metabolite_name	1 - CA1 1	2 - CA1 2	3 - CA1 3	4 - CA1 4	5 - CA1 5	6 - CA1 6	7 - CA1 7	8 - CA1 8	9 - CA1 9	10 - CA1 10	11 - CA1 11	12 - CA1 12	13 - CA1 13	14 - CA1 14	15 - CA1 15	16 - CA1 16	17 - NCRM1 1	18 - NCRM1 2	19 - NCRM1 3	20 - NCRM1 4	21 - NCRM1 5	22 - NCRM1 6	23 - NCRM1 7	24 - NCRM1 8	25 - NCRM1 9	26 - NCRM1 10	27 - NCRM1 11	28 - NCRM1 12	29 - NCRM1 13	30 - NCRM1 14	31 - NCRM1 15	32 - NCRM1 16	33 - ICD 1	34 - ICD 2	35 - ICD 3	36 - ICD 4	37 - ICD 5	38 - ICD 6	39 - ICD 7	40 - ICD 8	41 - ICD 9	42 - ICD 10	43 - ICD 11	44 - ICD 12	45 - ICD 13	46 - ICD 14	47 - ICD 15	48 - ICD 16	49 - ICE 1	50 - ICE 2	51 - ICE 3	52 - ICE 4	53 - ICE 5	54 - ICE 6	55 - ICE 7	56 - ICE 8	57 - ICE 9	58 - ICE 10	59 - ICE 11	60 - ICE 12	61 - ICE 13	62 - ICE 14	63 - ICE 15	64 - ICE 16
Ac-Orn	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.142	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
ADMA	2.33	0	0	0.012	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.234	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
alpha-AAA	9.1	0	0	1.33	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.585	0	0.765	0	0	0	0	0	0	0.36	0	0	0	0	0
c4-OH-Pro	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Carnosine	3.1	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	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Creatinine	0.57	1.04	1.08	0.469	1.23	0.68	1.03	2.1	1.46	0.855	1.07	0.745	1.91	0.88	1.23	1.08	0.785	1.21	1.02	1.68	1.17	1.7	1.89	0.7	0.865	1.53	0.635	0.79	0.855	0.765	0.85	0.83	1.06	1.22	1.31	0.94	1.53	1.14	0.94	1.3	1.49	1.75	1.28	0.458	1.19	1.92	1.48	1.11	0.99	0.76	0.905	0.655	1.64	0.665	1.08	1.25	0.945	1.71	1.16	2.46	1.5	1.34	0.825	2.63
DOPA	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Dopamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Histamine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.114	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Kynurenine	11.9	0.343	0.151	3.42	0.035	0.102	0.068	0.098	0.022	0.041	0.106	0.059	0.061	0.074	0.043	0.089	0.217	0.026	0.108	0.079	0.075	0.054	0.078	0.053	0.11	0.081	0.054	0.027	0.064	0.062	0.1	0.107	0.071	0.081	0.038	0.185	0.01	0.053	0.058	0.111	0.161	0.021	0.093	0.049	0.116	0.123	0.03	0.051	0.065	0.072	0.036	0.071	0.055	0.039	0.046	0.072	0.035	0.067	0.083	0.078	0.061	0.032	0.113	0.058
Met-SO	1.25	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Nitro-Tyr	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
