Content for NMR-STAR saveframe, "spectral_peak_list_1"

    save_spectral_peak_list_1
   _Spectral_peak_list.Sf_category                      spectral_peak_list
   _Spectral_peak_list.Sf_framecode                     spectral_peak_list_1
   _Spectral_peak_list.Entry_ID                         34299
   _Spectral_peak_list.ID                               1
   _Spectral_peak_list.Sample_ID                        2
   _Spectral_peak_list.Sample_label                     $sample_2
   _Spectral_peak_list.Sample_condition_list_ID         1
   _Spectral_peak_list.Sample_condition_list_label      $sample_conditions_1
   _Spectral_peak_list.Experiment_ID                    2
   _Spectral_peak_list.Experiment_name                  '3D 1H-15N NOESY'
   _Spectral_peak_list.Experiment_class                 .
   _Spectral_peak_list.Experiment_type                  .
   _Spectral_peak_list.Number_of_spectral_dimensions    3
   _Spectral_peak_list.Chemical_shift_list              .
   _Spectral_peak_list.Assigned_chem_shift_list_ID      1
   _Spectral_peak_list.Assigned_chem_shift_list_label   $assigned_chemical_shifts_1
   _Spectral_peak_list.Details                          .
   _Spectral_peak_list.Text_data_format                 text
   _Spectral_peak_list.Text_data
;
Number	#	Position F1	Position F2	Position F3	Assign F1	Assign F2	Assign F3	Height	Volume	Line Width F1 (Hz)	Line Width F2 (Hz)	Line Width F3 (Hz)	Merit	Details	Fit Method	Vol. Method
1	1	6.56894	7.70034	112.47116	 95GlnHe2b	 91HisHe1	 95GlnNe2	8.01038e+06	9.69180e+07	27.18836	49.56172	41.47398	1.00000	None	parabolic	box sum
2	2	6.32592	7.70166	112.48009	 95GlnHe2a	 91HisHe1	 95GlnNe2	8.31096e+06	1.09481e+08	27.97693	50.24053	41.83006	1.00000	None	parabolic	box sum
3	4	6.56923	7.45135	112.47167	 95GlnHe2b	 95GlnH	 95GlnNe2	4.69642e+06	6.10242e+07	27.89617	49.41055	41.71729	1.00000	None	parabolic	box sum
4	5	6.32631	7.45702	112.50224	 95GlnHe2a	 95GlnH	 95GlnNe2	1.95339e+06	2.06134e+07	27.49860	40.49776	38.61690	1.00000	None	parabolic	box sum
5	8	6.56917	4.20815	112.46802	 95GlnHe2b	 95GlnHa	 95GlnNe2	6.78130e+06	9.51258e+07	26.52794	54.01890	41.33499	1.00000	None	parabolic	box sum
6	9	6.32602	4.20282	112.45409	 95GlnHe2a	 95GlnHa	 95GlnNe2	4.17271e+06	5.66273e+07	27.12816	53.26755	39.95132	1.00000	None	parabolic	box sum
7	10	6.56972	3.59332	112.47506	 95GlnHe2b	 92LeuHa	 95GlnNe2	7.22150e+06	8.62118e+07	26.44181	43.80551	42.28473	1.00000	None	parabolic	box sum
8	12	6.56927	2.25491	112.48453	 95GlnHe2b	 95Gln(Hgb/Hbb)	 95GlnNe2	2.84081e+07	3.97132e+08	27.89587	54.59608	42.47367	1.00000	None	parabolic	box sum
9	15	6.56989	2.09993	112.47838	 95GlnHe2b	 94GluHba	 95GlnNe2	1.08474e+07	1.64872e+08	26.53956	64.37541	41.91244	1.00000	None	parabolic	box sum
10	16	6.32661	2.09942	112.48137	 95GlnHe2a	 94GluHba	 95GlnNe2	5.84196e+06	8.87192e+07	26.57503	69.38519	38.61260	1.00000	None	parabolic	box sum
11	17	6.56913	1.95469	112.48428	 95GlnHe2b	 95GlnHga	 95GlnNe2	1.63498e+07	2.44244e+08	27.15796	63.30442	41.46039	1.00000	None	parabolic	box sum
12	18	6.32612	1.95748	112.48818	 95GlnHe2a	 95GlnHga	 95GlnNe2	7.09837e+06	1.03413e+08	27.60530	68.64839	38.78176	1.00000	None	parabolic	box sum
13	19	6.56746	1.05970	112.47945	 95GlnHe2b	 92LeuHdb*	 95GlnNe2	1.86062e+06	1.88127e+07	33.17982	33.88699	42.94503	1.00000	None	parabolic	box sum
14	20	6.32343	1.06267	112.49533	 95GlnHe2a	 92LeuHdb*	 95GlnNe2	1.19315e+06	7.67912e+06	31.36903	26.47179	48.67804	1.00000	None	parabolic	box sum
15	21	6.56950	0.91813	112.48415	 95GlnHe2b	 74LeuHdb*	 95GlnNe2	6.36418e+06	8.87411e+07	28.08124	142.52950	40.62700	1.00000	None	parabolic	box sum
16	22	6.32628	0.91917	112.48920	 95GlnHe2a	 74LeuHdb*	 95GlnNe2	8.32219e+06	1.10777e+08	27.07243	60.13861	40.85171	1.00000	None	parabolic	box sum
17	23	6.56905	0.78130	112.49221	 95GlnHe2b	 92LeuHda*	 95GlnNe2	7.20423e+06	1.14371e+08	26.56192	67.46102	40.33732	1.00000	None	parabolic	box sum
18	24	6.32549	0.79008	112.49292	 95GlnHe2a	 92LeuHda*	 95GlnNe2	5.70180e+06	8.72740e+07	26.24989	141.34566	38.26880	1.00000	None	parabolic	box sum
19	25	9.23514	8.35754	119.84946	 29AspH	 28LeuH	 29AspN	3.65884e+07	5.11729e+08	28.66507	120.30837	39.97850	1.00000	None	parabolic	box sum
20	26	9.23572	8.24266	119.85232	 29AspH	 30GlnH	 29AspN	3.31266e+07	4.46926e+08	28.93984	123.79029	40.21972	1.00000	None	parabolic	box sum
21	27	9.23604	7.93794	119.86926	 29AspH	 27ValH	 29AspN	5.39966e+06	6.89502e+07	26.61839	52.74277	41.34834	1.00000	None	parabolic	box sum
22	30	9.23488	8.87073	119.86466	 29AspH	 31AlaH	 29AspN	5.95514e+06	6.39313e+07	26.54523	38.82954	38.93554	1.00000	None	parabolic	box sum
23	31	9.23269	8.71491	119.75595	 29AspH	 32AlaH	 29AspN	3.12193e+06	3.64368e+07	32.06581	140.05463	51.44995	1.00000	None	parabolic	box sum
24	33	6.81745	7.37849	108.31676	 67GlnHe2a	 67GlnHe2b	 67GlnNe2	2.05994e+08	2.76047e+09	29.72633	52.09217	40.81488	1.00000	None	parabolic	box sum
25	34	7.37555	6.81972	108.31654	 67GlnHe2b	 67GlnHe2a	 67GlnNe2	2.13386e+08	2.84696e+09	30.77209	51.54036	40.44545	1.00000	None	parabolic	box sum
26	35	7.37581	8.88105	108.29737	 67GlnHe2b	 67GlnH	 67GlnNe2	5.92047e+06	7.87010e+07	29.74480	49.93243	43.31350	1.00000	None	parabolic	box sum
27	36	6.81728	8.88310	108.31555	 67GlnHe2a	 67GlnH	 67GlnNe2	3.63240e+06	4.30299e+07	27.86547	47.91006	39.49165	1.00000	None	parabolic	box sum
28	38	6.82013	8.73877	108.28474	 67GlnHe2a	 66LeuH	 67GlnNe2	1.21301e+06	5.31328e+06	24.30946	25.15654	33.51080	1.00000	None	parabolic	box sum
29	40	6.81710	8.26612	108.32001	 67GlnHe2a	 68ThrH	 67GlnNe2	1.81349e+06	1.83477e+07	23.93007	42.93906	35.43591	1.00000	None	parabolic	box sum
30	41	7.37706	9.18345	108.31569	 67GlnHe2b	 74LeuH	 67GlnNe2	2.19349e+06	3.19466e+07	25.84487	52.74862	45.49742	1.00000	None	parabolic	box sum
31	42	6.81993	9.17407	108.30128	 67GlnHe2a	 74LeuH	 67GlnNe2	2.49179e+06	3.22696e+07	33.87719	46.85902	42.05346	1.00000	None	parabolic	box sum
32	45	7.37583	4.38925	108.29342	 67GlnHe2b	 64AspHa	 67GlnNe2	1.89688e+07	2.68315e+08	30.01869	54.06648	42.90724	1.00000	None	parabolic	box sum
33	46	6.81767	4.38997	108.31382	 67GlnHe2a	 64AspHa	 67GlnNe2	1.48355e+07	2.00197e+08	29.50013	52.89679	40.39574	1.00000	None	parabolic	box sum
34	47	7.37397	4.16294	108.29048	 67GlnHe2b	 67GlnHa	 67GlnNe2	5.42095e+06	7.33036e+07	30.65079	52.45880	44.69812	1.00000	None	parabolic	box sum
35	49	7.37456	3.02004	108.31153	 67GlnHe2b	 64AspHbb	 67GlnNe2	3.57194e+06	5.35936e+07	28.44512	60.53178	42.99092	1.00000	None	parabolic	box sum
36	50	7.37552	2.85868	108.29955	 67GlnHe2b	 67GlnHgb	 67GlnNe2	1.23338e+07	1.71814e+08	30.26873	55.38478	42.22250	1.00000	None	parabolic	box sum
37	51	7.37584	2.54705	108.29184	 67GlnHe2b	 67GlnHga	 67GlnNe2	3.19555e+07	5.40423e+08	30.72619	71.69586	43.31505	1.00000	None	parabolic	box sum
38	52	7.37563	2.27970	108.29415	 67GlnHe2b	 67GlnHba	 67GlnNe2	2.51414e+07	3.75954e+08	30.03776	56.97162	42.93156	1.00000	None	parabolic	box sum
39	53	7.37570	2.01956	108.30357	 67GlnHe2b	 66LeuHbb	 67GlnNe2	1.40331e+06	2.21339e+07	19.56969	61.77262	48.60163	1.00000	None	parabolic	box sum
40	55	7.37618	1.52993	108.29410	 67GlnHe2b	 (69Ala/74Leu)Hb*	 67GlnNe2	3.59668e+06	5.36738e+07	28.71037	59.79380	43.56694	1.00000	None	parabolic	box sum
41	59	6.81856	3.01935	108.28265	 67GlnHe2a	 64AspHbb	 67GlnNe2	3.45706e+06	5.03849e+07	27.96859	56.91736	42.80829	1.00000	None	parabolic	box sum
42	60	6.81762	2.85712	108.31905	 67GlnHe2a	 67GlnHgb	 67GlnNe2	9.57468e+06	1.25588e+08	29.18333	53.98588	39.66403	1.00000	None	parabolic	box sum
43	61	6.81746	2.54787	108.31791	 67GlnHe2a	 67GlnHga	 67GlnNe2	2.49026e+07	4.05468e+08	29.39463	72.26556	39.85155	1.00000	None	parabolic	box sum
44	62	6.81735	2.27876	108.31316	 67GlnHe2a	 67GlnHba	 67GlnNe2	1.97627e+07	2.87392e+08	29.44827	56.80019	40.76457	1.00000	None	parabolic	box sum
45	63	6.81806	2.03217	108.29760	 67GlnHe2a	 63ArgHba	 67GlnNe2	1.65373e+06	2.16054e+07	29.52307	50.85388	42.64152	1.00000	None	parabolic	box sum
46	64	6.81617	1.53127	108.30393	 67GlnHe2a	 (69Ala/74Leu)Hb*	 67GlnNe2	3.11556e+06	3.94408e+07	28.12147	50.13123	40.86661	1.00000	None	parabolic	box sum
47	66	7.37691	0.81327	108.33623	 67GlnHe2b	 74LeuHda*	 67GlnNe2	2.81973e+06	3.84030e+07	26.20727	63.91304	37.40084	1.00000	None	parabolic	box sum
48	67	6.81775	0.80892	108.36207	 67GlnHe2a	 74LeuHda*	 67GlnNe2	2.10667e+06	2.50862e+07	24.81341	58.07839	37.10294	1.00000	None	parabolic	box sum
49	68	7.57557	0.13006	108.63852	 79IleH	 79IleHg1a	 79IleN	1.68926e+07	2.59780e+08	30.84898	60.49718	40.17532	1.00000	None	parabolic	box sum
50	69	7.57556	0.00355	108.63876	 79IleH	 79IleHd1*	 79IleN	1.51616e+07	1.91321e+08	30.47913	59.04402	41.04614	1.00000	None	parabolic	box sum
51	70	7.57555	-0.14632	108.64088	 79IleH	 79IleHg2*	 79IleN	3.98576e+07	5.11283e+08	31.10617	47.08691	40.87412	1.00000	None	parabolic	box sum
52	71	7.57533	1.74563	108.64500	 79IleH	 78LeuHba	 79IleN	3.39354e+07	4.79444e+08	31.30585	55.40483	41.31019	1.00000	None	parabolic	box sum
53	73	7.57595	1.38589	108.63327	 79IleH	 59AlaHb*	 79IleN	1.85280e+07	2.94711e+08	31.36247	124.29581	40.94923	1.00000	None	parabolic	box sum
54	74	7.57560	1.28977	108.63799	 79IleH	 79IleHb	 79IleN	3.19660e+07	4.63600e+08	30.90382	100.29903	41.26048	1.00000	None	parabolic	box sum
55	75	7.57544	1.04354	108.63283	 79IleH	 78LeuHdb*	 79IleN	6.51739e+06	8.72402e+07	30.93570	53.95600	39.81805	1.00000	None	parabolic	box sum
56	76	7.57605	0.81330	108.64912	 79IleH	 78LeuHda*	 79IleN	1.23746e+07	1.72416e+08	32.57900	56.87057	40.88926	1.00000	None	parabolic	box sum
57	77	7.57566	0.63304	108.63699	 79IleH	 79IleHg1b	 79IleN	3.25078e+07	4.55860e+08	30.96968	54.02166	41.21292	1.00000	None	parabolic	box sum
58	79	6.74683	7.11577	109.38742	 19GlnHe2a	 19GlnHe2b	 19GlnNe2	1.81509e+08	2.42724e+09	30.83676	50.25606	41.73112	1.00000	None	parabolic	box sum
59	81	7.11388	7.36244	109.37552	 19GlnHe2b	 14LeuH	 19GlnNe2	8.65810e+06	9.09184e+07	31.71623	40.40183	41.83054	1.00000	None	parabolic	box sum
60	82	6.74697	7.36480	109.41371	 19GlnHe2a	 14LeuH	 19GlnNe2	5.27628e+06	1.86401e+07	24.85663	27.16122	29.61040	1.00000	None	parabolic	box sum
61	83	6.74476	9.11101	109.41098	 19GlnHe2a	 19GlnH	 19GlnNe2	2.06866e+06	2.45795e+07	28.18793	49.49710	37.86314	1.00000	None	parabolic	box sum
62	84	7.11178	9.10438	109.35639	 19GlnHe2b	 19GlnH	 19GlnNe2	3.52966e+06	5.08189e+07	31.00425	53.33179	42.74595	1.00000	None	parabolic	box sum
63	85	9.10253	7.11418	118.51138	 19GlnH	 19GlnHe2b	 19GlnN	4.71459e+06	5.85141e+07	26.79348	46.09042	39.40010	1.00000	None	parabolic	box sum
64	86	9.10313	6.74979	118.51605	 19GlnH	 19GlnHe2a	 19GlnN	2.92857e+06	3.72901e+07	26.91880	51.70274	40.39019	1.00000	None	parabolic	box sum
65	87	8.24157	9.24347	118.14687	 30GlnH	 29AspH	 30GlnN	2.97204e+07	3.92287e+08	29.34903	52.07630	38.48743	1.00000	None	parabolic	box sum
66	88	8.24065	8.86618	118.14747	 30GlnH	 31AlaH	 30GlnN	4.15467e+07	5.61320e+08	29.14608	48.40870	49.57616	1.00000	None	parabolic	box sum
67	89	7.55090	0.13064	118.52953	 80PheH	 79IleHg1a	 80PheN	7.41563e+06	1.11974e+08	30.80964	60.37176	39.07877	1.00000	None	parabolic	box sum
68	90	7.55177	0.00370	118.51250	 80PheH	 79IleHd1*	 80PheN	4.51622e+06	5.71559e+07	30.64364	136.97910	38.02061	1.00000	None	parabolic	box sum
69	91	7.55070	-0.14542	118.52707	 80PheH	 79IleHg2*	 80PheN	9.29042e+06	1.16293e+08	30.38704	46.22115	39.41590	1.00000	None	parabolic	box sum
70	92	9.00618	0.00373	123.58534	 59AlaH	 79IleHd1*	 59AlaN	5.58252e+06	7.32322e+07	27.17867	53.70437	38.78891	1.00000	None	parabolic	box sum
71	93	9.00609	-0.14691	123.59020	 59AlaH	 79IleHg2*	 59AlaN	3.10605e+06	3.16673e+07	26.46804	36.39070	40.59961	1.00000	None	parabolic	box sum
72	94	7.32547	0.00198	123.73600	 78LeuH	 79IleHd1*	 78LeuN	1.57420e+06	1.61792e+07	28.80186	48.63050	40.80990	1.00000	None	parabolic	box sum
73	95	7.32308	-0.14558	123.76420	 78LeuH	 79IleHg2*	 78LeuN	4.39959e+06	5.25480e+07	28.74047	42.85325	40.97897	1.00000	None	parabolic	box sum
74	96	7.97802	-0.14654	119.67109	 81AspH	 79IleHg2*	 81AspN	2.92779e+06	3.23355e+07	29.40297	41.34937	38.19364	1.00000	None	parabolic	box sum
75	97	7.62985	-0.14686	119.51301	 63ArgH	 79IleHg2*	 63ArgN	3.80634e+06	4.29521e+07	30.80696	41.53849	40.42083	1.00000	None	parabolic	box sum
76	98	8.52161	-0.14514	119.55498	 88ValH	 79IleHg2*	 88ValN	1.48533e+06	1.53875e+07	31.96985	35.69872	42.80800	1.00000	None	parabolic	box sum
77	99	7.98010	0.00641	119.60907	 81AspH	 79IleHd1*	 81AspN	1.12356e+06	1.77881e+07	23.60940	56.26745	53.73776	1.00000	None	parabolic	box sum
78	100	7.63172	0.00192	119.49973	 63ArgH	 79IleHd1*	 63ArgN	3.75406e+06	4.72862e+07	27.53019	51.62961	39.16121	1.00000	None	parabolic	box sum
79	101	8.10402	0.11646	119.12020	 54PheH	 35LeuHda*	 54PheN	4.52593e+06	6.14409e+07	29.17647	52.97071	41.08751	1.00000	None	parabolic	box sum
80	102	8.21451	4.43395e-04	119.09519	 49PheH	 79IleHd1*	 49PheN	2.76575e+06	3.47652e+07	30.24131	51.76643	39.21795	1.00000	None	parabolic	box sum
81	103	8.10391	0.00174	119.13086	 54PheH	 35LeuHda*	 54PheN	4.57483e+06	5.74023e+07	30.56109	61.60238	39.25270	1.00000	None	parabolic	box sum
82	104	8.21417	-0.14463	119.07261	 49PheH	 79IleHg2*	 49PheN	3.30281e+06	3.80011e+07	27.86845	40.47496	41.17709	1.00000	None	parabolic	box sum
83	105	8.43116	0.24049	117.88316	 62LeuH	 62LeuHda*	 62LeuN	1.51027e+07	1.88868e+08	29.47658	47.21823	39.01762	1.00000	None	parabolic	box sum
84	107	8.43341	0.00277	117.85727	 62LeuH	 79IleHd1*	 62LeuN	2.72566e+06	2.85774e+07	26.35896	55.44965	36.83835	1.00000	None	parabolic	box sum
85	108	8.43218	-0.14940	117.90564	 62LeuH	 79IleHg2*	 62LeuN	2.16586e+06	2.01388e+07	25.09981	38.21265	38.14209	1.00000	None	parabolic	box sum
86	109	7.66259	-0.14540	117.77051	 82HisH	 79IleHg2*	 82HisN	3.59352e+06	3.95232e+07	30.84689	40.28938	41.35662	1.00000	None	parabolic	box sum
87	110	7.61881	1.28705	101.55764	 70ThrH	 70ThrHg2*	 70ThrN	4.24399e+07	6.08874e+08	32.04942	54.86855	40.32159	1.00000	None	parabolic	box sum
88	112	7.61847	4.49745	101.55614	 70ThrH	 70ThrHa	 70ThrN	2.75923e+07	3.61248e+08	32.34565	48.94346	40.57324	1.00000	None	parabolic	box sum
89	113	7.61891	4.31782	101.55730	 70ThrH	 69AlaHa	 70ThrN	2.21696e+07	3.13592e+08	32.05359	56.22892	40.34305	1.00000	None	parabolic	box sum
90	114	7.61872	4.14675	101.55214	 70ThrH	 {*}H*	 70ThrN	2.71777e+07	3.94293e+08	32.26548	57.65062	40.70389	1.00000	None	parabolic	box sum
91	115	7.62002	3.88487	101.56048	 70ThrH	 (71Gly/68Thr)Ha*	 70ThrN	1.05370e+07	1.71493e+08	32.75752	74.76652	40.05849	1.00000	None	parabolic	box sum
92	120	7.30769	5.07208	109.58520	 84ThrH	 83ProHa	 84ThrN	1.57400e+07	2.07056e+08	29.47837	56.41607	39.11400	1.00000	None	parabolic	box sum
93	121	7.30783	4.95736	109.58101	 84ThrH	 82HisHa	 84ThrN	5.96265e+06	1.00519e+08	29.41132	134.55422	38.41782	1.00000	None	parabolic	box sum
94	122	7.83880	4.79281	110.75961	 77ThrH	 77ThrHb	 77ThrN	1.54001e+07	2.43608e+08	30.60818	67.30414	41.87977	1.00000	None	parabolic	box sum
95	128	8.77702	4.74384	111.71774	 15ThrH	 14LeuHa	 15ThrN	1.03214e+08	1.37669e+09	29.73974	51.45032	39.34467	1.00000	None	parabolic	box sum
96	136	7.59157	6.91516	112.91727	 73AsnHd2b	 73AsnHd2a	 73AsnNd2	8.63014e+07	1.16229e+09	28.76490	53.25242	39.18791	1.00000	None	parabolic	box sum
97	150	8.98136	4.83683	117.68809	 75SerH	 74LeuHa	 75SerN	1.26513e+07	1.99521e+08	35.30741	67.77261	40.16948	1.00000	None	parabolic	box sum
98	151	7.66312	5.08678	117.75296	 82HisH	 83ProHa	 82HisN	4.14256e+06	3.48403e+07	31.55172	33.84315	37.63413	1.00000	None	parabolic	box sum
99	152	7.66177	4.95741	117.76270	 82HisH	 82HisHa	 82HisN	2.52063e+07	3.32595e+08	30.93451	51.16272	39.16746	1.00000	None	parabolic	box sum
100	159	8.46038	4.77763	118.92765	 73AsnH	 73AsnHa	 73AsnN	2.71418e+07	4.11479e+08	31.16995	61.58154	38.13994	1.00000	None	parabolic	box sum
101	162	8.21547	5.07508	119.11101	 49PheH	 83ProHa	 49PheN	3.87547e+06	4.23569e+07	26.23141	50.82872	38.52582	1.00000	None	parabolic	box sum
102	173	8.10075	4.91876	121.65339	 55AspH	 55AspHa	 55AspN	3.01621e+07	3.77852e+08	30.25234	48.15830	39.54303	1.00000	None	parabolic	box sum
103	181	9.00621	4.91904	123.56755	 59AlaH	 55AspHa	 59AlaN	2.67273e+06	3.14106e+07	26.73015	41.09322	40.98833	1.00000	None	parabolic	box sum
104	183	6.56881	6.33305	112.49731	 95GlnHe2b	 95GlnHe2a	 95GlnNe2	2.43723e+08	3.00553e+09	27.84401	47.20368	39.41965	1.00000	None	parabolic	box sum
105	184	6.32599	6.57600	112.49839	 95GlnHe2a	 95GlnHe2b	 95GlnNe2	1.93347e+08	2.59743e+09	27.96829	53.13663	38.87749	1.00000	None	parabolic	box sum
106	185	7.07863	6.82611	111.74455	 30GlnHe2b	 30GlnHe2a	 30GlnNe2	1.85473e+08	2.64319e+09	30.20972	53.18892	42.55950	1.00000	None	parabolic	box sum
107	186	6.82386	7.08222	111.74853	 30GlnHe2a	 30GlnHe2b	 30GlnNe2	1.77434e+08	2.43692e+09	29.38300	52.37250	41.78178	1.00000	None	parabolic	box sum
108	187	7.07842	8.24345	111.72616	 30GlnHe2b	 30GlnH	 30GlnNe2	4.50596e+06	6.10613e+07	31.38453	51.12743	41.40890	1.00000	None	parabolic	box sum
109	188	6.82230	8.24460	111.68721	 30GlnHe2a	 30GlnH	 30GlnNe2	1.81123e+06	1.85936e+07	28.85669	48.34113	32.02105	1.00000	None	parabolic	box sum
110	190	7.07834	1.27743	111.85137	 30GlnHe2b	 68ThrHg2*	 30GlnNe2	1.25882e+06	1.15862e+07	30.46125	35.11526	47.06895	1.00000	None	parabolic	box sum
111	191	7.07938	4.13632	111.74019	 30GlnHe2b	 30GlnHa	 30GlnNe2	7.20668e+06	1.03515e+08	29.64199	59.96365	42.05680	1.00000	None	parabolic	box sum
112	192	6.82356	4.13977	111.73904	 30GlnHe2a	 30GlnHa	 30GlnNe2	4.99323e+06	6.57723e+07	29.45244	55.65961	41.14676	1.00000	None	parabolic	box sum
113	193	7.07735	3.57822	111.71224	 30GlnHe2b	 65HisHbb	 30GlnNe2	1.25416e+06	1.16827e+07	29.33532	48.17835	32.99558	1.00000	None	parabolic	box sum
114	194	7.08075	2.95744	111.74042	 30GlnHe2b	 29AspHbb	 30GlnNe2	2.90360e+06	2.25153e+07	29.19793	36.36436	40.02261	1.00000	None	parabolic	box sum
115	195	7.07904	2.80433	111.73346	 30GlnHe2b	 30GlnHgb	 30GlnNe2	2.33392e+07	3.37119e+08	30.44873	54.55951	42.82439	1.00000	None	parabolic	box sum
116	196	6.82406	2.80396	111.76128	 30GlnHe2a	 30GlnHgb	 30GlnNe2	1.37524e+07	1.92288e+08	28.85550	53.53137	40.10773	1.00000	None	parabolic	box sum
117	197	7.07875	2.60436	111.73666	 30GlnHe2b	 29AspHba	 30GlnNe2	3.30209e+06	4.89979e+07	29.90454	55.83142	43.49220	1.00000	None	parabolic	box sum
118	198	6.82780	2.59524	111.74646	 30GlnHe2a	 29AspHba	 30GlnNe2	1.70558e+06	1.76456e+07	33.78868	41.60965	36.57281	1.00000	None	parabolic	box sum
119	200	7.07902	2.00768	111.74064	 30GlnHe2b	 30GlnHba	 30GlnNe2	1.76575e+07	2.65374e+08	29.49357	60.98550	43.26296	1.00000	None	parabolic	box sum
