10.0 | 3.354277628 | -0.648005228 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@H]2C(=O)N1C | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'dL', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 20.31, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4486 | null | 177.33 | 0.0 | 553.7509106 | 0.0 | 106.2357284 | -10.38396106 | -2.718693374 | -49.19597155 | -57.51086548 | -48.75620396 | -56.75427693 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
be777cefb2393fd3717b2b6563fb0fa02e391d6e3eb1dfdfa0f9780dd4c67c17 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,486 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'meL', 'P', 'dL', 'F'] | 40 | 4487 | -6.51 | -6.51 | Circle | 9 | -2.16e-16 | -2.71822073 | -1.49e-16 | -2.85880215 | -9.2e-17 | -1.135756562 | 1.09e-15 | -0.249287767 | 2.995363505 | 4193.826765 | 130.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 765.4788974 | 0.727272727 | 1.272727273 | 1.872727273 | 0.682926829 | 124.0 | PEPTIDE4487{P.[dA].[dL].[meL].P.[dL].F}$PEPTIDE4487,PEPTIDE4487,1:R1-7:R2$$$ | PEPTIDE4487{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4487,PEPTIDE4487,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4487 | null | null | 1.13e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.67895549 | 0.342800051 | 16.67895549 | 0.245675543 | 1.779090538 | 0.245675543 | -7.189518026 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_910 | -6.51 | 3.308584281 | -0.576066595 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -6.51 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1C(=O)N2CCC[C@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N[C@H](CC(C)C)C(=O)N1C | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'meL', 'P', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4487 | null | 177.33 | 4.5 | 553.7509136 | 0.0 | 106.1505978 | -10.29883042 | -2.679142125 | -49.2617999 | -57.37730347 | -48.66999408 | -56.94777475 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
36c6e12ce8cce550b9064c7d665dd48cc90a3dc5fc03259c85c470af9be97604 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,487 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Me_dL', 'dL', 'P', 'L', 'F'] | 41 | 4488 | -6.33 | -6.33 | Circle | 4 | -2.34e-16 | -2.713832687 | -1.45e-16 | -2.86126448 | -4.16e-17 | -1.135672081 | 1.3e-15 | -0.249287767 | 2.991194867 | 4193.826765 | 138.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 24.79690458 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 61.72521855 | 765.4788974 | 0.727272727 | 1.254545455 | 1.836363636 | 0.682926829 | 134.0 | PEPTIDE4488{P.[dA].[Me_dL].[dL].P.L.F}$PEPTIDE4488,PEPTIDE4488,1:R1-7:R2$$$ | PEPTIDE4488{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4488,PEPTIDE4488,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4488 | null | null | 5.589999999999999e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.49495665 | 0.342792017 | 16.49495665 | 0.245675543 | 1.783597952 | 0.245675543 | -7.061202372 | -0.342792017 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_911 | -6.33 | 3.37752281 | -0.577275551 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -6.33 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Me_dL', 'dL', 'P', 'L', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4488 | null | 177.33 | 6.81 | 553.4160707 | 0.0 | 106.304084 | -10.45231669 | -2.686960265 | -49.20040395 | -57.40539764 | -48.56969111 | -56.7387184 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
40e232e8e8cf58f45cc7fd20f6c8f28b8dd78edcd12ea7fec9ce536817396b34 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,488 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'L', 'P', 'Me_dL', 'F'] | 41 | 4489 | -6.43 | -6.43 | Circle | 2 | -2.14e-16 | -2.707729398 | -1.81e-16 | -2.867758643 | -1.5e-16 | -1.135354896 | 9.56e-16 | -0.249287767 | 3.001926314 | 4193.826765 | 135.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 20.64354539 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.87857774 | 765.4788974 | 0.727272727 | 1.290909091 | 1.927272727 | 0.682926829 | 139.0 | PEPTIDE4489{P.[dA].[dL].L.P.[Me_dL].F}$PEPTIDE4489,PEPTIDE4489,1:R1-7:R2$$$ | PEPTIDE4489{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4489,PEPTIDE4489,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4489 | null | null | 6.35e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.57926341 | 0.342800051 | 16.57926341 | 0.245675544 | 1.799654828 | 0.245675544 | -7.070537473 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_912 | -6.43 | 3.354277628 | -0.648005228 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -6.43 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'L', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 20.31, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4489 | null | 177.33 | 5.4 | 553.7509106 | 0.0 | 106.2357284 | -10.38396106 | -2.718693374 | -49.19597155 | -57.51086548 | -48.75620396 | -56.75427693 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
e4b1a5992211e41a49898b6bcbc82b2c3b09f18d4d84a36a4c2a411a3df266a8 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,489 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Me_dL', 'L', 'P', 'dL', 'F'] | 41 | 4490 | -5.9 | -5.9 | Circle | 6 | -2.34e-16 | -2.713832687 | -1.43e-16 | -2.86126448 | -9.9e-17 | -1.135672081 | 9.24e-16 | -0.249287767 | 2.991194867 | 4193.826765 | 131.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 24.79690458 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 61.72521855 | 765.4788974 | 0.727272727 | 1.254545455 | 1.836363636 | 0.682926829 | 128.0 | PEPTIDE4490{P.[dA].[Me_dL].L.P.[dL].F}$PEPTIDE4490,PEPTIDE4490,1:R1-7:R2$$$ | PEPTIDE4490{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4490,PEPTIDE4490,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4490 | null | null | 8.38e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.49495665 | 0.342792017 | 16.49495665 | 0.245675543 | 1.783597952 | 0.245675543 | -7.061202372 | -0.342792017 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_913 | -5.9 | 3.37752281 | -0.577275551 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -5.9 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H]2CCCN2C1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Me_dL', 'L', 'P', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4490 | null | 177.33 | 17.1 | 553.4160707 | 0.0 | 106.304084 | -10.45231669 | -2.686960265 | -49.20040395 | -57.40539764 | -48.56969111 | -56.7387184 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
e5d2c4504a012a2182bb011eef9d870b48e3ae223e3518aafed208be1090bf85 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,490 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'Me_dL', 'P', 'dL', 'F'] | 41 | 4491 | -5.93 | -5.93 | Circle | 8 | -2.04e-16 | -2.71822073 | -1.93e-16 | -2.85880215 | -3.83e-17 | -1.135756562 | 7.46e-16 | -0.249287767 | 2.995363505 | 4193.826765 | 136.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 765.4788974 | 0.727272727 | 1.272727273 | 1.872727273 | 0.682926829 | 130.0 | PEPTIDE4491{P.[dA].L.[Me_dL].P.[dL].F}$PEPTIDE4491,PEPTIDE4491,1:R1-7:R2$$$ | PEPTIDE4491{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4491,PEPTIDE4491,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4491 | null | null | 1.12e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.67895549 | 0.342800051 | 16.67895549 | 0.245675543 | 1.779090538 | 0.245675543 | -7.189518026 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_914 | -5.93 | 3.308584281 | -0.576066595 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -5.93 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(C)C)N(C)C1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'Me_dL', 'P', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4491 | null | 177.33 | 15.99 | 553.7509136 | 0.0 | 106.1505978 | -10.29883042 | -2.679142125 | -49.2617999 | -57.37730347 | -48.66999408 | -56.94777475 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
dc480f29f37f8aaf6c3b275d86555cff350227ca3330efbfbc326dccdf4b89ff | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,492 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'meL', 'P', 'L', 'F'] | 39 | 4493 | -10.0 | -10 | Circle | 2 | -1.6e-16 | -2.71822073 | -1.69e-16 | -2.85880215 | -4.13e-17 | -1.135756562 | 1.02e-15 | -0.249287767 | 2.995363505 | 4193.826765 | 123.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 291.7880964 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 765.4788974 | 0.727272727 | 1.272727273 | 1.872727273 | 0.682926829 | 120.0 | PEPTIDE4493{P.[dA].[dL].[meL].P.L.F}$PEPTIDE4493,PEPTIDE4493,1:R1-7:R2$$$ | PEPTIDE4493{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4493,PEPTIDE4493,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4493 | null | null | 2.69e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.67895549 | 0.342800051 | 16.67895549 | 0.245675543 | 1.779090538 | 0.245675543 | -7.189518026 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_916 | -10.0 | 3.308584281 | -0.576066595 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'meL', 'P', 'L', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4493 | null | 177.33 | 0.0 | 553.7509136 | 0.0 | 106.1505978 | -10.29883042 | -2.679142125 | -49.2617999 | -57.37730347 | -48.66999408 | -56.94777475 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
05c58b9357348e2e89c9e09fbd0e43a0d402b17fa26207c086b88e15ec5b295a | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,493 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'L', 'P', 'meL', 'F'] | 39 | 4494 | -6.16 | -6.16 | Circle | 9 | -2.14e-16 | -2.707729398 | -1.81e-16 | -2.867758643 | -1.5e-16 | -1.135354896 | 9.56e-16 | -0.249287767 | 3.001926314 | 4193.826765 | 132.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 20.64354539 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.87857774 | 765.4788974 | 0.727272727 | 1.290909091 | 1.927272727 | 0.682926829 | 126.0 | PEPTIDE4494{P.[dA].[dL].L.P.[meL].F}$PEPTIDE4494,PEPTIDE4494,1:R1-7:R2$$$ | PEPTIDE4494{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4494,PEPTIDE4494,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4494 | null | null | 6.35e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.57926341 | 0.342800051 | 16.57926341 | 0.245675544 | 1.799654828 | 0.245675544 | -7.070537473 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_917 | -6.16 | 3.354277628 | -0.648005228 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -6.16 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'L', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 20.31, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4494 | null | 177.33 | 9.91 | 553.7509106 | 0.0 | 106.2357284 | -10.38396106 | -2.718693374 | -49.19597155 | -57.51086548 | -48.75620396 | -56.75427693 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
fcea1c2547b8fcdd6707c0f2252df0f06baac3cba9d372cd2aedc21680e74516 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,494 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'L', 'P', 'Me_dL', 'F'] | 40 | 4495 | -4.0 | -4 | Circle | 5 | -1.66e-16 | -2.707729398 | -1.77e-16 | -2.867758643 | -7.07e-17 | -1.135354896 | 8.92e-16 | -0.249287767 | 3.001926314 | 4193.826765 | 132.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | there was no value in original paper (since %T>100, permeability was set to -4 by CycPeptMPDB) | null | null | 291.7880964 | 20.64354539 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.87857774 | 765.4788974 | 0.727272727 | 1.290909091 | 1.927272727 | 0.682926829 | 129.0 | PEPTIDE4495{P.[dA].L.L.P.[Me_dL].F}$PEPTIDE4495,PEPTIDE4495,1:R1-7:R2$$$ | PEPTIDE4495{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4495,PEPTIDE4495,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4495 | null | null | 1.89e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.57926341 | 0.342800051 | 16.57926341 | 0.245675544 | 1.799654828 | 0.245675544 | -7.070537473 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_918 | -4.0 | 3.354277628 | -0.648005228 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -4.0 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'L', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 20.31, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4495 | null | 177.33 | 102.69 | 553.7509106 | 0.0 | 106.2357284 | -10.38396106 | -2.718693374 | -49.19597155 | -57.51086548 | -48.75620396 | -56.75427693 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
f2a270dfb274a425f9f6212e48b367bbe35972a7758bcf672e0bff07f38e0ec9 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,495 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'meL', 'P', 'dL', 'F'] | 39 | 4496 | -6.34 | -6.34 | Circle | 4 | -2.04e-16 | -2.71822073 | -1.93e-16 | -2.85880215 | -3.83e-17 | -1.135756562 | 7.46e-16 | -0.249287767 | 2.995363505 | 4193.826765 | 138.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 765.4788974 | 0.727272727 | 1.272727273 | 1.872727273 | 0.682926829 | 136.0 | PEPTIDE4496{P.[dA].L.[meL].P.[dL].F}$PEPTIDE4496,PEPTIDE4496,1:R1-7:R2$$$ | PEPTIDE4496{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4496,PEPTIDE4496,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4496 | null | null | 1.12e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.67895549 | 0.342800051 | 16.67895549 | 0.245675543 | 1.779090538 | 0.245675543 | -7.189518026 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_919 | -6.34 | 3.308584281 | -0.576066595 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -6.34 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)N(C)C1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'meL', 'P', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4496 | null | 177.33 | 6.66 | 553.7509136 | 0.0 | 106.1505978 | -10.29883042 | -2.679142125 | -49.2617999 | -57.37730347 | -48.66999408 | -56.94777475 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
f99a201a296c514b3246e59d88cb421bb734c8109286966a00fe1e9889756272 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,496 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'Me_dL', 'P', 'L', 'F'] | 40 | 4497 | -6.41 | -6.41 | Circle | 2 | -1.6e-16 | -2.71822073 | -1.69e-16 | -2.85880215 | -4.13e-17 | -1.135756562 | 1.02e-15 | -0.249287767 | 2.995363505 | 4193.826765 | 138.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 765.4788974 | 0.727272727 | 1.272727273 | 1.872727273 | 0.682926829 | 138.0 | PEPTIDE4497{P.[dA].L.[Me_dL].P.L.F}$PEPTIDE4497,PEPTIDE4497,1:R1-7:R2$$$ | PEPTIDE4497{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4497,PEPTIDE4497,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4497 | null | null | 2.69e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.67895549 | 0.342800051 | 16.67895549 | 0.245675543 | 1.779090538 | 0.245675543 | -7.189518026 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_920 | -6.41 | 3.308584281 | -0.576066595 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -6.41 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'Me_dL', 'P', 'L', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4497 | null | 177.33 | 5.66 | 553.7509136 | 0.0 | 106.1505978 | -10.29883042 | -2.679142125 | -49.2617999 | -57.37730347 | -48.66999408 | -56.94777475 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
8e1fd2b703b4cd8f1afdb5f2e1f6dd5511e2ad0d32ed86bdef299d7eebf22103 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,497 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'L', 'P', 'meL', 'F'] | 38 | 4498 | -6.44 | -6.44 | Circle | 5 | -1.66e-16 | -2.707729398 | -1.77e-16 | -2.867758643 | -7.07e-17 | -1.135354896 | 8.92e-16 | -0.249287767 | 3.001926314 | 4193.826765 | 124.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 20.64354539 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.87857774 | 765.4788974 | 0.727272727 | 1.290909091 | 1.927272727 | 0.682926829 | 126.0 | PEPTIDE4498{P.[dA].L.L.P.[meL].F}$PEPTIDE4498,PEPTIDE4498,1:R1-7:R2$$$ | PEPTIDE4498{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4498,PEPTIDE4498,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4498 | null | null | 1.89e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.57926341 | 0.342800051 | 16.57926341 | 0.245675544 | 1.799654828 | 0.245675544 | -7.070537473 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_921 | -6.44 | 3.354277628 | -0.648005228 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -6.44 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'L', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 20.31, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4498 | null | 177.33 | 5.3 | 553.7509106 | 0.0 | 106.2357284 | -10.38396106 | -2.718693374 | -49.19597155 | -57.51086548 | -48.75620396 | -56.75427693 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
1270d51bd82845c2b0162f5c5e1e6a3e6f55e1e30ace3650b287fc675f1525e6 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,498 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'Me_dL', 'P', 'Me_dL', 'F'] | 45 | 4499 | -6.86 | -6.86 | Circle | 3 | -2.11e-16 | -2.719712142 | -1.95e-16 | -2.858627772 | -1.1e-16 | -1.135756817 | 8.43e-16 | -0.249287767 | 3.069052111 | 4301.733481 | 122.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 51.97841493 | 46.29543216 | 13.95379138 | 9.601973316 | 9.601973316 | 5.935689461 | 5.935689461 | 3.705184518 | 3.705184518 | null | null | null | null | 298.3540197 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.714285714 | 1.285714286 | 1.910714286 | 0.69047619 | 123.0 | PEPTIDE4499{P.[dA].[dL].[Me_dL].P.[Me_dL].F}$PEPTIDE4499,PEPTIDE4499,1:R1-7:R2$$$ | PEPTIDE4499{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4499,PEPTIDE4499,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4499 | null | null | 5.36e+37 | 9.201058546 | 19.58482586 | 10.8740383 | 423.8686541 | null | 16.8492361 | 0.342800051 | 16.8492361 | 0.245675544 | 1.817543247 | 0.245675544 | -7.288768664 | -0.342800051 | 2.4913 | 212.5631 | 780.024 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_922 | -6.86 | 3.217537921 | -0.494477593 | 35.52907898 | 42.12524728 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 101.8562259 | 16.44910267 | null | -6.86 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(C)C)N(C)C1=O | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.0718913 | 26.94537317 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'Me_dL', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 183.1242011 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4499 | null | 168.54 | 2.03 | 574.0492096 | 0.0 | 104.5329173 | -7.805164312 | -2.744005165 | -50.21660093 | -58.50241727 | -49.5111737 | -63.88609884 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.364593432 | null |
