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9f5d804af2572aff31a6a4c5e0c685bac4fca64c03c905de5168a40f1926b494
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
498
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['meA', 'meV', 'I', 'F', 'T', 'L', 'meL', 'meF', 'L', 'D', '-pip']
66
499
-5.21
-5.21
Lariat
6
-2.57e-16
-2.757665006
-2.38e-16
-2.904472539
-1.3e-16
-1.135773548
8.14e-16
-0.249287767
3.55167323
7402.023056
225.0
null
null
158.3370159
148.318329
43.31832904
83.93736301
74.07840315
21.98687328
14.86834851
14.86834851
8.93217055
8.93217055
5.261989234
5.261989234
null
null
null
null
475.4662084
50.96456771
52.73990902
0
0
0
0
0
0
5.108808191
93.27202292
1255.794418
0.6
1.166666667
1.744444444
0.656716418
206.0
PEPTIDE499{[meA].[meV].I.F.T.L.[meL].[meF].L.D.[-pip]}$PEPTIDE499,PEPTIDE499,1:R1-10:R3$$$
PEPTIDE499{<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meV/">[meV]</a>.<a href="/monomers/I/">I</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/D/">D...
-7.43
90
1150.802
499
null
null
1.3500000000000001e+73
15.12774312
35.24591726
21.35116938
681.1748822
null
18.01823117
0.390716897
18.01823117
0.245419315
2.173398983
0.245419315
-8.155882946
-0.390716897
3.3459
343.169
1256.642
Lariat
11
10
null
7
23
null
null
0
2
2
2
0
2
12
7
23
0
32
0
2
2
500
DP-488
-5.21
-5.798400205
2.708799463
61.46723697
60.17892468
8.47105247
66.41017668
0.0
0.0
52.73990902
0.0
0.0
0.0
135.3160332
92.53802505
159.1912856
41.23887261
null
-5.21
null
null
null
null
null
null
null
null
null
null
4
CC[C@H](C)[C@@H]1NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C)N(C)C(=O)C[C@@H](C(=O)N2CCCCC2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC1=O
200.6541082
64.97897702
1.431199657
56.35842877
29.46978843
212.2108971
40.89702697
71.55109006
0
0.0
[['Caco2']]
[7744]
[['-6.11']]
['2023_Ohta']
['meA', 'meV', 'I', 'F', 'T', 'L', 'meL', 'meF', 'L', 'D', '-pip']
[0.1353999999999999, 0.7715000000000001, 0.8193999999999999, 1.0159999999999998, -0.1918000000000002, 0.8193999999999995, 1.1616, 1.3581999999999996, 0.8193999999999995, -0.6377000000000004, 1.1021]
[20.31, 20.31, 29.1, 29.1, 38.33, 29.1, 20.31, 20.31, 29.1, 46.17, 3.24]
31.85888012
0.0
0.0
0.0
203.1745032
65.48575883
29.46978843
278.6673461
60.42418708
8.47105247
0.0
0
2013_CHUGAI
499
null
296.38
null
953.5423368
0.0
175.495815
-15.95353213
-6.667075719
-92.55014673
-103.9007676
-74.05693336
-115.0763629
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
11
11
0
0
0
5
6
0
0
4
1
0
0
0
0
0
0
11
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.135209581
null
f3c93fd793f0ebcf415aec8d87212a76358b564ddd8c1e10e7a2ea78bd4e73a7
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
500
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_Bal', 'F', 'meV', 'meA', 'T', 'meA', 'meL', 'I', 'meA', 'D', 'meF', 'A', '-pip']
85
501
-4.96
-4.96
Lariat
7
-2.67e-16
-2.756681043
-1.77e-16
-2.884633619
-4.79e-17
-1.134209404
1.79e-15
-0.249284436
3.407272316
7922.594513
215.0
null
null
167.146417
155.5292528
46.52925281
88.70210589
77.60468542
23.46036916
15.95849102
15.95849102
9.765717693
9.765717693
5.50161231
5.50161231
null
null
null
null
505.0999841
44.06969141
62.32898339
0
0
0
0
0
0
5.108808191
105.6088499
1355.821695
0.701030928
1.329896907
1.907216495
0.642857143
211.0
PEPTIDE501{[Me_Bal].F.[meV].[meA].T.[meA].[meL].I.[meA].D.[meF].A.[-pip]}$PEPTIDE501,PEPTIDE501,1:R1-10:R3$$$
PEPTIDE501{<a href="/monomers/Me_Bal/">[Me_Bal]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meV/">[meV]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/I/">I</a>.<a href="/monomers/meA/">[meA]</a>.<a hre...
-8.49
97
1246.847
501
null
null
1.64e+79
16.85914844
37.29864028
22.0085681
725.8842169
null
17.79653092
0.390716755
17.79653092
0.247752851
2.062872511
0.247752851
-8.123471554
-0.390716755
1.3311
364.7203
1356.719
Lariat
13
10
null
6
27
null
null
0
2
2
2
0
2
14
6
27
0
34
0
2
2
538
DP-490
-4.96
-5.752935931
2.880045979
70.8571528
66.19681715
7.059210392
78.22453614
0.0
0.0
62.32898339
0.0
0.0
0.0
107.9084647
88.55993623
198.4715851
42.60963116
null
-4.96
null
null
null
null
null
null
null
null
null
null
4
CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)CCN(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H](C)N(C)C1=O
215.6851333
76.79333648
1.431199657
65.74834461
17.68187306
205.0039726
68.32136735
71.55109006
0
0.0
null
null
null
null
['Me_Bal', 'F', 'meV', 'meA', 'T', 'meA', 'meL', 'I', 'meA', 'D', 'meF', 'A', '-pip']
[0.1369999999999998, 1.0159999999999998, 0.7715000000000001, 0.1353999999999999, -0.1918000000000002, 0.1353999999999999, 1.1616, 0.8193999999999999, 0.1353999999999999, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 29.1, 20.31, 20.31, 38.33, 20.31, 20.31, 29.1, 20.31, 46.17, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
263.1308247
75.0748332
17.68187306
272.2963219
60.42418708
7.059210392
0.0
0
2013_CHUGAI
501
null
328.21
null
980.4532228
0.0
197.1463419
-12.12916514
-6.392863894
-87.46575836
-108.2971393
-64.55506314
-135.3429082
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
13
13
0
0
0
8
5
0
0
6
1
0
0
0
0
0
0
13
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.146680436
null
7be9c298122a94d8469f624c3fc53dcfa4a5f76ca9fabe0249652a16eff0c67c
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
501
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dA', 'I', 'meA', 'meV', 'T', 'meA', 'meL', 'A', 'meF', 'D', 'meF', 'A', '-pip']
81
502
-4.74
-4.74
Lariat
8
-1.89e-16
-2.756675824
-1.36e-16
-2.886181569
-1.27e-16
-1.134192354
1.88e-15
-0.249284431
3.424153996
7804.021842
251.0
null
null
164.646417
153.0292528
46.02925281
87.49078102
76.32829222
23.23676236
15.84668762
15.84668762
9.703914294
9.703914294
5.521483233
5.521483233
null
null
null
null
498.5340609
41.36925782
62.32898339
0
0
0
0
0
0
5.108808191
105.6088499
1341.806045
0.677083333
1.291666667
1.854166667
0.637681159
250.0
PEPTIDE502{[dA].I.[meA].[meV].T.[meA].[meL].A.[meF].D.[meF].A.[-pip]}$PEPTIDE502,PEPTIDE502,1:R1-10:R3$$$
PEPTIDE502{<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/I/">I</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meV/">[meV]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/mono...
-8.49
96
1234.836
502
null
null
3.8199999999999995e+77
16.78850908
36.57485132
21.2540874
716.557419
null
17.92840692
0.390716755
17.92840692
0.247752854
2.058703333
0.247752854
-8.130572442
-0.390716755
0.9873
360.071
1342.692
Lariat
13
10
null
7
27
null
null
0
2
2
2
0
2
14
7
27
0
34
0
2
2
532
DP-491
-4.74
-5.985484185
2.788050645
71.26705643
72.21470962
8.47105247
78.22453614
0.0
0.0
62.32898339
0.0
0.0
0.0
107.9084647
95.41182835
173.1429394
43.98038972
null
-4.74
null
null
null
null
null
null
null
null
null
null
4
CC[C@H](C)[C@@H]1NC(=O)[C@@H](C)NC(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C)N(C)C1=O
212.9846997
76.79333648
1.431199657
66.15824824
17.68187306
211.5008323
54.84868077
71.55109006
0
0.0
null
null
null
null
['dA', 'I', 'meA', 'meV', 'T', 'meA', 'meL', 'A', 'meF', 'D', 'meF', 'A', '-pip']
[-0.2068000000000003, 0.8193999999999999, 0.1353999999999999, 0.7715000000000001, -0.1918000000000002, 0.1353999999999999, 1.1616, -0.2068000000000003, 1.3581999999999996, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[29.1, 29.1, 20.31, 20.31, 38.33, 20.31, 20.31, 29.1, 20.31, 46.17, 20.31, 29.1, 3.24]
31.85888012
0.0
0.0
0.0
250.7761209
75.0748332
17.68187306
268.6630134
60.42418708
8.47105247
0.0
0
2013_CHUGAI
502
null
337.0
null
961.9609189
0.0
200.6796928
-15.38272904
-6.618065497
-87.14978786
-116.2932782
-57.51248621
-127.5175982
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
13
13
0
0
0
7
6
0
0
6
1
0
0
0
0
0
0
13
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.130876822
null
c6dcbd7b769be0bbe3db53fb45eb63fbfa23ccdfa27177f8b4f944ade958ed3f
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
502
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['meA', 'meL', 'T', 'meA', 'meF', 'I', 'Sar', 'meL', 'meV', 'D', 'meF', 'A', '-pip']
84
503
-4.7
-4.7
Lariat
6
-2.67e-16
-2.756688843
-2.13e-16
-2.881238601
-4.32e-17
-1.135238146
1.25e-15
-0.249287763
3.578608348
8268.587695
238.0
null
null
174.646417
163.0292528
48.02925281
92.41343075
81.38107863
24.18397595
16.55709782
16.55709782
10.15527715
10.15527715
5.819123923
5.819123923
null
null
null
null
524.4117572
52.25315922
62.32898339
0
0
0
0
0
0
5.108808191
105.6088499
1397.868645
0.66
1.27
1.83
0.657534247
234.0
PEPTIDE503{[meA].[meL].T.[meA].[meF].I.[Sar].[meL].[meV].D.[meF].A.[-pip]}$PEPTIDE503,PEPTIDE503,1:R1-10:R3$$$
PEPTIDE503{<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/I/">I</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meV/">[meV]</a>.<a hre...
-8.49
100
1282.88
503
null
null
8.58e+82
17.07859624
38.35050746
22.25412846
753.5607811
null
18.19364569
0.390716755
18.19364569
0.247752853
2.133744623
0.247752853
-8.547581902
-0.390716755
2.3094
378.5116
1398.8
Lariat
13
10
null
5
27
null
null
0
2
2
2
0
2
14
5
27
0
38
0
2
2
556
DP-492
-4.7
-6.791499599
3.235770325
70.44724918
66.19681715
5.647368313
78.22453614
0.0
0.0
62.32898339
0.0
0.0
0.0
121.6122489
93.9749267
199.4314202
51.84800796
null
-4.7
null
null
null
null
null
null
null
null
null
null
4
CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C)N(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C1=O
223.8686011
76.79333648
1.431199657
65.33844099
23.57583074
211.8558647
75.29719426
71.55109006
0
0.0
null
null
null
null
['meA', 'meL', 'T', 'meA', 'meF', 'I', 'Sar', 'meL', 'meV', 'D', 'meF', 'A', '-pip']
[0.1353999999999999, 1.1616, -0.1918000000000002, 0.1353999999999999, 1.3581999999999996, 0.8193999999999999, -0.2531000000000001, 1.1616, 0.7715000000000001, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 20.31, 38.33, 20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 46.17, 20.31, 29.1, 3.24]
21.23925341
0.0
0.0
0.0
275.0065613
75.0748332
23.57583074
288.7435239
60.42418708
5.647368313
0.0
0
2013_CHUGAI
503
null
319.42
null
1044.041714
0.0
197.5270916
-9.604915713
-6.667568417
-97.79635726
-112.237051
-66.34797396
-151.7482727
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
13
13
0
0
0
9
4
0
0
8
1
0
0
0
0
0
0
13
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.151914422
null
1baeb95643b7b75e9821867481276cee90b952bd2540613274b2bd60758367f9
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
503
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Sar', 'T', 'meF', 'meL', 'A', 'meL', 'meL', 'meF', 'meL', 'D', 'meF', 'A', '-pip']
84
504
-5.62
-5.62
Lariat
6
-2.71e-16
-2.756689813
-2.09e-16
-2.876362628
-3.13e-17
-1.136028432
1.17e-15
-0.249287767
3.139734593
9043.810516
233.0
null
null
184.6105186
172.5292528
51.52925281
98.33885723
86.38107863
26.18397595
17.80709782
17.80709782
10.78687545
10.78687545
6.402112654
6.402112654
null
null
null
null
566.0812599
71.44377901
62.32898339
0
0
0
0
0
0
5.108808191
94.64278148
1487.915596
0.579439252
1.028037383
1.476635514
0.6125
228.0
PEPTIDE504{[Sar].T.[meF].[meL].A.[meL].[meL].[meF].[meL].D.[meF].A.[-pip]}$PEPTIDE504,PEPTIDE504,1:R1-10:R3$$$
PEPTIDE504{<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a hre...
-9.27
107
1366.957
504
null
null
3.53e+89
18.43286491
41.17365968
24.89476712
803.4126404
null
18.62397109
0.390716756
18.62397109
0.247773719
2.142988342
0.247773719
-8.533311265
-0.390716756
3.9223
407.6006
1488.925
Lariat
13
10
null
5
27
null
null
0
2
2
3
0
3
14
5
27
0
40
0
2
2
590
DP-493
-5.62
-7.888170813
4.88475588
70.44724918
66.19681715
5.647368313
78.22453614
0.0
0.0
62.32898339
0.0
0.0
0.0
145.4514176
105.4323359
207.1751037
58.70180074
null
-5.62
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)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)CC(=O)N(C)CC(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N1C
232.0931524
76.79333648
1.431199657
65.33844099
23.57583074
217.7498224
75.29719426
107.3266351
0
0.0
null
null
null
null
['Sar', 'T', 'meF', 'meL', 'A', 'meL', 'meL', 'meF', 'meL', 'D', 'meF', 'A', '-pip']
[-0.2531000000000001, -0.1918000000000002, 1.3581999999999996, 1.1616, -0.2068000000000003, 1.1616, 1.1616, 1.3581999999999996, 1.1616, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 38.33, 20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 46.17, 20.31, 29.1, 3.24]
21.23925341
0.0
0.0
0.0
275.0065613
81.4477581
23.57583074
302.0525595
90.63628061
5.647368313
0.0
0
2013_CHUGAI
504
null
319.42
null
1114.261521
0.0
200.7487643
-9.502151603
-10.49935337
-98.40734054
-129.1009635
-83.0478128
-146.0359969
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
13
13
0
0
0
9
4
0
0
8
1
0
0
0
0
0
0
13
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.1071466
null
3bcb187292f336bf912e47efe2cb9ed40a3bdf9b1ad200fddc612ba548bf386e
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
504
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['meA', 'meF', 'L', 'meL', 'meL', 'F', 'meL', 'T', 'D', '-pip']
63
505
-4.26
-4.26
Lariat
9
-2.74e-16
-2.757113692
-2.5e-16
-2.895777607
-1.49e-16
-1.136224448
9.18e-16
-0.249287769
3.533903189
6846.846491
163.0
null
null
147.6823154
138.4628672
40.46286715
78.33330373
69.25624501
20.55914234
13.95139254
13.95139254
8.374389169
8.374389169
4.975393185
4.975393185
null
null
null
null
445.1995042
44.02860789
47.94537184
0
0
0
0
0
0
5.108808191
90.53050581
1170.741654
0.583333333
1.05952381
1.595238095
0.650793651
163.0
PEPTIDE505{[meA].[meF].L.[meL].[meL].F.[meL].T.D.[-pip]}$PEPTIDE505,PEPTIDE505,1:R1-9:R3$$$
PEPTIDE505{<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/D/">D</a>.<a href="/monomers...
-6.9
84
1072.752
505
null
null
9.05e+67
14.07653786
32.39767792
19.58580959
636.2627942
null
17.93705717
0.390716897
17.93705717
0.245432171
2.172677168
0.245432171
-8.174043766
-0.390716897
3.5473
321.0276
1171.536
Lariat
10
9
null
5
21
null
null
0
2
2
2
0
2
11
5
21
0
30
0
2
2
466
DP-494
-4.26
-4.424266528
2.682964197
55.74751999
54.16103222
5.647368313
60.50299695
0.0
0.0
47.94537184
0.0
0.0
0.0
115.239324
93.01699227
160.6840783
39.86811405
null
-4.26
null
null
null
null
null
null
null
null
null
null
4
CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C)N(C)C(=O)C[C@@H](C(=O)N2CCCCC2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C1=O
186.1820941
59.07179729
1.431199657
50.6387118
23.57583074
192.4892204
47.87285387
71.55109006
0
0.0
null
null
null
null
['meA', 'meF', 'L', 'meL', 'meL', 'F', 'meL', 'T', 'D', '-pip']
[0.1353999999999999, 1.3581999999999996, 0.8193999999999995, 1.1616, 1.1616, 1.0159999999999998, 1.1616, -0.1918000000000002, -0.6377000000000004, 1.1021]
[20.31, 20.31, 29.1, 20.31, 20.31, 29.1, 20.31, 38.33, 46.17, 3.24]
21.23925341
0.0
0.0
0.0
203.1251676
60.69122164
23.57583074
258.1097691
60.42418708
5.647368313
0.0
0
2013_CHUGAI
505
null
258.49
null
889.5863986
0.0
155.2425345
-9.309586611
-6.618212681
-79.31916199
-95.74194147
-74.25909252
-108.1642712
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
10
10
0
0
0
6
4
0
0
5
1
0
0
0
0
0
0
10
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.182865056
null
82bffb4daf4f37743828fd207c146e842e475a7c7fcc0af51e6ff926472975db
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
505
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_Bal', 'I', 'meF', 'meA', 'T', 'Sar', 'meL', 'A', 'meV', 'D', 'meF', 'meF', 'A', '-pip']
92
506
-4.68
-4.68
Lariat
2
-2.13e-16
-2.75670904
-1.8e-16
-2.879449981
2.84e-17
-1.13417998
2.2e-15
-0.249284431
2.933640973
9022.418381
260.0
null
null
182.7652192
169.8847147
51.88471469
97.65424137
84.97962996
26.3353137
17.83585718
17.83585718
10.91965683
10.91965683
6.266249095
6.266249095
null
null
null
null
564.676338
59.14803553
67.12352058
0
0
0
0
0
0
5.108808191
102.8673328
1502.890109
0.648148148
1.305555556
1.87037037
0.594936709
273.0
PEPTIDE506{[Me_Bal].I.[meF].[meA].T.[Sar].[meL].A.[meV].D.[meF].[meF].A.[-pip]}$PEPTIDE506,PEPTIDE506,1:R1-10:R3$$$
PEPTIDE506{<a href="/monomers/Me_Bal/">[Me_Bal]</a>.<a href="/monomers/I/">I</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/meV/">[meV]</a>.<a hre...
-9.8
108
1384.952
506
null
null
7.07e+88
19.13415943
41.51459343
24.35604146
802.6022277
null
18.47045822
0.390716756
18.47045822
0.247548562
2.052144119
0.247548562
-8.509889631
-0.390716756
2.0123
406.8293
1503.896
Lariat
14
10
null
6
29
null
null
0
2
2
3
0
3
15
6
29
0
38
0
2
2
594
DP-495
-4.68
-7.342004365
4.698163581
75.75706254
66.19681715
7.059210392
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
138.1205582
87.27149561
214.561854
58.70180074
null
-4.68
null
null
null
null
null
null
null
null
null
null
5
CC[C@H](C)[C@@H]1NC(=O)CCN(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C1=O
232.8164975
82.70051621
1.431199657
70.64825434
17.68187306
204.5250054
81.79405394
107.3266351
0
0.0
null
null
null
null
['Me_Bal', 'I', 'meF', 'meA', 'T', 'Sar', 'meL', 'A', 'meV', 'D', 'meF', 'meF', 'A', '-pip']
[0.1369999999999998, 0.8193999999999999, 1.3581999999999996, 0.1353999999999999, -0.1918000000000002, -0.2531000000000001, 1.1616, -0.2068000000000003, 0.7715000000000001, -0.6377000000000004, 1.3581999999999996, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 29.1, 20.31, 20.31, 38.33, 20.31, 20.31, 29.1, 20.31, 46.17, 20.31, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
287.4106008
86.24229528
17.68187306
283.3447082
90.63628061
7.059210392
0.0
0
2013_CHUGAI
506
null
348.52
null
1072.374771
0.0
213.6357196
-12.30968171
-10.02024618
-93.36484465
-123.2866126
-72.05591446
-143.3898576
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
9
5
0
0
7
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.100012248
null
870a63688b4585ef85eaa947863c431aaf17c2c6a92f4d7fb21316263dacd778
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
506
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_Bal', 'meL', 'I', 'meV', 'F', 'T', 'Sar', 'meL', 'meV', 'D', 'meF', 'meF', 'A', '-pip']
92
507
-4.64
-4.64
Lariat
9
-3.1e-16
-2.756710312
-2e-16
-2.893231914
-3.79e-17
-1.135276218
1.12e-15
-0.249287763
3.069477581
9613.002171
237.0
null
null
195.2652192
182.3847147
54.38471469
103.9042414
91.22962996
27.5853137
18.71085718
18.71085718
11.39986193
11.39986193
6.659804147
6.659804147
null
null
null
null
596.5409625
70.11410398
67.12352058
0
0
0
0
0
0
5.108808191
105.6088499
1572.968359
0.592920354
1.159292035
1.699115044
0.619047619
234.0
PEPTIDE507{[Me_Bal].[meL].I.[meV].F.T.[Sar].[meL].[meV].D.[meF].[meF].A.[-pip]}$PEPTIDE507,PEPTIDE507,1:R1-10:R3$$$
PEPTIDE507{<a href="/monomers/Me_Bal/">[Me_Bal]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/I/">I</a>.<a href="/monomers/meV/">[meV]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meV/">[meV]</a>.<a hre...
-9.8
113
1445.007
507
null
null
3.87e+95
19.48528912
44.01930419
26.38593679
848.4766433
null
18.70639645
0.390716756
18.70639645
0.247548564
2.095305102
0.247548564
-8.740585688
-0.390716756
3.6746
429.7743
1574.031
Lariat
14
10
null
6
29
null
null
0
2
2
3
0
3
15
6
29
0
43
0
2
2
624
DP-496
-4.64
-8.999444441
4.865633925
75.75706254
66.19681715
7.059210392
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
165.5281267
91.72855164
228.2694396
58.70180074
null
-4.64
null
null
null
null
null
null
null
null
null
null
5
CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)N(C)C(=O)CCN(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](C(C)C)N(C)C1=O
246.524083
82.70051621
1.431199657
70.64825434
29.46978843
224.6017145
81.79405394
107.3266351
0
0.0
null
null
null
null
['Me_Bal', 'meL', 'I', 'meV', 'F', 'T', 'Sar', 'meL', 'meV', 'D', 'meF', 'meF', 'A', '-pip']
[0.1369999999999998, 1.1616, 0.8193999999999999, 0.7715000000000001, 1.0159999999999998, -0.1918000000000002, -0.2531000000000001, 1.1616, 0.7715000000000001, -0.6377000000000004, 1.3581999999999996, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 20.31, 29.1, 20.31, 29.1, 38.33, 20.31, 20.31, 20.31, 46.17, 20.31, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
287.4106008
86.24229528
29.46978843
317.1290029
90.63628061
7.059210392
0.0
0
2013_CHUGAI
507
null
348.52
null
1174.864007
0.0
217.1266508
-12.92374365
-10.19417972
-111.6762946
-127.4582354
-81.4749334
-160.4299372
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
9
5
0
0
7
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.083588306
null
b98768fc7022777e419bfd343ed8e1b6bad49a5504d1d7a10d35b0e9d51aaa33
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
507
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_Bal', 'Sar', 'T', 'F', 'meV', 'A', 'meL', 'meV', 'meA', 'D', 'meF', 'meF', 'A', '-pip']
92
508
-5.03
-5.03
Lariat
1
-2.43e-16
-2.756707021
-1.46e-16
-2.88690602
1.71e-17
-1.134165718
1.73e-15
-0.249264208
2.879873152
8881.871126
252.0
null
null
180.2652192
167.3847147
51.38471469
96.40424137
83.72962996
26.0853137
17.71085718
17.71085718
10.79465683
10.79465683
6.237949945
6.237949945
null
null
null
null
558.3034131
56.40651841
67.12352058
0
0
0
0
0
0
5.108808191
102.8673328
1488.874459
0.635514019
1.252336449
1.813084112
0.58974359
253.0
PEPTIDE508{[Me_Bal].[Sar].T.F.[meV].A.[meL].[meV].[meA].D.[meF].[meF].A.[-pip]}$PEPTIDE508,PEPTIDE508,1:R1-10:R3$$$
PEPTIDE508{<a href="/monomers/Me_Bal/">[Me_Bal]</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meV/">[meV]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meV/">[meV]</a>.<a href="/monomers/meA/">[meA]</a>.<a hre...
-9.8
107
1372.941
508
null
null
5.09e+86
19.06763225
40.79004867
24.35932158
793.4273446
null
18.26146721
0.390716898
18.26146721
0.245642976
2.031495275
0.245642976
-8.326871873
-0.390716898
1.6222
402.2123
1489.869
Lariat
14
10
null
6
29
null
null
0
2
2
3
0
3
15
6
29
0
37
0
2
2
588
DP-497
-5.03
-7.088017295
4.594415862
75.75706254
66.19681715
7.059210392
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
131.7476333
87.27149561
211.8203369
58.70180074
null
-5.03
null
null
null
null
null
null
null
null
null
null
5
CC(C)C[C@H]1C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C)C(=O)N[C@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)CC(=O)N(C)CCC(=O)N(C)CC(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N1C
230.0749803
82.70051621
1.431199657
70.64825434
17.68187306
198.1520805
81.79405394
107.3266351
0
0.0
null
null
null
null
['Me_Bal', 'Sar', 'T', 'F', 'meV', 'A', 'meL', 'meV', 'meA', 'D', 'meF', 'meF', 'A', '-pip']
[0.1369999999999998, -0.2531000000000001, -0.1918000000000002, 1.0159999999999998, 0.7715000000000001, -0.2068000000000003, 1.1616, 0.7715000000000001, 0.1353999999999999, -0.6377000000000004, 1.3581999999999996, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 20.31, 38.33, 29.1, 20.31, 29.1, 20.31, 20.31, 20.31, 46.17, 20.31, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
287.4106008
86.24229528
17.68187306
274.2302662
90.63628061
7.059210392
0.0
0
2013_CHUGAI
508
null
348.52
null
1052.728405
0.0
212.3978084
-11.64453166
-9.78304006
-92.71893484
-122.4436903
-64.6264088
-143.5762741
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
9
5
0
0
7
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.105428554
null
9594f80090a6fa3f76f3f51a4eedf720c182c26a3c219df98a1619836c5a991a
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
508
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_Bal', 'A', 'meV', 'meA', 'T', 'Sar', 'meA', 'meF', 'I', 'D', 'meF', 'meF', 'A', '-pip']
92
509
-5.57
-5.57
Lariat
5
-1.85e-16
-2.75670829
-1.46e-16
-2.88536577
4.75e-17
-1.125716907
2.52e-15
-0.249274536
2.879527721
8666.876499
253.0
null
null
175.2652192
162.3847147
50.38471469
93.90424137
81.22962996
25.5853137
17.33585718
17.33585718
10.67625513
10.67625513
6.038479329
6.038479329
null
null
null
null
545.5575633
56.36543489
67.12352058
0
0
0
0
0
0
5.108808191
97.42538211
1460.843159
0.647619048
1.285714286
1.847619048
0.578947368
248.0
PEPTIDE509{[Me_Bal].A.[meV].[meA].T.[Sar].[meA].[meF].I.D.[meF].[meF].A.[-pip]}$PEPTIDE509,PEPTIDE509,1:R1-10:R3$$$
PEPTIDE509{<a href="/monomers/Me_Bal/">[Me_Bal]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/meV/">[meV]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/I/">I</a>.<a hre...
-9.8
105
1348.919
509
null
null
2.54e+83
18.93873321
39.90218626
23.34698371
775.0775784
null
18.42901822
0.390716756
18.42901822
0.247548562
2.030280204
0.247548562
-8.420918412
-0.390716756
0.9861
393.0483
1461.815
Lariat
14
10
null
6
29
null
null
0
2
2
3
0
3
15
6
29
0
35
0
2
2
576
DP-498
-5.57
-6.60971848
4.636553731
75.75706254
66.19681715
7.059210392
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
124.416774
81.85650514
206.3373027
58.70180074
null
-5.57
null
null
null
null
null
null
null
null
null
null
5
CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C)N(C)C(=O)CN(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C)NC(=O)CCN(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC1=O
224.5919461
82.70051621
1.431199657
70.64825434
11.78791537
191.3001883
81.79405394
107.3266351
0
0.0
null
null
null
null
['Me_Bal', 'A', 'meV', 'meA', 'T', 'Sar', 'meA', 'meF', 'I', 'D', 'meF', 'meF', 'A', '-pip']
[0.1369999999999998, -0.2068000000000003, 0.7715000000000001, 0.1353999999999999, -0.1918000000000002, -0.2531000000000001, 0.1353999999999999, 1.3581999999999996, 0.8193999999999999, -0.6377000000000004, 1.3581999999999996, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 29.1, 20.31, 20.31, 38.33, 20.31, 20.31, 20.31, 29.1, 46.17, 20.31, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
287.4106008
86.24229528
11.78791537
261.8953399
90.63628061
7.059210392
0.0
0
2013_CHUGAI
509
null
348.52
null
1013.313476
0.0
211.9061187
-12.00101978
-10.00465304
-84.69538874
-121.5086411
-64.40671058
-134.7698481
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
9
5
0
0
7
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.109778824
null
ae1567b4f667a465d7e02449b39f279b606f2afb5def41d725684faedb250e45
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
509
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_Bal', 'meF', 'meL', 'meA', 'meF', 'I', 'meL', 'meL', 'T', 'D', 'meF', 'meF', 'A', '-pip']
94
510
-6.51
-6.51
Lariat
9
-2.99e-16
-2.756707473
-1.81e-16
-2.894651665
1.09e-17
-1.136053039
1.48e-15
-0.249287767
2.75366772
10429.09545
231.0
null
null
205.2293208
191.8847147
57.88471469
109.7909927
96.25602317
29.55892049
20.04626738
20.04626738
12.34514331
12.34514331
7.225769206
7.225769206
null
null
null
null
638.4034636
98.85895013
67.12352058
0
0
0
0
0
0
5.108808191
85.04747158
1663.01531
0.541666667
1.041666667
1.55
0.582417582
227.0
PEPTIDE510{[Me_Bal].[meF].[meL].[meA].[meF].I.[meL].[meL].T.D.[meF].[meF].A.[-pip]}$PEPTIDE510,PEPTIDE510,1:R1-10:R3$$$
PEPTIDE510{<a href="/monomers/Me_Bal/">[Me_Bal]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/I/">I</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>....
-10.58
120
1529.084
510
null
null
7.35e+102
20.84214445
46.2775556
26.9613012
898.4804175
null
18.76872271
0.390716897
18.76872271
0.245642976
2.104592321
0.245642976
-8.695706375
-0.390716897
5.3821
458.9216
1664.156
Lariat
14
10
null
5
29
null
null
0
2
2
4
0
4
15
5
29
0
45
0
2
2
658
DP-499
-6.51
-9.694542023
6.48190428
75.34715891
72.21470962
5.647368313
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
182.036436
104.6228625
245.7304671
57.68797528
null
-6.51
null
null
null
null
null
null
null
null
null
null
6
CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C(=O)CCN(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C1=O
254.7075508
82.70051621
1.431199657
70.23835072
23.57583074
236.5135647
82.27302116
143.1021801
0
0.0
[['Caco2']]
[2064]
[['-7.19']]
['2018_CHUGAI']
['Me_Bal', 'meF', 'meL', 'meA', 'meF', 'I', 'meL', 'meL', 'T', 'D', 'meF', 'meF', 'A', '-pip']
[0.1369999999999998, 1.3581999999999996, 1.1616, 0.1353999999999999, 1.3581999999999996, 0.8193999999999999, 1.1616, 1.1616, -0.1918000000000002, -0.6377000000000004, 1.3581999999999996, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 20.31, 20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 38.33, 46.17, 20.31, 20.31, 29.1, 3.24]
21.23925341
0.0
0.0
0.0
298.8073702
92.61522018
23.57583074
331.8087971
120.8483742
5.647368313
0.0
0
2013_CHUGAI
510
null
339.73
null
1245.691567
0.0
218.37404
-10.21710457
-13.9419307
-105.885842
-151.973552
-97.88209558
-155.081749
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
10
4
0
0
8
1
0
0
0
0
0
0
14
0
0
0
0
0
0
4
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.058778926
null
62ff86b44f4aeb9023af11394da6d0649d0d013ab3a4e587ee23bcd6656fc291
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
510
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_Bal', 'meF', 'meL', 'meA', 'V', 'meL', 'meA', 'T', 'meA', 'D', 'meF', 'meF', 'A', '-pip']
94
511
-4.57
-4.57
Lariat
3
-2.79e-16
-2.756707179
-1.84e-16
-2.883183874
3.17e-17
-1.135253053
2.33e-15
-0.249287763
2.973588154
9249.072857
253.0
null
null
187.7652192
174.8847147
52.88471469
100.1155662
87.50602317
26.80892049
18.29626738
18.29626738
11.23333991
11.23333991
6.398528823
6.398528823
null
null
null
null
577.6151862
60.47771056
67.12352058
0
0
0
0
0
0
5.108808191
106.9796085
1530.921409
0.572727273
1.063636364
1.545454545
0.604938272
232.0
PEPTIDE511{[Me_Bal].[meF].[meL].[meA].V.[meL].[meA].T.[meA].D.[meF].[meF].A.[-pip]}$PEPTIDE511,PEPTIDE511,1:R1-10:R3$$$
PEPTIDE511{<a href="/monomers/Me_Bal/">[Me_Bal]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>....
-9.8
110
1408.974
511
null
null
5.86e+91
19.27107159
41.84379497
24.34918285
821.1039088
null
18.39235975
0.390716755
18.39235975
0.247752731
2.050786739
0.247752731
-8.397041223
-0.390716755
2.743
416.0516
1531.95
Lariat
14
10
null
5
29
null
null
0
2
2
3
0
3
15
5
29
0
40
0
2
2
606
DP-500
-4.57
-7.842901065
4.701437879
75.34715891
72.21470962
5.647368313
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
131.7476333
100.4963126
229.7622323
50.8341825
null
-4.57
null
null
null
null
null
null
null
null
null
null
5
CC(C)C[C@H]1C(=O)N(C)[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N[C@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)CC(=O)N(C)CCC(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N1C
238.2584482
82.70051621
1.431199657
70.23835072
17.68187306
217.39479
82.27302116
107.3266351
0
0.0
null
null
null
null
['Me_Bal', 'meF', 'meL', 'meA', 'V', 'meL', 'meA', 'T', 'meA', 'D', 'meF', 'meF', 'A', '-pip']
[0.1369999999999998, 1.3581999999999996, 1.1616, 0.1353999999999999, 0.4292999999999995, 1.1616, 0.1353999999999999, -0.1918000000000002, 0.1353999999999999, -0.6377000000000004, 1.3581999999999996, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 38.33, 20.31, 46.17, 20.31, 20.31, 29.1, 3.24]
21.23925341
0.0
0.0
0.0
298.8073702
86.24229528
17.68187306
297.0503931
90.63628061
5.647368313
0.0
0
2013_CHUGAI
511
null
339.73
null
1113.060043
0.0
212.1814791
-9.274034158
-10.11508358
-94.20375268
-132.5661963
-73.66328612
-151.3358359
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
10
4
0
0
8
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.115237889
null
3a0635638be4cb5832dea3e9dd46ba8480f1541523e91f73deb555810f1ec800
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
511
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dA', 'V', 'meL', 'T', 'meF', 'G', 'meL', 'meV', 'F', 'D', 'meF', 'meF', 'A', '-pip']
86
512
-6.64
-6.64
Lariat
3
-2.12e-16
-2.75670682
-1.31e-16
-2.889713758
1.04e-16
-1.13524977
2.56e-15
-0.249287763
2.634295154
9671.984731
277.0
null
null
190.2293208
176.8847147
54.88471469
102.4070181
88.67684356
28.1381001
19.00044699
19.00044699
11.56220988
11.56220988
6.83828438
6.83828438
null
null
null
null
599.5869191
72.93778813
67.12352058
0
0
0
0
0
0
5.108808191
94.64278148
1578.921409
0.578947368
1.131578947
1.675438596
0.552941176
277.0
PEPTIDE512{[dA].V.[meL].T.[meF].G.[meL].[meV].F.D.[meF].[meF].A.[-pip]}$PEPTIDE512,PEPTIDE512,1:R1-10:R3$$$
PEPTIDE512{<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/G/">G</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meV/">[meV]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/D...