120	201	6.82423	2.00626	111.74268	 30GlnHe2a	 30Gln(Hba/Hga)	 30GlnNe2	1.09925e+07	1.59289e+08	29.76865	58.19909	41.18741	1.00000	None	parabolic	box sum
121	202	7.07907	1.53862	111.73165	 30GlnHe2b	 69AlaHb*	 30GlnNe2	1.05791e+07	1.48377e+08	30.40731	57.83934	41.98897	1.00000	None	parabolic	box sum
122	203	6.82374	1.53778	111.74032	 30GlnHe2a	 69AlaHb*	 30GlnNe2	9.33269e+06	1.27702e+08	28.57476	53.08198	42.06169	1.00000	None	parabolic	box sum
123	204	6.82744	1.26428	111.70465	 30GlnHe2a	 68ThrHg2*	 30GlnNe2	1.39845e+06	2.13777e+07	27.34601	54.65466	42.42575	1.00000	None	parabolic	box sum
124	205	7.07924	0.92296	111.73641	 30GlnHe2b	 26LeuHdb*	 30GlnNe2	1.32865e+07	1.86093e+08	30.41118	53.04345	43.23232	1.00000	None	parabolic	box sum
125	206	6.82334	0.92190	111.74672	 30GlnHe2a	 26LeuHdb*	 30GlnNe2	8.28791e+06	1.12285e+08	28.82808	52.58855	39.70039	1.00000	None	parabolic	box sum
126	207	7.07914	0.77239	111.73908	 30GlnHe2b	 26LeuHda*	 30GlnNe2	6.36169e+06	9.12212e+07	30.79951	56.13613	44.42751	1.00000	None	parabolic	box sum
127	208	6.82390	0.77057	111.73263	 30GlnHe2a	 26LeuHda*	 30GlnNe2	3.91365e+06	5.28480e+07	27.84759	55.00773	37.84370	1.00000	None	parabolic	box sum
128	209	7.07732	4.33465	111.78033	 30GlnHe2b	 26LeuHa	 30GlnNe2	3.38046e+06	4.46349e+07	28.30625	49.20099	42.51945	1.00000	None	parabolic	box sum
129	210	6.82614	4.32988	111.73160	 30GlnHe2a	 26LeuHa	 30GlnNe2	2.63043e+06	3.07709e+07	26.46625	48.75867	37.31978	1.00000	None	parabolic	box sum
130	213	7.11185	4.34882	109.39755	 19GlnHe2b	 11LeuHa	 19GlnNe2	5.95723e+06	8.41870e+07	31.40807	54.87680	39.26051	1.00000	None	parabolic	box sum
131	214	6.74780	4.34729	109.38615	 19GlnHe2a	 11LeuHa	 19GlnNe2	5.59649e+06	7.72095e+07	28.93388	54.20645	38.59866	1.00000	None	parabolic	box sum
132	215	7.11181	4.13886	109.39993	 19GlnHe2b	 12AlaHa	 19GlnNe2	8.36214e+06	1.27852e+08	30.41804	60.35996	41.87751	1.00000	None	parabolic	box sum
133	216	6.74743	4.14139	109.39121	 19GlnHe2a	 12AlaHa	 19GlnNe2	7.31451e+06	1.05085e+08	29.00690	56.85524	40.37583	1.00000	None	parabolic	box sum
134	217	7.11177	3.84392	109.37278	 19GlnHe2b	 19GlnHa	 19GlnNe2	5.19302e+06	6.90449e+07	29.31356	49.24385	43.04087	1.00000	None	parabolic	box sum
135	220	7.11237	2.85117	109.38176	 19GlnHe2b	 19GlnHgb	 19GlnNe2	1.82162e+07	2.65391e+08	31.08859	56.21437	42.37032	1.00000	None	parabolic	box sum
136	221	6.74674	2.85100	109.39289	 19GlnHe2a	 19GlnHgb	 19GlnNe2	1.47733e+07	2.05641e+08	30.81948	54.76436	40.82596	1.00000	None	parabolic	box sum
137	222	7.11155	2.45863	109.37990	 19GlnHe2b	 19GlnHbb	 19GlnNe2	4.27921e+06	6.23647e+07	30.71278	60.15119	41.45908	1.00000	None	parabolic	box sum
138	223	6.74687	2.45902	109.39135	 19GlnHe2a	 19GlnHbb	 19GlnNe2	3.24394e+06	4.18019e+07	29.02091	53.28525	39.05571	1.00000	None	parabolic	box sum
139	224	7.11196	2.25456	109.37364	 19GlnHe2b	 19GlnHga	 19GlnNe2	2.20968e+07	3.18805e+08	31.20482	55.77795	42.80782	1.00000	None	parabolic	box sum
140	225	6.74687	2.25403	109.39195	 19GlnHe2a	 19GlnHga	 19GlnNe2	1.77624e+07	2.51977e+08	30.40612	55.92932	40.40968	1.00000	None	parabolic	box sum
141	227	7.11228	1.91622	109.37882	 19GlnHe2b	 14Leu(Hbb/Hba/Hg)	 19GlnNe2	1.90048e+07	2.75410e+08	31.10528	59.28110	41.78798	1.00000	None	parabolic	box sum
142	228	6.74736	1.92100	109.39316	 19GlnHe2a	 {*}(Hb/Hba/Hg/Hbb)	 19GlnNe2	1.63090e+07	2.38686e+08	30.75689	58.57379	41.02862	1.00000	None	parabolic	box sum
143	229	7.11178	1.75427	109.39085	 19GlnHe2b	 11LeuHbb	 19GlnNe2	1.07909e+07	1.69372e+08	31.44890	67.92535	41.81004	1.00000	None	parabolic	box sum
144	230	6.74652	1.75439	109.39127	 19GlnHe2a	 11LeuHbb	 19GlnNe2	7.56424e+06	1.11222e+08	28.89335	64.74264	38.43141	1.00000	None	parabolic	box sum
145	231	7.11219	1.49416	109.37190	 19GlnHe2b	 11LeuHba	 19GlnNe2	1.39577e+07	2.15922e+08	30.65616	63.96848	41.79490	1.00000	None	parabolic	box sum
146	232	6.74740	1.49387	109.39440	 19GlnHe2a	 11LeuHba	 19GlnNe2	1.15791e+07	1.80852e+08	30.23893	66.75252	39.83808	1.00000	None	parabolic	box sum
147	233	6.74121	1.20232	109.36519	 19GlnHe2a	 99IleHg1a	 19GlnNe2	1.15557e+06	1.18945e+07	28.49400	48.44571	39.43574	1.00000	None	parabolic	box sum
148	234	7.11181	0.87647	109.37792	 19GlnHe2b	 14LeuHdb*	 19GlnNe2	1.11418e+07	1.84957e+08	30.70623	127.18168	42.09697	1.00000	None	parabolic	box sum
149	235	6.74708	0.87154	109.39260	 19GlnHe2a	 (14Leu/99Ile)(Hd*/Hg2*)	 19GlnNe2	9.75147e+06	1.62945e+08	29.96504	127.54143	40.73656	1.00000	None	parabolic	box sum
150	236	7.11179	0.77976	109.38233	 19GlnHe2b	 (14Leu/11Leu)(Hda*/Hdb*)	 19GlnNe2	1.17450e+07	2.22637e+08	30.77090	125.15725	42.07075	1.00000	None	parabolic	box sum
151	237	6.74670	0.79205	109.38373	 19GlnHe2a	 (99Ile/11Leu)(Hd1*/Hdb*)	 19GlnNe2	1.08546e+07	2.00267e+08	30.60639	122.61029	41.58592	1.00000	None	parabolic	box sum
152	238	6.91142	7.59460	112.91603	 73AsnHd2a	 73AsnHd2b	 73AsnNd2	9.03280e+07	1.18514e+09	26.99465	51.23368	40.67230	1.00000	None	parabolic	box sum
153	239	7.59080	2.70047	112.90377	 73AsnHd2b	 73AsnHba	 73AsnNd2	6.42848e+06	9.34638e+07	28.82838	59.30862	41.14950	1.00000	None	parabolic	box sum
154	240	6.91254	2.70305	112.91480	 73AsnHd2a	 73AsnHba	 73AsnNd2	5.08262e+06	7.53366e+07	27.52274	60.85300	41.65995	1.00000	None	parabolic	box sum
155	241	7.44098	6.57715	114.41416	 95GlnH	 95GlnHe2b	 95GlnN	6.99337e+06	9.59312e+07	28.93448	54.71442	40.47847	1.00000	None	parabolic	box sum
156	242	7.44147	6.33282	114.41623	 95GlnH	 95GlnHe2a	 95GlnN	3.47104e+06	4.21611e+07	28.97203	46.38215	40.70234	1.00000	None	parabolic	box sum
157	243	7.61891	8.60009	101.55767	 70ThrH	 71GlyH	 70ThrN	6.01751e+07	8.43864e+08	32.32419	54.26857	40.12251	1.00000	None	parabolic	box sum
158	244	7.61830	8.26445	101.57210	 70ThrH	 68ThrH	 70ThrN	6.41188e+06	8.60717e+07	34.18505	47.88426	45.76373	1.00000	None	parabolic	box sum
159	245	7.61834	7.98450	101.56177	 70ThrH	 69AlaH	 70ThrN	3.04152e+07	4.00959e+08	32.10545	52.00302	39.87646	1.00000	None	parabolic	box sum
160	246	7.61853	1.53671	101.54978	 70ThrH	 69AlaHb*	 70ThrN	3.57242e+07	4.97761e+08	32.05806	54.07120	39.78300	1.00000	None	parabolic	box sum
161	247	7.61846	0.78819	101.55979	 70ThrH	 74LeuHda*	 70ThrN	1.43070e+07	2.40548e+08	32.14508	120.35663	40.19415	1.00000	None	parabolic	box sum
162	248	8.59244	7.63377	111.22763	 71GlyH	 70ThrH	 71GlyN	7.08404e+07	1.10424e+09	31.87835	79.93593	39.69371	1.00000	None	parabolic	box sum
163	249	8.59239	4.48998	111.22348	 71GlyH	 70ThrHa	 71GlyN	1.37587e+07	1.87092e+08	31.22568	54.81114	38.39064	1.00000	None	parabolic	box sum
164	250	8.59226	4.31312	111.22761	 71GlyH	 71GlyHab	 71GlyN	5.35940e+07	7.46681e+08	31.73441	54.78362	39.54363	1.00000	None	parabolic	box sum
165	251	8.59225	4.15168	111.22614	 71GlyH	 70ThrHb	 71GlyN	1.68894e+07	2.19269e+08	32.04823	49.96689	39.68489	1.00000	None	parabolic	box sum
166	252	8.59222	3.87744	111.22719	 71GlyH	 71GlyHaa	 71GlyN	6.18574e+07	9.16194e+08	31.76123	58.45230	39.63208	1.00000	None	parabolic	box sum
167	253	8.59228	1.53946	111.23776	 71GlyH	 69AlaHb*	 71GlyN	1.32469e+07	2.15033e+08	31.74812	77.14678	39.96944	1.00000	None	parabolic	box sum
168	254	8.59213	1.27521	111.22750	 71GlyH	 70ThrHg2*	 71GlyN	1.71808e+07	2.52511e+08	31.74007	59.36209	40.01510	1.00000	None	parabolic	box sum
169	256	8.59269	0.81722	111.22571	 71GlyH	 (72Leu/74Leu)Hda*	 71GlyN	8.01075e+06	1.43115e+08	31.99130	131.19399	39.24394	1.00000	None	parabolic	box sum
170	257	7.73696	8.12790	102.82942	 53GlyH	 54PheH	 53GlyN	6.86973e+07	1.06419e+09	30.71964	62.28837	40.47656	1.00000	None	parabolic	box sum
171	259	7.73889	4.54740	102.83525	 53GlyH	 51AspHa	 53GlyN	7.28963e+06	8.15111e+07	30.62338	45.06012	39.70683	1.00000	None	parabolic	box sum
172	260	7.73711	4.38407	102.82706	 53GlyH	 53GlyHab	 53GlyN	4.40930e+07	7.68893e+08	30.68238	76.92975	40.58290	1.00000	None	parabolic	box sum
173	261	7.73739	4.09555	102.79936	 53GlyH	 54PheHa	 53GlyN	3.67020e+06	5.80566e+07	29.65808	59.88383	40.53652	1.00000	None	parabolic	box sum
174	262	7.73711	3.81175	102.82673	 53GlyH	 53GlyHaa	 53GlyN	5.81781e+07	8.00065e+08	30.67434	52.81541	40.26830	1.00000	None	parabolic	box sum
175	263	7.73715	2.83165	102.82075	 53GlyH	 (54Phe/51Asp)Hb*	 53GlyN	8.93646e+06	1.31708e+08	31.59225	58.16450	39.86120	1.00000	None	parabolic	box sum
176	264	7.73668	2.68313	102.82318	 53GlyH	 49PheHbb	 53GlyN	5.78719e+06	8.31242e+07	30.18677	58.58362	39.72709	1.00000	None	parabolic	box sum
177	265	7.73731	2.31176	102.82365	 53GlyH	 52LeuHbb	 53GlyN	1.03822e+07	1.47227e+08	29.92183	55.81334	39.84129	1.00000	None	parabolic	box sum
178	266	7.73707	1.83447	102.82220	 53GlyH	 52LeuHba	 53GlyN	1.46897e+07	2.14928e+08	30.93570	58.23881	40.95840	1.00000	None	parabolic	box sum
179	267	7.73730	0.99607	102.82344	 53GlyH	 52LeuHdb*	 53GlyN	4.60498e+06	5.90914e+07	27.90987	52.79182	38.76567	1.00000	None	parabolic	box sum
180	268	7.73748	0.76308	102.82736	 53GlyH	 52LeuHda*	 53GlyN	4.53750e+06	6.02987e+07	29.70368	54.33108	40.51423	1.00000	None	parabolic	box sum
181	269	8.12197	7.74036	118.00110	 100GlyH	 99IleH	 100GlyN	1.72704e+07	2.48870e+08	24.71149	59.33152	38.26630	1.00000	None	parabolic	box sum
182	270	7.74553	8.18098	106.96627	 36GlyH	 37TyrH	 36GlyN	6.09826e+07	7.69711e+08	30.40224	47.48942	39.62636	1.00000	None	parabolic	box sum
183	271	7.74662	7.61866	106.94319	 36GlyH	 35LeuH	 36GlyN	3.33574e+07	4.00692e+08	30.80666	45.32354	40.11869	1.00000	None	parabolic	box sum
184	272	7.74544	3.82400	106.96050	 36GlyH	 36GlyHaa	 36GlyN	5.91887e+07	8.96597e+08	30.50983	59.11046	39.87920	1.00000	None	parabolic	box sum
185	273	7.74558	4.06675	106.96125	 36GlyH	 36GlyHab	 36GlyN	5.44963e+07	8.13197e+08	30.42132	61.97629	40.14349	1.00000	None	parabolic	box sum
186	274	7.74554	4.30693	106.96245	 36GlyH	 33SerHa	 36GlyN	1.46113e+07	1.86932e+08	30.33876	50.50396	39.15191	1.00000	None	parabolic	box sum
187	275	7.74629	3.32983	106.97478	 36GlyH	 37TyrHbb	 36GlyN	3.62023e+06	4.98606e+07	32.85825	52.68212	40.54844	1.00000	None	parabolic	box sum
188	276	7.74435	2.91874	106.96878	 36GlyH	 37TyrHba	 36GlyN	5.95524e+06	8.34610e+07	30.77805	56.28278	38.24699	1.00000	None	parabolic	box sum
189	277	7.74658	2.25331	106.97289	 36GlyH	 34ValHb	 36GlyN	4.12476e+06	5.26475e+07	32.49198	48.95329	40.16769	1.00000	None	parabolic	box sum
190	278	7.74519	1.40339	106.96759	 36GlyH	 35LeuHbb	 36GlyN	1.69281e+07	2.46775e+08	31.13508	61.76515	40.00032	1.00000	None	parabolic	box sum
191	279	7.74492	1.18055	106.96111	 36GlyH	 35LeuHba	 36GlyN	8.99719e+06	1.29616e+08	30.41983	56.95314	40.74121	1.00000	None	parabolic	box sum
192	280	7.74477	0.87886	106.96819	 36GlyH	 34ValHga*	 36GlyN	4.49310e+06	6.00966e+07	29.40089	51.62371	40.56883	1.00000	None	parabolic	box sum
193	281	7.74465	0.62373	106.95420	 36GlyH	 35LeuHdb*	 36GlyN	4.76522e+06	6.24800e+07	31.37022	47.71402	40.73381	1.00000	None	parabolic	box sum
194	282	7.74544	0.11737	106.97517	 36GlyH	 35LeuHda*	 36GlyN	5.33729e+06	6.59106e+07	28.43231	46.81484	39.47628	1.00000	None	parabolic	box sum
195	283	8.17368	7.74998	119.88155	 37TyrH	 36GlyH	 37TyrN	5.72336e+07	7.37932e+08	29.33145	50.82882	40.78507	1.00000	None	parabolic	box sum
196	284	8.44260	7.73947	107.93431	 98GlyH	 99IleH	 98GlyN	5.12015e+06	7.41059e+07	33.05763	56.29173	42.08267	1.00000	None	parabolic	box sum
197	285	8.44227	4.47839	107.90564	 98GlyH	 97ProHa	 98GlyN	2.19596e+07	2.92482e+08	32.71967	51.23722	39.17623	1.00000	None	parabolic	box sum
198	286	8.44171	3.96479	107.89767	 98GlyH	 98GlyHaa	 98GlyN	2.59984e+07	3.66872e+08	33.18727	55.54952	38.96415	1.00000	None	parabolic	box sum
199	287	8.44212	2.30177	107.89445	 98GlyH	 97ProHbb	 98GlyN	3.88141e+06	5.20022e+07	38.58954	50.50278	39.31451	1.00000	None	parabolic	box sum
200	288	8.44145	1.94184	107.91551	 98GlyH	 96IleHb	 98GlyN	3.79457e+06	6.32737e+07	31.94332	64.61839	41.62610	1.00000	None	parabolic	box sum
201	289	7.74011	8.45282	117.96398	 99IleH	 98GlyH	 99IleN	6.97006e+06	1.02851e+08	24.31333	52.76154	41.79019	1.00000	None	parabolic	box sum
202	290	7.73823	8.12960	117.99928	 99IleH	 100GlyH	 99IleN	1.24693e+07	1.76359e+08	26.96455	52.72144	37.24271	1.00000	None	parabolic	box sum
203	291	7.57365	4.39084	108.62247	 79IleH	 77ThrHa	 79IleN	4.95502e+06	6.80676e+07	29.52754	54.62675	40.13491	1.00000	None	parabolic	box sum
204	292	7.57497	4.03026	108.63012	 79IleH	 78LeuHa	 79IleN	1.08905e+07	1.46705e+08	32.18889	52.86416	41.95917	1.00000	None	parabolic	box sum
205	293	7.57563	3.85446	108.63905	 79IleH	 79IleHa	 79IleN	2.56014e+07	3.31205e+08	30.85643	49.13730	40.34829	1.00000	None	parabolic	box sum
206	294	7.57567	2.11404	108.62998	 79IleH	 78LeuHbb	 79IleN	1.89233e+07	2.83453e+08	31.43102	62.84755	40.94219	1.00000	None	parabolic	box sum
207	295	7.57586	7.32900	108.63027	 79IleH	 78LeuH	 79IleN	1.58054e+07	2.00294e+08	32.59212	44.54840	43.73598	1.00000	None	parabolic	box sum
208	296	7.57389	7.99202	108.65874	 79IleH	 81AspH	 79IleN	4.38141e+06	6.13185e+07	31.05789	64.66086	41.54813	1.00000	None	parabolic	box sum
209	297	7.30662	8.51960	109.59025	 84ThrH	 88ValH	 84ThrN	1.23909e+07	1.67684e+08	29.78355	55.35165	39.33179	1.00000	None	parabolic	box sum
210	298	7.30736	8.22207	109.58260	 84ThrH	 87AlaH	 84ThrN	1.90832e+07	2.40085e+08	29.26141	49.57549	38.68365	1.00000	None	parabolic	box sum
211	300	7.30729	4.47636	109.58996	 84ThrH	 84ThrHa	 84ThrN	2.33858e+07	3.23511e+08	29.88309	65.00842	39.38758	1.00000	None	parabolic	box sum
212	301	7.30877	4.20789	109.59779	 84ThrH	 87AlaHa	 84ThrN	6.56361e+06	9.64038e+07	31.10319	54.40107	40.10916	1.00000	None	parabolic	box sum
213	302	7.30557	3.80935	109.58279	 84ThrH	 85ProHdb	 84ThrN	4.99380e+06	6.55499e+07	29.55735	51.54232	40.14206	1.00000	None	parabolic	box sum
214	303	7.30742	3.66618	109.58025	 84ThrH	 83ProHdb	 84ThrN	1.15116e+07	1.52602e+08	30.00498	51.81086	39.32774	1.00000	None	parabolic	box sum
215	304	7.30762	3.42887	109.58181	 84ThrH	 83ProHda	 84ThrN	9.08534e+06	1.17946e+08	30.66272	51.10590	39.28602	1.00000	None	parabolic	box sum
216	305	7.30667	3.11829	109.59570	 84ThrH	 82HisHbb	 84ThrN	4.31829e+06	5.28156e+07	28.79471	46.49204	37.79542	1.00000	None	parabolic	box sum
217	308	7.30751	1.96479	109.59026	 84ThrH	 83ProHba	 84ThrN	9.61017e+06	1.39317e+08	30.00647	104.49416	38.65314	1.00000	None	parabolic	box sum
218	309	7.30730	1.73915	109.58596	 84ThrH	 87AlaHb*	 84ThrN	1.18299e+08	1.52681e+09	30.11405	50.17251	39.43515	1.00000	None	parabolic	box sum
219	310	7.30774	1.31528	109.58750	 84ThrH	 88ValHgb*	 84ThrN	1.41319e+07	1.88918e+08	29.90097	53.11618	39.94298	1.00000	None	parabolic	box sum
220	311	7.30734	1.00842	109.58752	 84ThrH	 84ThrHg2*	 84ThrN	3.18899e+07	4.09109e+08	29.69325	50.63292	39.08336	1.00000	None	parabolic	box sum
221	312	8.21605	7.31472	121.64002	 87AlaH	 84ThrH	 87AlaN	1.32446e+07	1.81613e+08	31.71831	52.78297	40.76272	1.00000	None	parabolic	box sum
222	313	8.21557	8.50461	121.63066	 87AlaH	 {*}H	 87AlaN	4.68676e+07	6.83013e+08	28.73659	61.16960	39.25884	1.00000	None	parabolic	box sum
223	314	8.21626	6.85480	121.62981	 87AlaH	 86HisHd2	 87AlaN	7.73458e+06	9.53100e+07	30.82544	46.12050	39.33883	1.00000	None	parabolic	box sum
224	315	8.21585	4.20433	121.63746	 87AlaH	 87AlaHa	 87AlaN	3.66770e+07	5.04192e+08	30.27231	52.68606	40.20655	1.00000	None	parabolic	box sum
225	316	8.21420	4.06853	121.65705	 87AlaH	 85ProHa	 87AlaN	6.92602e+06	7.21284e+07	132.97558	35.42901	43.60318	1.00000	None	parabolic	box sum
226	317	8.21590	3.93058	121.64515	 87AlaH	 86HisHa	 87AlaN	1.49200e+07	1.94586e+08	30.87461	51.36500	39.53367	1.00000	None	parabolic	box sum
227	318	8.21545	3.42117	121.63211	 87AlaH	 88ValHa	 87AlaN	3.78322e+06	4.85211e+07	29.35499	48.42055	39.67232	1.00000	None	parabolic	box sum
228	319	8.21514	2.87163	121.63335	 87AlaH	 86HisHbb	 87AlaN	3.42679e+07	4.94900e+08	28.34082	57.49650	39.87283	1.00000	None	parabolic	box sum
229	321	8.21939	2.33594	121.64579	 87AlaH	 88ValHb	 87AlaN	7.36213e+06	1.18399e+08	43.17105	73.75332	39.46054	1.00000	None	parabolic	box sum
230	322	8.21627	1.73979	121.64128	 87AlaH	 87AlaHb*	 87AlaN	9.09347e+07	1.19048e+09	31.46261	50.42611	39.71070	1.00000	None	parabolic	box sum
231	323	8.21529	1.32268	121.63580	 87AlaH	 88ValHgb*	 87AlaN	7.72405e+06	1.19944e+08	28.97799	116.70526	39.37083	1.00000	None	parabolic	box sum
232	324	8.24606	0.99805	121.78086	 44AspH	 52LeuHdb*	 44AspN	1.17513e+07	1.82792e+08	86.94828	68.12233	40.69489	1.00000	None	parabolic	box sum
233	325	8.52125	7.01065	119.49939	 88ValH	 49PheHe*	 88ValN	7.30871e+06	1.02643e+08	30.01690	54.96507	41.64207	1.00000	None	parabolic	box sum
234	326	8.52201	7.31250	119.48981	 88ValH	 84ThrH	 88ValN	7.91553e+06	1.10561e+08	30.21508	53.41814	41.03863	1.00000	None	parabolic	box sum
235	327	8.77642	7.55924	111.72208	 15ThrH	 18GluH	 15ThrN	9.25429e+06	1.28748e+08	29.40536	54.31113	39.35230	1.00000	None	parabolic	box sum
236	328	8.77683	7.36193	111.72089	 15ThrH	 14LeuH	 15ThrN	7.18959e+06	9.11045e+07	29.14488	50.56903	37.65285	1.00000	None	parabolic	box sum
237	329	8.77679	4.40006	111.72110	 15ThrH	 15ThrHa	 15ThrN	3.19515e+07	3.89401e+08	29.80500	47.01300	38.79571	1.00000	None	parabolic	box sum
238	330	8.77744	4.17159	111.73143	 15ThrH	 18GluHa	 15ThrN	5.58246e+06	8.28400e+07	30.54112	64.16900	39.51168	1.00000	None	parabolic	box sum
239	331	8.77550	2.85127	111.72084	 15ThrH	 19GlnHgb	 15ThrN	4.28974e+06	5.81227e+07	30.14505	53.73189	39.90579	1.00000	None	parabolic	box sum
240	332	8.77697	2.37568	111.71767	 15ThrH	 18GluHbb	 15ThrN	4.17591e+07	6.19139e+08	29.87891	66.17967	39.27982	1.00000	None	parabolic	box sum
241	333	8.77696	2.08795	111.72295	 15ThrH	 18GluHba	 15ThrN	2.19558e+07	2.85873e+08	29.55556	51.05872	38.82289	1.00000	None	parabolic	box sum
242	334	8.77707	1.90927	111.72605	 15ThrH	 14Leu(Hbb/Hg)	 15ThrN	1.76395e+07	2.34548e+08	29.89799	52.18791	39.72840	1.00000	None	parabolic	box sum
243	335	8.77693	1.73410	111.71864	 15ThrH	 14LeuHba	 15ThrN	3.24930e+07	4.89120e+08	29.92362	65.89227	39.10625	1.00000	None	parabolic	box sum
244	336	8.77708	1.42802	111.71864	 15ThrH	 15ThrHg2*	 15ThrN	7.53812e+07	1.02134e+09	29.92600	53.28210	39.35599	1.00000	None	parabolic	box sum
245	337	8.77726	0.86827	111.71825	 15ThrH	 14LeuHda*	 15ThrN	2.72421e+07	3.89399e+08	30.39151	57.73044	39.36291	1.00000	None	parabolic	box sum
246	338	8.92468	2.04737	113.63166	 58ThrH	 57LeuHbb	 58ThrN	4.03774e+07	5.37570e+08	29.65599	51.66814	39.32774	1.00000	None	parabolic	box sum
247	339	8.92472	1.75182	113.63203	 58ThrH	 57LeuHba	 58ThrN	3.41337e+07	4.71939e+08	29.81544	53.87304	39.53969	1.00000	None	parabolic	box sum
248	340	8.92488	1.40782	113.63817	 58ThrH	 59AlaHb*	 58ThrN	1.06089e+07	1.05710e+08	30.54142	38.20872	38.88094	1.00000	None	parabolic	box sum