PEA	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Putrescine	0.14	0.043	0	0	0	0.341	0	0	0.178	0.078	0	0.535	0	0	0	0.199	0.102	0	0	0.061	0.072	0	0	0	0.395	0.059	0	0.086	1.04	0.311	0	2.82	0.077	0.175	0	0.795	0.136	0.076	0	0	0.165	0	0.262	0.085	0	0	0	0	0.161	0	0.116	0.38	0	0	0	0.079	0.19	0.635	0.344	0.328	0.121	0.283	2.62	0.164
SDMA	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Serotonin	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Spermidine	0.482	0.092	0.091	0.154	0.115	1.1	0.113	0.12	0.087	0.09	0.137	0.121	0.093	0.108	0	0.124	0.14	0	0	0	0.131	0	0.176	0	0	0.136	0.131	0	0.149	0	0.403	0.174	0	0.104	0	0.321	0.139	0.137	0	0.152	0	0	0	0	0	0	0	0	0	0.207	0.209	0.267	0.11	0	0	0	0	0.13	0	0	0	0	0	0
Spermine	0.63	0.138	0.156	0.209	0.152	0.473	0.13	0.124	0.125	0.13	0.126	0.138	0.13	0.138	0	0	0.148	0	0.126	0.126	0.137	0.125	0.143	0.124	0	0.136	0	0	0.13	0	0	0.127	0	0	0	0	0	0.131	0	0.132	0	0	0	0	0	0	0	0	0	0.167	0.157	0.135	0	0	0.135	0.133	0	0	0	0	0	0	0	0
t4-OH-Pro	0.945	0.226	0	0.605	0	1.61	0	0	0	0	0.297	0	0.236	0	0.52	0	0	0.258	0	0	0.458	0.243	0.254	0	0	0.34	0	0	0.246	0	0.238	0	0.227	0.51	0.299	0.875	0	0.535	0	0	0	0	0	0.237	0	0.31	0	0	0.324	0.79	0.411	0	0	0	0	0	0	0	0	0.269	0	0	0	0
Taurine	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.02	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.41	0
total DMA	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0
Ala	291	1.19	1.44	51.5	0	7.85	0	0	0	1.41	6.25	0	0.1	0	0	0	2.42	0	0	0	0	0	0	0	13.4	0.55	0	0	0.785	0	22	3.99	0	1.14	0	7.75	0	0	0	0	0	0	0.225	0	1.64	0	0	0	0.361	7.25	0.234	3.94	0	0	0	0	0	0.79	0	0	0	0	2.16	0
Arg	81	2.69	2.71	29.5	3	4.45	1.49	1.36	1.26	1.2	2.98	2.04	1.35	0	2.19	1.47	2.64	1.35	3.38	1.44	1.63	1.83	1.32	1.52	1.75	1.66	2.11	1.8	2.06	1.93	3.74	8.45	1.82	2.07	1.23	3.99	1.46	1.86	1.19	1.23	1.51	1.33	1.78	1.39	1.21	1.57	1.75	1.25	1.73	1.97	1.36	3.31	1.36	1.45	1.35	2.17	1.37	2.75	3.1	1.72	1.51	1.84	2.28	1.7
Asn	34.9	1.28	1.9	13.4	1.19	3.77	0	1.48	1.49	0	2.66	0.94	0.955	1.34	0	0	2.23	1.78	2.25	0.975	0	0.965	1.02	1.72	1.32	0	1.27	1.91	1.38	1.05	0	2	0	2.6	1.05	3.3	0.925	0	0	1.27	1.04	1.32	0	1.41	0	0	0	1.1	0	0	1.29	1.91	0.99	0	0	0	0	1.62	0	0.925	0	1.42	1.29	0
Asp	93.5	1.3	0	18.8	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.14	0	0	0	0	0	0	0	0	0	5.15	0	1.6	0	0	0	0	0	0	0	0	0	0	0	0	0	4.29	0	0	0	0	0	0	0	0	0	0	0	0