-10.58
114
1457.018
512
null
null
2.9100000000000002e+93
20.43307513
43.61322226
25.97724855
842.9753742
null
18.65649729
0.390716755
18.65649729
0.247773754
2.062426545
0.247773754
-8.489994148
-0.390716755
3.1852
431.1887
1579.994
Lariat
14
10
null
8
29
null
null
0
2
2
4
0
4
15
8
29
0
40
0
2
2
622
DP-501
-6.64
-8.728794576
5.949977004
76.57686978
72.21470962
9.882894548
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
175.6635111
98.24993757
188.6303063
66.92635208
null
-6.64
null
null
null
null
null
null
null
null
null
null
6
CC(C)C[C@H]1C(=O)N(C)[C@@H](C(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)CC(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)NCC(=O)N1C
238.3816987
82.70051621
1.431199657
71.46806159
23.57583074
217.39479
61.34554045
143.1021801
0
0.0
null
null
null
null
['dA', 'V', 'meL', 'T', 'meF', 'G', 'meL', 'meV', 'F', 'D', 'meF', 'meF', 'A', '-pip']
[-0.2068000000000003, 0.4292999999999995, 1.1616, -0.1918000000000002, 1.3581999999999996, -0.5953000000000002, 1.1616, 0.7715000000000001, 1.0159999999999998, -0.6377000000000004, 1.3581999999999996, 1.3581999999999996, -0.2068000000000003, 1.1021]
[29.1, 29.1, 20.31, 38.33, 20.31, 29.1, 20.31, 20.31, 29.1, 46.17, 20.31, 20.31, 29.1, 3.24]
37.16869347
0.0
0.0
0.0
263.1801603
92.61522018
23.57583074
292.1286441
120.8483742
9.882894548
0.0
0
2013_CHUGAI
512
null
366.1
null
1122.091584
0.0
223.9834983
-19.13028391
-13.56011814
-101.6249691
-146.7446771
-73.12644042
-130.3052606
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
7
7
0
0
6
1
0
0
0
0
0
0
14
0
0
0
0
0
0
4
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.056023786
null
fa974cece2649aaa7f3a3bc33702f9057f3fa4bf084fa659ffc9af19b8afab35
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
512
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dA', 'F', 'meA', 'meV', 'T', 'Sar', 'meL', 'meA', 'I', 'D', 'meF', 'meF', 'A', '-pip']
88
513
-4.77
-4.77
Lariat
3
-2.32e-16
-2.756708208
-1.54e-16
-2.886255936
2.75e-17
-1.134153905
2.98e-15
-0.249284431
2.939803453
8901.871126
244.0
null
null
180.2652192
167.3847147
51.38471469
96.44291651
83.70323676
26.1117069
17.72405378
17.72405378
10.85785343
10.85785343
6.230218319
6.230218319
null
null
null
null
558.1104147
60.5598776
67.12352058
0
0
0
0
0
0
5.108808191
98.75505715
1488.874459
0.654205607
1.289719626
1.85046729
0.58974359
245.0
PEPTIDE513{[dA].F.[meA].[meV].T.[Sar].[meL].[meA].I.D.[meF].[meF].A.[-pip]}$PEPTIDE513,PEPTIDE513,1:R1-10:R3$$$
PEPTIDE513{<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meV/">[meV]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/I/">I</a>.<a href="/mono...
-9.8
107
1372.941
513
null
null
1.35e+87
19.06763225
40.79004867
24.10114299
793.2754298
null
18.4445941
0.390716756
18.4445941
0.247548565
2.044969973
0.247548565
-8.447692114
-0.390716756
1.6685
402.18
1489.869
Lariat
14
10
null
7
29
null
null
0
2
2
3
0
3
15
7
29
0
38
0
2
2
588
DP-502
-4.77
-7.493337688
4.56815432
76.16696616
72.21470962
8.47105247
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
138.1205582
94.12338772
189.2332083
60.0725593
null
-4.77
null
null
null
null
null
null
null
null
null
null
5
CC[C@H](C)[C@@H]1NC(=O)[C@H](C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](C)NC(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC1=O
230.1160639
82.70051621
1.431199657
71.05815797
17.68187306
211.021865
68.32136735
107.3266351
0
0.0
null
null
null
null
['dA', 'F', 'meA', 'meV', 'T', 'Sar', 'meL', 'meA', 'I', 'D', 'meF', 'meF', 'A', '-pip']
[-0.2068000000000003, 1.0159999999999998, 0.1353999999999999, 0.7715000000000001, -0.1918000000000002, -0.2531000000000001, 1.1616, 0.1353999999999999, 0.8193999999999999, -0.6377000000000004, 1.3581999999999996, 1.3581999999999996, -0.2068000000000003, 1.1021]
[29.1, 29.1, 20.31, 20.31, 38.33, 20.31, 20.31, 20.31, 29.1, 46.17, 20.31, 20.31, 29.1, 3.24]
31.85888012
0.0
0.0
0.0
275.0558969
86.24229528
17.68187306
279.7113998
90.63628061
8.47105247
0.0
0
2013_CHUGAI
513
null
357.31
null
1053.35501
0.0
217.1316593
-15.68185036
-9.922876787
-93.35359352
-130.456347
-64.84332023
-135.8953478
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
8
6
0
0
7
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.08978273
null
9063ea14056f000d6b44ea4b36dfb0ce702e80c62731b113d2b38bb5a9089195
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
514
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_dA', 'F', 'G', 'meA', 'T', 'meA', 'meF', 'V', 'meV', 'D', 'meF', 'meF', 'A', '-pip']
89
515
-4.51
-4.51
Lariat
6
-1.69e-16
-2.756709132
-6.53e-17
-2.887040339
1.8e-16
-1.1156414
4.44e-15
-0.24921507
2.558610603
9075.109863
259.0
null
null
177.7293208
164.3847147
52.38471469
96.11834299
82.45323676
26.8617069
18.22405378
18.22405378
11.28875513
11.28875513
6.45851747
6.45851747
null
null
null
null
567.9152929
59.18911905
67.12352058
0
0
0
0
0
0
5.108808191
94.64278148
1508.843159
0.577981651
1.110091743
1.642201835
0.525
257.0
PEPTIDE515{[Me_dA].F.G.[meA].T.[meA].[meF].V.[meV].D.[meF].[meF].A.[-pip]}$PEPTIDE515,PEPTIDE515,1:R1-10:R3$$$
PEPTIDE515{<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/G/">G</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/meV/">[meV]</a>.<a href="/mono...
-10.58
109
1396.963
515
null
null
9.98e+85
20.12832185
40.56625491
23.46632451
797.2528735
null
18.6284906
0.390716755
18.6284906
0.247752851
2.040040211
0.247752851
-8.560410102
-0.390716755
1.475
408.254
1509.859
Lariat
14
10
null
7
29
null
null
0
2
2
4
0
4
15
7
29
0
35
0
2
2
592
DP-504
-4.51
-7.252002029
5.891451362
76.16696616
72.21470962
8.47105247
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
148.2559426
87.41995663
183.2693062
66.92635208
null
-4.51
null
null
null
null
null
null
null
null
null
null
6
CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C)N(C)C(=O)CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](C)N(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H](C(C)C)N(C)C1=O
224.6330296
82.70051621
1.431199657
71.05815797
11.78791537
190.9451559
68.32136735
143.1021801
0
0.0
null
null
null
null
['Me_dA', 'F', 'G', 'meA', 'T', 'meA', 'meF', 'V', 'meV', 'D', 'meF', 'meF', 'A', '-pip']
[0.1353999999999999, 1.0159999999999998, -0.5953000000000002, 0.1353999999999999, -0.1918000000000002, 0.1353999999999999, 1.3581999999999996, 0.4292999999999995, 0.7715000000000001, -0.6377000000000004, 1.3581999999999996, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 29.1, 29.1, 20.31, 38.33, 20.31, 20.31, 29.1, 20.31, 46.17, 20.31, 20.31, 29.1, 3.24]
31.85888012
0.0
0.0
0.0
275.0558969
92.61522018
11.78791537
253.342183
120.8483742
8.47105247
0.0
0
2013_CHUGAI
515
null
357.31
null
1023.638295
0.0
217.4116983
-14.6818757
-13.08717459
-85.655775
-141.996056
-57.06700589
-123.2287728
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
8
6
0
0
7
1
0
0
0
0
0
0
14
0
0
0
0
0
0
4
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.074198549
null
ce5a6b82698ba84995aa475bab773ac5df1d626258e4be1a9c96b99f40667acd
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
515
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_dA', 'A', 'meV', 'T', 'G', 'meA', 'V', 'meA', 'meF', 'D', 'meF', 'meF', 'A', '-pip']
89
516
-5.17
-5.17
Lariat
4
-2e-16
-2.75670714
-1.25e-16
-2.88567093
4.16e-17
-1.115645033
3.18e-15
-0.249214996
2.884200155
8407.173545
282.0
null
null
170.2652192
157.3847147
49.38471469
91.44291651
78.70323676
25.1117069
17.09905378
17.09905378
10.54535343
10.54535343
5.946198553
5.946198553
null
null
null
null
532.6187151
52.29424275
67.12352058
0
0
0
0
0
0
5.108808191
96.05462356
1432.811859
0.611650485
1.184466019
1.72815534
0.567567568
270.0
PEPTIDE516{[Me_dA].A.[meV].T.G.[meA].V.[meA].[meF].D.[meF].[meF].A.[-pip]}$PEPTIDE516,PEPTIDE516,1:R1-10:R3$$$
PEPTIDE516{<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/meV/">[meV]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/G/">G</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/mono...
-9.8
103
1324.897
516
null
null
7.11e+80
18.81581531
38.46371289
22.35079923
756.5758973
null
18.5123051
0.390716898
18.5123051
0.245642976
2.022096579
0.245642976
-8.41371807
-0.390716898
0.2522
383.782
1433.761
Lariat
14
10
null
7
29
null
null
0
2
2
3
0
3
15
7
29
0
34
0
2
2
564
DP-505
-5.17
-6.59699017
4.518854641
76.16696616
72.21470962
8.47105247
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
118.0438491
88.70839725
178.2671399
60.0725593
null
-5.17
null
null
null
null
null
null
null
null
null
null
5
CC(C)[C@@H]1NC(=O)[C@H](C)N(C)C(=O)CNC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C)NC(=O)[C@@H](C)N(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C)N(C)C1=O
219.1499954
82.70051621
1.431199657
71.05815797
11.78791537
191.4241231
68.32136735
107.3266351
0
0.0
null
null
null
null
['Me_dA', 'A', 'meV', 'T', 'G', 'meA', 'V', 'meA', 'meF', 'D', 'meF', 'meF', 'A', '-pip']
[0.1353999999999999, -0.2068000000000003, 0.7715000000000001, -0.1918000000000002, -0.5953000000000002, 0.1353999999999999, 0.4292999999999995, 0.1353999999999999, 1.3581999999999996, -0.6377000000000004, 1.3581999999999996, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 29.1, 20.31, 38.33, 29.1, 20.31, 29.1, 20.31, 20.31, 46.17, 20.31, 20.31, 29.1, 3.24]
31.85888012
0.0
0.0
0.0
275.0558969
86.24229528
11.78791537
249.1475894
90.63628061
8.47105247
0.0
0
2013_CHUGAI
516
null
357.31
null
975.6198315
0.0
214.0813232
-14.42525418
-10.08622002
-83.46922716
-128.6421483
-50.53746986
-127.2075018
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
8
6
0
0
7
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.101128338
null
912a67ee2b49f8c419ec11dd50c80af6b96ac809a6f4785d57f53f9f952b8429
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
516
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_dA', 'F', 'meL', 'meV', 'Sar', 'T', 'meA', 'meA', 'I', 'D', 'meF', 'meF', 'A', '-pip']
91
517
-4.7
-4.7
Lariat
6
-2.42e-16
-2.756708519
-2.12e-16
-2.885057113
5.4e-17
-1.134081379
2.2e-15
-0.24928443
2.997196654
9020.908606
248.0
null
null
182.7652192
169.8847147
51.88471469
97.65424137
84.97962996
26.3353137
17.94766058
17.94766058
11.07120208
11.07120208
6.333941792
6.333941792
null
null
null
null
564.676338
61.88955264
67.12352058
0
0
0
0
0
0
5.108808191
100.1258157
1502.890109
0.638888889
1.25
1.805555556
0.594936709
232.0
PEPTIDE517{[Me_dA].F.[meL].[meV].[Sar].T.[meA].[meA].I.D.[meF].[meF].A.[-pip]}$PEPTIDE517,PEPTIDE517,1:R1-10:R3$$$
PEPTIDE517{<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meV/">[meV]</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/I/">I</a>.<a href=...
-9.8
108
1384.952
517
null
null
1.12e+88
19.13415943
40.95623269
23.60164111
802.6022277
null
18.61529784
0.390716756
18.61529784
0.247752696
2.061784023
0.247752696
-8.609693392
-0.390716756
2.0107
406.8073
1503.896
Lariat
14
10
null
6
29
null
null
0
2
2
3
0
3
15
6
29
0
39
0
2
2
594
DP-506
-4.7
-7.685323577
4.707148551
75.75706254
72.21470962
7.059210392
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
138.1205582
94.12338772
200.3213109
60.0725593
null
-4.7
null
null
null
null
null
null
null
null
null
null
5
CC[C@H](C)[C@@H]1NC(=O)[C@H](C)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H]([C@@H](C)O)NC(=O)CN(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](C)N(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC1=O
232.8164975
82.70051621
1.431199657
70.64825434
17.68187306
211.021865
75.29719426
107.3266351
0
0.0
null
null
null
null
['Me_dA', 'F', 'meL', 'meV', 'Sar', 'T', 'meA', 'meA', 'I', 'D', 'meF', 'meF', 'A', '-pip']
[0.1353999999999999, 1.0159999999999998, 1.1616, 0.7715000000000001, -0.2531000000000001, -0.1918000000000002, 0.1353999999999999, 0.1353999999999999, 0.8193999999999999, -0.6377000000000004, 1.3581999999999996, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 29.1, 20.31, 20.31, 20.31, 38.33, 20.31, 20.31, 29.1, 46.17, 20.31, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
286.9316335
86.24229528
17.68187306
283.8236755
90.63628061
7.059210392
0.0
0
2013_CHUGAI
517
null
348.52
null
1075.83295
0.0
215.1697545
-12.61851146
-10.18958158
-94.57756779
-132.6325228
-65.6681804
-143.7330069
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
9
5
0
0
8
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.100010161
null
e8d6ad9641500c23989d5f83d87e1b7f73011d21f3e7380e3d9adc25b40c657c
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
517
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_dA', 'Sar', 'T', 'meA', 'F', 'meL', 'meA', 'meV', 'A', 'D', 'meF', 'meF', 'A', '-pip']
91
518
-4.96
-4.96
Lariat
6
-2.27e-16
-2.756706738
-1.54e-16
-2.876679042
7.17e-17
-1.134175108
2.41e-15
-0.249252948
2.845093077
8649.366724
272.0
null
null
175.2652192
162.3847147
50.38471469
93.90424137
81.22962996
25.5853137
17.44766058
17.44766058
10.70939868
10.70939868
6.111906507
6.111906507
null
null
null
null
545.5575633
50.92348419
67.12352058
0
0
0
0
0
0
5.108808191
102.8673328
1460.843159
0.638095238
1.247619048
1.8
0.578947368
270.0
PEPTIDE518{[Me_dA].[Sar].T.[meA].F.[meL].[meA].[meV].A.D.[meF].[meF].A.[-pip]}$PEPTIDE518,PEPTIDE518,1:R1-10:R3$$$
PEPTIDE518{<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meV/">[meV]</a>.<a href="/monomers/A/">A</a>.<a href=...
-9.8
105
1348.919
518
null
null
9.139999999999999e+83
18.93873321
39.35067684
23.09688392
775.0775784
null
18.18795139
0.390716756
18.18795139
0.247752576
2.018524353
0.247752576
-8.267929392
-0.390716756
0.9845
393.0263
1461.815
Lariat
14
10
null
6
29
null
null
0
2
2
3
0
3
15
6
29
0
36
0
2
2
576
DP-507
-4.96
-6.630352162
4.537909991
75.75706254
72.21470962
7.059210392
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
118.0438491
95.08132215
192.0967595
60.0725593
null
-4.96
null
null
null
null
null
null
null
null
null
null
5
CC(C)C[C@H]1C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)CC(=O)N(C)[C@H](C)C(=O)N(C)CC(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1C
224.5919461
82.70051621
1.431199657
70.64825434
11.78791537
197.797048
75.29719426
107.3266351
0
0.0
null
null
null
null
['Me_dA', 'Sar', 'T', 'meA', 'F', 'meL', 'meA', 'meV', 'A', 'D', 'meF', 'meF', 'A', '-pip']
[0.1353999999999999, -0.2531000000000001, -0.1918000000000002, 0.1353999999999999, 1.0159999999999998, 1.1616, 0.1353999999999999, 0.7715000000000001, -0.2068000000000003, -0.6377000000000004, 1.3581999999999996, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 20.31, 38.33, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1, 46.17, 20.31, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
286.9316335
86.24229528
11.78791537
262.3743071
90.63628061
7.059210392
0.0
0
2013_CHUGAI
518
null
348.52
null
1013.27027
0.0
212.2701487
-11.78453287
-9.768378472
-84.75163611
-128.476565
-57.40352072
-135.5224519
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
9
5
0
0
8
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.109771858
null
3f36a1c960a7ca231d012175ae215ce622242304872b923bf29827b8c9b6362a
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
519
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_dA', 'meA', 'V', 'meA', 'meF', 'meA', 'T', 'meA', 'meA', 'D', 'meF', 'meF', 'A', '-pip']
93
520
-5.29
-5.29
Lariat
1
-1.89e-16
-2.75670713
-1.26e-16
-2.876266144
1.2e-16
-1.115633339
3.07e-15
-0.248932069
2.835932461
8535.90417
250.0
null
null
172.7652192
159.8847147
49.88471469
92.61556624
80.00602317
25.30892049
17.40807078
17.40807078
10.89808176
10.89808176
6.035681986
6.035681986
null
null
null
null
539.3776368
45.39936644
67.12352058
0
0
0
0
0
0
5.108808191
105.6088499
1446.827509
0.567307692
1.019230769
1.490384615
0.573333333
236.0
PEPTIDE520{[Me_dA].[meA].V.[meA].[meF].[meA].T.[meA].[meA].D.[meF].[meF].A.[-pip]}$PEPTIDE520,PEPTIDE520,1:R1-10:R3$$$
PEPTIDE520{<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meA/">[meA]</a>.<a...
-9.8
104
1336.908
520
null
null
1.4e+82
18.87649151
38.10195271
21.19822866
766.0546101
null
18.22763213
0.390716755
18.22763213
0.247752851
2.016808656
0.247752851
-8.309785239
-0.390716755
0.689
388.4676
1447.788
Lariat
14
10
null
5
29
null
null
0
2
2
3
0
3
15
5
29
0
35
0
2
2
570
DP-509
-5.29
-6.347099572
4.563782842
75.34715891
78.23260209
5.647368313
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
104.3400648
96.5182238
199.0725864
52.20494106
null
-5.29
null
null
null
null
null
null
null
null
null
null
5
CC(C)[C@@H]1NC(=O)[C@H](C)N(C)C(=O)[C@@H](C)N(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H](C)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C)N(C)C1=O
221.8093455
82.70051621
1.431199657
70.23835072
5.893957685
197.4420156
75.77616147
107.3266351
0
0.0
null
null
null
null
['Me_dA', 'meA', 'V', 'meA', 'meF', 'meA', 'T', 'meA', 'meA', 'D', 'meF', 'meF', 'A', '-pip']
[0.1353999999999999, 0.1353999999999999, 0.4292999999999995, 0.1353999999999999, 1.3581999999999996, 0.1353999999999999, -0.1918000000000002, 0.1353999999999999, 0.1353999999999999, -0.6377000000000004, 1.3581999999999996, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 38.33, 20.31, 20.31, 46.17, 20.31, 20.31, 29.1, 3.24]
21.23925341
0.0
0.0
0.0
298.328403
86.24229528
5.893957685
254.6306237
90.63628061
5.647368313
0.0
0
2013_CHUGAI
520
null
339.73
null
994.1412779
0.0
209.5994695
-8.744390885
-9.750437167
-77.67106114
-135.1151906
-50.255087
-135.6212474
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
10
4
0
0
9
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.139811202
null
46cc67dbd5e78b72eb856c4ed2c07928e769085a990d144cdd791a84694e52f4
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
520
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'meA', 'meF', 'meL', 'T', 'meA', 'I', 'meL', 'meV', 'D', 'meF', 'meF', 'A', '-pip']
90
521
-5.66
-5.66
Lariat
3
-2.79e-16
-2.756710776
-2.3e-16
-2.889236908
-7.95e-17
-1.135269071
1.38e-15
-0.249287763
3.174962424
9735.662742
256.0
null
null
197.7652192
184.8847147
54.88471469
105.1542414
92.47962996
27.8353137
19.05946398
19.05946398
11.77014331
11.77014331
6.856220316
6.856220316
null
null
null
null
602.9138874
79.70941387
67.12352058
0
0
0
0
0
0
5.108808191
98.75505715
1586.984009
0.570175439
1.114035088
1.657894737
0.623529412
249.0
PEPTIDE521{[dV].[meA].[meF].[meL].T.[meA].I.[meL].[meV].D.[meF].[meF].A.[-pip]}$PEPTIDE521,PEPTIDE521,1:R1-10:R3$$$
PEPTIDE521{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/I/">I</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meV/">[meV]</a>.<a href=...
-9.8
114
1457.018
521
null
null
2.69e+97
19.55886276
43.61907037
25.10154455
857.6515264
null
18.91546873
0.390716755
18.91546873
0.247752732
2.1182342
0.247752732
-8.912754109
-0.390716755
4.0615
434.3473
1588.058
Lariat
14
10
null
6
29
null
null
0
2
2
3
0
3
15
6
29
0
45
0
2
2
630
DP-510
-5.66
-9.580336884
4.855061073
75.75706254
78.23260209
7.059210392
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
165.5281267
105.4323359
218.1411721
52.20494106
null
-5.66
null
null
null
null
null
null
null
null
null
null
5
CC[C@H](C)[C@@H]1NC(=O)[C@H](C)N(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C)N(C)C(=O)[C@@H](C(C)C)NC(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C1=O
249.2656001
82.70051621
1.431199657
70.64825434
29.46978843
243.9683588
68.80033457
107.3266351
0
0.0
null
null
null
null
['dV', 'meA', 'meF', 'meL', 'T', 'meA', 'I', 'meL', 'meV', 'D', 'meF', 'meF', 'A', '-pip']
[0.4292999999999995, 0.1353999999999999, 1.3581999999999996, 1.1616, -0.1918000000000002, 0.1353999999999999, 0.8193999999999999, 1.1616, 0.7715000000000001, -0.6377000000000004, 1.3581999999999996, 1.3581999999999996, -0.2068000000000003, 1.1021]
[29.1, 20.31, 20.31, 20.31, 38.33, 20.31, 29.1, 20.31, 20.31, 46.17, 20.31, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
286.4526663
86.24229528
29.46978843
327.2013794
90.63628061
7.059210392
0.0
0
2013_CHUGAI
521
null
348.52
null
1200.261003
0.0
220.1033247
-13.76336642
-10.49616525
-114.2856662
-146.1234624
-75.0223637
-161.5899705
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
9
5
0
0
8
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.082615723
null
f355284c9e85d1e552a17464850668342df66b844ad3cd5c6bca900ad5e80e4c
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
521
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_Bal', 'meA', 'meF', 'A', 'meL', 'Sar', 'meL', 'V', 'meA', 'T', 'meA', 'D', '-pip']
87
522
-5.96
-5.96
Lariat
9
-2.52e-16
-2.757026687
-2.48e-16
-2.884438444
-3.09e-17
-1.135183259
1.43e-15
-0.249287763
4.013072027
7246.529493
236.0
null
null
159.6823154
148.5292528
43.52925281
83.98800427
73.88107863
21.68397595
14.82029442
14.82029442
8.898526804
8.898526804
4.908224475
4.908224475
null
null
null
null
469.9964047
39.91633222
62.32898339
0
0
0
0
0
0
5.108808191
104.2380914
1279.790395
0.582417582
1.164835165
1.725274725
0.703125
238.0
PEPTIDE522{[Me_Bal].[meA].[meF].A.[meL].[Sar].[meL].V.[meA].T.[meA].D.[-pip]}$PEPTIDE522,PEPTIDE522,1:R1-12:R3$$$
PEPTIDE522{<a href="/monomers/Me_Bal/">[Me_Bal]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/meA/">[meA]</a>....
-7.71
91
1174.781
522
null
null
2.99e+74
15.57596829
35.20050819
21.44212154
685.3591556
null
17.00066978
0.390716755
17.00066978
0.247752731
2.106853744
0.247752731
-7.748021352
-0.390716755
0.062
340.2806
1280.621
Lariat
13
12
null
5
27
null
null
0
2
2
1
0
1
14
5
27
0
29
0
2
2
510
DP-511
-5.96
-4.874366343
1.648493853
70.44724918
60.17892468
5.647368313
78.22453614
0.0
0.0
62.32898339
0.0
0.0
0.0
71.32344624
89.36940964
200.4452457
43.62345662
null
-5.96
null
null
null
null
null
null
null
null
null
null
3
CC(C)C[C@H]1C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)CCC(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)CC(=O)N1C
210.1610155
76.79333648
1.431199657
65.33844099
17.68187306
192.6131552
81.79405394
35.77554503
0
0.0
[['Caco2']]
[7745]
[['-7.54']]
['2023_Ohta']
['Me_Bal', 'meA', 'meF', 'A', 'meL', 'Sar', 'meL', 'V', 'meA', 'T', 'meA', 'D', '-pip']
[0.1369999999999998, 0.1353999999999999, 1.3581999999999996, -0.2068000000000003, 1.1616, -0.2531000000000001, 1.1616, 0.4292999999999995, 0.1353999999999999, -0.1918000000000002, 0.1353999999999999, -0.6377000000000004, 1.1021]
[20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 29.1, 20.31, 38.33, 20.31, 46.17, 3.24]
21.23925341
0.0
0.0
0.0
275.4855286
68.70190829
17.68187306
262.6205947
30.21209354
5.647368313
0.0
0
2013_CHUGAI
522
null
319.42
null
931.0978956
0.0
190.0284138
-8.834830253
-3.133338469
-84.78850223
-86.12680058
-58.14613978
-146.6800314
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
13
13
0
0
0
9
4
0
0
7
1
0
0
0
0
0
0
13
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.218604669
null
2244ebc49aa4fd3f922e50bfda8067e3a1290b0b9ac83ef40cdbad9875c43951
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
522
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_dA', 'T', 'Sar', 'meL', 'I', 'meL', 'meF', 'meL', 'D', '-pip']
67
523
-4.74
-4.74
Lariat
5
-3.21e-16
-2.758145351
-3.03e-16
-2.882982317
-1.4e-16
-1.135235761
8.01e-16
-0.249287763
4.262358494
6215.078135
148.0
null
null
140.2182138
131.4628672
37.46286715
73.61920212
65.53263821
18.78274914
12.81319594
12.81319594
7.744001679
7.744001679
4.479388936
4.479388936
null
null
null
null
410.0959248
39.8752487
47.94537184
0
0
0
0
0
0
5.108808191
89.15974725
1094.710354
0.679487179
1.256410256
1.820512821
0.719298246
148.0
PEPTIDE523{[Me_dA].T.[Sar].[meL].I.[meL].[meF].[meL].D.[-pip]}$PEPTIDE523,PEPTIDE523,1:R1-9:R3$$$
PEPTIDE523{<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/I/">I</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/D/">D</a>.<a href=...
-6.12
78
1000.686
523
null
null
1.2399999999999999e+63
12.81319882
30.29958019
17.95676491
595.7377328
null
17.98123092
0.390716756
17.98123092
0.247548562
2.251891338
0.247548562
-8.166323225
-0.390716756
2.2782
296.5879
1095.438
Lariat
10
9
null
4
21
null
null
0
2
2
1
0
1
11
4
21
0
29
0
2
2
438
DP-512
-4.74
-3.490087448
1.420365741
55.33761637
48.14313975
4.235526235
60.50299695
0.0
0.0
47.94537184
0.0
0.0
0.0
91.40015538
81.08061588
162.6577388
40.88193951
null
-4.74
null
null
null
null
null
null
null
null
null
null
3
CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H](C)N(C)C(=O)C[C@@H](C(=O)N2CCCCC2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](CC(C)C)N(C)C1=O
180.6579763
59.07179729
1.431199657
50.22880818
23.57583074
180.0984031
61.34554045
35.77554503
0
0.0
[['Caco2']]
[7746]
[['-7.11']]
['2023_Ohta']
['Me_dA', 'T', 'Sar', 'meL', 'I', 'meL', 'meF', 'meL', 'D', '-pip']
[0.1353999999999999, -0.1918000000000002, -0.2531000000000001, 1.1616, 0.8193999999999999, 1.1616, 1.3581999999999996, 1.1616, -0.6377000000000004, 1.1021]
[20.31, 38.33, 20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
215.4798715
54.31829674
23.57583074
248.4340419
30.21209354
4.235526235
0.0
0
2013_CHUGAI
523
null
249.7
null
843.3645732
0.0
149.3146169
-6.02693002
-3.436350639
-79.15109709
-75.05412393
-66.55154394
-121.0424777
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
10
10
0
0
0
7
3
0
0
6
1
0
0
0
0
0
0
10
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.236524006
null
113f292d3e94ea3b7b5c138326a06d11b39fb789481999b27d167d3a3576b8fd
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
523
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['A', 'L', 'L', 'F', 'I', 'T', 'G', 'L', 'F', 'meL', 'D', '-pip']
65
524
-4.52
-4.52
Lariat
4
-2.45e-16
-2.757647546
-1.61e-16
-2.905605541
-1.15e-16
-1.135355278
8.75e-16
-0.249287767
3.348877797
7486.909672
287.0
null
null
158.9917165
148.1737909
44.17379092
84.61877255
73.84777487
22.46739063
14.85128747
14.85128747
8.551813408
8.551813408
5.061397694
5.061397694
null
null
null
null
479.8552162
49.71705972
57.53444621
0
0
0
0
0
0
5.108808191
93.31310644
1284.784581
0.586956522
1.108695652
1.641304348
0.641791045
273.0
PEPTIDE524{A.L.L.F.I.T.G.L.F.[meL].D.[-pip]}$PEPTIDE524,PEPTIDE524,1:R1-11:R3$$$
PEPTIDE524{<a href="/monomers/A/">A</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/I/">I</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/G/">G</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/mon...
-7.96
92
1180.808
524
null
null
3.57e+74
15.87859625
37.52617037
24.92031504
689.083608
null
17.52189102
0.390716898
17.52189102
0.245417149
2.137351286
0.245417149
-7.848788772
-0.390716898
1.8256
346.9138
1285.64
Lariat
12
11
null
11
25
null
null
0
2
2
2
0
2
13
11
25
0
30
0
2
2
510
DP-513
-4.52
-6.296211996
2.5804283
68.00676119
60.17892468
14.11842078
72.31735641
0.0
0.0
57.53444621
0.0
0.0
0.0
135.3160332
98.91094995
128.668495
50.4772494
null
-4.52
null
null
null
null
null
null
null
null
null
null
4
CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)C[C@@H](C(=O)N2CCCCC2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H]([C@@H](C)O)NC1=O
204.2422209
70.88615675
1.431199657
62.89795299
29.46978843
218.583822
26.46640595
71.55109006
0
0.0
[['Caco2']]
[7747]
[['-7.00']]
['2023_Ohta']
['A', 'L', 'L', 'F', 'I', 'T', 'G', 'L', 'F', 'meL', 'D', '-pip']
[-0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 1.0159999999999998, 0.8193999999999999, -0.1918000000000002, -0.5953000000000002, 0.8193999999999995, 1.0159999999999998, 1.1616, -0.6377000000000004, 1.1021]
[29.1, 29.1, 29.1, 29.1, 29.1, 38.33, 29.1, 29.1, 29.1, 20.31, 46.17, 3.24]
53.09813353
0.0
0.0
0.0
179.9513327
70.28029601
29.46978843
278.1864782
60.42418708
14.11842078
0.0
0
2013_CHUGAI
524
null
351.85
null
932.8480377
0.0
196.2212646
-27.14917859
-6.42538374
-93.15415906
-99.9427504
-78.95301915
-98.19481139
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
12
12
0
0
0
2
10
0
0
1
1
0
0
0
0
0
0
12
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.114466359
null
4c5b6e447eaf89dea876375d79467e8072eb23c4668dc638d8bbbb4908cd85a7
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
524
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_Bal', 'V', 'L', 'L', 'T', 'A', 'L', 'L', 'F', 'L', 'D', '-pip']
68
525
-5.17
-5.17
Lariat
3
-2.51e-16
-2.757513424
-2.76e-16
-2.903962476
-1.7e-16
-1.135369275
4.27e-16
-0.249287767
4.086456308
7164.687729
272.0
null
null
159.0276149
148.6737909
42.67379092
83.69334607
73.84777487
21.46739063
14.22628747
14.22628747
7.938102597
7.938102597
4.64777677
4.64777677
null
null
null
null
463.6774131
53.87041891
57.53444621
0
0
0
0
0
0
5.108808191
91.90126436
1250.800231
0.561797753
1.011235955
1.471910112
0.71875
268.0
PEPTIDE525{[Me_Bal].V.L.L.T.A.L.L.F.L.D.[-pip]}$PEPTIDE525,PEPTIDE525,1:R1-11:R3$$$
PEPTIDE525{<a href="/monomers/Me_Bal/">[Me_Bal]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/L/">L</a>.<a href...
-7.18
89
1144.775
525
null
null
1.7e+73
14.83246148
37.09405027
26.43426357
675.9312812
null
17.19800518
0.390716897
17.19800518
0.245409145
2.177891158
0.245409145
-7.656829704
-0.390716897
1.629
336.2228
1251.623
Lariat
12
11
null
11
25
null
null
0
2
2
1
0
1
13
11
25
0
31
0
2
2
500
DP-514
-5.17
-6.469442904
1.053145659
68.00676119
60.17892468
14.11842078
72.31735641
0.0
0.0
57.53444621
0.0
0.0
0.0
112.4347989
105.614381
147.5021817
34.38507983
null
-5.17
null
null
null
null
null
null
null
null
null
null
3
CC(C)C[C@@H]1NC(=O)[C@H](C)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)NC(=O)CCN(C)C(=O)C[C@@H](C(=O)N2CCCCC2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC1=O
206.983738
70.88615675
1.431199657
62.89795299
35.36374611
232.2876063
26.46640595
35.77554503
0
0.0
[['Caco2']]
[7748]
[['-7.47']]
['2023_Ohta']
['Me_Bal', 'V', 'L', 'L', 'T', 'A', 'L', 'L', 'F', 'L', 'D', '-pip']
[0.1369999999999998, 0.4292999999999995, 0.8193999999999995, 0.8193999999999995, -0.1918000000000002, -0.2068000000000003, 0.8193999999999995, 0.8193999999999995, 1.0159999999999998, 0.8193999999999995, -0.6377000000000004, 1.1021]
[20.31, 29.1, 29.1, 29.1, 38.33, 29.1, 29.1, 29.1, 29.1, 29.1, 46.17, 3.24]
53.09813353
0.0
0.0
0.0
179.9513327
63.90737111
35.36374611
295.441253
30.21209354
14.11842078
0.0
0
2013_CHUGAI
525
null
351.85
null
942.3964748
0.0
194.9312312
-27.90457584
-3.242913515
-99.74779251
-87.44621093
-80.00201227
-109.9842009
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
12
12
0
0
0
2
10
0
0
0
1
0
0
0
0
0
0
12
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.119160072
null
79948ef7c3f60889f714ea2b4c601c7d9e8550ef1de6dcb57a9712bc97c17241
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
525
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dA', 'L', 'F', 'I', 'L', 'F', 'T', 'L', 'F', 'D', '-pip']
59
526
-7.0
-7
Lariat
7
-1.9e-16
-2.756588501
-9.22e-17
-2.908007341
3.67e-18
-1.134729515
2.21e-15
-0.249287762
2.839796239
7365.471667
265.0
null
null
150.8011175
140.318329
43.31832904
81.26749003
70.22283034
22.34244609
14.72392131
14.72392131
8.585374271
8.585374271
5.121579825
5.121579825
null
Although it was not mentioned in the text, it may be -7 (by CycPeptMPDB)
null
null
471.7532433
52.49966036
52.73990902
0
0
0
0
0
0
5.108808191
80.93519592
1247.731818
0.533333333
0.933333333
1.333333333
0.567164179
260.0
PEPTIDE526{[dA].L.F.I.L.F.T.L.F.D.[-pip]}$PEPTIDE526,PEPTIDE526,1:R1-10:R3$$$
PEPTIDE526{<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/I/">I</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/D/">D</a>.<a href="/monom...
-8.21
90
1150.802
526
null
null
3.1e+69
15.97756374
35.84374743
23.30425341
666.1949003
null
17.24206607
0.390716897
17.24206607
0.245419195
2.09839298
0.245419195
-7.618145808
-0.390716897
2.5638
339.9678
1248.578
Lariat
11
10
null
11
23
null
null
0
2
2
3
0
3
12
11
23
0
27
0
2
2
492
DP-515
-7.0
-5.326582683
3.752069
63.10685145
60.17892468
14.11842078
66.41017668
0.0
0.0
52.73990902
0.0
0.0
0.0
151.8243425
92.20751886
114.3580074
48.09266539
null
-7.0
null
null
null
null
null
null
null
null
null
null
5
CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C[C@@H](C(=O)N2CCCCC2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC1=O
189.8523738
64.97897702
1.431199657
57.99804326
23.57583074
204.8800378
12.99371937
107.3266351
0
0.0
null
null
null
null
['dA', 'L', 'F', 'I', 'L', 'F', 'T', 'L', 'F', 'D', '-pip']
[-0.2068000000000003, 0.8193999999999995, 1.0159999999999998, 0.8193999999999999, 0.8193999999999995, 1.0159999999999998, -0.1918000000000002, 0.8193999999999995, 1.0159999999999998, -0.6377000000000004, 1.1021]
[29.1, 29.1, 29.1, 29.1, 29.1, 29.1, 38.33, 29.1, 29.1, 46.17, 3.24]
53.09813353
0.0
0.0
0.0
155.6715567
71.85868373
23.57583074
254.0779107
90.63628061
14.11842078
0.0
0
2013_CHUGAI
526
null
331.54
null
876.0297944
0.0
184.0343418
-26.57705212
-9.412019539
-80.68028271
-110.6879533
-77.3991334
-71.97436176
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
11
11
0
0
0
1
10
0
0
0
1
0
0
0
0
0
0
11
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.098654508
null
1f0f21d035ae4d12014133303cea7451c168d0a92d008227a330feaf2952a64f
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
526
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_Bal', 'meV', 'T', 'meA', 'meF', 'meA', 'Sar', 'meF', 'meL', 'I', 'D', '-pip']
82
527
-5.04
-5.04
Lariat
5
-2.46e-16
-2.758102694
-1.92e-16
-2.885367859
-1.8e-17
-1.134173726
1.33e-15
-0.249284435
3.392636759
7484.870572
198.0
null
null
158.9917165
148.1737909
44.17379092
84.34804661
74.03252729
22.28263821
15.17973166
15.17973166
9.344405276
9.344405276
5.296343591
5.296343591
null
null
null
null
481.2062049
41.24600725
57.53444621
0
0
0
0
0
0
5.108808191
101.4965743
1284.784581
0.608695652
1.195652174
1.75
0.641791045
199.0
PEPTIDE527{[Me_Bal].[meV].T.[meA].[meF].[meA].[Sar].[meF].[meL].I.D.[-pip]}$PEPTIDE527,PEPTIDE527,1:R1-11:R3$$$
PEPTIDE527{<a href="/monomers/Me_Bal/">[Me_Bal]</a>.<a href="/monomers/meV/">[meV]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL...