249	341	8.92468	1.24133	113.63121	 58ThrH	 58ThrHg2*	 58ThrN	4.96961e+07	6.60502e+08	29.59907	51.27379	39.37805	1.00000	None	parabolic	box sum
250	342	8.92483	0.99882	113.62849	 58ThrH	 57LeuHdb*	 58ThrN	9.38410e+06	1.36097e+08	29.98203	64.95613	39.28208	1.00000	None	parabolic	box sum
251	343	8.92461	4.47527	113.63174	 58ThrH	 57LeuHa	 58ThrN	1.42289e+07	1.89155e+08	30.40642	52.15370	39.50953	1.00000	None	parabolic	box sum
252	345	8.92453	4.12018	113.63323	 58ThrH	 58ThrHa	 58ThrN	4.64622e+07	6.49531e+08	29.65599	54.49110	39.46865	1.00000	None	parabolic	box sum
253	346	8.92590	3.86128	113.62406	 58ThrH	 59AlaHa	 58ThrN	3.40990e+06	4.44973e+07	29.97279	47.79069	41.12744	1.00000	None	parabolic	box sum
254	347	8.92397	8.32240	113.63003	 58ThrH	 57LeuH	 58ThrN	6.72689e+07	8.93167e+08	29.39343	51.34957	39.60931	1.00000	None	parabolic	box sum
255	348	8.92463	8.10348	113.63456	 58ThrH	 55AspH	 58ThrN	1.73410e+07	2.23840e+08	29.61993	50.11118	39.94060	1.00000	None	parabolic	box sum
256	349	8.92474	7.22552	113.61579	 58ThrH	 60LeuH	 58ThrN	6.31126e+06	8.55254e+07	29.22654	52.07389	40.20000	1.00000	None	parabolic	box sum
257	350	8.97939	4.39875	117.66865	 75SerH	 75SerHa	 75SerN	5.03588e+06	6.10683e+07	34.94292	45.55355	39.04617	1.00000	None	parabolic	box sum
258	351	8.98138	4.04173	117.69368	 75SerH	 75SerHbb	 75SerN	6.08630e+06	8.52803e+07	36.03414	54.04564	39.39515	1.00000	None	parabolic	box sum
259	352	8.98237	3.70467	117.68081	 75SerH	 75SerHba	 75SerN	6.09046e+06	8.50483e+07	32.70000	54.05626	40.14814	1.00000	None	parabolic	box sum
260	353	8.98068	1.52567	117.67039	 75SerH	 74LeuHbb	 75SerN	5.98330e+06	8.47188e+07	35.57116	52.96678	42.05191	1.00000	None	parabolic	box sum
261	354	8.98240	0.92004	117.66801	 75SerH	 74LeuHdb*	 75SerN	4.32484e+06	6.13372e+07	35.16227	61.04290	41.49085	1.00000	None	parabolic	box sum
262	355	9.10348	8.48722	118.47945	 19GlnH	 22ValH	 19GlnN	3.83779e+06	5.54452e+07	66.89414	45.43294	58.77286	1.00000	None	parabolic	box sum
263	356	9.10183	8.18140	118.53692	 19GlnH	 17ThrH	 19GlnN	3.43225e+06	4.14440e+07	31.03286	43.27807	41.52220	1.00000	None	parabolic	box sum
264	357	9.10307	7.94452	118.52355	 19GlnH	 20ArgH	 19GlnN	2.85866e+07	3.99692e+08	29.80351	54.41650	39.87491	1.00000	None	parabolic	box sum
265	358	9.10218	7.70308	118.53444	 19GlnH	 21AlaH	 19GlnN	5.09501e+06	4.37373e+07	30.08991	149.96740	40.89755	1.00000	None	parabolic	box sum
266	359	9.10249	7.55777	118.51795	 19GlnH	 18GluH	 19GlnN	3.63247e+07	5.06859e+08	29.57791	54.45670	40.04669	1.00000	None	parabolic	box sum
267	360	9.10260	4.17016	118.51689	 19GlnH	 18GluHa	 19GlnN	2.79266e+07	4.22698e+08	29.31014	58.38389	39.85941	1.00000	None	parabolic	box sum
268	361	9.10413	3.98189	118.54882	 19GlnH	 17ThrHa	 19GlnN	3.65232e+06	4.02264e+07	26.25704	42.29101	36.84378	1.00000	None	parabolic	box sum
269	362	9.10281	3.84574	118.52256	 19GlnH	 19GlnHa	 19GlnN	3.07277e+07	4.06941e+08	29.49506	50.54878	39.76095	1.00000	None	parabolic	box sum
270	363	9.10289	2.85111	118.51884	 19GlnH	 19GlnHgb	 19GlnN	4.18587e+07	5.90758e+08	29.47077	55.95212	39.60943	1.00000	None	parabolic	box sum
271	364	9.10255	2.44439	118.52052	 19GlnH	 19GlnHbb	 19GlnN	3.60134e+07	6.52830e+08	29.18094	172.10733	39.74718	1.00000	None	parabolic	box sum
272	365	9.10280	2.26267	118.51915	 19GlnH	 19GlnHga	 19GlnN	2.89937e+07	4.45085e+08	29.40789	182.23109	40.06875	1.00000	None	parabolic	box sum
273	366	9.10329	2.08431	118.51997	 19GlnH	 18GluHba	 19GlnN	1.54101e+07	2.16977e+08	29.99336	55.26919	40.49700	1.00000	None	parabolic	box sum
274	367	9.10276	1.90343	118.51930	 19GlnH	 {*}(Hg/Hbb/Hba)	 19GlnN	3.97839e+07	5.81150e+08	29.25396	60.00689	39.73055	1.00000	None	parabolic	box sum
275	368	9.10339	1.74297	118.52046	 19GlnH	 20ArgHgb	 19GlnN	1.69725e+07	2.50838e+08	29.76567	173.05645	39.98291	1.00000	None	parabolic	box sum
276	369	9.10230	1.53077	118.50797	 19GlnH	 16AlaHb*	 19GlnN	1.02816e+07	1.56188e+08	27.93238	71.10374	40.22521	1.00000	None	parabolic	box sum
277	370	9.10298	0.87473	118.51695	 19GlnH	 (14Leu/22Val)(Hd*/Hga*)	 19GlnN	1.39111e+07	2.23352e+08	29.42100	120.57917	40.70193	1.00000	None	parabolic	box sum
278	371	9.10270	0.79138	118.52577	 19GlnH	 11LeuHdb*	 19GlnN	1.41407e+07	2.61687e+08	29.67700	119.93594	39.33358	1.00000	None	parabolic	box sum
279	372	9.23549	4.35291	119.85196	 29AspH	 29AspHa	 29AspN	5.60030e+07	7.36840e+08	28.80335	51.95240	39.41423	1.00000	None	parabolic	box sum
280	373	9.23567	3.98456	119.85129	 29AspH	 28LeuHa	 29AspN	2.61447e+07	3.41213e+08	28.80841	51.05518	39.61718	1.00000	None	parabolic	box sum
281	374	9.23365	3.44001	119.87691	 29AspH	 27ValHa	 29AspN	3.20720e+06	4.10122e+07	26.75653	51.28244	40.50559	1.00000	None	parabolic	box sum
282	375	9.23548	2.95679	119.85167	 29AspH	 29AspHbb	 29AspN	5.85590e+07	8.02301e+08	28.73600	54.62046	39.82043	1.00000	None	parabolic	box sum
283	376	9.23566	2.80330	119.85598	 29AspH	 30GlnHgb	 29AspN	3.20310e+06	2.41174e+07	25.99344	39.67682	38.51873	1.00000	None	parabolic	box sum
284	377	9.23543	2.60425	119.84900	 29AspH	 29AspHba	 29AspN	4.08113e+07	5.36258e+08	28.55927	51.50418	39.59423	1.00000	None	parabolic	box sum
285	379	9.23573	1.97338	119.85104	 29AspH	 28LeuHbb	 29AspN	3.54467e+07	5.19467e+08	28.78442	61.61182	39.71815	1.00000	None	parabolic	box sum
286	380	9.23562	1.79602	119.84577	 29AspH	 28LeuHg	 29AspN	1.05694e+07	1.62571e+08	28.00062	66.96680	40.46875	1.00000	None	parabolic	box sum
287	381	9.23574	1.56928	119.84895	 29AspH	 28LeuHba	 29AspN	2.65498e+07	4.19901e+08	28.52321	75.16913	39.62117	1.00000	None	parabolic	box sum
288	382	9.23562	1.28295	119.84690	 29AspH	 40ThrHg2*	 29AspN	1.32443e+07	1.72764e+08	28.63348	51.28676	39.51281	1.00000	None	parabolic	box sum
289	383	9.23397	1.11839	119.85535	 29AspH	 27ValHga*	 29AspN	4.08133e+06	6.80056e+07	28.03832	68.03583	38.35922	1.00000	None	parabolic	box sum
290	384	9.23533	0.88910	119.84807	 29AspH	 28LeuHdb*	 29AspN	1.26268e+07	1.90420e+08	28.91764	118.34006	40.21853	1.00000	None	parabolic	box sum
291	385	9.23568	0.77786	119.83957	 29AspH	 28LeuHda*	 29AspN	8.72388e+06	1.22410e+08	28.38433	130.72769	39.90531	1.00000	None	parabolic	box sum
292	386	8.35439	9.24299	119.34411	 28LeuH	 29AspH	 28LeuN	2.99536e+07	4.00679e+08	29.05041	52.72925	39.22868	1.00000	None	parabolic	box sum
293	387	8.24122	7.08386	118.14501	 30GlnH	 30GlnHe2b	 30GlnN	7.22704e+06	1.00824e+08	29.63394	53.93693	40.24607	1.00000	None	parabolic	box sum
294	388	8.85999	8.24482	122.52229	 31AlaH	 30GlnH	 31AlaN	4.07645e+07	5.60252e+08	29.14131	55.15733	39.74062	1.00000	None	parabolic	box sum
295	389	8.86072	8.73417	122.51612	 31AlaH	 32AlaH	 31AlaN	3.35447e+07	3.92483e+08	29.13296	44.97244	37.64307	1.00000	None	parabolic	box sum
296	390	8.85945	7.66818	122.53703	 31AlaH	 33SerH	 31AlaN	5.80544e+06	7.67052e+07	28.09227	51.96744	37.95087	1.00000	None	parabolic	box sum
297	391	8.85914	7.34563	122.51833	 31AlaH	 54PheHz	 31AlaN	4.80872e+06	6.53091e+07	30.86388	53.05347	43.68705	1.00000	None	parabolic	box sum
298	392	8.86173	4.34603	122.50898	 31AlaH	 29AspHa	 31AlaN	3.83530e+06	4.36146e+07	27.81600	46.40476	32.89711	1.00000	None	parabolic	box sum
299	393	8.86036	4.17545	122.52033	 31AlaH	 31AlaHa	 31AlaN	3.88288e+07	5.44838e+08	29.01345	58.79082	38.05274	1.00000	None	parabolic	box sum
300	394	8.86010	3.99524	122.53198	 31AlaH	 28LeuHa	 31AlaN	1.54836e+07	2.26416e+08	28.64331	58.60485	39.59650	1.00000	None	parabolic	box sum
301	395	8.85948	3.43826	122.51363	 31AlaH	 27ValHa	 31AlaN	6.18847e+06	8.60911e+07	28.76848	54.86147	38.91915	1.00000	None	parabolic	box sum
302	396	8.86025	2.80397	122.49445	 31AlaH	 30GlnHgb	 31AlaN	7.24397e+06	9.02788e+07	28.52470	55.24088	34.05792	1.00000	None	parabolic	box sum
303	397	8.86034	2.02556	122.52580	 31AlaH	 30GlnHba	 31AlaN	2.93911e+07	5.07883e+08	29.02359	83.31052	38.69981	1.00000	None	parabolic	box sum
304	398	8.86302	1.83554	122.51444	 31AlaH	 66LeuHg	 31AlaN	3.51324e+06	-1.18219e+07	28.31757	16.37438	35.38096	1.00000	None	parabolic	box sum
305	399	8.86005	1.67425	122.53194	 31AlaH	 31AlaHb*	 31AlaN	9.04161e+07	1.25056e+09	29.19286	53.84198	39.75993	1.00000	None	parabolic	box sum
306	400	8.86018	1.52334	122.51851	 31AlaH	 (32Ala/28Leu)Hb*	 31AlaN	1.23481e+07	1.05293e+08	28.90974	34.69456	37.21827	1.00000	None	parabolic	box sum
307	401	8.86308	1.29012	122.48543	 31AlaH	 40ThrHg2*	 31AlaN	3.43925e+06	4.93047e+07	29.36780	58.96381	36.95667	1.00000	None	parabolic	box sum
308	402	8.86002	1.13954	122.53454	 31AlaH	 27ValHga*	 31AlaN	6.48055e+06	7.96518e+07	28.02402	51.82305	38.45745	1.00000	None	parabolic	box sum
309	403	8.86021	0.88619	122.52979	 31AlaH	 62LeuHdb*	 31AlaN	3.23448e+07	4.38758e+08	28.81736	55.80311	39.36774	1.00000	None	parabolic	box sum
310	404	8.86065	0.77061	122.51082	 31AlaH	 {*}Hda*	 31AlaN	1.06173e+07	1.34777e+08	28.80484	137.46782	36.09651	1.00000	None	parabolic	box sum
311	405	8.86011	0.24040	122.53506	 31AlaH	 62LeuHda*	 31AlaN	6.43806e+06	7.85097e+07	27.44198	45.73047	39.73275	1.00000	None	parabolic	box sum
312	406	9.17326	8.47715	124.69111	 74LeuH	 73AsnH	 74LeuN	5.74042e+06	7.48099e+07	30.37617	50.52863	38.04788	1.00000	None	parabolic	box sum
313	409	9.17424	2.85823	124.68150	 74LeuH	 67GlnHgb	 74LeuN	1.14927e+07	1.49881e+08	32.48125	219.46947	40.07569	1.00000	None	parabolic	box sum
314	411	9.17392	2.62089	124.68242	 74LeuH	 67GlnHga	 74LeuN	1.94237e+07	3.25911e+08	32.21646	128.68006	40.00941	1.00000	None	parabolic	box sum
315	412	9.17492	2.27991	124.68359	 74LeuH	 67GlnHba	 74LeuN	4.56670e+06	6.63943e+07	31.62190	55.07378	41.77028	1.00000	None	parabolic	box sum
316	413	9.17489	2.02518	124.69365	 74LeuH	 66LeuHbb	 74LeuN	2.99919e+06	4.62920e+07	31.59061	68.30633	38.82805	1.00000	None	parabolic	box sum
317	414	9.17408	1.52875	124.68207	 74LeuH	 74LeuHbb	 74LeuN	7.65460e+07	1.06267e+09	31.91933	55.26526	39.22719	1.00000	None	parabolic	box sum
318	415	9.17586	1.36398	124.68516	 74LeuH	 74LeuHba	 74LeuN	4.38451e+06	5.96402e+07	31.64247	173.99888	40.37300	1.00000	None	parabolic	box sum
319	416	9.17430	0.91949	124.68213	 74LeuH	 74LeuHdb*	 74LeuN	1.39089e+07	1.93608e+08	31.92469	122.69285	39.32396	1.00000	None	parabolic	box sum
320	417	9.17388	0.80849	124.68113	 74LeuH	 74LeuHda*	 74LeuN	1.90798e+07	2.65832e+08	32.22331	109.87077	39.21425	1.00000	None	parabolic	box sum
321	418	8.45932	9.17704	118.91862	 73AsnH	 74LeuH	 73AsnN	4.68505e+06	6.29363e+07	30.21747	50.90150	39.48891	1.00000	None	parabolic	box sum
322	419	8.46055	4.44545	118.92982	 73AsnH	 72LeuHa	 73AsnN	7.55201e+07	9.80608e+08	31.08442	49.81237	39.03776	1.00000	None	parabolic	box sum
323	420	8.45989	2.70490	118.92876	 73AsnH	 73AsnHbb	 73AsnN	4.39812e+07	6.73161e+08	31.04508	63.68383	39.12348	1.00000	None	parabolic	box sum
324	421	8.46396	0.84091	118.76723	 73AsnH	 72LeuHda*	 73AsnN	2.70096e+07	4.91651e+08	34.48606	69.31246	65.01603	1.00000	None	parabolic	box sum
325	422	8.46085	1.22977	118.91939	 73AsnH	 72LeuHba	 73AsnN	2.44848e+07	3.27422e+08	31.86822	52.01649	40.04550	1.00000	None	parabolic	box sum
326	423	9.00540	8.32286	123.57865	 59AlaH	 57LeuH	 59AlaN	1.20686e+07	1.76543e+08	27.92940	57.71835	40.41648	1.00000	None	parabolic	box sum
327	424	9.00576	8.10382	123.58176	 59AlaH	 55AspH	 59AlaN	1.75567e+07	2.30451e+08	27.76355	50.40252	40.44303	1.00000	None	parabolic	box sum
328	425	9.00602	7.64351	123.58265	 59AlaH	 61GluH	 59AlaN	6.30400e+06	8.73592e+07	26.31202	53.97221	38.02013	1.00000	None	parabolic	box sum
329	426	9.00583	7.38956	123.58008	 59AlaH	 54PheHd*	 59AlaN	1.06445e+07	1.14829e+08	27.48325	48.70756	39.03055	1.00000	None	parabolic	box sum
330	427	9.00596	7.22435	123.58408	 59AlaH	 60LeuH	 59AlaN	3.86449e+07	5.22885e+08	28.10314	53.16454	39.86630	1.00000	None	parabolic	box sum
331	430	9.00517	4.47733	123.54358	 59AlaH	 57LeuHa	 59AlaN	5.10796e+06	6.08796e+07	27.37552	49.06023	35.55226	1.00000	None	parabolic	box sum
332	432	9.00552	4.12090	123.58194	 59AlaH	 58ThrHa	 59AlaN	2.70588e+07	3.82867e+08	28.14054	55.72487	40.52860	1.00000	None	parabolic	box sum
333	433	9.00570	3.86043	123.57643	 59AlaH	 59AlaHa	 59AlaN	3.88131e+07	5.13115e+08	27.95070	50.90774	40.11521	1.00000	None	parabolic	box sum
334	434	8.87758	8.26342	123.64578	 67GlnH	 68ThrH	 67GlnN	3.50219e+07	4.45586e+08	30.36410	50.28054	37.85717	1.00000	None	parabolic	box sum
335	435	8.87763	8.73445	123.64157	 67GlnH	 66LeuH	 67GlnN	3.93084e+07	3.64336e+08	30.05356	38.26072	38.90464	1.00000	None	parabolic	box sum
336	436	8.87751	7.99297	123.61868	 67GlnH	 69AlaH	 67GlnN	4.31348e+06	5.69372e+07	28.46628	55.94377	40.06726	1.00000	None	parabolic	box sum
337	437	8.25911	8.88308	117.38411	 68ThrH	 67GlnH	 68ThrN	3.07454e+07	4.27221e+08	27.85593	51.57343	90.17241	1.00000	None	parabolic	box sum
338	438	7.32396	7.84355	123.72652	 78LeuH	 77ThrH	 78LeuN	5.02615e+07	6.28828e+08	28.87756	47.94894	39.05448	1.00000	None	parabolic	box sum
339	439	7.32522	7.58317	123.72407	 78LeuH	 79IleH	 78LeuN	2.06720e+07	1.90898e+08	29.58715	33.66701	38.05399	1.00000	None	parabolic	box sum
340	440	7.32574	6.68159	123.72132	 78LeuH	 82HisHd2	 78LeuN	5.09479e+06	5.56241e+07	32.61089	36.45911	43.94197	1.00000	None	parabolic	box sum
341	441	7.32432	4.39183	123.72436	 78LeuH	 77ThrHa	 78LeuN	2.73573e+07	3.51576e+08	29.05637	51.13382	39.22707	1.00000	None	parabolic	box sum
342	442	7.32413	4.02963	123.72584	 78LeuH	 78LeuHa	 78LeuN	6.19569e+07	8.67780e+08	29.37347	56.07519	39.23076	1.00000	None	parabolic	box sum
343	443	7.32418	3.70223	123.71943	 78LeuH	 75SerHba	 78LeuN	1.67317e+07	2.22450e+08	29.17677	54.43252	38.91751	1.00000	None	parabolic	box sum
344	446	7.32446	1.38213	123.71479	 78LeuH	 59AlaHb*	 78LeuN	1.39172e+07	2.02757e+08	28.86385	67.75393	37.36493	1.00000	None	parabolic	box sum
345	447	7.32398	1.13061	123.72532	 78LeuH	 77ThrHg2*	 78LeuN	8.48211e+06	1.32419e+08	29.18541	127.30121	39.27913	1.00000	None	parabolic	box sum
346	448	7.32412	1.03942	123.72455	 78LeuH	 78LeuHdb*	 78LeuN	1.74703e+07	2.70263e+08	29.25038	63.48134	38.57571	1.00000	None	parabolic	box sum
347	449	7.32436	0.81071	123.72576	 78LeuH	 78LeuHda*	 78LeuN	1.89451e+07	2.53834e+08	29.35886	55.16303	38.97455	1.00000	None	parabolic	box sum
348	450	7.32423	2.11498	123.72526	 78LeuH	 78LeuHbb	 78LeuN	6.38773e+07	9.13504e+08	29.23459	60.02813	39.28173	1.00000	None	parabolic	box sum
349	451	7.57308	7.32237	115.00995	 11LeuH	 12AlaH	 11LeuN	6.44916e+07	7.69616e+08	29.93226	44.43596	39.93791	1.00000	None	parabolic	box sum
350	452	7.57308	7.71448	115.00644	 11LeuH	 10LysH	 11LeuN	4.05072e+07	3.42188e+08	29.92958	30.28250	38.63841	1.00000	None	parabolic	box sum
351	453	7.80362	3.87688	115.03256	 90GluH	 90GluHa	 90GluN	4.11858e+07	5.89609e+08	29.79070	60.46651	39.50375	1.00000	None	parabolic	box sum
352	454	7.80361	4.20907	115.03741	 90GluH	 87AlaHa	 90GluN	2.10381e+07	2.97742e+08	30.61086	55.01166	39.53534	1.00000	None	parabolic	box sum
353	455	7.85801	4.27842	115.33948	 9SerH	 9SerHa	 9SerN	2.45332e+07	3.78241e+08	31.42446	65.66737	39.54989	1.00000	None	parabolic	box sum
354	456	7.85837	3.99416	115.33525	 9SerH	 9SerHba	 9SerN	2.40305e+07	3.44122e+08	30.98965	54.96802	39.34079	1.00000	None	parabolic	box sum
355	457	7.63096	4.08006	115.26628	 93LeuH	 94GluHa	 93LeuN	4.14234e+06	5.00596e+07	32.69106	145.42795	35.65687	1.00000	None	parabolic	box sum
356	458	7.63200	3.88532	115.36984	 93LeuH	 93LeuHa	 93LeuN	4.57785e+07	6.20323e+08	30.08395	53.17319	40.48824	1.00000	None	parabolic	box sum
357	459	7.57337	4.32956	115.00779	 11LeuH	 11LeuHa	 11LeuN	3.28540e+07	4.99600e+08	30.83944	113.47300	39.71404	1.00000	None	parabolic	box sum
358	460	7.57381	4.23693	115.00202	 11LeuH	 10LysHa	 11LeuN	1.81983e+07	3.39779e+08	31.14253	141.97866	39.50375	1.00000	None	parabolic	box sum
359	462	7.57319	3.71831	115.00841	 11LeuH	 8ThrHa	 11LeuN	1.61449e+07	1.97200e+08	30.41148	46.01709	39.12687	1.00000	None	parabolic	box sum
360	463	7.63167	8.41112	115.37453	 93LeuH	 92LeuH	 93LeuN	2.68268e+07	3.58947e+08	29.68103	51.51932	40.46708	1.00000	None	parabolic	box sum
361	464	7.80355	8.51861	115.02753	 90GluH	 89AlaH	 90GluN	3.78632e+07	4.90751e+08	29.68758	52.66836	39.00820	1.00000	None	parabolic	box sum
362	465	8.51064	7.80514	121.33579	 89AlaH	 90GluH	 89AlaN	3.35975e+07	4.58817e+08	30.56467	53.06674	39.54995	1.00000	None	parabolic	box sum
363	466	8.53111	7.65839	121.23273	 24ArgH	 25LysH	 24ArgN	3.58593e+07	4.96925e+08	30.79951	54.22247	40.57896	1.00000	None	parabolic	box sum
364	467	8.53234	8.00963	121.21773	 24ArgH	 23ThrH	 24ArgN	3.96579e+07	5.39710e+08	29.26469	52.76783	40.74234	1.00000	None	parabolic	box sum
365	468	8.73900	7.63300	121.52173	 64AspH	 63ArgH	 64AspN	3.38515e+07	4.45481e+08	29.49685	50.31632	40.15779	1.00000	None	parabolic	box sum
366	469	8.73929	7.05968	121.52316	 64AspH	 63ArgHe	 64AspN	1.00290e+07	1.50457e+08	28.58847	61.57230	40.96246	1.00000	None	parabolic	box sum
367	470	8.73959	4.38959	121.52557	 64AspH	 64AspHa	 64AspN	3.26224e+07	4.52231e+08	29.60742	53.68156	40.00276	1.00000	None	parabolic	box sum
368	471	8.73944	4.16217	121.52234	 64AspH	 60LeuHa	 64AspN	2.79454e+07	4.03543e+08	29.69980	56.43022	40.26002	1.00000	None	parabolic	box sum
369	473	8.73972	3.63462	121.53051	 64AspH	 63ArgHa	 64AspN	1.26260e+07	1.76808e+08	29.03819	54.40185	40.87979	1.00000	None	parabolic	box sum
370	474	8.73947	2.95193	121.52490	 64AspH	 64AspHbb	 64AspN	5.24974e+07	7.62440e+08	29.61695	59.78475	40.11285	1.00000	None	parabolic	box sum
371	475	8.73970	2.74446	121.52373	 64AspH	 64AspHba	 64AspN	3.38654e+07	4.78778e+08	29.73288	54.96369	40.42840	1.00000	None	parabolic	box sum
372	476	8.73966	2.29208	121.52098	 64AspH	 63ArgHbb	 64AspN	3.21009e+07	4.58535e+08	29.85299	57.97145	39.99323	1.00000	None	parabolic	box sum
373	477	8.73984	2.03345	121.52325	 64AspH	 63ArgHba	 64AspN	2.83983e+07	4.15286e+08	29.28913	60.41776	39.92087	1.00000	None	parabolic	box sum
374	478	8.73960	3.23546	121.53653	 64AspH	 65HisHba	 64AspN	7.95356e+06	1.30000e+08	28.76103	69.55504	40.37738	1.00000	None	parabolic	box sum
375	480	8.73936	1.03250	121.51875	 64AspH	 {*}(Hda*/Hgb*/Hdb*)	 64AspN	5.03712e+06	8.48278e+07	29.52874	72.00293	40.70961	1.00000	None	parabolic	box sum
376	481	8.73885	0.82569	121.53217	 64AspH	 66LeuHda*	 64AspN	4.42697e+06	8.14189e+07	29.71679	109.59830	40.56096	1.00000	None	parabolic	box sum
377	483	8.73798	1.79245	121.49930	 64AspH	 62LeuHbb	 64AspN	3.49516e+06	6.24869e+07	34.56712	243.37385	42.78338	1.00000	None	parabolic	box sum
378	484	7.62981	8.74300	119.50393	 63ArgH	 64AspH	 63ArgN	3.10426e+07	4.18932e+08	28.97710	52.49458	40.45105	1.00000	None	parabolic	box sum
379	493	7.55413	9.10902	123.87473	 18GluH	 19GlnH	 18GluN	3.31271e+07	4.75295e+08	29.48672	55.33342	40.71897	1.00000	None	parabolic	box sum