cd15dd2d1646ebb846a326e3e91c8db381c84c19ca0cd39a59d346e5df22502c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,499 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Me_dL', 'dL', 'P', 'Me_dL', 'F'] | 45 | 4500 | -5.82 | -5.82 | Circle | 4 | -2.1e-16 | -2.715032686 | -2.14e-16 | -2.857155078 | -1.09e-16 | -1.135675439 | 9.87e-16 | -0.249287767 | 3.063444165 | 4301.733481 | 109.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 51.97841493 | 46.29543216 | 13.95379138 | 9.601973316 | 9.601973316 | 5.935689461 | 5.935689461 | 3.705184518 | 3.705184518 | null | null | null | null | 298.3540197 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.714285714 | 1.232142857 | 1.803571429 | 0.69047619 | 105.0 | PEPTIDE4500{P.[dA].[Me_dL].[dL].P.[Me_dL].F}$PEPTIDE4500,PEPTIDE4500,1:R1-7:R2$$$ | PEPTIDE4500{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4500,PEPTIDE4500,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4500 | null | null | 3.52e+38 | 9.201058546 | 19.58482586 | 10.8740383 | 423.8686541 | null | 16.66523726 | 0.342792017 | 16.66523726 | 0.245675544 | 1.822050661 | 0.245675544 | -7.127735501 | -0.342792017 | 2.4913 | 212.5631 | 780.024 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_923 | -5.82 | 3.301345915 | -0.481389783 | 35.52907898 | 42.12524728 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 101.8562259 | 16.44910267 | null | -5.82 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C1=O | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.0718913 | 26.94537317 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Me_dL', 'dL', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 183.1242011 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4500 | null | 168.54 | 20.23 | 573.663012 | 0.0 | 104.7284217 | -8.00066877 | -2.751823305 | -50.15520499 | -58.53051144 | -49.41087073 | -63.62568784 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.364593432 | null |
5251de5cffc3d803f28fbf297d1ea1c888a4fa69f960ab3213d292a5239397c4 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,501 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'Me_dL', 'P', 'Me_dL', 'F'] | 44 | 4502 | -5.68 | -5.68 | Circle | 8 | -2.11e-16 | -2.719712142 | -1.95e-16 | -2.858627772 | -1.1e-16 | -1.135756817 | 8.43e-16 | -0.249287767 | 3.069052111 | 4301.733481 | 129.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 51.97841493 | 46.29543216 | 13.95379138 | 9.601973316 | 9.601973316 | 5.935689461 | 5.935689461 | 3.705184518 | 3.705184518 | null | null | null | null | 298.3540197 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.714285714 | 1.285714286 | 1.910714286 | 0.69047619 | 127.0 | PEPTIDE4502{P.[dA].L.[Me_dL].P.[Me_dL].F}$PEPTIDE4502,PEPTIDE4502,1:R1-7:R2$$$ | PEPTIDE4502{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4502,PEPTIDE4502,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4502 | null | null | 5.36e+37 | 9.201058546 | 19.58482586 | 10.8740383 | 423.8686541 | null | 16.8492361 | 0.342800051 | 16.8492361 | 0.245675544 | 1.817543247 | 0.245675544 | -7.288768664 | -0.342800051 | 2.4913 | 212.5631 | 780.024 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_925 | -5.68 | 3.217537921 | -0.494477593 | 35.52907898 | 42.12524728 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 101.8562259 | 16.44910267 | null | -5.68 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(C)C)N(C)C1=O | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.0718913 | 26.94537317 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'Me_dL', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 183.1242011 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4502 | null | 168.54 | 26.66 | 574.0492096 | 0.0 | 104.5329173 | -7.805164312 | -2.744005165 | -50.21660093 | -58.50241727 | -49.5111737 | -63.88609884 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.364593432 | null |
6639fda51a459f394ab4d50d62cb020ae67903a906bacfe220e69aab4207a9ad | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,502 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Me_dL', 'dL', 'P', 'meL', 'F'] | 43 | 4503 | -5.5 | -5.5 | Circle | 3 | -2.57e-16 | -2.715032686 | -1.8e-16 | -2.857155078 | -3.56e-17 | -1.135675439 | 7.52e-16 | -0.249287767 | 3.063444165 | 4301.733481 | 110.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 51.97841493 | 46.29543216 | 13.95379138 | 9.601973316 | 9.601973316 | 5.935689461 | 5.935689461 | 3.705184518 | 3.705184518 | null | null | null | null | 298.3540197 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.714285714 | 1.232142857 | 1.803571429 | 0.69047619 | 111.0 | PEPTIDE4503{P.[dA].[Me_dL].[dL].P.[meL].F}$PEPTIDE4503,PEPTIDE4503,1:R1-7:R2$$$ | PEPTIDE4503{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4503,PEPTIDE4503,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4503 | null | null | 3.24e+39 | 9.201058546 | 19.58482586 | 10.8740383 | 423.8686541 | null | 16.66523726 | 0.342792017 | 16.66523726 | 0.245675544 | 1.822050661 | 0.245675544 | -7.127735501 | -0.342792017 | 2.4913 | 212.5631 | 780.024 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_926 | -5.5 | 3.301345915 | -0.481389783 | 35.52907898 | 42.12524728 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 101.8562259 | 16.44910267 | null | -5.5 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@H]2C(=O)N1C | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.0718913 | 26.94537317 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Me_dL', 'dL', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 183.1242011 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4503 | null | 168.54 | 37.48 | 573.663012 | 0.0 | 104.7284217 | -8.00066877 | -2.751823305 | -50.15520499 | -58.53051144 | -49.41087073 | -63.62568784 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.364593432 | null |
0112c9cbcd8da3e05f53d29831c107052f77036a03ec3e46fa8eb000dc05702b | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,503 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'dL', 'P', 'Me_dL', 'F'] | 43 | 4504 | -5.68 | -5.68 | Circle | 9 | -2.49e-16 | -2.715032686 | -1.98e-16 | -2.857155078 | -1.3e-16 | -1.135675439 | 5.08e-16 | -0.249287767 | 3.063444165 | 4301.733481 | 116.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 51.97841493 | 46.29543216 | 13.95379138 | 9.601973316 | 9.601973316 | 5.935689461 | 5.935689461 | 3.705184518 | 3.705184518 | null | null | null | null | 298.3540197 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.714285714 | 1.232142857 | 1.803571429 | 0.69047619 | 114.0 | PEPTIDE4504{P.[dA].[meL].[dL].P.[Me_dL].F}$PEPTIDE4504,PEPTIDE4504,1:R1-7:R2$$$ | PEPTIDE4504{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4504,PEPTIDE4504,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4504 | null | null | 1.0999999999999999e+39 | 9.201058546 | 19.58482586 | 10.8740383 | 423.8686541 | null | 16.66523726 | 0.342792017 | 16.66523726 | 0.245675544 | 1.822050661 | 0.245675544 | -7.127735501 | -0.342792017 | 2.4913 | 212.5631 | 780.024 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_927 | -5.68 | 3.301345915 | -0.481389783 | 35.52907898 | 42.12524728 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 101.8562259 | 16.44910267 | null | -5.68 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N1C | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.0718913 | 26.94537317 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'dL', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 183.1242011 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4504 | null | 168.54 | 26.98 | 573.663012 | 0.0 | 104.7284217 | -8.00066877 | -2.751823305 | -50.15520499 | -58.53051144 | -49.41087073 | -63.62568784 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.364593432 | null |
05b0f2c0a53790cbe3d8213d0d4ea74fc3756a609a3e49739647b5d2e51f76ba | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,504 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'Bn_Gly', 'P', 'dL', 'F'] | 43 | 4505 | -6.44 | -6.44 | Circle | 8 | -9.8e-17 | -2.688123094 | -9.69e-17 | -2.858169854 | 1.26e-16 | -1.134689244 | 2.09e-15 | -0.249287762 | 2.482632664 | 4366.753295 | 146.0 | null | null | 93.011107 | 86.4882332 | 27.4882332 | 50.44251654 | 43.76903896 | 14.48018458 | 9.753366518 | 9.753366518 | 5.98380978 | 5.98380978 | 3.738445528 | 3.738445528 | null | null | null | null | 301.5929746 | 26.16766313 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 54.87142577 | 785.4475972 | 0.719298246 | 1.263157895 | 1.894736842 | 0.558139535 | 130.0 | PEPTIDE4505{P.[dA].[dL].[Bn_Gly].P.[dL].F}$PEPTIDE4505,PEPTIDE4505,1:R1-7:R2$$$ | PEPTIDE4505{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4505,PEPTIDE4505,1:R1-7:R2$$$ | -5.27 | 57 | 726.515 | 4505 | null | null | 8.679999999999999e+35 | 10.11388977 | 19.73595983 | 11.41466339 | 418.5192999 | null | 16.52234055 | 0.342800051 | 16.52234055 | 0.245675543 | 1.737377777 | 0.245675543 | -6.733819648 | -0.342800051 | 2.3048 | 213.7818 | 785.987 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 4 | 14 | 0 | 13 | 0 | 3 | 3 | 308 | hepta_928 | -6.44 | 4.307947499 | 0.824334608 | 35.93898261 | 42.60421449 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 73.84005342 | 27.41517112 | null | -6.44 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1NC(=O)[C@@H]2CCCN2C(=O)CN(Cc2ccccc2)C(=O)[C@@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 114.6008492 | 41.35025811 | 0.0 | 35.93898261 | 11.78791537 | 121.4741494 | 19.49057905 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'Bn_Gly', 'P', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.3173, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 111.6479212 | 46.43154487 | 11.78791537 | 159.0156336 | 60.42418708 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4505 | null | 177.33 | 5.23 | 521.0198523 | 0.0 | 106.1638475 | -9.800600101 | -5.254021273 | -41.39818588 | -59.31970419 | -40.90964515 | -50.83487658 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.317610476 | null |
a31608455c873a670da6a189ecb14e7e15d63472c563adee014a2cd316a86640 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,505 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'Me_dL', 'P', 'meL', 'F'] | 42 | 4506 | -5.99 | -5.99 | Circle | 5 | -2.11e-16 | -2.719712142 | -1.95e-16 | -2.858627772 | -1.1e-16 | -1.135756817 | 8.43e-16 | -0.249287767 | 3.069052111 | 4301.733481 | 132.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 51.97841493 | 46.29543216 | 13.95379138 | 9.601973316 | 9.601973316 | 5.935689461 | 5.935689461 | 3.705184518 | 3.705184518 | null | null | null | null | 298.3540197 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.714285714 | 1.285714286 | 1.910714286 | 0.69047619 | 131.0 | PEPTIDE4506{P.[dA].L.[Me_dL].P.[meL].F}$PEPTIDE4506,PEPTIDE4506,1:R1-7:R2$$$ | PEPTIDE4506{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4506,PEPTIDE4506,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4506 | null | null | 5.36e+37 | 9.201058546 | 19.58482586 | 10.8740383 | 423.8686541 | null | 16.8492361 | 0.342800051 | 16.8492361 | 0.245675544 | 1.817543247 | 0.245675544 | -7.288768664 | -0.342800051 | 2.4913 | 212.5631 | 780.024 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_929 | -5.99 | 3.217537921 | -0.494477593 | 35.52907898 | 42.12524728 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 101.8562259 | 16.44910267 | null | -5.99 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(C)C)N(C)C1=O | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.0718913 | 26.94537317 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'Me_dL', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 183.1242011 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4506 | null | 168.54 | 14.21 | 574.0492096 | 0.0 | 104.5329173 | -7.805164312 | -2.744005165 | -50.21660093 | -58.50241727 | -49.5111737 | -63.88609884 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.364593432 | null |
90c773e22ec3613300cdbf884b6d60bbeee6b2a1d1fb3e277bbef2955245e80a | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,506 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'meL', 'P', 'dL', 'F'] | 41 | 4507 | -5.95 | -5.95 | Circle | 7 | -2.21e-16 | -2.726662629 | -1.48e-16 | -2.85833211 | -4.93e-17 | -1.136011287 | 8.11e-16 | -0.249287767 | 3.060397376 | 4301.733481 | 111.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 51.97841493 | 46.29543216 | 13.95379138 | 9.601973316 | 9.601973316 | 5.935689461 | 5.935689461 | 3.705184518 | 3.705184518 | null | null | null | null | 298.3540197 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.714285714 | 1.232142857 | 1.803571429 | 0.69047619 | 114.0 | PEPTIDE4507{P.[dA].[meL].[meL].P.[dL].F}$PEPTIDE4507,PEPTIDE4507,1:R1-7:R2$$$ | PEPTIDE4507{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4507,PEPTIDE4507,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4507 | null | null | 2.19e+39 | 9.201058546 | 19.58482586 | 10.8740383 | 423.8686541 | null | 16.82337671 | 0.342792017 | 16.82337671 | 0.245675543 | 1.801486371 | 0.245675543 | -7.314943196 | -0.342792017 | 2.4913 | 212.5631 | 780.024 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_930 | -5.95 | 3.154566114 | -0.476829613 | 35.52907898 | 42.12524728 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 101.8562259 | 16.44910267 | null | -5.95 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1C(=O)N2CCC[C@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N1C | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.0718913 | 26.94537317 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'meL', 'P', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 183.1242011 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4507 | null | 168.54 | 15.37 | 573.8328126 | 0.0 | 104.5063076 | -7.778554666 | -2.712272056 | -50.22103334 | -58.39694943 | -49.32466084 | -63.98898323 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.364593432 | null |
0ced09c0223a9afa8e5150e033e8abc90fefba5b57b07eb312f4afbc9e558567 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,507 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'dL', 'P', 'meL', 'F'] | 41 | 4508 | -5.62 | -5.62 | Circle | 1 | -2.57e-16 | -2.715032686 | -1.8e-16 | -2.857155078 | -3.56e-17 | -1.135675439 | 7.52e-16 | -0.249287767 | 3.063444165 | 4301.733481 | 119.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 51.97841493 | 46.29543216 | 13.95379138 | 9.601973316 | 9.601973316 | 5.935689461 | 5.935689461 | 3.705184518 | 3.705184518 | null | null | null | null | 298.3540197 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.714285714 | 1.232142857 | 1.803571429 | 0.69047619 | 128.0 | PEPTIDE4508{P.[dA].[meL].[dL].P.[meL].F}$PEPTIDE4508,PEPTIDE4508,1:R1-7:R2$$$ | PEPTIDE4508{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4508,PEPTIDE4508,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4508 | null | null | 3.24e+39 | 9.201058546 | 19.58482586 | 10.8740383 | 423.8686541 | null | 16.66523726 | 0.342792017 | 16.66523726 | 0.245675544 | 1.822050661 | 0.245675544 | -7.127735501 | -0.342792017 | 2.4913 | 212.5631 | 780.024 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_931 | -5.62 | 3.301345915 | -0.481389783 | 35.52907898 | 42.12524728 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 101.8562259 | 16.44910267 | null | -5.62 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N2CCC[C@H]2C(=O)N1C | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.0718913 | 26.94537317 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'dL', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 183.1242011 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4508 | null | 168.54 | 30.34 | 573.663012 | 0.0 | 104.7284217 | -8.00066877 | -2.751823305 | -50.15520499 | -58.53051144 | -49.41087073 | -63.62568784 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.364593432 | null |
ffbe3b93024e45de9592a7e35acb76648b1a9caaba082026dd571a5cda932cce | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,508 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'L', 'P', 'Me_dL', 'F'] | 42 | 4509 | -5.82 | -5.82 | Circle | 9 | -2.1e-16 | -2.715032686 | -2.14e-16 | -2.857155078 | -1.09e-16 | -1.135675439 | 9.87e-16 | -0.249287767 | 3.063444165 | 4301.733481 | 131.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 51.97841493 | 46.29543216 | 13.95379138 | 9.601973316 | 9.601973316 | 5.935689461 | 5.935689461 | 3.705184518 | 3.705184518 | null | null | null | null | 298.3540197 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.714285714 | 1.232142857 | 1.803571429 | 0.69047619 | 131.0 | PEPTIDE4509{P.[dA].[meL].L.P.[Me_dL].F}$PEPTIDE4509,PEPTIDE4509,1:R1-7:R2$$$ | PEPTIDE4509{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4509,PEPTIDE4509,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4509 | null | null | 3.52e+38 | 9.201058546 | 19.58482586 | 10.8740383 | 423.8686541 | null | 16.66523726 | 0.342792017 | 16.66523726 | 0.245675544 | 1.822050661 | 0.245675544 | -7.127735501 | -0.342792017 | 2.4913 | 212.5631 | 780.024 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_932 | -5.82 | 3.301345915 | -0.481389783 | 35.52907898 | 42.12524728 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 101.8562259 | 16.44910267 | null | -5.82 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C1=O | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.0718913 | 26.94537317 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'L', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 183.1242011 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4509 | null | 168.54 | 20.37 | 573.663012 | 0.0 | 104.7284217 | -8.00066877 | -2.751823305 | -50.15520499 | -58.53051144 | -49.41087073 | -63.62568784 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.364593432 | null |