-7.96
92
1180.808
527
null
null
3.6199999999999997e+74
15.87859625
35.18210779
20.26918017
690.147012
null
17.73646985
0.390716755
17.73646985
0.247752854
2.128540009
0.247752854
-7.981254448
-0.390716755
1.7801
347.1479
1285.64
Lariat
12
11
null
4
25
null
null
0
2
2
2
0
2
13
4
25
0
29
0
2
2
510
DP-516
-5.04
-4.5658289
3.132026415
65.13743583
54.16103222
4.235526235
72.31735641
0.0
0.0
57.53444621
0.0
0.0
0.0
107.9084647
74.856152
201.3351363
49.10649085
null
-5.04
null
null
null
null
null
null
null
null
null
null
4
CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C(=O)CN(C)C(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C(C)C)N(C)C(=O)CCN(C)C(=O)C[C@@H](C(=O)N2CCCCC2)NC1=O
203.9546363
70.88615675
1.431199657
60.02862764
17.68187306
179.2644034
81.79405394
71.55109006
0
0.0
[['Caco2']]
[7724]
[['-7.51']]
['2023_Ohta']
['Me_Bal', 'meV', 'T', 'meA', 'meF', 'meA', 'Sar', 'meF', 'meL', 'I', 'D', '-pip']
[0.1369999999999998, 0.7715000000000001, -0.1918000000000002, 0.1353999999999999, 1.3581999999999996, 0.1353999999999999, -0.2531000000000001, 1.3581999999999996, 1.1616, 0.8193999999999999, -0.6377000000000004, 1.1021]
[20.31, 20.31, 38.33, 20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
263.5604564
70.28029601
17.68187306
254.480262
60.42418708
4.235526235
0.0
0
2013_CHUGAI
527
null
290.32
null
936.770915
0.0
177.6845563
-6.187238715
-6.490048587
-81.81897351
-93.55273522
-65.6385266
-135.5179487
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
12
12
0
0
0
9
3
0
0
7
1
0
0
0
0
0
0
12
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.250018665
null
58847c4b605f5fed89f86736da6ab6f82a036e0696c62d96b0317fcf0570024d
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
527
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['meA', 'meL', 'L', 'meF', 'T', 'meA', 'meF', 'meL', 'D', '-pip']
65
528
-4.54
-4.54
Lariat
9
-3.21e-16
-2.758170938
-2.1e-16
-2.8859364
-7.68e-17
-1.135684192
1.35e-15
-0.249287767
3.459884267
6618.245867
178.0
null
null
142.6823154
133.4628672
39.46286715
75.7946286
66.78263821
20.03274914
13.67499934
13.67499934
8.344336114
8.344336114
4.876346891
4.876346891
null
null
null
null
432.6466528
38.50449014
47.94537184
0
0
0
0
0
0
5.108808191
90.53050581
1142.710354
0.597560976
1.073170732
1.585365854
0.639344262
165.0
PEPTIDE528{[meA].[meL].L.[meF].T.[meA].[meF].[meL].D.[-pip]}$PEPTIDE528,PEPTIDE528,1:R1-9:R3$$$
PEPTIDE528{<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/D/">D</a>.<a href="/mo...
-6.9
82
1048.73
528
null
null
1.58e+65
13.92241619
30.95478216
18.04899736
618.0649428
null
17.72062888
0.390716755
17.72062888
0.247752854
2.137600579
0.247752854
-7.880095256
-0.390716755
2.8633
311.8739
1143.482
Lariat
10
9
null
4
21
null
null
0
2
2
2
0
2
11
4
21
0
28
0
2
2
454
DP-520
-4.54
-3.407423486
2.720574396
55.33761637
54.16103222
4.235526235
60.50299695
0.0
0.0
47.94537184
0.0
0.0
0.0
101.5355398
87.6020018
163.5476295
39.86811405
null
-4.54
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)N(C)C(=O)C[C@@H](C(=O)N2CCCCC2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)N(C)C1=O
180.6579763
59.07179729
1.431199657
50.22880818
17.68187306
179.2644034
54.84868077
71.55109006
0
0.0
[['Caco2']]
[7761]
[['-6.30']]
['2023_Ohta']
['meA', 'meL', 'L', 'meF', 'T', 'meA', 'meF', 'meL', 'D', '-pip']
[0.1353999999999999, 1.1616, 0.8193999999999995, 1.3581999999999996, -0.1918000000000002, 0.1353999999999999, 1.3581999999999996, 1.1616, -0.6377000000000004, 1.1021]
[20.31, 20.31, 29.1, 20.31, 38.33, 20.31, 20.31, 20.31, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
215.0009043
60.69122164
17.68187306
240.7726764
60.42418708
4.235526235
0.0
0
2013_CHUGAI
528
null
249.7
null
849.6152787
0.0
151.4850261
-5.945769221
-6.498309063
-71.3671814
-94.03442568
-66.3938544
-107.9440984
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
10
10
0
0
0
7
3
0
0
6
1
0
0
0
0
0
0
10
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.240708508
null
fc7dff51c7ee37746418cf3a8387e5211814da8e810acc222024296f2aedb490
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
528
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Sar', 'T', 'meA', 'Ser(tBu)', 'meF', 'meL', 'meF', 'D', '-pip']
65
529
-4.36
-4.36
Lariat
6
-2.21e-16
-2.757041874
-1.52e-16
-2.879300975
3.66e-17
-1.134114611
1.78e-15
-0.249260305
3.304333141
5740.164426
176.0
null
null
125.2347216
116.5156536
35.51565355
66.97502637
58.31594197
18.06605289
12.33433675
12.33433675
7.310321737
7.310321737
4.258304968
4.258304968
null
null
null
null
383.2472978
27.49733817
43.15083466
0
0
0
0
0
0
9.845671145
83.71779655
1031.605554
0.783783784
1.391891892
1.959459459
0.611111111
173.0
PEPTIDE529{[Sar].T.[meA].[Ser(tBu)].[meF].[meL].[meF].D.[-pip]}$PEPTIDE529,PEPTIDE529,1:R1-8:R3$$$
PEPTIDE529{<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/Ser(tBu)/">[Ser(tBu)]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/-pip/">[-pip...
-6.41
74
950.646
529
null
null
2.91e+54
13.0424557
27.21912857
16.80873093
550.4379209
null
17.77646376
0.390716756
17.77646376
0.247752576
2.080864869
0.247752576
-7.823365183
-0.390716756
1.3707
277.5159
1032.294
Lariat
9
8
null
4
20
null
null
0
2
2
2
0
2
11
4
20
0
20
0
2
2
408
DP-521
-4.36
-1.374815485
2.786801693
55.17456959
42.12524728
4.235526235
54.59581722
0.0
0.0
43.15083466
0.0
0.0
0.0
74.12797131
76.77202086
136.0104243
61.2665269
null
-4.36
null
null
null
null
null
null
null
null
null
null
4
CC(C)C[C@H]1C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)CC(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](COC(C)(C)C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N1C
162.7804409
53.16461756
1.431199657
45.32889844
5.893957685
146.3800352
60.9286988
71.55109006
0
0.0
[['Caco2']]
[7763]
[['-7.23']]
['2023_Ohta']
['Sar', 'T', 'meA', 'Ser(tBu)', 'meF', 'meL', 'meF', 'D', '-pip']
[-0.2531000000000001, -0.1918000000000002, 0.1353999999999999, 0.5883999999999996, 1.3581999999999996, 1.1616, 1.3581999999999996, -0.6377000000000004, 1.1021]
[20.31, 38.33, 20.31, 38.33, 20.31, 20.31, 20.31, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
203.8390987
60.63354741
5.893957685
196.5031811
60.42418708
4.235526235
0.0
0
2013_CHUGAI
529
null
238.62
null
727.6591926
0.0
134.4901997
-5.0708681
-12.56613231
-50.21672227
-76.35917952
-50.07881043
-98.60767962
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
9
9
0
0
0
6
3
0
0
5
1
0
0
0
0
0
0
9
0
0
0
0
0
0
2
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.265300933
null
e35333f79b4fff322d13e0bc89ea34a0442c03ea905288a751054c4ece288580
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
529
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_Bal', 'T', 'meA', 'Ser(tBu)', 'meF', 'meL', 'G', 'D', '-pip']
66
530
-5.28
-5.28
Lariat
9
-2.46e-16
-2.756601971
-1.81e-16
-2.880048754
-5.87e-17
-1.134115654
1.71e-15
-0.249260237
3.738602142
5002.325201
210.0
null
null
115.27062
107.0156536
32.01565355
61.08827503
53.28954876
16.09244609
10.87392655
10.87392655
6.257927846
6.257927846
3.549569882
3.549569882
null
null
null
null
341.3847967
17.86094475
43.15083466
0
0
0
0
0
0
9.845671145
85.17072215
941.5586042
0.895522388
1.611940299
2.23880597
0.680851064
212.0
PEPTIDE530{[Me_Bal].T.[meA].[Ser(tBu)].[meF].[meL].G.D.[-pip]}$PEPTIDE530,PEPTIDE530,1:R1-8:R3$$$
PEPTIDE530{<a href="/monomers/Me_Bal/">[Me_Bal]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/Ser(tBu)/">[Ser(tBu)]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/G/">G</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/-pip/">[-pip...
-5.63
67
866.569
530
null
null
5.93e+48
11.68192983
25.48871985
16.8848994
500.4341468
null
17.16901569
0.390716764
17.16901569
0.247751621
2.024152916
0.247751621
-7.316842975
-0.390716764
-0.1927
248.4386
942.169
Lariat
9
8
null
5
20
null
null
0
2
2
1
0
1
11
5
20
0
17
0
2
2
374
DP-522
-5.28
-0.235502004
1.104896444
55.58447321
36.10735481
5.647368313
54.59581722
0.0
0.0
43.15083466
0.0
0.0
0.0
43.91587777
71.20856937
134.1606985
53.04197557
null
-5.28
null
null
null
null
null
null
null
null
null
null
3
CC(C)C[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)CCC(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](COC(C)(C)C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N1C
154.596973
53.16461756
1.431199657
45.73880207
5.893957685
140.3621428
60.44973158
35.77554503
0
0.0
[['Caco2']]
[7765]
[['-7.07']]
['2023_Ohta']
['Me_Bal', 'T', 'meA', 'Ser(tBu)', 'meF', 'meL', 'G', 'D', '-pip']
[0.1369999999999998, -0.1918000000000002, 0.1353999999999999, 0.5883999999999996, 1.3581999999999996, 1.1616, -0.5953000000000002, -0.6377000000000004, 1.1021]
[20.31, 38.33, 20.31, 38.33, 20.31, 20.31, 29.1, 46.17, 3.24]
21.23925341
0.0
0.0
0.0
192.4423293
54.26062251
5.893957685
187.7173447
30.21209354
5.647368313
0.0
0
2013_CHUGAI
530
null
247.41
null
658.5417289
0.0
132.0805894
-7.367875819
-9.167928846
-47.65204909
-54.3969556
-48.16604188
-95.87146709
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
9
9
0
0
0
5
4
0
0
3
1
0
0
0
0
0
0
9
0
0
0
0
0
0
1
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.228706188
null
98cbc17a028803f553da3e85af6fef211c949f10c1cfca7f795cf23ff23df156
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
530
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['meA', 'meF', 'meL', 'T', 'Sar', 'meL', 'Ser(tBu)', 'D', '-pip']
65
531
-4.7
-4.7
Lariat
2
-2.51e-16
-2.757086141
-2.76e-16
-2.885471453
-7.72e-17
-1.135204652
7.16e-16
-0.249287763
4.00470157
5444.269888
158.0
null
null
125.27062
117.0156536
34.01565355
66.04959989
58.31594197
17.06605289
11.70933675
11.70933675
6.810321737
6.810321737
3.917854118
3.917854118
null
null
null
null
367.0694947
30.2799388
43.15083466
0
0
0
0
0
0
9.845671145
83.67671303
997.6212045
0.802816901
1.436619718
2.014084507
0.705882353
166.0
PEPTIDE531{[meA].[meF].[meL].T.[Sar].[meL].[Ser(tBu)].D.[-pip]}$PEPTIDE531,PEPTIDE531,1:R1-8:R3$$$
PEPTIDE531{<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Ser(tBu)/">[Ser(tBu)]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/-pip/">[-pip...
-5.63
71
914.613
531
null
null
2.53e+54
11.97907003
26.71317939
17.28217809
537.2855941
null
17.29186256
0.390716756
17.29186256
0.247548563
2.056660626
0.247548563
-7.527455406
-0.390716756
1.1741
266.8249
998.277
Lariat
9
8
null
4
20
null
null
0
2
2
1
0
1
11
4
20
0
22
0
2
2
398
DP-523
-4.7
-1.50092374
1.349244035
55.17456959
42.12524728
4.235526235
54.59581722
0.0
0.0
43.15083466
0.0
0.0
0.0
57.61966201
83.47545196
139.2328093
54.41273412
null
-4.7
null
null
null
null
null
null
null
null
null
null
3
CC(C)C[C@H]1C(=O)N[C@@H](COC(C)(C)C)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)CC(=O)N1C
165.521958
53.16461756
1.431199657
45.32889844
11.78791537
160.0838195
60.9286988
35.77554503
0
0.0
[['Caco2']]
[7767]
[['-7.03']]
['2023_Ohta']
['meA', 'meF', 'meL', 'T', 'Sar', 'meL', 'Ser(tBu)', 'D', '-pip']
[0.1353999999999999, 1.3581999999999996, 1.1616, -0.1918000000000002, -0.2531000000000001, 1.1616, 0.5883999999999996, -0.6377000000000004, 1.1021]
[20.31, 20.31, 20.31, 38.33, 20.31, 20.31, 38.33, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
203.8390987
54.26062251
11.78791537
213.7579559
30.21209354
4.235526235
0.0
0
2013_CHUGAI
531
null
238.62
null
737.6204403
0.0
133.7444236
-5.675461402
-9.341416469
-57.34600671
-64.01600757
-50.90784494
-111.0781268
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
9
9
0
0
0
6
3
0
0
5
1
0
0
0
0
0
0
9
0
0
0
0
0
0
1
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.25975291
null
89b9a50bf74c9dd123d6f5b9d2ff4f7b6fff4488d64a8a6caf7115c7068c7ddb
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
532
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Mono6', 'meF', 'T', 'Sar', 'Ser(tBu)', 'meL', 'meL', 'D', '-pip']
67
533
-4.66
-4.66
Lariat
4
-2.99e-16
-2.758564902
-2.26e-16
-2.879130051
-7e-17
-1.13600818
7.69e-16
-0.249287767
3.956859535
5563.157896
172.0
null
null
127.77062
119.5156536
34.51565355
67.29959989
59.56594197
17.31605289
11.72253335
11.72253335
6.721276491
6.721276491
3.886707716
3.886707716
null
null
null
null
373.4424196
34.39221447
43.15083466
0
0
0
0
0
0
9.845671145
82.30595447
1011.636855
0.791666667
1.444444444
2.055555556
0.711538462
168.0
PEPTIDE533{[Mono6].[meF].T.[Sar].[Ser(tBu)].[meL].[meL].D.[-pip]}$PEPTIDE533,PEPTIDE533,1:R1-8:R3$$$
PEPTIDE533{<a href="/monomers/Mono6/">[Mono6]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/Ser(tBu)/">[Ser(tBu)]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/-pip/">[...
-5.63
72
926.624
533
null
null
2.12e+55
12.0572413
27.99111255
18.44877899
546.4604772
null
17.43287794
0.390716756
17.43287794
0.247548445
1.937957931
0.247548445
-7.913419438
-0.390716756
1.5658
271.4639
1012.304
Lariat
9
8
null
4
20
null
null
0
2
2
1
0
1
11
4
20
0
21
0
2
2
404
DP-525
-4.66
-1.593977852
1.433508138
55.17456959
36.10735481
4.235526235
54.59581722
0.0
0.0
43.15083466
0.0
0.0
0.0
57.61966201
82.99648474
156.2148695
53.04197557
null
-4.66
null
null
null
null
null
null
null
null
null
null
3
CC(C)C[C@H]1C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)CCCC(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)CC(=O)N[C@@H](COC(C)(C)C)C(=O)N1C
168.2634751
53.16461756
1.431199657
45.32889844
11.78791537
159.9598847
67.42555848
35.77554503
0
0.0
[['Caco2']]
[7771]
[['-7.47']]
['2023_Ohta']
['Mono6', 'meF', 'T', 'Sar', 'Ser(tBu)', 'meL', 'meL', 'D', '-pip']
[0.5270999999999999, 1.3581999999999996, -0.1918000000000002, -0.2531000000000001, 0.5883999999999996, 1.1616, 1.1616, -0.6377000000000004, 1.1021]
[20.31, 20.31, 38.33, 20.31, 38.33, 20.31, 20.31, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
204.3180659
54.26062251
11.78791537
222.3934307
30.21209354
4.235526235
0.0
0
2013_CHUGAI
533
null
238.62
null
755.1224023
0.0
132.4660732
-5.348295706
-9.123820048
-57.18913695
-56.00873336
-64.0990958
-111.5693936
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
9
9
0
0
0
6
3
0
0
4
1
0
0
0
0
0
0
9
0
0
0
0
0
0
1
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.262567193
null
d0ad46040d48f39da025335db9238a60f08f40a459cec46be75ad2a2c268dffe
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
533
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'A', 'T', 'meA', 'F', 'meL', 'meF', 'D', '-pip']
55
534
-4.85
-4.85
Lariat
4
-1.75e-16
-2.757105397
-1.18e-16
-2.887178527
2.65e-17
-1.134052502
1.91e-15
-0.249251818
3.197384871
5400.971149
199.0
null
null
117.0276149
108.6074053
33.60740526
62.84526986
54.35490727
17.210591
11.61361619
11.61361619
7.038365253
7.038365253
4.104006055
4.104006055
null
null
null
null
363.3704057
27.53842169
43.15083466
0
0
0
0
0
0
5.108808191
75.53432873
973.5636896
0.728571429
1.385714286
1.971428571
0.588235294
199.0
PEPTIDE534{[dV].A.T.[meA].F.[meL].[meF].D.[-pip]}$PEPTIDE534,PEPTIDE534,1:R1-8:R3$$$
PEPTIDE534{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/-pip/">[-pip]</a>}$PEPTIDE534,PEPTID...
-6.37
70
898.614
534
null
null
3.74e+48
12.44274602
26.01228092
15.31390296
517.4958967
null
17.4915424
0.390716755
17.4915424
0.24775273
1.966984582
0.24775273
-7.588609837
-0.390716755
0.9157
261.9893
974.214
Lariat
9
8
null
6
19
null
null
0
2
2
2
0
2
10
6
19
0
20
0
2
2
384
DP-526
-4.85
-0.872178147
2.203064664
51.25751388
48.14313975
7.059210392
54.59581722
0.0
0.0
43.15083466
0.0
0.0
0.0
87.83175555
68.96219431
115.2049777
38.4973555
null
-4.85
null
null
null
null
null
null
null
null
null
null
4
CC(C)C[C@H]1C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1C
149.9011936
53.16461756
1.431199657
46.14870569
11.78791537
146.7968769
33.92120007
71.55109006
0
0.0
[['Caco2']]
[7773]
[['-7.38']]
['2023_Ohta']
['dV', 'A', 'T', 'meA', 'F', 'meL', 'meF', 'D', '-pip']
[0.4292999999999995, -0.2068000000000003, -0.1918000000000002, 0.1353999999999999, 1.0159999999999998, 1.1616, 1.3581999999999996, -0.6377000000000004, 1.1021]
[29.1, 29.1, 38.33, 20.31, 29.1, 20.31, 20.31, 46.17, 3.24]
26.54906677
0.0
0.0
0.0
167.4486222
55.89668446
11.78791537
185.5371127
60.42418708
7.059210392
0.0
0
2013_CHUGAI
534
null
246.97
null
666.4585706
0.0
138.122357
-10.22666506
-6.068294285
-55.11285596
-80.04509498
-49.24485671
-71.88316064
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
9
9
0
0
0
4
5
0
0
3
1
0
0
0
0
0
0
9
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.207557311
null
2ba9fc8d0cb6eecf8dc2c8f2bc509386acf5199c1c81cee2bd7c6bb4ed82be3c
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
535
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dA', 'meF', 'meL', 'T', 'Sar', 'meL', 'Ser(tBu)', 'D', '-pip']
64
536
-4.89
-4.89
Lariat
4
-2.57e-16
-2.756723828
-2.43e-16
-2.886558204
-1.1e-16
-1.13520465
1.17e-15
-0.249287763
3.925265902
5332.700109
172.0
null
null
122.77062
114.5156536
33.51565355
64.83827503
57.03954876
16.84244609
11.48572995
11.48572995
6.596973092
6.596973092
3.842081495
3.842081495
null
null
null
null
360.5035714
31.69178088
43.15083466
0
0
0
0
0
0
9.845671145
79.56443736
983.6055544
0.828571429
1.471428571
2.057142857
0.7
168.0
PEPTIDE536{[dA].[meF].[meL].T.[Sar].[meL].[Ser(tBu)].D.[-pip]}$PEPTIDE536,PEPTIDE536,1:R1-8:R3$$$
PEPTIDE536{<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Ser(tBu)/">[Ser(tBu)]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/-pip/">[-pip]<...
-5.63
70
902.602
536
null
null
7.53e+51
11.90235108
26.54308985
17.34626281
527.9587961
null
17.15919473
0.390716756
17.15919473
0.247548563
2.018207917
0.247548563
-7.461891621
-0.390716756
0.8319
262.1976
984.25
Lariat
9
8
null
5
20
null
null
0
2
2
1
0
1
11
5
20
0
21
0
2
2
392
DP-528
-4.89
-1.383727433
1.250377417
55.58447321
42.12524728
5.647368313
54.59581722
0.0
0.0
43.15083466
0.0
0.0
0.0
57.61966201
83.47545196
128.1447067
54.41273412
null
-4.89
null
null
null
null
null
null
null
null
null
null
3
CC(C)C[C@H]1C(=O)N[C@@H](COC(C)(C)C)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N[C@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)CC(=O)N1C
162.8215244
53.16461756
1.431199657
45.73880207
11.78791537
160.0838195
53.9528719
35.77554503
0
0.0
[['Caco2']]
[7777]
[['-7.30']]
['2023_Ohta']
['dA', 'meF', 'meL', 'T', 'Sar', 'meL', 'Ser(tBu)', 'D', '-pip']
[-0.2068000000000003, 1.3581999999999996, 1.1616, -0.1918000000000002, -0.2531000000000001, 1.1616, 0.5883999999999996, -0.6377000000000004, 1.1021]
[29.1, 20.31, 20.31, 38.33, 20.31, 20.31, 38.33, 46.17, 3.24]
21.23925341
0.0
0.0
0.0
191.9633621
54.26062251
11.78791537
209.6456802
30.21209354
5.647368313
0.0
0
2013_CHUGAI
536
null
247.41
null
717.2686272
0.0
135.4661813
-8.378014544
-9.229420164
-56.48240139
-62.97131621
-50.27387649
-103.6497797
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
9
9
0
0
0
5
4
0
0
4
1
0
0
0
0
0
0
9
0
0
0
0
0
0
1
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.219904075
null
67bc16bb2ca1310fd4222bade2ffc690c97218ad8839a4ecb7ce314f365817d7
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
536
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dA', 'meF', 'meL', 'T', 'meA', 'meL', 'Ser(tBu)', 'D', '-pip']
64
537
-4.64
-4.64
Lariat
6
-2.34e-16
-2.756734276
-2.2e-16
-2.888986595
-5.69e-17
-1.135207672
9.47e-16
-0.249287763
4.00012337
5448.269888
163.0
null
null
125.27062
117.0156536
34.01565355
66.08827503
58.28954876
17.09244609
11.72253335
11.72253335
6.815709227
6.815709227
3.948755818
3.948755818
null
null
null
null
366.8764963
30.32102232
43.15083466
0
0
0
0
0
0
9.845671145
83.67671303
997.6212045
0.788732394
1.408450704
1.971830986
0.705882353
163.0
PEPTIDE537{[dA].[meF].[meL].T.[meA].[meL].[Ser(tBu)].D.[-pip]}$PEPTIDE537,PEPTIDE537,1:R1-8:R3$$$
PEPTIDE537{<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Ser(tBu)/">[Ser(tBu)]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/-pip/">[-pip]<...
-5.63
71
914.613
537
null
null
4.9e+54
11.97907003
26.71317939
17.28217809
537.1336792
null
17.23185313
0.390716755
17.23185313
0.247752853
2.038161555
0.247752853
-7.624391621
-0.390716755
1.2204
266.7926
998.277
Lariat
9
8
null
5
20
null
null
0
2
2
1
0
1
11
5
20
0
22
0
2
2
398
DP-529
-4.64
-1.804685269
1.123763865
55.58447321
48.14313975
5.647368313
54.59581722
0.0
0.0
43.15083466
0.0
0.0
0.0
57.61966201
90.32734407
132.2569824
46.54511588
null
-4.64
null
null
null
null
null
null
null
null
null
null
3
CC(C)C[C@H]1C(=O)N[C@@H](COC(C)(C)C)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N[C@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N1C
165.5630415
53.16461756
1.431199657
45.73880207
11.78791537
172.9536041
47.45601221
35.77554503
0
0.0
[['Caco2']]
[7779]
[['-7.09']]
['2023_Ohta']
['dA', 'meF', 'meL', 'T', 'meA', 'meL', 'Ser(tBu)', 'D', '-pip']
[-0.2068000000000003, 1.3581999999999996, 1.1616, -0.1918000000000002, 0.1353999999999999, 1.1616, 0.5883999999999996, -0.6377000000000004, 1.1021]
[29.1, 20.31, 20.31, 38.33, 20.31, 20.31, 38.33, 46.17, 3.24]
21.23925341
0.0
0.0
0.0
191.4843949
54.26062251
11.78791537
219.2390895
30.21209354
5.647368313
0.0
0
2013_CHUGAI
537
null
247.41
null
737.793082
0.0
136.498213
-8.573145135
-9.305384488
-57.3803603
-70.97945226
-50.75081948
-104.3021333
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
9
9
0
0
0
5
4
0
0
4
1
0
0
0
0
0
0
9
0
0
0
0
0
0
1
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.223180851
null
31c77d080acb484fe45c28a108dec7b71eb05302d1131a888372bfd22226f63e
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
538
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Sar', 'T', 'meA', 'Ser(tBu)', 'meF', 'meL', 'D', '-pip']
58
539
-5.24
-5.24
Lariat
9
-1.93e-16
-2.75786963
-1.65e-16
-2.885804971
-2.92e-17
-1.134120843
1.09e-15
-0.249260233
3.816785656
4591.410641
174.0
null
null
107.1159195
99.66019167
29.66019167
56.77289089
49.69099743
14.94110835
10.22016719
10.22016719
5.937646466
5.937646466
3.41494471
3.41494471
null
null
null
null
317.298019
22.01430394
38.35629747
0
0
0
0
0
0
9.845671145
74.12248666
870.5214904
0.935483871
1.64516129
2.258064516
0.681818182
171.0
PEPTIDE539{[Sar].T.[meA].[Ser(tBu)].[meF].[meL].D.[-pip]}$PEPTIDE539,PEPTIDE539,1:R1-7:R3$$$
PEPTIDE539{<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/Ser(tBu)/">[Ser(tBu)]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/-pip/">[-pip]</a>}$PEPTIDE539,PEPTIDE539,1:R1-7...
-5.1
62
800.53
539
null
null
6.46e+43
10.70114004
22.83337815
14.49435515
464.545027
null
17.2591382
0.390716756
17.2591382
0.247752576
2.005448056
0.247752576
-7.470974417
-0.390716756
0.301
230.8119
871.09
Lariat
8
7
null
4
18
null
null
0
2
2
1
0
1
10
4
18
0
17
0
2
2
346
DP-531
-5.24
0.492720183
1.033193502
50.27465986
36.10735481
4.235526235
48.68863749
0.0
0.0
38.35629747
0.0
0.0
0.0
43.91587777
71.20856937
115.8078797
53.04197557
null
-5.24
null
null
null
null
null
null
null
null
null
null
3
CC(C)C[C@H]1C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)CC(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](COC(C)(C)C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N1C
142.9075596
47.25743783
1.431199657
40.42898871
5.893957685
133.9892179
53.9528719
35.77554503
0
0.0
null
null
null
null
['Sar', 'T', 'meA', 'Ser(tBu)', 'meF', 'meL', 'D', '-pip']
[-0.2531000000000001, -0.1918000000000002, 0.1353999999999999, 0.5883999999999996, 1.3581999999999996, 1.1616, -0.6377000000000004, 1.1021]
[20.31, 38.33, 20.31, 38.33, 20.31, 20.31, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
180.0382899
49.46608533
5.893957685
175.8613855
30.21209354
4.235526235
0.0
0
2013_CHUGAI
539
null
218.31
null
616.2166357
0.0
117.328396
-4.789162025
-9.102922839
-43.5818751
-54.56320283
-42.32842865
-89.34610693
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
8
8
0
0
0
5
3
0
0
4
1
0
0
0
0
0
0
8
0
0
0
0
0
0
1
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.280319081
null
6644c4f0a33db60a307a697d4b1c84bcd20f0b0d6c56a391b7ec60ffdaf5f82f
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
539
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_Bal', 'T', 'meA', 'Ser(tBu)', 'meF', 'meL', 'D', '-pip']
61
540
-4.7
-4.7
Lariat
9
-2.89e-16
-2.758038302
-2.08e-16
-2.879062769
-4.72e-17
-1.134122273
1.37e-15
-0.249260234
3.831451364
4706.333194
161.0
null
null
109.6159195
102.1601917
30.16019167
58.02289089
50.94099743
15.19110835
10.34516719
10.34516719
6.004837355
6.004837355
3.425975486
3.425975486
null
null
null
null
323.6709439
22.01430394
38.35629747
0
0
0
0
0
0
9.845671145
76.86400377
884.5371405
0.920634921
1.634920635
2.253968254
0.688888889
164.0
PEPTIDE540{[Me_Bal].T.[meA].[Ser(tBu)].[meF].[meL].D.[-pip]}$PEPTIDE540,PEPTIDE540,1:R1-7:R3$$$
PEPTIDE540{<a href="/monomers/Me_Bal/">[Me_Bal]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/Ser(tBu)/">[Ser(tBu)]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/-pip/">[-pip]</a>}$PEPTIDE540,PEPTIDE540,...
-5.1
63
812.541
540
null
null
1.02e+44
10.77490638
23.54487176
15.29202626
473.7199101
null
17.31725854
0.390716764
17.31725854
0.247751621
2.024582435
0.247751621
-7.510159014
-0.390716764
0.6911
235.4289
885.117
Lariat
8
7
null
4
18
null
null
0
2
2
1
0
1
10
4
18
0
17
0
2
2
352
DP-532
-4.7
0.419290457
0.948019683
50.27465986
36.10735481
4.235526235
48.68863749
0.0
0.0
38.35629747
0.0
0.0
0.0
43.91587777
71.20856937
134.1606985
43.80359877
null
-4.7
null
null
null
null
null
null
null
null
null
null
3
CC(C)C[C@H]1C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)CCC(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](COC(C)(C)C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N1C
145.6490767
47.25743783
1.431199657
40.42898871
5.893957685
140.3621428
53.9528719
35.77554503
0
0.0
null
null
null
null
['Me_Bal', 'T', 'meA', 'Ser(tBu)', 'meF', 'meL', 'D', '-pip']
[0.1369999999999998, -0.1918000000000002, 0.1353999999999999, 0.5883999999999996, 1.3581999999999996, 1.1616, -0.6377000000000004, 1.1021]
[20.31, 38.33, 20.31, 38.33, 20.31, 20.31, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
180.0382899
49.46608533
5.893957685
184.9758275
30.21209354
4.235526235
0.0
0
2013_CHUGAI
540
null
218.31
null
634.8143676
0.0
117.4762652
-4.84051104
-9.158248777
-43.80018644
-54.84788795
-48.86001462
-89.70045063
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
8
8
0
0
0
5
3
0
0
3
1
0
0
0
0
0
0
8
0
0
0
0
0
0
1
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.286561315
null
568ddfff0ced8475516ced977df546afa0add7ce063a2164e30e36a9c661ea92
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
540
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['meA', 'meF', 'meL', 'T', 'Sar', 'meL', 'D', '-pip']
53
541
-5.0
-5
Lariat
9
-2.3e-16
-2.757980328
-1.95e-16
-2.880082482
-6.64e-17
-1.135202584
8.4e-16
-0.249287763
3.81553214
4590.440372
126.0
null
null
106.4088127
99.25194338
29.25194338
56.27710897
49.55914234
14.75646686
10.05846362
10.05846362
6.093598082
6.093598082
3.524175524
3.524175524
null
null
null
null
317.1188967
22.01430394
38.35629747
0
0
0
0
0
0
5.108808191
74.08140313
854.5265758
0.819672131
1.442622951
2.016393443
0.681818182
126.0
PEPTIDE541{[meA].[meF].[meL].T.[Sar].[meL].D.[-pip]}$PEPTIDE541,PEPTIDE541,1:R1-7:R3$$$
PEPTIDE541{<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/-pip/">[-pip]</a>}$PEPTIDE541,PEPTIDE541,1:R1-7:R3$$$
-5.06
61
784.531
541
null
null
2.17e+43
10.3154239
22.68676694
13.46406407
459.5833966
null
16.98564969
0.390716756
16.98564969
0.247548563
1.947268485
0.247548563
-7.301622853
-0.390716756
0.8742
229.1892
855.091
Lariat
8
7
null
3
17
null
null
0
2
2
1
0
1
9
3
17
0
20
0
2
2
340
DP-533
-5.0
0.878079016
0.968362654
45.12789328
36.10735481
2.823684157
48.68863749
0.0
0.0
38.35629747
0.0
0.0
0.0
57.61966201
62.9197756
126.8959822
38.1404224
null
-5.0
null
null
null
null
null
null
null
null
null
null
3
CC(C)C[C@H]1C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)CC(=O)N1C
138.1296131
47.25743783
1.431199657
40.01908509
11.78791537
127.9091999
54.36971355
35.77554503
0
0.0
null
null
null
null
['meA', 'meF', 'meL', 'T', 'Sar', 'meL', 'D', '-pip']
[0.1353999999999999, 1.3581999999999996, 1.1616, -0.1918000000000002, -0.2531000000000001, 1.1616, -0.6377000000000004, 1.1021]
[20.31, 20.31, 20.31, 38.33, 20.31, 20.31, 46.17, 3.24]
10.61962671
0.0
0.0
0.0
179.7539905
44.72922237
11.78791537
176.7531769
30.21209354
2.823684157
0.0
0
2013_CHUGAI
541
null
200.29
null
613.8705164
0.0
115.3804644
-2.124696082
-2.976740278
-50.17576112
-54.38011013
-49.25461909
-84.00572075
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
8
8
0
0
0
6
2
0
0
5
1
0
0
0
0
0
0
8
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.339799563
null
08404ed6558c9ed1af2048ee942541e09241f50e3143c3f9fdc52da8cea1c92e
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
541
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Mono6', 'T', 'meL', 'Sar', 'meF', 'Ser(tBu)', 'D', '-pip']
60
542
-5.2
-5.2
Lariat
1
-1.82e-16
-2.757102909
-1.6e-16
-2.884029384
-4.07e-17
-1.134089506
9.49e-16
-0.24926015
3.705113266
4707.842969
155.0
null
null
109.6159195
102.1601917
30.16019167
58.02289089
50.94099743
15.19110835
10.23336379
10.23336379
5.84860122
5.84860122
3.352896608
3.352896608
null
null
null
null
323.6709439
23.3850625
38.35629747
0
0
0
0
0
0
9.845671145
75.49324521
884.5371405
0.904761905
1.634920635
2.26984127
0.688888889
168.0
PEPTIDE542{[Mono6].T.[meL].[Sar].[meF].[Ser(tBu)].D.[-pip]}$PEPTIDE542,PEPTIDE542,1:R1-7:R3$$$
PEPTIDE542{<a href="/monomers/Mono6/">[Mono6]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/Ser(tBu)/">[Ser(tBu)]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/-pip/">[-pip]</a>}$PEPTIDE542,PEPTIDE542,1:...
-5.1
63
812.541
542
null
null
4.82e+44
10.77490638
24.09625522
16.1966876
473.7199101
null
16.71900766
0.390716764
16.71900766
0.247761798
1.946758912
0.247761798
-7.191574067
-0.390716764
0.6927
235.4509
885.117
Lariat
8
7
null
4
18
null
null
0
2
2
1
0
1
10
4
18
0
16
0
2
2
352
DP-534
-5.2
0.726173241
1.104946356
50.27465986
30.08946234
4.235526235
48.68863749
0.0
0.0
38.35629747
0.0
0.0
0.0
43.91587777
70.72960215
132.7899399
51.67121701
null
-5.2
null
null
null
null
null
null
null
null
null
null
3
CC(C)C[C@H]1C(=O)N(C)CC(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](COC(C)(C)C)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)CCCC(=O)N[C@@H]([C@@H](C)O)C(=O)N1C
145.6490767
47.25743783
1.431199657
40.42898871
5.893957685
133.8652831
60.44973158
35.77554503
0
0.0
null
null
null
null
['Mono6', 'T', 'meL', 'Sar', 'meF', 'Ser(tBu)', 'D', '-pip']
[0.5270999999999999, -0.1918000000000002, 1.1616, -0.2531000000000001, 1.3581999999999996, 0.5883999999999996, -0.6377000000000004, 1.1021]
[20.31, 38.33, 20.31, 20.31, 20.31, 38.33, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
180.5172571
49.46608533
5.893957685
184.4968603
30.21209354
4.235526235
0.0
0
2013_CHUGAI
542
null
218.31
null
631.7602761
0.0
116.6454117
-4.770699096
-8.962492482
-42.95796893
-46.74196101
-54.60390787
-89.28532511
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
8
8
0
0
0
5
3
0
0
3
1
0
0
0
0
0
0
8
0
0
0
0
0
0
1
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.286584418
null
43997ef1432d3b03a50ee1efcfde91b388ebbf5acf3cbd698198c0b20a0b527b
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
542
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Mono6', 'meF', 'T', 'Sar', 'Ser(tBu)', 'meL', 'D', '-pip']
60
543
-4.68
-4.68
Lariat
4
-2.39e-16
-2.758146689
-1.76e-16
-2.88158153
-2.38e-17
-1.134087093
1.2e-15
-0.249260154
3.687805881
4707.842969
170.0
null
null
109.6159195
102.1601917
30.16019167
58.02289089
50.94099743
15.19110835
10.23336379
10.23336379
5.84860122
5.84860122
3.355847457
3.355847457
null
null
null
null
323.6709439
22.05538747
38.35629747
0
0
0
0
0
0
9.845671145
76.82292025
884.5371405
0.904761905
1.619047619
2.253968254
0.688888889
164.0
PEPTIDE543{[Mono6].[meF].T.[Sar].[Ser(tBu)].[meL].D.[-pip]}$PEPTIDE543,PEPTIDE543,1:R1-7:R3$$$
PEPTIDE543{<a href="/monomers/Mono6/">[Mono6]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/Ser(tBu)/">[Ser(tBu)]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/-pip/">[-pip]</a>}$PEPTIDE543,PEPTIDE543,1:...