380	494	7.55361	8.18320	123.87587	 18GluH	 17ThrH	 18GluN	1.33066e+07	1.62991e+08	28.87964	45.65872	38.69194	1.00000	None	parabolic	box sum
381	495	7.55480	8.78377	123.86144	 18GluH	 15ThrH	 18GluN	9.58383e+06	1.20867e+08	28.74792	45.86415	40.03829	1.00000	None	parabolic	box sum
382	496	7.55442	4.14929	123.87001	 18GluH	 18GluHa	 18GluN	4.38521e+07	7.75000e+08	29.44559	79.33241	40.72365	1.00000	None	parabolic	box sum
383	497	7.55404	3.97665	123.86693	 18GluH	 17ThrHa	 18GluN	1.35347e+07	1.57808e+08	29.03432	39.74327	41.30566	1.00000	None	parabolic	box sum
384	499	7.55560	2.85348	123.87310	 18GluH	 19GlnHgb	 18GluN	5.34455e+06	7.28492e+07	26.53390	52.94555	41.14637	1.00000	None	parabolic	box sum
385	500	7.55426	2.36285	123.86947	 18GluH	 18GluHbb	 18GluN	6.87116e+07	1.16422e+09	29.70606	73.74821	40.85147	1.00000	None	parabolic	box sum
386	501	7.55555	1.74018	123.86753	 18GluH	 20ArgHgb	 18GluN	9.56390e+06	1.42997e+08	30.71636	60.24555	41.38979	1.00000	None	parabolic	box sum
387	502	7.55401	2.08849	123.86083	 18GluH	 18GluHba	 18GluN	2.88958e+07	4.00827e+08	29.80769	53.30726	41.15018	1.00000	None	parabolic	box sum
388	503	7.55546	1.90772	123.85104	 18GluH	 {*}Hb*	 18GluN	8.04132e+06	1.16764e+08	29.68669	60.49875	40.61404	1.00000	None	parabolic	box sum
389	504	7.55462	1.55763	123.87279	 18GluH	 21AlaHb*	 18GluN	6.77253e+06	1.03875e+08	28.25052	217.30231	40.17666	1.00000	None	parabolic	box sum
390	505	7.55482	0.87365	123.87645	 18GluH	 14LeuHda*	 18GluN	7.26909e+06	1.07909e+08	28.78398	64.95652	38.80805	1.00000	None	parabolic	box sum
391	506	7.55583	1.43943	123.85198	 18GluH	 15ThrHg2*	 18GluN	8.67426e+06	1.23511e+08	29.39194	140.24046	41.64359	1.00000	None	parabolic	box sum
392	507	7.55426	1.30767	123.85413	 18GluH	 17ThrHg2*	 18GluN	1.47193e+07	1.98585e+08	29.45781	50.96239	40.64062	1.00000	None	parabolic	box sum
393	508	7.94001	9.10971	120.04513	 20ArgH	 19GlnH	 20ArgN	2.68425e+07	3.81064e+08	29.27005	55.09442	40.00694	1.00000	None	parabolic	box sum
394	509	7.93969	8.49247	120.06831	 20ArgH	 22ValH	 20ArgN	4.38441e+06	4.73822e+07	25.33525	43.55643	37.51874	1.00000	None	parabolic	box sum
395	511	7.94026	3.88850	120.03793	 20ArgH	 20ArgHa	 20ArgN	3.82287e+07	5.92600e+08	29.83928	69.64587	40.84027	1.00000	None	parabolic	box sum
396	512	7.93554	4.16060	120.03262	 20ArgH	 18GluHa	 20ArgN	1.83964e+07	3.10194e+08	45.56388	67.41344	44.35641	1.00000	None	parabolic	box sum
397	514	7.94014	1.91019	120.03682	 20ArgH	 20ArgHbb	 20ArgN	7.32304e+07	1.22669e+09	30.12359	91.36737	40.72213	1.00000	None	parabolic	box sum
398	515	7.93993	1.53644	120.06824	 20ArgH	 20ArgHga	 20ArgN	2.12639e+07	3.14081e+08	29.71768	68.06257	37.40090	1.00000	None	parabolic	box sum
399	516	7.93998	2.46150	120.03138	 20ArgH	 19GlnHbb	 20ArgN	2.56790e+07	3.77668e+08	28.85342	61.97865	39.83647	1.00000	None	parabolic	box sum
400	517	7.94004	0.79874	120.03912	 20ArgH	 (11Leu/93Leu)(Hdb*/Hda*)	 20ArgN	1.96278e+07	2.81915e+08	29.79487	57.01408	40.54320	1.00000	None	parabolic	box sum
401	518	7.21701	7.64565	119.51598	 60LeuH	 61GluH	 60LeuN	4.98158e+07	7.07194e+08	29.38718	54.07896	40.01492	1.00000	None	parabolic	box sum
402	519	7.64023	7.22060	119.43810	 61GluH	 60LeuH	 61GluN	5.53434e+07	7.94859e+08	29.70427	55.21198	39.75648	1.00000	None	parabolic	box sum
403	520	7.21704	8.44007	119.51615	 60LeuH	 62LeuH	 60LeuN	5.70036e+06	6.68716e+07	28.54675	44.12840	39.09463	1.00000	None	parabolic	box sum
404	521	7.21725	9.00716	119.50959	 60LeuH	 59AlaH	 60LeuN	3.80232e+07	5.34128e+08	29.52904	53.97000	40.33756	1.00000	None	parabolic	box sum
405	522	7.63563	8.43804	119.46770	 63ArgH	 62LeuH	 63ArgN	5.99651e+07	7.83893e+08	30.39122	49.17317	40.10761	1.00000	None	parabolic	box sum
406	524	7.62968	3.63633	119.50892	 63ArgH	 63ArgHa	 63ArgN	3.34716e+07	4.32086e+08	29.42204	48.26603	40.46476	1.00000	None	parabolic	box sum
407	526	7.63659	3.86610	119.49028	 63ArgH	 59AlaHa	 63ArgN	7.45165e+06	1.09317e+08	111.55188	53.85928	40.65752	1.00000	None	parabolic	box sum
408	527	7.63071	3.24380	119.50772	 63ArgH	 65HisHba	 63ArgN	4.76586e+06	7.23318e+07	30.10869	63.34885	40.49546	1.00000	None	parabolic	box sum
409	528	7.63155	2.98262	119.49466	 63ArgH	 64AspHbb	 63ArgN	5.34568e+06	9.56287e+07	27.00061	82.20649	40.49820	1.00000	None	parabolic	box sum
410	529	7.21794	4.47690	119.51318	 60LeuH	 57LeuHa	 60LeuN	1.35781e+07	1.78493e+08	29.83004	51.67325	39.62874	1.00000	None	parabolic	box sum
411	530	7.21748	4.14660	119.50980	 60LeuH	 60LeuHa	 60LeuN	5.11148e+07	6.91183e+08	29.59430	52.01295	40.17061	1.00000	None	parabolic	box sum
412	531	7.21787	3.86203	119.51456	 60LeuH	 59AlaHa	 60LeuN	1.15502e+07	1.57584e+08	30.62755	51.62843	40.32910	1.00000	None	parabolic	box sum
413	532	7.21752	2.18789	119.50317	 60LeuH	 61GluHga	 60LeuN	5.86777e+06	7.36057e+07	27.33439	52.67269	38.64890	1.00000	None	parabolic	box sum
414	533	7.22118	2.09351	119.51329	 60LeuH	 61GluHga	 60LeuN	4.39156e+06	2.29242e+07	29.68162	25.44208	39.36005	1.00000	None	parabolic	box sum
415	534	7.21772	1.92722	119.51741	 60LeuH	 60LeuHbb	 60LeuN	1.09035e+08	1.68717e+09	31.41850	62.84559	40.10385	1.00000	None	parabolic	box sum
416	535	7.21766	1.40618	119.50962	 60LeuH	 59AlaHb*	 60LeuN	4.94384e+07	6.47161e+08	29.67536	49.72430	40.09730	1.00000	None	parabolic	box sum
417	536	7.21688	1.25488	119.51641	 60LeuH	 58ThrHg2*	 60LeuN	3.51429e+06	2.53908e+07	74.83304	42.79349	40.08621	1.00000	None	parabolic	box sum
418	537	7.21764	1.02682	119.50646	 60LeuH	 60LeuHdb*	 60LeuN	1.90050e+07	2.98951e+08	28.69874	65.84862	39.92391	1.00000	None	parabolic	box sum
419	538	7.28076	7.44832	119.93306	 96IleH	 95GlnH	 96IleN	5.21937e+07	5.77576e+08	27.83090	42.15714	38.73545	1.00000	None	parabolic	box sum
420	541	7.28096	4.32409	119.93665	 96IleH	 96IleHa	 96IleN	3.59493e+07	4.39271e+08	29.11687	46.66032	38.79243	1.00000	None	parabolic	box sum
421	542	7.28014	4.19040	119.91370	 96IleH	 95GlnHa	 96IleN	2.04093e+07	2.46384e+08	30.94345	43.17879	40.44873	1.00000	None	parabolic	box sum
422	543	7.28166	4.07004	119.92829	 96IleH	 94GluHa	 96IleN	8.70505e+06	9.28035e+07	83.55767	211.23529	39.65455	1.00000	None	parabolic	box sum
423	544	7.28083	3.90028	119.92700	 96IleH	 93LeuHa	 96IleN	2.30161e+07	3.18598e+08	30.09707	54.04485	39.79099	1.00000	None	parabolic	box sum
424	545	7.28114	3.66428	119.94461	 96IleH	 97ProHda	 96IleN	8.90476e+06	1.24855e+08	28.35274	61.82059	39.31510	1.00000	None	parabolic	box sum
425	546	7.28101	2.25918	119.92831	 96IleH	 95GlnHbb	 96IleN	1.69057e+07	2.15341e+08	29.19525	49.45223	38.43528	1.00000	None	parabolic	box sum
426	547	7.28090	2.08811	119.89464	 96IleH	 94GluHba	 96IleN	3.29352e+06	3.63483e+07	31.08978	38.71867	42.89615	1.00000	None	parabolic	box sum
427	548	7.28044	1.91469	119.91833	 96IleH	 96IleHb	 96IleN	9.26538e+07	1.27813e+09	32.63533	53.81642	40.71712	1.00000	None	parabolic	box sum
428	549	7.28125	1.66270	119.93649	 96IleH	 96IleHg1b	 96IleN	4.14077e+07	5.34860e+08	30.65914	50.37028	39.16764	1.00000	None	parabolic	box sum
429	550	7.28101	1.21921	119.93388	 96IleH	 96IleHg1a	 96IleN	3.52879e+07	4.88597e+08	29.15353	55.11192	39.25180	1.00000	None	parabolic	box sum
430	551	7.28125	0.89802	119.93643	 96IleH	 96IleHg2*	 96IleN	2.69968e+07	4.40452e+08	31.58063	147.89863	38.74099	1.00000	None	parabolic	box sum
431	552	7.28105	0.75980	119.93400	 96IleH	 96IleHd1*	 96IleN	2.40935e+07	3.89030e+08	28.97114	152.43858	39.36535	1.00000	None	parabolic	box sum
432	553	7.35558	7.11197	119.97905	 14LeuH	 19GlnHe2b	 14LeuN	1.38363e+07	1.12240e+08	28.83285	28.13864	40.28964	1.00000	None	parabolic	box sum
433	554	7.35480	6.73675	119.94939	 14LeuH	 19GlnHe2a	 14LeuN	6.60093e+06	8.91841e+07	28.98425	53.56794	40.20953	1.00000	None	parabolic	box sum
434	555	7.35555	4.74361	119.97556	 14LeuH	 14LeuHa	 14LeuN	3.62665e+07	4.98204e+08	29.85269	53.04011	39.25490	1.00000	None	parabolic	box sum
435	556	7.35029	4.34097	119.96906	 14LeuH	 11LeuHa	 14LeuN	7.78852e+06	1.14527e+08	84.43803	58.39253	39.15042	1.00000	None	parabolic	box sum
436	557	7.35513	4.10156	119.97299	 14LeuH	 13GlyHab	 14LeuN	2.96184e+07	4.33937e+08	30.13551	60.28329	39.88159	1.00000	None	parabolic	box sum
437	558	7.35514	3.84285	119.97182	 14LeuH	 13GlyHaa	 14LeuN	2.28034e+07	3.08707e+08	30.26783	52.67701	39.31713	1.00000	None	parabolic	box sum
438	559	7.35599	2.85174	119.97288	 14LeuH	 19GlnHgb	 14LeuN	8.64463e+06	1.15006e+08	28.75030	52.38764	38.11824	1.00000	None	parabolic	box sum
439	560	7.35659	2.38329	119.97567	 14LeuH	 18GluHbb	 14LeuN	4.99448e+06	7.67022e+07	29.10435	143.42239	37.84448	1.00000	None	parabolic	box sum
440	561	7.35502	2.26100	119.97568	 14LeuH	 19GlnHga	 14LeuN	9.00214e+06	1.20650e+08	79.22232	58.80418	38.45036	1.00000	None	parabolic	box sum
441	562	7.35725	2.08971	119.92508	 14LeuH	 18GluHba	 14LeuN	3.39731e+06	4.03699e+07	31.91173	46.39847	36.63445	1.00000	None	parabolic	box sum
442	564	7.35523	1.70201	119.97571	 14LeuH	 14LeuHba	 14LeuN	6.77260e+07	1.07146e+09	30.51907	69.31993	39.61313	1.00000	None	parabolic	box sum
443	565	7.35460	1.45308	119.95964	 14LeuH	 {*}(Hb*/Hg2*/Hba)	 14LeuN	1.08144e+07	1.49791e+08	31.24863	56.12826	43.05756	1.00000	None	parabolic	box sum
444	566	7.35496	0.87899	119.97431	 14LeuH	 14LeuHda*	 14LeuN	4.24231e+07	6.08172e+08	30.88772	58.86631	39.53594	1.00000	None	parabolic	box sum
445	567	7.48149	2.04709	121.75449	 47GluH	 47GluHbb	 47GluN	2.09903e+07	3.40432e+08	34.67292	132.12109	38.92171	1.00000	None	parabolic	box sum
446	568	7.48134	1.93682	121.75838	 47GluH	 47GluHba	 47GluN	2.89804e+07	4.31619e+08	35.32171	121.17836	39.92581	1.00000	None	parabolic	box sum
447	569	7.48007	1.00293	121.75508	 47GluH	 52LeuHdb*	 47GluN	5.05048e+06	7.32283e+07	35.45046	57.86922	38.62041	1.00000	None	parabolic	box sum
448	570	7.48072	0.76809	121.77327	 47GluH	 52LeuHda*	 47GluN	3.29700e+06	4.23478e+07	36.79931	55.53812	39.96277	1.00000	None	parabolic	box sum
449	571	7.48039	3.27406	121.76269	 47GluH	 46HisHbb	 47GluN	4.68690e+06	6.40007e+07	36.03458	52.16117	39.94054	1.00000	None	parabolic	box sum
450	572	7.48198	2.94203	121.74190	 47GluH	 46HisHba	 47GluN	5.83020e+06	7.96810e+07	33.32824	55.03328	39.06912	1.00000	None	parabolic	box sum
451	573	7.48079	2.77516	121.74993	 47GluH	 44AspHbb	 47GluN	6.98135e+06	9.22645e+07	35.34615	51.54232	38.42038	1.00000	None	parabolic	box sum
452	574	7.47953	2.63374	121.76360	 47GluH	 44AspHba	 47GluN	3.46858e+06	4.81457e+07	36.58831	63.89771	39.67822	1.00000	None	parabolic	box sum
453	575	7.48088	2.36891	121.75459	 47GluH	 47GluHgb	 47GluN	9.07502e+06	1.35089e+08	34.36953	98.21208	38.47510	1.00000	None	parabolic	box sum
454	576	7.48096	4.62774	121.75645	 47GluH	 46HisHa	 47GluN	1.72515e+07	2.23837e+08	34.98822	49.21829	39.77495	1.00000	None	parabolic	box sum
455	577	7.48087	4.32467	121.75494	 47GluH	 47GluHa	 47GluN	2.31942e+07	3.12679e+08	35.23201	51.91426	39.62070	1.00000	None	parabolic	box sum
456	578	7.47978	3.87855	121.76473	 47GluH	 45ThrHa	 47GluN	3.74452e+06	5.33455e+07	32.55576	100.48578	39.64531	1.00000	None	parabolic	box sum
457	580	7.48155	8.81727	121.75120	 47GluH	 48SerH	 47GluN	6.46635e+06	8.08394e+07	33.61315	48.31871	38.71167	1.00000	None	parabolic	box sum
458	581	7.48064	8.45339	121.76526	 47GluH	 46HisH	 47GluN	1.57431e+07	2.16644e+08	35.20072	52.94348	40.12769	1.00000	None	parabolic	box sum
459	582	7.68208	9.11110	122.10155	 21AlaH	 19GlnH	 21AlaN	5.21864e+06	7.04786e+07	31.75706	51.91003	40.09932	1.00000	None	parabolic	box sum
460	583	7.68366	8.49142	122.12209	 21AlaH	 22ValH	 21AlaN	3.79623e+07	5.03198e+08	28.70530	51.12035	39.93016	1.00000	None	parabolic	box sum
461	584	7.68290	7.94483	122.12210	 21AlaH	 20ArgH	 21AlaN	3.59727e+07	4.27454e+08	28.63139	52.04155	39.34878	1.00000	None	parabolic	box sum
462	585	7.68304	4.12616	122.11660	 21AlaH	 21AlaHa	 21AlaN	4.88392e+07	7.32534e+08	28.75268	68.67395	39.91789	1.00000	None	parabolic	box sum
463	586	7.68291	3.88839	122.11112	 21AlaH	 20ArgHa	 21AlaN	1.48587e+07	2.30169e+08	29.13862	71.49731	40.73948	1.00000	None	parabolic	box sum
464	587	7.68277	3.72126	122.07476	 21AlaH	 22ValHa	 21AlaN	3.26694e+06	4.03046e+07	29.00600	48.72171	39.06512	1.00000	None	parabolic	box sum
465	589	7.68098	2.35160	122.07655	 21AlaH	 18GluHbb	 21AlaN	3.05024e+06	5.28729e+07	49.75080	134.42743	41.14354	1.00000	None	parabolic	box sum
466	591	7.68296	1.58255	122.11614	 21AlaH	 21AlaHb*	 21AlaN	1.16397e+08	1.57525e+09	29.38271	52.04440	39.95138	1.00000	None	parabolic	box sum
467	592	7.68491	1.31063	122.10846	 21AlaH	 17ThrHg2*	 21AlaN	4.18783e+06	5.50412e+07	28.50980	55.20942	38.51938	1.00000	None	parabolic	box sum
468	593	7.68316	1.08790	122.11707	 21AlaH	 22ValHgb*	 21AlaN	7.66758e+06	1.08098e+08	29.77073	54.29098	39.81227	1.00000	None	parabolic	box sum
469	594	7.68319	0.83203	122.10940	 21AlaH	 22ValHga*	 21AlaN	5.95555e+06	1.08340e+08	29.14429	104.01606	38.51449	1.00000	None	parabolic	box sum
470	596	7.84938	4.48645	122.16252	 43LeuH	 43LeuHa	 43LeuN	8.17933e+07	1.05447e+09	29.76686	50.05260	39.28024	1.00000	None	parabolic	box sum
471	597	7.84909	4.20841	122.15859	 43LeuH	 (40Thr/41Glu)Ha	 43LeuN	1.16536e+07	1.82030e+08	29.08528	60.99690	40.51661	1.00000	None	parabolic	box sum
472	600	7.84975	2.01688	122.15600	 43LeuH	 41GluHb2	 43LeuN	3.24295e+06	4.41491e+07	29.12998	53.39180	38.10841	1.00000	None	parabolic	box sum
473	602	7.84913	1.64824	122.16096	 43LeuH	 43LeuHg	 43LeuN	3.77933e+07	5.03769e+08	29.47628	52.94201	39.46489	1.00000	None	parabolic	box sum
474	603	7.84941	1.43923	122.15292	 43LeuH	 43LeuHba	 43LeuN	2.61879e+07	3.58782e+08	29.24174	54.17774	39.75123	1.00000	None	parabolic	box sum
475	604	7.84921	0.86835	122.15332	 43LeuH	 43LeuHdb*	 43LeuN	1.73750e+07	2.81117e+08	29.14160	92.05463	38.89024	1.00000	None	parabolic	box sum
476	605	8.00950	8.16435	122.26288	 51AspH	 52LeuH	 51AspN	2.83583e+07	3.78641e+08	28.82481	46.57854	39.78670	1.00000	None	parabolic	box sum
477	606	8.00925	7.75001	122.24775	 51AspH	 53GlyH	 51AspN	7.33464e+06	7.28943e+07	29.30522	34.50977	42.42021	1.00000	None	parabolic	box sum
478	607	8.00898	8.77532	122.25127	 51AspH	 50LysH	 51AspN	2.42009e+07	3.45603e+08	29.62589	56.91077	39.29394	1.00000	None	parabolic	box sum
479	611	8.00912	4.54416	122.24697	 51AspH	 51AspHa	 51AspN	3.74029e+07	4.83106e+08	29.35022	50.24171	40.27754	1.00000	None	parabolic	box sum
480	612	8.00941	4.32847	122.25026	 51AspH	 50LysHa	 51AspN	2.37615e+07	3.60014e+08	29.32489	67.85380	40.36236	1.00000	None	parabolic	box sum
481	613	8.01126	4.03724	122.23524	 51AspH	 48SerHba	 51AspN	8.77684e+06	1.23199e+08	28.15515	52.46313	41.25291	1.00000	None	parabolic	box sum
482	614	8.00909	2.98153	122.25067	 51AspH	 51AspHbb	 51AspN	4.90733e+07	6.64949e+08	29.15680	55.56878	39.45595	1.00000	None	parabolic	box sum
483	615	8.00922	2.83473	122.24750	 51AspH	 51AspHba	 51AspN	3.34519e+07	4.73387e+08	29.17737	58.49083	40.38113	1.00000	None	parabolic	box sum
484	616	8.01024	2.68541	122.20267	 51AspH	 49PheHba	 51AspN	3.89362e+06	4.74244e+07	29.01971	41.21451	45.22312	1.00000	None	parabolic	box sum
485	617	8.00956	2.31182	122.23309	 51AspH	 47GluHga	 51AspN	6.50902e+06	1.01193e+08	27.73792	69.40328	40.69257	1.00000	None	parabolic	box sum
486	618	8.00913	1.87571	122.24600	 51AspH	 50LysHba	 51AspN	4.03958e+07	6.06824e+08	29.48225	75.73530	39.87294	1.00000	None	parabolic	box sum
487	619	8.00710	1.61845	122.22181	 51AspH	 50LysHgb	 51AspN	5.88454e+06	8.64203e+07	31.91769	119.67173	43.50483	1.00000	None	parabolic	box sum
488	620	8.01042	1.50768	122.25772	 51AspH	 50LysHga	 51AspN	4.66891e+06	7.36936e+07	25.98435	130.74460	46.06926	1.00000	None	parabolic	box sum
489	621	8.01002	1.00499	122.22589	 51AspH	 52LeuHdb*	 51AspN	4.67264e+06	6.76529e+07	29.78116	55.88135	41.72450	1.00000	None	parabolic	box sum
490	622	8.01192	0.75889	122.26369	 51AspH	 52LeuHda*	 51AspN	3.41108e+06	4.42269e+07	29.81067	46.60174	41.29618	1.00000	None	parabolic	box sum
491	623	7.54959	7.98185	118.52106	 80PheH	 81AspH	 80PheN	6.85619e+07	9.04109e+08	30.44009	51.23319	39.30002	1.00000	None	parabolic	box sum
492	624	7.55027	7.11381	118.51487	 80PheH	 80PheHd*	 80PheN	1.57336e+07	1.86958e+08	31.85391	42.14790	40.11613	1.00000	None	parabolic	box sum
493	625	7.54987	4.52944	118.52058	 80PheH	 80PheHa	 80PheN	2.70885e+07	3.42227e+08	31.42238	48.16577	39.55328	1.00000	None	parabolic	box sum
494	626	7.55028	4.38574	118.50469	 80PheH	 77ThrHa	 80PheN	6.87004e+06	8.69711e+07	29.70010	49.51553	38.02073	1.00000	None	parabolic	box sum
495	627	7.55107	4.06062	118.54191	 80PheH	 78LeuHa	 80PheN	5.38314e+06	9.77729e+07	30.69103	83.65926	40.27510	1.00000	None	parabolic	box sum
496	628	7.55006	3.85272	118.52183	 80PheH	 79IleHa	 80PheN	1.38231e+07	1.76835e+08	29.98680	48.66392	39.21789	1.00000	None	parabolic	box sum
497	629	7.54992	3.24895	118.51882	 80PheH	 80PheHbb	 80PheN	2.68408e+07	3.47951e+08	30.96521	48.97806	39.45142	1.00000	None	parabolic	box sum
498	630	7.54981	2.88013	118.51738	 80PheH	 80PheHba	 80PheN	3.25797e+07	4.71054e+08	31.00485	56.51593	39.73162	1.00000	None	parabolic	box sum
499	631	7.55061	2.34365	118.52303	 80PheH	 81AspHbb	 80PheN	9.72054e+06	1.27177e+08	29.74331	53.77553	38.24878	1.00000	None	parabolic	box sum
500	632	7.55254	2.08435	118.54352	 80PheH	 81AspHba	 80PheN	5.71683e+06	7.34310e+07	31.13449	51.16448	42.34654	1.00000	None	parabolic	box sum
501	633	7.55132	1.74062	118.50516	 80PheH	 78LeuHba	 80PheN	4.61494e+06	5.93105e+07	31.16369	50.10686	40.26788	1.00000	None	parabolic	box sum
502	634	7.55141	1.38456	118.53157	 80PheH	 59AlaHb*	 80PheN	4.30324e+06	6.62618e+07	28.16260	122.28356	39.70444	1.00000	None	parabolic	box sum
503	635	7.54929	1.29201	118.51855	 80PheH	 79IleHb	 80PheN	9.06623e+06	1.25151e+08	30.12955	63.34137	38.89662	1.00000	None	parabolic	box sum
504	636	7.55124	1.13889	118.52538	 80PheH	 77ThrHg2*	 80PheN	4.25834e+06	4.88197e+07	29.41847	45.87280	38.61493	1.00000	None	parabolic	box sum
505	637	7.55128	0.63396	118.52550	 80PheH	 79IleHg1b	 80PheN	7.29312e+06	9.97232e+07	32.57453	54.08378	39.05755	1.00000	None	parabolic	box sum
506	638	8.19417	0.91151	123.30005	 6LeuH	 6LeuHdb*	 6LeuN	6.06174e+06	8.39425e+07	33.89418	57.82283	38.29402	1.00000	None	parabolic	box sum
507	639	8.19334	1.65049	123.30377	 6LeuH	 6LeuHbb	 6LeuN	2.56457e+07	4.16982e+08	31.85481	74.98237	39.16296	1.00000	None	parabolic	box sum
508	640	8.19159	1.23866	123.30917	 6LeuH	 5ThrHg2*	 6LeuN	5.85307e+06	7.02079e+07	31.49509	48.38988	37.27958	1.00000	None	parabolic	box sum
509	641	8.19337	4.41428	123.30780	 6LeuH	 5ThrHa	 6LeuN	3.28309e+07	4.63163e+08	32.02945	55.22594	39.21351	1.00000	None	parabolic	box sum
510	642	8.19282	4.24753	123.30578	 6LeuH	 6LeuHa	 6LeuN	1.14939e+07	1.57304e+08	31.08770	53.45824	39.39968	1.00000	None	parabolic	box sum