16e49e4502089ca1fc09fab819c7e5f876754a4ed44ca941a0673edc96d6c99d | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,509 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Me_dL', 'L', 'P', 'meL', 'F'] | 42 | 4510 | -5.63 | -5.63 | Circle | 3 | -2.1e-16 | -2.715032686 | -2.14e-16 | -2.857155078 | -1.09e-16 | -1.135675439 | 9.87e-16 | -0.249287767 | 3.063444165 | 4301.733481 | 137.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 51.97841493 | 46.29543216 | 13.95379138 | 9.601973316 | 9.601973316 | 5.935689461 | 5.935689461 | 3.705184518 | 3.705184518 | null | null | null | null | 298.3540197 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.714285714 | 1.232142857 | 1.803571429 | 0.69047619 | 141.0 | PEPTIDE4510{P.[dA].[Me_dL].L.P.[meL].F}$PEPTIDE4510,PEPTIDE4510,1:R1-7:R2$$$ | PEPTIDE4510{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4510,PEPTIDE4510,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4510 | null | null | 3.52e+38 | 9.201058546 | 19.58482586 | 10.8740383 | 423.8686541 | null | 16.66523726 | 0.342792017 | 16.66523726 | 0.245675544 | 1.822050661 | 0.245675544 | -7.127735501 | -0.342792017 | 2.4913 | 212.5631 | 780.024 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_933 | -5.63 | 3.301345915 | -0.481389783 | 35.52907898 | 42.12524728 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 101.8562259 | 16.44910267 | null | -5.63 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C1=O | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.0718913 | 26.94537317 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Me_dL', 'L', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 183.1242011 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4510 | null | 168.54 | 29.82 | 573.663012 | 0.0 | 104.7284217 | -8.00066877 | -2.751823305 | -50.15520499 | -58.53051144 | -49.41087073 | -63.62568784 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.364593432 | null |
79e7b6a2e7ba7a172e65de4e49509464f0d86b63bf2f5cbd0a3fc80c09c6dc39 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,510 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'Me_dL', 'P', 'L', 'F'] | 42 | 4511 | -5.86 | -5.86 | Circle | 2 | -2.33e-16 | -2.726662629 | -2.25e-16 | -2.85833211 | -9.47e-17 | -1.136011287 | 7.05e-16 | -0.249287767 | 3.060397376 | 4301.733481 | 121.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 51.97841493 | 46.29543216 | 13.95379138 | 9.601973316 | 9.601973316 | 5.935689461 | 5.935689461 | 3.705184518 | 3.705184518 | null | null | null | null | 298.3540197 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.714285714 | 1.232142857 | 1.803571429 | 0.69047619 | 118.0 | PEPTIDE4511{P.[dA].[meL].[Me_dL].P.L.F}$PEPTIDE4511,PEPTIDE4511,1:R1-7:R2$$$ | PEPTIDE4511{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4511,PEPTIDE4511,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4511 | null | null | 1.81e+39 | 9.201058546 | 19.58482586 | 10.8740383 | 423.8686541 | null | 16.82337671 | 0.342792017 | 16.82337671 | 0.245675543 | 1.801486371 | 0.245675543 | -7.314943196 | -0.342792017 | 2.4913 | 212.5631 | 780.024 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_934 | -5.86 | 3.154566114 | -0.476829613 | 35.52907898 | 42.12524728 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 101.8562259 | 16.44910267 | null | -5.86 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.0718913 | 26.94537317 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'Me_dL', 'P', 'L', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 183.1242011 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4511 | null | 168.54 | 18.83 | 573.8328126 | 0.0 | 104.5063076 | -7.778554666 | -2.712272056 | -50.22103334 | -58.39694943 | -49.32466084 | -63.98898323 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.364593432 | null |
acf397d5f996c180fbcd0ee222fcc854a8acea8daea0a80f4dc52d155fe87473 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,513 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'L', 'P', 'Bn_Gly', 'F'] | 42 | 4514 | -6.48 | -6.48 | Circle | 5 | -1.13e-16 | -2.703054431 | -6.8e-17 | -2.867589944 | 1.36e-16 | -1.135354302 | 2.72e-15 | -0.249287767 | 2.494063672 | 4366.753295 | 132.0 | null | null | 93.011107 | 86.4882332 | 27.4882332 | 50.44251654 | 43.76903896 | 14.48018458 | 9.753366518 | 9.753366518 | 5.98380978 | 5.98380978 | 3.766396377 | 3.766396377 | null | null | null | null | 301.5929746 | 22.01430394 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 59.02478496 | 785.4475972 | 0.719298246 | 1.280701754 | 1.912280702 | 0.558139535 | 129.0 | PEPTIDE4514{P.[dA].[dL].L.P.[Bn_Gly].F}$PEPTIDE4514,PEPTIDE4514,1:R1-7:R2$$$ | PEPTIDE4514{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4514,PEPTIDE4514,1:R1-7:R2$$$ | -5.27 | 57 | 726.515 | 4514 | null | null | 1.01e+37 | 10.11388977 | 19.73595983 | 11.41466339 | 418.5192999 | null | 16.59489393 | 0.342800051 | 16.59489393 | 0.245675342 | 1.703313549 | 0.245675342 | -6.877867805 | -0.342800051 | 2.3048 | 213.7818 | 785.987 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 4 | 14 | 0 | 13 | 0 | 3 | 3 | 308 | hepta_937 | -6.48 | 4.174119831 | 0.875103624 | 35.93898261 | 36.10735481 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 73.84005342 | 33.91203081 | null | -6.48 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CN(Cc2ccccc2)C(=O)[C@@H]2CCCN2C1=O | 114.6008492 | 41.35025811 | 0.0 | 35.93898261 | 11.78791537 | 121.4741494 | 19.49057905 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'L', 'P', 'Bn_Gly', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 20.31, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 111.6479212 | 46.43154487 | 11.78791537 | 159.0156336 | 60.42418708 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4514 | null | 177.33 | 4.85 | 520.9942245 | 0.0 | 106.2079785 | -9.844731076 | -5.132233789 | -41.51506148 | -59.06981325 | -41.07908185 | -50.89461489 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.317610476 | null |
6f7de50c72582740420540e4503268f33a61f9c7d3ce2a8666f7ef211e79f0be | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,514 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'Bn_Gly', 'P', 'dL', 'F'] | 42 | 4515 | -6.12 | -6.12 | Circle | 5 | -1.07e-16 | -2.688123094 | -9.46e-17 | -2.858169854 | 9.76e-17 | -1.134689244 | 3.09e-15 | -0.249287762 | 2.482632664 | 4366.753295 | 119.0 | null | null | 93.011107 | 86.4882332 | 27.4882332 | 50.44251654 | 43.76903896 | 14.48018458 | 9.753366518 | 9.753366518 | 5.98380978 | 5.98380978 | 3.738445528 | 3.738445528 | null | null | null | null | 301.5929746 | 26.16766313 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 54.87142577 | 785.4475972 | 0.719298246 | 1.263157895 | 1.894736842 | 0.558139535 | 119.0 | PEPTIDE4515{P.[dA].L.[Bn_Gly].P.[dL].F}$PEPTIDE4515,PEPTIDE4515,1:R1-7:R2$$$ | PEPTIDE4515{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4515,PEPTIDE4515,1:R1-7:R2$$$ | -5.27 | 57 | 726.515 | 4515 | null | null | 1.43e+37 | 10.11388977 | 19.73595983 | 11.41466339 | 418.5192999 | null | 16.52234055 | 0.342800051 | 16.52234055 | 0.245675543 | 1.737377777 | 0.245675543 | -6.733819648 | -0.342800051 | 2.3048 | 213.7818 | 785.987 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 4 | 14 | 0 | 13 | 0 | 3 | 3 | 308 | hepta_938 | -6.12 | 4.307947499 | 0.824334608 | 35.93898261 | 42.60421449 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 73.84005342 | 27.41517112 | null | -6.12 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H]2CCCN2C(=O)CN(Cc2ccccc2)C1=O | 114.6008492 | 41.35025811 | 0.0 | 35.93898261 | 11.78791537 | 121.4741494 | 19.49057905 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'Bn_Gly', 'P', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.3173, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 111.6479212 | 46.43154487 | 11.78791537 | 159.0156336 | 60.42418708 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4515 | null | 177.33 | 10.69 | 521.0198523 | 0.0 | 106.1638475 | -9.800600101 | -5.254021273 | -41.39818588 | -59.31970419 | -40.90964515 | -50.83487658 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.317610476 | null |
68190b8c6bf5aab03c3309fdaa1c5043617c17cf7a67d51eaef42a7fe73c4ffb | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,515 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'dL', 'P', 'Bn_Gly', 'F'] | 42 | 4516 | -7.3 | -7.3 | Circle | 1 | -1.13e-16 | -2.703054431 | -3.91e-17 | -2.867589944 | 3.22e-17 | -1.135354302 | 2.03e-15 | -0.249287767 | 2.494063672 | 4366.753295 | 163.0 | null | null | 93.011107 | 86.4882332 | 27.4882332 | 50.44251654 | 43.76903896 | 14.48018458 | 9.753366518 | 9.753366518 | 5.98380978 | 5.98380978 | 3.766396377 | 3.766396377 | null | null | null | null | 301.5929746 | 22.01430394 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 59.02478496 | 785.4475972 | 0.719298246 | 1.280701754 | 1.912280702 | 0.558139535 | 164.0 | PEPTIDE4516{P.[dA].L.[dL].P.[Bn_Gly].F}$PEPTIDE4516,PEPTIDE4516,1:R1-7:R2$$$ | PEPTIDE4516{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4516,PEPTIDE4516,1:R1-7:R2$$$ | -5.27 | 57 | 726.515 | 4516 | null | null | 1.36e+37 | 10.11388977 | 19.73595983 | 11.41466339 | 418.5192999 | null | 16.59489393 | 0.342800051 | 16.59489393 | 0.245675342 | 1.703313549 | 0.245675342 | -6.877867805 | -0.342800051 | 2.3048 | 213.7818 | 785.987 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 4 | 14 | 0 | 13 | 0 | 3 | 3 | 308 | hepta_939 | -7.3 | 4.174119831 | 0.875103624 | 35.93898261 | 36.10735481 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 73.84005342 | 33.91203081 | null | -7.3 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CN(Cc2ccccc2)C(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(C)C)NC1=O | 114.6008492 | 41.35025811 | 0.0 | 35.93898261 | 11.78791537 | 121.4741494 | 19.49057905 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'dL', 'P', 'Bn_Gly', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 20.31, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 111.6479212 | 46.43154487 | 11.78791537 | 159.0156336 | 60.42418708 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4516 | null | 177.33 | 0.74 | 520.9942245 | 0.0 | 106.2079785 | -9.844731076 | -5.132233789 | -41.51506148 | -59.06981325 | -41.07908185 | -50.89461489 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.317610476 | null |
2f8002615451dc8fd095e46be6d77025b4dc7f590bc1afa196c083f53f3c4ee5 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,516 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'meL', 'P', 'meL', 'F'] | 40 | 4517 | -5.83 | -5.83 | Circle | 6 | -2.11e-16 | -2.719712142 | -1.95e-16 | -2.858627772 | -1.1e-16 | -1.135756817 | 8.43e-16 | -0.249287767 | 3.069052111 | 4301.733481 | 121.0 | null | null | 98.04700538 | 91.9882332 | 26.9882332 | 51.97841493 | 46.29543216 | 13.95379138 | 9.601973316 | 9.601973316 | 5.935689461 | 5.935689461 | 3.705184518 | 3.705184518 | null | null | null | null | 298.3540197 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.83749422 | 779.4945474 | 0.714285714 | 1.285714286 | 1.910714286 | 0.69047619 | 119.0 | PEPTIDE4517{P.[dA].L.[meL].P.[meL].F}$PEPTIDE4517,PEPTIDE4517,1:R1-7:R2$$$ | PEPTIDE4517{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4517,PEPTIDE4517,1:R1-7:R2$$$ | -4.49 | 56 | 714.504 | 4517 | null | null | 5.36e+37 | 9.201058546 | 19.58482586 | 10.8740383 | 423.8686541 | null | 16.8492361 | 0.342800051 | 16.8492361 | 0.245675544 | 1.817543247 | 0.245675544 | -7.288768664 | -0.342800051 | 2.4913 | 212.5631 | 780.024 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 3 | 14 | 0 | 17 | 0 | 3 | 3 | 310 | hepta_940 | -5.83 | 3.217537921 | -0.494477593 | 35.52907898 | 42.12524728 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 101.8562259 | 16.44910267 | null | -5.83 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)N(C)C1=O | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 17.68187306 | 141.0718913 | 26.94537317 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'meL', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 39.93468519 | 17.68187306 | 183.1242011 | 30.21209354 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4517 | null | 168.54 | 20.03 | 574.0492096 | 0.0 | 104.5329173 | -7.805164312 | -2.744005165 | -50.21660093 | -58.50241727 | -49.5111737 | -63.88609884 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.364593432 | null |
7d94d50f49b88fabddc234e46c185e185148a097ac92b5e91a2c1324593aa43b | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,518 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Me_dL', 'Me_dL', 'P', 'Me_dL', 'F'] | 48 | 4519 | -5.65 | -5.65 | Circle | 9 | -3.01e-16 | -2.727406547 | -2.7e-16 | -2.84907677 | -1.14e-16 | -1.136011557 | 5.98e-16 | -0.249287767 | 3.132056386 | 4410.008052 | 115.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.18973979 | 47.57182536 | 14.17739817 | 9.825580114 | 9.825580114 | 6.149038106 | 6.149038106 | 3.833907991 | 3.833907991 | null | null | null | null | 304.9199429 | 24.71473753 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.20825277 | 793.5101975 | 0.701754386 | 1.228070175 | 1.807017544 | 0.697674419 | 115.0 | PEPTIDE4519{P.[dA].[Me_dL].[Me_dL].P.[Me_dL].F}$PEPTIDE4519,PEPTIDE4519,1:R1-7:R2$$$ | PEPTIDE4519{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4519,PEPTIDE4519,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4519 | null | null | 6.189999999999999e+40 | 9.28286508 | 19.77991863 | 10.92394938 | 433.1954521 | null | 16.98190393 | 0.342792017 | 16.98190393 | 0.245675544 | 1.83993908 | 0.245675544 | -7.414193834 | -0.342792017 | 2.8335 | 217.1904 | 794.051 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_942 | -5.65 | 3.124112193 | -0.343557032 | 35.11917536 | 42.12524728 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 112.9443284 | 16.44910267 | null | -5.65 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(C)[C@H](CC(C)C)C(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@H]2C(=O)N1C | 125.4847506 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.0718913 | 33.92120007 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Me_dL', 'Me_dL', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 187.2364768 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4519 | null | 159.75 | 28.54 | 594.2121613 | 0.0 | 102.8256106 | -5.221872027 | -2.777135096 | -51.17583437 | -59.52206324 | -50.16584047 | -71.00836008 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.409836501 | null |
e98183f757117abc0f2a3cd9a205e0e38bfd140a1b068976cc140d531c9ddfaa | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,519 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'Me_dL', 'P', 'Me_dL', 'F'] | 46 | 4520 | -5.68 | -5.68 | Circle | 9 | -2.82e-16 | -2.727406547 | -1.79e-16 | -2.84907677 | -1.01e-16 | -1.136011557 | 8.02e-16 | -0.249287767 | 3.132056386 | 4410.008052 | 121.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.18973979 | 47.57182536 | 14.17739817 | 9.825580114 | 9.825580114 | 6.149038106 | 6.149038106 | 3.833907991 | 3.833907991 | null | null | null | null | 304.9199429 | 24.71473753 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.20825277 | 793.5101975 | 0.701754386 | 1.228070175 | 1.807017544 | 0.697674419 | 120.0 | PEPTIDE4520{P.[dA].[meL].[Me_dL].P.[Me_dL].F}$PEPTIDE4520,PEPTIDE4520,1:R1-7:R2$$$ | PEPTIDE4520{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4520,PEPTIDE4520,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4520 | null | null | 2.02e+41 | 9.28286508 | 19.77991863 | 10.92394938 | 433.1954521 | null | 16.98190393 | 0.342792017 | 16.98190393 | 0.245675544 | 1.83993908 | 0.245675544 | -7.414193834 | -0.342792017 | 2.8335 | 217.1904 | 794.051 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_943 | -5.68 | 3.124112193 | -0.343557032 | 35.11917536 | 42.12524728 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 112.9443284 | 16.44910267 | null | -5.68 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1C(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N1C | 125.4847506 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.0718913 | 33.92120007 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'Me_dL', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 187.2364768 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4520 | null | 159.75 | 26.76 | 594.2121613 | 0.0 | 102.8256106 | -5.221872027 | -2.777135096 | -51.17583437 | -59.52206324 | -50.16584047 | -71.00836008 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.409836501 | null |
47d1c4c15a75f62b772212e3d5fab3b7ecb6055dd9ea03ccd3f6a6a8cd28ea23 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,520 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'bHph', 'P', 'dL', 'F'] | 41 | 4521 | -6.53 | -6.53 | Circle | 6 | -1.34e-16 | -2.69315921 | -4.38e-17 | -2.872746948 | 3.04e-20 | -1.134686225 | 2.27e-15 | -0.249287762 | 2.481681641 | 4484.8343 | 149.0 | null | null | 95.511107 | 88.9882332 | 27.9882332 | 51.73119168 | 44.99264576 | 14.75657778 | 9.90475972 | 9.90475972 | 6.031750325 | 6.031750325 | 3.769438423 | 3.769438423 | null | null | null | null | 307.7729011 | 27.53842169 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 56.28326785 | 799.4632473 | 0.689655172 | 1.189655172 | 1.775862069 | 0.568181818 | 150.0 | PEPTIDE4521{P.[dA].[dL].[bHph].P.[dL].F}$PEPTIDE4521,PEPTIDE4521,1:R1-7:R2$$$ | PEPTIDE4521{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4521,PEPTIDE4521,1:R1-7:R2$$$ | -5.27 | 58 | 738.526 | 4521 | null | null | 8.259999999999999e+36 | 10.18048434 | 20.42689225 | 11.88795643 | 427.5422682 | null | 16.39519303 | 0.350730365 | 16.39519303 | 0.245675543 | 1.757423584 | 0.245675543 | -6.725264962 | -0.350730365 | 2.3936 | 218.6165 | 800.014 | Circle | 7 | 7 | null | 5 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 5 | 14 | 0 | 13 | 0 | 3 | 3 | 314 | hepta_944 | -6.53 | 3.652646703 | 0.745902716 | 36.34888623 | 36.10735481 | 7.059210392 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 85.21704533 | 23.30289545 | null | -6.53 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1NC(=O)[C@@H]2CCCN2C(=O)C[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 117.3834498 | 41.35025811 | 0.0 | 36.34888623 | 11.78791537 | 133.741032 | 12.99371937 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'bHph', 'P', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.4060999999999997, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 29.1, 29.1] | 26.54906677 | 0.0 | 0.0 | 0.0 | 106.2690442 | 46.30761009 | 11.78791537 | 166.759317 | 60.42418708 | 7.059210392 | 0.0 | 0 | 2020_Townsend | 4521 | null | 186.12 | 4.28 | 539.9771764 | 0.0 | 108.1488795 | -12.3338561 | -5.303531958 | -41.48381294 | -66.07100669 | -53.35762057 | -38.65956095 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 2 | 5 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.271530341 | null |