-5.1
63
812.541
543
null
null
1.8e+44
10.77490638
24.09625522
16.1966876
473.7199101
null
16.72083475
0.390716756
16.72083475
0.247548445
1.832657518
0.247548445
-7.437497761
-0.390716756
0.6927
235.4509
885.117
Lariat
8
7
null
4
18
null
null
0
2
2
1
0
1
10
4
18
0
16
0
2
2
352
DP-535
-4.68
0.705441299
1.108647058
50.27465986
30.08946234
4.235526235
48.68863749
0.0
0.0
38.35629747
0.0
0.0
0.0
43.91587777
70.72960215
132.7899399
51.67121701
null
-4.68
null
null
null
null
null
null
null
null
null
null
3
CC(C)C[C@H]1C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)CCCC(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)CC(=O)N[C@@H](COC(C)(C)C)C(=O)N1C
145.6490767
47.25743783
1.431199657
40.42898871
5.893957685
133.8652831
60.44973158
35.77554503
0
0.0
null
null
null
null
['Mono6', 'meF', 'T', 'Sar', 'Ser(tBu)', 'meL', 'D', '-pip']
[0.5270999999999999, 1.3581999999999996, -0.1918000000000002, -0.2531000000000001, 0.5883999999999996, 1.1616, -0.6377000000000004, 1.1021]
[20.31, 20.31, 38.33, 20.31, 38.33, 20.31, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
180.5172571
49.46608533
5.893957685
184.4968603
30.21209354
4.235526235
0.0
0
2013_CHUGAI
543
null
218.31
null
631.6084121
0.0
116.6048332
-4.800876297
-8.781468535
-43.1500279
-46.06107183
-54.85593241
-89.48053506
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
8
8
0
0
0
5
3
0
0
3
1
0
0
0
0
0
0
8
0
0
0
0
0
0
1
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.286584418
null
8e8e6d53bdade06fd194d2bd004726962a971026df77fd757da202c0f15f0635
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
543
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_dA', 'meL', 'T', 'Sar', 'Ser(tBu)', 'meL', 'D', '-pip']
60
544
-5.0
-5
Lariat
2
-2.71e-16
-2.758118708
-2.59e-16
-2.886383912
-4.63e-17
-1.135203292
4.94e-16
-0.249287763
4.931112215
4304.178511
175.0
null
null
107.1518179
100.1601917
28.16019167
55.84746441
49.69099743
13.94110835
9.595167186
9.595167186
5.437646466
5.437646466
3.10244471
3.10244471
null
null
null
null
301.1202159
17.86094475
38.35629747
0
0
0
0
0
0
9.845671145
81.01736296
836.5371405
0.881355932
1.508474576
2.050847458
0.804878049
171.0
PEPTIDE544{[Me_dA].[meL].T.[Sar].[Ser(tBu)].[meL].D.[-pip]}$PEPTIDE544,PEPTIDE544,1:R1-7:R3$$$
PEPTIDE544{<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/Ser(tBu)/">[Ser(tBu)]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/-pip/">[-pip]</a>}$PEPTIDE544,PEPTIDE544,1:...
-4.32
59
764.497
544
null
null
1e+43
9.66513161
22.32917007
15.02609794
451.3927001
null
16.69106355
0.390716756
16.69106355
0.247548444
2.323420151
0.247548444
-7.477329593
-0.390716756
0.1044
220.1209
837.073
Lariat
8
7
null
4
18
null
null
0
2
2
0
0
0
10
4
18
0
19
0
2
2
336
DP-536
-5.0
-0.06977599
-0.5896338
50.27465986
36.10735481
4.235526235
48.68863749
0.0
0.0
38.35629747
0.0
0.0
0.0
27.40756847
77.91200046
119.0302647
46.18818278
null
-5.0
null
null
null
null
null
null
null
null
null
null
2
CC(C)C[C@H]1C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)CC(=O)N[C@@H](COC(C)(C)C)C(=O)N1C
145.6490767
47.25743783
1.431199657
40.42898871
11.78791537
147.6930021
53.9528719
0.0
0
0.0
null
null
null
null
['Me_dA', 'meL', 'T', 'Sar', 'Ser(tBu)', 'meL', 'D', '-pip']
[0.1353999999999999, 1.1616, -0.1918000000000002, -0.2531000000000001, 0.5883999999999996, 1.1616, -0.6377000000000004, 1.1021]
[20.31, 20.31, 38.33, 20.31, 38.33, 20.31, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
180.0382899
43.09316043
11.78791537
193.1161603
0.0
4.235526235
0.0
0
2013_CHUGAI
544
null
218.31
null
626.8905337
0.0
116.4448911
-5.164379681
-6.024030922
-50.63089633
-43.11031632
-43.27687021
-101.545598
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
8
8
0
0
0
5
3
0
0
4
1
0
0
0
0
0
0
8
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.258741156
null
64d7954db685e681b9c1e75e1346f50cb7532fa662e2dd3094717c4f3d6ccba9
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
544
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dA', 'meF', 'meL', 'T', 'Sar', 'meL', 'D', '-pip']
52
545
-5.0
-5
Lariat
1
-2.23e-16
-2.757594255
-1.74e-16
-2.881837683
-6.37e-19
-1.135202559
1.08e-15
-0.249287763
3.730340982
4481.465941
152.0
null
null
103.9088127
96.75194338
28.75194338
55.06578411
48.28274914
14.53286006
9.834856823
9.834856823
5.880249437
5.880249437
3.448402901
3.448402901
null
null
null
null
310.5529735
22.01430394
38.35629747
0
0
0
0
0
0
5.108808191
71.38096954
840.5109258
0.85
1.483333333
2.066666667
0.674418605
159.0
PEPTIDE545{[dA].[meF].[meL].T.[Sar].[meL].D.[-pip]}$PEPTIDE545,PEPTIDE545,1:R1-7:R3$$$
PEPTIDE545{<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/-pip/">[-pip]</a>}$PEPTIDE545,PEPTIDE545,1:R1-7:R3$$$
-5.06
60
772.52
545
null
null
3.6e+40
10.24017871
22.51577483
13.47781528
450.2565987
null
16.85298186
0.390716756
16.85298186
0.247548563
1.908815776
0.247548563
-7.235419149
-0.390716756
0.532
224.5619
841.064
Lariat
8
7
null
4
17
null
null
0
2
2
1
0
1
9
4
17
0
19
0
2
2
334
DP-537
-5.0
0.980962542
0.862712751
45.53779691
36.10735481
4.235526235
48.68863749
0.0
0.0
38.35629747
0.0
0.0
0.0
57.61966201
62.9197756
115.8078797
38.1404224
null
-5.0
null
null
null
null
null
null
null
null
null
null
3
CC(C)C[C@H]1C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N[C@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)CC(=O)N1C
135.4291795
47.25743783
1.431199657
40.42898871
11.78791537
127.9091999
47.39388665
35.77554503
0
0.0
null
null
null
null
['dA', 'meF', 'meL', 'T', 'Sar', 'meL', 'D', '-pip']
[-0.2068000000000003, 1.3581999999999996, 1.1616, -0.1918000000000002, -0.2531000000000001, 1.1616, -0.6377000000000004, 1.1021]
[29.1, 20.31, 20.31, 38.33, 20.31, 20.31, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
167.8782538
44.72922237
11.78791537
172.6409012
30.21209354
4.235526235
0.0
0
2013_CHUGAI
545
null
209.08
null
593.9115778
0.0
116.9933412
-4.693436325
-2.911877238
-49.32072026
-53.38255203
-48.59497332
-76.91802653
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
8
8
0
0
0
5
3
0
0
4
1
0
0
0
0
0
0
8
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.287677298
null
aa0a973f876541cffc9a31e741783e2901abb8464a347375eb53e42597130cdb
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
545
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dA', 'meA', 'meF', 'meL', 'T', 'meA', 'D', '-pip']
52
546
-5.26
-5.26
Lariat
9
-1.73e-16
-2.756716458
-1.42e-16
-2.886208923
-3.28e-17
-1.133995184
1.53e-15
-0.248761203
3.659062204
4269.563777
146.0
null
null
98.9088127
91.75194338
27.75194338
52.56578411
45.78274914
14.03286006
9.571660222
9.571660222
5.855583873
5.855583873
3.327307457
3.327307457
null
null
null
null
297.8071237
16.4901862
38.35629747
0
0
0
0
0
0
5.108808191
71.42205307
812.4796256
0.844827586
1.517241379
2.120689655
0.658536585
146.0
PEPTIDE546{[dA].[meA].[meF].[meL].T.[meA].D.[-pip]}$PEPTIDE546,PEPTIDE546,1:R1-7:R3$$$
PEPTIDE546{<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/-pip/">[-pip]</a>}$PEPTIDE546,PEPTIDE546,1:R1-7:R3$$$
-5.06
58
748.498
546
null
null
6.38e+38
10.09559591
21.09072644
11.98913054
431.9068324
null
16.82586946
0.390716755
16.82586946
0.247752732
1.886114268
0.247752732
-7.23744409
-0.390716755
-0.1057
215.3759
813.01
Lariat
8
7
null
4
17
null
null
0
2
2
1
0
1
9
4
17
0
17
0
2
2
322
DP-538
-5.26
1.48255336
0.651594603
45.53779691
42.12524728
4.235526235
48.68863749
0.0
0.0
38.35629747
0.0
0.0
0.0
43.91587777
64.35667725
111.695604
30.27280416
null
-5.26
null
null
null
null
null
null
null
null
null
null
3
CC(C)C[C@H]1C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N[C@H](C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N1C
129.9461453
47.25743783
1.431199657
40.42898871
5.893957685
127.5541674
40.89702697
35.77554503
0
0.0
null
null
null
null
['dA', 'meA', 'meF', 'meL', 'T', 'meA', 'D', '-pip']
[-0.2068000000000003, 0.1353999999999999, 1.3581999999999996, 1.1616, -0.1918000000000002, 0.1353999999999999, -0.6377000000000004, 1.1021]
[29.1, 20.31, 20.31, 20.31, 38.33, 20.31, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
167.3992866
44.72922237
5.893957685
160.7849421
30.21209354
4.235526235
0.0
0
2013_CHUGAI
546
null
209.08
null
556.6003267
0.0
116.0189153
-4.374345571
-2.889199101
-42.27156629
-58.98237245
-41.27151029
-70.24691503
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
8
8
0
0
0
5
3
0
0
4
1
0
0
0
0
0
0
8
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.302027477
null
6e5e241af0c6b1a497246e8bef1c3bff6d72490beb058391a722ff8f87065c97
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
546
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['A', 'meA', 'meF', 'T', 'meF', 'L', 'D', '-pip']
49
547
-4.7
-4.7
Lariat
2
-1.54e-16
-2.757211131
-5.68e-17
-2.89240277
2.05e-17
-1.133253569
2.67e-15
-0.248651488
3.058738191
4773.697731
166.0
null
null
103.8729143
96.25194338
30.25194338
56.02988572
48.25635593
15.55925326
10.47305342
10.47305342
6.385636927
6.385636927
3.738853751
3.738853751
null
null
null
null
326.5377782
26.16766313
38.35629747
0
0
0
0
0
0
5.108808191
64.52717676
874.4952757
0.793650794
1.396825397
1.936507937
0.565217391
166.0
PEPTIDE547{A.[meA].[meF].T.[meF].L.D.[-pip]}$PEPTIDE547,PEPTIDE547,1:R1-7:R3$$$
PEPTIDE547{<a href="/monomers/A/">A</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/-pip/">[-pip]</a>}$PEPTIDE547,PEPTIDE547,1:R1-7:R3$$$
-5.84
63
808.553
547
null
null
1.1600000000000001e+42
11.32669113
23.01782233
13.5748974
463.2570107
null
16.78073771
0.390716755
16.78073771
0.247773757
1.847695622
0.247773757
-7.115554541
-0.390716755
0.7749
235.2206
875.081
Lariat
8
7
null
5
17
null
null
0
2
2
2
0
2
9
5
17
0
17
0
2
2
344
DP-539
-4.7
0.9990102
2.125420136
45.94770053
42.12524728
5.647368313
48.68863749
0.0
0.0
38.35629747
0.0
0.0
0.0
74.12797131
63.06823663
105.6096678
37.12659694
null
-4.7
null
null
null
null
null
null
null
null
null
null
4
CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H](C)NC(=O)C[C@@H](C(=O)N2CCCCC2)NC1=O
132.7287459
47.25743783
1.431199657
40.83889234
5.893957685
127.0752002
33.92120007
71.55109006
0
0.0
null
null
null
null
['A', 'meA', 'meF', 'T', 'meF', 'L', 'D', '-pip']
[-0.2068000000000003, 0.1353999999999999, 1.3581999999999996, -0.1918000000000002, 1.3581999999999996, 0.8193999999999995, -0.6377000000000004, 1.1021]
[29.1, 20.31, 20.31, 38.33, 20.31, 29.1, 46.17, 3.24]
21.23925341
0.0
0.0
0.0
155.52355
51.10214728
5.893957685
160.86726
60.42418708
5.647368313
0.0
0
2013_CHUGAI
547
null
217.87
null
581.8151822
0.0
120.706648
-7.105937729
-5.704242406
-42.30468365
-70.21310908
-47.68317235
-58.17735167
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
8
8
0
0
0
4
4
0
0
3
1
0
0
0
0
0
0
8
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.252978972
null
57065f82c94a720ac9f1fddbf69dee53148f65a193301827225ae9bb24700a3d
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
547
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['meA', 'meF', 'Pr_Gly', 'meL', 'T', 'meA', 'meL', 'meI', 'Ser(tBu)', 'D', '-pip']
82
548
-4.44
-4.44
Lariat
5
-2.76e-16
-2.757226226
-3.03e-16
-2.892706868
-9.69e-17
-1.13527259
4.63e-16
-0.249287763
4.383561265
7112.801173
186.0
null
null
159.0800211
149.2265773
42.22657733
83.35301791
74.31583104
21.06594197
14.42447926
14.42447926
8.598377378
8.598377378
4.936597258
4.936597258
null
null
null
null
460.2395211
41.24600725
52.73990902
0
0
0
0
0
0
9.845671145
105.6088499
1237.804982
0.715909091
1.363636364
1.943181818
0.734375
183.0
PEPTIDE548{[meA].[meF].[Pr_Gly].[meL].T.[meA].[meL].[meI].[Ser(tBu)].D.[-pip]}$PEPTIDE548,PEPTIDE548,1:R1-10:R3$$$
PEPTIDE548{<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meI/">[meI]</a>.<a href="/monomers/Ser(tBu)/"...
-6.69
88
1130.768
548
null
null
2.58e+72
14.47971435
34.326721
20.96551629
673.5918451
null
17.82915214
0.390716755
17.82915214
0.247752853
2.227061034
0.247752853
-8.276698361
-0.390716755
2.6743
334.3039
1238.624
Lariat
11
10
null
4
24
null
null
0
2
2
1
0
1
13
4
24
0
31
0
2
2
496
DP-540
-4.44
-5.155717502
1.839493642
64.97438905
54.16103222
4.235526235
66.41017668
0.0
0.0
52.73990902
0.0
0.0
0.0
84.54826326
102.5942267
182.8621841
57.15425123
null
-4.44
null
null
null
null
null
null
null
null
null
null
3
CCCN1CC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H]([C@@H](C)CC)C(=O)N[C@@H](COC(C)(C)C)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C1=O
208.0092377
64.97897702
1.431199657
55.12871791
17.68187306
212.2730227
74.40138538
35.77554503
0
0.0
[['Caco2']]
[7749]
[['-5.92']]
['2023_Ohta']
['meA', 'meF', 'Pr_Gly', 'meL', 'T', 'meA', 'meL', 'meI', 'Ser(tBu)', 'D', '-pip']
[0.1353999999999999, 1.3581999999999996, 0.5271000000000001, 1.1616, -0.1918000000000002, 0.1353999999999999, 1.1616, 1.1616, 0.5883999999999996, -0.6377000000000004, 1.1021]
[20.31, 20.31, 20.31, 20.31, 38.33, 20.31, 20.31, 20.31, 38.33, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
250.9617492
63.84969688
17.68187306
286.8095795
30.21209354
4.235526235
0.0
0
2013_CHUGAI
548
null
279.24
null
967.6372892
0.0
165.3844942
-6.6861775
-9.909652678
-79.97262718
-84.01922828
-66.93834701
-157.4124174
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
11
11
0
0
0
8
3
0
0
6
1
0
0
0
0
0
0
11
0
0
0
0
0
0
1
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.208909555
null
5c969a09ed45f749467d7c9fa6f58b0c79838703e801789bb47e5b88b0ce48a7
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
548
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['meA', 'T', 'Pr_Gly', 'meF', 'meF', 'meL', 'P', 'meL', 'A', 'meV', 'D', '-pip']
80
549
-4.64
-4.64
Lariat
8
-2.62e-16
-2.757834153
-1.86e-16
-2.880009884
4.12e-19
-1.135167393
1.42e-15
-0.249287762
2.975507059
7843.130361
182.0
null
null
164.4917165
153.6737909
45.67379092
87.34804661
77.03252729
23.28263821
15.89014186
15.89014186
9.893860719
9.893860719
5.88849173
5.88849173
null
null
null
null
499.3670451
59.06586848
57.53444621
0
0
0
0
0
0
5.108808191
89.15974725
1324.815882
0.621052632
1.221052632
1.778947368
0.657142857
175.0
PEPTIDE549{[meA].T.[Pr_Gly].[meF].[meF].[meL].P.[meL].A.[meV].D.[-pip]}$PEPTIDE549,PEPTIDE549,1:R1-11:R3$$$
PEPTIDE549{<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/A/">A</a>.<a hre...
-7.96
95
1216.841
549
null
null
1.2299999999999999e+79
16.2644342
35.68912279
20.29455235
713.8558892
null
18.22052467
0.390716754
18.22052467
0.247806842
2.236651199
0.247806842
-8.069592734
-0.390716754
2.7028
358.8629
1325.705
Lariat
12
11
null
4
25
null
null
0
3
3
2
0
2
13
4
25
0
30
0
3
3
526
DP-541
-4.64
-5.213543435
2.931877484
65.13743583
60.17892468
4.235526235
72.31735641
0.0
0.0
57.53444621
0.0
0.0
0.0
108.3874319
100.3478516
191.619693
50.4772494
null
-4.64
null
null
null
null
null
null
null
null
null
null
5
CCCN1CC(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=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](C)C(=O)N(C)[C@@H](C(C)C)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C1=O
209.4376705
70.88615675
1.431199657
60.02862764
17.68187306
204.8800378
74.33925982
71.55109006
0
0.0
[['Caco2']]
[7751]
[['-7.05']]
['2023_Ohta']
['meA', 'T', 'Pr_Gly', 'meF', 'meF', 'meL', 'P', 'meL', 'A', 'meV', 'D', '-pip']
[0.1353999999999999, -0.1918000000000002, 0.5271000000000001, 1.3581999999999996, 1.3581999999999996, 1.1616, 0.2794999999999998, 1.1616, -0.2068000000000003, 0.7715000000000001, -0.6377000000000004, 1.1021]
[20.31, 38.33, 20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1, 20.31, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
262.1235547
70.28029601
17.68187306
279.5610381
60.42418708
4.235526235
0.0
0
2013_CHUGAI
549
null
290.32
null
984.5081531
0.0
180.5253451
-6.013873373
-6.777777862
-83.0519787
-103.4386408
-79.59951184
-137.1517156
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
12
12
0
0
0
9
3
0
0
6
1
0
0
0
0
0
0
12
0
0
0
0
0
0
2
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.224784021
null
a465e4cae16ffefb9dc520701aaf14c6588e5d95e9974f3774a2632c41bb5d4b
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
549
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['meA', 'T', 'Sar', 'Et_Phe', 'meF', 'meL', 'P', 'meL', 'A', 'meV', 'D', '-pip']
80
550
-4.66
-4.66
Lariat
9
-2.36e-16
-2.757830874
-2.28e-16
-2.879198032
2.24e-17
-1.135167395
1.6e-15
-0.249287762
2.950172084
7720.709974
208.0
null
null
161.9917165
151.1737909
45.17379092
86.09804661
75.78252729
23.03263821
15.76514186
15.76514186
9.837959019
9.837959019
5.86054088
5.86054088
null
null
null
null
492.9941202
59.06586848
57.53444621
0
0
0
0
0
0
5.108808191
86.41823014
1310.800231
0.627659574
1.244680851
1.819148936
0.652173913
189.0
PEPTIDE550{[meA].T.[Sar].[Et_Phe].[meF].[meL].P.[meL].A.[meV].D.[-pip]}$PEPTIDE550,PEPTIDE550,1:R1-11:R3$$$
PEPTIDE550{<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/Et_Phe/">[Et_Phe]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/A/">A</a>.<a hre...
-7.96
94
1204.83
550
null
null
1.17e+78
16.19039771
34.97740375
19.57951172
704.6810061
null
18.21247475
0.390716756
18.21247475
0.247548564
2.228393913
0.247548564
-8.058991984
-0.390716756
2.3127
354.2459
1311.678
Lariat
12
11
null
4
25
null
null
0
3
3
2
0
2
13
4
25
0
29
0
3
3
520
DP-542
-4.66
-5.042103735
2.871791826
65.13743583
60.17892468
4.235526235
72.31735641
0.0
0.0
57.53444621
0.0
0.0
0.0
101.5355398
100.8268188
188.8781759
50.4772494
null
-4.66
null
null
null
null
null
null
null
null
null
null
5
CCN1C(=O)CN(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C)N(C)C(=O)C[C@@H](C(=O)N2CCCCC2)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@@H]1Cc1ccccc1
206.6961534
70.88615675
1.431199657
60.02862764
17.68187306
198.5071129
74.33925982
71.55109006
0
0.0
[['Caco2']]
[7752]
[['-7.07']]
['2023_Ohta']
['meA', 'T', 'Sar', 'Et_Phe', 'meF', 'meL', 'P', 'meL', 'A', 'meV', 'D', '-pip']
[0.1353999999999999, -0.1918000000000002, -0.2531000000000001, 1.7483, 1.3581999999999996, 1.1616, 0.2794999999999998, 1.1616, -0.2068000000000003, 0.7715000000000001, -0.6377000000000004, 1.1021]
[20.31, 38.33, 20.31, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1, 20.31, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
262.1235547
70.28029601
17.68187306
270.4465961
60.42418708
4.235526235
0.0
0
2013_CHUGAI
550
null
290.32
null
965.2731035
0.0
179.9412138
-5.885030664
-6.77058721
-82.46627473
-102.9581635
-72.89998125
-136.4842799
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
12
12
0
0
0
9
3
0
0
7
1
0
0
0
0
0
0
12
0
0
0
0
0
0
2
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.237738184
null
f4bf35d5b9fcd26bf289aee5f68030050a91d4f42de299015d921f5c476c56b6
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
550
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Sar', 'Ser(tBu)', 'Pr_Gly', 'meL', 'T', 'meF', 'meL', 'meI', 'meA', 'D', '-pip']
82
551
-4.55
-4.55
Lariat
5
-2.79e-16
-2.7571821
-2.87e-16
-2.883147051
-7.22e-17
-1.135265497
7.01e-16
-0.249287763
4.322581568
6993.343316
199.0
null
null
156.5800211
146.7265773
41.72657733
82.10301791
73.06583104
20.81594197
14.18767586
14.18767586
8.379641243
8.379641243
4.857873786
4.857873786
null
null
null
null
453.8665962
46.72904148
52.73990902
0
0
0
0
0
0
9.845671145
97.38429859
1223.789332
0.747126437
1.425287356
2.022988506
0.73015873
179.0
PEPTIDE551{[Sar].[Ser(tBu)].[Pr_Gly].[meL].T.[meF].[meL].[meI].[meA].D.[-pip]}$PEPTIDE551,PEPTIDE551,1:R1-10:R3$$$
PEPTIDE551{<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/Ser(tBu)/">[Ser(tBu)]</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meI/">[meI]</a>.<a href="/monomers/...
-6.69
87
1118.757
551
null
null
1.6800000000000001e+72
14.39804737
34.16714623
21.55055338
664.416962
null
18.05408703
0.390716755
18.05408703
0.247773876
2.288333278
0.247773876
-8.254213325
-0.390716755
2.2858
329.7089
1224.597
Lariat
11
10
null
4
24
null
null
0
2
2
1
0
1
13
4
24
0
30
0
2
2
490
DP-543
-4.55
-4.833584103
2.013398838
64.97438905
48.14313975
4.235526235
66.41017668
0.0
0.0
52.73990902
0.0
0.0
0.0
84.54826326
95.74233454
178.7499084
65.02186947
null
-4.55
null
null
null
null
null
null
null
null
null
null
3
CCCN1CC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H]([C@@H](C)CC)C(=O)N(C)[C@@H](C)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)CC(=O)N[C@@H](COC(C)(C)C)C1=O
205.2677206
64.97897702
1.431199657
55.12871791
17.68187306
199.4032381
80.89824507
35.77554503
0
0.0
[['Caco2']]
[7754]
[['-6.92']]
['2023_Ohta']
['Sar', 'Ser(tBu)', 'Pr_Gly', 'meL', 'T', 'meF', 'meL', 'meI', 'meA', 'D', '-pip']
[-0.2531000000000001, 0.5883999999999996, 0.5271000000000001, 1.1616, -0.1918000000000002, 1.3581999999999996, 1.1616, 1.1616, 0.1353999999999999, -0.6377000000000004, 1.1021]
[20.31, 38.33, 20.31, 20.31, 38.33, 20.31, 20.31, 20.31, 20.31, 46.17, 3.24]
15.92944006
0.0
0.0
0.0
251.4407164
63.84969688
17.68187306
277.2161703
30.21209354
4.235526235
0.0
0
2013_CHUGAI
551
null
279.24
null
947.3822084
0.0
163.8421621
-6.091977119
-9.812623917
-79.0841798
-76.43346891
-66.49851445
-156.4702729
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
11
11
0
0
0
8
3
0
0
6
1
0
0
0
0
0
0
11
0
0
0
0
0
0
1
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.208481244
null
624a086dcf9cace4034a061afd54665710342324f7cd4ee4e2471ba9f491731c
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
551
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Pr_Gly', 'L', 'T', 'Sar', 'meF', 'A', 'meF', 'meL', 'meI', 'meL', 'D', '-pip']
80
552
-4.38
-4.38
Lariat
6
-2.87e-16
-2.759250802
-2.39e-16
-2.882519297
-9.94e-17
-1.135163604
9.56e-16
-0.249287763
3.591128786
7962.058623
233.0
null
null
168.9917165
158.1737909
46.17379092
89.38672175
79.00613409
23.30903142
15.69292826
15.69292826
9.481570841
9.481570841
5.608919613
5.608919613
null
null
null
null
506.5049061
63.21922767
57.53444621
0
0
0
0
0
0
5.108808191
90.53050581
1340.847182
0.614583333
1.208333333
1.78125
0.661971831
232.0
PEPTIDE552{[Pr_Gly].L.T.[Sar].[meF].A.[meF].[meL].[meI].[meL].D.[-pip]}$PEPTIDE552,PEPTIDE552,1:R1-11:R3$$$
PEPTIDE552{<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meI/">[meI]</a>.<a hre...
-7.96
96
1228.852
552
null
null
6.94e+80
16.17910856
38.10357848
22.84380661
726.6946296
null
18.34325674
0.390716756
18.34325674
0.247548563
2.145138171
0.247548563
-8.561249064
-0.390716756
3.2443
365.5356
1341.748
Lariat
12
11
null
5
25
null
null
0
2
2
2
0
2
13
5
25
0
34
0
2
2
534
DP-544
-4.38
-6.187782558
3.442176825
65.54733945
54.16103222
5.647368313
72.31735641
0.0
0.0
57.53444621
0.0
0.0
0.0
128.464141
93.01699227
187.8643504
58.34486764
null
-4.38
null
null
null
null
null
null
null
null
null
null
4
CCCN1CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)CC(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H]([C@@H](C)CC)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N2CCCCC2)CC1=O
214.9617882
70.88615675
1.431199657
60.43853126
23.57583074
205.7140374
74.33925982
71.55109006
0
0.0
[['Caco2']]
[7756]
[['-6.96']]
['2023_Ohta']
['Pr_Gly', 'L', 'T', 'Sar', 'meF', 'A', 'meF', 'meL', 'meI', 'meL', 'D', '-pip']
[0.5271000000000001, 0.8193999999999995, -0.1918000000000002, -0.2531000000000001, 1.3581999999999996, -0.2068000000000003, 1.3581999999999996, 1.1616, 1.1616, 1.1616, -0.6377000000000004, 1.1021]
[20.31, 29.1, 38.33, 20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 46.17, 3.24]
21.23925341
0.0
0.0
0.0
251.2057525
70.28029601
23.57583074
290.5252059
60.42418708
5.647368313
0.0
0
2013_CHUGAI
552
null
299.11
null
1019.067544
0.0
182.8637534
-9.319589132
-6.614578848
-91.94109367
-96.94398892
-81.65777168
-145.2042753
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
12
12
0
0
0
8
4
0
0
6
1
0
0
0
0
0
0
12
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.161554823
null
0f2d3501c0253d8cda4e171a11989d81aa844056e6176b2b68e3e07de6a54df1
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
552
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Sar', 'L', 'T', 'Pr_Gly', 'meF', 'A', 'meF', 'meL', 'meI', 'meL', 'D', '-pip']
80
553
-4.4
-4.4
Lariat
5
-3.13e-16
-2.758929454
-2.53e-16
-2.883599423
-1.03e-16
-1.135163577
8.52e-16
-0.249287763
3.580622111
7962.058623
211.0
null
null
168.9917165
158.1737909
46.17379092
89.38672175
79.00613409
23.30903142
15.69292826
15.69292826
9.481570841
9.481570841
5.608919613
5.608919613
null
null
null
null
506.5049061
67.33150334
57.53444621
0
0
0
0
0
0
5.108808191
86.41823014
1340.847182
0.614583333
1.208333333
1.78125
0.661971831
211.0
PEPTIDE553{[Sar].L.T.[Pr_Gly].[meF].A.[meF].[meL].[meI].[meL].D.[-pip]}$PEPTIDE553,PEPTIDE553,1:R1-11:R3$$$
PEPTIDE553{<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meI/">[meI]</a>.<a hre...
-7.96
96
1228.852
553
null
null
3.59e+80
16.17910856
38.10357848
22.84380661
726.6946296
null
18.32132528
0.390716754
18.32132528
0.247806843
2.183785747
0.247806843
-8.519386465
-0.390716754
3.2443
365.5356
1341.748
Lariat
12
11
null
5
25
null
null
0
2
2
2
0
2
13
5
25
0
34
0
2
2
534
DP-545
-4.4
-6.189436504
3.467481079
65.54733945
54.16103222
5.647368313
72.31735641
0.0
0.0
57.53444621
0.0
0.0
0.0
128.464141
93.01699227
187.8643504
58.34486764
null
-4.4
null
null
null
null
null
null
null
null
null
null
4
CCCN1CC(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H]([C@@H](C)CC)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C1=O
214.9617882
70.88615675
1.431199657
60.43853126
23.57583074
205.7140374
74.33925982
71.55109006
0
0.0
[['Caco2']]
[7757]
[['-6.64']]
['2023_Ohta']
['Sar', 'L', 'T', 'Pr_Gly', 'meF', 'A', 'meF', 'meL', 'meI', 'meL', 'D', '-pip']
[-0.2531000000000001, 0.8193999999999995, -0.1918000000000002, 0.5271000000000001, 1.3581999999999996, -0.2068000000000003, 1.3581999999999996, 1.1616, 1.1616, 1.1616, -0.6377000000000004, 1.1021]
[20.31, 29.1, 38.33, 20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 46.17, 3.24]
21.23925341
0.0
0.0
0.0
251.2057525
70.28029601
23.57583074
290.5252059
60.42418708
5.647368313
0.0
0
2013_CHUGAI
553
null
299.11
null
1018.852333
0.0
182.7526364
-9.278776127
-6.699579214
-91.76375481
-97.32987277
-81.25998129
-145.0230055
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
12
12
0
0
0
8
4
0
0
6
1
0
0
0
0
0
0
12
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.161554823
null
67526eb5d6b24888c9066c069d5474f03f81c46222fdc8e653a49c80b0769fbf
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
553
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Sar', 'L', 'T', 'Sar', 'Et_Phe', 'A', 'meF', 'meL', 'meI', 'meL', 'D', '-pip']
80
554
-4.39
-4.39
Lariat
7
-2.58e-16
-2.758929233
-2.6e-16
-2.882196952
-1.22e-16
-1.135163576
1.15e-15
-0.249287763
3.555328999
7839.429097
220.0
null
null
166.4917165
155.6737909
45.67379092
88.13672175
77.75613409
23.05903142
15.56792826
15.56792826
9.425669142
9.425669142
5.580968763
5.580968763
null
null
null
null
500.1319812
63.21922767
57.53444621
0
0
0
0
0
0
5.108808191
87.7889887
1326.831532
0.610526316
1.2
1.768421053
0.657142857
212.0
PEPTIDE554{[Sar].L.T.[Sar].[Et_Phe].A.[meF].[meL].[meI].[meL].D.[-pip]}$PEPTIDE554,PEPTIDE554,1:R1-11:R3$$$
PEPTIDE554{<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/Et_Phe/">[Et_Phe]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meI/">[meI]</a>.<a hre...
-7.96
95
1216.841
554
null
null
4.09e+78
16.10222883
37.36785732
22.58254935
717.5197465
null
18.30784706
0.390716756
18.30784706
0.247548564
2.175528461
0.247548564
-8.509792971
-0.390716756
2.8542
360.9186
1327.721
Lariat
12
11
null
5
25
null
null
0
2
2
2
0
2
13
5
25
0
33
0
2
2
528
DP-546
-4.39
-6.047794558
3.391409209
65.54733945
54.16103222
5.647368313
72.31735641
0.0
0.0
57.53444621
0.0
0.0
0.0
121.6122489
93.49595948
185.1228333
58.34486764
null
-4.39
null
null
null
null
null
null
null
null
null
null
4
CC[C@H](C)[C@H]1C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)CC(=O)N(CC)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N1C
212.2202711
70.88615675
1.431199657
60.43853126
23.57583074
199.3411125
74.33925982
71.55109006
0
0.0
[['Caco2']]
[7758]
[['-7.04']]
['2023_Ohta']
['Sar', 'L', 'T', 'Sar', 'Et_Phe', 'A', 'meF', 'meL', 'meI', 'meL', 'D', '-pip']
[-0.2531000000000001, 0.8193999999999995, -0.1918000000000002, -0.2531000000000001, 1.7483, -0.2068000000000003, 1.3581999999999996, 1.1616, 1.1616, 1.1616, -0.6377000000000004, 1.1021]
[20.31, 29.1, 38.33, 20.31, 20.31, 29.1, 20.31, 20.31, 20.31, 20.31, 46.17, 3.24]
21.23925341
0.0
0.0
0.0
251.2057525
70.28029601
23.57583074
281.4107639
60.42418708
5.647368313
0.0
0
2013_CHUGAI
554
null
299.11
null
999.5294721
0.0
182.140296
-9.114193623
-6.691426307
-91.12991701
-96.89980577
-74.5614879
-144.2729375
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
12
12
0
0
0
8
4
0
0
7
1
0
0
0
0
0
0
12
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.171701275
null
81f72c4c6c32b2164d2a2eadfd943185b31da4d4843d95c00c63e52766b6b7a3
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
554
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dA', 'meA', 'meF', 'meL', 'T', 'Pr_Gly', 'meL', 'Ser(tBu)', 'meL', 'D', '-pip']
81
555
-4.47
-4.47
Lariat
9
-2.74e-16
-2.75770287
-2.99e-16
-2.885809767
-1.16e-16
-1.135216571
6.41e-16
-0.249287763
4.30844367
6981.343316
220.0
null
null
156.5800211
146.7265773
41.72657733
82.14169304
73.03943784
20.84233517
14.20087246
14.20087246
8.266627034
8.266627034
4.810657418
4.810657418
null
null
null
null
453.6735978
45.39936644
52.73990902
0
0
0
0
0
0
9.845671145
98.75505715
1223.789332
0.712643678
1.298850575
1.850574713
0.73015873
215.0
PEPTIDE555{[dA].[meA].[meF].[meL].T.[Pr_Gly].[meL].[Ser(tBu)].[meL].D.[-pip]}$PEPTIDE555,PEPTIDE555,1:R1-10:R3$$$
PEPTIDE555{<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Pr_Gly/">[Pr_Gly]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Ser(tBu)/">[Ser(tBu)]</a>.<a href="/monomers/me...
-6.69
87
1118.757
555
null
null
6.570000000000001e+71
14.39804737
34.16714623
22.14375541
664.2650471
null
17.65590292
0.390716754
17.65590292
0.247806844
2.195135529
0.247806844
-8.088348669
-0.390716754
2.3321
329.6766
1224.597
Lariat
11
10
null
5
24
null
null
0
2
2
1
0
1
13
5
24
0
30
0
2
2
490
DP-547
-4.47
-5.041399509
1.758798003
65.38429267
54.16103222
5.647368313
66.41017668
0.0
0.0
52.73990902
0.0
0.0
0.0
78.17533836
108.9671516
171.7740815
57.15425123
null
-4.47
null
null
null
null
null
null
null
null
null
null
3
CCCN1CC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](COC(C)(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N[C@H](C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C1=O
205.3088041
64.97897702
1.431199657
55.53862153
17.68187306
212.2730227
67.42555848
35.77554503
0
0.0
[['Caco2']]
[7759]
[['-5.80']]
['2023_Ohta']
['dA', 'meA', 'meF', 'meL', 'T', 'Pr_Gly', 'meL', 'Ser(tBu)', 'meL', 'D', '-pip']
[-0.2068000000000003, 0.1353999999999999, 1.3581999999999996, 1.1616, -0.1918000000000002, 0.5271000000000001, 1.1616, 0.5883999999999996, 1.1616, -0.6377000000000004, 1.1021]
[29.1, 20.31, 20.31, 20.31, 38.33, 20.31, 20.31, 38.33, 20.31, 46.17, 3.24]
21.23925341
0.0
0.0
0.0
239.0860125
63.84969688
17.68187306
282.6973038
30.21209354
5.647368313
0.0
0
2013_CHUGAI
555
null
288.03
null
946.164434
0.0
167.1934037
-9.667471571
-9.864397599
-78.21477938
-82.70365137
-67.05458157
-149.0196229
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
11
11
0
0
0
7
4
0
0
5
1
0
0
0
0
0
0
11
0
0
0
0
0
0
1
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.179122386
null
af73f8de0eefdceabbc298b4fb3a271554923b941e52fcd43ad25086de09e542
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
555
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['meA', 'L', 'L', 'Aib', 'L', 'Sar', 'T', 'F', 'L', 'meV', 'D', '-pip']
71
556
-4.59
-4.59
Lariat
4
-2.49e-16
-2.758053952
-2.37e-16
-2.898848954
-1.53e-16
-1.13536405
9.89e-16
-0.249287767
4.142251734
7028.589711
244.0
null
null
156.5276149
146.1737909
42.17379092
82.3659958
72.65056128
21.16460423
14.41030447
14.41030447
8.217041733
8.217041733
4.773097495
4.773097495
null
null
null
null
457.690485
45.56370053
57.53444621
0
0
0
0
0
0
5.108808191
97.38429859
1236.784581
0.659090909
1.227272727
1.784090909
0.714285714
233.0
PEPTIDE556{[meA].L.L.[Aib].L.[Sar].T.F.L.[meV].D.[-pip]}$PEPTIDE556,PEPTIDE556,1:R1-11:R3$$$
PEPTIDE556{<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Aib/">[Aib]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meV/">[meV]...