511	643	8.31956	8.93021	121.92228	 57LeuH	 58ThrH	 57LeuN	6.51995e+07	9.00994e+08	29.13624	56.66578	39.38693	1.00000	None	parabolic	box sum
512	644	8.31912	4.48009	121.91066	 57LeuH	 57LeuHa	 57LeuN	4.73714e+07	6.38920e+08	78.27073	51.87927	40.35991	1.00000	None	parabolic	box sum
513	645	8.32175	4.02411	121.92090	 57LeuH	 56SerHa	 57LeuN	2.67614e+07	3.64868e+08	30.89875	57.51694	39.64084	1.00000	None	parabolic	box sum
514	646	8.33835	4.19860	121.91197	 41GluH	 41GluHa	 41GluN	3.64416e+07	5.68769e+08	29.91587	70.02764	39.10393	1.00000	None	parabolic	box sum
515	647	8.33381	4.78818	121.91217	 44AspH	 44AspHa	 44AspN	2.80014e+07	4.33039e+08	33.79554	68.34604	39.95901	1.00000	None	parabolic	box sum
516	648	8.33868	2.26611	121.91455	 41GluH	 41GluHga	 41GluN	1.73264e+07	2.13611e+08	28.40281	47.69043	38.83702	1.00000	None	parabolic	box sum
517	649	8.32743	2.03720	121.91602	 57LeuH	 57LeuHbb	 57LeuN	9.88683e+07	1.35808e+09	33.51599	54.40854	39.21551	1.00000	None	parabolic	box sum
518	650	8.75766	8.21468	120.08140	 50LysH	 49PheH	 50LysN	1.35306e+07	1.96710e+08	31.50970	60.49846	40.33875	1.00000	None	parabolic	box sum
519	651	8.75830	8.01298	120.09652	 50LysH	 51AspH	 50LysN	1.71158e+07	2.34187e+08	31.28529	51.68907	42.02855	1.00000	None	parabolic	box sum
520	652	8.75668	6.92942	120.08759	 50LysH	 49PheHd*	 50LysN	4.14634e+06	6.10624e+07	28.59056	56.69266	41.29207	1.00000	None	parabolic	box sum
521	654	8.75756	4.66552	120.08768	 50LysH	 48SerHa	 50LysN	4.91154e+06	6.90532e+07	29.41728	153.14628	39.62827	1.00000	None	parabolic	box sum
522	655	8.75825	4.32344	120.08437	 50LysH	 50LysHa	 50LysN	2.86763e+07	4.24481e+08	30.79474	63.42905	40.21060	1.00000	None	parabolic	box sum
523	656	8.75828	4.03960	120.07513	 50LysH	 48SerHba	 50LysN	5.87020e+06	9.06309e+07	30.79712	58.32648	42.98747	1.00000	None	parabolic	box sum
524	657	8.75911	2.69462	120.09318	 50LysH	 49PheHbb	 50LysN	1.42197e+07	2.12380e+08	30.46513	63.30520	40.26234	1.00000	None	parabolic	box sum
525	658	8.75840	1.98285	120.10745	 50LysH	 50LysHbb	 50LysN	2.78072e+07	3.96989e+08	30.53188	119.92690	39.63608	1.00000	None	parabolic	box sum
526	659	8.75852	1.88311	120.10554	 50LysH	 50LysHba	 50LysN	2.80404e+07	4.19965e+08	30.22254	119.57265	39.57844	1.00000	None	parabolic	box sum
527	660	8.75759	1.61917	120.09432	 50LysH	 50LysHgb	 50LysN	5.13334e+06	8.64853e+07	30.59804	123.03570	38.41013	1.00000	None	parabolic	box sum
528	661	8.75443	1.52380	119.95423	 50LysH	 50LysHga	 50LysN	5.66977e+06	7.88844e+07	32.47678	58.53014	51.42361	1.00000	None	parabolic	box sum
529	662	8.65172	8.23511	119.66005	 65HisH	 68ThrH	 65HisN	3.90557e+06	5.62058e+07	330.37633	74.00230	46.50980	1.00000	None	parabolic	box sum
530	664	8.65649	7.63647	119.59448	 65HisH	 63ArgH	 65HisN	5.67094e+06	7.82599e+07	26.83789	54.96291	42.28354	1.00000	None	parabolic	box sum
531	665	8.65579	7.10877	119.58572	 65HisH	 65HisHd2	 65HisN	1.45614e+07	1.78928e+08	28.30476	46.39041	39.26861	1.00000	None	parabolic	box sum
532	666	8.65582	4.49809	119.58940	 65HisH	 65HisHa	 65HisN	3.86936e+07	5.04884e+08	29.05339	50.13634	39.60872	1.00000	None	parabolic	box sum
533	667	8.65607	4.37307	119.59929	 65HisH	 64AspHa	 65HisN	1.08211e+07	1.41250e+08	28.59265	137.21697	40.84420	1.00000	None	parabolic	box sum
534	668	8.65581	4.07169	119.59222	 65HisH	 62LeuHa	 65HisN	1.83972e+07	2.66631e+08	29.01047	101.47736	39.40690	1.00000	None	parabolic	box sum
535	669	8.65601	3.56987	119.58649	 65HisH	 65HisHbb	 65HisN	3.29267e+07	4.89290e+08	28.63824	59.14113	38.87886	1.00000	None	parabolic	box sum
536	670	8.65586	3.18978	119.58853	 65HisH	 65HisHba	 65HisN	5.16750e+07	7.25102e+08	28.84984	56.62798	39.20394	1.00000	None	parabolic	box sum
537	671	8.65574	2.94876	119.59140	 65HisH	 64AspHbb	 65HisN	3.14131e+07	4.23880e+08	28.82779	54.14315	39.31993	1.00000	None	parabolic	box sum
538	672	8.65578	2.74551	119.58880	 65HisH	 64AspHba	 65HisN	2.25108e+07	3.13722e+08	28.48059	54.89803	39.84523	1.00000	None	parabolic	box sum
539	673	8.65596	2.28700	119.56924	 65HisH	 63ArgHbb	 65HisN	3.97488e+06	6.27958e+07	34.91908	242.87688	43.27089	1.00000	None	parabolic	box sum
540	675	8.65503	1.84531	119.53579	 65HisH	 62LeuHbb	 65HisN	5.94270e+06	1.02855e+08	27.49115	71.33218	44.88111	1.00000	None	parabolic	box sum
541	676	8.65511	1.28586	119.55345	 65HisH	 62LeuHg	 65HisN	3.75508e+06	5.78673e+07	29.85209	65.32571	42.29277	1.00000	None	parabolic	box sum
542	678	8.65531	0.88050	119.58855	 65HisH	 62LeuHdb*	 65HisN	1.47270e+07	2.04310e+08	28.70023	60.79245	40.15440	1.00000	None	parabolic	box sum
543	680	8.52135	1.73915	119.49718	 88ValH	 87AlaHb*	 88ValN	4.00766e+07	5.42276e+08	30.74467	49.80805	41.18282	1.00000	None	parabolic	box sum
544	681	8.52136	1.31721	119.49977	 88ValH	 88ValHgb*	 88ValN	5.91402e+07	8.29620e+08	30.39777	54.31732	40.69889	1.00000	None	parabolic	box sum
545	682	8.52137	0.89817	119.50259	 88ValH	 88ValHga*	 88ValN	1.93705e+07	2.82845e+08	31.41016	55.61439	41.78160	1.00000	None	parabolic	box sum
546	683	8.52176	1.13129	119.49404	 88ValH	 27ValHgb*	 88ValN	9.87346e+06	1.59830e+08	29.13803	91.18140	40.62015	1.00000	None	parabolic	box sum
547	684	8.52313	0.75920	119.45686	 88ValH	 92LeuHda*	 88ValN	5.83450e+06	8.72068e+07	33.54758	153.06450	46.05246	1.00000	None	parabolic	box sum
548	685	8.52173	2.31811	119.50006	 88ValH	 88ValHb	 88ValN	5.95175e+07	8.91924e+08	30.27231	58.73459	40.83169	1.00000	None	parabolic	box sum
549	687	8.52150	3.41751	119.49677	 88ValH	 88ValHa	 88ValN	2.95362e+07	3.85482e+08	30.07084	47.78322	40.97837	1.00000	None	parabolic	box sum
550	688	8.52162	3.12042	119.49486	 88ValH	 82HisHbb	 88ValN	5.88944e+06	9.03374e+07	29.43963	66.40693	40.09575	1.00000	None	parabolic	box sum
551	689	8.52115	4.20383	119.48198	 88ValH	 87AlaHa	 88ValN	1.14024e+07	1.92561e+08	31.08382	125.58934	41.54170	1.00000	None	parabolic	box sum
552	690	8.52257	4.09819	119.47283	 88ValH	 85ProHa	 88ValN	1.25915e+07	1.95849e+08	30.75570	122.48054	42.06097	1.00000	None	parabolic	box sum
553	691	8.52271	3.92795	119.45755	 88ValH	 86HisHa	 88ValN	5.01765e+06	6.79304e+07	33.14316	123.12573	40.56603	1.00000	None	parabolic	box sum
554	692	8.52215	3.80865	119.44166	 88ValH	 89AlaHa	 88ValN	4.28728e+06	5.86044e+07	28.33366	129.53049	36.00180	1.00000	None	parabolic	box sum
555	693	8.52193	6.59340	119.51422	 88ValH	 49PheHz	 88ValN	5.74272e+06	7.88310e+07	29.29300	51.37640	40.97861	1.00000	None	parabolic	box sum
556	694	8.52408	7.79510	119.47422	 88ValH	 90GluH	 88ValN	5.07791e+06	7.73755e+07	29.87713	124.72417	43.28257	1.00000	None	parabolic	box sum
557	695	8.52498	7.68370	119.40615	 88ValH	 91HisH	 88ValN	4.22323e+06	6.89660e+07	40.63338	133.97341	131.72805	1.00000	None	parabolic	box sum
558	696	8.52086	8.22229	119.50415	 88ValH	 87AlaH	 88ValN	3.63784e+07	5.40547e+08	31.81607	56.79626	41.74554	1.00000	None	parabolic	box sum
559	697	8.17382	7.62845	119.83864	 37TyrH	 35LeuH	 37TyrN	1.15513e+07	1.66318e+08	33.94961	141.18348	46.38511	1.00000	None	parabolic	box sum
560	698	8.17334	7.03263	119.87609	 37TyrH	 37TyrHd*	 37TyrN	1.60291e+07	2.01270e+08	29.08349	48.26465	39.79081	1.00000	None	parabolic	box sum
561	699	8.17114	4.76057	119.87598	 37TyrH	 37TyrHa	 37TyrN	4.14435e+07	5.28946e+08	29.18512	51.87553	39.40284	1.00000	None	parabolic	box sum
562	700	8.17253	4.31176	119.91876	 37TyrH	 33SerHa	 37TyrN	1.21734e+07	1.49866e+08	27.50039	48.49171	112.93834	1.00000	None	parabolic	box sum
563	701	8.17296	4.06944	119.87754	 37TyrH	 36GlyHab	 37TyrN	2.03615e+07	2.98203e+08	28.20581	58.35951	41.72355	1.00000	None	parabolic	box sum
564	702	8.17320	3.84281	119.87226	 37TyrH	 36GlyHaa	 37TyrN	3.21682e+07	4.61898e+08	29.50549	59.73875	39.90501	1.00000	None	parabolic	box sum
565	704	8.17332	2.91843	119.87474	 37TyrH	 37TyrHba	 37TyrN	5.90408e+07	8.30802e+08	29.06859	56.16129	39.52360	1.00000	None	parabolic	box sum
566	705	8.17301	1.52007	119.87574	 37TyrH	 32AlaHb*	 37TyrN	1.88329e+07	2.49337e+08	28.80335	62.66040	40.33434	1.00000	None	parabolic	box sum
567	706	8.17426	1.40265	119.87050	 37TyrH	 35LeuHbb	 37TyrN	1.27623e+07	1.83702e+08	29.20806	129.51554	40.01993	1.00000	None	parabolic	box sum
568	707	8.17279	1.18215	119.87043	 37TyrH	 35LeuHba	 37TyrN	7.58043e+06	1.04707e+08	29.79279	54.81901	39.97356	1.00000	None	parabolic	box sum
569	708	8.17219	0.88083	119.86481	 37TyrH	 43LeuHdb*	 37TyrN	3.53071e+06	5.03726e+07	27.71586	58.07643	44.36690	1.00000	None	parabolic	box sum
570	709	8.17405	0.62623	119.89259	 37TyrH	 35LeuHdb*	 37TyrN	4.48600e+06	5.80186e+07	31.38989	48.14493	42.88977	1.00000	None	parabolic	box sum
571	710	8.06072	8.45231	114.04166	 45ThrH	 46HisH	 45ThrN	5.17728e+06	6.83589e+07	32.55874	50.78606	39.63435	1.00000	None	parabolic	box sum
572	711	8.06084	4.05753	114.03203	 45ThrH	 45ThrHb	 45ThrN	1.21618e+07	1.49518e+08	31.14820	45.86415	40.28499	1.00000	None	parabolic	box sum
573	712	8.06119	3.89083	114.03753	 45ThrH	 45ThrHa	 45ThrN	1.39084e+07	1.74306e+08	31.64053	46.24277	39.68871	1.00000	None	parabolic	box sum
574	713	8.06002	2.77574	114.03684	 45ThrH	 44AspHbb	 45ThrN	5.92450e+06	6.92191e+07	29.19734	42.65981	38.75387	1.00000	None	parabolic	box sum
575	714	8.06207	2.63352	114.04160	 45ThrH	 44AspHba	 45ThrN	6.98866e+06	9.30194e+07	32.61298	53.25773	38.81907	1.00000	None	parabolic	box sum
576	715	8.06096	1.10348	114.03203	 45ThrH	 45ThrHg2*	 45ThrN	2.43245e+07	3.06794e+08	31.49599	47.19149	39.59835	1.00000	None	parabolic	box sum
577	716	8.06188	0.87393	114.02107	 45ThrH	 43LeuHdb*	 45ThrN	3.35267e+06	4.85266e+07	28.17214	110.39565	37.59456	1.00000	None	parabolic	box sum
578	717	8.06010	0.79258	114.03373	 45ThrH	 28LeuHda*	 45ThrN	3.20985e+06	5.85563e+07	30.49433	111.92980	38.68568	1.00000	None	parabolic	box sum
579	718	8.07055	1.24112	112.48106	 5ThrH	 5ThrHg2*	 5ThrN	3.14339e+06	4.32025e+07	32.07684	50.29794	40.74359	1.00000	None	parabolic	box sum
580	719	8.07176	4.42606	112.48321	 5ThrH	 4AlaHa	 5ThrN	9.04916e+06	1.30297e+08	34.64162	55.89118	38.74087	1.00000	None	parabolic	box sum
581	720	8.31552	4.48101	113.97363	 42SerH	 42SerHa	 42SerN	5.34993e+06	7.17620e+07	33.12111	49.97672	40.32660	1.00000	None	parabolic	box sum
582	721	8.31454	4.18742	113.97363	 42SerH	 41GluHa	 42SerN	7.02777e+06	9.54775e+07	35.63553	52.28266	39.61766	1.00000	None	parabolic	box sum
583	722	8.31749	3.83845	113.97363	 42SerH	 42SerHba	 42SerN	6.91514e+06	9.28971e+07	36.86219	53.04384	37.65368	1.00000	None	parabolic	box sum
584	723	8.31158	2.02676	113.97363	 42SerH	 41GluHb*	 42SerN	3.44674e+06	4.84926e+07	30.08991	52.35029	40.60924	1.00000	None	parabolic	box sum
585	724	8.31651	7.85202	113.97363	 42SerH	 43LeuH	 42SerN	3.45745e+06	4.49454e+07	34.95574	50.94667	37.14418	1.00000	None	parabolic	box sum
586	725	7.71343	6.17596	118.88286	 91HisH	 91HisHd2	 91HisN	6.42566e+06	7.90389e+07	29.24919	47.80130	38.81025	1.00000	None	parabolic	box sum
587	726	7.71190	8.40928	118.89123	 91HisH	 92LeuH	 91HisN	3.33773e+07	4.51965e+08	29.05309	53.71036	40.36874	1.00000	None	parabolic	box sum
588	727	7.71419	8.51361	118.88717	 91HisH	 89AlaH	 91HisN	5.32566e+06	8.79223e+07	26.79169	130.04918	51.43613	1.00000	None	parabolic	box sum
589	728	7.71354	3.87419	118.95832	 91HisH	 90GluHa	 91HisN	1.25097e+07	1.84747e+08	28.00345	56.98734	89.83588	1.00000	None	parabolic	box sum
590	729	7.71246	4.22784	118.87540	 91HisH	 91HisHa	 91HisN	4.91283e+07	6.44136e+08	29.34903	48.93953	40.03221	1.00000	None	parabolic	box sum
591	730	7.71214	3.41691	118.87694	 91HisH	 88ValHa	 91HisN	2.32226e+07	2.91606e+08	29.02567	47.63578	39.74551	1.00000	None	parabolic	box sum
592	731	7.71224	3.01343	118.87752	 91HisH	 91HisHbb	 91HisN	5.77650e+07	8.42599e+08	29.15502	58.66107	39.52509	1.00000	None	parabolic	box sum
593	732	7.71220	2.20794	118.88333	 91HisH	 90GluHgb	 91HisN	7.02506e+07	9.92793e+08	29.02627	67.41777	40.56919	1.00000	None	parabolic	box sum
594	733	7.71201	2.10665	118.89372	 91HisH	 90GluHga	 91HisN	3.24750e+07	5.35560e+08	27.96799	136.29066	42.92083	1.00000	None	parabolic	box sum
595	735	7.71222	1.05846	118.89894	 91HisH	 93LeuHdb*	 91HisN	5.50912e+06	7.93824e+07	27.73374	58.30446	44.73305	1.00000	None	parabolic	box sum
596	736	7.71069	1.36312	118.87378	 91HisH	 89AlaHb*	 91HisN	5.58420e+06	1.04784e+08	26.96037	65.11929	41.55445	1.00000	None	parabolic	box sum
597	737	7.61817	8.00462	116.39399	 35LeuH	 34ValH	 35LeuN	3.53981e+07	4.68320e+08	29.89650	49.86053	39.91783	1.00000	None	parabolic	box sum
598	738	7.61969	7.76014	116.40456	 35LeuH	 36GlyH	 35LeuN	2.74029e+07	2.03271e+08	29.06203	29.23441	40.49754	1.00000	None	parabolic	box sum
599	739	7.61781	8.18103	116.39116	 35LeuH	 37TyrH	 35LeuN	6.47604e+06	7.62088e+07	30.19273	44.51941	39.15328	1.00000	None	parabolic	box sum
600	740	7.61448	4.17268	116.49751	 35LeuH	 31AlaHa	 35LeuN	6.47913e+06	1.08186e+08	56.65302	174.10543	42.68742	1.00000	None	parabolic	box sum
601	741	7.61846	3.85980	116.47148	 35LeuH	 32AlaHa	 35LeuN	1.49164e+07	1.83175e+08	48.86180	52.90820	35.96479	1.00000	None	parabolic	box sum
602	742	7.61868	4.01728	116.39903	 35LeuH	 35LeuHa	 35LeuN	3.46506e+07	4.87335e+08	30.15459	53.30884	41.17727	1.00000	None	parabolic	box sum
603	743	7.61870	3.71979	116.40049	 35LeuH	 34ValHa	 35LeuN	1.28937e+07	1.69375e+08	30.81053	47.27524	41.11093	1.00000	None	parabolic	box sum
604	744	7.61700	4.31181	116.36588	 35LeuH	 33SerHa	 35LeuN	4.96902e+06	6.09237e+07	35.06690	53.81563	39.08437	1.00000	None	parabolic	box sum
605	745	7.61865	2.24865	116.41195	 35LeuH	 34ValHb	 35LeuN	2.85030e+07	4.00078e+08	30.21687	53.74958	40.96365	1.00000	None	parabolic	box sum
606	746	7.61877	1.40768	116.39821	 35LeuH	 35LeuHbb	 35LeuN	7.96418e+07	1.15762e+09	30.22969	57.10844	40.69912	1.00000	None	parabolic	box sum
607	747	7.61869	1.18063	116.40713	 35LeuH	 35LeuHba	 35LeuN	2.79399e+07	4.00112e+08	30.25800	54.30159	40.92127	1.00000	None	parabolic	box sum
608	748	7.61874	1.00716	116.41093	 35LeuH	 (34Val/35Leu)(Hgb*/Hg)	 35LeuN	1.57202e+07	1.94247e+08	29.74540	55.32738	40.43001	1.00000	None	parabolic	box sum
609	749	7.61822	0.87963	116.41164	 35LeuH	 34ValHga*	 35LeuN	1.87638e+07	2.54234e+08	30.19631	50.04906	40.88163	1.00000	None	parabolic	box sum
610	750	7.61883	0.62457	116.39896	 35LeuH	 35LeuHdb*	 35LeuN	2.05080e+07	2.65743e+08	30.61235	47.93891	40.83389	1.00000	None	parabolic	box sum
611	751	7.61898	0.11766	116.40051	 35LeuH	 35LeuHda*	 35LeuN	2.00937e+07	2.61971e+08	29.93613	48.87505	40.29340	1.00000	None	parabolic	box sum
612	752	7.56737	1.48755	116.82834	 94GluH	 93LeuHba	 94GluN	1.63219e+07	2.25692e+08	30.04730	54.99239	39.54750	1.00000	None	parabolic	box sum
613	753	7.56676	2.10462	116.82660	 94GluH	 94GluHba	 94GluN	7.83400e+07	1.20970e+09	28.96518	65.94731	39.53242	1.00000	None	parabolic	box sum
614	754	7.56943	1.95369	116.83364	 94GluH	 95GlnHga	 94GluN	8.84309e+06	1.45051e+08	28.36913	275.72944	36.72171	1.00000	None	parabolic	box sum
615	755	7.56634	1.82766	116.82837	 94GluH	 93LeuHbb	 94GluN	2.88471e+07	3.98302e+08	28.19866	57.29126	39.18076	1.00000	None	parabolic	box sum
616	756	7.56701	0.79722	116.83839	 94GluH	 93LeuHda*	 94GluN	1.65092e+07	2.34760e+08	28.47403	61.23948	39.18135	1.00000	None	parabolic	box sum
617	757	7.56734	2.29840	116.81554	 94GluH	 94GluHga	 94GluN	1.58859e+07	2.18684e+08	30.88415	56.54621	39.81209	1.00000	None	parabolic	box sum
618	758	7.56664	2.46334	116.83125	 94GluH	 94GluHgb	 94GluN	2.43550e+07	3.07916e+08	28.92166	50.05810	39.38079	1.00000	None	parabolic	box sum
619	759	7.56699	3.88758	116.81928	 94GluH	 93LeuHa	 94GluN	2.00525e+07	2.67025e+08	29.66672	52.52957	39.78205	1.00000	None	parabolic	box sum
620	760	7.56708	4.22767	116.83542	 94GluH	 91HisHa	 94GluN	1.86871e+07	2.22883e+08	28.90795	46.32455	39.14839	1.00000	None	parabolic	box sum
621	761	7.56684	4.07149	116.82289	 94GluH	 94GluHa	 94GluN	4.94473e+07	6.23637e+08	29.46824	49.04490	39.79266	1.00000	None	parabolic	box sum
622	762	7.56732	7.43231	116.82208	 94GluH	 95GlnH	 94GluN	3.29397e+07	3.84795e+08	28.29880	61.68927	40.55691	1.00000	None	parabolic	box sum
623	763	8.00542	8.51734	116.99219	 23ThrH	 22ValH	 23ThrN	5.85491e+07	8.49592e+08	30.00498	58.25001	39.80356	1.00000	None	parabolic	box sum
624	764	8.00611	7.66607	117.01413	 23ThrH	 21AlaH	 23ThrN	1.17931e+07	1.60442e+08	31.82501	54.73398	39.49541	1.00000	None	parabolic	box sum
625	765	8.00541	3.81005	116.99222	 23ThrH	 23ThrHb	 23ThrN	3.43205e+07	5.51466e+08	30.51788	85.30664	40.21984	1.00000	None	parabolic	box sum
626	766	8.00600	4.13487	116.98980	 23ThrH	 23ThrHa	 23ThrN	8.54208e+07	1.32770e+09	29.99097	70.13301	39.40892	1.00000	None	parabolic	box sum
627	768	8.00645	1.90903	116.99420	 23ThrH	 (25Lys/20Arg)Hb*	 23ThrN	9.43479e+06	1.69300e+08	30.25591	240.33071	39.46728	1.00000	None	parabolic	box sum
628	769	8.00464	1.78212	116.99205	 23ThrH	 24ArgHba	 23ThrN	1.03175e+07	1.72120e+08	34.57546	237.45703	39.96700	1.00000	None	parabolic	box sum
629	770	8.00347	1.57812	117.00163	 23ThrH	 21AlaHb*	 23ThrN	8.42520e+06	1.25369e+08	32.68242	68.79229	37.55325	1.00000	None	parabolic	box sum
630	772	8.00539	1.23109	116.99469	 23ThrH	 23ThrHg2*	 23ThrN	2.54056e+07	3.20053e+08	31.02958	46.22665	40.36236	1.00000	None	parabolic	box sum
631	773	8.00146	1.08895	117.02656	 23ThrH	 22ValHgb*	 23ThrN	2.25181e+07	3.01551e+08	83.24057	50.31524	41.66549	1.00000	None	parabolic	box sum
632	775	7.93340	3.43881	117.22233	 27ValH	 27ValHa	 27ValN	2.64761e+07	3.70826e+08	30.20823	53.73661	39.95538	1.00000	None	parabolic	box sum
633	776	7.93348	2.28648	117.22289	 27ValH	 27ValHb	 27ValN	5.45550e+07	7.75490e+08	30.14624	55.64152	40.15696	1.00000	None	parabolic	box sum
634	777	7.93374	2.05468	117.21281	 23ThrH	 (26Leu/22Val)Hb*	 23ThrN	3.55914e+07	5.49407e+08	31.11273	62.75870	40.44235	1.00000	None	parabolic	box sum
635	780	7.93482	1.39866	117.20530	 27ValH	 89AlaHb*	 27ValN	5.59777e+06	8.14705e+07	31.88938	66.76353	40.76064	1.00000	None	parabolic	box sum
636	781	7.93358	1.09002	117.21975	 27ValH	 27ValHga*	 27ValN	7.52024e+07	1.11620e+09	30.65586	58.49122	39.84076	1.00000	None	parabolic	box sum
637	782	7.93396	0.91609	117.21109	 27ValH	 26LeuHdb*	 27ValN	1.26067e+07	1.40235e+08	31.17055	57.55430	40.18146	1.00000	None	parabolic	box sum
638	783	7.93347	0.76588	117.21263	 27ValH	 26LeuHda*	 27ValN	2.52557e+07	3.60498e+08	31.55977	58.13619	40.14963	1.00000	None	parabolic	box sum
639	784	7.93272	4.33085	117.21223	 27ValH	 26LeuHa	 27ValN	1.10712e+07	1.38204e+08	27.65357	48.83691	38.61457	1.00000	None	parabolic	box sum
640	787	7.93373	8.35875	117.22561	 27ValH	 28LeuH	 27ValN	3.27035e+07	4.16411e+08	30.38406	47.68974	39.98953	1.00000	None	parabolic	box sum