Cit	0.64	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.153	0.71	4.47	4.52	0	2.24	0	6.95	0	0	0	0	0	0	0.035	0.033	0	0	0	0	0.825	7.85	4.02	6.95	0	0	0	0	0	1.43	0.429	0	0	0	5.3	0
Gln	255	20.1	13.6	173	2.7	4.24	0	1.87	2.16	0	23.4	2.99	3.85	0	19.1	0	9.35	2.92	35.4	3.21	4.78	3.1	1.73	2.23	9.25	3.37	4.3	3.91	3.33	4.65	100	18	4.58	7.35	0	66.5	1.88	4.75	3.04	1.82	2.54	1.67	3.98	4.54	1.61	5.85	4.48	1.7	3.78	15.2	2.6	21.5	1.99	3.13	2.29	20	1.99	10.1	4.01	4.2	5.1	7.95	13.6	2.14
Glu	358	5.6	4.13	130	0	42	0	0	0	0	15.4	0	1.77	0	1.17	2.98	24.3	2.01	2.2	1.84	5.9	2.22	2.67	1.45	2.58	5	0	2.55	5.45	1.8	43.3	14.9	1.55	20.5	2.12	62	2.66	2.99	0	2.52	3.73	0	3.51	1.87	0	1.75	4.19	0	10.9	37.3	11.2	36.1	0	0	1.12	0	0	6.35	1.98	2.12	1.19	2.33	22.3	0
Gly	157	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	46	0	0	0	0	0	0	0	0	0	0	0	0	0	0
His	66.5	0	0.64	7.85	0	0	0	0	0	0	0	0	0	0	0.352	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.95	0	0	0	9.85	0	0.287	0	0	0	0	0	0	0	0.247	0	0	0.51	1.04	0	2.99	0	0	0	0	0	0.313	0	0	0	0	0.009	0
Ile	72	1.31	1.26	16.8	0.62	1.52	0.143	0	0	0	1.14	0.418	0.56	0	12.1	0.255	0.795	0.099	2.15	0.257	1.21	0.227	0.316	0.48	1.47	0.585	0.283	0.321	0.605	0.695	6.05	7.05	0.865	1.73	0.05	10.5	0	13.4	0.139	0.171	0	0	0.74	0.289	0	4.56	0.94	0.122	1.21	7.85	0.65	7.1	0	0.293	0	0.805	0	1.39	0.457	0.417	0.62	0.97	2.24	0.088
Leu	126	1.49	0	21.4	0	3.62	0	0	0	0	4.52	0	0	0	2.75	0	2.33	1.55	2.52	0	2.98	0	0	0	1.77	0	0	0	2.06	1.33	13.6	9.15	0	4.99	0	10.9	0	2.04	0	0	0	0	0	0	1.41	0	2.23	0	2.55	12.3	0	5.2	0	0	0	1.84	0	2.79	0	0	1.2	1.48	4.04	0
Lys	83	3.66	3.35	14.5	2.5	3.03	2.15	2.09	2.09	0	2.45	2.16	2.28	2.07	2.68	2.08	3.1	2.25	3.28	2.12	2.43	2.14	2.07	2.14	2.62	2.36	2.22	2.42	2.2	2.35	3.8	4.09	2.23	2.84	2.09	5.3	2.15	2.51	2.09	2.1	2.05	2.03	2.32	2.2	2.03	2.12	2.3	0	2.95	4.33	2.25	4.79	2.12	2.08	2.1	2.42	2.06	2.63	2.1	2.07	2.15	2.35	2.69	2.06
Met	45.9	0.82	0.915	8.75	0.66	1.32	0.615	0.63	0.61	0	1.15	0.685	0.7	0	1.11	0.67	0.99	0.685	0.915	0.66	0.845	0.67	0.63	0	1.02	0.925	0.695	0.79	0.89	0.775	1.48	2.75	0.655	1.2	0.615	3.02	0	0.835	0.61	0	0.655	0	0.915	0.685	0	0.75	0.75	0	1.12	3.47	0.775	2.29	0	0.625	0.64	0	0	0.955	0.665	0.645	0.715	0.9	1.47	0
Orn	17.6	0	0.002	3.08	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	1.2	0.333	0	0	0	0.63	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0	0.08	0