-7.18
88
1132.764
556
null
null
8.82e+71
14.75351687
34.54028797
23.07705125
667.0602278
null
17.48206437
0.390716898
17.48206437
0.245428962
2.13751191
0.245428962
-7.897551829
-0.390716898
1.2872
331.6964
1237.596
Lariat
12
11
null
9
25
null
null
0
2
2
1
0
1
13
9
25
0
31
0
2
2
494
DP-560
-4.59
-5.893207413
1.519973605
67.18695394
59.69995747
11.29473663
72.31735641
0.0
0.0
57.53444621
0.0
0.0
0.0
98.73101471
107.0512827
147.2132924
42.25269807
null
-4.59
null
null
null
null
null
null
null
null
null
null
3
CC(C)C[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N(C)C(=O)C[C@@H](C(=O)N2CCCCC2)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)CN(C)C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)NC1=O
204.1600539
70.88615675
1.431199657
62.07814575
29.46978843
219.0627892
40.41805975
35.77554503
0
0.0
[['Caco2']]
[7783]
[['-7.54']]
['2023_Ohta']
['meA', 'L', 'L', 'Aib', 'L', 'Sar', 'T', 'F', 'L', 'meV', 'D', '-pip']
[0.1353999999999999, 0.8193999999999995, 0.8193999999999995, 0.1832999999999998, 0.8193999999999995, -0.2531000000000001, -0.1918000000000002, 1.0159999999999998, 0.8193999999999995, 0.7715000000000001, -0.6377000000000004, 1.1021]
[20.31, 29.1, 29.1, 29.1, 29.1, 20.31, 38.33, 29.1, 29.1, 20.31, 46.17, 3.24]
42.47850683
0.0
0.0
0.0
203.2238388
63.90737111
29.46978843
282.6954032
30.21209354
11.29473663
0.0
0
2013_CHUGAI
556
null
334.27
null
926.9451678
0.0
190.1346552
-21.66449801
-10.51763321
-94.41277911
-80.56795824
-66.26405695
-125.9028975
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
12
12
0
0
0
4
8
0
0
3
1
0
0
0
0
0
0
12
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.134689544
null
acdb4f91c36d4c6d77b0982ef7ca1b0ccbd05b757a9c0f59cf0002ecb30af330
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
556
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['meA', 'L', 'L', 'Phg', 'L', 'Sar', 'T', 'F', 'L', 'meV', 'D', '-pip']
71
557
-4.62
-4.62
Lariat
9
-2.23e-16
-2.758052122
-1.9e-16
-2.894221803
-1.26e-16
-1.135354724
1.32e-15
-0.249287767
3.389124361
7459.890122
238.0
null
null
158.9917165
148.1737909
44.17379092
84.54142229
73.90056128
22.41460423
15.04850107
15.04850107
8.791010697
8.791010697
5.225610157
5.225610157
null
null
null
null
480.241213
49.6759762
57.53444621
0
0
0
0
0
0
5.108808191
93.27202292
1284.784581
0.597826087
1.130434783
1.684782609
0.641791045
236.0
PEPTIDE557{[meA].L.L.[Phg].L.[Sar].T.F.L.[meV].D.[-pip]}$PEPTIDE557,PEPTIDE557,1:R1-11:R3$$$
PEPTIDE557{<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Phg/">[Phg]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meV/">[meV]...
-7.96
92
1180.808
557
null
null
6.810000000000001e+72
15.87859625
36.32579509
23.30820314
689.3874377
null
17.52351124
0.390716898
17.52351124
0.247386099
2.134246382
0.247386099
-7.896926337
-0.390716898
2.2499
346.8004
1285.64
Lariat
12
11
null
9
25
null
null
0
2
2
2
0
2
13
9
25
0
30
0
2
2
510
DP-561
-4.62
-5.901322194
2.741880894
67.18695394
60.17892468
11.29473663
72.31735641
0.0
0.0
57.53444621
0.0
0.0
0.0
128.9431082
98.91094995
138.988741
50.4772494
null
-4.62
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)N(C)C(=O)C[C@@H](C(=O)N2CCCCC2)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)CN(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](c2ccccc2)NC1=O
204.1600539
70.88615675
1.431199657
62.07814575
29.46978843
205.8379722
40.41805975
71.55109006
0
0.0
[['Caco2']]
[7784]
[['-7.55']]
['2023_Ohta']
['meA', 'L', 'L', 'Phg', 'L', 'Sar', 'T', 'F', 'L', 'meV', 'D', '-pip']
[0.1353999999999999, 0.8193999999999995, 0.8193999999999995, 1.146, 0.8193999999999995, -0.2531000000000001, -0.1918000000000002, 1.0159999999999998, 0.8193999999999995, 0.7715000000000001, -0.6377000000000004, 1.1021]
[20.31, 29.1, 29.1, 29.1, 29.1, 20.31, 38.33, 29.1, 29.1, 20.31, 46.17, 3.24]
42.47850683
0.0
0.0
0.0
197.6849135
63.90737111
29.46978843
280.5729629
60.42418708
11.29473663
0.0
0
2013_CHUGAI
557
null
334.27
null
934.1451807
0.0
191.6991356
-21.00962123
-6.622280563
-93.6687356
-100.7920896
-66.10877607
-112.3928132
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
12
12
0
0
0
4
8
0
0
3
1
0
0
0
0
0
0
12
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.131298445
null
9cfba80ef05c2160f607be9d3bad78acabeedfcdccaf4f187c88b9afe82f37e9
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
557
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Phg', 'T', 'meA', 'meF', 'meF', 'Ser(tBu)', 'meL', 'G', 'D', '-pip']
70
558
-4.46
-4.46
Lariat
3
-1.37e-16
-2.756195475
-1.19e-16
-2.880916406
1.79e-16
-1.134088812
3.97e-15
-0.249260241
2.794939822
6569.10947
217.0
null
null
135.8535238
125.8711154
39.87111544
73.50451213
63.1381001
20.49378383
13.87629271
13.87629271
8.305603118
8.305603118
4.916086349
4.916086349
null
null
null
null
429.6918051
41.3281743
47.94537184
0
0
0
0
0
0
9.845671145
76.82292025
1150.642668
0.710843373
1.313253012
1.891566265
0.540983607
218.0
PEPTIDE558{[Phg].T.[meA].[meF].[meF].[Ser(tBu)].[meL].G.D.[-pip]}$PEPTIDE558,PEPTIDE558,1:R1-9:R3$$$
PEPTIDE558{<a href="/monomers/Phg/">[Phg]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/Ser(tBu)/">[Ser(tBu)]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/G/">G</a>.<a href="/monomers/D/">D</a>.<a...
-7.72
83
1064.729
558
null
null
1.49e+59
15.20487283
30.5423432
18.90327434
608.5023358
null
17.72453314
0.390716753
17.72453314
0.247753023
2.077057161
0.247753023
-7.65268901
-0.390716753
1.886
310.2143
1151.417
Lariat
10
9
null
6
22
null
null
0
2
2
3
0
3
12
6
22
0
20
0
2
2
452
DP-563
-4.46
-2.601318702
4.290892683
60.89428657
48.14313975
7.059210392
60.50299695
0.0
0.0
47.94537184
0.0
0.0
0.0
104.3400648
82.33547235
124.9223217
69.49107824
null
-4.46
null
null
null
null
null
null
null
null
null
null
5
CC(C)C[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N[C@@H](c2ccccc2)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](COC(C)(C)C)C(=O)N1C
174.5109379
59.07179729
1.431199657
51.04861542
5.893957685
152.3979277
53.9528719
107.3266351
0
0.0
[['Caco2']]
[7786]
[['-6.80']]
['2023_Ohta']
['Phg', 'T', 'meA', 'meF', 'meF', 'Ser(tBu)', 'meL', 'G', 'D', '-pip']
[1.146, -0.1918000000000002, 0.1353999999999999, 1.3581999999999996, 1.3581999999999996, 0.5883999999999996, 1.1616, -0.5953000000000002, -0.6377000000000004, 1.1021]
[29.1, 38.33, 20.31, 20.31, 20.31, 38.33, 20.31, 29.1, 46.17, 3.24]
26.54906677
0.0
0.0
0.0
197.8705418
65.4280846
5.893957685
212.1968008
90.63628061
7.059210392
0.0
0
2013_CHUGAI
558
null
276.51
null
777.6586079
0.0
154.7605885
-10.30356363
-15.77360941
-54.15286014
-94.93166158
-49.52205348
-92.81878146
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
10
10
0
0
0
5
5
0
0
4
1
0
0
0
0
0
0
10
0
0
0
0
0
0
3
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.160748619
null
bb3a97c6e59bf5252ae657dc5e3a77cfb474af74b670d31ef6575d4f9bae4f43
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
558
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['meA', 'F', 'meL', 'L', 'meI', 'G', 'meL', 'T', 'P', 'Aib', 'D', '-pip']
73
559
-4.57
-4.57
Lariat
7
-2.77e-16
-2.757320496
-3.17e-16
-2.886765244
-1.14e-16
-1.135712969
1e-15
-0.249287767
3.38899542
7181.406589
268.0
null
null
157.0276149
146.6737909
42.67379092
82.78864554
73.20334768
21.61181782
14.84432146
14.84432146
8.929845821
8.929845821
5.221071312
5.221071312
null
null
null
null
463.4914722
45.48153349
57.53444621
0
0
0
0
0
0
5.108808191
97.38429859
1248.784581
0.707865169
1.348314607
1.95505618
0.71875
245.0
PEPTIDE559{[meA].F.[meL].L.[meI].G.[meL].T.P.[Aib].D.[-pip]}$PEPTIDE559,PEPTIDE559,1:R1-11:R3$$$
PEPTIDE559{<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meI/">[meI]</a>.<a href="/monomers/G/">G</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Aib/"...
-7.18
89
1144.775
559
null
null
1.76e+74
14.9899844
33.58618638
20.41685329
672.7231684
null
17.55702615
0.390716753
17.55702615
0.248021179
2.188316354
0.248021179
-7.983767425
-0.390716753
1.4796
334.29
1249.607
Lariat
12
11
null
7
25
null
null
0
3
3
1
0
1
13
7
25
0
29
0
3
3
498
DP-564
-4.57
-5.229904841
1.41247943
66.3671467
59.69995747
8.47105247
72.31735641
0.0
0.0
57.53444621
0.0
0.0
0.0
91.40015538
107.5302499
163.427496
42.25269807
null
-4.57
null
null
null
null
null
null
null
null
null
null
4
CC[C@H](C)[C@H]1C(=O)NCC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N2CCC[C@H]2C(=O)NC(C)(C)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N(C)[C@@H](C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1C
204.0778868
70.88615675
1.431199657
61.2583385
23.57583074
218.1048548
53.89074634
35.77554503
0
0.0
[['Caco2']]
[7787]
[['-7.57']]
['2023_Ohta']
['meA', 'F', 'meL', 'L', 'meI', 'G', 'meL', 'T', 'P', 'Aib', 'D', '-pip']
[0.1353999999999999, 1.0159999999999998, 1.1616, 0.8193999999999995, 1.1616, -0.5953000000000002, 1.1616, -0.1918000000000002, 0.2794999999999998, 0.1832999999999998, -0.6377000000000004, 1.1021]
[20.31, 29.1, 20.31, 29.1, 20.31, 29.1, 20.31, 38.33, 20.31, 29.1, 46.17, 3.24]
31.85888012
0.0
0.0
0.0
226.4963448
63.90737111
23.57583074
284.4789859
30.21209354
8.47105247
0.0
0
2013_CHUGAI
559
null
316.69
null
934.4428032
0.0
185.7655662
-15.26696987
-10.48906559
-88.380049
-81.02830233
-78.62316875
-127.4208139
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
12
12
0
0
0
6
6
0
0
4
1
0
0
0
0
0
0
12
0
0
0
0
0
0
1
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.156271821
null
144b6d529371d321dcccb653cefe0674617692431afe97188d2cf5b2fef3369a
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
559
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['A', 'meL', 'T', 'Sar', 'meF', 'L', 'D', 'meF', 'meA', 'P', 'meF', 'A', '-pip']
80
560
-4.74
-4.74
Lariat
8
-1.8e-16
-2.756668955
-1.56e-16
-2.885721945
3.62e-17
-1.134995701
3.1e-15
-0.249287763
2.353457888
8348.855999
225.0
null
null
167.6105186
155.5292528
48.52925281
90.12753237
78.10468542
24.96036916
16.94529442
16.94529442
10.4353302
10.4353302
6.173994586
6.173994586
null
null
null
null
526.6927777
52.29424275
62.32898339
0
0
0
0
0
0
5.108808191
94.64278148
1401.806045
0.673267327
1.297029703
1.881188119
0.581081081
235.0
PEPTIDE560{A.[meL].T.[Sar].[meF].L.D.[meF].[meA].P.[meF].A.[-pip]}$PEPTIDE560,PEPTIDE560,1:R1-7:R3$$$
PEPTIDE560{<a href="/monomers/A/">A</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers...
-9.27
101
1294.891
560
null
null
2.47e+81
18.19295498
37.41510155
21.86912348
744.3956547
null
18.19806439
0.390716756
18.19806439
0.247548563
1.90328984
0.247548563
-8.228803509
-0.390716756
1.6718
377.9143
1402.747
Lariat
13
7
null
6
27
null
null
0
3
3
3
0
3
14
6
27
0
36
0
3
3
552
DP-565
-4.74
-6.228312182
3.945290521
70.8571528
66.19681715
7.059210392
78.22453614
0.0
0.0
62.32898339
0.0
0.0
0.0
118.0438491
100.4963126
179.1589312
58.70180074
null
-4.74
null
null
null
null
null
null
null
null
null
null
6
CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)CN(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C)NC(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](C)C(=O)N2CCC[C@H]2C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC1=O
212.9436161
76.79333648
1.431199657
65.74834461
11.78791537
197.194146
67.84240014
107.3266351
0
0.0
null
null
null
null
['A', 'meL', 'T', 'Sar', 'meF', 'L', 'D', 'meF', 'meA', 'P', 'meF', 'A', '-pip']
[-0.2068000000000003, 1.1616, -0.1918000000000002, -0.2531000000000001, 1.3581999999999996, 0.8193999999999995, -0.6377000000000004, 1.3581999999999996, 0.1353999999999999, 0.2794999999999998, 1.3581999999999996, -0.2068000000000003, 1.1021]
[29.1, 20.31, 38.33, 20.31, 20.31, 29.1, 46.17, 20.31, 20.31, 20.31, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
262.6518575
81.4477581
11.78791537
260.9355048
90.63628061
7.059210392
0.0
0
2013_CHUGAI
560
null
328.21
null
967.5817554
0.0
198.8678769
-11.66309541
-9.553183437
-77.29232699
-118.5750683
-76.11656185
-112.3327297
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
13
13
0
0
0
8
5
0
0
6
2
0
0
0
0
0
0
13
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.088455176
null
e4b9dd89e7b8b2cafc41214907b798b969e11e1592f49bd51f06791437c81ac2
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
560
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['A', 'meL', 'T', 'Sar', 'meF', 'L', 'D', 'meL', 'V', 'meA', 'A', '-pip']
73
561
-4.96
-4.96
Lariat
6
-2.42e-16
-2.756718973
-2.14e-16
-2.889902442
-1.23e-16
-1.135214168
1e-15
-0.249287763
3.94225819
6815.158829
250.0
null
null
151.5276149
141.1737909
41.17379092
79.78864554
70.20334768
20.61181782
13.99571467
13.99571467
8.237502888
8.237502888
4.721100352
4.721100352
null
null
null
null
445.3306319
39.95741574
57.53444621
0
0
0
0
0
0
5.108808191
97.42538211
1208.753281
0.779069767
1.476744186
2.081395349
0.704918033
230.0
PEPTIDE561{A.[meL].T.[Sar].[meF].L.D.[meL].V.[meA].A.[-pip]}$PEPTIDE561,PEPTIDE561,1:R1-7:R3$$$
PEPTIDE561{<a href="/monomers/A/">A</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/meA/"...
-7.18
86
1108.742
561
null
null
4.55e+69
14.59909564
33.65157755
21.05643174
649.0142912
null
17.82999028
0.390716756
17.82999028
0.247548563
1.924440669
0.247548563
-8.26178723
-0.390716756
0.5553
322.553
1209.542
Lariat
12
7
null
7
25
null
null
0
2
2
1
0
1
13
7
25
0
37
0
2
2
482
DP-566
-4.96
-5.05462094
1.241973404
66.3671467
60.17892468
8.47105247
72.31735641
0.0
0.0
57.53444621
0.0
0.0
0.0
85.02723048
94.78440011
157.0526705
43.62345662
null
-4.96
null
null
null
null
null
null
null
null
null
null
3
CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)CN(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C)NC(=O)C[C@@H](C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N(C)[C@@H](C)C(=O)N[C@@H](C)C(=O)N2CCCCC2)C(C)C)NC1=O
198.5948526
70.88615675
1.431199657
61.2583385
23.57583074
199.4650473
54.36971355
35.77554503
0
0.0
null
null
null
null
['A', 'meL', 'T', 'Sar', 'meF', 'L', 'D', 'meL', 'V', 'meA', 'A', '-pip']
[-0.2068000000000003, 1.1616, -0.1918000000000002, -0.2531000000000001, 1.3581999999999996, 0.8193999999999995, -0.6377000000000004, 1.1616, 0.4292999999999995, 0.1353999999999999, -0.2068000000000003, 1.1021]
[29.1, 20.31, 38.33, 20.31, 20.31, 29.1, 46.17, 20.31, 29.1, 20.31, 29.1, 3.24]
31.85888012
0.0
0.0
0.0
227.4542793
63.90737111
23.57583074
259.8771769
30.21209354
8.47105247
0.0
0
2013_CHUGAI
561
null
316.69
null
884.8925157
0.0
183.2129598
-15.18262154
-3.157891724
-86.72416751
-86.49403219
-57.76079797
-123.5359646
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
12
12
0
0
0
6
6
0
0
5
1
0
0
0
0
0
0
12
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.099758657
null
1fb2a201a8867dad67ef3d131af3903c71ed50d2bfd00e71e08bfd9a61a14867
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
561
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['A', 'meL', 'T', 'Sar', 'meF', 'L', 'D', 'meF', 'I', '-pip']
61
562
-4.52
-4.52
Lariat
7
-2.47e-16
-2.76796607
-1.32e-16
-2.890097712
-2.75e-17
-1.134994977
1.91e-15
-0.249287763
3.241776419
6287.784061
201.0
null
null
135.1823154
125.9628672
37.96286715
72.12197887
62.97985181
19.33553554
12.99098235
12.99098235
7.81730439
7.81730439
4.587392841
4.587392841
null
null
null
null
413.1418813
37.21589863
47.94537184
0
0
0
0
0
0
5.108808191
83.67671303
1100.663404
0.835443038
1.518987342
2.126582278
0.620689655
195.0
PEPTIDE562{A.[meL].T.[Sar].[meF].L.D.[meF].I.[-pip]}$PEPTIDE562,PEPTIDE562,1:R1-7:R3$$$
PEPTIDE562{<a href="/monomers/A/">A</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/I/">I</a>.<a href="/monomers/-pip/...
-6.9
79
1012.697
562
null
null
1.22e+60
13.70145044
30.45977528
18.60008794
590.2364637
null
17.74336914
0.390716756
17.74336914
0.247548563
2.041479446
0.247548563
-7.963721334
-0.390716756
1.7904
298.0243
1101.401
Lariat
10
7
null
6
21
null
null
0
2
2
2
0
2
11
6
21
0
29
0
2
2
436
DP-567
-4.52
-2.807269753
2.517148902
56.15742361
48.14313975
7.059210392
60.50299695
0.0
0.0
47.94537184
0.0
0.0
0.0
107.9084647
74.37718478
137.2591487
47.73573229
null
-4.52
null
null
null
null
null
null
null
null
null
null
4
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)N(C)C(=O)[C@@H]1CC(=O)N[C@@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)CC(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(C)C)C(=O)N1)C(=O)N1CCCCC1
172.515592
59.07179729
1.431199657
51.04861542
17.68187306
166.3946188
47.39388665
71.55109006
0
0.0
null
null
null
null
['A', 'meL', 'T', 'Sar', 'meF', 'L', 'D', 'meF', 'I', '-pip']
[-0.2068000000000003, 1.1616, -0.1918000000000002, -0.2531000000000001, 1.3581999999999996, 0.8193999999999995, -0.6377000000000004, 1.3581999999999996, 0.8193999999999999, 1.1021]
[29.1, 20.31, 38.33, 20.31, 20.31, 29.1, 46.17, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
191.7283982
60.69122164
17.68187306
222.9547158
60.42418708
7.059210392
0.0
0
2013_CHUGAI
562
null
267.28
null
785.057044
0.0
154.5035285
-11.63044262
-6.281599227
-68.58626391
-83.5172314
-63.17920226
-91.19916645
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
10
10
0
0
0
5
5
0
0
4
1
0
0
0
0
0
0
10
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.141188605
null
aba6e53369b3a995ee730d6c8892521be6d642b7845149450052c0c42e26a9ea
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
562
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dA', 'meF', 'I', 'T', 'Sar', 'V', 'D', 'meL', 'G', 'meL', 'A', '-pip']
72
563
-5.36
-5.36
Lariat
1
-1.98e-16
-2.757494315
-2.11e-16
-2.897971649
-1.14e-16
-1.135159896
1.15e-15
-0.249287763
3.72509298
6597.738215
243.0
null
null
146.5276149
136.1737909
40.17379092
77.32732067
67.67695448
20.13821102
13.53530447
13.53530447
7.979721508
7.979721508
4.563820624
4.563820624
null
null
null
null
432.3917837
31.7328644
57.53444621
0
0
0
0
0
0
5.108808191
100.2079827
1180.721981
0.797619048
1.488095238
2.083333333
0.694915254
239.0
PEPTIDE563{[dA].[meF].I.T.[Sar].V.D.[meL].G.[meL].A.[-pip]}$PEPTIDE563,PEPTIDE563,1:R1-7:R3$$$
PEPTIDE563{<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/I/">I</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/G/">G</a>.<a href="/monomers/meL/">[...
-7.18
84
1084.72
563
null
null
1.82e+66
14.44972664
33.34624963
20.85581616
630.5126102
null
17.41356974
0.390716756
17.41356974
0.247548444
1.942294431
0.247548444
-7.955823424
-0.390716756
-0.1754
313.3307
1181.488
Lariat
12
7
null
8
25
null
null
0
2
2
1
0
1
13
8
25
0
35
0
2
2
470
DP-568
-5.36
-4.527567219
1.247186862
66.77705032
54.16103222
9.882894548
72.31735641
0.0
0.0
57.53444621
0.0
0.0
0.0
91.40015538
81.55958309
141.8522922
51.49107486
null
-5.36
null
null
null
null
null
null
null
null
null
null
3
CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@@H](C)NC(=O)C[C@@H](C(=O)N(C)[C@@H](CC(C)C)C(=O)NCC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H](C(C)C)NC(=O)CN(C)C(=O)[C@H]([C@@H](C)O)NC1=O
193.1529019
70.88615675
1.431199657
61.66824213
23.57583074
186.5952627
53.89074634
35.77554503
0
0.0
null
null
null
null
['dA', 'meF', 'I', 'T', 'Sar', 'V', 'D', 'meL', 'G', 'meL', 'A', '-pip']
[-0.2068000000000003, 1.3581999999999996, 0.8193999999999999, -0.1918000000000002, -0.2531000000000001, 0.4292999999999995, -0.6377000000000004, 1.1616, -0.5953000000000002, 1.1616, -0.2068000000000003, 1.1021]
[29.1, 20.31, 29.1, 38.33, 20.31, 29.1, 46.17, 20.31, 29.1, 20.31, 29.1, 3.24]
37.16869347
0.0
0.0
0.0
216.0575098
63.90737111
23.57583074
246.171492
30.21209354
9.882894548
0.0
0
2013_CHUGAI
563
null
325.48
null
842.8854408
0.0
183.2670528
-17.24013024
-3.067870816
-84.44060347
-77.12826257
-55.72413758
-115.801489
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
12
12
0
0
0
5
7
0
0
4
1
0
0
0
0
0
0
12
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.089344549
null
3c05e3e3f59f3cf098d6e350da7f5b06c3e1e15e066ddbbcedef566117d85f4c
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
563
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dA', 'meF', 'I', 'T', 'Sar', 'V', 'D', 'meF', 'meF', 'A', '-pip']
67
564
-4.68
-4.68
Lariat
6
-1.68e-16
-2.756707223
-7.52e-17
-2.897961729
1.4e-16
-1.125732067
3.35e-15
-0.249274013
2.676306997
6895.296495
221.0
null
null
140.8011175
130.318329
41.31832904
76.11278949
65.32840315
21.23687328
14.25654511
14.25654511
8.726631016
8.726631016
5.093177077
5.093177077
null
null
null
null
447.0335372
41.36925782
52.73990902
0
0
0
0
0
0
5.108808191
80.93519592
1191.669217
0.744186047
1.38372093
1.953488372
0.53968254
225.0
PEPTIDE564{[dA].[meF].I.T.[Sar].V.D.[meF].[meF].A.[-pip]}$PEPTIDE564,PEPTIDE564,1:R1-7:R3$$$
PEPTIDE564{<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/I/">I</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/A...
-8.21
86
1102.758
564
null
null
5.57e+63
15.72563639
32.33829845
18.89440986
630.1030272
null
17.83231972
0.390716756
17.83231972
0.247548444
1.920463719
0.247548444
-7.87928329
-0.390716756
1.1016
321.703
1192.47
Lariat
11
7
null
7
23
null
null
0
2
2
3
0
3
12
7
23
0
29
0
2
2
468
DP-569
-4.68
-3.365067476
3.98698744
61.46723697
54.16103222
8.47105247
66.41017668
0.0
0.0
52.73990902
0.0
0.0
0.0
124.416774
68.1527209
135.4075223
55.96028363
null
-4.68
null
null
null
null
null
null
null
null
null
null
5
CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@@H](C)NC(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H](C(C)C)NC(=O)CN(C)C(=O)[C@H]([C@@H](C)O)NC1=O
178.7219713
64.97897702
1.431199657
56.35842877
11.78791537
159.1876943
47.39388665
107.3266351
0
0.0
null
null
null
null
['dA', 'meF', 'I', 'T', 'Sar', 'V', 'D', 'meF', 'meF', 'A', '-pip']
[-0.2068000000000003, 1.3581999999999996, 0.8193999999999999, -0.1918000000000002, -0.2531000000000001, 0.4292999999999995, -0.6377000000000004, 1.3581999999999996, 1.3581999999999996, -0.2068000000000003, 1.1021]
[29.1, 20.31, 29.1, 38.33, 20.31, 29.1, 46.17, 20.31, 20.31, 29.1, 3.24]
31.85888012
0.0
0.0
0.0
203.6534704
71.85868373
11.78791537
208.9204254
90.63628061
8.47105247
0.0
0
2013_CHUGAI
564
null
296.38
null
797.5277104
0.0
170.9057589
-13.77055016
-9.2780829
-66.07839034
-101.0673443
-54.67667712
-85.2290912
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
11
11
0
0
0
5
6
0
0
4
1
0
0
0
0
0
0
11
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.100086155
null
96ce9942ed346cfb41414b119245567a54361952364a255cf8f3d1a8a4ca82e6
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
564
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dA', 'V', 'meF', 'meL', 'meA', 'T', 'F', 'D', 'meL', 'meF', 'V', 'meA', 'I', '-pip']
86
565
-5.68
-5.68
Lariat
4
-2.69e-16
-2.767978583
-1.86e-16
-2.894899256
-1.88e-17
-1.135223692
1.51e-15
-0.249287763
2.891202692
9495.505941
272.0
null
null
192.7652192
179.8847147
53.88471469
102.7315916
89.92684356
27.3881001
18.61225038
18.61225038
11.34344602
11.34344602
6.570822521
6.570822521
null
null
null
null
589.7820409
60.60096113
67.12352058
0
0
0
0
0
0
5.108808191
112.4626427
1558.952709
0.616071429
1.241071429
1.8125
0.614457831
278.0
PEPTIDE565{[dA].V.[meF].[meL].[meA].T.F.D.[meL].[meF].V.[meA].I.[-pip]}$PEPTIDE565,PEPTIDE565,1:R1-8:R3$$$
PEPTIDE565{<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/m...
-9.8
112
1432.996
565
null
null
1.54e+95
19.41276915
43.29108045
25.6149233
838.9979305
null
18.54372212
0.390716897
18.54372212
0.245632137
2.230726938
0.245632137
-8.555407051
-0.390716897
3.3771
425.0927
1560.004
Lariat
14
8
null
8
29
null
null
0
2
2
3
0
3
15
8
29
0
47
0
2
2
618
DP-570
-5.68
-9.284667425
4.462828754
76.57686978
78.23260209
9.882894548
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
165.5281267
105.4323359
195.964967
52.20494106
null
-5.68
null
null
null
null
null
null
null
null
null
null
5
CC[C@H](C)[C@H](NC(=O)[C@H](C)N(C)C(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H]1CC(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(C)C)C(=O)N1CCCCC1
243.8647329
82.70051621
1.431199657
71.46806159
29.46978843
243.9683588
54.84868077
107.3266351
0
0.0
null
null
null
null
['dA', 'V', 'meF', 'meL', 'meA', 'T', 'F', 'D', 'meL', 'meF', 'V', 'meA', 'I', '-pip']
[-0.2068000000000003, 0.4292999999999995, 1.3581999999999996, 1.1616, 0.1353999999999999, -0.1918000000000002, 1.0159999999999998, -0.6377000000000004, 1.1616, 1.3581999999999996, 0.4292999999999995, 0.1353999999999999, 0.8193999999999999, 1.1021]
[29.1, 29.1, 20.31, 20.31, 20.31, 38.33, 29.1, 46.17, 20.31, 20.31, 29.1, 20.31, 29.1, 3.24]
37.16869347
0.0
0.0
0.0
262.7011931
86.24229528
29.46978843
318.9768281
90.63628061
9.882894548
0.0
0
2013_CHUGAI
565
null
366.1
null
1149.514294
0.0
222.526755
-19.2260063
-10.38747668
-108.6788689
-141.8023202
-73.24709982
-142.115944
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
7
7
0
0
6
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.057122692
null
4b1bdfc53ef673a4dbc58b9347571a06886a11896fdaee2a6f8cb11eceac34dd
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
565
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dA', 'V', 'meF', 'meL', 'meA', 'T', 'F', 'D', 'Sar', 'L', '-pip']
67
566
-4.64
-4.64
Lariat
8
-2.11e-16
-2.764228039
-1.69e-16
-2.892179943
3.43e-18
-1.135130524
1.65e-15
-0.249287762
3.166493227
6576.638636
236.0
null
null
140.8370159
130.818329
39.81832904
75.18736301
65.32840315
20.23687328
13.63154511
13.63154511
8.108229317
8.108229317
4.73050986
4.73050986
null
null
null
null
430.8557341
37.21589863
52.73990902
0
0
0
0
0
0
5.108808191
87.83007222
1157.684867
0.746987952
1.385542169
1.975903614
0.616666667
239.0
PEPTIDE566{[dA].V.[meF].[meL].[meA].T.F.D.[Sar].L.[-pip]}$PEPTIDE566,PEPTIDE566,1:R1-8:R3$$$
PEPTIDE566{<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/L...
-7.43
83
1066.725
566
null
null
9.869999999999999e+63
14.61435552
31.85079838
19.87435759
616.9507004
null
17.46072087
0.390716897
17.46072087
0.245632137
2.080659016
0.245632137
-7.638812187
-0.390716897
0.905
311.012
1158.453
Lariat
11
8
null
7
23
null
null
0
2
2
2
0
2
12
7
23
0
29
0
2
2
458
DP-571
-4.64
-3.486046654
2.537305787
61.46723697
54.16103222
8.47105247
66.41017668
0.0
0.0
52.73990902
0.0
0.0
0.0
101.5355398
81.2290769
138.6299073
49.10649085
null
-4.64
null
null
null
null
null
null
null
null
null
null
4
CC(C)C[C@H](NC(=O)CN(C)C(=O)[C@@H]1CC(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N1CCCCC1
181.4634884
64.97897702
1.431199657
56.35842877
17.68187306
172.8914785
47.39388665
71.55109006
0
0.0
null
null
null
null
['dA', 'V', 'meF', 'meL', 'meA', 'T', 'F', 'D', 'Sar', 'L', '-pip']
[-0.2068000000000003, 0.4292999999999995, 1.3581999999999996, 1.1616, 0.1353999999999999, -0.1918000000000002, 1.0159999999999998, -0.6377000000000004, -0.2531000000000001, 0.8193999999999995, 1.1021]
[29.1, 29.1, 20.31, 20.31, 20.31, 38.33, 29.1, 46.17, 20.31, 29.1, 3.24]
31.85888012
0.0
0.0
0.0
203.6534704
65.48575883
17.68187306
226.1752002
60.42418708
8.47105247
0.0
0
2013_CHUGAI
566
null
296.38
null
809.3496963
0.0
169.5512417
-13.98038356
-6.285458317
-72.64618622
-90.04758863
-56.00715092
-97.85083705
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
11
11
0
0
0
5
6
0
0
4
1
0
0
0
0
0
0
11
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.13104702
null
13798c86f27d84b6ff34834aa04c2525089c372bfdf1fbf4b32142ada04933b1
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
566
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['A', 'L', 'meI', 'V', 'meF', 'L', 'meF', 'D', 'meF', 'A', 'T', 'F', '-pip']
76
567
-7.0
-7
Lariat
3
-2.27e-16
-2.757218373
-1.32e-16
-2.893745648
-5.66e-17
-1.134757198
3.04e-15
-0.249287762
2.522016649
9252.673111
266.0
null
null
182.0746202
169.5292528
52.52925281
98.16898425
85.02550582
27.03954876
18.14947403
18.14947403
11.0074221
11.0074221
6.544394738
6.544394738
null
Although it was not mentioned in the text, it may be -7 (by CycPeptMPDB)
null
null
575.1141446
68.86659599
62.32898339
0
0
0
0
0
0
5.108808191
91.90126436
1507.884295
0.614678899
1.165137615
1.678899083
0.548780488
264.0
PEPTIDE567{A.L.[meI].V.[meF].L.[meF].D.[meF].A.T.F.[-pip]}$PEPTIDE567,PEPTIDE567,1:R1-8:R3$$$
PEPTIDE567{<a href="/monomers/A/">A</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meI/">[meI]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/A/">A...
-10.05
109
1390.979
567
null
null
4.01e+88
19.44628594
42.06008327
25.52758544
806.7824248
null
18.38677233
0.390716897
18.38677233
0.245620315
1.878775292
0.245620315
-8.361425876
-0.390716897
3.7747
413.5414
1508.915
Lariat
13
8
null
9
27
null
null
0
2
2
4
0
4
14
9
27
0
41
0
2
2
594
DP-572
-7.0
-7.952371309
5.673888259
72.08686367
72.21470962
11.29473663
78.22453614
0.0
0.0
62.32898339
0.0
0.0
0.0
182.036436
98.24993757
169.1956183
57.68797528
null
-7.0
null
null
null
null
null
null
null
null
null
null
6
CC[C@H](C)[C@H]1C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCCC2)[C@@H](C)O)CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N1C
226.7744523
76.79333648
1.431199657
66.97805548
23.57583074
223.7677149
40.89702697
143.1021801
0
0.0
null
null
null
null
['A', 'L', 'meI', 'V', 'meF', 'L', 'meF', 'D', 'meF', 'A', 'T', 'F', '-pip']
[-0.2068000000000003, 0.8193999999999995, 1.1616, 0.4292999999999995, 1.3581999999999996, 0.8193999999999995, 1.3581999999999996, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, -0.1918000000000002, 1.0159999999999998, 1.1021]
[29.1, 29.1, 20.31, 29.1, 20.31, 29.1, 20.31, 46.17, 20.31, 29.1, 38.33, 29.1, 3.24]
42.47850683
0.0
0.0
0.0
227.0246476
87.820683
23.57583074
290.2770176
120.8483742
11.29473663
0.0
0
2013_CHUGAI
567
null
354.58
null
1072.683846
0.0
211.8786207
-21.66804566
-13.12298516
-95.54908891
-143.8006867
-78.38681806
-108.6181756
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
13
13
0
0
0
5
8
0
0
4
1
0
0
0
0
0
0
13
0
0
0
0
0
0
4
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.045634573
null
06747343f3bcc821152023f27b0847a5708d716af4c9f0fc18b63117f0103c44
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
567
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['A', 'L', 'meI', 'V', 'meF', 'L', 'meF', 'D', 'meF', 'I', '-pip']
66
568
-7.0
-7
Lariat
3
-3.24e-16
-2.767960494
-1.95e-16
-2.887260163
-7.76e-17
-1.134757184
1.45e-15
-0.249287762
3.008210543
7924.219083
193.0
null
null
162.5940108
152.4100807
45.41008075
86.80212932
76.46603071
23.28274914
15.66422436
15.66422436
9.578897666
9.578897666
5.701581271
5.701581271
null
Although it was not mentioned in the text, it may be -7 (by CycPeptMPDB)
null
null
504.6827682
57.81836049
52.73990902
0
0
0
0
0
0
0.0
89.09930615
1301.815153
0.659574468
1.212765957
1.734042553
0.597222222
195.0
PEPTIDE568{A.L.[meI].V.[meF].L.[meF].D.[meF].I.[-pip]}$PEPTIDE568,PEPTIDE568,1:R1-8:R3$$$
PEPTIDE568{<a href="/monomers/A/">A</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meI/">[meI]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/I/">I...