641	788	7.93500	9.24280	117.22262	 27ValH	 29AspH	 27ValN	3.95563e+06	5.18552e+07	28.98812	51.82870	39.63643	1.00000	None	parabolic	box sum
642	789	8.21455	8.77489	119.08692	 49PheH	 50LysH	 49PheN	2.02164e+07	2.79198e+08	29.69027	54.61181	39.77901	1.00000	None	parabolic	box sum
643	790	8.21515	6.92555	119.09392	 49PheH	 49PheHd*	 49PheN	3.21638e+07	4.72064e+08	29.60563	57.21735	40.12030	1.00000	None	parabolic	box sum
644	791	8.20887	7.38079	119.09545	 49PheH	 54PheHd*	 49PheN	4.93242e+06	8.21673e+07	119.46678	63.94017	45.41147	1.00000	None	parabolic	box sum
645	792	8.21512	4.65889	119.09345	 49PheH	 48SerHa	 49PheN	8.43668e+07	1.08265e+09	29.06442	49.41605	39.53665	1.00000	None	parabolic	box sum
646	793	8.21379	4.37395	119.09172	 49PheH	 48SerHbb	 49PheN	3.68078e+07	6.78876e+08	89.53959	146.01535	41.75979	1.00000	None	parabolic	box sum
647	794	8.21486	4.03496	119.10107	 49PheH	 48SerHba	 49PheN	1.88964e+07	2.58761e+08	29.03134	53.59821	41.27210	1.00000	None	parabolic	box sum
648	795	8.21460	3.80622	119.10454	 49PheH	 85ProHdb	 49PheN	6.56429e+06	1.03010e+08	30.65228	59.78554	63.03692	1.00000	None	parabolic	box sum
649	797	8.21518	2.52863	119.09058	 49PheH	 85ProHda	 49PheN	7.57971e+06	9.75853e+07	26.09342	61.52453	40.52395	1.00000	None	parabolic	box sum
650	798	8.21463	1.29834	119.09680	 49PheH	 79IleHb	 49PheN	5.04886e+06	7.69438e+07	111.87941	59.55868	42.24145	1.00000	None	parabolic	box sum
651	800	8.21173	0.76227	119.09514	 49PheH	 52LeuHda*	 49PheN	8.99807e+06	1.16613e+08	91.59178	50.67066	42.77408	1.00000	None	parabolic	box sum
652	801	7.98089	1.53641	119.05868	 69AlaH	 69AlaHb*	 69AlaN	1.14237e+08	1.47841e+09	29.17618	50.17566	39.46918	1.00000	None	parabolic	box sum
653	802	7.98111	1.27082	119.06708	 69AlaH	 68ThrHg2*	 69AlaN	2.96343e+07	3.94972e+08	29.30373	50.12966	41.43310	1.00000	None	parabolic	box sum
654	803	7.97979	0.91900	119.05150	 69AlaH	 66LeuHba	 69AlaN	5.99575e+06	7.77841e+07	29.11001	62.88176	42.44387	1.00000	None	parabolic	box sum
655	804	7.98153	0.77618	119.06609	 69AlaH	 26LeuHda*	 69AlaN	1.15061e+07	1.75050e+08	30.29585	61.77773	39.07412	1.00000	None	parabolic	box sum
656	805	7.98174	4.13902	119.18180	 69AlaH	 (67Gln/66Leu)Ha	 69AlaN	2.38428e+07	3.50560e+08	28.78934	48.06001	72.38573	1.00000	None	parabolic	box sum
657	806	7.98132	3.95361	119.05054	 69AlaH	 68ThrHa	 69AlaN	1.48053e+07	2.15078e+08	28.81825	52.84883	38.06782	1.00000	None	parabolic	box sum
658	807	7.98088	4.30835	119.05826	 69AlaH	 69AlaHa	 69AlaN	8.25550e+07	1.18474e+09	29.27184	57.40410	39.51901	1.00000	None	parabolic	box sum
659	808	7.98144	4.49829	119.23120	 69AlaH	 65HisHa	 69AlaN	9.92163e+06	1.41870e+08	27.82702	43.29792	71.65766	1.00000	None	parabolic	box sum
660	809	7.98075	7.62555	119.20266	 69AlaH	 70ThrH	 69AlaN	3.90763e+07	6.79549e+08	29.69295	47.79540	68.39782	1.00000	None	parabolic	box sum
661	810	7.98069	8.26410	119.05532	 69AlaH	 68ThrH	 69AlaN	3.72964e+07	4.80269e+08	28.67997	50.03284	37.22161	1.00000	None	parabolic	box sum
662	812	7.97686	7.11332	119.65029	 81AspH	 80PheHd*	 81AspN	6.60321e+06	8.37746e+07	32.16594	45.18849	42.16689	1.00000	None	parabolic	box sum
663	813	7.97731	6.68363	119.67168	 81AspH	 82HisHd2	 81AspN	8.41875e+06	1.03652e+08	29.52456	45.29405	40.25841	1.00000	None	parabolic	box sum
664	815	7.97731	3.24777	119.67888	 81AspH	 80PheHbb	 81AspN	2.04927e+07	2.74753e+08	29.79249	50.52873	40.65984	1.00000	None	parabolic	box sum
665	816	7.97678	2.88162	119.68082	 81AspH	 80PheHba	 81AspN	2.42423e+07	3.61223e+08	30.41893	57.23150	41.91369	1.00000	None	parabolic	box sum
666	817	7.97742	2.34384	119.67918	 81AspH	 81AspHbb	 81AspN	4.55270e+07	6.34790e+08	29.58566	55.90062	40.30293	1.00000	None	parabolic	box sum
667	818	7.97753	2.07455	119.67227	 81AspH	 81AspHba	 81AspN	3.01062e+07	4.17510e+08	29.89888	55.44022	40.59863	1.00000	None	parabolic	box sum
668	820	8.43269	1.01114	117.87319	 62LeuH	 34ValHgb*	 62LeuN	1.86030e+07	2.68623e+08	29.68013	139.14508	42.21153	1.00000	None	parabolic	box sum
669	821	8.43176	0.88120	117.89260	 62LeuH	 (62Leu/34Val)(Hdb*/Hga*)	 62LeuN	3.13057e+07	4.40330e+08	29.07723	52.90702	43.82324	1.00000	None	parabolic	box sum
670	822	8.43148	1.49014	117.87645	 62LeuH	 62LeuHba	 62LeuN	4.62182e+07	6.65564e+08	29.53231	58.76487	39.66218	1.00000	None	parabolic	box sum
671	823	8.43195	1.28053	117.86743	 62LeuH	 62LeuHg	 62LeuN	1.40270e+07	2.05882e+08	29.15025	64.11042	41.16875	1.00000	None	parabolic	box sum
672	825	8.43345	2.18603	117.83501	 62LeuH	 61GluHga	 62LeuN	2.74512e+07	5.11207e+08	27.09210	134.91378	80.85620	1.00000	None	parabolic	box sum
673	826	8.43146	1.80008	117.88098	 62LeuH	 62LeuHbb	 62LeuN	4.87850e+07	7.15677e+08	29.61844	58.21757	40.95650	1.00000	None	parabolic	box sum
674	827	8.43404	3.86889	117.86453	 62LeuH	 59AlaHa	 62LeuN	1.45486e+07	2.36096e+08	30.14565	56.93859	49.84683	1.00000	None	parabolic	box sum
675	828	8.43247	4.08187	117.87824	 62LeuH	 62LeuHa	 62LeuN	3.63013e+07	5.80229e+08	30.33727	93.42444	40.46178	1.00000	None	parabolic	box sum
676	829	8.43127	7.21749	117.88075	 62LeuH	 60LeuH	 62LeuN	1.42093e+07	2.01705e+08	30.30807	55.08184	39.99716	1.00000	None	parabolic	box sum
677	830	8.43168	7.63805	117.88169	 62LeuH	 63ArgH	 62LeuN	6.42555e+07	9.08832e+08	29.18839	52.51463	43.31374	1.00000	None	parabolic	box sum
678	831	8.44918	7.48770	117.71233	 46HisH	 47GluH	 46HisN	1.34663e+07	1.68196e+08	34.00415	50.95178	41.26543	1.00000	None	parabolic	box sum
679	832	8.45091	4.62716	117.70699	 46HisH	 46HisHa	 46HisN	1.05919e+07	1.32866e+08	33.65070	46.63870	39.93791	1.00000	None	parabolic	box sum
680	833	8.45071	3.27252	117.71265	 46HisH	 46HisHbb	 46HisN	9.67981e+06	1.40876e+08	34.93100	57.67264	40.02649	1.00000	None	parabolic	box sum
681	834	8.44864	2.93911	117.72055	 46HisH	 46HisHba	 46HisN	1.47437e+07	2.16303e+08	34.14094	55.30418	41.37611	1.00000	None	parabolic	box sum
682	835	8.48683	3.84912	118.38095	 22ValH	 19GlnHa	 22ValN	1.70175e+07	2.21894e+08	31.15445	46.56203	41.67753	1.00000	None	parabolic	box sum
683	836	8.48684	3.71545	118.38644	 22ValH	 22ValHa	 22ValN	4.10955e+07	5.29706e+08	29.69593	49.60871	39.52062	1.00000	None	parabolic	box sum
684	838	8.48687	1.58301	118.41216	 22ValH	 21AlaHb*	 22ValN	5.71467e+07	8.04420e+08	29.75553	52.95380	42.78201	1.00000	None	parabolic	box sum
685	839	8.48679	1.08923	118.38527	 22ValH	 22ValHgb*	 22ValN	7.80468e+07	1.01953e+09	29.87355	51.28991	39.57331	1.00000	None	parabolic	box sum
686	840	8.48677	0.87445	118.40593	 22ValH	 22ValHga*	 22ValN	3.61296e+07	5.60811e+08	31.05938	63.43967	45.45027	1.00000	None	parabolic	box sum
687	842	8.48608	4.13427	118.37513	 22ValH	 21AlaHa	 22ValN	2.58608e+07	4.29251e+08	33.02902	70.34689	41.91023	1.00000	None	parabolic	box sum
688	843	8.48727	8.00832	118.39119	 22ValH	 23ThrH	 22ValN	4.01992e+07	5.53782e+08	29.99693	54.74794	40.18456	1.00000	None	parabolic	box sum
689	844	8.48546	7.68298	118.37170	 22ValH	 21AlaH	 22ValN	3.90421e+07	5.72286e+08	33.06448	55.23351	43.50877	1.00000	None	parabolic	box sum
690	845	8.35340	7.93644	119.33647	 28LeuH	 27ValH	 28LeuN	3.75000e+07	4.87110e+08	30.79802	50.96259	40.10880	1.00000	None	parabolic	box sum
691	846	8.28554	7.97255	119.16300	 7LeuH	 8ThrH	 7LeuN	2.97550e+07	4.05665e+08	34.38383	50.33716	42.28789	1.00000	None	parabolic	box sum
692	848	8.28552	4.48245	119.15223	 7LeuH	 4AlaHa	 7LeuN	1.57301e+07	2.39562e+08	76.28173	112.13976	40.24923	1.00000	None	parabolic	box sum
693	849	8.28377	4.41445	119.13000	 7LeuH	 {*}H*	 7LeuN	1.49705e+07	2.53445e+08	138.27562	116.09427	40.53891	1.00000	None	parabolic	box sum
694	851	8.28616	1.82810	119.15071	 7LeuH	 7LeuHbb	 7LeuN	4.39345e+07	5.96751e+08	33.65874	53.35327	40.43466	1.00000	None	parabolic	box sum
695	852	8.28614	1.56135	119.15232	 7LeuH	 7LeuHba	 7LeuN	5.86164e+07	9.97573e+08	30.45291	88.35843	40.13485	1.00000	None	parabolic	box sum
696	853	8.28609	1.26940	119.15485	 7LeuH	 {*}Hg2*	 7LeuN	1.38437e+07	2.09246e+08	31.35443	62.96629	41.64404	1.00000	None	parabolic	box sum
697	854	8.28634	0.89237	119.15457	 7LeuH	 (7Leu/6Leu)(Hd*/Hda*)	 7LeuN	2.92651e+07	4.67934e+08	31.25519	74.11543	40.01206	1.00000	None	parabolic	box sum
698	855	8.35418	1.11603	119.34246	 28LeuH	 27ValHga*	 28LeuN	2.47092e+07	4.03780e+08	29.13356	73.20799	39.76583	1.00000	None	parabolic	box sum
699	856	8.35349	0.88306	119.32710	 28LeuH	 {*}Hdb*	 28LeuN	2.45783e+07	3.71502e+08	34.64460	118.74660	40.32624	1.00000	None	parabolic	box sum
700	857	8.35392	0.78277	119.33182	 28LeuH	 28LeuHda*	 28LeuN	2.16543e+07	3.98773e+08	31.15207	123.05654	40.94690	1.00000	None	parabolic	box sum
701	858	8.35396	1.29546	119.35888	 28LeuH	 40ThrHg2*	 28LeuN	6.54083e+06	1.03112e+08	75.10334	64.48118	41.41963	1.00000	None	parabolic	box sum
702	860	8.35416	1.97005	119.33936	 28LeuH	 28LeuHbb	 28LeuN	5.39678e+07	7.54745e+08	29.72126	58.09726	39.90179	1.00000	None	parabolic	box sum
703	862	8.35312	1.57711	119.32813	 28LeuH	 28LeuHba	 28LeuN	3.79230e+07	5.56825e+08	72.36153	62.35570	40.41666	1.00000	None	parabolic	box sum
704	863	8.35345	3.73752	119.32948	 28LeuH	 24ArgHa	 28LeuN	6.37677e+06	8.57956e+07	28.67311	56.71448	38.94639	1.00000	None	parabolic	box sum
705	864	8.35434	3.43800	119.34182	 28LeuH	 27ValHa	 28LeuN	1.08042e+07	1.47328e+08	30.47407	53.17083	39.85685	1.00000	None	parabolic	box sum
706	865	8.35360	2.96246	119.33086	 28LeuH	 29AspHbb	 28LeuN	4.12821e+06	6.21141e+07	29.93286	61.45612	40.79592	1.00000	None	parabolic	box sum
707	866	8.35168	4.34372	119.32650	 28LeuH	 26LeuHa	 28LeuN	7.47762e+06	1.15054e+08	188.19839	61.13176	43.30903	1.00000	None	parabolic	box sum
708	867	8.35419	3.98460	119.33905	 28LeuH	 28LeuHa	 28LeuN	5.42442e+07	7.10918e+08	29.53053	50.90853	40.05599	1.00000	None	parabolic	box sum
709	868	8.35252	7.77268	119.35044	 28LeuH	 26LeuH	 28LeuN	6.45253e+06	1.26164e+08	240.56703	109.91785	51.14585	1.00000	None	parabolic	box sum
710	869	8.15287	2.31268	118.87253	 52LeuH	 52LeuHbb	 52LeuN	4.60341e+07	6.57396e+08	32.26072	56.80727	40.42774	1.00000	None	parabolic	box sum
711	870	8.15279	1.83862	118.87540	 52LeuH	 52LeuHba	 52LeuN	7.20278e+07	1.03138e+09	31.82322	57.49611	40.06904	1.00000	None	parabolic	box sum
712	872	8.15292	2.98339	118.86014	 52LeuH	 51AspHbb	 52LeuN	1.54184e+07	1.90580e+08	30.07829	53.61315	38.77020	1.00000	None	parabolic	box sum
713	873	8.15383	0.99536	118.87302	 52LeuH	 52LeuHdb*	 52LeuN	1.81663e+07	2.44871e+08	66.27470	54.38377	38.84989	1.00000	None	parabolic	box sum
714	874	8.15338	0.76219	118.88203	 52LeuH	 52LeuHda*	 52LeuN	2.28521e+07	2.96593e+08	32.46158	49.38028	40.34275	1.00000	None	parabolic	box sum
715	875	8.15572	3.81244	118.83015	 52LeuH	 53GlyHaa	 52LeuN	6.18465e+06	8.55874e+07	100.76642	52.07664	166.19092	1.00000	None	parabolic	box sum
716	876	8.10985	4.32671	119.11320	 54PheH	 (52Leu/50Lys)Ha	 54PheN	3.15280e+07	4.84796e+08	95.68691	75.71249	38.22923	1.00000	None	parabolic	box sum
717	877	8.15271	4.54246	118.86646	 52LeuH	 51AspHa	 52LeuN	1.30391e+07	1.75085e+08	31.73172	54.56345	39.73401	1.00000	None	parabolic	box sum
718	878	8.15345	4.32984	118.88761	 52LeuH	 52LeuHa	 52LeuN	4.54116e+07	7.44615e+08	38.55467	68.41996	45.70532	1.00000	None	parabolic	box sum
719	879	8.14942	7.74253	118.88495	 52LeuH	 53GlyH	 52LeuN	3.80052e+07	5.30070e+08	59.74740	53.11795	43.36321	1.00000	None	parabolic	box sum
720	880	8.15274	8.01081	118.85796	 52LeuH	 51AspH	 52LeuN	4.67001e+07	5.47177e+08	31.72994	39.69294	38.62619	1.00000	None	parabolic	box sum
721	881	8.15749	8.77331	118.89250	 52LeuH	 50LysH	 52LeuN	5.58956e+06	7.95089e+07	76.29663	57.28232	37.41622	1.00000	None	parabolic	box sum
722	882	7.98049	8.88074	119.05797	 69AlaH	 67GlnH	 69AlaN	3.90785e+06	4.89780e+07	28.52082	50.53005	35.78860	1.00000	None	parabolic	box sum
723	883	7.98054	8.60470	119.07473	 69AlaH	 71GlyH	 69AlaN	7.81913e+06	9.41889e+07	27.84610	49.14850	38.37520	1.00000	None	parabolic	box sum
724	884	7.76864	2.04870	119.55090	 26LeuH	 26LeuHbb	 26LeuN	6.71825e+07	1.08772e+09	29.39373	76.25507	40.50899	1.00000	None	parabolic	box sum
725	885	7.76889	1.73620	119.55424	 26LeuH	 26LeuHba	 26LeuN	6.43109e+07	9.13113e+08	29.07693	59.68607	40.45069	1.00000	None	parabolic	box sum
726	887	7.76808	1.08903	119.55581	 26LeuH	 22ValHgb*	 26LeuN	1.13197e+07	1.58722e+08	29.19912	53.12247	40.47579	1.00000	None	parabolic	box sum
727	888	7.76789	0.91063	119.55205	 26LeuH	 26LeuHdb*	 26LeuN	1.70363e+07	2.50209e+08	30.67553	137.64631	40.83174	1.00000	None	parabolic	box sum
728	889	7.76764	0.77534	119.55175	 26LeuH	 26LeuHda*	 26LeuN	1.71071e+07	2.57336e+08	73.20940	137.50320	41.07183	1.00000	None	parabolic	box sum
729	890	7.76833	4.32922	119.55438	 26LeuH	 26LeuHa	 26LeuN	4.06357e+07	5.34671e+08	29.65838	50.33489	40.66539	1.00000	None	parabolic	box sum
730	891	7.76871	3.97794	119.55185	 26LeuH	 25LysHa	 26LeuN	1.52954e+07	1.95041e+08	28.48774	45.99232	41.67789	1.00000	None	parabolic	box sum
731	892	7.76903	3.80122	119.55085	 26LeuH	 23ThrHb	 26LeuN	2.48179e+07	3.59851e+08	28.93478	65.50028	40.40110	1.00000	None	parabolic	box sum
732	893	7.76929	7.93668	119.57431	 26LeuH	 27ValH	 26LeuN	3.57981e+07	2.90770e+08	28.71633	35.39598	41.45938	1.00000	None	parabolic	box sum
733	894	7.76658	8.36497	119.47127	 26LeuH	 28LeuH	 26LeuN	5.05369e+06	8.12887e+07	47.53292	60.59183	42.61667	1.00000	None	parabolic	box sum
734	895	7.70126	8.60150	119.61570	 72LeuH	 71GlyH	 72LeuN	3.97541e+07	5.32369e+08	30.44188	52.67436	39.45178	1.00000	None	parabolic	box sum
735	896	7.70149	4.44962	119.61182	 72LeuH	 72LeuHa	 72LeuN	3.60908e+07	4.90530e+08	30.92796	55.53497	39.18445	1.00000	None	parabolic	box sum
736	897	7.70327	4.31677	119.60461	 72LeuH	 71GlyHab	 72LeuN	1.73776e+07	2.15650e+08	76.49153	47.16043	36.01176	1.00000	None	parabolic	box sum
737	898	7.69849	4.14765	119.58274	 72LeuH	 70ThrHb	 72LeuN	4.11493e+07	5.97021e+08	75.61624	54.70263	40.70985	1.00000	None	parabolic	box sum
738	899	7.70104	3.87656	119.58343	 72LeuH	 71GlyHaa	 72LeuN	1.62963e+07	2.52663e+08	31.22389	57.49689	77.70890	1.00000	None	parabolic	box sum
739	902	7.70145	0.81431	119.60401	 72LeuH	 (74Leu/72Leu)Hda*	 72LeuN	4.16278e+07	6.62872e+08	32.38708	72.50343	41.02367	1.00000	None	parabolic	box sum
740	905	7.63153	0.24104	119.49192	 63ArgH	 62LeuHda*	 63ArgN	8.47404e+06	1.10144e+08	29.51145	48.08085	40.54129	1.00000	None	parabolic	box sum
741	906	7.62862	2.28736	119.51746	 63ArgH	 63ArgHbb	 63ArgN	3.94405e+07	6.02200e+08	29.13147	344.15216	39.93553	1.00000	None	parabolic	box sum
742	907	7.63260	1.48784	119.50795	 63ArgH	 62LeuHba	 63ArgN	1.90896e+07	3.14269e+08	106.45956	187.74334	39.13796	1.00000	None	parabolic	box sum
743	908	7.63056	1.36202	119.49754	 63ArgH	None	 63ArgN	1.60873e+07	3.01474e+08	29.25009	196.10018	40.30657	1.00000	None	parabolic	box sum
744	909	7.64035	2.18649	119.43391	 61GluH	 61GluHga	 61GluN	6.92889e+07	1.07264e+09	29.16008	74.43508	39.65116	1.00000	None	parabolic	box sum
745	910	7.63285	2.04296	119.48330	 63ArgH	 63ArgHba	 63ArgN	7.97430e+07	1.23197e+09	30.71666	86.50385	40.36498	1.00000	None	parabolic	box sum
746	911	7.64088	1.92862	119.42809	 61GluH	 60LeuHbb	 61GluN	4.70185e+07	8.10395e+08	30.10720	327.99284	39.55966	1.00000	None	parabolic	box sum
747	912	7.63186	1.80704	119.49223	 63ArgH	 62LeuHbb	 63ArgN	2.82097e+07	4.69965e+08	30.12240	358.65780	41.23622	1.00000	None	parabolic	box sum
748	913	7.63538	1.27735	119.48208	 63ArgH	 62LeuHg	 63ArgN	1.58038e+07	2.68391e+08	76.34729	201.36671	39.93893	1.00000	None	parabolic	box sum
749	914	7.64058	2.42845	119.43558	 61GluH	 61GluHgb	 61GluN	2.80280e+07	3.29095e+08	28.65314	43.06281	39.06119	1.00000	None	parabolic	box sum
750	915	7.22043	-0.00557	119.47829	 60LeuH	 79IleHd1*	 60LeuN	1.95139e+06	2.34816e+07	26.21561	46.10005	43.16777	1.00000	None	parabolic	box sum
751	916	7.21511	2.42770	119.47566	 60LeuH	 61GluHgb	 60LeuN	2.56206e+06	2.67874e+07	28.66030	38.94474	38.41221	1.00000	None	parabolic	box sum
752	917	8.44688	0.89150	107.89596	 98GlyH	 96IleHg2*	 98GlyN	2.03728e+06	2.96545e+07	35.80689	54.50290	42.71495	1.00000	None	parabolic	box sum
753	918	7.57276	3.24473	108.68377	 79IleH	 80PheHbb	 79IleN	2.03869e+06	2.94700e+07	39.21092	59.49381	46.69034	1.00000	None	parabolic	box sum
754	919	7.57375	2.87764	108.63889	 79IleH	 80PheHba	 79IleN	2.52139e+06	3.59624e+07	31.87060	58.40394	43.99276	1.00000	None	parabolic	box sum
755	920	7.57367	2.69846	108.64036	 79IleH	 49PheHbb	 79IleN	2.25533e+06	3.79491e+07	33.00637	70.52736	42.62173	1.00000	None	parabolic	box sum
756	921	7.57330	2.31913	108.61840	 79IleH	 82HisHba	 79IleN	2.05470e+06	3.35596e+07	28.12862	84.64415	40.18438	1.00000	None	parabolic	box sum
757	922	7.30438	2.87442	109.57918	 84ThrH	 86HisHbb	 84ThrN	1.86284e+06	2.24179e+07	28.52798	49.47464	39.36327	1.00000	None	parabolic	box sum
758	923	7.31104	2.69335	109.59906	 84ThrH	 86HisHba	 84ThrN	2.13746e+06	2.06341e+07	26.44300	38.68407	36.86070	1.00000	None	parabolic	box sum
759	924	7.30731	6.98806	109.58487	 84ThrH	 49PheHe*	 84ThrN	1.41166e+07	2.16215e+08	29.03938	87.59155	39.63387	1.00000	None	parabolic	box sum
760	925	7.61991	2.59955	101.56832	 70ThrH	 67GlnHga	 70ThrN	2.18112e+06	3.86344e+07	33.60480	97.42495	42.33003	1.00000	None	parabolic	box sum
761	926	7.62008	2.28701	101.53560	 70ThrH	 67GlnHba	 70ThrN	1.86971e+06	2.41606e+07	27.60142	53.70987	43.01703	1.00000	None	parabolic	box sum
762	927	7.61855	2.01527	101.54121	 70ThrH	 66LeuHbb	 70ThrN	2.42078e+06	3.97362e+07	33.73176	69.27039	49.29948	1.00000	None	parabolic	box sum
763	930	7.73699	0.62358	102.82694	 53GlyH	 35LeuHdb*	 53GlyN	2.74817e+06	3.22677e+07	30.53874	44.58595	36.78179	1.00000	None	parabolic	box sum
764	931	7.73720	1.64559	102.83616	 53GlyH	None	 53GlyN	1.46641e+06	1.90872e+07	23.13972	61.68534	43.27035	1.00000	None	parabolic	box sum
765	932	7.73481	2.00940	102.78017	 53GlyH	 50LysHbb	 53GlyN	1.83302e+06	2.55724e+07	28.59533	65.21090	39.14475	1.00000	None	parabolic	box sum
766	934	7.73715	2.98565	102.81533	 53GlyH	 51AspHbb	 53GlyN	2.54415e+06	2.89043e+07	32.61924	42.07634	41.85212	1.00000	None	parabolic	box sum
767	936	7.74178	8.77226	102.78781	 53GlyH	 50LysH	 53GlyN	1.57924e+06	2.69392e+07	51.71239	62.98959	41.97073	1.00000	None	parabolic	box sum
768	937	8.77578	9.12207	111.71154	 15ThrH	 19GlnH	 15ThrN	4.29947e+06	2.66185e+07	29.70070	28.64784	38.93757	1.00000	None	parabolic	box sum
769	938	8.77918	3.84223	111.68171	 15ThrH	 19GlnHa	 15ThrN	2.08281e+06	2.63030e+07	28.09376	48.17285	44.60931	1.00000	None	parabolic	box sum
770	939	8.59251	2.27786	111.28159	 71GlyH	 67GlnHba	 71GlyN	1.48104e+06	1.77559e+07	29.99932	49.91302	36.66890	1.00000	None	parabolic	box sum
771	940	8.59482	2.57119	111.18254	 71GlyH	 67GlnHga	 71GlyN	1.59431e+06	2.66317e+07	28.80692	91.56749	36.04472	1.00000	None	parabolic	box sum