9be1ee4156b386a5017629f6f0da8e3e6edca48fd4232611405a5663f7000182 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,521 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'Me_dL', 'P', 'Bn_Gly', 'F'] | 46 | 4522 | -6.63 | -6.63 | Circle | 8 | -1.71e-16 | -2.717873371 | -6.61e-17 | -2.858593892 | 8.41e-17 | -1.135754689 | 2.46e-15 | -0.249287767 | 2.551905879 | 4475.324525 | 131.0 | null | null | 95.511107 | 88.9882332 | 27.9882332 | 51.65384141 | 45.04543216 | 14.70379138 | 9.976973316 | 9.976973316 | 6.197158425 | 6.197158425 | 3.89511985 | 3.89511985 | null | null | null | null | 308.1588979 | 30.23885528 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 53.50066721 | 799.4632473 | 0.75862069 | 1.379310345 | 2.017241379 | 0.568181818 | 125.0 | PEPTIDE4522{P.[dA].[dL].[Me_dL].P.[Bn_Gly].F}$PEPTIDE4522,PEPTIDE4522,1:R1-7:R2$$$ | PEPTIDE4522{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4522,PEPTIDE4522,1:R1-7:R2$$$ | -5.27 | 58 | 738.526 | 4522 | null | null | 7.15e+36 | 10.18048434 | 19.93008749 | 11.01358637 | 427.8460979 | null | 16.85755955 | 0.342800051 | 16.85755955 | 0.245675342 | 1.721201968 | 0.245675342 | -7.164326138 | -0.342800051 | 2.647 | 218.4091 | 800.014 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 14 | 0 | 3 | 3 | 314 | hepta_945 | -6.63 | 4.108951705 | 1.01934479 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 84.92815599 | 33.91203081 | null | -6.63 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CN(Cc2ccccc2)C(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(C)C)N(C)C1=O | 117.3012828 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.4741494 | 26.46640595 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'Me_dL', 'P', 'Bn_Gly', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 163.1279092 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4522 | null | 168.54 | 3.48 | 541.2397429 | 0.0 | 104.5954062 | -7.356173194 | -5.202690209 | -42.4885576 | -60.16715768 | -41.77857639 | -57.92532743 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.369231058 | null |
9e88cdde92dde925ae6571775143c96be693a115a83299b8462ceaee1265de07 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,522 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'Bn_Gly', 'P', 'Me_dL', 'F'] | 46 | 4523 | -6.6 | -6.6 | Circle | 2 | -1.2e-16 | -2.700490644 | -8.34e-17 | -2.852676715 | 3.97e-18 | -1.13499315 | 2.42e-15 | -0.249287762 | 2.542605656 | 4475.324525 | 127.0 | null | null | 95.511107 | 88.9882332 | 27.9882332 | 51.65384141 | 45.04543216 | 14.70379138 | 9.976973316 | 9.976973316 | 6.197158425 | 6.197158425 | 3.867169 | 3.867169 | null | null | null | null | 308.1588979 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.98370144 | 799.4632473 | 0.75862069 | 1.379310345 | 2.034482759 | 0.568181818 | 126.0 | PEPTIDE4523{P.[dA].[dL].[Bn_Gly].P.[Me_dL].F}$PEPTIDE4523,PEPTIDE4523,1:R1-7:R2$$$ | PEPTIDE4523{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4523,PEPTIDE4523,1:R1-7:R2$$$ | -5.27 | 58 | 738.526 | 4523 | null | null | 6.86e+38 | 10.18048434 | 19.93008749 | 11.01358637 | 427.8460979 | null | 16.60942733 | 0.342800051 | 16.60942733 | 0.245675544 | 1.775830486 | 0.245675544 | -6.976692845 | -0.342800051 | 2.647 | 218.4091 | 800.014 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 14 | 0 | 3 | 3 | 314 | hepta_946 | -6.6 | 4.290899375 | 0.867350954 | 35.52907898 | 42.60421449 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 84.92815599 | 27.41517112 | null | -6.6 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)CN(Cc2ccccc2)C1=O | 117.3012828 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.4741494 | 26.46640595 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'Bn_Gly', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 163.1279092 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4523 | null | 168.54 | 3.71 | 541.1177916 | 0.0 | 104.6968247 | -7.45759161 | -5.364028941 | -42.28678321 | -60.51756369 | -41.67052963 | -57.60145256 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.369231058 | null |
1c9fcd5515904ecdf80bf958c7d4fb28f0cbdd35196a299635ed7bb2459ac2dc | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,523 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Bn_Gly', 'dL', 'P', 'Me_dL', 'F'] | 46 | 4524 | -5.61 | -5.61 | Circle | 4 | -1.45e-16 | -2.703144647 | -1.39e-16 | -2.849419993 | 3.61e-17 | -1.134960479 | 2.94e-15 | -0.249287762 | 2.542360694 | 4475.324525 | 135.0 | null | null | 95.511107 | 88.9882332 | 27.9882332 | 51.65384141 | 45.04543216 | 14.70379138 | 9.976973316 | 9.976973316 | 6.197158425 | 6.197158425 | 3.89511985 | 3.89511985 | null | null | null | null | 308.1588979 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.98370144 | 799.4632473 | 0.75862069 | 1.362068966 | 2.0 | 0.568181818 | 130.0 | PEPTIDE4524{P.[dA].[Bn_Gly].[dL].P.[Me_dL].F}$PEPTIDE4524,PEPTIDE4524,1:R1-7:R2$$$ | PEPTIDE4524{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4524,PEPTIDE4524,1:R1-7:R2$$$ | -5.27 | 58 | 738.526 | 4524 | null | null | 7.45e+37 | 10.18048434 | 19.93008749 | 11.01358637 | 427.8460979 | null | 16.58351126 | 0.34279177 | 16.58351126 | 0.245675544 | 1.724720158 | 0.245675544 | -7.018452118 | -0.34279177 | 2.647 | 218.4091 | 800.014 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 14 | 0 | 3 | 3 | 314 | hepta_947 | -5.61 | 4.361330876 | 1.008530072 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 84.92815599 | 33.91203081 | null | -5.61 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1NC(=O)CN(Cc2ccccc2)C(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C1=O | 117.3012828 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.4741494 | 26.46640595 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Bn_Gly', 'dL', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.3173, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 163.1279092 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4524 | null | 168.54 | 30.69 | 540.9662855 | 0.0 | 104.705161 | -7.46592796 | -5.266996485 | -42.32401408 | -60.37647997 | -41.88524436 | -57.43611696 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.369231058 | null |
b4ee5edac9b21b3977673ae1dc1561ec87097cf8d8377c9e4538083ae0c4f0d0 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,524 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Me_dL', 'meL', 'P', 'meL', 'F'] | 44 | 4525 | -5.75 | -5.75 | Circle | 9 | -3.01e-16 | -2.727406547 | -2.7e-16 | -2.84907677 | -1.14e-16 | -1.136011557 | 5.98e-16 | -0.249287767 | 3.132056386 | 4410.008052 | 97.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.18973979 | 47.57182536 | 14.17739817 | 9.825580114 | 9.825580114 | 6.149038106 | 6.149038106 | 3.833907991 | 3.833907991 | null | null | null | null | 304.9199429 | 24.71473753 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.20825277 | 793.5101975 | 0.701754386 | 1.228070175 | 1.807017544 | 0.697674419 | 95.0 | PEPTIDE4525{P.[dA].[Me_dL].[meL].P.[meL].F}$PEPTIDE4525,PEPTIDE4525,1:R1-7:R2$$$ | PEPTIDE4525{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4525,PEPTIDE4525,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4525 | null | null | 6.189999999999999e+40 | 9.28286508 | 19.77991863 | 10.92394938 | 433.1954521 | null | 16.98190393 | 0.342792017 | 16.98190393 | 0.245675544 | 1.83993908 | 0.245675544 | -7.414193834 | -0.342792017 | 2.8335 | 217.1904 | 794.051 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_948 | -5.75 | 3.124112193 | -0.343557032 | 35.11917536 | 42.12524728 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 112.9443284 | 16.44910267 | null | -5.75 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(C)[C@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N2CCC[C@H]2C(=O)N1C | 125.4847506 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.0718913 | 33.92120007 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Me_dL', 'meL', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 187.2364768 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4525 | null | 159.75 | 23.45 | 594.2121613 | 0.0 | 102.8256106 | -5.221872027 | -2.777135096 | -51.17583437 | -59.52206324 | -50.16584047 | -71.00836008 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.409836501 | null |
d0ed8f153c1d176fdd48405a25e638d7ff13e6955c8cc2cdf809bb3ff84e4108 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,525 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'meL', 'P', 'Me_dL', 'F'] | 44 | 4526 | -5.5 | -5.5 | Circle | 4 | -2.39e-16 | -2.727406547 | -2.25e-16 | -2.84907677 | -5.31e-17 | -1.136011557 | 7.85e-16 | -0.249287767 | 3.132056386 | 4410.008052 | 102.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.18973979 | 47.57182536 | 14.17739817 | 9.825580114 | 9.825580114 | 6.149038106 | 6.149038106 | 3.833907991 | 3.833907991 | null | null | null | null | 304.9199429 | 24.71473753 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.20825277 | 793.5101975 | 0.701754386 | 1.228070175 | 1.807017544 | 0.697674419 | 105.0 | PEPTIDE4526{P.[dA].[meL].[meL].P.[Me_dL].F}$PEPTIDE4526,PEPTIDE4526,1:R1-7:R2$$$ | PEPTIDE4526{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4526,PEPTIDE4526,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4526 | null | null | 1.45e+41 | 9.28286508 | 19.77991863 | 10.92394938 | 433.1954521 | null | 16.98190393 | 0.342792017 | 16.98190393 | 0.245675544 | 1.83993908 | 0.245675544 | -7.414193834 | -0.342792017 | 2.8335 | 217.1904 | 794.051 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_949 | -5.5 | 3.124112193 | -0.343557032 | 35.11917536 | 42.12524728 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 112.9443284 | 16.44910267 | null | -5.5 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1C(=O)N2CCC[C@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N1C | 125.4847506 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.0718913 | 33.92120007 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'meL', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 187.2364768 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4526 | null | 159.75 | 37.67 | 594.2121613 | 0.0 | 102.8256106 | -5.221872027 | -2.777135096 | -51.17583437 | -59.52206324 | -50.16584047 | -71.00836008 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.409836501 | null |
f93f82a02b963cd0ca61598145ad6ab3c4248b4d549ea311d06f3c40517cd97c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,526 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'Me_dL', 'P', 'meL', 'F'] | 44 | 4527 | -5.2 | -5.2 | Circle | 9 | -3.01e-16 | -2.727406547 | -2.7e-16 | -2.84907677 | -1.14e-16 | -1.136011557 | 5.98e-16 | -0.249287767 | 3.132056386 | 4410.008052 | 113.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.18973979 | 47.57182536 | 14.17739817 | 9.825580114 | 9.825580114 | 6.149038106 | 6.149038106 | 3.833907991 | 3.833907991 | null | null | null | null | 304.9199429 | 24.71473753 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.20825277 | 793.5101975 | 0.701754386 | 1.228070175 | 1.807017544 | 0.697674419 | 111.0 | PEPTIDE4527{P.[dA].[meL].[Me_dL].P.[meL].F}$PEPTIDE4527,PEPTIDE4527,1:R1-7:R2$$$ | PEPTIDE4527{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4527,PEPTIDE4527,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4527 | null | null | 6.189999999999999e+40 | 9.28286508 | 19.77991863 | 10.92394938 | 433.1954521 | null | 16.98190393 | 0.342792017 | 16.98190393 | 0.245675544 | 1.83993908 | 0.245675544 | -7.414193834 | -0.342792017 | 2.8335 | 217.1904 | 794.051 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_950 | -5.2 | 3.124112193 | -0.343557032 | 35.11917536 | 42.12524728 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 112.9443284 | 16.44910267 | null | -5.2 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@H]2C(=O)N1C | 125.4847506 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.0718913 | 33.92120007 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'Me_dL', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 187.2364768 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4527 | null | 159.75 | 61.51 | 594.2121613 | 0.0 | 102.8256106 | -5.221872027 | -2.777135096 | -51.17583437 | -59.52206324 | -50.16584047 | -71.00836008 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.409836501 | null |
2188a2d4c05d87e992aee07c0ab5a4bae69252cb067da662d79c438076828381 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,527 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'Bn_Gly', 'P', 'dL', 'F'] | 44 | 4528 | -6.32 | -6.32 | Circle | 3 | -1.78e-16 | -2.704514461 | -8.89e-17 | -2.857163422 | 4.26e-19 | -1.13499543 | 2.27e-15 | -0.249287762 | 2.537877019 | 4475.324525 | 114.0 | null | null | 95.511107 | 88.9882332 | 27.9882332 | 51.65384141 | 45.04543216 | 14.70379138 | 9.976973316 | 9.976973316 | 6.197158425 | 6.197158425 | 3.867169 | 3.867169 | null | null | null | null | 308.1588979 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.98370144 | 799.4632473 | 0.75862069 | 1.344827586 | 1.982758621 | 0.568181818 | 117.0 | PEPTIDE4528{P.[dA].[meL].[Bn_Gly].P.[dL].F}$PEPTIDE4528,PEPTIDE4528,1:R1-7:R2$$$ | PEPTIDE4528{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4528,PEPTIDE4528,1:R1-7:R2$$$ | -5.27 | 58 | 738.526 | 4528 | null | null | 7.060000000000001e+38 | 10.18048434 | 19.93008749 | 11.01358637 | 427.8460979 | null | 16.83900722 | 0.342792017 | 16.83900722 | 0.245675543 | 1.759773611 | 0.245675543 | -7.020277981 | -0.342792017 | 2.647 | 218.4091 | 800.014 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 14 | 0 | 3 | 3 | 314 | hepta_951 | -6.32 | 4.147007032 | 0.870075144 | 35.52907898 | 42.60421449 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 84.92815599 | 27.41517112 | null | -6.32 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N1C | 117.3012828 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.4741494 | 26.46640595 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'Bn_Gly', 'P', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.3173, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 163.1279092 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4528 | null | 168.54 | 6.9 | 540.9978751 | 0.0 | 104.6910992 | -7.45186611 | -5.366870592 | -42.27712418 | -60.4962031 | -41.46506128 | -57.71518233 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.369231058 | null |
2471b1829eb452df654127d0de8a9a77e25831980c2bc72651d72c07b3230e1b | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,528 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'Me_dL', 'P', 'Bn_Gly', 'F'] | 45 | 4529 | -6.07 | -6.07 | Circle | 7 | -1.71e-16 | -2.717873371 | -6.61e-17 | -2.858593892 | 8.41e-17 | -1.135754689 | 2.46e-15 | -0.249287767 | 2.551905879 | 4475.324525 | 141.0 | null | null | 95.511107 | 88.9882332 | 27.9882332 | 51.65384141 | 45.04543216 | 14.70379138 | 9.976973316 | 9.976973316 | 6.197158425 | 6.197158425 | 3.89511985 | 3.89511985 | null | null | null | null | 308.1588979 | 30.23885528 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 53.50066721 | 799.4632473 | 0.75862069 | 1.379310345 | 2.017241379 | 0.568181818 | 139.0 | PEPTIDE4529{P.[dA].L.[Me_dL].P.[Bn_Gly].F}$PEPTIDE4529,PEPTIDE4529,1:R1-7:R2$$$ | PEPTIDE4529{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4529,PEPTIDE4529,1:R1-7:R2$$$ | -5.27 | 58 | 738.526 | 4529 | null | null | 7.15e+36 | 10.18048434 | 19.93008749 | 11.01358637 | 427.8460979 | null | 16.85755955 | 0.342800051 | 16.85755955 | 0.245675342 | 1.721201968 | 0.245675342 | -7.164326138 | -0.342800051 | 2.647 | 218.4091 | 800.014 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 14 | 0 | 3 | 3 | 314 | hepta_952 | -6.07 | 4.108951705 | 1.01934479 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 84.92815599 | 33.91203081 | null | -6.07 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CN(Cc2ccccc2)C(=O)[C@@H]2CCCN2C(=O)[C@@H](CC(C)C)N(C)C1=O | 117.3012828 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.4741494 | 26.46640595 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'Me_dL', 'P', 'Bn_Gly', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 163.1279092 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4529 | null | 168.54 | 11.83 | 541.2397429 | 0.0 | 104.5954062 | -7.356173194 | -5.202690209 | -42.4885576 | -60.16715768 | -41.77857639 | -57.92532743 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.369231058 | null |
79b16fe67d1fe5875fcccb03f310f52695b8611fef7da952f8ee0f6875a0e270 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,529 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'meL', 'P', 'Bn_Gly', 'F'] | 44 | 4530 | -5.56 | -5.56 | Circle | 5 | -1.64e-16 | -2.717873371 | -1.17e-16 | -2.858593892 | 3.87e-17 | -1.135754689 | 2.7e-15 | -0.249287767 | 2.551905879 | 4475.324525 | 116.0 | null | null | 95.511107 | 88.9882332 | 27.9882332 | 51.65384141 | 45.04543216 | 14.70379138 | 9.976973316 | 9.976973316 | 6.197158425 | 6.197158425 | 3.89511985 | 3.89511985 | null | null | null | null | 308.1588979 | 30.23885528 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 53.50066721 | 799.4632473 | 0.75862069 | 1.379310345 | 2.017241379 | 0.568181818 | 115.0 | PEPTIDE4530{P.[dA].[dL].[meL].P.[Bn_Gly].F}$PEPTIDE4530,PEPTIDE4530,1:R1-7:R2$$$ | PEPTIDE4530{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4530,PEPTIDE4530,1:R1-7:R2$$$ | -5.27 | 58 | 738.526 | 4530 | null | null | 5.23e+38 | 10.18048434 | 19.93008749 | 11.01358637 | 427.8460979 | null | 16.85755955 | 0.342800051 | 16.85755955 | 0.245675342 | 1.721201968 | 0.245675342 | -7.164326138 | -0.342800051 | 2.647 | 218.4091 | 800.014 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 14 | 0 | 3 | 3 | 314 | hepta_953 | -5.56 | 4.108951705 | 1.01934479 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 84.92815599 | 33.91203081 | null | -5.56 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N2CCC[C@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N[C@H](CC(C)C)C(=O)N1C | 117.3012828 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.4741494 | 26.46640595 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'meL', 'P', 'Bn_Gly', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 163.1279092 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4530 | null | 168.54 | 34.0 | 541.2397429 | 0.0 | 104.5954062 | -7.356173194 | -5.202690209 | -42.4885576 | -60.16715768 | -41.77857639 | -57.92532743 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.369231058 | null |
04768b3e4c855c4d732b86115c6de91e61f44f319d0e7bce317999aa00b9706d | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,530 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'meL', 'P', 'meL', 'F'] | 42 | 4531 | -5.28 | -5.28 | Circle | 5 | -2.39e-16 | -2.727406547 | -2.25e-16 | -2.84907677 | -5.31e-17 | -1.136011557 | 7.85e-16 | -0.249287767 | 3.132056386 | 4410.008052 | 116.0 | null | null | 100.5470054 | 94.4882332 | 27.4882332 | 53.18973979 | 47.57182536 | 14.17739817 | 9.825580114 | 9.825580114 | 6.149038106 | 6.149038106 | 3.833907991 | 3.833907991 | null | null | null | null | 304.9199429 | 24.71473753 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 67.20825277 | 793.5101975 | 0.701754386 | 1.228070175 | 1.807017544 | 0.697674419 | 117.0 | PEPTIDE4531{P.[dA].[meL].[meL].P.[meL].F}$PEPTIDE4531,PEPTIDE4531,1:R1-7:R2$$$ | PEPTIDE4531{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4531,PEPTIDE4531,1:R1-7:R2$$$ | -4.49 | 57 | 726.515 | 4531 | null | null | 1.45e+41 | 9.28286508 | 19.77991863 | 10.92394938 | 433.1954521 | null | 16.98190393 | 0.342792017 | 16.98190393 | 0.245675544 | 1.83993908 | 0.245675544 | -7.414193834 | -0.342792017 | 2.8335 | 217.1904 | 794.051 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 2 | 14 | 0 | 18 | 0 | 3 | 3 | 316 | hepta_954 | -5.28 | 3.124112193 | -0.343557032 | 35.11917536 | 42.12524728 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 112.9443284 | 16.44910267 | null | -5.28 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1C(=O)N2CCC[C@H]2C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N1C | 125.4847506 | 41.35025811 | 0.0 | 35.11917536 | 17.68187306 | 141.0718913 | 33.92120007 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'meL', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 141.8962541 | 39.93468519 | 17.68187306 | 187.2364768 | 30.21209354 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4531 | null | 159.75 | 54.73 | 594.2121613 | 0.0 | 102.8256106 | -5.221872027 | -2.777135096 | -51.17583437 | -59.52206324 | -50.16584047 | -71.00836008 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.409836501 | null |