-8.17
94
1194.858
568
null
null
3.4599999999999996e+76
15.94246461
36.48235134
21.42831028
707.7960713
null
18.2669612
0.344513264
18.2669612
0.245620315
2.24094876
0.245620315
-8.280913383
-0.344513264
5.2078
361.6342
1302.714
Lariat
11
8
null
6
22
null
null
0
2
2
3
0
3
11
6
22
0
35
0
2
2
516
DP-573
-7.0
-5.340785514
3.681417642
56.35842877
60.17892468
8.47105247
64.97897702
0.0
0.0
52.73990902
0.0
0.0
0.0
171.9010516
84.87665953
164.1934519
40.64188881
null
-7.0
null
null
null
null
null
null
null
null
null
null
5
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)N(C)C(=O)[C@@H]1CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N1)C(=O)N1CCCCC1
199.6575757
64.97897702
0.0
56.35842877
29.46978843
205.6519119
40.89702697
107.3266351
0
0.0
null
null
null
null
['A', 'L', 'meI', 'V', 'meF', 'L', 'meF', 'D', 'meF', 'I', '-pip']
[-0.2068000000000003, 0.8193999999999995, 1.1616, 0.4292999999999995, 1.3581999999999996, 0.8193999999999995, 1.3581999999999996, -0.6377000000000004, 1.3581999999999996, 0.8193999999999999, 1.1021]
[29.1, 29.1, 20.31, 29.1, 20.31, 29.1, 20.31, 46.17, 20.31, 29.1, 3.24]
31.85888012
0.0
0.0
0.0
190.5544773
71.85868373
29.46978843
281.4911811
90.63628061
8.47105247
0.0
0
2013_CHUGAI
568
null
276.15
null
979.7636452
0.0
178.1104298
-19.74343578
-10.22491526
-92.82987327
-118.1493087
-72.71313935
-108.1300693
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
0
0
0
0
0
11
11
0
0
0
5
6
0
0
4
1
0
0
0
0
0
0
11
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.085484928
null
9bc416af1c3d8bcdebb3701520aa932871c543a169878947019264feacdde4b3
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
568
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['A', 'L', 'meL', 'meF', 'A', 'meL', 'meF', 'D', 'meA', 'T', 'meF', 'meL', 'A', '-pip']
87
569
-5.92
-5.92
Lariat
7
-2.34e-16
-2.757657527
-2.04e-16
-2.884957135
-8.92e-17
-1.135779445
2.08e-15
-0.249287767
2.872621743
9491.505941
272.0
null
null
192.7652192
179.8847147
53.88471469
102.6929165
89.95323676
27.3617069
18.58585718
18.58585718
11.20818787
11.20818787
6.579430523
6.579430523
null
null
null
null
589.9750392
59.18911905
67.12352058
0
0
0
0
0
0
5.108808191
113.8334013
1558.952709
0.5625
1.080357143
1.580357143
0.614457831
273.0
PEPTIDE569{A.L.[meL].[meF].A.[meL].[meF].D.[meA].T.[meF].[meL].A.[-pip]}$PEPTIDE569,PEPTIDE569,1:R1-8:R3$$$
PEPTIDE569{<a href="/monomers/A/">A</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers...
-9.8
112
1432.996
569
null
null
4.3500000000000005e+94
19.41276915
43.29108045
26.14523891
839.1498453
null
18.14915056
0.390716755
18.14915056
0.247773875
2.062529011
0.247773875
-8.420503562
-0.390716755
3.4733
425.173
1560.004
Lariat
14
8
null
7
29
null
null
0
2
2
3
0
3
15
7
29
0
47
0
2
2
618
DP-574
-5.92
-8.935556416
4.567041091
76.16696616
78.23260209
8.47105247
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
145.4514176
119.1361201
204.3115524
52.20494106
null
-5.92
null
null
null
null
null
null
null
null
null
null
5
CC(C)C[C@@H]1NC(=O)[C@H](C)NC(=O)C[C@@H](C(=O)N(C)[C@@H](C)C(=O)N[C@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N2CCCCC2)[C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](CC(C)C)N(C)C1=O
243.8236494
82.70051621
1.431199657
71.05815797
23.57583074
243.4893916
61.82450767
107.3266351
0
0.0
null
null
null
null
['A', 'L', 'meL', 'meF', 'A', 'meL', 'meF', 'D', 'meA', 'T', 'meF', 'meL', 'A', '-pip']
[-0.2068000000000003, 0.8193999999999995, 1.1616, 1.3581999999999996, -0.2068000000000003, 1.1616, 1.3581999999999996, -0.6377000000000004, 0.1353999999999999, -0.1918000000000002, 1.3581999999999996, 1.1616, -0.2068000000000003, 1.1021]
[29.1, 29.1, 20.31, 20.31, 29.1, 20.31, 20.31, 46.17, 20.31, 38.33, 20.31, 20.31, 29.1, 3.24]
31.85888012
0.0
0.0
0.0
274.5769297
86.24229528
23.57583074
319.8686194
90.63628061
8.47105247
0.0
0
2013_CHUGAI
569
null
357.31
null
1148.456196
0.0
219.1367684
-15.96956036
-10.28493697
-100.7317608
-141.2246292
-80.97797663
-141.8207667
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
8
6
0
0
7
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.060511856
null
af543332c8fd3d2a0dfeb1fa415768fee955b92917f9cd863f1dd98966c8f572
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
570
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'A', 'T', 'meA', 'F', 'meL', 'meF', 'meL', 'D', 'Sar', 'meL', 'I', '-pip']
81
571
-4.82
-4.82
Lariat
1
-2.62e-16
-2.769284783
-2.04e-16
-2.890895103
-7.84e-17
-1.135266117
1.33e-15
-0.249287763
3.496324227
8385.524733
255.0
null
null
177.146417
165.5292528
48.52925281
93.74078102
82.57829222
24.48676236
16.60988422
16.60988422
9.971981558
9.971981558
5.786495895
5.786495895
null
null
null
null
530.3986854
61.93063616
62.32898339
0
0
0
0
0
0
5.108808191
98.75505715
1411.884295
0.673267327
1.306930693
1.881188119
0.662162162
254.0
PEPTIDE571{[dV].A.T.[meA].F.[meL].[meF].[meL].D.[Sar].[meL].I.[-pip]}$PEPTIDE571,PEPTIDE571,1:R1-9:R3$$$
PEPTIDE571{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/S...
-8.49
101
1294.891
571
null
null
5.82e+85
17.15406491
39.64542894
24.35357092
762.4318345
null
18.41308528
0.390716755
18.41308528
0.24775273
2.199891062
0.24775273
-8.481296212
-0.390716755
2.6512
383.038
1412.827
Lariat
13
9
null
7
27
null
null
0
2
2
2
0
2
14
7
27
0
41
0
2
2
562
DP-576
-4.82
-7.661174949
3.148945505
71.26705643
66.19681715
8.47105247
78.22453614
0.0
0.0
62.32898339
0.0
0.0
0.0
135.3160332
99.38991717
185.4797664
51.84800796
null
-4.82
null
null
null
null
null
null
null
null
null
null
4
CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C(=O)[C@@H]1CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N1)C(=O)N1CCCCC1
226.6922852
76.79333648
1.431199657
66.15824824
29.46978843
225.0806817
61.34554045
71.55109006
0
0.0
null
null
null
null
['dV', 'A', 'T', 'meA', 'F', 'meL', 'meF', 'meL', 'D', 'Sar', 'meL', 'I', '-pip']
[0.4292999999999995, -0.2068000000000003, -0.1918000000000002, 0.1353999999999999, 1.0159999999999998, 1.1616, 1.3581999999999996, 1.1616, -0.6377000000000004, -0.2531000000000001, 1.1616, 0.8193999999999999, 1.1021]
[29.1, 29.1, 38.33, 20.31, 29.1, 20.31, 20.31, 20.31, 46.17, 20.31, 20.31, 29.1, 3.24]
31.85888012
0.0
0.0
0.0
251.2550881
75.0748332
29.46978843
301.9683409
60.42418708
8.47105247
0.0
0
2013_CHUGAI
571
null
337.0
null
1060.065954
0.0
202.5856975
-15.8056314
-6.877994701
-103.0536866
-112.1182835
-73.89663226
-142.4827561
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
13
13
0
0
0
7
6
0
0
6
1
0
0
0
0
0
0
13
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.094565654
null
db173149d07c0fffcaedc817fa55b513aaba35d67dd0dc9372e2b5a81749a224
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
571
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'A', 'T', 'meA', 'F', 'meL', 'meF', 'meL', 'D', 'meF', 'F', '-pip']
74
572
-6.03
-6.03
Lariat
6
-2.41e-16
-2.75732729
-1e-16
-2.892613934
5.26e-17
-1.135162356
3.04e-15
-0.249287763
2.626288465
8558.006296
221.0
null
null
168.9199197
157.1737909
49.17379092
91.31492498
78.95334768
25.36181782
17.10751806
17.10751806
10.44304242
10.44304242
6.192863358
6.192863358
null
null
null
null
538.4745156
67.41367039
57.53444621
0
0
0
0
0
0
5.108808191
80.93519592
1408.815882
0.607843137
1.166666667
1.715686275
0.532467532
219.0
PEPTIDE572{[dV].A.T.[meA].F.[meL].[meF].[meL].D.[meF].F.[-pip]}$PEPTIDE572,PEPTIDE572,1:R1-9:R3$$$
PEPTIDE572{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/D/">D</a>.<a href="/monomers/m...
-9.52
102
1300.918
572
null
null
6.73e+80
18.32993896
38.49527818
22.74183102
752.6954536
null
18.52857784
0.390716755
18.52857784
0.24775273
2.013749133
0.24775273
-8.459026052
-0.390716755
3.586
386.783
1409.782
Lariat
12
9
null
7
25
null
null
0
2
2
4
0
4
13
7
25
0
34
0
2
2
554
DP-577
-6.03
-6.465091561
5.578452882
66.3671467
66.19681715
8.47105247
72.31735641
0.0
0.0
57.53444621
0.0
0.0
0.0
161.9597269
92.35597988
167.9468939
56.31721673
null
-6.03
null
null
null
null
null
null
null
null
null
null
6
CC(C)C[C@H]1C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCCC2)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1C
209.560921
70.88615675
1.431199657
61.2583385
17.68187306
197.6731132
47.87285387
143.1021801
0
0.0
[['Caco2']]
[2066]
[['-7.24']]
['2018_CHUGAI']
['dV', 'A', 'T', 'meA', 'F', 'meL', 'meF', 'meL', 'D', 'meF', 'F', '-pip']
[0.4292999999999995, -0.2068000000000003, -0.1918000000000002, 0.1353999999999999, 1.0159999999999998, 1.1616, 1.3581999999999996, 1.1616, -0.6377000000000004, 1.3581999999999996, 1.0159999999999998, 1.1021]
[29.1, 29.1, 38.33, 20.31, 29.1, 20.31, 20.31, 20.31, 46.17, 20.31, 29.1, 3.24]
31.85888012
0.0
0.0
0.0
226.975312
83.02614581
17.68187306
260.6049986
120.8483742
8.47105247
0.0
0
2013_CHUGAI
572
null
316.69
null
994.339573
0.0
191.841774
-15.20171904
-13.11086075
-83.09321401
-135.9775225
-72.95141558
-103.0966151
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
12
12
0
0
0
6
6
0
0
5
1
0
0
0
0
0
0
12
0
0
0
0
0
0
4
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.070720647
null
cee4b560cc11fe14c1a09b9a11e4af741c5c6a320878836092de9db3917cbe0b
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
572
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_dA', 'meA', 'meF', 'meL', 'T', 'meA', 'meL', 'S', 'D', 'meA', 'I', 'P', 'V', 'A', '-pip']
94
573
-5.47
-5.47
Lariat
4
-2.48e-16
-2.757004369
-2.28e-16
-2.88994642
-7e-17
-1.135207727
9.29e-16
-0.249287763
3.292823396
8765.762105
302.0
null
null
187.1988233
174.1484249
51.14842487
98.67943273
86.69055374
25.69077558
17.66389221
17.66389221
10.90774282
10.90774282
6.159835186
6.159835186
null
null
null
null
548.7837432
48.18196708
71.91805776
0
0
0
0
0
0
10.21761638
120.7887187
1505.922137
0.654205607
1.271028037
1.831775701
0.72
290.0
PEPTIDE573{[Me_dA].[meA].[meF].[meL].T.[meA].[meL].S.D.[meA].I.P.V.A.[-pip]}$PEPTIDE573,PEPTIDE573,1:R1-9:R3$$$
PEPTIDE573{<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/S/">S</a>.<a href="/monomers/D/">D</a>.<a href=...
-8.81
107
1382.913
573
null
null
2.78e+92
18.45346606
40.94903159
23.59581328
804.0769425
null
17.79182608
0.393679071
17.79182608
0.247752853
1.962493749
0.247752853
-8.365663673
-0.393679071
-0.399
397.7588
1506.897
Lariat
15
9
null
8
32
null
null
0
3
3
1
0
1
17
8
32
0
44
0
3
3
600
DP-578
-5.47
-9.40636255
2.121387761
86.17568408
84.25049456
8.47105247
91.47009525
0.0
0.0
71.91805776
0.0
0.0
0.0
91.40015538
114.8611092
202.174838
49.16861641
null
-5.47
null
null
null
null
null
null
null
null
null
null
4
CC[C@H](C)[C@H](NC(=O)[C@H](C)N(C)C(=O)[C@@H]1CC(=O)N(C)[C@H](C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N1CCCCC1)C(C)C
248.2439606
88.60769594
2.862399314
75.9580677
23.57583074
249.9862512
74.8803526
35.77554503
0
0.0
null
null
null
null
['Me_dA', 'meA', 'meF', 'meL', 'T', 'meA', 'meL', 'S', 'D', 'meA', 'I', 'P', 'V', 'A', '-pip']
[0.1353999999999999, 0.1353999999999999, 1.3581999999999996, 1.1616, -0.1918000000000002, 0.1353999999999999, 1.1616, -1.2344000000000002, -0.6377000000000004, 0.1353999999999999, 0.8193999999999999, 0.2794999999999998, 0.4292999999999995, -0.2068000000000003, 1.1021]
[20.31, 20.31, 20.31, 20.31, 38.33, 20.31, 20.31, 49.33, 46.17, 20.31, 29.1, 20.31, 29.1, 29.1, 3.24]
31.85888012
0.0
0.0
0.0
310.9977644
78.29098266
23.57583074
316.4834992
30.21209354
8.47105247
0.0
0
2013_CHUGAI
573
null
397.85
null
1103.790425
0.0
227.9800242
-12.08820591
-3.381190699
-104.9600177
-119.4912211
-71.28456426
-161.0652495
0.0
1.0
2013
null
null
null
null
null
null
0
2
0
0
0
0
0
0
0
0
15
15
0
0
0
9
6
0
0
7
2
0
0
0
0
0
0
15
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.077630424
null
cc608e69f9dd6231d941bd3ff0522425f73cd9814b0d760505729634203a4f21
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
573
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dA', 'meA', 'meF', 'meL', 'T', 'Sar', 'meL', 'Ser(tBu)', 'meL', 'D', 'P', 'V', 'L', '-pip']
93
574
-4.62
-4.62
Lariat
9
-3.27e-16
-2.765362682
-2.75e-16
-2.884625217
-1.19e-16
-1.1352166
8.02e-16
-0.249287763
3.5586387
8869.380676
250.0
null
null
191.5441227
179.292963
51.29296298
100.5491703
89.36148505
25.76995519
17.72116754
17.72116754
10.38885726
10.38885726
6.105507616
6.105507616
null
null
null
null
557.0336193
66.04291183
67.12352058
0
0
0
0
0
0
9.845671145
109.7211256
1504.963274
0.672897196
1.280373832
1.85046729
0.74025974
265.0
PEPTIDE574{[dA].[meA].[meF].[meL].T.[Sar].[meL].[Ser(tBu)].[meL].D.P.V.L.[-pip]}$PEPTIDE574,PEPTIDE574,1:R1-10:R3$$$
PEPTIDE574{<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Ser(tBu)/">[Ser(tBu)]</a>.<a href="/monomers/meL/">[m...
-8.28
107
1376.929
574
null
null
4.63e+93
17.86382469
41.33113013
26.52625649
814.1429647
null
18.15998682
0.390716756
18.15998682
0.247548563
2.294085646
0.247548563
-8.559358937
-0.390716756
2.2146
403.332
1505.953
Lariat
14
10
null
7
30
null
null
0
3
3
1
0
1
16
7
30
0
40
0
3
3
602
DP-579
-4.62
-9.556448334
1.770531733
80.90382911
72.21470962
8.47105247
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
98.73101471
133.5009167
203.4235624
61.2665269
null
-4.62
null
null
null
null
null
null
null
null
null
null
4
CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CC(=O)N[C@H](C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)CC(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](COC(C)(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N1)C(C)C)C(=O)N1CCCCC1
251.3020295
82.70051621
1.431199657
71.05815797
29.46978843
263.6282262
74.40138538
35.77554503
0
0.0
null
null
null
null
['dA', 'meA', 'meF', 'meL', 'T', 'Sar', 'meL', 'Ser(tBu)', 'meL', 'D', 'P', 'V', 'L', '-pip']
[-0.2068000000000003, 0.1353999999999999, 1.3581999999999996, 1.1616, -0.1918000000000002, -0.2531000000000001, 1.1616, 0.5883999999999996, 1.1616, -0.6377000000000004, 0.2794999999999998, 0.4292999999999995, 0.8193999999999995, 1.1021]
[29.1, 20.31, 20.31, 20.31, 38.33, 20.31, 20.31, 38.33, 20.31, 46.17, 20.31, 29.1, 29.1, 3.24]
31.85888012
0.0
0.0
0.0
286.7369657
78.23330843
29.46978843
344.7847597
30.21209354
8.47105247
0.0
0
2013_CHUGAI
574
null
366.54
null
1162.508106
0.0
217.9534978
-16.90705382
-10.19220131
-109.4538699
-108.1045958
-81.62958118
-176.590968
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
8
6
0
0
6
2
0
0
0
0
0
0
14
0
0
0
0
0
0
1
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.09840226
null
0fbc7c41eb96b3f7e32d56589a627b3082382a8a0a14872fddbb0dfca11ab7fb
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
575
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['meA', 'T', 'meA', 'meV', 'F', 'Sar', 'meL', 'I', 'A', 'D', 'meL', 'T', 'meL', 'A', '-pip']
92
576
-5.57
-5.57
Lariat
7
-2.79e-16
-2.757653558
-2.76e-16
-2.893339495
-1.76e-16
-1.135260725
1.21e-15
-0.249287763
4.241808919
8868.770132
331.0
null
null
191.6988233
178.6484249
51.64842487
100.7181079
88.66416053
25.71716878
17.56874069
17.56874069
10.48885464
10.48885464
5.930430286
5.930430286
null
null
null
null
555.9216042
55.07684338
71.91805776
0
0
0
0
0
0
10.21761638
119.4179601
1521.953438
0.657407407
1.333333333
1.907407407
0.723684211
323.0
PEPTIDE576{[meA].T.[meA].[meV].F.[Sar].[meL].I.A.D.[meL].T.[meL].A.[-pip]}$PEPTIDE576,PEPTIDE576,1:R1-10:R3$$$
PEPTIDE576{<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meV/">[meV]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/I/">I</a>.<a href="/monomers/A/">A</a>.<a href="/monomers...
-8.81
108
1394.924
576
null
null
1.8199999999999998e+92
18.36577222
42.81084635
26.22082598
816.9156829
null
18.16225945
0.390716755
18.16225945
0.247762797
2.114721187
0.247762797
-8.611062209
-0.390716755
0.1409
404.4095
1522.94
Lariat
15
10
null
9
32
null
null
0
2
2
1
0
1
17
9
32
0
47
0
2
2
608
DP-581
-5.57
-9.996081797
2.50786498
86.5855877
78.23260209
9.882894548
91.47009525
0.0
0.0
71.91805776
0.0
0.0
0.0
105.1039396
114.382142
199.790254
55.18650888
null
-5.57
null
null
null
null
null
null
null
null
null
null
3
CC[C@H](C)[C@@H]1NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C)N(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N2CCCCC2)[C@@H](C)O)NC(=O)[C@H](C)NC1=O
253.7680783
88.60769594
2.862399314
76.36797132
29.46978843
257.3792361
68.32136735
35.77554503
0
0.0
null
null
null
null
['meA', 'T', 'meA', 'meV', 'F', 'Sar', 'meL', 'I', 'A', 'D', 'meL', 'T', 'meL', 'A', '-pip']
[0.1353999999999999, -0.1918000000000002, 0.1353999999999999, 0.7715000000000001, 1.0159999999999998, -0.2531000000000001, 1.1616, 0.8193999999999999, -0.2068000000000003, -0.6377000000000004, 1.1616, -0.1918000000000002, 1.1616, -0.2068000000000003, 1.1021]
[20.31, 38.33, 20.31, 20.31, 29.1, 20.31, 20.31, 29.1, 29.1, 46.17, 20.31, 38.33, 20.31, 29.1, 3.24]
37.16869347
0.0
0.0
0.0
299.600995
78.29098266
29.46978843
327.9266342
30.21209354
9.882894548
0.0
0
2013_CHUGAI
576
null
406.64
null
1139.321334
0.0
231.8340382
-16.34686117
-3.224802681
-114.3882928
-113.6035354
-73.83509889
-169.0067817
0.0
1.0
2013
null
null
null
null
null
null
0
2
0
0
0
0
0
0
0
0
15
15
0
0
0
8
7
0
0
7
1
0
0
0
0
0
0
15
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.074552314
null
028bea50a139b74192d94e11afcf62bdb46a6caf6418e281720267fe82c7f9f1
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
576
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'meA', 'meL', 'meL', 'Sar', 'meF', 'A', 'meF', 'meL', 'T', 'D', 'meA', 'meL', 'A', '-pip']
97
577
-4.68
-4.68
Lariat
8
-2.94e-16
-2.757630848
-2.68e-16
-2.894762045
-9.09e-17
-1.136031106
1.17e-15
-0.249287767
3.653475291
9610.590956
259.0
null
null
200.9558181
187.7401766
54.74017658
106.0055239
93.6045745
27.46025823
18.81183014
18.81183014
11.32547565
11.32547565
6.527134833
6.527134833
null
null
null
null
598.2700105
63.26031119
71.91805776
0
0
0
0
0
0
5.108808191
119.3164355
1596.005473
0.578947368
1.140350877
1.675438596
0.674698795
257.0
PEPTIDE577{[dV].[meA].[meL].[meL].[Sar].[meF].A.[meF].[meL].T.D.[meA].[meL].A.[-pip]}$PEPTIDE577,PEPTIDE577,1:R1-11:R3$$$
PEPTIDE577{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a...
-9.55
114
1463.002
577
null
null
4.2500000000000004e+98
19.33391796
44.36119999
26.77403699
862.190468
null
18.1544914
0.390716897
18.1544914
0.245632014
2.158950509
0.245632014
-8.682515708
-0.390716897
2.6872
432.1293
1597.066
Lariat
15
11
null
6
31
null
null
0
2
2
2
0
2
16
6
31
0
46
0
2
2
636
DP-582
-4.68
-9.825104092
3.473445964
80.65697227
78.23260209
7.059210392
90.0388956
0.0
0.0
71.91805776
0.0
0.0
0.0
128.9431082
119.4666263
226.9686254
54.58952507
null
-4.68
null
null
null
null
null
null
null
null
null
null
4
CC(C)C[C@@H](C(=O)N[C@@H](C)C(=O)N1CCCCC1)N(C)C(=O)[C@H](C)N(C)C(=O)[C@@H]1CC(=O)N[C@H](C(C)C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)CC(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N1
258.172413
88.60769594
1.431199657
75.54816407
29.46978843
250.8202509
82.27302116
71.55109006
0
0.0
null
null
null
null
['dV', 'meA', 'meL', 'meL', 'Sar', 'meF', 'A', 'meF', 'meL', 'T', 'D', 'meA', 'meL', 'A', '-pip']
[0.4292999999999995, 0.1353999999999999, 1.1616, 1.1616, -0.2531000000000001, 1.3581999999999996, -0.2068000000000003, 1.3581999999999996, 1.1616, -0.1918000000000002, -0.6377000000000004, 0.1353999999999999, 1.1616, -0.2068000000000003, 1.1021]
[29.1, 20.31, 20.31, 20.31, 20.31, 20.31, 29.1, 20.31, 20.31, 38.33, 46.17, 20.31, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
310.7324424
84.66390756
29.46978843
338.9750206
60.42418708
7.059210392
0.0
0
2013_CHUGAI
577
null
368.83
null
1211.608516
0.0
229.896194
-13.61525511
-6.841742212
-116.5342968
-130.4119993
-75.74375507
-179.8576614
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
15
15
0
0
0
10
5
0
0
9
1
0
0
0
0
0
0
15
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.104627586
null
c4d5eeb44029af560b763acb8861e8313069e07f58e777de60bf23e338aed712
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
577
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Me_dA', 'meL', 'F', 'T', 'Sar', 'meA', 'meV', 'A', 'meL', 'L', 'D', 'meI', 'F', '-pip']
89
578
-4.6
-4.6
Lariat
3
-2.62e-16
-2.758769258
-2.46e-16
-2.890040664
-6.7e-17
-1.135672836
1.08e-15
-0.249287767
3.628421158
8943.997653
260.0
null
null
187.8011175
175.3847147
51.38471469
99.26749003
87.45323676
25.8617069
17.59905378
17.59905378
10.60125513
10.60125513
6.120488086
6.120488086
null
null
null
null
561.0513863
59.18911905
67.12352058
0
0
0
0
0
0
5.108808191
111.0918842
1496.937059
0.635514019
1.214953271
1.757009346
0.666666667
263.0
PEPTIDE578{[Me_dA].[meL].F.T.[Sar].[meA].[meV].A.[meL].L.D.[meI].F.[-pip]}$PEPTIDE578,PEPTIDE578,1:R1-11:R3$$$
PEPTIDE578{<a href="/monomers/Me_dA/">[Me_dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/T/">T</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meV/">[meV]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/meL/">[meL]</a>.<a href=...
-9.02
107
1372.941
578
null
null
5.079999999999999e+90
18.20597616
41.92344397
25.56801192
807.6477523
null
18.53282612
0.390716756
18.53282612
0.247548564
2.130317956
0.247548564
-8.834394129
-0.390716756
2.4981
405.27
1497.933
Lariat
14
11
null
7
29
null
null
0
2
2
2
0
2
15
7
29
0
41
0
2
2
596
DP-583
-4.6
-8.753911226
3.227338526
76.16696616
72.21470962
8.47105247
84.13171587
0.0
0.0
67.12352058
0.0
0.0
0.0
135.3160332
106.2418093
200.6801446
53.21876652
null
-4.6
null
null
null
null
null
null
null
null
null
null
4
CC[C@H](C)[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCCC1)N(C)C(=O)[C@@H]1CC(=O)N(C)[C@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)CC(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1
241.0821323
82.70051621
1.431199657
71.05815797
29.46978843
237.9504663
68.32136735
71.55109006
0
0.0
null
null
null
null
['Me_dA', 'meL', 'F', 'T', 'Sar', 'meA', 'meV', 'A', 'meL', 'L', 'D', 'meI', 'F', '-pip']
[0.1353999999999999, 1.1616, 1.0159999999999998, -0.1918000000000002, -0.2531000000000001, 0.1353999999999999, 0.7715000000000001, -0.2068000000000003, 1.1616, 0.8193999999999995, -0.6377000000000004, 1.1616, 1.0159999999999998, 1.1021]
[20.31, 20.31, 29.1, 38.33, 20.31, 20.31, 20.31, 29.1, 20.31, 29.1, 46.17, 20.31, 29.1, 3.24]
31.85888012
0.0
0.0
0.0
275.0558969
79.86937038
29.46978843
318.4155429
60.42418708
8.47105247
0.0
0
2013_CHUGAI
578
null
357.31
null
1127.174908
0.0
218.0147552
-16.80688189
-6.445235512
-110.7985603
-120.2389247
-74.91500044
-158.1517266
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
14
14
0
0
0
8
6
0
0
7
1
0
0
0
0
0
0
14
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.1062704
null
c0abb56e0c5335fc510ecf4837d374b07ba63a13604790482004b26c2552ad49
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
579
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'meA', 'meF', 'meL', 'H', 'Sar', 'V', 'meL', 'meL', 'D', 'meF', 'A', '-pip']
83
580
-4.82
-4.82
Lariat
4
-2.56e-16
-2.756693881
-2.07e-16
-2.881090818
-2.79e-17
-1.136024321
1.72e-15
-0.249287767
3.068500408
8735.109844
253.0
null
null
178.9558181
167.0154317
50.01543171
95.22866824
83.58395378
25.4006722
17.28838387
17.28838387
10.45566412
10.45566412
6.163496736
6.163496736
null
null
null
null
547.1798967
67.37258686
62.32898339
0
0
0
0
0
0
4.983978521
93.25266534
1447.895529
0.625
1.163461538
1.692307692
0.631578947
233.0
PEPTIDE580{[dV].[meA].[meF].[meL].H.[Sar].V.[meL].[meL].D.[meF].A.[-pip]}$PEPTIDE580,PEPTIDE580,1:R1-10:R3$$$
PEPTIDE580{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/H/">H</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href=...
-9.24
104
1330.928
580
null
null
2.3000000000000002e+86
17.89445115
39.58457623
23.64127646
778.8818625
null
18.32421707
0.350903295
18.32421707
0.245632015
1.174665928
0.245632015
-8.611769535
-0.350903295
3.1883
393.6592
1448.864
Lariat
13
10
null
6
28
null
null
0
2
2
2
1
3
14
6
28
0
38
0
2
2
574
DP-585
-4.82
-7.148352487
5.19114501
70.72534788
67.56757571
8.47105247
76.79333648
0.0
0.0
62.32898339
4.983978521
0.0
0.0
128.9431082
92.53802505
205.0014134
57.76528964
null
-4.82
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)N[C@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)CC(=O)N[C@H](C(C)C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N(C)CC(=O)N[C@@H](C(C)C)C(=O)N1C
222.9542356
76.79333648
0.0
75.7093264
29.46978843
212.1487716
68.32136735
89.72128498
0
0.0
null
null
null
null
['dV', 'meA', 'meF', 'meL', 'H', 'Sar', 'V', 'meL', 'meL', 'D', 'meF', 'A', '-pip']
[0.4292999999999995, 0.1353999999999999, 1.3581999999999996, 1.1616, -0.2609000000000005, -0.2531000000000001, 0.4292999999999995, 1.1616, 1.1616, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[29.1, 20.31, 20.31, 20.31, 57.78, 20.31, 29.1, 20.31, 20.31, 46.17, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
260.4717806
81.4477581
29.46978843
295.8082104
72.900454
8.47105247
0.0
0
2013_CHUGAI
580
null
336.66
null
1071.465125
0.0
204.2413548
-16.62845039
-9.935172752
-104.7480873
-113.3457702
-72.63910019
-144.743232
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
2
1
0
0
0
13
13
0
0
0
9
6
0
0
7
1
1
0
0
0
0
0
13
0
0
0
0
0
0
2
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.100473329
null
a7fcf2405ade07b19c3b8b096b146c2945d09337fcf4c8aa708a184625d1b3e8
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
580
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'meL', 'meF', 'meL', 'H', 'meL', 'V', 'meL', 'meL', 'D', 'meF', 'A', '-pip']
83
581
-6.36
-6.36
Lariat
1
-3.12e-16
-2.756696115
-2.63e-16
-2.884818171
-1.38e-16
-1.136026001
9.27e-16
-0.249287767
3.290513087
9572.698712
237.0
null
null
196.4558181
184.5154317
53.51543171
103.9786682
92.33395378
27.1506722
18.52518727
18.52518727
11.16120365
11.16120365
6.697759743
6.697759743
null
null
null
null
591.790371
89.30472376
62.32898339
0
0
0
0
0
0
4.983978521
90.51114823
1546.005079
0.54954955
0.990990991
1.45045045
0.662650602
235.0
PEPTIDE581{[dV].[meL].[meF].[meL].H.[meL].V.[meL].[meL].D.[meF].A.[-pip]}$PEPTIDE581,PEPTIDE581,1:R1-10:R3$$$
PEPTIDE581{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/H/">H</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href=...
-9.24
111
1415.005
581
null
null
3.05e+96
18.43048455
42.97162136
26.17713241
843.1060443
null
18.61465801
0.350903295
18.61465801
0.245632016
1.364363756
0.245632016
-8.86821506
-0.350903295
5.6292
425.8162
1547.053
Lariat
13
10
null
6
28
null
null
0
2
2
2
1
3
14
6
28
0
45
0
2
2
616
DP-586
-6.36
-9.397482288
5.403969237
70.72534788
73.58546818
8.47105247
76.79333648
0.0
0.0
62.32898339
4.983978521
0.0
0.0
156.3506767
110.2198981
225.5627918
49.8976714
null
-6.36
null
null
null
null
null
null
null
null
null
null
5
CC(C)C[C@H]1C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)CC(=O)N[C@H](C(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N1C
242.1448554
76.79333648
0.0
75.7093264
41.2577038
251.4681902
61.82450767
89.72128498
0
0.0
null
null
null
null
['dV', 'meL', 'meF', 'meL', 'H', 'meL', 'V', 'meL', 'meL', 'D', 'meF', 'A', '-pip']
[0.4292999999999995, 1.1616, 1.3581999999999996, 1.1616, -0.2609000000000005, 1.1616, 0.4292999999999995, 1.1616, 1.1616, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[29.1, 20.31, 20.31, 20.31, 57.78, 20.31, 29.1, 20.31, 20.31, 46.17, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
259.9928134
81.4477581
41.2577038
348.3003564
72.900454
8.47105247
0.0
0
2013_CHUGAI
581
null
336.66
null
1217.499855
0.0
209.2563421
-17.87300064
-10.64300256
-124.9054346
-127.6282936
-91.2457654
-162.044034
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
2
1
0
0
0
13
13
0
0
0
9
6
0
0
7
1
1
0
0
0
0
0
13
0
0
0
0
0
0
2
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.06705885
null
a8ac44144c94f1d2f78371e201355fa43f4adcdbd363949364c54eb313c5a935
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
581
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'meA', 'meF', 'meL', 'Lys(Me2)', 'Sar', 'L', 'meL', 'meL', 'D', 'meF', 'A', '-pip']
90
582
-5.48
-5.48
Lariat
2
-3.63e-16
-2.756695443
-3.19e-16
-2.880081127
-2.3e-16
-1.136228112
7.31e-16
-0.249287769
3.729214551
9003.331758
247.0
null
null
190.5166605
179.0682181
51.06821811
100.2574711
89.41313338
25.6770654
17.32658047
17.32658047
10.26295902
10.26295902
6.028780369
6.028780369
null
null
null
null
568.4998964
76.96789676
62.32898339
0
0
0
0
0
0
0.0
98.69461604
1480.97853
0.594339623
1.160377358
1.716981132
0.683544304
246.0
PEPTIDE582{[dV].[meA].[meF].[meL].[Lys(Me2)].[Sar].L.[meL].[meL].D.[meF].A.[-pip]}$PEPTIDE582,PEPTIDE582,1:R1-10:R3$$$
PEPTIDE582{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Lys(Me2)/">[Lys(Me2)]</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[m...
-8.49
106
1352.954
582
null
null
6.41e+92
17.39335524
42.74700351
26.77190476
810.7420651
null
18.40389218
0.343971318
18.40389218
0.245632015
2.154321786
0.245632015
-8.705840238
-0.343971318
4.3445
408.3895
1481.978
Lariat
13
10
null
5
27
null
null
0
2
2
2
0
2
14
5
27
0
44
0
2
2
592
DP-587
-5.48
-8.277408251
2.906242229
70.64825434
66.19681715
7.059210392
76.79333648
0.0
0.0
62.32898339
0.0
0.0
0.0
128.9431082
138.4782381
211.6462131
44.39723138
null
-5.48
null
null
null
null
null
null
null
null
null
null
4
CC(C)C[C@@H]1NC(=O)CN(C)C(=O)[C@H](CCCCN(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C)N(C)C(=O)[C@@H](C(C)C)NC(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C1=O
237.9914962
76.79333648
0.0
70.64825434
29.46978843
231.2675463
88.76988084
71.55109006
0
0.0
null
null
null
null
['dV', 'meA', 'meF', 'meL', 'Lys(Me2)', 'Sar', 'L', 'meL', 'meL', 'D', 'meF', 'A', '-pip']
[0.4292999999999995, 0.1353999999999999, 1.3581999999999996, 1.1616, 0.5051999999999996, -0.2531000000000001, 0.8193999999999995, 1.1616, 1.1616, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[29.1, 20.31, 20.31, 20.31, 32.34, 20.31, 29.1, 20.31, 20.31, 46.17, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
275.8592221
75.0748332
29.46978843
332.0550847
60.42418708
7.059210392
0.0
0
2013_CHUGAI
582
null
311.22
null
1171.184858
0.0
201.4819119
-17.52324759
-6.979854475
-107.5309921
-116.6232187
-91.25198184
-164.5908081
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
0
0
0
0
0
13
13
0
0
0
9
5
0
0
7
1
0
0
0
0
0
0
13
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.096749879
null
45f742e42f031b1e64e1e0656ac9f809ef494f9f484d5cfd168ffeb5d07dbfe2
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
582
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'meL', 'meF', 'meL', 'Lys(Me2)', 'meL', 'L', 'meL', 'meL', 'D', 'meF', 'A', '-pip']
90
583
-6.22
-6.22
Lariat
1
-4.52e-16
-2.756697866
-3.8e-16
-2.88238233
-2.51e-16
-1.136338704
3.24e-16
-0.24928777
4.007392562
9843.685559
227.0
null
null
208.0166605
196.5682181
54.56821811
109.0074711
98.16313338
27.4270654
18.56338387
18.56338387
10.96849855
10.96849855
6.563043375
6.563043375
null
null
null
null
613.1103707
97.5292751
62.32898339
0
0
0
0
0
0
0.0
97.32385749
1579.088081
0.522123894
0.96460177
1.451327434
0.709302326
217.0
PEPTIDE583{[dV].[meL].[meF].[meL].[Lys(Me2)].[meL].L.[meL].[meL].D.[meF].A.[-pip]}$PEPTIDE583,PEPTIDE583,1:R1-10:R3$$$
PEPTIDE583{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Lys(Me2)/">[Lys(Me2)]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[m...