Phe	45.9	1.19	1.07	11.7	0.565	2	0.446	0.474	0.473	0.434	1.42	0.605	0.685	0.435	7.15	0.64	1.15	0.595	1.41	0.496	0.92	0.64	0.575	0.51	1.24	0.805	0.56	0.65	1.1	0.785	4.96	5.6	0.735	1.57	0.47	5.9	0.486	4.29	0.515	0.482	0.481	0.42	0.895	0.69	0.432	2.42	0.835	0.453	1.5	4.35	0.66	2.94	0.451	0.52	0.535	0.83	0.46	1.12	0.54	0.53	0.635	1.1	1.9	0.461
Pro	175	2.53	2.14	56	1.19	4.94	1.32	1.14	1.2	1.1	3.75	1.15	1.25	1.06	16.3	1.39	5.65	1.49	2.01	1.27	1.82	1.27	1.23	1.32	1.7	1.99	1.35	1.38	2.95	1.41	14.5	4.94	1.59	6.35	1.38	47.3	1.38	10.3	1.21	1.19	1.24	1.1	1.45	1.23	1.13	7.6	2.13	1.23	4.93	26.8	3.66	16	1.14	1.26	1.29	1.41	1.27	1.89	1.14	1.48	1.29	1.82	3.37	1.15
Ser	239	5.85	12.2	62	0	1.57	0	0	0	0	4.77	0	1.12	0	5.45	0.015	5.65	0.337	1.75	0.825	6.7	1.53	0	0	3.62	1.7	0	0	4.25	1.05	16.6	8.55	1.36	8	0.471	67	1.55	7.85	0	0.56	0	0	0	2.02	0	5.3	2.77	1.26	8.1	11.5	2.04	8	0	2.4	0.79	1.23	0.484	1.74	2.41	1.23	0.285	0.285	4.13	0.52
Thr	98	1.84	2.59	27.1	0.995	3.39	0.479	0.63	0.61	0.498	2.08	0.94	1.16	0.496	8.3	0.82	2.05	0.7	2.77	0.645	1.53	0.755	1	0.745	2.04	1.5	1.14	1.09	1.29	0.75	12.4	10.2	0.99	5.3	0.76	51	0.575	8	0.785	0	0.525	0	2.04	1.36	0.419	3	0.88	0.575	4.8	19.2	1.13	8.25	0.725	0.52	0.96	0.81	0.515	2.37	0.71	0.715	0.82	2.04	9.05	0.545
Trp	0.498	0.263	0.348	0.31	0.261	0.75	0.255	0.262	0.236	0.233	0.555	0.261	0.303	0.234	1.29	0.267	0.235	0.25	0.464	0.263	0.403	0.28	0.268	0.259	0.425	0.328	0.268	0.287	0.303	0.317	1.28	1.03	0.272	0.56	0.257	1.74	0.24	1.4	0.262	0	0.249	0.231	0.319	0.27	0.236	0.745	0.331	0.257	0.412	1.97	0.309	1.18	0	0.241	0.244	0.299	0.231	0.389	0.258	0.251	0.278	0.332	0.62	0.231
Tyr	49.9	1.79	0.905	7.95	0.466	1.52	0.371	0.258	0.242	0.328	1.92	0.402	0.545	0.336	0.975	0.265	1.35	0.388	1.62	0.431	1.03	0.347	0.466	0.381	1.26	0.795	0.352	0.565	1.52	1.01	7	7.4	0.64	1.6	0.231	7.75	0.3	0.825	0.361	0.297	1.03	0.177	0.73	0.46	0.335	0.72	0.665	0.369	0.75	3.97	0.6	3.26	0.342	0.156	0.605	0.8	0.344	0.785	0.394	0.479	0.545	0.585	2.95	0.395
Val	102	0.349	0.265	19.7	0	1.22	0	0	0	0	1.09	0.02	0	0	9.05	0	1.59	0	2.92	0	1.18	0	0	0	0.87	0	0	0.238	1.09	0.555	7.9	6.2	0	0.54	0	6.65	0	8.3	0	0	0	0	0	0	0	2.12	0	0	0.397	3.17	0	2.96	0	0	0	0.275	0	0.267	0	0.001	0	0.364	1.97	0

metabolite_name
Ac-Orn
ADMA
alpha-AAA
c4-OH-Pro
Carnosine
Creatinine
DOPA
Dopamine
Histamine
Kynurenine
Met-SO
Nitro-Tyr
PEA
Putrescine
SDMA
Serotonin
Spermidine
Spermine
t4-OH-Pro
Taurine
total DMA
Ala
Arg
Asn
Asp
Cit
Gln
Glu
Gly
His
Ile
Leu
Lys
Met
Orn
Phe
Pro
Ser
Thr
Trp
Tyr
Val