d6d02715351e72fd2a214f83913bec797fc28713b9a9b65f0d68bb2adc2c6289 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,531 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'bHph', 'P', 'L', 'F'] | 39 | 4532 | -6.7 | -6.7 | Circle | 1 | -1.34e-16 | -2.69315921 | -4.38e-17 | -2.872746948 | 3.04e-20 | -1.134686225 | 2.27e-15 | -0.249287762 | 2.481681641 | 4484.8343 | 158.0 | null | null | 95.511107 | 88.9882332 | 27.9882332 | 51.73119168 | 44.99264576 | 14.75657778 | 9.90475972 | 9.90475972 | 6.031750325 | 6.031750325 | 3.769438423 | 3.769438423 | null | null | null | null | 307.7729011 | 27.53842169 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 56.28326785 | 799.4632473 | 0.689655172 | 1.189655172 | 1.775862069 | 0.568181818 | 159.0 | PEPTIDE4532{P.[dA].L.[bHph].P.L.F}$PEPTIDE4532,PEPTIDE4532,1:R1-7:R2$$$ | PEPTIDE4532{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4532,PEPTIDE4532,1:R1-7:R2$$$ | -5.27 | 58 | 738.526 | 4532 | null | null | 8.259999999999999e+36 | 10.18048434 | 20.42689225 | 11.88795643 | 427.5422682 | null | 16.39519303 | 0.350730365 | 16.39519303 | 0.245675543 | 1.757423584 | 0.245675543 | -6.725264962 | -0.350730365 | 2.3936 | 218.6165 | 800.014 | Circle | 7 | 7 | null | 5 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 5 | 14 | 0 | 13 | 0 | 3 | 3 | 314 | hepta_955 | -6.7 | 3.652646703 | 0.745902716 | 36.34888623 | 36.10735481 | 7.059210392 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 85.21704533 | 23.30289545 | null | -6.7 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)C[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 117.3834498 | 41.35025811 | 0.0 | 36.34888623 | 11.78791537 | 133.741032 | 12.99371937 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'bHph', 'P', 'L', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.4060999999999997, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 29.1, 29.1] | 26.54906677 | 0.0 | 0.0 | 0.0 | 106.2690442 | 46.30761009 | 11.78791537 | 166.759317 | 60.42418708 | 7.059210392 | 0.0 | 0 | 2020_Townsend | 4532 | null | 186.12 | 2.92 | 539.9771764 | 0.0 | 108.1488795 | -12.3338561 | -5.303531958 | -41.48381294 | -66.07100669 | -53.35762057 | -38.65956095 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 2 | 5 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.271530341 | null |
0a13dfc7ee3368c5da63b4fe1368be663da9bab8a92f3cc741b028ea8a1e0281 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,532 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'meL', 'P', 'Bn_Gly', 'F'] | 43 | 4533 | -6.06 | -6.06 | Circle | 6 | -1.71e-16 | -2.717873371 | -6.61e-17 | -2.858593892 | 8.41e-17 | -1.135754689 | 2.46e-15 | -0.249287767 | 2.551905879 | 4475.324525 | 125.0 | null | null | 95.511107 | 88.9882332 | 27.9882332 | 51.65384141 | 45.04543216 | 14.70379138 | 9.976973316 | 9.976973316 | 6.197158425 | 6.197158425 | 3.89511985 | 3.89511985 | null | null | null | null | 308.1588979 | 30.23885528 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 53.50066721 | 799.4632473 | 0.75862069 | 1.379310345 | 2.017241379 | 0.568181818 | 104.0 | PEPTIDE4533{P.[dA].L.[meL].P.[Bn_Gly].F}$PEPTIDE4533,PEPTIDE4533,1:R1-7:R2$$$ | PEPTIDE4533{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4533,PEPTIDE4533,1:R1-7:R2$$$ | -5.27 | 58 | 738.526 | 4533 | null | null | 7.15e+36 | 10.18048434 | 19.93008749 | 11.01358637 | 427.8460979 | null | 16.85755955 | 0.342800051 | 16.85755955 | 0.245675342 | 1.721201968 | 0.245675342 | -7.164326138 | -0.342800051 | 2.647 | 218.4091 | 800.014 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 14 | 0 | 3 | 3 | 314 | hepta_956 | -6.06 | 4.108951705 | 1.01934479 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 84.92815599 | 33.91203081 | null | -6.06 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CN(Cc2ccccc2)C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)N(C)C1=O | 117.3012828 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.4741494 | 26.46640595 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'meL', 'P', 'Bn_Gly', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 163.1279092 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4533 | null | 168.54 | 12.21 | 541.2397429 | 0.0 | 104.5954062 | -7.356173194 | -5.202690209 | -42.4885576 | -60.16715768 | -41.77857639 | -57.92532743 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.369231058 | null |
3a18ae633a3d6f9f82d6b8f474e0b2585f5d4cee3abe98242b75a90141bbecb9 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,533 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'Bn_Gly', 'P', 'meL', 'F'] | 43 | 4534 | -5.75 | -5.75 | Circle | 7 | -1.2e-16 | -2.700490644 | -8.34e-17 | -2.852676715 | 3.97e-18 | -1.13499315 | 2.42e-15 | -0.249287762 | 2.542605656 | 4475.324525 | 137.0 | null | null | 95.511107 | 88.9882332 | 27.9882332 | 51.65384141 | 45.04543216 | 14.70379138 | 9.976973316 | 9.976973316 | 6.197158425 | 6.197158425 | 3.867169 | 3.867169 | null | null | null | null | 308.1588979 | 24.75582106 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.98370144 | 799.4632473 | 0.75862069 | 1.379310345 | 2.034482759 | 0.568181818 | 127.0 | PEPTIDE4534{P.[dA].L.[Bn_Gly].P.[meL].F}$PEPTIDE4534,PEPTIDE4534,1:R1-7:R2$$$ | PEPTIDE4534{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4534,PEPTIDE4534,1:R1-7:R2$$$ | -5.27 | 58 | 738.526 | 4534 | null | null | 6.86e+38 | 10.18048434 | 19.93008749 | 11.01358637 | 427.8460979 | null | 16.60942733 | 0.342800051 | 16.60942733 | 0.245675544 | 1.775830486 | 0.245675544 | -6.976692845 | -0.342800051 | 2.647 | 218.4091 | 800.014 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 14 | 0 | 3 | 3 | 314 | hepta_957 | -5.75 | 4.290899375 | 0.867350954 | 35.52907898 | 42.60421449 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 84.92815599 | 27.41517112 | null | -5.75 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)CN(Cc2ccccc2)C1=O | 117.3012828 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.4741494 | 26.46640595 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'Bn_Gly', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 163.1279092 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4534 | null | 168.54 | 23.25 | 541.1177916 | 0.0 | 104.6968247 | -7.45759161 | -5.364028941 | -42.28678321 | -60.51756369 | -41.67052963 | -57.60145256 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.369231058 | null |
d310c76b6b9e7ea3349f8901858e40f2ee002fe244547d32151f10533aab578b | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,534 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'L', 'P', 'Bn_Gly', 'F'] | 43 | 4535 | -5.87 | -5.87 | Circle | 2 | -1.75e-16 | -2.713630638 | -8.69e-17 | -2.85665116 | -2.6e-17 | -1.135665036 | 3.63e-15 | -0.249287767 | 2.547539801 | 4475.324525 | 113.0 | null | null | 95.511107 | 88.9882332 | 27.9882332 | 51.65384141 | 45.04543216 | 14.70379138 | 9.976973316 | 9.976973316 | 6.197158425 | 6.197158425 | 3.89511985 | 3.89511985 | null | null | null | null | 308.1588979 | 27.49733817 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 56.24218433 | 799.4632473 | 0.75862069 | 1.362068966 | 2.0 | 0.568181818 | 111.0 | PEPTIDE4535{P.[dA].[meL].L.P.[Bn_Gly].F}$PEPTIDE4535,PEPTIDE4535,1:R1-7:R2$$$ | PEPTIDE4535{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4535,PEPTIDE4535,1:R1-7:R2$$$ | -5.27 | 58 | 738.526 | 4535 | null | null | 3.66e+38 | 10.18048434 | 19.93008749 | 11.01358637 | 427.8460979 | null | 16.6735607 | 0.342792017 | 16.6735607 | 0.245675342 | 1.725709382 | 0.245675342 | -7.043207029 | -0.342792017 | 2.647 | 218.4091 | 800.014 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 14 | 0 | 3 | 3 | 314 | hepta_958 | -5.87 | 4.221639968 | 1.002165217 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 84.92815599 | 33.91203081 | null | -5.87 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CN(Cc2ccccc2)C(=O)[C@@H]2CCCN2C1=O | 117.3012828 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 121.4741494 | 26.46640595 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'L', 'P', 'Bn_Gly', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 0.8193999999999995, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 46.43154487 | 11.78791537 | 163.1279092 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4535 | null | 168.54 | 18.23 | 540.8747245 | 0.0 | 104.7563264 | -7.517093375 | -5.194194779 | -42.44342757 | -60.16430173 | -41.69854001 | -57.69682677 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.369231058 | null |
19080dab74e2dabe6a298bd1ec49b311a8c373ba20411dc2741e42889e92a36c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,535 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Me_dL', 'Bn_Gly', 'P', 'Me_dL', 'F'] | 49 | 4536 | -6.03 | -6.03 | Circle | 3 | -2.31e-16 | -2.705196413 | -1.24e-16 | -2.849038323 | -1.37e-17 | -1.135204551 | 1.93e-15 | -0.249287762 | 2.596130728 | 4584.247812 | 117.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.86516627 | 46.32182536 | 14.92739817 | 10.20058011 | 10.20058011 | 6.41050707 | 6.41050707 | 3.995892473 | 3.995892473 | null | null | null | null | 314.7248211 | 23.34397898 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.09597711 | 813.4788974 | 0.745762712 | 1.338983051 | 1.966101695 | 0.577777778 | 117.0 | PEPTIDE4536{P.[dA].[Me_dL].[Bn_Gly].P.[Me_dL].F}$PEPTIDE4536,PEPTIDE4536,1:R1-7:R2$$$ | PEPTIDE4536{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4536,PEPTIDE4536,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4536 | null | null | 1.0099999999999999e+40 | 10.24948353 | 20.12706948 | 11.0676877 | 437.1728958 | null | 16.926094 | 0.342792017 | 16.926094 | 0.245675544 | 1.79822632 | 0.245675544 | -7.075753188 | -0.342792017 | 2.9892 | 223.0364 | 814.041 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_959 | -6.03 | 4.128848623 | 0.977112696 | 35.11917536 | 42.60421449 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 96.01625856 | 27.41517112 | null | -6.03 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(C)[C@H](CC(C)C)C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@H]2C(=O)N1C | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.4741494 | 33.44223285 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Me_dL', 'Bn_Gly', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 167.2401849 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4536 | null | 159.75 | 12.97 | 561.1768672 | 0.0 | 103.1610598 | -5.045841091 | -5.47687826 | -43.16572151 | -61.6940626 | -42.22594576 | -64.56281107 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.414938484 | null |
427e513c1bb8008b1b4101aa21820be31404474c9e770032f509f57a33b1f5af | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,536 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Bn_Gly', 'Me_dL', 'P', 'Me_dL', 'F'] | 49 | 4537 | -5.73 | -5.73 | Circle | 9 | -2.07e-16 | -2.708273485 | -1.2e-16 | -2.848742208 | 3.58e-17 | -1.135165426 | 2.22e-15 | -0.249287762 | 2.597211874 | 4584.247812 | 110.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.86516627 | 46.32182536 | 14.92739817 | 10.20058011 | 10.20058011 | 6.41050707 | 6.41050707 | 3.995892473 | 3.995892473 | null | null | null | null | 314.7248211 | 27.49733817 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.94261792 | 813.4788974 | 0.745762712 | 1.338983051 | 1.949152542 | 0.577777778 | 108.0 | PEPTIDE4537{P.[dA].[Bn_Gly].[Me_dL].P.[Me_dL].F}$PEPTIDE4537,PEPTIDE4537,1:R1-7:R2$$$ | PEPTIDE4537{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4537,PEPTIDE4537,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4537 | null | null | 1.07e+40 | 10.24948353 | 20.12706948 | 11.0676877 | 437.1728958 | null | 16.81204308 | 0.34279177 | 16.81204308 | 0.245675544 | 1.769864786 | 0.245675544 | -7.085800072 | -0.34279177 | 2.9892 | 223.0364 | 814.041 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_960 | -5.73 | 4.151385359 | 1.008829271 | 35.11917536 | 42.60421449 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 96.01625856 | 27.41517112 | null | -5.73 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1C(=O)N2CCC[C@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(Cc2ccccc2)CC(=O)N1C | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.4741494 | 33.44223285 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Bn_Gly', 'Me_dL', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.3173, 1.1616, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 167.2401849 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4537 | null | 159.75 | 24.52 | 561.0626121 | 0.0 | 103.1098944 | -4.994675675 | -5.372027665 | -43.21921829 | -61.43468488 | -42.4777141 | -64.50751917 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.414938484 | null |
841cf30308c11c7faa67c7e22c7c8929be80ccd589f8fc4d0e2c0b149128db0d | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,537 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'dL', 'bHph', 'P', 'meL', 'F'] | 42 | 4538 | -10.0 | -10 | Circle | 3 | -1.42e-16 | -2.702317966 | -7.22e-17 | -2.869832642 | 1.83e-17 | -1.134985831 | 1.84e-15 | -0.249287763 | 2.540667834 | 4593.757587 | 146.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.94251654 | 46.26903896 | 14.98018458 | 10.12836652 | 10.12836652 | 6.245098969 | 6.245098969 | 3.898161895 | 3.898161895 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 314.3388244 | 26.12657961 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 60.39554352 | 813.4788974 | 0.728813559 | 1.338983051 | 1.983050847 | 0.577777778 | 149.0 | PEPTIDE4538{P.[dA].[dL].[bHph].P.[meL].F}$PEPTIDE4538,PEPTIDE4538,1:R1-7:R2$$$ | PEPTIDE4538{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4538,PEPTIDE4538,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4538 | null | null | 4.47e+39 | 10.24948353 | 20.61658265 | 11.91281718 | 436.8690661 | null | 16.5905036 | 0.350730365 | 16.5905036 | 0.245675544 | 1.788409601 | 0.245675544 | -7.011723295 | -0.350730365 | 2.7358 | 223.2438 | 814.041 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 4 | 14 | 0 | 14 | 0 | 3 | 3 | 320 | hepta_961 | -10.0 | 3.603554838 | 0.77469618 | 35.93898261 | 36.10735481 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 96.3051479 | 23.30289545 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@H]2C(=O)N1C | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 11.78791537 | 133.741032 | 19.96954627 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'dL', 'bHph', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 20.31, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 46.30761009 | 11.78791537 | 170.8715927 | 60.42418708 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4538 | null | 177.33 | 0.0 | 560.1518408 | 0.0 | 106.6889181 | -10.00623053 | -5.413539626 | -42.35423455 | -67.34081939 | -54.27735251 | -45.28191554 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.316968996 | null |
d159c141f09f8573ef141675e1c0b868c337630f90d3401b992839f999bdbf7f | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,538 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Me_dL', 'bHph', 'P', 'L', 'F'] | 43 | 4539 | -10.0 | -10 | Circle | 8 | -1.93e-16 | -2.707513716 | -8.71e-17 | -2.866641164 | -2.08e-17 | -1.134998022 | 2.16e-15 | -0.249287763 | 2.533528618 | 4593.757587 | 132.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.94251654 | 46.26903896 | 14.98018458 | 10.12836652 | 10.12836652 | 6.245098969 | 6.245098969 | 3.898161895 | 3.898161895 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 314.3388244 | 27.53842169 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 58.98370144 | 813.4788974 | 0.728813559 | 1.305084746 | 1.93220339 | 0.577777778 | 126.0 | PEPTIDE4539{P.[dA].[Me_dL].[bHph].P.L.F}$PEPTIDE4539,PEPTIDE4539,1:R1-7:R2$$$ | PEPTIDE4539{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4539,PEPTIDE4539,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4539 | null | null | 1.14e+40 | 10.24948353 | 20.61658265 | 11.91281718 | 436.8690661 | null | 16.4822798 | 0.35072394 | 16.4822798 | 0.245675543 | 1.779819417 | 0.245675543 | -6.950310021 | -0.35072394 | 2.7358 | 223.2438 | 814.041 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 4 | 14 | 0 | 14 | 0 | 3 | 3 | 320 | hepta_962 | -10.0 | 3.640104492 | 0.80938875 | 35.93898261 | 36.10735481 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 96.3051479 | 23.30289545 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)C[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 11.78791537 | 133.741032 | 19.96954627 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Me_dL', 'bHph', 'P', 'L', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.4060999999999997, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 46.30761009 | 11.78791537 | 170.8715927 | 60.42418708 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4539 | null | 177.33 | 0.0 | 559.8828849 | 0.0 | 106.7576612 | -10.09102835 | -5.401524929 | -42.33761427 | -67.31075576 | -54.09051283 | -45.24244331 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.316968996 | null |