-8.49
113
1437.031
583
null
null
5.51e+102
17.98649546
46.15741007
29.38761963
874.9662469
null
18.75265333
0.343971316
18.75265333
0.245632016
2.255022607
0.245632016
-8.962285763
-0.343971316
6.7854
440.5465
1580.167
Lariat
13
10
null
5
27
null
null
0
2
2
2
0
2
14
5
27
0
51
0
2
2
634
DP-588
-6.22
-10.52618211
3.129147083
70.64825434
72.21470962
7.059210392
76.79333648
0.0
0.0
62.32898339
0.0
0.0
0.0
156.3506767
156.1601112
232.2075914
36.52961314
null
-6.22
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](CCCCN(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C(C)C)NC(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C1=O
257.182116
76.79333648
0.0
70.64825434
41.2577038
270.5869649
82.27302116
71.55109006
0
0.0
null
null
null
null
['dV', 'meL', 'meF', 'meL', 'Lys(Me2)', 'meL', 'L', 'meL', 'meL', 'D', 'meF', 'A', '-pip']
[0.4292999999999995, 1.1616, 1.3581999999999996, 1.1616, 0.5051999999999996, 1.1616, 0.8193999999999995, 1.1616, 1.1616, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[29.1, 20.31, 20.31, 20.31, 32.34, 20.31, 29.1, 20.31, 20.31, 46.17, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
275.3802548
75.0748332
41.2577038
384.5472307
60.42418708
7.059210392
0.0
0
2013_CHUGAI
583
null
311.22
null
1319.363182
0.0
206.5946217
-18.76779784
-7.365590987
-127.9971848
-131.3116619
-110.9768877
-182.6220141
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
0
0
0
0
0
13
13
0
0
0
9
5
0
0
7
1
0
0
0
0
0
0
13
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.057591666
null
36b79475f1f2410850e155cfcc382947683f2e424e32ae12c4e27ee9bf73e850
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
583
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'meA', 'meF', 'meL', 'E', 'Sar', 'L', 'meL', 'meL', 'D', 'meF', 'A', '-pip']
83
584
-4.96
-4.96
Lariat
5
-2.82e-16
-2.756695279
-2.27e-16
-2.880078595
-5.42e-17
-1.136227749
1.12e-15
-0.249287769
3.669667074
8615.150913
263.0
null
null
181.2237673
168.9375011
49.9375011
95.87282619
84.30880957
25.1644933
17.04182436
17.04182436
10.13481599
10.13481599
5.964708856
5.964708856
null
null
null
null
542.7478536
66.68408982
62.32898339
0
0
0
0
0
0
5.108808191
101.4965743
1453.89486
0.625
1.182692308
1.730769231
0.657894737
263.0
PEPTIDE584{[dV].[meA].[meF].[meL].E.[Sar].L.[meL].[meL].D.[meF].A.[-pip]}$PEPTIDE584,PEPTIDE584,1:R1-10:R3$$$
PEPTIDE584{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/E/">E</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href=...
-8.98
104
1334.912
584
null
null
3.52e+86
17.83429727
40.90830606
25.42241241
782.2850967
null
18.33763634
0.481229262
18.33763634
0.302935674
2.16539588
0.302935674
-8.655507276
-0.481229262
3.4774
392.8543
1454.864
Lariat
13
10
null
6
28
null
null
0
2
2
2
0
2
15
6
28
0
40
0
2
2
578
DP-589
-4.96
-8.301450956
1.797070304
70.8571528
66.19681715
7.059210392
76.79333648
1.431199657
5.969305288
67.12352058
0.0
0.0
0.0
128.9431082
105.2838749
204.3115524
44.39723138
null
-4.96
null
null
null
null
null
null
null
null
null
null
4
CC(C)C[C@@H]1NC(=O)CN(C)C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C)N(C)C(=O)[C@@H](C(C)C)NC(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C1=O
234.187256
82.76264177
1.431199657
65.74834461
29.46978843
224.8946214
68.32136735
71.55109006
0
0.0
null
null
null
null
['dV', 'meA', 'meF', 'meL', 'E', 'Sar', 'L', 'meL', 'meL', 'D', 'meF', 'A', '-pip']
[0.4292999999999995, 0.1353999999999999, 1.3581999999999996, 1.1616, -0.2476000000000005, -0.2531000000000001, 0.8193999999999995, 1.1616, 1.1616, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[29.1, 20.31, 20.31, 20.31, 46.17, 20.31, 29.1, 20.31, 20.31, 46.17, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
261.5889123
79.86937038
29.46978843
311.9745743
60.42418708
7.059210392
1.431199657
0
2013_CHUGAI
584
null
345.28
null
1085.50384
0.0
216.0338476
-13.84977343
-6.867442175
-109.7793745
-114.7853809
-82.44744782
-145.4749356
0.0
1.0
2013
null
null
null
null
null
null
1
0
0
0
0
0
0
0
1
1
14
13
0
0
0
8
5
0
0
7
1
0
0
0
0
0
0
13
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.10422906
null
3593a77e9e3927af36ed72897fea94f4c37373399929799c7e3914d10cd56e74
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
585
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'meA', 'meF', 'meL', '3Pal', 'Sar', 'A', 'meL', 'meL', 'D', 'meF', 'A', '-pip']
86
586
-4.59
-4.59
Lariat
5
-2.53e-16
-2.756693278
-1.85e-16
-2.879248605
1.45e-17
-1.136011694
1.91e-15
-0.249287767
3.014999844
8617.574592
216.0
null
null
175.5331684
163.5682181
49.56821811
93.63935184
81.93952658
25.20345861
17.08977707
17.08977707
10.31886072
10.31886072
6.0624657
6.0624657
null
null
null
null
541.280928
66.00182831
62.32898339
0
0
0
0
0
0
4.983978521
90.47006471
1430.86898
0.621359223
1.203883495
1.776699029
0.605263158
223.0
PEPTIDE586{[dV].[meA].[meF].[meL].[3Pal].[Sar].A.[meL].[meL].D.[meF].A.[-pip]}$PEPTIDE586,PEPTIDE586,1:R1-10:R3$$$
PEPTIDE586{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/3Pal/">[3Pal]</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>....
-9.3
103
1316.921
586
null
null
4.4699999999999996e+83
17.96624605
39.37587436
23.8805983
768.6698497
null
18.2474814
0.343971318
18.2474814
0.245632015
2.123434503
0.245632015
-8.539087685
-0.343971318
3.2241
390.1445
1431.833
Lariat
13
10
null
5
27
null
null
0
2
2
2
1
3
14
5
27
0
36
0
2
2
566
DP-591
-4.59
-6.38489177
4.574385533
65.74834461
66.19681715
7.059210392
76.79333648
0.0
0.0
67.31296191
0.0
0.0
0.0
121.2817427
105.1018297
205.6912744
49.8802656
null
-4.59
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)N[C@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)CC(=O)N[C@H](C(C)C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](Cc2cccnc2)C(=O)N(C)CC(=O)N[C@@H](C)C(=O)N1C
218.8008764
76.79333648
0.0
70.73232313
23.57583074
205.2968795
68.32136735
101.5451694
0
0.0
null
null
null
null
['dV', 'meA', 'meF', 'meL', '3Pal', 'Sar', 'A', 'meL', 'meL', 'D', 'meF', 'A', '-pip']
[0.4292999999999995, 0.1353999999999999, 1.3581999999999996, 1.1616, 0.4109999999999996, -0.2531000000000001, -0.2068000000000003, 1.1616, 1.1616, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[29.1, 20.31, 20.31, 20.31, 41.99, 20.31, 29.1, 20.31, 20.31, 46.17, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
255.4947774
81.4477581
23.57583074
286.0843247
84.85481491
7.059210392
0.0
0
2013_CHUGAI
586
null
320.87
null
1041.324577
0.0
204.2248016
-16.24199255
-9.87831161
-96.12187363
-117.0623685
-71.83340467
-136.9114272
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
1
0
0
0
0
13
13
0
0
0
9
5
0
0
7
1
0
0
0
0
0
0
13
0
0
0
0
0
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
1
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0.122209863
null
2df91ff1fe48e6f6af3628a207228f0414d4b308e4ec4386262ce3d235947a64
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
586
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Sar', 'F', 'meL', 'meL', 'F', 'meL', 'L', 'meF', 'H', 'L', 'D', 'meF', 'A', '-pip']
85
587
-6.74
-6.74
Lariat
1
-2.55e-16
-2.756684029
-1.52e-16
-2.889188814
-3.6e-17
-1.136007229
2.13e-15
-0.249287767
2.462660093
10665.69898
304.0
null
null
204.5387219
190.8708936
58.87089359
110.1835805
95.90611191
30.32840315
20.33033983
20.33033983
12.1582404
12.1582404
7.33864878
7.33864878
null
null
null
null
648.0397565
92.12840792
67.12352058
0
0
0
0
0
0
4.983978521
89.14038967
1685.010893
0.508196721
0.950819672
1.459016393
0.554347826
299.0
PEPTIDE587{[Sar].F.[meL].[meL].F.[meL].L.[meF].H.L.D.[meF].A.[-pip]}$PEPTIDE587,PEPTIDE587,1:R1-11:R3$$$
PEPTIDE587{<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/H/">H</a>.<a href="/monomers...
-11.33
122
1553.11
587
null
null
2.34e+101
21.52577558
47.18668121
29.2113459
905.1479029
null
18.45311866
0.350903295
18.45311866
0.245620449
1.334721724
0.245620449
-8.475360954
-0.350903295
5.5766
464.8146
1686.166
Lariat
14
11
null
8
30
null
null
0
2
2
4
1
5
15
8
30
0
42
0
2
2
664
DP-592
-6.74
-9.810445716
8.103146461
76.44506486
73.58546818
11.29473663
82.70051621
0.0
0.0
67.12352058
4.983978521
0.0
0.0
189.3672953
109.5588857
213.5129534
72.84363376
null
-6.74
null
null
null
null
null
null
null
null
null
null
7
CC(C)C[C@@H]1NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)CN(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC1=O
248.3923182
82.70051621
0.0
81.42904338
29.46978843
236.8064715
61.34554045
161.272375
0
0.0
null
null
null
null
['Sar', 'F', 'meL', 'meL', 'F', 'meL', 'L', 'meF', 'H', 'L', 'D', 'meF', 'A', '-pip']
[-0.2531000000000001, 1.0159999999999998, 1.1616, 1.1616, 1.0159999999999998, 1.1616, 0.8193999999999995, 1.3581999999999996, -0.2609000000000005, 0.8193999999999995, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 29.1, 20.31, 20.31, 29.1, 20.31, 29.1, 20.31, 57.78, 29.1, 46.17, 20.31, 29.1, 3.24]
37.16869347
0.0
0.0
0.0
260.5211162
98.98814508
29.46978843
330.6489323
133.3246411
11.29473663
0.0
0
2013_CHUGAI
587
null
374.55
null
1231.944389
0.0
230.0313194
-23.67806307
-17.37952153
-111.1030302
-151.4075251
-103.3384949
-131.9857402
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
2
1
0
0
0
14
14
0
0
0
8
8
0
0
6
1
1
0
0
0
0
0
14
0
0
0
0
0
0
4
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.035370224
null
a6345c541d6edc5d8304c07d19ee3b803be68cbfc008d4629b95dc489ee6a3fc
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
587
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Sar', 'F', 'meL', 'meL', 'F', 'meL', 'A', 'P', 'Lys(Me2)', 'L', 'D', 'meF', 'A', '-pip']
90
588
-5.96
-5.96
Lariat
8
-2.83e-16
-2.756685468
-2.11e-16
-2.882905436
-9.75e-17
-1.136006451
1.2e-15
-0.249287767
2.697670695
9904.38515
278.0
null
null
199.1354627
186.42368
55.42368
106.0369569
93.48529152
28.35479635
18.98033983
18.98033983
11.3207404
11.3207404
6.785955035
6.785955035
null
null
null
null
613.9864693
89.38689081
67.12352058
0
0
0
0
0
0
0.0
90.47006471
1597.999994
0.565217391
1.095652174
1.652173913
0.627906977
274.0
PEPTIDE588{[Sar].F.[meL].[meL].F.[meL].A.P.[Lys(Me2)].L.D.[meF].A.[-pip]}$PEPTIDE588,PEPTIDE588,1:R1-11:R3$$$
PEPTIDE588{<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Lys(Me2)/">[Lys(Me2)]</a>.<a href=...
-9.8
115
1467.037
588
null
null
3.41e+98
19.63344774
45.48467066
28.56339883
864.9907078
null
18.31028357
0.342791866
18.31028357
0.245620449
2.163016644
0.245620449
-8.511082161
-0.342791866
4.2378
439.1779
1599.085
Lariat
14
11
null
7
29
null
null
0
3
3
3
0
3
15
7
29
0
41
0
3
3
634
DP-593
-5.96
-9.041537325
3.929191851
76.36797132
72.21470962
9.882894548
82.70051621
0.0
0.0
67.12352058
0.0
0.0
0.0
145.4514176
150.8935818
203.7105511
52.62178271
null
-5.96
null
null
null
null
null
null
null
null
null
null
6
CC(C)C[C@@H]1NC(=O)[C@H](CCCCN(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)CN(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC1=O
246.9804761
82.70051621
0.0
76.36797132
23.57583074
242.7004292
81.31508672
107.3266351
0
0.0
null
null
null
null
['Sar', 'F', 'meL', 'meL', 'F', 'meL', 'A', 'P', 'Lys(Me2)', 'L', 'D', 'meF', 'A', '-pip']
[-0.2531000000000001, 1.0159999999999998, 1.1616, 1.1616, 1.0159999999999998, 1.1616, -0.2068000000000003, 0.2794999999999998, 0.5051999999999996, 0.8193999999999995, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 29.1, 20.31, 20.31, 29.1, 20.31, 29.1, 20.31, 32.34, 29.1, 46.17, 20.31, 29.1, 3.24]
37.16869347
0.0
0.0
0.0
275.4295904
86.24229528
23.57583074
338.0313603
90.63628061
9.882894548
0.0
0
2013_CHUGAI
588
null
349.11
null
1206.371384
0.0
222.7425331
-23.6649731
-10.35204214
-102.9545259
-135.6372029
-110.5766929
-142.0951465
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
0
0
0
0
0
14
14
0
0
0
8
7
0
0
5
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.061710908
null
97d9a26807b2d6115b2c74963d69750997ec6e375a58c0f808c486b269a0ffd5
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
588
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Sar', 'F', 'meL', 'meL', 'F', 'meL', 'L', 'meF', 'Lys(Me2)', 'L', 'D', 'meF', 'A', '-pip']
92
589
-5.89
-5.89
Lariat
8
-3.48e-16
-2.756685718
-2.59e-16
-2.889014898
-1.27e-16
-1.136007229
1.19e-15
-0.249287767
2.853096587
10813.34442
248.0
null
null
213.5995643
200.42368
59.42368
113.9623834
100.4852915
30.35479635
20.24353644
20.24353644
11.958937
11.958937
7.16694793
7.16694793
null
null
null
null
662.9868313
97.61144214
67.12352058
0
0
0
0
0
0
0.0
95.95309893
1704.078244
0.487804878
0.926829268
1.43902439
0.595744681
243.0
PEPTIDE589{[Sar].F.[meL].[meL].F.[meL].L.[meF].[Lys(Me2)].L.D.[meF].A.[-pip]}$PEPTIDE589,PEPTIDE589,1:R1-11:R3$$$
PEPTIDE589{<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/Lys(Me2)/">[Lys(Me2)]</a>.<a...
-10.58
123
1563.125
589
null
null
1.7799999999999997e+107
20.89862172
49.64581067
31.92344906
927.8332224
null
18.54644869
0.342781817
18.54644869
0.245620449
2.206998846
0.245620449
-8.664904368
-0.342781817
6.3427
474.9279
1705.253
Lariat
14
11
null
7
29
null
null
0
2
2
4
0
4
15
7
29
0
47
0
2
2
676
DP-594
-5.89
-10.71450263
5.840965916
76.36797132
72.21470962
9.882894548
82.70051621
0.0
0.0
67.12352058
0.0
0.0
0.0
189.3672953
149.1261739
217.416236
59.4755755
null
-5.89
null
null
null
null
null
null
null
null
null
null
6
CC(C)C[C@@H]1NC(=O)[C@H](CCCCN(C)C)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)CN(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC1=O
260.6880617
82.70051621
0.0
76.36797132
29.46978843
249.5523213
81.79405394
143.1021801
0
0.0
null
null
null
null
['Sar', 'F', 'meL', 'meL', 'F', 'meL', 'L', 'meF', 'Lys(Me2)', 'L', 'D', 'meF', 'A', '-pip']
[-0.2531000000000001, 1.0159999999999998, 1.1616, 1.1616, 1.0159999999999998, 1.1616, 0.8193999999999995, 1.3581999999999996, 0.5051999999999996, 0.8193999999999995, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 29.1, 20.31, 20.31, 29.1, 20.31, 29.1, 20.31, 32.34, 29.1, 46.17, 20.31, 29.1, 3.24]
37.16869347
0.0
0.0
0.0
275.9085576
92.61522018
29.46978843
357.7813646
120.8483742
9.882894548
0.0
0
2013_CHUGAI
589
null
349.11
null
1314.15378
0.0
227.351512
-24.92542212
-14.37335541
-113.8331488
-155.4122477
-114.8871267
-151.7406576
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
0
0
0
0
0
14
14
0
0
0
8
7
0
0
6
1
0
0
0
0
0
0
14
0
0
0
0
0
0
4
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.030499719
null
e3791a07581ea0c5ff74b216e27785339c2a7f5b0e9473eb4b6538ae43dac9ce
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
589
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Sar', 'F', 'meL', 'meA', 'F', 'meL', 'L', 'P', 'E', 'L', 'D', 'meF', 'A', '-pip']
83
590
-5.31
-5.31
Lariat
1
-2.15e-16
-2.7566841
-1.38e-16
-2.882606951
-4.02e-17
-1.135666162
2.11e-15
-0.249287767
2.632782457
9511.260345
256.0
null
null
189.8425694
176.292963
54.29296298
101.6523119
88.3809677
27.84222424
18.69558372
18.69558372
11.19259737
11.19259737
6.693932673
6.693932673
null
null
null
null
588.2344265
84.5861181
67.12352058
0
0
0
0
0
0
5.108808191
87.7889887
1570.916324
0.592920354
1.132743363
1.699115044
0.602409639
262.0
PEPTIDE590{[Sar].F.[meL].[meA].F.[meL].L.P.E.L.D.[meF].A.[-pip]}$PEPTIDE590,PEPTIDE590,1:R1-11:R3$$$
PEPTIDE590{<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/E/">E</a>.<a href="/monomers/L/">L...
-10.29
113
1448.995
590
null
null
9.800000000000001e+93
20.13632603
43.6620981
27.22905593
836.5337394
null
18.14562065
0.481229262
18.14562065
0.302935673
2.128275051
0.302935673
-8.381399797
-0.481229262
3.3707
423.6427
1571.971
Lariat
14
11
null
8
30
null
null
0
3
3
3
0
3
16
8
30
0
37
0
3
3
620
DP-595
-5.31
-8.967327647
2.859474181
76.57686978
72.21470962
9.882894548
82.70051621
1.431199657
5.969305288
71.91805776
0.0
0.0
0.0
145.4514176
117.6992185
196.3758904
52.62178271
null
-5.31
null
null
null
null
null
null
null
null
null
null
6
CC(C)C[C@@H]1NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)CN(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC1=O
243.1762359
88.6698215
1.431199657
71.46806159
23.57583074
236.3275043
60.86657324
107.3266351
0
0.0
null
null
null
null
['Sar', 'F', 'meL', 'meA', 'F', 'meL', 'L', 'P', 'E', 'L', 'D', 'meF', 'A', '-pip']
[-0.2531000000000001, 1.0159999999999998, 1.1616, 0.1353999999999999, 1.0159999999999998, 1.1616, 0.8193999999999995, 0.2794999999999998, -0.2476000000000005, 0.8193999999999995, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 29.1, 20.31, 20.31, 29.1, 20.31, 29.1, 20.31, 46.17, 29.1, 46.17, 20.31, 29.1, 3.24]
37.16869347
0.0
0.0
0.0
261.1592807
91.03683247
23.57583074
317.9508499
90.63628061
9.882894548
1.431199657
0
2013_CHUGAI
590
null
383.17
null
1119.289065
0.0
237.2998855
-19.86798996
-10.07472255
-105.1371098
-132.9996047
-101.4491578
-123.0603654
0.0
1.0
2013
null
null
null
null
null
null
1
0
0
0
0
0
0
0
1
1
15
14
0
0
0
7
7
0
0
5
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.071474379
null
9069736673223d9d18898606077e16ca4ecdb24019e5e1305762612a3fe0eae7
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
590
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Sar', 'F', 'meL', 'meL', 'F', 'meL', 'L', 'meF', 'E', 'L', 'D', 'meF', 'A', '-pip']
85
591
-5.49
-5.49
Lariat
2
-2.1e-16
-2.756684345
-1.71e-16
-2.888303165
-9.38e-18
-1.136007229
2.18e-15
-0.249287767
2.783099919
10415.79553
323.0
null
null
204.306671
190.292963
58.29296298
109.5777384
95.3809677
29.84222424
19.95878032
19.95878032
11.83079398
11.83079398
7.102876418
7.102876418
null
null
null
null
637.2347885
96.9229451
67.12352058
0
0
0
0
0
0
5.108808191
89.15974725
1676.994574
0.512396694
0.94214876
1.446280992
0.571428571
319.0
PEPTIDE591{[Sar].F.[meL].[meL].F.[meL].L.[meF].E.L.D.[meF].A.[-pip]}$PEPTIDE591,PEPTIDE591,1:R1-11:R3$$$
PEPTIDE591{<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/E/">E</a>.<a href="/monomers...
-11.07
121
1545.083
591
null
null
2.9e+101
21.39259762
47.80020319
30.54533881
899.376254
null
18.43389309
0.481229262
18.43389309
0.302935673
2.170458736
0.302935673
-8.527157348
-0.481229262
5.4756
459.3927
1678.139
Lariat
14
11
null
8
30
null
null
0
2
2
4
0
4
16
8
30
0
43
0
2
2
662
DP-596
-5.49
-10.66382999
4.811541025
76.57686978
72.21470962
9.882894548
82.70051621
1.431199657
5.969305288
71.91805776
0.0
0.0
0.0
189.3672953
115.9318106
210.0815753
59.4755755
null
-5.49
null
null
null
null
null
null
null
null
null
null
6
CC(C)C[C@@H]1NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)CN(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC1=O
256.8838215
88.6698215
1.431199657
71.46806159
29.46978843
243.1793964
61.34554045
143.1021801
0
0.0
null
null
null
null
['Sar', 'F', 'meL', 'meL', 'F', 'meL', 'L', 'meF', 'E', 'L', 'D', 'meF', 'A', '-pip']
[-0.2531000000000001, 1.0159999999999998, 1.1616, 1.1616, 1.0159999999999998, 1.1616, 0.8193999999999995, 1.3581999999999996, -0.2476000000000005, 0.8193999999999995, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 29.1, 20.31, 20.31, 29.1, 20.31, 29.1, 20.31, 46.17, 29.1, 46.17, 20.31, 29.1, 3.24]
37.16869347
0.0
0.0
0.0
261.6382479
97.40975737
29.46978843
337.7008541
120.8483742
9.882894548
1.431199657
0
2013_CHUGAI
591
null
383.17
null
1226.131123
0.0
242.1208797
-20.91513044
-14.09899435
-116.1891531
-152.6602954
-105.4223695
-132.46606
0.0
1.0
2013
null
null
null
null
null
null
1
0
0
0
0
0
0
0
1
1
15
14
0
0
0
7
7
0
0
6
1
0
0
0
0
0
0
14
0
0
0
0
0
0
4
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.03859279
null
782ee75e3c745cc2fec06fbc81762aa8a1e01b1afd42120eb73b21c57e4b2512
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
591
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Sar', 'F', 'meL', 'Sar', 'F', 'meL', 'L', 'P', 'Arg(Me,Me)', 'L', 'D', 'meF', 'A', '-pip']
92
592
-5.77
-5.77
Lariat
6
-2.21e-16
-2.756684482
-1.95e-16
-2.884392927
-5.64e-17
-1.135666194
2.48e-15
-0.249287767
2.67761632
9905.308207
304.0
null
null
197.99727
184.8181072
55.81810719
105.8314506
92.5505391
28.52561674
18.91853644
18.91853644
11.28360257
11.28360257
6.745079863
6.745079863
null
null
null
null
612.919891
82.53309803
67.12352058
0
0
0
0
0
0
4.992404733
94.66450742
1611.990492
0.594827586
1.137931034
1.698275862
0.611764706
296.0
PEPTIDE592{[Sar].F.[meL].[Sar].F.[meL].L.P.[Arg(Me,Me)].L.D.[meF].A.[-pip]}$PEPTIDE592,PEPTIDE592,1:R1-11:R3$$$
PEPTIDE592{<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/Arg(Me,Me)/">[Arg(Me,Me)]</a>.<a h...
-10.49
116
1483.04
592
null
null
2.2e+98
20.08917107
46.30264732
28.74954051
866.1671512
null
18.311032
0.35949118
18.311032
0.245620449
1.799658393
0.245620449
-8.488839671
-0.35949118
2.6924
441.8333
1613.072
Lariat
14
11
null
9
31
null
null
0
3
3
3
0
3
15
9
31
0
39
0
3
3
638
DP-597
-5.77
-9.582115128
5.067133691
82.0876883
66.19681715
18.66613327
82.70051621
0.0
0.0
72.11592531
0.0
0.0
0.0
145.4514176
117.2202512
217.3052718
60.48940096
null
-5.77
null
null
null
null
null
null
null
null
null
null
6
C/N=C(\NC)NCCC[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](Cc2ccccc2)NC(=O)CN(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)CN(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H](CC(C)C)NC1=O
244.321126
88.66007078
0.0
82.0876883
28.56823547
223.4577197
87.81194641
107.3266351
0
0.0
null
null
null
null
['Sar', 'F', 'meL', 'Sar', 'F', 'meL', 'L', 'P', 'Arg(Me,Me)', 'L', 'D', 'meF', 'A', '-pip']
[-0.2531000000000001, 1.0159999999999998, 1.1616, -0.2531000000000001, 1.0159999999999998, 1.1616, 0.8193999999999995, 0.2794999999999998, -0.6516999999999995, 0.8193999999999995, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 29.1, 20.31, 20.31, 29.1, 20.31, 29.1, 20.31, 65.52, 29.1, 46.17, 20.31, 29.1, 3.24]
47.78832018
0.0
0.0
0.0
276.9682025
86.24229528
23.57583074
319.3235091
95.62868535
12.7065787
0.0
0
2013_CHUGAI
592
null
382.29
null
1184.144295
0.0
226.6586508
-27.59509858
-10.082449
-105.0693496
-126.3385191
-103.1526294
-140.5649002
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
0
0
0
0
0
14
14
0
0
1
8
9
0
0
5
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
1
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.037434487
null
e0490865fb6da7b0e4bccbdedc564aac30f0c40ece128363c25db020779af73b
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
592
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Sar', 'F', 'meL', 'meL', 'F', 'meL', 'L', 'meF', 'Arg(Me,Me)', 'L', 'D', 'meF', 'A', '-pip']
94
593
-7.0
-7
Lariat
8
-2.94e-16
-2.756684767
-2.22e-16
-2.890532223
-6.42e-17
-1.136007229
1.81e-15
-0.249287767
2.857819845
10940.22107
309.0
null
null
214.9613716
201.3181072
60.31810719
115.0068771
100.8005391
30.77561674
20.41853644
20.41853644
12.1405353
12.1405353
7.232747081
7.232747081
null
Although it was not mentioned in the text, it may be -7 (by CycPeptMPDB)
null
null
668.293178
97.61144214
67.12352058
0
0
0
0
0
0
4.992404733
96.03526598
1732.084392
0.528
0.984
1.504
0.585106383
283.0
PEPTIDE593{[Sar].F.[meL].[meL].F.[meL].L.[meF].[Arg(Me,Me)].L.D.[meF].A.[-pip]}$PEPTIDE593,PEPTIDE593,1:R1-11:R3$$$
PEPTIDE593{<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/Arg(Me,Me)/">[Arg(Me,Me)]</a...
-11.27
125
1591.139
593
null
null
9.32e+107
21.42445693
50.62343427
32.03108608
938.1845489
null
18.57486976
0.35949118
18.57486976
0.245620449
1.876023434
0.245620449
-8.661875868
-0.35949118
5.1858
482.1783
1733.267
Lariat
14
11
null
9
31
null
null
0
2
2
4
0
4
15
9
31
0
46
0
2
2
686
DP-598
-7.0
-11.49548305
6.91038972
82.0876883
72.21470962
18.66613327
82.70051621
0.0
0.0
72.11592531
0.0
0.0
0.0
189.3672953
122.3047355
235.1232324
59.4755755
null
-7.0
null
null
null
null
null
null
null
null
null
null
6
C/N=C(\NC)NCCC[C@@H]1NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)CN(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC(=O)[C@H](CC(C)C)NC1=O
260.7702287
88.66007078
0.0
82.0876883
34.46219316
243.1793964
81.79405394
143.1021801
0
0.0
null
null
null
null
['Sar', 'F', 'meL', 'meL', 'F', 'meL', 'L', 'meF', 'Arg(Me,Me)', 'L', 'D', 'meF', 'A', '-pip']
[-0.2531000000000001, 1.0159999999999998, 1.1616, 1.1616, 1.0159999999999998, 1.1616, 0.8193999999999995, 1.3581999999999996, -0.6516999999999995, 0.8193999999999995, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 29.1, 20.31, 20.31, 29.1, 20.31, 29.1, 20.31, 65.52, 29.1, 46.17, 20.31, 29.1, 3.24]
47.78832018
0.0
0.0
0.0
276.9682025
92.61522018
29.46978843
348.6669226
125.8407789
12.7065787
0.0
0
2013_CHUGAI
593
null
382.29
null
1313.87767
0.0
232.3264805
-29.10351208
-14.36648264
-117.169563
-155.3259522
-107.6314961
-150.8571446
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
0
0
0
0
0
14
14
0
0
1
8
9
0
0
6
1
0
0
0
0
0
0
14
0
0
0
0
0
0
4
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.021075379
null
3a137b0bb0b9162ecd0b5628651b6ba5b00fb62b98cf113ee563ff1842b4fd52
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
593
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['meA', 'F', 'meL', 'meA', 'F', 'meL', 'A', 'P', '3Pal', 'L', 'D', 'meF', 'A', '-pip']
86
594
-4.55
-4.55
Lariat
6
-1.94e-16
-2.756685163
-1.24e-16
-2.883830655
-2.43e-18
-1.135217177
3.25e-15
-0.249287763
2.316987327
9637.46848
258.0
null
null
186.6519705
173.42368
54.42368
100.6688376
87.26168472
28.13118955
18.98033983
18.98033983
11.59537823
11.59537823
6.87041299
6.87041299
null
null
null
null
593.1404258
67.45475391
67.12352058
0
0
0
0
0
0
4.983978521
95.95309893
1561.906093
0.557522124
1.088495575
1.654867257
0.55952381
258.0
PEPTIDE594{[meA].F.[meL].[meA].F.[meL].A.P.[3Pal].L.D.[meF].A.[-pip]}$PEPTIDE594,PEPTIDE594,1:R1-11:R3$$$
PEPTIDE594{<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/A/">A</a>.<a href="/monomers/P/">P</a>.<a href="/monomers/3Pal/">[3Pal]</a>.<a href="/monome...
-10.61
113
1443.015
594
null
null
1.38e+92
20.35659169
42.3184642
25.19264446
832.0933756
null
18.29050595
0.342791866
18.29050595
0.24562045
2.113152575
0.24562045
-8.404156197
-0.342791866
3.5059
425.5279
1562.967
Lariat
14
11
null
7
29
null
null
0
3
3
3
1
4
15
7
29
0
34
0
3
3
614
DP-599
-4.55
-7.554668292
5.368714761
71.46806159
78.23260209
9.882894548
82.70051621
0.0
0.0
72.1074991
0.0
0.0
0.0
137.790052
124.3690654
201.8678881
50.2371987
null
-4.55
null
null
null
null
null
null
null
null
null
null
7
CC(C)C[C@@H]1NC(=O)[C@H](Cc2cccnc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](C)N(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC1=O
230.5313734
82.70051621
0.0
76.45204011
17.68187306
229.599547
54.36971355
137.3207144
0
0.0
null
null
null
null
['meA', 'F', 'meL', 'meA', 'F', 'meL', 'A', 'P', '3Pal', 'L', 'D', 'meF', 'A', '-pip']
[0.1353999999999999, 1.0159999999999998, 1.1616, 0.1353999999999999, 1.0159999999999998, 1.1616, -0.2068000000000003, 0.2794999999999998, 0.4109999999999996, 0.8193999999999995, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 29.1, 20.31, 20.31, 29.1, 20.31, 29.1, 20.31, 41.99, 29.1, 46.17, 20.31, 29.1, 3.24]
37.16869347
0.0
0.0
0.0
254.5861785
92.61522018
17.68187306
301.6540095
115.0669085
9.882894548
0.0
0
2013_CHUGAI
594
null
358.76
null
1096.507027
0.0
226.4003828
-22.26299591
-13.2494144
-92.56531866
-143.7020921
-91.02930309
-115.6816189
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
1
0
0
0
0
14
14
0
0
0
8
7
0
0
5
1
0
0
0
0
0
0
14
0
0
0
0
0
0
3
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0.070645095
null
c51c8ae2b29113a0c018576c530841a8029b2d2b3c9c55efb8272b65ed9a17d1
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
594
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Sar', 'F', 'meL', 'meL', 'F', 'meL', 'L', 'meF', '3Pal', 'L', 'D', 'meF', 'A', '-pip']
88
595
-7.0
-7
Lariat
8
-2.75e-16
-2.756684064
-1.44e-16
-2.889210915
6.96e-17
-1.136007229
2.5e-15
-0.249287767
2.477967746
10781.57388
271.0
null
null
206.1160721
192.42368
59.42368
111.0942641
96.76168472
30.63118955
20.50673304
20.50673304
12.2582404
12.2582404
7.400452179
7.400452179
null
Although it was not mentioned in the text, it may be -7 (by CycPeptMPDB)
null
null
654.8866377
93.49916647
67.12352058
0
0
0
0
0
0
4.983978521
89.09930615
1696.015644
0.487804878
0.918699187
1.447154472
0.542553191
275.0
PEPTIDE595{[Sar].F.[meL].[meL].F.[meL].L.[meF].[3Pal].L.D.[meF].A.[-pip]}$PEPTIDE595,PEPTIDE595,1:R1-11:R3$$$
PEPTIDE595{<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/3Pal/">[3Pal]</a>.<a href="/...
-11.39
123
1563.125
595
null
null
7.83e+102
21.74178014
47.87321774
29.9822191
913.2856564
null
18.46675088
0.342781817
18.46675088
0.245620449
2.158784232
0.245620449
-8.50032502
-0.342781817
6.2485
470.4639
1697.189
Lariat
14
11
null
7
29
null
null
0
2
2
4
1
5
15
7
29
0
42
0
2
2
668
DP-600
-7.0
-9.675023977
7.593632946
71.46806159
72.21470962
9.882894548
82.70051621
0.0
0.0
72.1074991
0.0
0.0
0.0
195.409714
121.1647559
219.6858486
64.95860972
null
-7.0
null
null
null
null
null
null
null
null
null
null
7
CC(C)C[C@@H]1NC(=O)[C@H](Cc2cccnc2)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)CN(C)C(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC1=O
249.7219932
82.70051621
0.0
76.45204011
29.46978843
236.8064715
61.34554045
173.0962594
0
0.0
null
null
null
null
['Sar', 'F', 'meL', 'meL', 'F', 'meL', 'L', 'meF', '3Pal', 'L', 'D', 'meF', 'A', '-pip']
[-0.2531000000000001, 1.0159999999999998, 1.1616, 1.1616, 1.0159999999999998, 1.1616, 0.8193999999999995, 1.3581999999999996, 0.4109999999999996, 0.8193999999999995, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[20.31, 29.1, 20.31, 20.31, 29.1, 20.31, 29.1, 20.31, 41.99, 29.1, 46.17, 20.31, 29.1, 3.24]
37.16869347
0.0
0.0
0.0
255.5441129
98.98814508
29.46978843
333.2599729
145.279002
9.882894548
0.0
0
2013_CHUGAI
595
null
358.76
null
1243.514232
0.0
231.9468983
-23.79348037
-17.49847932
-111.4208077
-157.6300976
-103.4576871
-132.2439117
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
1
0
0
0
0
14
14
0
0
0
8
7
0
0
6
1
0
0
0
0
0
0
14
0
0
0
0
0
0
4
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0.033956106
null
13ab8f9d6821da6ea19616634aca1a47130d030b1d18228b5b886cfc6814d93b
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
595
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['A', 'F', 'meL', 'Met(O2)', 'meF', 'L', 'meL', 'meL', 'L', 'D', 'meF', 'A', '-pip']
84
596
-5.92
-5.92
Lariat
8
-2.79e-16
-2.756684294
-1.78e-16
-2.885113984
-5.11e-17
-1.136361868
1.38e-15
-0.24928777
3.171119108
9568.391082
291.0
null
null
191.4034118
178.3457494
54.16224597
101.6442225
89.18110821
28.53377629
18.27445554
19.48545326
10.69768817
11.06847898
6.396478072
6.627517024
null
null
null
null
587.0423386
81.16233947
70.74678038
0
0
0
0
0
0
0.0
90.47006471
1563.913881
0.54954955
1.009009009
1.540540541
0.62195122
286.0
PEPTIDE596{A.F.[meL].[Met(O2)].[meF].L.[meL].[meL].L.D.[meF].A.[-pip]}$PEPTIDE596,PEPTIDE596,1:R1-10:R3$$$
PEPTIDE596{<a href="/monomers/A/">A</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Met(O2)/">[Met(O2)]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/...
-9.28
111
1439.045
596
null
null
8.370000000000001e+93
19.3850667
43.51055157
28.76723828
833.0511565
null
18.40985803
0.344513263
18.40985803
0.245620312
2.160079996
0.245620312
-8.770273166
-0.344513263
4.3643
424.7417
1565.045
Lariat
13
10
null
7
28
null
null
0
2
2
3
0
3
15
7
29
0
42
0
2
2
614
DP-607
-5.92
-9.527058214
4.011068569
66.56815186
82.05196276
9.882894548
76.79333648
0.0
0.0
62.32898339
8.417796984
0.0
0.0
159.1552018
117.2202512
197.9145813
49.0883628
null
-5.92
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](CC(C)C)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](C)NC(=O)C[C@@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)NC1=O
242.3791846
86.63058962
0.0
66.56815186
29.46978843
237.2854387
59.76173486
107.3266351
0
0.0
null
null
null
null
['A', 'F', 'meL', 'Met(O2)', 'meF', 'L', 'meL', 'meL', 'L', 'D', 'meF', 'A', '-pip']
[-0.2068000000000003, 1.0159999999999998, 1.1616, -0.792, 1.3581999999999996, 0.8193999999999995, 1.1616, 1.1616, 0.8193999999999995, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[29.1, 29.1, 20.31, 63.24, 20.31, 29.1, 20.31, 20.31, 29.1, 46.17, 20.31, 29.1, 3.24]
37.16869347
0.0
0.0
0.0
246.5870363
91.28501123
29.46978843
324.3918185
90.63628061
9.882894548
0.0
0
2013_CHUGAI
596
null
359.7
null
1180.491247
0.0
211.0868654
-24.31210261
-17.74407692
-107.1188616
-138.074294
-98.07010994
-125.1550609
-8.770273166
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
0
0
0
0
0
13
13
0
0
0
6
7
0
0
5
1
0
0
0
0
0
0
13
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0.065501737
null
3cb3052b5814409e7a1797e674d7941d45b29b32acaa667a08b83786fc8b0c20
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
596
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'meA', 'meL', 'L', 'meF', 'F', 'meL', 'Sar', 'meL', 'Q', 'D', '-pip']
76
597
-4.54
-4.54
Lariat
9
-2.72e-16
-2.757056647
-2.13e-16
-2.883010661
-1.29e-16
-1.135687074
9.54e-16
-0.249287767
3.59200845
8099.309684
246.0
null
null
171.4393102
160.1210045
47.12100452
90.71879599
79.93952658
23.80903142
16.07034988
16.07034988
9.510413085
9.510413085
5.608151996
5.608151996
null
null
null
null
517.7527441
65.31333127
57.53444621
0
0
0
0
0
0
0.0
94.66450742
1367.858081
0.56122449
1.071428571
1.62244898
0.652777778
244.0
PEPTIDE597{[dV].[meA].[meL].L.[meF].F.[meL].[Sar].[meL].Q.D.[-pip]}$PEPTIDE597,PEPTIDE597,1:R1-11:R3$$$
PEPTIDE597{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meL/">[meL]</a>.<a href=...