772	941	8.59302	7.98084	111.25082	 71GlyH	 69AlaH	 71GlyN	8.14726e+06	9.75601e+07	35.17926	47.00897	40.41910	1.00000	None	parabolic	box sum
773	942	8.17666	7.55680	111.31119	 17ThrH	 18GluH	 17ThrN	7.76928e+06	1.06420e+08	30.94524	55.17738	40.16125	1.00000	None	parabolic	box sum
774	943	8.17393	4.40548	111.33249	 17ThrH	 15ThrHa	 17ThrN	1.72681e+06	1.81237e+07	28.52440	37.55134	39.79170	1.00000	None	parabolic	box sum
775	944	8.17582	4.11483	111.33122	 17ThrH	 17ThrHb	 17ThrN	1.65179e+07	2.24076e+08	32.50748	54.07631	38.99407	1.00000	None	parabolic	box sum
776	945	8.17587	3.97891	111.32646	 17ThrH	 17ThrHa	 17ThrN	1.22412e+07	1.44887e+08	31.23432	41.93834	39.48796	1.00000	None	parabolic	box sum
777	946	8.18127	2.35020	111.37607	 17ThrH	 18GluHgb	 17ThrN	1.53141e+06	2.73960e+07	32.96375	99.02358	36.15654	1.00000	None	parabolic	box sum
778	947	8.18756	2.08521	111.44400	 17ThrH	 18GluHba	 17ThrN	1.34044e+06	1.58179e+07	47.92660	54.12427	33.44083	1.00000	None	parabolic	box sum
779	948	8.17515	1.52962	111.32772	 17ThrH	 16AlaHb*	 17ThrN	1.38489e+07	1.79461e+08	32.82875	48.83967	39.04772	1.00000	None	parabolic	box sum
780	949	8.17567	1.30742	111.31125	 17ThrH	 17ThrHg2*	 17ThrN	7.02304e+06	9.01099e+07	31.86047	48.72761	40.34209	1.00000	None	parabolic	box sum
781	950	7.97045	0.89160	111.38708	 8ThrH	 (7Leu/6Leu)(Hd*/Hdb*)	 8ThrN	1.53372e+07	2.43130e+08	30.60818	77.75383	39.67416	1.00000	None	parabolic	box sum
782	951	7.97045	0.75651	111.38737	 8ThrH	 11LeuHda*	 8ThrN	8.50394e+06	1.40982e+08	28.48387	159.94853	41.33308	1.00000	None	parabolic	box sum
783	952	7.97029	1.82847	111.38641	 8ThrH	 7LeuHbb	 8ThrN	2.34913e+07	3.27962e+08	29.38986	56.79036	40.09020	1.00000	None	parabolic	box sum
784	953	7.97113	1.55448	111.38636	 8ThrH	 7LeuHba	 8ThrN	2.04807e+07	3.52301e+08	28.72080	94.71247	38.91683	1.00000	None	parabolic	box sum
785	955	7.95128	3.32703	111.17021	 39SerH	 37TyrHbb	 39SerN	3.71406e+06	5.20795e+07	30.86776	56.71606	38.05196	1.00000	None	parabolic	box sum
786	956	7.95746	2.93221	111.22156	 39SerH	 37TyrHba	 39SerN	2.22387e+06	3.18294e+07	36.06379	58.82817	37.53483	1.00000	None	parabolic	box sum
787	957	7.97023	3.71823	111.39046	 8ThrH	 8ThrHa	 8ThrN	3.49169e+07	4.26444e+08	29.32012	45.13443	39.74974	1.00000	None	parabolic	box sum
788	958	7.96711	4.01281	111.29369	 39SerH	 39SerHbb	 39SerN	4.18799e+06	5.98670e+07	36.99720	52.82681	42.88459	1.00000	None	parabolic	box sum
789	959	7.96951	4.41422	111.38446	 8ThrH	 5ThrHa	 8ThrN	9.22067e+06	1.30024e+08	28.82659	60.92849	39.49404	1.00000	None	parabolic	box sum
790	960	7.97040	4.26097	111.38850	 8ThrH	 8ThrHb	 8ThrN	4.50342e+07	6.64301e+08	29.32161	63.06065	39.75809	1.00000	None	parabolic	box sum
791	961	7.95290	3.85134	111.18140	 39SerH	 39SerHba	 39SerN	5.27759e+06	5.04397e+07	32.59271	35.93974	37.91177	1.00000	None	parabolic	box sum
792	962	7.97011	8.29703	111.38351	 8ThrH	 7LeuH	 8ThrN	2.28283e+07	2.93998e+08	29.41757	54.10098	40.17377	1.00000	None	parabolic	box sum
793	963	7.83864	1.14053	110.75415	 77ThrH	 77ThrHg2*	 77ThrN	4.49082e+07	5.87272e+08	30.63500	48.49014	40.72464	1.00000	None	parabolic	box sum
794	965	7.84154	1.74581	110.79023	 77ThrH	 78LeuHba	 77ThrN	4.55795e+06	6.24872e+07	29.15353	52.52486	40.57705	1.00000	None	parabolic	box sum
795	966	7.84326	1.39217	110.83550	 77ThrH	 59AlaHb*	 77ThrN	1.73005e+06	1.79154e+07	29.50072	40.23827	40.02571	1.00000	None	parabolic	box sum
796	967	7.83919	2.10704	110.73796	 77ThrH	 78LeuHbb	 77ThrN	4.76818e+06	7.57940e+07	30.09498	61.14905	40.59827	1.00000	None	parabolic	box sum
797	968	7.83841	4.39343	110.75309	 77ThrH	 77ThrHa	 77ThrN	3.39241e+07	4.53555e+08	30.40195	51.16842	40.20119	1.00000	None	parabolic	box sum
798	969	7.83861	4.01257	110.75875	 77ThrH	 76SerHa	 77ThrN	2.73330e+07	4.31331e+08	30.54261	67.08672	41.19277	1.00000	None	parabolic	box sum
799	970	7.83903	3.70565	110.74479	 77ThrH	 75SerHba	 77ThrN	1.43962e+07	1.93962e+08	30.17277	51.82934	40.85922	1.00000	None	parabolic	box sum
800	971	7.83891	7.32696	110.76417	 77ThrH	 78LeuH	 77ThrN	3.75711e+07	4.99581e+08	30.61533	49.25623	40.78567	1.00000	None	parabolic	box sum
801	972	7.66696	8.87733	111.49884	 33SerH	 31AlaH	 33SerN	4.85038e+06	3.67102e+07	28.83077	30.23876	38.66124	1.00000	None	parabolic	box sum
802	973	7.66593	8.74094	111.51712	 33SerH	 32AlaH	 33SerN	3.89857e+07	4.96681e+08	28.71424	46.85032	40.43913	1.00000	None	parabolic	box sum
803	974	7.66614	8.00687	111.52011	 33SerH	 34ValH	 33SerN	3.72050e+07	4.46368e+08	28.51993	45.35588	40.60853	1.00000	None	parabolic	box sum
804	975	7.66585	4.30882	111.51167	 33SerH	 33SerHa	 33SerN	4.56095e+07	6.15109e+08	28.77980	51.41454	39.94560	1.00000	None	parabolic	box sum
805	976	7.66600	4.05535	111.51503	 33SerH	 33SerHba	 33SerN	1.07251e+08	1.52850e+09	28.92405	55.39343	40.14289	1.00000	None	parabolic	box sum
806	977	7.66623	3.87667	111.51082	 33SerH	 32AlaHa	 33SerN	1.38495e+07	1.56909e+08	28.53990	49.24109	40.30907	1.00000	None	parabolic	box sum
807	978	7.66627	3.71645	111.52631	 33SerH	 34ValHa	 33SerN	4.13088e+06	3.78290e+07	28.61142	32.20422	41.60821	1.00000	None	parabolic	box sum
808	979	7.66666	3.34099	111.47980	 33SerH	 37TyrHbb	 33SerN	1.70039e+06	2.09994e+07	28.58371	51.20066	38.18774	1.00000	None	parabolic	box sum
809	981	7.66594	2.93696	111.48730	 33SerH	 37TyrHba	 33SerN	3.23261e+06	4.44704e+07	30.24936	56.62995	39.85751	1.00000	None	parabolic	box sum
810	982	7.66328	2.60493	111.45896	 33SerH	 29AspHba	 33SerN	1.58267e+06	2.01932e+07	35.70348	47.43329	39.84892	1.00000	None	parabolic	box sum
811	983	7.66720	2.25172	111.50213	 33SerH	 34ValHb	 33SerN	5.34147e+06	6.72310e+07	26.32946	49.65982	39.07037	1.00000	None	parabolic	box sum
812	984	7.66717	2.04606	111.53123	 33SerH	 30GlnHba	 33SerN	3.16559e+06	5.61709e+07	28.09495	83.45048	40.33613	1.00000	None	parabolic	box sum
813	985	7.66493	1.67376	111.53035	 33SerH	 31AlaHb*	 33SerN	6.36561e+06	4.96232e+07	29.02746	42.30989	40.38990	1.00000	None	parabolic	box sum
814	986	7.66607	1.52286	111.51278	 33SerH	 32AlaHb*	 33SerN	5.44548e+07	7.12951e+08	28.82868	50.57551	40.21955	1.00000	None	parabolic	box sum
815	987	7.66618	1.36172	111.53454	 33SerH	 35LeuHbb	 33SerN	1.57110e+06	3.15163e+07	25.60437	225.39573	51.53656	1.00000	None	parabolic	box sum
816	989	7.66599	1.27627	111.48088	 33SerH	 40ThrHg2*	 33SerN	3.57985e+06	4.03184e+07	26.73537	42.18289	37.94706	1.00000	None	parabolic	box sum
817	990	7.66573	1.01498	111.52565	 33SerH	 34ValHgb*	 33SerN	1.99843e+06	1.98272e+07	23.96047	36.41154	36.57746	1.00000	None	parabolic	box sum
818	991	7.66591	0.88054	111.51756	 33SerH	 34ValHga*	 33SerN	1.35655e+07	1.80060e+08	29.22028	52.64163	39.94894	1.00000	None	parabolic	box sum
819	992	7.66783	0.62462	111.51893	 33SerH	 35LeuHdb*	 33SerN	1.25102e+06	1.22570e+07	21.78401	45.38566	35.73000	1.00000	None	parabolic	box sum
820	993	8.07792	1.40344	112.43983	 5ThrH	 4AlaHb*	 5ThrN	2.02530e+06	2.11843e+07	29.21522	38.41199	36.50618	1.00000	None	parabolic	box sum
821	994	8.92554	7.64749	113.62950	 58ThrH	 61GluH	 58ThrN	2.80674e+06	4.09338e+07	29.10674	53.77357	40.84218	1.00000	None	parabolic	box sum
822	995	8.92566	7.39027	113.65849	 58ThrH	 54PheHd*	 58ThrN	2.72175e+06	3.22655e+07	29.39194	51.19279	39.37793	1.00000	None	parabolic	box sum
823	998	8.92418	3.28470	113.65214	 58ThrH	 55AspHbb	 58ThrN	2.69236e+06	3.11704e+07	32.72235	44.42672	37.60862	1.00000	None	parabolic	box sum
824	999	8.92310	2.74100	113.65713	 58ThrH	 55AspHba	 58ThrN	2.87212e+06	5.00051e+07	33.45490	85.66404	39.61325	1.00000	None	parabolic	box sum
825	1001	7.44139	1.66313	114.43358	 95GlnH	 96IleHg1b	 95GlnN	6.70256e+06	8.52568e+07	29.85239	48.06787	40.86661	1.00000	None	parabolic	box sum
826	1002	7.44123	1.49457	114.42065	 95GlnH	 (72Leu/93Leu)(Hg/Hba)	 95GlnN	2.86716e+06	4.11083e+07	26.48294	57.70291	40.41231	1.00000	None	parabolic	box sum
827	1003	7.44166	1.22411	114.43008	 95GlnH	 96IleHg1a	 95GlnN	6.73575e+06	9.05811e+07	28.91481	54.60984	39.03151	1.00000	None	parabolic	box sum
828	1004	7.44034	1.07136	114.44511	 95GlnH	 93LeuHdb*	 95GlnN	2.38106e+06	2.51403e+07	29.84345	48.43981	38.94305	1.00000	None	parabolic	box sum
829	1006	7.44135	2.25654	114.42469	 95GlnH	 95GlnHbb	 95GlnN	6.87070e+07	9.18963e+08	30.14416	52.49379	39.49893	1.00000	None	parabolic	box sum
830	1007	7.44211	2.09688	114.42640	 95GlnH	 94GluHba	 95GlnN	2.07614e+07	2.96143e+08	29.92839	59.19146	39.50429	1.00000	None	parabolic	box sum
831	1008	7.44130	1.92858	114.42736	 95GlnH	 94GluHb*	 95GlnN	6.38154e+07	9.70753e+08	30.23148	63.87216	39.91795	1.00000	None	parabolic	box sum
832	1009	7.44063	2.46805	114.42925	 95GlnH	 94GluHgb	 95GlnN	2.66960e+06	2.29638e+07	25.52629	35.51393	38.61821	1.00000	None	parabolic	box sum
833	1010	7.44138	4.32877	114.48099	 95GlnH	 96IleHa	 95GlnN	3.06727e+06	2.30755e+07	29.52695	33.48674	38.77318	1.00000	None	parabolic	box sum
834	1011	7.44135	4.19567	114.42399	 95GlnH	 95GlnHa	 95GlnN	3.84702e+07	4.97574e+08	29.81365	49.38146	39.70611	1.00000	None	parabolic	box sum
835	1012	7.44142	4.06706	114.42251	 95GlnH	 94GluHa	 95GlnN	1.77818e+07	2.02116e+08	30.67970	41.41031	39.72983	1.00000	None	parabolic	box sum
836	1013	7.44154	3.89251	114.42060	 95GlnH	 93LeuHa	 95GlnN	9.78202e+06	1.35607e+08	29.07664	54.68336	39.26361	1.00000	None	parabolic	box sum
837	1014	7.44195	3.59607	114.41645	 95GlnH	 92LeuHa	 95GlnN	1.18879e+07	1.56537e+08	29.85239	51.67010	39.42144	1.00000	None	parabolic	box sum
838	1015	7.44071	7.28400	114.42967	 95GlnH	 96IleH	 95GlnN	6.05614e+07	6.99214e+08	30.10720	40.10282	40.10081	1.00000	None	parabolic	box sum
839	1016	7.57327	0.89662	115.01200	 11LeuH	 14LeuHdb*	 11LeuN	1.89605e+07	2.87211e+08	30.60818	61.12822	38.99300	1.00000	None	parabolic	box sum
840	1017	7.57342	0.76176	115.01756	 11LeuH	 11LeuHdb*	 11LeuN	4.44429e+07	6.03369e+08	32.53311	55.65567	39.92850	1.00000	None	parabolic	box sum
841	1018	7.57329	1.92616	115.00846	 11LeuH	 10LysHba	 11LeuN	8.60635e+07	1.22097e+09	31.17085	57.51852	39.63542	1.00000	None	parabolic	box sum
842	1019	7.57355	1.77644	115.02313	 11LeuH	 11LeuHbb	 11LeuN	4.59507e+07	6.48080e+08	58.09516	56.17898	40.35616	1.00000	None	parabolic	box sum
843	1020	7.57351	1.48793	115.01712	 11LeuH	 (11Leu/12Ala)Hb*	 11LeuN	4.18823e+07	6.26628e+08	33.04362	67.02696	39.60598	1.00000	None	parabolic	box sum
844	1021	7.57346	1.29268	114.99333	 11LeuH	 8ThrHg2*	 11LeuN	3.57252e+06	5.88740e+07	63.07155	61.71955	41.17000	1.00000	None	parabolic	box sum
845	1022	7.63103	0.79233	115.36539	 93LeuH	 93LeuHda*	 93LeuN	4.56284e+07	7.06040e+08	33.93650	64.61918	41.14479	1.00000	None	parabolic	box sum
846	1024	7.63148	1.22915	115.34472	 93LeuH	 96IleHg1a	 93LeuN	1.48998e+07	1.82781e+08	30.42817	46.91942	39.34634	1.00000	None	parabolic	box sum
847	1025	7.63162	1.07231	115.36237	 93LeuH	 93LeuHdb*	 93LeuN	1.74934e+07	2.37162e+08	29.37049	54.11916	40.32755	1.00000	None	parabolic	box sum
848	1026	7.63179	2.12620	115.36377	 93LeuH	 {*}(Hg/Hba/Hga)	 93LeuN	1.28745e+07	1.92000e+08	30.63768	62.29043	40.64411	1.00000	None	parabolic	box sum
849	1027	7.62860	1.95794	115.32353	 93LeuH	 {*}(Hbb/Hga/Hba/Hb2)	 93LeuN	3.40394e+07	4.80629e+08	67.18516	148.84421	43.06519	1.00000	None	parabolic	box sum
850	1028	7.63163	1.82378	115.37688	 93LeuH	 93LeuHbb	 93LeuN	9.49120e+07	1.36611e+09	30.44754	55.85422	40.83252	1.00000	None	parabolic	box sum
851	1029	7.63148	3.00724	115.34805	 93LeuH	 91HisHbb	 93LeuN	2.02170e+06	2.79350e+07	28.94044	58.75543	38.34516	1.00000	None	parabolic	box sum
852	1030	7.63041	2.46739	115.38071	 93LeuH	 94GluHgb	 93LeuN	1.57566e+06	1.49792e+07	38.76507	35.69282	38.91611	1.00000	None	parabolic	box sum
853	1031	7.63143	3.59248	115.37446	 93LeuH	 92LeuHa	 93LeuN	1.06813e+07	1.44345e+08	30.44873	51.42830	40.84402	1.00000	None	parabolic	box sum
854	1033	7.80457	3.41821	115.01540	 90GluH	 88ValHa	 90GluN	4.85709e+06	5.98576e+07	29.97428	45.70767	39.22474	1.00000	None	parabolic	box sum
855	1034	7.80386	3.01471	115.01896	 90GluH	 91HisHbb	 90GluN	5.00000e+06	7.09108e+07	31.51029	57.09075	39.76309	1.00000	None	parabolic	box sum
856	1036	7.80662	2.33534	115.04276	 90GluH	 88ValHb	 90GluN	2.31323e+06	1.51439e+07	28.39237	291.08984	37.39792	1.00000	None	parabolic	box sum
857	1037	7.80388	2.22064	115.03263	 90GluH	 90GluHgb	 90GluN	2.65520e+07	3.67972e+08	29.92600	56.60911	38.99050	1.00000	None	parabolic	box sum
858	1038	7.80382	2.09335	115.03034	 90GluH	 90GluHbb	 90GluN	7.75060e+07	1.08397e+09	29.93286	58.11496	39.49773	1.00000	None	parabolic	box sum
859	1040	7.80386	1.75080	115.04072	 90GluH	 87AlaHb*	 90GluN	8.27742e+06	1.14914e+08	30.72441	78.33376	40.22759	1.00000	None	parabolic	box sum
860	1041	7.80374	1.40093	115.02768	 90GluH	 89AlaHb*	 90GluN	4.62536e+07	6.10696e+08	30.13670	51.58439	39.53904	1.00000	None	parabolic	box sum
861	1042	7.80602	1.25429	115.07876	 90GluH	 23ThrHg2*	 90GluN	3.36830e+06	5.04465e+07	54.68100	60.64776	44.96884	1.00000	None	parabolic	box sum
862	1045	7.85704	3.72153	115.30538	 9SerH	 8ThrHa	 9SerN	4.98812e+06	6.12567e+07	29.60205	45.56337	39.12383	1.00000	None	parabolic	box sum
863	1046	7.85042	0.90799	115.31754	 9SerH	 7LeuHdb*	 9SerN	2.72492e+06	4.05083e+07	58.92634	137.45052	40.16846	1.00000	None	parabolic	box sum
864	1047	8.46647	2.03847	115.74861	 86HisH	 85ProHba	 86HisN	3.43580e+07	5.17551e+08	29.36661	66.14272	39.68018	1.00000	None	parabolic	box sum
865	1048	8.46629	1.74645	115.76154	 86HisH	 87AlaHb*	 86HisN	7.56734e+06	1.08280e+08	27.72748	61.17500	39.19470	1.00000	None	parabolic	box sum
866	1049	8.46672	1.31891	115.76273	 86HisH	 88ValHgb*	 86HisN	7.50935e+06	1.12146e+08	27.95070	71.58695	38.86825	1.00000	None	parabolic	box sum
867	1050	8.46547	1.10628	115.73004	 86HisH	 (27Val/45Thr)(Hgb*/Hg2*)	 86HisN	1.04838e+07	1.70215e+08	30.02793	117.21048	39.93154	1.00000	None	parabolic	box sum
868	1051	8.46608	1.01910	115.77006	 86HisH	 45ThrHg2*	 86HisN	8.59711e+06	1.40074e+08	29.04147	125.27363	39.80750	1.00000	None	parabolic	box sum
869	1052	8.46459	0.87615	115.74620	 86HisH	 88ValHga*	 86HisN	2.12026e+06	3.12860e+07	26.96931	278.66721	37.81760	1.00000	None	parabolic	box sum
870	1053	8.46417	0.77210	115.73590	 86HisH	 28LeuHda*	 86HisN	3.87863e+06	5.26873e+07	29.89858	63.69130	40.54797	1.00000	None	parabolic	box sum
871	1055	8.46671	2.87230	115.75492	 86HisH	 86HisHbb	 86HisN	4.66928e+07	6.23362e+08	29.59937	53.53727	39.77150	1.00000	None	parabolic	box sum
872	1056	8.46678	2.69752	115.75196	 86HisH	 86HisHba	 86HisN	4.86850e+07	6.67408e+08	29.60384	53.37450	39.98572	1.00000	None	parabolic	box sum
873	1057	8.46685	2.53186	115.75787	 86HisH	 85ProHda	 86HisN	7.92490e+06	1.12701e+08	30.62636	53.97841	40.31819	1.00000	None	parabolic	box sum
874	1058	8.46606	2.32412	115.75503	 86HisH	 88ValHb	 86HisN	1.79369e+06	2.86885e+07	24.06776	71.02354	43.10179	1.00000	None	parabolic	box sum
875	1059	8.46665	4.07051	115.75731	 86HisH	 85ProHa	 86HisN	1.83326e+07	2.32069e+08	29.16843	49.77384	39.82496	1.00000	None	parabolic	box sum
876	1060	8.46669	3.92842	115.75205	 86HisH	 86HisHa	 86HisN	4.01518e+07	5.35526e+08	29.36304	54.05193	39.91014	1.00000	None	parabolic	box sum
877	1061	8.46641	3.79665	115.75520	 86HisH	 85ProHdb	 86HisN	1.19666e+07	1.87458e+08	28.23055	163.52678	39.56938	1.00000	None	parabolic	box sum
878	1063	8.46683	4.38591	115.75013	 86HisH	 84ThrHa	 86HisN	2.10432e+07	3.20051e+08	29.67983	59.37782	39.48998	1.00000	None	parabolic	box sum
879	1065	8.46688	8.22294	115.76075	 86HisH	 87AlaH	 86HisN	2.85167e+07	3.38984e+08	29.96117	44.61573	39.86955	1.00000	None	parabolic	box sum
880	1066	8.46708	6.85728	115.75446	 86HisH	 86HisHd2	 86HisN	6.31279e+06	7.84804e+07	29.66851	48.10090	39.54369	1.00000	None	parabolic	box sum
881	1067	8.81020	8.20277	115.23359	 48SerH	 49PheH	 48SerN	5.69708e+06	8.46643e+07	29.03759	65.12283	43.06167	1.00000	None	parabolic	box sum
882	1069	8.80971	7.48694	115.25409	 48SerH	 47GluH	 48SerN	1.00513e+07	1.35029e+08	30.16472	54.19160	39.02721	1.00000	None	parabolic	box sum
883	1070	8.81026	4.65902	115.24413	 48SerH	 48SerHa	 48SerN	2.77037e+07	3.47829e+08	30.35009	48.16145	40.09950	1.00000	None	parabolic	box sum
884	1073	8.81037	2.97888	115.24678	 48SerH	 51AspHbb	 48SerN	1.69311e+07	2.27967e+08	30.01988	56.53126	39.46584	1.00000	None	parabolic	box sum
885	1074	8.81014	2.83347	115.24496	 48SerH	 51AspHba	 48SerN	1.09490e+07	1.54416e+08	30.25323	61.41405	39.31767	1.00000	None	parabolic	box sum
886	1076	8.81034	2.37088	115.25968	 48SerH	 47GluHgb	 48SerN	1.28813e+07	1.89665e+08	30.29704	95.77678	39.02066	1.00000	None	parabolic	box sum
887	1077	8.81012	2.05072	115.24966	 48SerH	 47GluHbb	 48SerN	2.22108e+07	3.21487e+08	30.41327	58.50891	39.58285	1.00000	None	parabolic	box sum
888	1078	8.81033	1.93206	115.25243	 48SerH	 47GluHba	 48SerN	1.38267e+07	2.10337e+08	30.00706	138.60015	40.36480	1.00000	None	parabolic	box sum
889	1079	8.81064	1.00606	115.24195	 48SerH	 (84Thr/52Leu)(Hg2*/Hdb*)	 48SerN	1.48605e+07	1.96286e+08	29.99157	51.50183	40.00539	1.00000	None	parabolic	box sum
890	1081	7.61710	7.03198	116.43097	 35LeuH	 37TyrHd*	 35LeuN	3.14169e+06	4.37405e+07	33.17565	54.95701	42.00846	1.00000	None	parabolic	box sum
891	1082	7.56700	3.59784	116.82448	 94GluH	 92LeuHa	 94GluN	5.49120e+06	7.32154e+07	29.87117	51.80575	40.03680	1.00000	None	parabolic	box sum
892	1083	7.56788	6.57007	116.82579	 94GluH	 95GlnHe2b	 94GluN	3.50290e+06	4.74511e+07	28.10895	53.43957	42.77879	1.00000	None	parabolic	box sum
893	1084	7.56642	6.33532	116.72425	 94GluH	 95GlnHe2a	 94GluN	1.53835e+06	1.32297e+07	23.49377	35.58175	36.13573	1.00000	None	parabolic	box sum
894	1085	7.56547	8.40957	116.83093	 94GluH	 92LeuH	 94GluN	4.34630e+06	4.71381e+07	26.95680	47.16201	35.23111	1.00000	None	parabolic	box sum
895	1086	7.66058	7.98762	117.77090	 82HisH	 81AspH	 82HisN	4.23329e+07	6.04458e+08	29.96534	53.95639	39.71034	1.00000	None	parabolic	box sum
896	1087	7.64807	8.53456	117.99670	 25LysH	 24ArgH	 25LysN	3.44721e+07	4.53028e+08	28.70589	50.28034	40.09324	1.00000	None	parabolic	box sum
897	1088	7.66156	6.68262	117.75966	 82HisH	 82HisHd2	 82HisN	2.01056e+07	2.54680e+08	30.15399	46.92787	39.81787	1.00000	None	parabolic	box sum
898	1090	7.66150	3.43184	117.75827	 82HisH	 (88Val/83Pro)(Ha/Hda)	 82HisN	1.14768e+07	1.59772e+08	30.09796	53.70004	39.56980	1.00000	None	parabolic	box sum
899	1092	7.64860	3.98009	117.99863	 25LysH	 25LysHa	 25LysN	4.31281e+07	5.61619e+08	29.36006	49.49469	40.11303	1.00000	None	parabolic	box sum
900	1093	7.64860	3.72142	117.99480	 25LysH	 22ValHa	 25LysN	2.92394e+07	4.06278e+08	29.07842	55.12293	40.60292	1.00000	None	parabolic	box sum
901	1094	7.65716	4.10863	117.85257	 82HisH	 81AspHa	 82HisN	2.05859e+07	3.03007e+08	30.27081	55.42685	43.33049	1.00000	None	parabolic	box sum