0d787a285a0bf36cd62a4bfacbb4860538344a4a8c4e1f1d6d6751a4df98861b | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,539 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'Bn_Gly', 'P', 'Me_dL', 'F'] | 47 | 4540 | -5.9 | -5.9 | Circle | 2 | -2.09e-16 | -2.705196413 | -9.9e-17 | -2.849038323 | 2.32e-17 | -1.135204551 | 1.61e-15 | -0.249287762 | 2.596130728 | 4584.247812 | 103.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.86516627 | 46.32182536 | 14.92739817 | 10.20058011 | 10.20058011 | 6.41050707 | 6.41050707 | 3.995892473 | 3.995892473 | null | null | null | null | 314.7248211 | 23.34397898 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.09597711 | 813.4788974 | 0.745762712 | 1.338983051 | 1.966101695 | 0.577777778 | 103.0 | PEPTIDE4540{P.[dA].[meL].[Bn_Gly].P.[Me_dL].F}$PEPTIDE4540,PEPTIDE4540,1:R1-7:R2$$$ | PEPTIDE4540{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4540,PEPTIDE4540,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4540 | null | null | 8.57e+39 | 10.24948353 | 20.12706948 | 11.0676877 | 437.1728958 | null | 16.926094 | 0.342792017 | 16.926094 | 0.245675544 | 1.79822632 | 0.245675544 | -7.075753188 | -0.342792017 | 2.9892 | 223.0364 | 814.041 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_963 | -5.9 | 4.128848623 | 0.977112696 | 35.11917536 | 42.60421449 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 96.01625856 | 27.41517112 | null | -5.9 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N1C | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.4741494 | 33.44223285 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'Bn_Gly', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 167.2401849 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4540 | null | 159.75 | 17.05 | 561.1768672 | 0.0 | 103.1610598 | -5.045841091 | -5.47687826 | -43.16572151 | -61.6940626 | -42.22594576 | -64.56281107 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.414938484 | null |
3d6d7a43cca0485c1640cc08baf783a7959a2c6f7c2458a1f96d9129212cb55a | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,540 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'bHph', 'P', 'Me_dL', 'F'] | 43 | 4541 | -5.89 | -5.89 | Circle | 5 | -2.18e-16 | -2.702317966 | -9.48e-17 | -2.869832642 | 3.76e-17 | -1.134985831 | 1.27e-15 | -0.249287763 | 2.540667834 | 4593.757587 | 136.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.94251654 | 46.26903896 | 14.98018458 | 10.12836652 | 10.12836652 | 6.245098969 | 6.245098969 | 3.898161895 | 3.898161895 | null | null | null | null | 314.3388244 | 26.12657961 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 60.39554352 | 813.4788974 | 0.728813559 | 1.338983051 | 1.983050847 | 0.577777778 | 141.0 | PEPTIDE4541{P.[dA].L.[bHph].P.[Me_dL].F}$PEPTIDE4541,PEPTIDE4541,1:R1-7:R2$$$ | PEPTIDE4541{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4541,PEPTIDE4541,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4541 | null | null | 1.99e+40 | 10.24948353 | 20.61658265 | 11.91281718 | 436.8690661 | null | 16.5905036 | 0.350730365 | 16.5905036 | 0.245675544 | 1.788409601 | 0.245675544 | -7.011723295 | -0.350730365 | 2.7358 | 223.2438 | 814.041 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 4 | 14 | 0 | 14 | 0 | 3 | 3 | 320 | hepta_964 | -5.89 | 3.603554838 | 0.77469618 | 35.93898261 | 36.10735481 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 96.3051479 | 23.30289545 | null | -5.89 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)C[C@H](Cc2ccccc2)NC1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 11.78791537 | 133.741032 | 19.96954627 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'bHph', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 20.31, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 46.30761009 | 11.78791537 | 170.8715927 | 60.42418708 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4541 | null | 177.33 | 17.44 | 560.1518408 | 0.0 | 106.6889181 | -10.00623053 | -5.413539626 | -42.35423455 | -67.34081939 | -54.27735251 | -45.28191554 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.316968996 | null |
99822fa644d70292eb88269b763a50c692bef1efd7c59013891e4d647d075320 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,542 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'Me_dL', 'P', 'Bn_Gly', 'F'] | 47 | 4543 | -5.36 | -5.36 | Circle | 1 | -1.97e-16 | -2.726522409 | -1.19e-16 | -2.847590016 | -2.51e-18 | -1.136010947 | 2.75e-15 | -0.249287767 | 2.606522711 | 4584.247812 | 108.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.86516627 | 46.32182536 | 14.92739817 | 10.20058011 | 10.20058011 | 6.41050707 | 6.41050707 | 4.023843323 | 4.023843323 | null | null | null | null | 314.7248211 | 28.8270132 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 57.61294288 | 813.4788974 | 0.745762712 | 1.305084746 | 1.898305085 | 0.577777778 | 105.0 | PEPTIDE4543{P.[dA].[meL].[Me_dL].P.[Bn_Gly].F}$PEPTIDE4543,PEPTIDE4543,1:R1-7:R2$$$ | PEPTIDE4543{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4543,PEPTIDE4543,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4543 | null | null | 4.9e+39 | 10.24948353 | 20.12706948 | 11.0676877 | 437.1728958 | null | 16.99022737 | 0.342792017 | 16.99022737 | 0.245675342 | 1.743597801 | 0.245675342 | -7.289751308 | -0.342792017 | 2.9892 | 223.0364 | 814.041 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_966 | -5.36 | 4.015900641 | 1.15563376 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 96.01625856 | 33.91203081 | null | -5.36 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N(C)[C@H](CC(C)C)C(=O)N2CCC[C@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N1C | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.4741494 | 33.44223285 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'Me_dL', 'P', 'Bn_Gly', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.1616, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 167.2401849 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4543 | null | 159.75 | 47.81 | 561.3710932 | 0.0 | 102.9437542 | -4.828535494 | -5.264651199 | -43.41692369 | -61.26164616 | -42.39803454 | -64.97838965 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.414938484 | null |
cad14c4347bffa91ddb27b937a5fb8070011bc31b2cb3da4fa7d1bd382d8f596 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,544 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'Bn_Gly', 'P', 'meL', 'F'] | 45 | 4545 | -6.15 | -6.15 | Circle | 6 | -2.31e-16 | -2.705196413 | -1.24e-16 | -2.849038323 | -1.37e-17 | -1.135204551 | 1.93e-15 | -0.249287762 | 2.596130728 | 4584.247812 | 113.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.86516627 | 46.32182536 | 14.92739817 | 10.20058011 | 10.20058011 | 6.41050707 | 6.41050707 | 3.995892473 | 3.995892473 | null | null | null | null | 314.7248211 | 23.34397898 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.09597711 | 813.4788974 | 0.745762712 | 1.338983051 | 1.966101695 | 0.577777778 | 115.0 | PEPTIDE4545{P.[dA].[meL].[Bn_Gly].P.[meL].F}$PEPTIDE4545,PEPTIDE4545,1:R1-7:R2$$$ | PEPTIDE4545{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4545,PEPTIDE4545,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4545 | null | null | 1.0099999999999999e+40 | 10.24948353 | 20.12706948 | 11.0676877 | 437.1728958 | null | 16.926094 | 0.342792017 | 16.926094 | 0.245675544 | 1.79822632 | 0.245675544 | -7.075753188 | -0.342792017 | 2.9892 | 223.0364 | 814.041 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_968 | -6.15 | 4.128848623 | 0.977112696 | 35.11917536 | 42.60421449 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 96.01625856 | 27.41517112 | null | -6.15 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@H]2C(=O)N1C | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.4741494 | 33.44223285 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'Bn_Gly', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 167.2401849 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4545 | null | 159.75 | 10.12 | 561.1768672 | 0.0 | 103.1610598 | -5.045841091 | -5.47687826 | -43.16572151 | -61.6940626 | -42.22594576 | -64.56281107 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.414938484 | null |
fe4cfe61d4f9dd25343ac002bdbbce0e22d7ed8b48eff00822e13a539e5ed78f | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,545 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'meL', 'P', 'Bn_Gly', 'F'] | 45 | 4546 | -5.4 | -5.4 | Circle | 5 | -1.71e-16 | -2.726522409 | -1.09e-16 | -2.847590016 | 6.53e-17 | -1.136010947 | 1.72e-15 | -0.249287767 | 2.606522711 | 4584.247812 | 99.0 | null | null | 98.011107 | 91.4882332 | 28.4882332 | 52.86516627 | 46.32182536 | 14.92739817 | 10.20058011 | 10.20058011 | 6.41050707 | 6.41050707 | 4.023843323 | 4.023843323 | null | null | null | null | 314.7248211 | 28.8270132 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 57.61294288 | 813.4788974 | 0.745762712 | 1.305084746 | 1.898305085 | 0.577777778 | 101.0 | PEPTIDE4546{P.[dA].[meL].[meL].P.[Bn_Gly].F}$PEPTIDE4546,PEPTIDE4546,1:R1-7:R2$$$ | PEPTIDE4546{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4546,PEPTIDE4546,1:R1-7:R2$$$ | -5.27 | 59 | 750.537 | 4546 | null | null | 2.0999999999999999e+40 | 10.24948353 | 20.12706948 | 11.0676877 | 437.1728958 | null | 16.99022737 | 0.342792017 | 16.99022737 | 0.245675342 | 1.743597801 | 0.245675342 | -7.289751308 | -0.342792017 | 2.9892 | 223.0364 | 814.041 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 2 | 14 | 0 | 15 | 0 | 3 | 3 | 320 | hepta_969 | -5.4 | 4.015900641 | 1.15563376 | 35.11917536 | 36.10735481 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 68.00425988 | 96.01625856 | 33.91203081 | null | -5.4 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N2CCC[C@H]2C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N1C | 120.0017164 | 41.35025811 | 0.0 | 35.11917536 | 11.78791537 | 121.4741494 | 33.44223285 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'meL', 'P', 'Bn_Gly', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.1616, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 135.3993944 | 46.43154487 | 11.78791537 | 167.2401849 | 60.42418708 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4546 | null | 159.75 | 44.78 | 561.3710932 | 0.0 | 102.9437542 | -4.828535494 | -5.264651199 | -43.41692369 | -61.26164616 | -42.39803454 | -64.97838965 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.414938484 | null |
50f379627478d84b2effdc6cf391373b8ed2bc8693e3cece55339013e5e2bf9c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,546 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Bn_Gly', 'Bn_Gly', 'P', 'L', 'F'] | 46 | 4547 | -10.0 | -10 | Circle | 9 | -4.68e-17 | -2.683345657 | 2.32e-18 | -2.856886538 | 5.12e-16 | -1.13321224 | 10.22150305 | -0.247899104 | 2.165347048 | 4649.432248 | 122.0 | null | null | 92.97520861 | 85.9882332 | 28.9882332 | 51.32926789 | 43.79543216 | 15.45379138 | 10.35197332 | 10.35197332 | 6.458627389 | 6.458627389 | 4.029153482 | 4.029153482 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 317.9637761 | 27.53842169 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 50.71806658 | 819.4319472 | 0.683333333 | 1.2 | 1.8 | 0.456521739 | 148.0 | PEPTIDE4547{P.[dA].[Bn_Gly].[Bn_Gly].P.L.F}$PEPTIDE4547,PEPTIDE4547,1:R1-7:R2$$$ | PEPTIDE4547{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4547,PEPTIDE4547,1:R1-7:R2$$$ | -6.05 | 60 | 762.548 | 4547 | null | null | 6.33e+37 | 11.2507603 | 20.27662491 | 11.15535669 | 431.8235416 | null | 16.45855531 | 0.34279177 | 16.45855531 | 0.245675543 | 1.681394332 | 0.245675543 | -6.638149156 | -0.34279177 | 2.8027 | 224.2551 | 820.004 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 3 | 14 | 0 | 11 | 0 | 3 | 3 | 318 | hepta_970 | -10.0 | 5.086382547 | 2.690425575 | 35.52907898 | 43.08318171 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 104.3400648 | 61.30082878 | 68.0000861 | 38.38123957 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 6 | CC(C)C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)CN(Cc2ccccc2)C(=O)CN(Cc2ccccc2)C(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 111.8182486 | 41.35025811 | 0.0 | 35.52907898 | 5.893957685 | 101.8764075 | 25.98743874 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Bn_Gly', 'Bn_Gly', 'P', 'L', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.3173, 1.3173, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 29.1, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 117.0267981 | 52.92840456 | 5.893957685 | 143.1316174 | 90.63628061 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4547 | null | 168.54 | 0.0 | 507.8326288 | 0.0 | 104.8895908 | -7.138877685 | -7.600371467 | -34.71369037 | -61.77494528 | -34.27173444 | -51.30593372 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.314361038 | null |
f9440779427bcefe40d66da2b71c27024b7cc0237c4a69fe681e520acbddfa1f | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,547 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'L', 'Bn_Gly', 'P', 'Bn_Gly', 'F'] | 46 | 4548 | -6.48 | -6.48 | Circle | 1 | -1.02e-16 | -2.687528474 | -7.83e-18 | -2.848875217 | 3.41e-16 | -1.133201522 | 10.21376815 | -0.247898695 | 2.174443962 | 4649.432248 | 142.0 | null | null | 92.97520861 | 85.9882332 | 28.9882332 | 51.32926789 | 43.79543216 | 15.45379138 | 10.35197332 | 10.35197332 | 6.458627389 | 6.458627389 | 4.057104332 | 4.057104332 | null | null | null | null | 317.9637761 | 28.86809672 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 49.38839154 | 819.4319472 | 0.7 | 1.266666667 | 1.866666667 | 0.456521739 | 133.0 | PEPTIDE4548{P.[dA].L.[Bn_Gly].P.[Bn_Gly].F}$PEPTIDE4548,PEPTIDE4548,1:R1-7:R2$$$ | PEPTIDE4548{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4548,PEPTIDE4548,1:R1-7:R2$$$ | -6.05 | 60 | 762.548 | 4548 | null | null | 4.31e+37 | 11.2507603 | 20.27662491 | 11.15535669 | 431.8235416 | null | 16.61453635 | 0.342800051 | 16.61453635 | 0.245675342 | 1.679489208 | 0.245675342 | -6.715824305 | -0.342800051 | 2.8027 | 224.2551 | 820.004 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 3 | 14 | 0 | 11 | 0 | 3 | 3 | 318 | hepta_971 | -6.48 | 5.170904136 | 2.843414914 | 35.52907898 | 36.58632203 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 104.3400648 | 61.30082878 | 68.0000861 | 44.87809926 | null | -6.48 | null | null | null | null | null | null | null | null | null | null | 6 | CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CN(Cc2ccccc2)C(=O)[C@@H]2CCCN2C(=O)CN(Cc2ccccc2)C1=O | 111.8182486 | 41.35025811 | 0.0 | 35.52907898 | 5.893957685 | 101.8764075 | 25.98743874 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'L', 'Bn_Gly', 'P', 'Bn_Gly', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.3173, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 117.0267981 | 52.92840456 | 5.893957685 | 143.1316174 | 90.63628061 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4548 | null | 168.54 | 4.81 | 508.1941317 | 0.0 | 104.7593136 | -7.008600492 | -7.639171362 | -34.75452797 | -61.77412486 | -34.17199909 | -51.68835487 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.314361038 | null |
c386ecb0a0db12fd6804bb4be4ee79086aad02083999aa7621eb6041f5472d42 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,548 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Bn_Gly', 'L', 'P', 'Bn_Gly', 'F'] | 46 | 4549 | -5.99 | -5.99 | Circle | 3 | -1.06e-16 | -2.684025764 | -6.93e-33 | -2.832251354 | 3.67e-16 | -1.133167397 | 10.22852981 | -0.247899143 | 2.173848497 | 4649.432248 | 102.0 | null | null | 92.97520861 | 85.9882332 | 28.9882332 | 51.32926789 | 43.79543216 | 15.45379138 | 10.35197332 | 10.35197332 | 6.458627389 | 6.458627389 | 4.085055182 | 4.085055182 | null | null | null | null | 317.9637761 | 28.86809672 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 49.38839154 | 819.4319472 | 0.683333333 | 1.166666667 | 1.716666667 | 0.456521739 | 103.0 | PEPTIDE4549{P.[dA].[Bn_Gly].L.P.[Bn_Gly].F}$PEPTIDE4549,PEPTIDE4549,1:R1-7:R2$$$ | PEPTIDE4549{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4549,PEPTIDE4549,1:R1-7:R2$$$ | -6.05 | 60 | 762.548 | 4549 | null | null | 4.8e+37 | 11.2507603 | 20.27662491 | 11.15535669 | 431.8235416 | null | 16.59510633 | 0.34279177 | 16.59510633 | 0.245675342 | 1.689969663 | 0.245675342 | -6.674899212 | -0.34279177 | 2.8027 | 224.2551 | 820.004 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 3 | 14 | 0 | 11 | 0 | 3 | 3 | 318 | hepta_972 | -5.99 | 5.313848676 | 3.050159694 | 35.52907898 | 30.08946234 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 104.3400648 | 61.30082878 | 68.0000861 | 51.37495894 | null | -5.99 | null | null | null | null | null | null | null | null | null | null | 6 | CC(C)C[C@@H]1NC(=O)CN(Cc2ccccc2)C(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)CN(Cc2ccccc2)C(=O)[C@@H]2CCCN2C1=O | 111.8182486 | 41.35025811 | 0.0 | 35.52907898 | 5.893957685 | 101.8764075 | 25.98743874 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Bn_Gly', 'L', 'P', 'Bn_Gly', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.3173, 0.8193999999999995, 0.2794999999999998, 1.3173, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 117.0267981 | 52.92840456 | 5.893957685 | 143.1316174 | 90.63628061 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4549 | null | 168.54 | 14.08 | 508.0865647 | 0.0 | 104.7330657 | -6.982352565 | -7.593950446 | -34.7359406 | -61.71743628 | -34.31550319 | -51.5577807 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.314361038 | null |
cb22de668920db5dcdfa863a26e3d91492246530b29ea23b8a09ec2fd2a841cb | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,550 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'bHph', 'P', 'Me_dL', 'F'] | 45 | 4551 | -5.69 | -5.69 | Circle | 6 | -2.39e-16 | -2.709034602 | -9.97e-17 | -2.861905174 | 5.17e-17 | -1.135201116 | 1.92e-15 | -0.249287763 | 2.590669938 | 4703.026224 | 133.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.15384141 | 47.54543216 | 15.20379138 | 10.35197332 | 10.35197332 | 6.458447614 | 6.458447614 | 4.026885368 | 4.026885368 | null | null | null | null | 320.9047477 | 26.12657961 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.09597711 | 827.4945474 | 0.716666667 | 1.266666667 | 1.85 | 0.586956522 | 130.0 | PEPTIDE4551{P.[dA].[meL].[bHph].P.[Me_dL].F}$PEPTIDE4551,PEPTIDE4551,1:R1-7:R2$$$ | PEPTIDE4551{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4551,PEPTIDE4551,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4551 | null | null | 1.91e+41 | 10.32069879 | 20.80932391 | 11.50832527 | 446.1958641 | null | 16.64330519 | 0.35072394 | 16.64330519 | 0.245675544 | 1.818272126 | 0.245675544 | -7.046931905 | -0.35072394 | 3.078 | 227.8711 | 828.068 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 15 | 0 | 3 | 3 | 326 | hepta_974 | -5.69 | 3.537682361 | 0.910211429 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 107.3932505 | 23.30289545 | null | -5.69 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@H]2C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N1C | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 133.741032 | 26.94537317 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'bHph', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 46.30761009 | 11.78791537 | 174.9838684 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4551 | null | 168.54 | 26.27 | 580.1279665 | 0.0 | 105.2432742 | -7.708977233 | -5.511532598 | -43.20803588 | -68.58056847 | -55.01024477 | -51.93521512 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367874367 | null |