-8.45
98
1254.87
597
null
null
4.47e+80
16.61910987
38.63148495
24.22113675
739.0492494
null
17.9684864
0.369678619
17.9684864
0.245417271
2.138993343
0.245417271
-8.074176888
-0.369678619
3.0312
372.1809
1368.774
Lariat
12
11
null
7
26
null
null
0
2
2
2
0
2
13
6
26
0
34
0
2
2
544
DP-617
-4.54
-6.503233871
3.208427125
66.56815186
60.17892468
9.882894548
76.79333648
0.0
0.0
62.32898339
0.0
0.0
0.0
128.9431082
98.43198274
189.1111742
43.02647282
null
-4.54
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)N(C)C(=O)[C@@H](C(C)C)NC(=O)C[C@@H](C(=O)N2CCCCC2)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)N(C)C1=O
217.5122849
76.79333648
0.0
60.84843488
35.1895054
212.0248368
61.34554045
71.55109006
0
0.0
null
null
null
null
['dV', 'meA', 'meL', 'L', 'meF', 'F', 'meL', 'Sar', 'meL', 'Q', 'D', '-pip']
[0.4292999999999995, 0.1353999999999999, 1.1616, 0.8193999999999995, 1.3581999999999996, 1.0159999999999998, 1.1616, -0.2531000000000001, 1.1616, -0.9612, -0.6377000000000004, 1.1021]
[29.1, 20.31, 20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 20.31, 72.19, 46.17, 3.24]
32.26878374
0.0
0.0
0.0
232.6171697
75.0748332
29.46978843
295.5273722
60.42418708
9.882894548
0.0
0
2013_CHUGAI
597
null
330.76
null
1027.85522
0.0
201.1239981
-16.81149927
-8.97005621
-102.25901
-105.6121004
-82.2311169
-130.6787685
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
0
0
0
0
0
13
13
0
0
0
7
5
1
0
6
1
0
0
0
0
0
0
13
0
0
0
0
0
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
1
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0.132884314
null
2781a925164b7fd7df7df168acf488ebca68f7ad7bca6cbf4ba71b73646aa9c2
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
598
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'meA', 'meL', 'L', 'meF', 'Tyr(3-F)', 'meL', 'meA', 'meA', 'T', 'D', '-pip']
83
599
-4.92
-4.92
Lariat
1
-2.24e-16
-2.75694596
-1.79e-16
-2.892420949
2.08e-18
-1.135684771
1.75e-15
-0.249287767
3.522004273
7736.101376
255.0
null
null
164.6988233
152.9600037
45.96000369
87.46340168
76.28109556
23.228531
15.97423124
15.97423124
9.648118396
9.648118396
5.562765589
5.562765589
null
null
null
null
493.0479532
49.55272563
61.92486126
0
0
0
0
0
0
10.21761638
97.44473969
1346.801374
0.583333333
1.145833333
1.739583333
0.652173913
248.0
PEPTIDE599{[dV].[meA].[meL].L.[meF].[Tyr(3-F)].[meL].[meA].[meA].T.D.[-pip]}$PEPTIDE599,PEPTIDE599,1:R1-11:R3$$$
PEPTIDE599{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/Tyr(3-F)/">[Tyr(3-F)]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meA/">[m...
-8.23
96
1239.827
599
null
null
2.0499999999999998e+77
16.89524392
36.21099906
21.63860582
715.8344175
null
17.91781231
0.504880839
17.91781231
0.293254678
2.284844486
0.293254678
-8.046358687
-0.504880839
2.3535
357.8701
1347.683
Lariat
12
11
null
7
26
null
null
0
2
2
2
0
2
14
7
27
0
33
0
2
2
534
DP-619
-4.92
-7.389065663
1.864581277
71.06605126
66.19681715
18.62594307
72.31735641
1.431199657
0.0
57.53444621
4.390415048
0.0
0.0
91.06964918
112.432689
177.2552151
39.86811405
null
-4.92
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)N(C)C(=O)[C@@H](C(C)C)NC(=O)C[C@@H](C(=O)N2CCCCC2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccc(O)c(F)c2)NC(=O)[C@H](Cc2ccccc2)N(C)C1=O
216.2775436
70.88615675
2.862399314
60.84843488
23.57583074
211.8558647
54.84868077
65.28347349
0
5.749511833
[['Caco2']]
[1938]
[['-7.54']]
['2018_CHUGAI']
['dV', 'meA', 'meL', 'L', 'meF', 'Tyr(3-F)', 'meL', 'meA', 'meA', 'T', 'D', '-pip']
[0.4292999999999995, 0.1353999999999999, 1.1616, 0.8193999999999995, 1.3581999999999996, 0.8606999999999996, 1.1616, 0.1353999999999999, 0.1353999999999999, -0.1918000000000002, -0.6377000000000004, 1.1021]
[29.1, 20.31, 20.31, 29.1, 20.31, 49.33, 20.31, 20.31, 20.31, 38.33, 46.17, 3.24]
26.54906677
4.390415048
5.749511833
0.0
245.3910565
70.28029601
29.39305158
275.0359383
48.33934966
7.059210392
0.0
0
2013_CHUGAI
599
null
328.13
null
985.4196752
0.0
184.9972579
-8.917131037
-7.009065133
-96.13679269
-107.4689968
-67.38831422
-129.2466332
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
1
0
0
12
12
0
0
0
7
5
0
0
6
1
0
0
0
0
0
0
12
0
0
0
0
0
0
2
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
1
0
0
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.151532342
null
c479a06bc473e511988e46ec541bdcadffd08032902b2e59ef2c9b03bea49a44
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
599
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'meA', 'meL', 'L', 'meF', 'F', 'meL', 'meA', 'meL', 'Met(O2)', 'D', '-pip']
82
600
-4.62
-4.62
Lariat
8
-2.79e-16
-2.7570815
-2.42e-16
-2.886182524
-6.09e-17
-1.135687068
8e-16
-0.249287767
3.663390112
8449.707429
230.0
null
null
175.7846097
163.9902875
48.80678408
92.61473671
81.85895007
25.60604534
16.48249958
17.6934973
9.74511189
10.1159027
5.717678577
5.948717529
null
null
null
null
527.8519815
67.56583251
57.53444621
0
0
0
0
0
0
0.0
100.0653746
1416.845467
0.52
0.97
1.47
0.671232877
232.0
PEPTIDE600{[dV].[meA].[meL].L.[meF].F.[meL].[meA].[meL].[Met(O2)].D.[-pip]}$PEPTIDE600,PEPTIDE600,1:R1-11:R3$$$
PEPTIDE600{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href=...
-7.97
100
1300.94
600
null
null
3.9099999999999996e+83
17.12419283
38.72684052
24.68362201
756.6369754
null
18.1070425
0.343971318
18.1070425
0.245417272
2.320826675
0.245417272
-8.653524905
-0.343971318
3.5889
382.6753
1417.868
Lariat
12
11
null
5
26
null
null
0
2
2
2
0
2
14
5
27
0
36
0
2
2
558
DP-620
-4.62
-7.872617719
2.544166078
60.84843488
76.03407029
7.059210392
70.88615675
0.0
0.0
57.53444621
8.417796984
0.0
0.0
128.9431082
105.2838749
197.1467247
40.86381147
null
-4.62
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)N(C)C(=O)[C@@H](C(C)C)NC(=O)C[C@@H](C(=O)N2CCCCC2)NC(=O)[C@H](CCS(C)(=O)=O)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)N(C)C1=O
225.1656533
80.72340989
0.0
60.84843488
29.46978843
218.5216965
66.73756176
71.55109006
0
0.0
null
null
null
null
['dV', 'meA', 'meL', 'L', 'meF', 'F', 'meL', 'meA', 'meL', 'Met(O2)', 'D', '-pip']
[0.4292999999999995, 0.1353999999999999, 1.1616, 0.8193999999999995, 1.3581999999999996, 1.0159999999999998, 1.1616, 0.1353999999999999, 1.1616, -0.792, -0.6377000000000004, 1.1021]
[29.1, 20.31, 20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 20.31, 63.24, 46.17, 3.24]
26.54906677
0.0
0.0
0.0
246.5377008
80.11754915
29.46978843
302.8601322
60.42418708
7.059210392
0.0
0
2013_CHUGAI
600
null
321.81
null
1087.150456
0.0
187.7886836
-17.34023069
-14.13903606
-100.2105885
-115.3122938
-83.16785529
-131.9489436
-8.653524905
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
0
0
0
0
0
12
12
0
0
0
7
5
0
0
6
1
0
0
0
0
0
0
12
0
0
0
0
0
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
1
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0.151268101
null
24e4f3ddb8fb25e19fda72ee1a432a5d49f85576d6b3ab7b2dc4458fd455e33c
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
600
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'meA', 'meL', 'Met(O2)', 'meF', 'F', 'meL', 'meF', 'meL', 'T', 'D', '-pip']
82
601
-4.68
-4.68
Lariat
1
-2.83e-16
-2.757036276
-1.73e-16
-2.896290957
-1.6e-17
-1.135221722
1.63e-15
-0.249287763
3.144695644
8915.458758
266.0
null
null
178.9558181
166.3985358
51.21503237
95.35082336
83.22132251
27.06016949
17.43662372
18.64762144
10.46018817
10.83097898
6.206023524
6.437062477
null
null
null
null
550.1098026
72.85562109
65.95224319
0
0
0
0
0
0
5.108808191
86.41823014
1480.840382
0.533333333
1.0
1.514285714
0.61038961
263.0
PEPTIDE601{[dV].[meA].[meL].[Met(O2)].[meF].F.[meL].[meF].[meL].T.D.[-pip]}$PEPTIDE601,PEPTIDE601,1:R1-11:R3$$$
PEPTIDE601{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Met(O2)/">[Met(O2)]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meL/">[meL...
-8.79
105
1364.983
601
null
null
9.72e+85
18.65665546
40.07592193
25.19087543
783.8450894
null
18.50163544
0.390716897
18.50163544
0.245632016
2.34790554
0.245632016
-8.710976961
-0.390716897
3.1464
399.3731
1481.911
Lariat
12
11
null
6
27
null
null
0
2
2
3
0
3
15
6
28
0
36
0
2
2
580
DP-621
-4.68
-8.720268897
4.50628889
65.95724307
76.03407029
7.059210392
72.31735641
0.0
0.0
57.53444621
8.417796984
0.0
0.0
145.4514176
98.58044376
193.9243397
55.16838083
null
-4.68
null
null
null
null
null
null
null
null
null
null
5
CC(C)C[C@H]1C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](C(=O)N2CCCCC2)CC(=O)N[C@H](C(C)C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)N1C
228.903703
80.72340989
1.431199657
60.84843488
23.57583074
210.8979303
66.73756176
107.3266351
0
0.0
null
null
null
null
['dV', 'meA', 'meL', 'Met(O2)', 'meF', 'F', 'meL', 'meF', 'meL', 'T', 'D', '-pip']
[0.4292999999999995, 0.1353999999999999, 1.1616, -0.792, 1.3581999999999996, 1.0159999999999998, 1.1616, 1.3581999999999996, 1.1616, -0.1918000000000002, -0.6377000000000004, 1.1021]
[29.1, 20.31, 20.31, 63.24, 20.31, 29.1, 20.31, 20.31, 20.31, 38.33, 46.17, 3.24]
26.54906677
0.0
0.0
0.0
259.1577266
86.49047405
23.57583074
286.976116
90.63628061
7.059210392
0.0
0
2013_CHUGAI
601
null
342.04
null
1097.595932
0.0
189.8925522
-13.40871908
-17.85871998
-93.30911716
-129.8515008
-90.0230409
-119.1597427
-8.710976961
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
12
12
0
0
0
7
5
0
0
6
1
0
0
0
0
0
0
12
0
0
0
0
0
0
3
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
1
0
0
0
0
0
0
0
0.106570629
null
b044fdbed8d9d552e58d6b9556c508efaef7d5f1e1eedb34dcc523e12c3b2beb
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
601
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'meA', 'meL', 'L', 'meF', 'F', 'meA', 'meA', 'meA', 'Tza', 'D', '-pip']
78
602
-4.62
-4.62
Lariat
5
-1.69e-16
-2.756805596
-1.14e-16
-2.881762308
8.7e-17
-1.135679182
2.61e-15
-0.249287767
2.876928457
7664.932745
226.0
null
null
157.4308741
146.1210045
45.9375011
84.27443888
73.22283034
23.80325894
15.63282215
16.22364463
9.542110895
10.02009632
5.474683792
5.850607144
null
null
null
null
495.7617172
46.81120852
57.53444621
0
0
0
0
0
0
4.983978521
91.84082326
1323.741337
0.563829787
1.063829787
1.617021277
0.602941176
223.0
PEPTIDE602{[dV].[meA].[meL].L.[meF].F.[meA].[meA].[meA].[Tza].D.[-pip]}$PEPTIDE602,PEPTIDE602,1:R1-11:R3$$$
PEPTIDE602{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meA/">[meA]</a>.<a href=...
-8.29
94
1222.894
602
null
null
5.52e+73
16.91040178
35.28112679
20.60487957
699.934588
null
17.77792836
0.343971318
17.77792836
0.245407207
0.850308551
0.245407207
-7.936021657
-0.343971318
2.801
356.6035
1324.702
Lariat
12
11
null
5
25
null
null
0
2
2
2
1
3
14
5
26
0
28
0
2
2
516
DP-624
-4.62
-4.1678025
4.052331427
60.84843488
66.19681715
7.059210392
70.88615675
0.0
0.0
57.53444621
4.983978521
0.0
11.33678588
101.5355398
88.08096902
179.3889445
49.0808906
null
-4.62
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)N(C)C(=O)[C@@H](C(C)C)NC(=O)C[C@@H](C(=O)N2CCCCC2)NC(=O)[C@H](Cc2cscn2)NC(=O)[C@H](C)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)N(C)C1=O
196.186478
82.22294263
0.0
65.8324134
17.68187306
192.0720624
54.84868077
88.08772338
0
0.0
null
null
null
null
['dV', 'meA', 'meL', 'L', 'meF', 'F', 'meA', 'meA', 'meA', 'Tza', 'D', '-pip']
[0.4292999999999995, 0.1353999999999999, 1.1616, 0.8193999999999995, 1.3581999999999996, 1.0159999999999998, 0.1353999999999999, 0.1353999999999999, 0.1353999999999999, 0.4724999999999997, -0.6377000000000004, 1.1021]
[29.1, 20.31, 20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 20.31, 41.99, 46.17, 3.24]
26.54906677
0.0
0.0
11.33678588
231.2150013
76.65322091
17.68187306
255.170123
71.2668924
7.059210392
0.0
0
2013_CHUGAI
602
null
300.56
null
916.1236604
-0.850308551
187.5752849
-17.57441711
-11.11874443
-80.44676647
-107.0480133
-58.07059397
-114.5067681
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
1
0
0
0
0
12
12
0
0
0
8
5
0
0
6
1
0
0
0
0
0
0
12
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0.174599549
null
9cabe4cd47a3bd751ffe25772be8961b57dcc5bc965ec7098bbdaa6379694703
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
602
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'meA', 'meL', 'L', 'meF', 'Tza', 'meL', 'meA', 'meF', 'T', 'D', '-pip']
78
603
-4.59
-4.59
Lariat
6
-2.58e-16
-2.756951399
-1.99e-16
-2.89480764
-1.58e-17
-1.135684769
2.02e-15
-0.249287767
3.008150564
8166.848988
230.0
null
null
168.1379808
156.5292528
48.34574939
89.83509905
78.33520277
25.00738309
16.4619463
17.05276877
10.00058888
10.4785743
5.878298506
6.254221857
null
null
null
null
520.9605099
56.40651841
57.53444621
0
0
0
0
0
0
10.09278671
93.27202292
1395.798852
0.575757576
1.080808081
1.606060606
0.625
229.0
PEPTIDE603{[dV].[meA].[meL].L.[meF].[Tza].[meL].[meA].[meF].T.D.[-pip]}$PEPTIDE603,PEPTIDE603,1:R1-11:R3$$$
PEPTIDE603{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/Tza/">[Tza]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a...
-8.33
99
1286.937
603
null
null
6.14e+79
17.57534377
37.7445453
22.58980814
741.5150245
null
17.92736444
0.390716897
17.92736444
0.245478885
1.023031273
0.245478885
-8.015360856
-0.390716897
3.1881
376.3913
1396.809
Lariat
12
11
null
6
26
null
null
0
2
2
2
1
3
15
6
27
0
33
0
2
2
546
DP-625
-4.59
-6.198325814
4.68731614
65.95724307
66.19681715
7.059210392
72.31735641
0.0
0.0
57.53444621
4.983978521
0.0
11.33678588
115.239324
93.49595948
187.6134958
56.53166718
null
-4.59
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)N(C)C(=O)[C@@H](C(C)C)NC(=O)C[C@@H](C(=O)N2CCCCC2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2cscn2)NC(=O)[C@H](Cc2ccccc2)N(C)C1=O
210.8905961
82.22294263
1.431199657
65.8324134
23.57583074
211.3768975
54.84868077
88.08772338
0
0.0
null
null
null
null
['dV', 'meA', 'meL', 'L', 'meF', 'Tza', 'meL', 'meA', 'meF', 'T', 'D', '-pip']
[0.4292999999999995, 0.1353999999999999, 1.1616, 0.8193999999999995, 1.3581999999999996, 0.4724999999999997, 1.1616, 0.1353999999999999, 1.3581999999999996, -0.1918000000000002, -0.6377000000000004, 1.1021]
[29.1, 20.31, 20.31, 29.1, 20.31, 41.99, 20.31, 20.31, 20.31, 38.33, 46.17, 3.24]
26.54906677
0.0
0.0
11.33678588
243.8350272
76.65322091
23.57583074
277.9902499
71.2668924
7.059210392
0.0
0
2013_CHUGAI
603
null
320.79
null
997.2873768
-1.023031273
190.7703148
-14.93318655
-11.78239774
-90.04656956
-111.049149
-73.76691716
-122.873107
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
1
0
0
0
0
12
12
0
0
0
8
5
0
0
6
1
0
0
0
0
0
0
12
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
1
0
0
0
0
0.127410795
null
ba298c5900e95c86fcda8326a639667c8339c78ab0ccbfa6efa052ccd3c71f88
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
603
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'meA', 'meL', 'L', 'meF', 'F', 'meL', 'meA', 'meL', 'Gln(Me)', 'D', '-pip']
82
604
-4.44
-4.44
Lariat
4
-2.68e-16
-2.757082455
-2.33e-16
-2.884310718
-1.09e-16
-1.135687071
7.54e-16
-0.249287767
3.662665683
8340.821267
230.0
null
null
176.4393102
165.1210045
48.12100452
93.18012085
82.46591979
24.28263821
16.41895668
16.41895668
9.830694466
9.830694466
5.742777168
5.742777168
null
null
null
null
530.6915923
63.94257271
57.53444621
0
0
0
0
0
0
0.0
101.4772167
1395.889381
0.53
0.99
1.5
0.662162162
226.0
PEPTIDE604{[dV].[meA].[meL].L.[meF].F.[meL].[meA].[meL].[Gln(Me)].D.[-pip]}$PEPTIDE604,PEPTIDE604,1:R1-11:R3$$$
PEPTIDE604{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/F/">F</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href=...
-8.45
100
1278.892
604
null
null
7.97e+83
16.7729402
39.52033262
24.14011161
757.5509305
null
18.12353939
0.359178035
18.12353939
0.245417272
2.228706115
0.245417272
-8.195595143
-0.359178035
3.6804
381.6482
1396.828
Lariat
12
11
null
6
26
null
null
0
2
2
2
0
2
13
6
26
0
36
0
2
2
556
DP-626
-4.44
-7.010809726
2.528447528
66.15824824
66.19681715
8.47105247
76.79333648
0.0
0.0
62.32898339
0.0
0.0
0.0
128.9431082
105.2838749
204.3115524
35.15885458
null
-4.44
null
null
null
null
null
null
null
null
null
null
4
CNC(=O)CC[C@@H]1NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C)N(C)C(=O)[C@@H](C(C)C)NC(=O)C[C@@H](C(=O)N2CCCCC2)NC1=O
222.9542356
76.79333648
0.0
66.15824824
29.46978843
224.8946214
61.82450767
71.55109006
0
0.0
null
null
null
null
['dV', 'meA', 'meL', 'L', 'meF', 'F', 'meL', 'meA', 'meL', 'Gln(Me)', 'D', '-pip']
[0.4292999999999995, 0.1353999999999999, 1.1616, 0.8193999999999995, 1.3581999999999996, 1.0159999999999998, 1.1616, 0.1353999999999999, 1.1616, -0.7005000000000001, -0.6377000000000004, 1.1021]
[29.1, 20.31, 20.31, 29.1, 20.31, 29.1, 20.31, 20.31, 20.31, 58.2, 46.17, 3.24]
31.85888012
0.0
0.0
0.0
239.1140294
75.0748332
29.46978843
309.2330571
60.42418708
8.47105247
0.0
0
2013_CHUGAI
604
null
316.77
null
1067.646256
0.0
203.1934541
-19.39026892
-6.928611555
-104.0842285
-114.9831794
-83.55107909
-136.9856756
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
0
0
0
0
0
13
13
0
0
0
7
6
0
0
6
1
0
0
0
0
0
0
13
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.131901915
null
1a947b41effb0c686b1b439a203cc10a4b1a3010532cd26c05af4a94e20a0d50
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
605
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dV', 'meA', 'meF', 'meA', 'Lys(Me2)', 'Sar', 'V', 'meL', 'meL', 'D', 'meF', 'A', '-pip']
90
606
-5.8
-5.8
Lariat
8
-3.32e-16
-2.756693891
-2.45e-16
-2.881087617
-8.32e-17
-1.136023668
1.02e-15
-0.249287767
3.601598423
8524.015856
214.0
null
null
180.5166605
169.0682181
49.06821811
95.25747112
84.41313338
24.6770654
16.70158047
16.70158047
10.01295902
10.01295902
5.76402612
5.76402612
null
null
null
null
543.0081968
57.77727697
62.32898339
0
0
0
0
0
0
0.0
106.9191674
1424.91593
0.617647059
1.18627451
1.754901961
0.666666667
209.0
PEPTIDE606{[dV].[meA].[meF].[meA].[Lys(Me2)].[Sar].V.[meL].[meL].D.[meF].A.[-pip]}$PEPTIDE606,PEPTIDE606,1:R1-10:R3$$$
PEPTIDE606{<a href="/monomers/dV/">[dV]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/meF/">[meF]</a>.<a href="/monomers/meA/">[meA]</a>.<a href="/monomers/Lys(Me2)/">[Lys(Me2)]</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[m...
-8.49
102
1304.91
606
null
null
3.81e+86
17.07180726
40.37974138
24.61620206
774.0425327
null
18.29051297
0.343971318
18.29051297
0.24562195
2.05227616
0.24562195
-8.608177613
-0.343971318
2.9282
389.9915
1425.87
Lariat
13
10
null
5
27
null
null
0
2
2
2
0
2
14
5
27
0
40
0
2
2
568
DP-631
-5.8
-7.127263671
2.6727682
70.64825434
66.19681715
7.059210392
76.79333648
0.0
0.0
62.32898339
0.0
0.0
0.0
115.239324
126.6903228
200.6801446
44.39723138
null
-5.8
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)N[C@H](C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N2CCCCC2)CC(=O)N[C@H](C(C)C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N(C)[C@@H](C)C(=O)N[C@@H](CCCCN(C)C)C(=O)N(C)CC(=O)N[C@@H](C(C)C)C(=O)N1C
227.0254277
76.79333648
0.0
70.64825434
23.57583074
211.6698044
88.76988084
71.55109006
0
0.0
null
null
null
null
['dV', 'meA', 'meF', 'meA', 'Lys(Me2)', 'Sar', 'V', 'meL', 'meL', 'D', 'meF', 'A', '-pip']
[0.4292999999999995, 0.1353999999999999, 1.3581999999999996, 0.1353999999999999, 0.5051999999999996, -0.2531000000000001, 0.4292999999999995, 1.1616, 1.1616, -0.6377000000000004, 1.3581999999999996, -0.2068000000000003, 1.1021]
[29.1, 20.31, 20.31, 20.31, 32.34, 20.31, 29.1, 20.31, 20.31, 46.17, 20.31, 29.1, 3.24]
26.54906677
0.0
0.0
0.0
275.8592221
75.0748332
23.57583074
301.4912743
60.42418708
7.059210392
0.0
0
2013_CHUGAI
606
null
311.22
null
1089.895146
0.0
199.0967887
-16.89286162
-6.744384766
-98.35668446
-113.2026936
-74.43177111
-156.1968726
0.0
1.0
2013
null
null
null
null
null
null
0
0
0
0
0
0
0
0
0
0
13
13
0
0
0
9
5
0
0
7
1
0
0
0
0
0
0
13
0
0
0
0
0
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
1
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.119198098
null
4b75ad74f80c5abc94cd8dbb8862f06a07a8aed90067ec8cd511c9566122a7e8
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
606
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['dA', 'meL', 'meL', 'meL', 'meS', 'L', 'Sar', 'meL', 'L', 'meL', 'Bal(3-Me)']
78
607
-4.48
-4.48
Circle
9
-3.73e-16
-2.739295085
-3.57e-16
-2.876042448
-2.83e-16
-1.136353566
1.41e-17
-0.249287769
8.340468048
6786.761101
177.0
null
null
160.4088127
151.318329
40.31832904
82.75915978
74.88118955
19.68408688
13.47669663
13.47669663
7.673123207
7.673123207
4.508433134
4.508433134
null
null
null
null
444.4545333
46.72904148
52.73990902
0
0
0
0
0
0
5.108808191
105.6499334
1189.841368
0.464285714
0.833333333
1.238095238
0.819672131
174.0
PEPTIDE607{[dA].[meL].[meL].[meL].[meS].L.[Sar].[meL].L.[meL].[Bal(3-Me)]}$PEPTIDE607,PEPTIDE607,1:R1-11:R2$$$
PEPTIDE607{<a href="/monomers/dA/">[dA]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meS/">[meS]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href=...
-5.87
84
1078.736
607
null
null
4.500000000000001e+72
12.99402332
34.92845829
23.18862079
658.9898303
null
17.79332369
0.393671484
17.79332369
0.24537757
3.091620461
0.24537757
-8.288733446
-0.393671484
3.1045
323.9436
1190.624
Circle
11
11
null
5
23
null
null
0
1
1
0
0
0
12
5
23
0
39
0
1
1
482
DP-639
-4.48
-6.251094438
-0.299954114
60.64742972
54.16103222
5.647368313
66.41017668
0.0
0.0
52.73990902
0.0
0.0
0.0
95.92648964
99.57196234
187.3313928
32.24646471
null
-4.48
null
null
null
null
null
null
null
null
null
null
1
CC(C)C[C@@H]1NC(=O)[C@H](CO)N(C)C(=O)[C@H](CC(C)C)N(C)C(=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[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C1=O
208.7964925
64.97897702
1.431199657
55.53862153
41.2577038
220.7925978
61.88663323
0.0
0
0.0
[['Caco2']]
[7798]
[['-6.52']]
['2023_Ohta']
['dA', 'meL', 'meL', 'meL', 'meS', 'L', 'Sar', 'meL', 'L', 'meL', 'Bal(3-Me)']
[-0.2068000000000003, 1.1616, 1.1616, 1.1616, -0.8922000000000003, 0.8193999999999995, -0.2531000000000001, 1.1616, 0.8193999999999995, 1.1616, 0.1832999999999998]
[29.1, 20.31, 20.31, 20.31, 40.540000000000006, 29.1, 20.31, 20.31, 29.1, 20.31, 29.1]
21.23925341
0.0
0.0
0.0
227.8839109
52.73990902
41.2577038
305.91408
0.0
5.647368313
0.0
0
2013_CHUGAI
607
null
278.8
null
989.3601302
0.0
164.4688993
-9.590840433
0.0
-106.3247305
-78.2223223
-59.25189973
-162.1059033
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
11
11
0
0
0
7
4
0
0
7
0
0
0
0
0
0
0
11
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.158317525
null
6404d35a08c43acd1fcc1ee69178d5e94945c68fb46cbfcfe318b740f978a8f0
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
607
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['V', 'meL', 'L', 'dL', 'meL', 'meL', 'meL', 'meS', 'L', 'Sar', 'Bal(3-Me)']
76
608
-4.3
-4.3
Circle
7
-3.56e-16
-2.743220749
-3.71e-16
-2.884654397
-2.73e-16
-1.136519357
-7.55e-17
-0.249287771
8.540051115
6895.226859
215.0
null
null
162.9088127
153.818329
40.81832904
84.04783491
76.10479635
19.96048008
13.62808983
13.62808983
7.696577961
7.696577961
4.570494946
4.570494946
null
null
null
null
450.6344599
48.14088355
52.73990902
0
0
0
0
0
0
5.108808191
107.020692
1203.857018
0.458823529
0.847058824
1.282352941
0.822580645
212.0
PEPTIDE608{V.[meL].L.[dL].[meL].[meL].[meL].[meS].L.[Sar].[Bal(3-Me)]}$PEPTIDE608,PEPTIDE608,1:R1-11:R2$$$
PEPTIDE608{<a href="/monomers/V/">V</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meS/">[meS]</a>.<a href="/monomers/L/">L</a>.<a href="/mono...
-5.87
85
1090.747
608
null
null
7.19e+75
13.08538331
35.68328696
24.43553178
668.0127986
null
18.10661325
0.393671484
18.10661325
0.24537757
2.896395265
0.24537757
-8.517846807
-0.393671484
3.3984
328.4803
1204.651
Circle
11
11
null
6
23
null
null
0
1
1
0
0
0
12
6
23
0
40
0
1
1
488
DP-640
-4.3
-6.915410691
-0.357337914
61.05733334
54.16103222
7.059210392
66.41017668
0.0
0.0
52.73990902
0.0
0.0
0.0
109.6302739
98.61402791
181.7263245
32.24646471
null
-4.3
null
null
null
null
null
null
null
null
null
null
1
CC(C)C[C@@H]1NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C(C)C)NC(=O)C[C@H](C)NC(=O)CN(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CC(C)C)NC1=O
211.5790931
64.97897702
1.431199657
55.94852515
47.15166148
227.6444899
54.91080633
0.0
0
0.0
[['Caco2']]
[7799]
[['-6.17']]
['2023_Ohta']
['V', 'meL', 'L', 'dL', 'meL', 'meL', 'meL', 'meS', 'L', 'Sar', 'Bal(3-Me)']
[0.4292999999999995, 1.1616, 0.8193999999999995, 0.8193999999999995, 1.1616, 1.1616, 1.1616, -0.8922000000000003, 0.8193999999999995, -0.2531000000000001, 0.1832999999999998]
[29.1, 20.31, 29.1, 29.1, 20.31, 20.31, 20.31, 40.540000000000006, 29.1, 20.31, 29.1]
26.54906677
0.0
0.0
0.0
216.0081743
52.73990902
47.15166148
314.1367307
0.0
7.059210392
0.0
0
2013_CHUGAI
608
null
287.59
null
1011.208098
0.0
168.2233128
-13.0064315
0.0
-114.7486946
-79.42828925
-60.13887548
-162.5257869
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
11
11
0
0
0
6
5
0
0
6
0
0
0
0
0
0
0
11
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.129762397
null
e6f6a991efa8caa8b45c0e27e635ae9c7f141b4a5f35231abfd751c775027702
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
608
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['Sar', 'meL', 'L', 'meL', 'Abu', 'dL', 'meL', 'meL', 'meL', 'meS', 'Bal(3-Me)']
80
609
-4.34
-4.34
Circle
3
-3.85e-16
-2.74233858
-3.72e-16
-2.881526915
-2.37e-16
-1.13648818
1.08e-16
-0.24928777
8.498081091
6907.226859
171.0
null
null
162.9088127
153.818329
40.81832904
84.00915978
76.13118955
19.93408688
13.60169663
13.60169663
7.791524907
7.791524907
4.564850352
4.564850352
null
null
null
null
450.8274583
52.25315922
52.73990902
0
0
0
0
0
0
5.108808191
102.8673328
1203.857018
0.458823529
0.811764706
1.2
0.822580645
168.0
PEPTIDE609{[Sar].[meL].L.[meL].[Abu].[dL].[meL].[meL].[meL].[meS].[Bal(3-Me)]}$PEPTIDE609,PEPTIDE609,1:R1-11:R2$$$
PEPTIDE609{<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/Abu/">[Abu]</a>.<a href="/monomers/dL/">[dL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a...
-5.87
85
1090.747
609
null
null
3.6399999999999996e+74
13.08538331
35.68328696
23.73304487
668.1647134
null
17.98966939
0.393671485
17.98966939
0.245377569
2.920487871
0.245377569
-8.428045606
-0.393671485
3.4946
328.5606
1204.651
Circle
11
11
null
5
23
null
null
0
1
1
0
0
0
12
5
23
0
40
0
1
1
488
DP-641
-4.34
-6.608102282
-0.156040094
60.64742972
54.16103222
5.647368313
66.41017668
0.0
0.0
52.73990902
0.0
0.0
0.0
102.7783818
99.09299513
190.07291
32.24646471
null
-4.34
null
null
null
null
null
null
null
null
null
null
1
CC[C@@H]1NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C(=O)C[C@H](C)NC(=O)[C@H](CO)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](CC(C)C)NC1=O
211.5380096
64.97897702
1.431199657
55.53862153
41.2577038
227.1655227
61.88663323
0.0
0
0.0
[['Caco2']]
[7800]
[['-5.25']]
['2023_Ohta']
['Sar', 'meL', 'L', 'meL', 'Abu', 'dL', 'meL', 'meL', 'meL', 'meS', 'Bal(3-Me)']
[-0.2531000000000001, 1.1616, 0.8193999999999995, 1.1616, 0.1833, 0.8193999999999995, 1.1616, 1.1616, 1.1616, -0.8922000000000003, 0.1832999999999998]
[20.31, 20.31, 29.1, 20.31, 29.1, 29.1, 20.31, 20.31, 20.31, 40.540000000000006, 29.1]
21.23925341
0.0
0.0
0.0
227.8839109
52.73990902
41.2577038
315.0285221
0.0
5.647368313
0.0
0
2013_CHUGAI
609
null
278.8
null
1010.792991
0.0
165.5408718
-10.04749432
0.0
-107.68703
-79.4080013
-67.09682645
-162.5111775
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
11
11
0
0
0
7
4
0
0
7
0
0
0
0
0
0
0
11
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.148634707
null
323339bf35d8f872f03f08155e0e377c8cc6c1f1c52e7976978e0336263f3087
cycpeptmpdb
peptide/cycpeptmpdb/CycPeptMPDB_Peptide_All.csv
tables/peptide_cycpeptmpdb_CycPeptMPDB_Peptide_All.csv.jsonl
609
all
CycPeptMPDB
CycPeptMPDB_Peptide_All
peptide
CycPeptMPDB_Peptide_All
['meL', 'meL', 'meS', 'L', 'Sar', 'meL', 'V', 'meL', 'L', 'dL', 'Bal(3-Me)']
76
610
-4.49
-4.49
Circle
8
-4e-16
-2.732314575
-4e-16
-2.88725645
-2.99e-16
-1.136039267
-1.82e-17
-0.249287769
8.418491493
6895.226859
197.0
null
null
162.9088127
153.818329
40.81832904
84.04783491
76.10479635
19.96048008
13.62808983
13.62808983
7.696577961
7.696577961
4.517544096
4.517544096
null
null
null
null
450.6344599
53.6650013
52.73990902
0
0
0
0
0
0
5.108808191
101.4965743
1203.857018
0.458823529
0.847058824
1.317647059
0.822580645
204.0
PEPTIDE610{[meL].[meL].[meS].L.[Sar].[meL].V.[meL].L.[dL].[Bal(3-Me)]}$PEPTIDE610,PEPTIDE610,1:R1-11:R2$$$
PEPTIDE610{<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/meS/">[meS]</a>.<a href="/monomers/L/">L</a>.<a href="/monomers/Sar/">[Sar]</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/V/">V</a>.<a href="/monomers/meL/">[meL]</a>.<a href="/monomers/L/">L</a>.<a href="/mo...
-5.87
85
1090.747
610
null
null
9.76e+74
13.08538331
35.68328696
24.43553178
668.0127986
null
17.5536415
0.393671484
17.5536415
0.24537757
3.178645124
0.24537757
-8.110799032
-0.393671484
3.3984
328.4803
1204.651
Circle
11
11
null
6
23
null
null
0
1
1
0
0
0
12
6
23
0
40
0
1
1
488
DP-642
-4.49
-6.690922347
-0.397650413
61.05733334
54.16103222
7.059210392
66.41017668
0.0
0.0
52.73990902
0.0
0.0
0.0
109.6302739
98.61402791
181.7263245
32.24646471
null
-4.49
null
null
null
null
null
null
null
null
null
null
1
CC(C)C[C@@H]1NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)C[C@H](C)NC(=O)[C@@H](CC(C)C)NC1=O
211.5790931
64.97897702
1.431199657
55.94852515
47.15166148
227.6444899
54.91080633
0.0
0
0.0
[['Caco2']]
[7801]
[['-6.02']]
['2023_Ohta']
['meL', 'meL', 'meS', 'L', 'Sar', 'meL', 'V', 'meL', 'L', 'dL', 'Bal(3-Me)']
[1.1616, 1.1616, -0.8922000000000003, 0.8193999999999995, -0.2531000000000001, 1.1616, 0.4292999999999995, 1.1616, 0.8193999999999995, 0.8193999999999995, 0.1832999999999998]
[20.31, 20.31, 40.540000000000006, 29.1, 20.31, 20.31, 29.1, 20.31, 29.1, 29.1, 29.1]
26.54906677
0.0
0.0
0.0
216.0081743
52.73990902
47.15166148
314.1367307
0.0
7.059210392
0.0
0
2013_CHUGAI
610
null
287.59
null
1008.218035
0.0
168.5723479
-13.50151565
0.0
-113.9318139
-78.75068499
-59.40882779
-161.6142069
0.0
1.0
2013
null
null
null
null
null
null
0
1
0
0
0
0
0
0
0
0
11
11
0
0
0
6
5
0
0
6
0
0
0
0
0
0
0
11
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0
0.129762397
null