4453f507b66905a1189db092bb204d2c5f12444a2da2ef5fbeab536467c2cf1b | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,551 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Me_dL', 'bHph', 'P', 'meL', 'F'] | 45 | 4552 | -5.41 | -5.41 | Circle | 9 | -1.75e-16 | -2.709034602 | -1.21e-16 | -2.861905174 | 1.9e-17 | -1.135201116 | 1.79e-15 | -0.249287763 | 2.590669938 | 4703.026224 | 138.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.15384141 | 47.54543216 | 15.20379138 | 10.35197332 | 10.35197332 | 6.458447614 | 6.458447614 | 4.026885368 | 4.026885368 | null | null | null | null | 320.9047477 | 26.12657961 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.09597711 | 827.4945474 | 0.716666667 | 1.266666667 | 1.85 | 0.586956522 | 136.0 | PEPTIDE4552{P.[dA].[Me_dL].[bHph].P.[meL].F}$PEPTIDE4552,PEPTIDE4552,1:R1-7:R2$$$ | PEPTIDE4552{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4552,PEPTIDE4552,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4552 | null | null | 1.0600000000000001e+42 | 10.32069879 | 20.80932391 | 11.50832527 | 446.1958641 | null | 16.64330519 | 0.35072394 | 16.64330519 | 0.245675544 | 1.818272126 | 0.245675544 | -7.046931905 | -0.35072394 | 3.078 | 227.8711 | 828.068 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 15 | 0 | 3 | 3 | 326 | hepta_975 | -5.41 | 3.537682361 | 0.910211429 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 107.3932505 | 23.30289545 | null | -5.41 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@H]2C(=O)N1C | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 133.741032 | 26.94537317 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Me_dL', 'bHph', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 46.30761009 | 11.78791537 | 174.9838684 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4552 | null | 168.54 | 44.24 | 580.1279665 | 0.0 | 105.2432742 | -7.708977233 | -5.511532598 | -43.20803588 | -68.58056847 | -55.01024477 | -51.93521512 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367874367 | null |
c4e4f776d0b51b04a7b22c4d61e397af55fa72045fc81c46d8a96fb912f6ea57 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,552 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Bn_Gly', 'bHph', 'P', 'dL', 'F'] | 45 | 4553 | -6.45 | -6.45 | Circle | 6 | -1.05e-16 | -2.684278842 | -8.37e-18 | -2.860673698 | 1.3e-16 | -1.133213835 | 10.12354638 | -0.247900942 | 2.162983788 | 4768.507298 | 141.0 | null | null | 95.47520861 | 88.4882332 | 29.4882332 | 52.61794302 | 45.01903896 | 15.73018458 | 10.50336652 | 10.50336652 | 6.506567933 | 6.506567933 | 4.088097227 | 4.088097227 | null | null | null | null | 324.1437026 | 30.32102232 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 50.71806658 | 833.4475972 | 0.721311475 | 1.278688525 | 1.901639344 | 0.468085106 | 139.0 | PEPTIDE4553{P.[dA].[Bn_Gly].[bHph].P.[dL].F}$PEPTIDE4553,PEPTIDE4553,1:R1-7:R2$$$ | PEPTIDE4553{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4553,PEPTIDE4553,1:R1-7:R2$$$ | -6.05 | 61 | 774.559 | 4553 | null | null | 4.49e+37 | 11.30372809 | 20.96025739 | 12.04403712 | 440.8465099 | null | 16.48738882 | 0.350975417 | 16.48738882 | 0.245675543 | 1.679255476 | 0.245675543 | -6.681220256 | -0.350975417 | 2.8915 | 229.0898 | 834.031 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 4 | 14 | 0 | 11 | 0 | 3 | 3 | 324 | hepta_976 | -6.45 | 4.713176535 | 2.721750908 | 35.93898261 | 30.08946234 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 104.3400648 | 67.67375369 | 79.37707801 | 40.76582359 | null | -6.45 | null | null | null | null | null | null | null | null | null | null | 6 | CC(C)C[C@H]1NC(=O)[C@@H]2CCCN2C(=O)C[C@H](Cc2ccccc2)NC(=O)CN(Cc2ccccc2)C(=O)[C@@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 114.6008492 | 41.35025811 | 0.0 | 35.93898261 | 5.893957685 | 114.1432901 | 19.49057905 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Bn_Gly', 'bHph', 'P', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.3173, 1.4060999999999997, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 111.6479212 | 52.80446978 | 5.893957685 | 150.8753008 | 90.63628061 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4553 | null | 177.33 | 5.15 | 526.9938984 | 0.0 | 106.7038307 | -9.483202979 | -7.667892525 | -34.89370762 | -68.48034991 | -46.49629519 | -39.50961427 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.26992809 | null |
28ba8a49e3734d68c59511978dbc013d0aba2441feadd55710acd41953b2fdd1 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,553 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Bn_Gly', 'Bn_Gly', 'P', 'Me_dL', 'F'] | 50 | 4554 | -6.12 | -6.12 | Circle | 1 | -1.35e-16 | -2.700157696 | -3.74e-17 | -2.847857839 | 3.2e-16 | -1.133982971 | 10.16028807 | -0.2481351 | 2.214857278 | 4758.997523 | 113.0 | null | null | 95.47520861 | 88.4882332 | 29.4882332 | 52.54059275 | 45.07182536 | 15.67739817 | 10.57558011 | 10.57558011 | 6.671976033 | 6.671976033 | 4.157876955 | 4.157876955 | null | null | null | null | 324.5296993 | 26.12657961 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 54.83034225 | 833.4475972 | 0.721311475 | 1.295081967 | 1.901639344 | 0.468085106 | 115.0 | PEPTIDE4554{P.[dA].[Bn_Gly].[Bn_Gly].P.[Me_dL].F}$PEPTIDE4554,PEPTIDE4554,1:R1-7:R2$$$ | PEPTIDE4554{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4554,PEPTIDE4554,1:R1-7:R2$$$ | -6.05 | 61 | 774.559 | 4554 | null | null | 6.45e+38 | 11.30372809 | 20.47536328 | 11.21331168 | 441.1503396 | null | 16.59122313 | 0.34279177 | 16.59122313 | 0.245675544 | 1.701347971 | 0.245675544 | -6.924607489 | -0.34279177 | 3.1449 | 228.8824 | 834.031 | Circle | 7 | 7 | null | 2 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 2 | 14 | 0 | 12 | 0 | 3 | 3 | 324 | hepta_977 | -6.12 | 5.01845645 | 2.754429476 | 35.11917536 | 43.08318171 | 2.823684157 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 104.3400648 | 61.30082878 | 79.08818867 | 38.38123957 | null | -6.12 | null | null | null | null | null | null | null | null | null | null | 6 | CC(C)C[C@@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(Cc2ccccc2)CC(=O)N(Cc2ccccc2)CC(=O)N2CCC[C@H]2C(=O)N1C | 114.5186821 | 41.35025811 | 0.0 | 35.11917536 | 5.893957685 | 101.8764075 | 32.96326564 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Bn_Gly', 'Bn_Gly', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.3173, 1.3173, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 29.1] | 10.61962671 | 0.0 | 0.0 | 0.0 | 128.9025347 | 52.92840456 | 5.893957685 | 147.243893 | 90.63628061 | 2.823684157 | 0.0 | 0 | 2020_Townsend | 4554 | null | 159.75 | 10.72 | 527.9051323 | 0.0 | 103.4453435 | -4.81864474 | -7.739210195 | -35.56176132 | -63.03269847 | -34.98548566 | -58.04600872 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 5 | 2 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.353104375 | null |
e4289200456f0f6bafe36eb4a4c32daba7364d40a5d6e2cbe91dc948584d0b47 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,554 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'meL', 'bHph', 'P', 'meL', 'F'] | 43 | 4555 | -5.49 | -5.49 | Circle | 3 | -1.75e-16 | -2.709034602 | -1.21e-16 | -2.861905174 | 1.9e-17 | -1.135201116 | 1.79e-15 | -0.249287763 | 2.590669938 | 4703.026224 | 137.0 | null | null | 100.511107 | 93.9882332 | 28.9882332 | 54.15384141 | 47.54543216 | 15.20379138 | 10.35197332 | 10.35197332 | 6.458447614 | 6.458447614 | 4.026885368 | 4.026885368 | null | null | null | null | 320.9047477 | 26.12657961 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.09597711 | 827.4945474 | 0.716666667 | 1.266666667 | 1.85 | 0.586956522 | 132.0 | PEPTIDE4555{P.[dA].[meL].[bHph].P.[meL].F}$PEPTIDE4555,PEPTIDE4555,1:R1-7:R2$$$ | PEPTIDE4555{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4555,PEPTIDE4555,1:R1-7:R2$$$ | -5.27 | 60 | 762.548 | 4555 | null | null | 1.0600000000000001e+42 | 10.32069879 | 20.80932391 | 11.50832527 | 446.1958641 | null | 16.64330519 | 0.35072394 | 16.64330519 | 0.245675544 | 1.818272126 | 0.245675544 | -7.046931905 | -0.35072394 | 3.078 | 227.8711 | 828.068 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 2 | 0 | 2 | 7 | 3 | 14 | 0 | 15 | 0 | 3 | 3 | 326 | hepta_978 | -5.49 | 3.537682361 | 0.910211429 | 35.52907898 | 36.10735481 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 87.83175555 | 74.37718478 | 107.3932505 | 23.30289545 | null | -5.49 | null | null | null | null | null | null | null | null | null | null | 5 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@H]2C(=O)N1C | 122.784317 | 41.35025811 | 0.0 | 35.52907898 | 11.78791537 | 133.741032 | 26.94537317 | 71.55109006 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'meL', 'bHph', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 130.0205175 | 46.30761009 | 11.78791537 | 174.9838684 | 60.42418708 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4555 | null | 168.54 | 38.26 | 580.1279665 | 0.0 | 105.2432742 | -7.708977233 | -5.511532598 | -43.20803588 | -68.58056847 | -55.01024477 | -51.93521512 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.367874367 | null |
103753e1231cfc8a94424b3d02044e300281ee8bcf429c00d066670976cf82b6 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,556 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Bn_Gly', 'bHph', 'P', 'Me_dL', 'F'] | 48 | 4557 | -6.09 | -6.09 | Circle | 5 | -1.35e-16 | -2.70089283 | -1.77e-18 | -2.852854607 | 3.63e-16 | -1.133984288 | 10.0892237 | -0.248136603 | 2.211747703 | 4878.402914 | 139.0 | null | null | 97.97520861 | 90.9882332 | 29.9882332 | 53.82926789 | 46.29543216 | 15.95379138 | 10.72697332 | 10.72697332 | 6.719916578 | 6.719916578 | 4.2168207 | 4.2168207 | null | null | null | null | 330.7096259 | 28.90918025 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 54.83034225 | 847.4632473 | 0.758064516 | 1.370967742 | 2.0 | 0.479166667 | 136.0 | PEPTIDE4557{P.[dA].[Bn_Gly].[bHph].P.[Me_dL].F}$PEPTIDE4557,PEPTIDE4557,1:R1-7:R2$$$ | PEPTIDE4557{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4557,PEPTIDE4557,1:R1-7:R2$$$ | -6.05 | 62 | 786.57 | 4557 | null | null | 1.0699999999999999e+41 | 11.35983112 | 21.15492169 | 11.64916291 | 450.1733078 | null | 16.64675633 | 0.350975417 | 16.64675633 | 0.245675544 | 1.697143895 | 0.245675544 | -6.967678589 | -0.350975417 | 3.2337 | 233.7171 | 848.058 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 3 | 14 | 0 | 12 | 0 | 3 | 3 | 330 | hepta_980 | -6.09 | 4.633831034 | 2.785499714 | 35.52907898 | 30.08946234 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 104.3400648 | 67.67375369 | 90.46518058 | 40.76582359 | null | -6.09 | null | null | null | null | null | null | null | null | null | null | 6 | CC(C)C[C@@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@H]2C(=O)N1C | 117.3012828 | 41.35025811 | 0.0 | 35.52907898 | 5.893957685 | 114.1432901 | 26.46640595 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Bn_Gly', 'bHph', 'P', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.3173, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 52.80446978 | 5.893957685 | 154.9875765 | 90.63628061 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4557 | null | 168.54 | 11.34 | 547.1501562 | 0.0 | 105.2625283 | -7.174236422 | -7.803211985 | -35.72892063 | -69.80561671 | -47.37550075 | -46.10853134 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.313081439 | null |
f6d5717c230ab8fe4a223c1dfcb93f61544a5b2afe55a6c3d0838b022b9e6c77 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,557 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'dA', 'Bn_Gly', 'bHph', 'P', 'meL', 'F'] | 46 | 4558 | -5.32 | -5.32 | Circle | 4 | -1.35e-16 | -2.70089283 | -1.77e-18 | -2.852854607 | 3.63e-16 | -1.133984288 | 10.0892237 | -0.248136603 | 2.211747703 | 4878.402914 | 128.0 | null | null | 97.97520861 | 90.9882332 | 29.9882332 | 53.82926789 | 46.29543216 | 15.95379138 | 10.72697332 | 10.72697332 | 6.719916578 | 6.719916578 | 4.2168207 | 4.2168207 | null | null | null | null | 330.7096259 | 28.90918025 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 54.83034225 | 847.4632473 | 0.758064516 | 1.370967742 | 2.0 | 0.479166667 | 134.0 | PEPTIDE4558{P.[dA].[Bn_Gly].[bHph].P.[meL].F}$PEPTIDE4558,PEPTIDE4558,1:R1-7:R2$$$ | PEPTIDE4558{<a href="/monomers/P/">P</a>.<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/Bn_Gly/">[Bn_Gly]</a>.<a href="/monomers/bHph/">[bHph]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4558,PEPTIDE4558,1:R1-7:R2$$$ | -6.05 | 62 | 786.57 | 4558 | null | null | 1.0699999999999999e+41 | 11.35983112 | 21.15492169 | 11.64916291 | 450.1733078 | null | 16.64675633 | 0.350975417 | 16.64675633 | 0.245675544 | 1.697143895 | 0.245675544 | -6.967678589 | -0.350975417 | 3.2337 | 233.7171 | 848.058 | Circle | 7 | 7 | null | 3 | 14 | null | null | 0 | 3 | 3 | 3 | 0 | 3 | 7 | 3 | 14 | 0 | 12 | 0 | 3 | 3 | 330 | hepta_981 | -5.32 | 4.633831034 | 2.785499714 | 35.52907898 | 30.08946234 | 4.235526235 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 104.3400648 | 67.67375369 | 90.46518058 | 40.76582359 | null | -5.32 | null | null | null | null | null | null | null | null | null | null | 6 | CC(C)C[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@H](C)C(=O)N(Cc2ccccc2)CC(=O)N[C@@H](Cc2ccccc2)CC(=O)N2CCC[C@H]2C(=O)N1C | 117.3012828 | 41.35025811 | 0.0 | 35.52907898 | 5.893957685 | 114.1432901 | 26.46640595 | 107.3266351 | 0 | 0.0 | null | null | null | null | ['P', 'dA', 'Bn_Gly', 'bHph', 'P', 'meL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.3173, 1.4060999999999997, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 29.1] | 15.92944006 | 0.0 | 0.0 | 0.0 | 123.5236578 | 52.80446978 | 5.893957685 | 154.9875765 | 90.63628061 | 4.235526235 | 0.0 | 0 | 2020_Townsend | 4558 | null | 168.54 | 51.17 | 547.1501562 | 0.0 | 105.2625283 | -7.174236422 | -7.803211985 | -35.72892063 | -69.80561671 | -47.37550075 | -46.10853134 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 4 | 3 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.313081439 | null |
5d2364cd66ebba61f7259a313465029eb91ba2d7f60ed52fe42bbe734dbf9c76 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,558 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'A', 'dL', 'dL', 'dP', 'dL', 'F'] | 39 | 4559 | -10.0 | -10 | Circle | 5 | -1.71e-16 | -2.703775545 | -1.63e-16 | -2.868550446 | -3.46e-17 | -1.135354484 | 9.33e-16 | -0.249287767 | 2.927614811 | 4086.295672 | 150.0 | null | null | 93.04700538 | 86.9882332 | 25.9882332 | 49.5557652 | 43.74264576 | 13.50657778 | 9.15475972 | 9.15475972 | 5.508992172 | 5.508992172 | 3.447737573 | 3.447737573 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 285.2221731 | 20.68462891 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 751.4632473 | 0.685185185 | 1.12962963 | 1.648148148 | 0.675 | 148.0 | PEPTIDE4559{P.A.[dL].[dL].[dP].[dL].F}$PEPTIDE4559,PEPTIDE4559,1:R1-7:R2$$$ | PEPTIDE4559{<a href="/monomers/P/">P</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4559,PEPTIDE4559,1:R1-7:R2$$$ | -4.49 | 54 | 690.482 | 4559 | null | null | 7.15e+36 | 9.042473157 | 19.20403085 | 11.26626648 | 405.2150582 | null | 16.36228882 | 0.342800051 | 16.36228882 | 0.245675543 | 1.761202119 | 0.245675543 | -6.903059693 | -0.342800051 | 1.8069 | 203.3085 | 751.97 | Circle | 7 | 7 | null | 5 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 5 | 14 | 0 | 15 | 0 | 3 | 3 | 298 | hepta_982 | -10.0 | 3.334617113 | -0.672073818 | 36.34888623 | 42.12524728 | 7.059210392 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 79.68002074 | 16.44910267 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H]2CCCN2C(=O)[C@@H](CC(C)C)NC1=O | 117.3834498 | 41.35025811 | 0.0 | 36.34888623 | 17.68187306 | 141.0718913 | 12.99371937 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'A', 'dL', 'dL', 'dP', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 29.1, 29.1] | 26.54906677 | 0.0 | 0.0 | 0.0 | 106.2690442 | 39.93468519 | 17.68187306 | 174.8996498 | 30.21209354 | 7.059210392 | 0.0 | 0 | 2020_Townsend | 4559 | null | 186.12 | 0.0 | 533.5850221 | 0.0 | 107.7483742 | -12.77259244 | -2.653830334 | -48.24117052 | -56.38575167 | -47.91502434 | -49.94836025 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 2 | 5 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.268210792 | null |
1cea34c405967f1360bbcb4805bdc26fcc0e6e8dd4efecf1f8e73e94e6dcca93 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,559 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'A', 'L', 'dL', 'dP', 'dL', 'F'] | 38 | 4560 | -6.69 | -6.69 | Circle | 7 | -1.71e-16 | -2.703775545 | -1.63e-16 | -2.868550446 | -3.46e-17 | -1.135354484 | 9.33e-16 | -0.249287767 | 2.927614811 | 4086.295672 | 143.0 | null | null | 93.04700538 | 86.9882332 | 25.9882332 | 49.5557652 | 43.74264576 | 13.50657778 | 9.15475972 | 9.15475972 | 5.508992172 | 5.508992172 | 3.447737573 | 3.447737573 | null | null | null | null | 285.2221731 | 20.68462891 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 751.4632473 | 0.685185185 | 1.12962963 | 1.648148148 | 0.675 | 141.0 | PEPTIDE4560{P.A.L.[dL].[dP].[dL].F}$PEPTIDE4560,PEPTIDE4560,1:R1-7:R2$$$ | PEPTIDE4560{<a href="/monomers/P/">P</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4560,PEPTIDE4560,1:R1-7:R2$$$ | -4.49 | 54 | 690.482 | 4560 | null | null | 7.15e+36 | 9.042473157 | 19.20403085 | 11.26626648 | 405.2150582 | null | 16.36228882 | 0.342800051 | 16.36228882 | 0.245675543 | 1.761202119 | 0.245675543 | -6.903059693 | -0.342800051 | 1.8069 | 203.3085 | 751.97 | Circle | 7 | 7 | null | 5 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 5 | 14 | 0 | 15 | 0 | 3 | 3 | 298 | hepta_983 | -6.69 | 3.334617113 | -0.672073818 | 36.34888623 | 42.12524728 | 7.059210392 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 79.68002074 | 16.44910267 | null | -6.69 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H]2CCCN2C(=O)[C@@H](CC(C)C)NC1=O | 117.3834498 | 41.35025811 | 0.0 | 36.34888623 | 17.68187306 | 141.0718913 | 12.99371937 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'A', 'L', 'dL', 'dP', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 29.1, 29.1] | 26.54906677 | 0.0 | 0.0 | 0.0 | 106.2690442 | 39.93468519 | 17.68187306 | 174.8996498 | 30.21209354 | 7.059210392 | 0.0 | 0 | 2020_Townsend | 4560 | null | 186.12 | 2.99 | 533.5850221 | 0.0 | 107.7483742 | -12.77259244 | -2.653830334 | -48.24117052 | -56.38575167 | -47.91502434 | -49.94836025 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 2 | 5 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.268210792 | null |
d7ce0b1862823d5845215cf2841024e15a9a796bbc39e4f449bfab81290b102c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,560 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'A', 'dL', 'dL', 'dP', 'L', 'F'] | 38 | 4561 | -6.59 | -6.59 | Circle | 9 | -2.19e-16 | -2.703775545 | -1.88e-16 | -2.868550446 | -7.78e-17 | -1.135354484 | 7.86e-16 | -0.249287767 | 2.927614811 | 4086.295672 | 147.0 | null | null | 93.04700538 | 86.9882332 | 25.9882332 | 49.5557652 | 43.74264576 | 13.50657778 | 9.15475972 | 9.15475972 | 5.508992172 | 5.508992172 | 3.447737573 | 3.447737573 | null | null | null | null | 285.2221731 | 20.68462891 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 751.4632473 | 0.685185185 | 1.12962963 | 1.648148148 | 0.675 | 147.0 | PEPTIDE4561{P.A.[dL].[dL].[dP].L.F}$PEPTIDE4561,PEPTIDE4561,1:R1-7:R2$$$ | PEPTIDE4561{<a href="/monomers/P/">P</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4561,PEPTIDE4561,1:R1-7:R2$$$ | -4.49 | 54 | 690.482 | 4561 | null | null | 1.56e+36 | 9.042473157 | 19.20403085 | 11.26626648 | 405.2150582 | null | 16.36228882 | 0.342800051 | 16.36228882 | 0.245675543 | 1.761202119 | 0.245675543 | -6.903059693 | -0.342800051 | 1.8069 | 203.3085 | 751.97 | Circle | 7 | 7 | null | 5 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 5 | 14 | 0 | 15 | 0 | 3 | 3 | 298 | hepta_984 | -6.59 | 3.334617113 | -0.672073818 | 36.34888623 | 42.12524728 | 7.059210392 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 79.68002074 | 16.44910267 | null | -6.59 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 117.3834498 | 41.35025811 | 0.0 | 36.34888623 | 17.68187306 | 141.0718913 | 12.99371937 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'A', 'dL', 'dL', 'dP', 'L', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 29.1, 29.1] | 26.54906677 | 0.0 | 0.0 | 0.0 | 106.2690442 | 39.93468519 | 17.68187306 | 174.8996498 | 30.21209354 | 7.059210392 | 0.0 | 0 | 2020_Townsend | 4561 | null | 186.12 | 3.74 | 533.5850221 | 0.0 | 107.7483742 | -12.77259244 | -2.653830334 | -48.24117052 | -56.38575167 | -47.91502434 | -49.94836025 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 2 | 5 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.268210792 | null |
ab61b2fc56adcfc7b537616b19450a148dae1c0fea41bed1d66197679d2277a0 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,561 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'A', 'L', 'dL', 'dP', 'L', 'F'] | 37 | 4562 | -10.0 | -10 | Circle | 2 | -1.71e-16 | -2.703775545 | -1.63e-16 | -2.868550446 | -3.46e-17 | -1.135354484 | 9.33e-16 | -0.249287767 | 2.927614811 | 4086.295672 | 153.0 | null | null | 93.04700538 | 86.9882332 | 25.9882332 | 49.5557652 | 43.74264576 | 13.50657778 | 9.15475972 | 9.15475972 | 5.508992172 | 5.508992172 | 3.447737573 | 3.447737573 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 285.2221731 | 20.68462891 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 751.4632473 | 0.685185185 | 1.12962963 | 1.648148148 | 0.675 | 147.0 | PEPTIDE4562{P.A.L.[dL].[dP].L.F}$PEPTIDE4562,PEPTIDE4562,1:R1-7:R2$$$ | PEPTIDE4562{<a href="/monomers/P/">P</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4562,PEPTIDE4562,1:R1-7:R2$$$ | -4.49 | 54 | 690.482 | 4562 | null | null | 7.15e+36 | 9.042473157 | 19.20403085 | 11.26626648 | 405.2150582 | null | 16.36228882 | 0.342800051 | 16.36228882 | 0.245675543 | 1.761202119 | 0.245675543 | -6.903059693 | -0.342800051 | 1.8069 | 203.3085 | 751.97 | Circle | 7 | 7 | null | 5 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 5 | 14 | 0 | 15 | 0 | 3 | 3 | 298 | hepta_985 | -10.0 | 3.334617113 | -0.672073818 | 36.34888623 | 42.12524728 | 7.059210392 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 79.68002074 | 16.44910267 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H]2CCCN2C(=O)[C@@H](CC(C)C)NC1=O | 117.3834498 | 41.35025811 | 0.0 | 36.34888623 | 17.68187306 | 141.0718913 | 12.99371937 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'A', 'L', 'dL', 'dP', 'L', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 29.1, 29.1] | 26.54906677 | 0.0 | 0.0 | 0.0 | 106.2690442 | 39.93468519 | 17.68187306 | 174.8996498 | 30.21209354 | 7.059210392 | 0.0 | 0 | 2020_Townsend | 4562 | null | 186.12 | 0.0 | 533.5850221 | 0.0 | 107.7483742 | -12.77259244 | -2.653830334 | -48.24117052 | -56.38575167 | -47.91502434 | -49.94836025 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 2 | 5 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.268210792 | null |
de72158aad190dc1e40ea5b5c128b7744e9786c482666ec98cc426071e28cb23 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,563 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'A', 'dL', 'Me_dL', 'dP', 'dL', 'F'] | 42 | 4564 | -10.0 | -10 | Circle | 7 | -1.6e-16 | -2.71822073 | -1.69e-16 | -2.85880215 | -4.13e-17 | -1.135756562 | 1.02e-15 | -0.249287767 | 2.995363505 | 4193.826765 | 132.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 291.7880964 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 765.4788974 | 0.727272727 | 1.272727273 | 1.872727273 | 0.682926829 | 131.0 | PEPTIDE4564{P.A.[dL].[Me_dL].[dP].[dL].F}$PEPTIDE4564,PEPTIDE4564,1:R1-7:R2$$$ | PEPTIDE4564{<a href="/monomers/P/">P</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4564,PEPTIDE4564,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4564 | null | null | 2.69e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.67895549 | 0.342800051 | 16.67895549 | 0.245675543 | 1.779090538 | 0.245675543 | -7.189518026 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_987 | -10.0 | 3.308584281 | -0.576066595 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1NC(=O)[C@H]2CCCN2C(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'A', 'dL', 'Me_dL', 'dP', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4564 | null | 177.33 | 0.0 | 553.7509136 | 0.0 | 106.1505978 | -10.29883042 | -2.679142125 | -49.2617999 | -57.37730347 | -48.66999408 | -56.94777475 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
c9059eec749a1bead7b3dd9bf7317f2be71f2f781f4afdbd26b9ccc68ebde8dc | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,565 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'A', 'dL', 'Me_dL', 'dP', 'L', 'F'] | 41 | 4566 | -10.0 | -10 | Circle | 6 | -1.6e-16 | -2.71822073 | -1.69e-16 | -2.85880215 | -4.13e-17 | -1.135756562 | 1.02e-15 | -0.249287767 | 2.995363505 | 4193.826765 | 121.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | 0 (x 10^-6 cm/s) is the value described in the original paper (permeability was set to -10 by CycPeptMPDB) | null | null | 291.7880964 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 765.4788974 | 0.727272727 | 1.272727273 | 1.872727273 | 0.682926829 | 116.0 | PEPTIDE4566{P.A.[dL].[Me_dL].[dP].L.F}$PEPTIDE4566,PEPTIDE4566,1:R1-7:R2$$$ | PEPTIDE4566{<a href="/monomers/P/">P</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4566,PEPTIDE4566,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4566 | null | null | 2.69e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.67895549 | 0.342800051 | 16.67895549 | 0.245675543 | 1.779090538 | 0.245675543 | -7.189518026 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_989 | -10.0 | 3.308584281 | -0.576066595 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -10.0 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@@H](CC(C)C)N(C)C(=O)[C@@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'A', 'dL', 'Me_dL', 'dP', 'L', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4566 | null | 177.33 | 0.0 | 553.7509136 | 0.0 | 106.1505978 | -10.29883042 | -2.679142125 | -49.2617999 | -57.37730347 | -48.66999408 | -56.94777475 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
cdb8f3b312e9aeb5198575a1978eee85ced02ccda5e01f50a59266f7991d112c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,566 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'A', 'L', 'dL', 'dP', 'Me_dL', 'F'] | 41 | 4567 | -6.36 | -6.36 | Circle | 3 | -1.66e-16 | -2.707729398 | -1.77e-16 | -2.867758643 | -7.07e-17 | -1.135354896 | 8.92e-16 | -0.249287767 | 3.001926314 | 4193.826765 | 128.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 20.64354539 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.87857774 | 765.4788974 | 0.727272727 | 1.290909091 | 1.927272727 | 0.682926829 | 125.0 | PEPTIDE4567{P.A.L.[dL].[dP].[Me_dL].F}$PEPTIDE4567,PEPTIDE4567,1:R1-7:R2$$$ | PEPTIDE4567{<a href="/monomers/P/">P</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4567,PEPTIDE4567,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4567 | null | null | 1.89e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.57926341 | 0.342800051 | 16.57926341 | 0.245675544 | 1.799654828 | 0.245675544 | -7.070537473 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_990 | -6.36 | 3.354277628 | -0.648005228 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -6.36 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@H]2CCCN2C(=O)[C@@H](CC(C)C)NC1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'A', 'L', 'dL', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 20.31, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4567 | null | 177.33 | 6.31 | 553.7509106 | 0.0 | 106.2357284 | -10.38396106 | -2.718693374 | -49.19597155 | -57.51086548 | -48.75620396 | -56.75427693 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
c2727dc5f2fd696f0c1efce980c08e0284a9b67bc6ae936d5fa2b1e6c2458dcd | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,567 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'A', 'Me_dL', 'dL', 'dP', 'L', 'F'] | 41 | 4568 | -6.54 | -6.54 | Circle | 4 | -2.34e-16 | -2.713832687 | -1.45e-16 | -2.86126448 | -4.16e-17 | -1.135672081 | 1.3e-15 | -0.249287767 | 2.991194867 | 4193.826765 | 138.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 24.79690458 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 61.72521855 | 765.4788974 | 0.727272727 | 1.254545455 | 1.836363636 | 0.682926829 | 132.0 | PEPTIDE4568{P.A.[Me_dL].[dL].[dP].L.F}$PEPTIDE4568,PEPTIDE4568,1:R1-7:R2$$$ | PEPTIDE4568{<a href="/monomers/P/">P</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4568,PEPTIDE4568,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4568 | null | null | 5.589999999999999e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.49495665 | 0.342792017 | 16.49495665 | 0.245675543 | 1.783597952 | 0.245675543 | -7.061202372 | -0.342792017 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_991 | -6.54 | 3.37752281 | -0.577275551 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -6.54 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'A', 'Me_dL', 'dL', 'dP', 'L', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4568 | null | 177.33 | 4.21 | 553.4160707 | 0.0 | 106.304084 | -10.45231669 | -2.686960265 | -49.20040395 | -57.40539764 | -48.56969111 | -56.7387184 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
6873e078f357e26fa94d0289d0b49a0d761b8c3db1e277c5dc7d18855504e637 | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,568 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'A', 'dL', 'L', 'dP', 'Me_dL', 'F'] | 41 | 4569 | -6.12 | -6.12 | Circle | 6 | -2.14e-16 | -2.707729398 | -1.81e-16 | -2.867758643 | -1.5e-16 | -1.135354896 | 9.56e-16 | -0.249287767 | 3.001926314 | 4193.826765 | 137.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 20.64354539 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 65.87857774 | 765.4788974 | 0.727272727 | 1.290909091 | 1.927272727 | 0.682926829 | 123.0 | PEPTIDE4569{P.A.[dL].L.[dP].[Me_dL].F}$PEPTIDE4569,PEPTIDE4569,1:R1-7:R2$$$ | PEPTIDE4569{<a href="/monomers/P/">P</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4569,PEPTIDE4569,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4569 | null | null | 6.35e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.57926341 | 0.342800051 | 16.57926341 | 0.245675544 | 1.799654828 | 0.245675544 | -7.070537473 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_992 | -6.12 | 3.354277628 | -0.648005228 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -6.12 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@H]2CCCN2C1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'A', 'dL', 'L', 'dP', 'Me_dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 0.2794999999999998, 1.1616, 1.0159999999999998] | [20.31, 29.1, 29.1, 29.1, 20.31, 20.31, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4569 | null | 177.33 | 10.77 | 553.7509106 | 0.0 | 106.2357284 | -10.38396106 | -2.718693374 | -49.19597155 | -57.51086548 | -48.75620396 | -56.75427693 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
714fd681dd0d3dfd340146b4196873eec342cf011ebe82ac58af6a4401127f2c | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,569 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'A', 'Me_dL', 'L', 'dP', 'dL', 'F'] | 41 | 4570 | -5.92 | -5.92 | Circle | 1 | -2.34e-16 | -2.713832687 | -1.43e-16 | -2.86126448 | -9.9e-17 | -1.135672081 | 9.24e-16 | -0.249287767 | 2.991194867 | 4193.826765 | 120.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 24.79690458 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 61.72521855 | 765.4788974 | 0.727272727 | 1.254545455 | 1.836363636 | 0.682926829 | 120.0 | PEPTIDE4570{P.A.[Me_dL].L.[dP].[dL].F}$PEPTIDE4570,PEPTIDE4570,1:R1-7:R2$$$ | PEPTIDE4570{<a href="/monomers/P/">P</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4570,PEPTIDE4570,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4570 | null | null | 8.38e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.49495665 | 0.342792017 | 16.49495665 | 0.245675543 | 1.783597952 | 0.245675543 | -7.061202372 | -0.342792017 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_993 | -5.92 | 3.37752281 | -0.577275551 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -5.92 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@@H](CC(C)C)N(C)C(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H]2CCCN2C1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'A', 'Me_dL', 'L', 'dP', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 1.1616, 0.8193999999999995, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 20.31, 29.1, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4570 | null | 177.33 | 16.33 | 553.4160707 | 0.0 | 106.304084 | -10.45231669 | -2.686960265 | -49.20040395 | -57.40539764 | -48.56969111 | -56.7387184 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
87fe65db60bf5e82e17ecbc8345f2c4734cdff39078ecbcfc103973d9831eaff | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,570 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'A', 'dL', 'meL', 'dP', 'dL', 'F'] | 40 | 4571 | -5.92 | -5.92 | Circle | 5 | -2.16e-16 | -2.71822073 | -1.49e-16 | -2.85880215 | -9.2e-17 | -1.135756562 | 1.09e-15 | -0.249287767 | 2.995363505 | 4193.826765 | 141.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 765.4788974 | 0.727272727 | 1.272727273 | 1.872727273 | 0.682926829 | 137.0 | PEPTIDE4571{P.A.[dL].[meL].[dP].[dL].F}$PEPTIDE4571,PEPTIDE4571,1:R1-7:R2$$$ | PEPTIDE4571{<a href="/monomers/P/">P</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4571,PEPTIDE4571,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4571 | null | null | 1.13e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.67895549 | 0.342800051 | 16.67895549 | 0.245675543 | 1.779090538 | 0.245675543 | -7.189518026 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_994 | -5.92 | 3.308584281 | -0.576066595 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -5.92 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@H]1C(=O)N2CCC[C@@H]2C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCC[C@H]2C(=O)N[C@@H](C)C(=O)N[C@H](CC(C)C)C(=O)N1C | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'A', 'dL', 'meL', 'dP', 'dL', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4571 | null | 177.33 | 16.53 | 553.7509136 | 0.0 | 106.1505978 | -10.29883042 | -2.679142125 | -49.2617999 | -57.37730347 | -48.66999408 | -56.94777475 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
ca86b75df6cc0dd650c8dcef7d8424a8855787cf74733f517ba24e962354939a | cycpeptmpdb | peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv | tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl | 4,571 | all | CycPeptMPDB | CycPeptMPDB_Peptide_All | peptide | CycPeptMPDB_Peptide_All | ['P', 'A', 'L', 'Me_dL', 'dP', 'L', 'F'] | 40 | 4572 | -5.24 | -5.24 | Circle | 6 | -1.6e-16 | -2.71822073 | -1.69e-16 | -2.85880215 | -4.13e-17 | -1.135756562 | 1.02e-15 | -0.249287767 | 2.995363505 | 4193.826765 | 119.0 | null | null | 95.54700538 | 89.4882332 | 26.4882332 | 50.76709006 | 45.01903896 | 13.73018458 | 9.378366518 | 9.378366518 | 5.722340816 | 5.722340816 | 3.576461046 | 3.576461046 | null | null | null | null | 291.7880964 | 23.3850625 | 33.56176029 | 0 | 0 | 0 | 0 | 0 | 0 | 0.0 | 63.13706063 | 765.4788974 | 0.727272727 | 1.272727273 | 1.872727273 | 0.682926829 | 118.0 | PEPTIDE4572{P.A.L.[Me_dL].[dP].L.F}$PEPTIDE4572,PEPTIDE4572,1:R1-7:R2$$$ | PEPTIDE4572{<a href="/monomers/P/">P</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Me_dL/">[Me_dL]</a>.<a href="/monomers/dP/">[dP]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>}$PEPTIDE4572,PEPTIDE4572,1:R1-7:R2$$$ | -4.49 | 55 | 702.493 | 4572 | null | null | 2.69e+37 | 9.12088157 | 19.39277693 | 11.28572685 | 414.5418561 | null | 16.67895549 | 0.342800051 | 16.67895549 | 0.245675543 | 1.779090538 | 0.245675543 | -7.189518026 | -0.342800051 | 2.1491 | 207.9358 | 765.997 | Circle | 7 | 7 | null | 4 | 14 | null | null | 0 | 3 | 3 | 1 | 0 | 1 | 7 | 4 | 14 | 0 | 16 | 0 | 3 | 3 | 304 | hepta_995 | -5.24 | 3.308584281 | -0.576066595 | 35.93898261 | 42.12524728 | 5.647368313 | 41.35025811 | 0.0 | 0.0 | 33.56176029 | 0.0 | 0.0 | 0.0 | 71.32344624 | 74.70769097 | 90.76812331 | 16.44910267 | null | -5.24 | null | null | null | null | null | null | null | null | null | null | 4 | CC(C)C[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O | 120.0838834 | 41.35025811 | 0.0 | 35.93898261 | 17.68187306 | 141.0718913 | 19.96954627 | 35.77554503 | 0 | 0.0 | null | null | null | null | ['P', 'A', 'L', 'Me_dL', 'dP', 'L', 'F'] | [0.2794999999999998, -0.2068000000000003, 0.8193999999999995, 1.1616, 0.2794999999999998, 0.8193999999999995, 1.0159999999999998] | [20.31, 29.1, 29.1, 20.31, 20.31, 29.1, 29.1] | 21.23925341 | 0.0 | 0.0 | 0.0 | 118.1447808 | 39.93468519 | 17.68187306 | 179.0119254 | 30.21209354 | 5.647368313 | 0.0 | 0 | 2020_Townsend | 4572 | null | 177.33 | 57.91 | 553.7509136 | 0.0 | 106.1505978 | -10.29883042 | -2.679142125 | -49.2617999 | -57.37730347 | -48.66999408 | -56.94777475 | 0.0 | 1.0 | 2020 | null | null | null | null | null | null | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 7 | 0 | 0 | 0 | 3 | 4 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 7 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.3135853 | null |
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