902	1095	7.66088	3.84712	117.76483	 82HisH	 79IleHa	 82HisN	1.72324e+07	2.15707e+08	30.11703	46.24867	39.75457	1.00000	None	parabolic	box sum
903	1096	7.66121	2.87762	117.76749	 82HisH	 80PheHba	 82HisN	3.17101e+06	3.84478e+07	31.16727	55.14612	41.51273	1.00000	None	parabolic	box sum
904	1098	7.66276	4.52810	117.76552	 82HisH	 80PheHa	 82HisN	4.58127e+06	5.33667e+07	29.80798	45.79063	37.95439	1.00000	None	parabolic	box sum
905	1099	7.64804	1.51863	118.00250	 25LysH	 25LysHga	 25LysN	1.53790e+07	2.43767e+08	27.49205	85.79614	38.48308	1.00000	None	parabolic	box sum
906	1101	7.65769	1.32617	117.82447	 82HisH	 88ValHgb*	 82HisN	1.74667e+07	2.82760e+08	30.86627	76.19334	41.65924	1.00000	None	parabolic	box sum
907	1103	7.64861	1.91087	118.00346	 25LysH	 (25Lys/24Arg)Hb*	 25LysN	7.89541e+07	1.42407e+09	29.32221	116.54602	40.06982	1.00000	None	parabolic	box sum
908	1104	7.66175	2.35250	117.76438	 82HisH	 82HisHba	 82HisN	5.36962e+07	7.78433e+08	30.62248	58.37170	39.45792	1.00000	None	parabolic	box sum
909	1106	7.64905	4.33874	118.07549	 25LysH	 26LeuHa	 25LysN	3.34422e+06	4.15686e+07	26.67934	47.83236	37.87696	1.00000	None	parabolic	box sum
910	1108	7.73528	4.48653	117.99316	 99IleH	 97ProHa	 99IleN	7.22797e+06	7.52207e+07	29.45781	36.22282	40.87895	1.00000	None	parabolic	box sum
911	1109	7.73479	4.34701	117.99940	 99IleH	 99IleHa	 99IleN	2.19931e+07	2.99641e+08	28.49281	52.09591	39.20233	1.00000	None	parabolic	box sum
912	1110	7.73423	3.96578	118.00068	 99IleH	 98GlyHaa	 99IleN	3.80538e+07	5.34521e+08	29.38688	55.50666	39.42227	1.00000	None	parabolic	box sum
913	1111	7.73575	1.42768	117.98997	 99IleH	 99IleHg1b	 99IleN	1.85492e+07	2.62993e+08	29.11955	54.53435	40.99780	1.00000	None	parabolic	box sum
914	1112	7.73511	1.95018	117.99099	 99IleH	 99IleHb	 99IleN	3.29574e+07	4.69000e+08	29.18333	53.63674	42.26822	1.00000	None	parabolic	box sum
915	1113	7.73444	1.20663	117.99455	 99IleH	 99IleHg1a	 99IleN	3.01742e+07	4.32776e+08	28.49877	56.93584	39.79284	1.00000	None	parabolic	box sum
916	1114	7.73519	0.89485	117.99629	 99IleH	 99IleHg2*	 99IleN	2.09802e+07	3.21655e+08	28.32204	60.36547	40.01510	1.00000	None	parabolic	box sum
917	1115	8.12517	1.43843	118.04061	 100GlyH	 99IleHg1b	 100GlyN	6.45296e+06	8.73410e+07	27.26704	58.17079	35.99536	1.00000	None	parabolic	box sum
918	1116	8.12368	1.20779	118.05202	 100GlyH	 99IleHg1a	 100GlyN	3.90959e+06	5.46379e+07	31.33208	59.58620	38.35946	1.00000	None	parabolic	box sum
919	1118	8.12488	1.95037	118.04875	 100GlyH	 99IleHb	 100GlyN	1.90913e+07	2.53716e+08	28.16141	51.98975	38.31786	1.00000	None	parabolic	box sum
920	1121	8.12600	3.98020	118.08643	 100GlyH	 98GlyHaa	 100GlyN	3.27318e+06	2.50483e+07	26.40635	28.19467	39.25264	1.00000	None	parabolic	box sum
921	1122	8.12491	3.78438	118.04182	 100GlyH	 100GlyHa*	 100GlyN	3.79392e+07	6.66371e+08	27.67056	86.29783	39.11889	1.00000	None	parabolic	box sum
922	1124	8.25906	6.81818	117.37163	 68ThrH	 67GlnHe2a	 68ThrN	3.78986e+06	5.11949e+07	28.71871	49.33801	81.47436	1.00000	None	parabolic	box sum
923	1125	8.25737	7.38130	117.38135	 68ThrH	 67GlnHe2b	 68ThrN	5.82404e+06	8.46937e+07	30.22075	55.74610	39.80505	1.00000	None	parabolic	box sum
924	1126	8.25765	7.99005	117.37982	 68ThrH	 69AlaH	 68ThrN	3.92945e+07	5.92255e+08	29.63781	55.36620	40.89028	1.00000	None	parabolic	box sum
925	1127	8.25888	8.73112	117.37084	 68ThrH	 66LeuH	 68ThrN	5.04668e+06	5.02283e+07	27.43572	43.75233	44.37292	1.00000	None	parabolic	box sum
926	1128	8.25793	4.28492	117.37883	 68ThrH	 68ThrHb	 68ThrN	7.97360e+07	1.05607e+09	28.86593	51.92252	39.57987	1.00000	None	parabolic	box sum
927	1129	8.26115	4.14978	117.39245	 68ThrH	 67GlnHa	 68ThrN	1.39474e+07	1.74122e+08	27.29565	39.64458	94.56414	1.00000	None	parabolic	box sum
928	1130	8.25782	3.95171	117.37897	 68ThrH	 68ThrHa	 68ThrN	4.58191e+07	6.18496e+08	28.86742	52.54687	39.99007	1.00000	None	parabolic	box sum
929	1131	8.25739	4.50028	117.37657	 68ThrH	 65HisHa	 68ThrN	1.64285e+07	2.19031e+08	28.22191	52.21386	38.45429	1.00000	None	parabolic	box sum
930	1132	8.25974	2.86472	117.38408	 68ThrH	 67GlnHgb	 68ThrN	6.19985e+06	8.34160e+07	26.70437	42.31303	89.43826	1.00000	None	parabolic	box sum
931	1133	8.25839	2.54252	117.38124	 68ThrH	 67GlnHga	 68ThrN	2.78755e+07	4.51379e+08	28.84954	66.08885	42.97215	1.00000	None	parabolic	box sum
932	1134	8.25774	2.27997	117.37996	 68ThrH	 67GlnHba	 68ThrN	2.16222e+07	3.18259e+08	28.89842	57.61170	40.45290	1.00000	None	parabolic	box sum
933	1135	8.25949	0.79536	117.36470	 68ThrH	 {*}Hda*	 68ThrN	6.75198e+06	1.10187e+08	29.15591	66.99590	94.62857	1.00000	None	parabolic	box sum
934	1137	8.25789	1.53469	117.37020	 68ThrH	 69AlaHb*	 68ThrN	1.19712e+07	1.53198e+08	27.56566	48.64111	45.77816	1.00000	None	parabolic	box sum
935	1138	8.25818	1.26535	117.37750	 68ThrH	 68ThrHg2*	 68ThrN	2.89324e+07	3.76097e+08	28.84537	50.22402	40.49742	1.00000	None	parabolic	box sum
936	1139	8.40728	3.01303	117.13826	 92LeuH	 91HisHbb	 92LeuN	2.36515e+07	3.52713e+08	29.74272	58.47903	39.90936	1.00000	None	parabolic	box sum
937	1140	8.40726	3.80623	117.14754	 92LeuH	 89AlaHa	 92LeuN	1.46073e+07	2.22687e+08	30.16859	65.30566	42.28485	1.00000	None	parabolic	box sum
938	1141	8.40716	3.59402	117.13670	 92LeuH	 92LeuHa	 92LeuN	2.97500e+07	3.86464e+08	30.04104	48.20430	40.98332	1.00000	None	parabolic	box sum
939	1142	8.40732	3.41919	117.14050	 92LeuH	 88ValHa	 92LeuN	8.51533e+06	1.10421e+08	29.29717	47.92751	40.49981	1.00000	None	parabolic	box sum
940	1143	8.40656	1.39154	117.14500	 92LeuH	 89AlaHb*	 92LeuN	4.39915e+06	7.05646e+07	26.76606	267.38282	57.82914	1.00000	None	parabolic	box sum
941	1144	8.40587	1.23472	117.16451	 92LeuH	 23ThrHg2*	 92LeuN	7.91000e+06	1.08599e+08	28.74792	55.88529	45.40044	1.00000	None	parabolic	box sum
942	1145	8.40711	1.07191	117.14237	 92LeuH	 92LeuHdb*	 92LeuN	2.77333e+07	3.87960e+08	29.75613	54.51626	41.25005	1.00000	None	parabolic	box sum
943	1146	8.40490	0.90329	117.17877	 92LeuH	 92LeuHba	 92LeuN	1.04018e+07	1.86568e+08	25.45536	163.54250	89.76966	1.00000	None	parabolic	box sum
944	1147	8.40736	0.75629	117.14428	 92LeuH	 92LeuHda*	 92LeuN	4.66461e+07	6.86918e+08	29.95551	61.05627	40.68065	1.00000	None	parabolic	box sum
945	1149	8.40749	1.96040	117.14532	 92LeuH	 92LeuHbb	 92LeuN	4.17996e+07	5.74466e+08	29.72394	52.80597	41.15450	1.00000	None	parabolic	box sum
946	1150	8.40731	4.22962	117.13088	 92LeuH	 91HisHa	 92LeuN	1.27232e+07	1.63780e+08	29.51592	47.17459	40.59494	1.00000	None	parabolic	box sum
947	1151	8.40724	6.17596	117.14243	 92LeuH	 91HisHd2	 92LeuN	7.11060e+06	8.75535e+07	29.00183	46.68430	40.49033	1.00000	None	parabolic	box sum
948	1152	8.40698	7.72022	117.12769	 92LeuH	 91HisH	 92LeuN	3.05828e+07	5.28152e+08	30.06935	105.48436	41.38482	1.00000	None	parabolic	box sum
949	1153	8.40698	7.65243	117.12769	 92LeuH	 93LeuH	 92LeuN	2.82580e+07	5.88712e+08	28.10448	110.20025	89.36441	1.00000	None	None	box sum
950	1155	8.43200	7.38630	117.87773	 62LeuH	 54PheHd*	 62LeuN	4.25884e+06	5.65365e+07	28.30833	110.24635	43.95449	1.00000	None	parabolic	box sum
951	1156	8.44872	6.94721	117.71111	 46HisH	 46HisHd2	 46HisN	3.19963e+06	3.98960e+07	36.28612	44.78175	41.03833	1.00000	None	parabolic	box sum
952	1157	8.43167	2.42461	117.89467	 62LeuH	 61GluHgb	 62LeuN	4.20130e+06	4.51000e+07	27.70364	44.28478	38.44756	1.00000	None	parabolic	box sum
953	1158	8.98568	0.80702	117.63986	 75SerH	 74LeuHda*	 75SerN	1.93427e+06	3.15568e+07	36.30862	154.27744	40.53307	1.00000	None	parabolic	box sum
954	1159	8.23931	6.82539	118.10807	 30GlnH	 30GlnHe2a	 30GlnN	3.48691e+06	5.06593e+07	26.60096	50.60736	78.82786	1.00000	None	parabolic	box sum
955	1160	8.24147	4.35529	118.12510	 30GlnH	 29AspHa	 30GlnN	1.81877e+07	2.46823e+08	30.28095	44.66655	45.21632	1.00000	None	parabolic	box sum
956	1161	8.24115	4.14144	118.14039	 30GlnH	 30GlnHa	 30GlnN	3.48590e+07	4.89946e+08	29.94746	55.09108	43.20109	1.00000	None	parabolic	box sum
957	1162	8.24141	3.43902	118.14130	 30GlnH	 27ValHa	 30GlnN	1.02000e+07	1.38202e+08	29.89650	53.62809	40.09604	1.00000	None	parabolic	box sum
958	1163	8.24097	2.95730	118.14718	 30GlnH	 29AspHbb	 30GlnN	2.79724e+07	3.62846e+08	29.95193	50.94274	40.28833	1.00000	None	parabolic	box sum
959	1164	8.24128	2.80313	118.14430	 30GlnH	 30GlnHgb	 30GlnN	3.86990e+07	5.37364e+08	29.45781	54.24262	40.26669	1.00000	None	parabolic	box sum
960	1165	8.24114	2.60647	118.14209	 30GlnH	 29AspHba	 30GlnN	1.97352e+07	2.77935e+08	29.16306	48.11780	47.77825	1.00000	None	parabolic	box sum
961	1166	8.24126	2.01729	118.14447	 30GlnH	 30GlnHba	 30GlnN	6.31250e+07	9.82747e+08	29.92809	76.61482	40.08055	1.00000	None	parabolic	box sum
962	1168	8.24139	1.66788	118.13667	 30GlnH	 31AlaHb*	 30GlnN	1.28865e+07	1.79424e+08	29.18661	59.04559	38.81472	1.00000	None	parabolic	box sum
963	1169	8.24123	1.12654	118.14967	 30GlnH	 27ValHga*	 30GlnN	3.65013e+06	5.73414e+07	27.57907	74.42800	37.55826	1.00000	None	parabolic	box sum
964	1170	8.24129	0.89544	118.13539	 30GlnH	 62LeuHdb*	 30GlnN	1.50657e+07	2.30799e+08	30.46632	61.82727	39.81084	1.00000	None	parabolic	box sum
965	1171	8.24098	0.77132	118.13258	 30GlnH	 26LeuHda*	 30GlnN	1.32538e+07	1.86852e+08	28.99289	132.62552	42.78612	1.00000	None	parabolic	box sum
966	1172	8.23967	1.52816	118.06197	 30GlnH	 (32Ala/69Ala)Hb*	 30GlnN	5.84204e+06	9.10287e+07	27.29475	159.32614	90.70778	1.00000	None	parabolic	box sum
967	1173	9.23447	7.78145	119.88947	 29AspH	 26LeuH	 29AspN	2.86219e+06	3.39977e+07	28.58341	119.29153	43.32900	1.00000	None	parabolic	box sum
968	1174	9.23455	7.66260	119.93123	 29AspH	 33SerH	 29AspN	2.06658e+06	3.47790e+07	25.72402	128.36237	39.56598	1.00000	None	parabolic	box sum
969	1175	9.23868	7.07430	119.84737	 29AspH	 30GlnHe2b	 29AspN	1.34551e+06	1.94637e+07	27.01044	52.57400	43.13791	1.00000	None	parabolic	box sum
970	1176	9.23643	4.14876	119.85990	 29AspH	 30GlnHa	 29AspN	2.85731e+06	4.41751e+07	25.15659	63.83480	37.10198	1.00000	None	parabolic	box sum
971	1177	9.10171	1.30755	118.52672	 19GlnH	 17ThrHg2*	 19GlnN	2.68052e+06	4.10886e+07	28.50741	60.83924	42.86116	1.00000	None	parabolic	box sum
972	1178	9.10244	1.08654	118.52247	 19GlnH	 22ValHgb*	 19GlnN	2.94771e+06	3.63977e+07	30.08530	47.61494	36.89337	1.00000	None	parabolic	box sum
973	1179	9.10223	7.35573	118.54225	 19GlnH	 14LeuH	 19GlnN	2.18515e+06	3.76346e+07	25.83608	67.71343	39.81197	1.00000	None	parabolic	box sum
974	1180	9.10186	8.78202	118.50711	 19GlnH	 15ThrH	 19GlnN	4.25362e+06	4.59326e+07	24.06895	40.81328	38.63066	1.00000	None	parabolic	box sum
975	1183	8.73453	8.00408	118.70843	 32AlaH	 34ValH	 32AlaN	6.64350e+06	9.73944e+07	31.87865	52.73442	49.46184	1.00000	None	parabolic	box sum
976	1184	8.73480	7.67024	118.59754	 32AlaH	 33SerH	 32AlaN	4.50869e+07	5.89517e+08	28.55122	49.94271	40.30102	1.00000	None	parabolic	box sum
977	1187	8.73376	7.34944	118.74395	 32AlaH	 54PheHz	 32AlaN	2.20440e+06	4.08568e+07	27.65030	66.71242	56.45293	1.00000	None	parabolic	box sum
978	1188	8.73974	6.83557	118.86152	 66LeuH	 67GlnHe2a	 66LeuN	1.38197e+06	2.65006e+07	25.39515	76.56194	64.25178	1.00000	None	parabolic	box sum
979	1189	8.72912	7.22284	118.63360	 66LeuH	 65HisHd2	 66LeuN	1.69120e+06	2.79098e+07	31.79282	59.53725	46.83983	1.00000	None	parabolic	box sum
980	1190	8.73444	7.02757	118.61036	 32AlaH	 37TyrHd*	 32AlaN	3.78112e+06	5.69236e+07	28.35244	57.51596	43.64055	1.00000	None	parabolic	box sum
981	1191	8.73170	4.49757	119.09553	 66LeuH	 65HisHa	 66LeuN	1.22674e+07	1.67913e+08	30.49791	50.41314	44.24846	1.00000	None	parabolic	box sum
982	1192	8.73169	4.13532	119.03735	 66LeuH	 66LeuHa	 66LeuN	3.60451e+07	5.57886e+08	30.14266	59.68843	46.80395	1.00000	None	parabolic	box sum
983	1193	8.73398	4.35125	118.62448	 32AlaH	 29AspHa	 32AlaN	1.63586e+07	2.38631e+08	29.07634	55.68673	43.44010	1.00000	None	parabolic	box sum
984	1194	8.73498	4.02485	118.60589	 32AlaH	 28LeuHa	 32AlaN	1.43655e+07	2.03371e+08	28.10240	146.15138	41.78399	1.00000	None	parabolic	box sum
985	1195	8.73475	3.86960	118.58634	 32AlaH	 32AlaHa	 32AlaN	3.85495e+07	5.36591e+08	28.29552	55.79014	39.53606	1.00000	None	parabolic	box sum
986	1196	8.73011	2.93637	118.68950	 32AlaH	 37TyrHba	 32AlaN	5.45271e+06	8.50955e+07	27.01879	60.05447	49.61348	1.00000	None	parabolic	box sum
987	1197	8.73491	1.67362	118.58572	 32AlaH	 31AlaHb*	 32AlaN	5.60742e+07	6.89634e+08	28.55808	50.31366	39.39837	1.00000	None	parabolic	box sum
988	1198	8.73490	1.52329	118.59682	 32AlaH	 32AlaHb*	 32AlaN	1.19627e+08	1.53421e+09	28.60546	49.58197	40.72720	1.00000	None	parabolic	box sum
989	1199	8.73472	1.27866	118.70328	 32AlaH	 40ThrHg2*	 32AlaN	1.31006e+07	1.80415e+08	28.97680	49.03075	55.05794	1.00000	None	parabolic	box sum
990	1200	8.73211	1.07238	119.09162	 66LeuH	 66LeuHdb*	 66LeuN	2.97393e+07	4.21778e+08	29.97726	56.34215	40.42888	1.00000	None	parabolic	box sum
991	1201	8.73196	0.76762	119.07949	 66LeuH	 66LeuHda*	 66LeuN	4.39033e+07	6.91739e+08	30.56228	74.76927	41.64058	1.00000	None	parabolic	box sum
992	1202	8.73382	0.24733	118.86272	 66LeuH	 62LeuHda*	 66LeuN	3.17153e+06	4.46824e+07	27.97484	49.87764	52.76299	1.00000	None	parabolic	box sum
993	1203	8.73474	0.88437	118.69527	 32AlaH	 43LeuHdb*	 32AlaN	3.14244e+07	5.05640e+08	28.85491	65.29661	53.40123	1.00000	None	parabolic	box sum
994	1204	8.73619	0.62652	118.57378	 32AlaH	 35LeuHdb*	 32AlaN	3.91747e+06	5.18333e+07	28.21326	48.24834	38.74946	1.00000	None	parabolic	box sum
995	1205	8.73316	0.11053	118.65194	 32AlaH	 35LeuHda*	 32AlaN	1.18591e+06	1.57208e+07	26.46506	48.70009	47.97524	1.00000	None	parabolic	box sum
996	1206	8.73145	2.02194	119.07802	 66LeuH	 66LeuHbb	 66LeuN	4.63202e+07	6.65254e+08	29.89680	58.52503	41.07267	1.00000	None	parabolic	box sum
997	1209	8.73283	2.55680	119.07892	 66LeuH	 67GlnHga	 66LeuN	3.61252e+06	6.58524e+07	27.04561	84.85961	46.28903	1.00000	None	parabolic	box sum
998	1210	8.73206	3.19019	119.10274	 66LeuH	 65HisHba	 66LeuN	2.25182e+07	3.25677e+08	30.79385	56.86428	40.72297	1.00000	None	parabolic	box sum
999	1211	8.73188	3.59150	119.10298	 66LeuH	 65HisHbb	 66LeuN	2.02361e+07	3.36747e+08	30.71785	76.24720	40.02327	1.00000	None	parabolic	box sum
1000	1212	8.45822	6.92516	118.94710	 73AsnH	 73AsnHd2a	 73AsnN	1.36342e+06	1.97481e+07	34.89494	53.74742	45.39782	1.00000	None	parabolic	box sum
1001	1213	8.48703	1.88902	118.37713	 22ValH	 25LysHba	 22ValN	7.54640e+06	1.43409e+08	34.34926	227.20235	44.53039	1.00000	None	parabolic	box sum
1002	1214	8.35327	2.60626	119.35073	 28LeuH	 29AspHba	 28LeuN	1.94058e+06	2.61833e+07	27.35406	51.40039	36.69250	1.00000	None	parabolic	box sum
1003	1215	8.35430	1.44406	119.31909	 28LeuH	 89AlaHb*	 28LeuN	3.14388e+06	5.28194e+07	76.40034	668.96346	40.57306	1.00000	None	parabolic	box sum
1004	1216	8.28664	3.72069	119.13501	 7LeuH	 8ThrHa	 7LeuN	3.28701e+06	4.01943e+07	72.47984	44.03630	38.96052	1.00000	None	parabolic	box sum
1005	1217	8.15223	0.62370	118.87335	 52LeuH	 35LeuHdb*	 52LeuN	3.82591e+06	3.46744e+07	53.40248	32.32925	40.64792	1.00000	None	parabolic	box sum
1006	1218	8.14877	7.21280	118.96086	 52LeuH	 80PheHe*	 52LeuN	4.39341e+06	7.39026e+07	58.01469	55.43117	58.31075	1.00000	None	parabolic	box sum
1007	1219	8.15614	6.92896	118.96427	 52LeuH	 49PheHd*	 52LeuN	5.32662e+06	8.38955e+07	98.24336	57.43418	40.87007	1.00000	None	parabolic	box sum
1008	1220	8.10517	7.74520	119.11855	 54PheH	 53GlyH	 54PheN	5.67736e+07	7.24629e+08	42.66858	50.82105	39.79480	1.00000	None	parabolic	box sum
1009	1221	8.10470	7.39477	119.12260	 54PheH	 54PheHd*	 54PheN	5.16104e+07	6.96985e+08	31.68881	52.70689	39.84356	1.00000	None	parabolic	box sum
1010	1222	8.10477	7.22397	119.14164	 54PheH	 54PheHe*	 54PheN	8.73805e+06	9.13240e+07	37.87249	48.27134	41.04030	1.00000	None	parabolic	box sum
1011	1223	8.11006	6.92699	119.07831	 54PheH	 49PheHd*	 54PheN	4.00716e+06	6.16037e+07	118.18618	57.00150	41.54444	1.00000	None	parabolic	box sum
1012	1224	8.10375	4.10363	119.12282	 54PheH	 54PheHa	 54PheN	3.11486e+07	4.10442e+08	30.64603	51.12124	39.88111	1.00000	None	parabolic	box sum
1013	1225	8.10440	3.81547	119.13500	 54PheH	 53GlyHaa	 54PheN	1.97613e+07	2.56915e+08	32.68838	54.97942	37.16874	1.00000	None	parabolic	box sum
1014	1226	8.17270	0.11458	119.90605	 37TyrH	 35LeuHda*	 37TyrN	2.56091e+06	3.03359e+07	30.93094	42.65391	40.63690	1.00000	None	parabolic	box sum
1015	1227	7.97513	0.12383	119.62833	 81AspH	 79IleHg1a	 81AspN	1.45649e+06	1.77329e+07	30.82484	50.67931	34.44993	1.00000	None	parabolic	box sum
1016	1229	7.21730	8.32681	119.50245	 60LeuH	 57LeuH	 60LeuN	2.23089e+06	2.59630e+07	30.64156	123.08937	42.10746	1.00000	None	parabolic	box sum
1017	1231	7.64261	4.47510	119.47937	 61GluH	 57LeuHa	 61GluN	5.23844e+06	7.44270e+07	77.65442	60.51920	38.05482	1.00000	None	parabolic	box sum
1018	1232	7.70148	2.60181	119.62297	 72LeuH	 67GlnHga	 72LeuN	2.98122e+06	4.58244e+07	27.63927	94.54694	34.69712	1.00000	None	parabolic	box sum
1019	1235	7.71258	3.59559	118.91912	 91HisH	 92LeuHa	 91HisN	2.73638e+06	3.59282e+07	26.72404	44.99524	47.00935	1.00000	None	parabolic	box sum
1020	1237	7.71107	1.75212	118.97806	 91HisH	 87AlaHb*	 91HisN	4.35590e+06	7.25678e+07	23.06104	87.16202	76.08479	1.00000	None	parabolic	box sum
1021	1239	7.76751	3.44504	119.51709	 26LeuH	 27ValHa	 26LeuN	2.86852e+06	3.86372e+07	26.48085	51.08349	51.45508	1.00000	None	parabolic	box sum
1022	1240	7.76791	9.23491	119.58068	 26LeuH	 29AspH	 26LeuN	2.06127e+06	2.54617e+07	28.42307	49.84161	38.72019	1.00000	None	parabolic	box sum
1023	1241	7.69588	7.32250	120.69270	 10LysH	 12AlaH	 10LysN	6.85793e+06	9.26912e+07	26.59947	49.21180	44.43181	1.00000	None	parabolic	box sum
1024	1242	7.69749	7.57684	120.66340	 10LysH	 11LeuH	 10LysN	2.95884e+07	4.16404e+08	30.48718	56.98076	38.19227	1.00000	None	parabolic	box sum
1025	1243	7.69755	3.71748	120.68348	 10LysH	 8ThrHa	 10LysN	4.77080e+06	6.16264e+07	29.46407	50.01761	38.67471	1.00000	None	parabolic	box sum
1026	1244	7.69740	4.22817	120.67691	 10LysH	 10LysHa	 10LysN	4.07836e+07	6.20660e+08	30.08038	69.44220	39.34127	1.00000	None	parabolic	box sum
1027	1245	7.69763	3.99274	120.66971	 10LysH	 9SerHba	 10LysN	2.25033e+07	2.99357e+08	29.87742	52.83861	39.54202	1.00000	None	parabolic	box sum
1028	1247	7.69746	1.94011	120.67682	 10LysH	 10LysHba	 10LysN	5.70830e+07	8.85780e+08	29.90693	68.01932	38.99622	1.00000	None	parabolic	box sum
1029	1248	7.70608	1.26385	120.81201	 10LysH	 8ThrHg2*	 10LysN	2.12782e+06	2.69450e+07	27.59695	79.72087	26.32499	1.00000	None	parabolic	box sum
1030	1250	7.69708	1.47665	120.71480	 10LysH	 {*}(Hba/Hga/Hb*)	 10LysN	1.48913e+07	2.03054e+08	30.41744	149.69503	31.85767	1.00000	None	parabolic	box sum
1031	1251	7.69695	0.90549	120.70501	 10LysH	 7LeuHdb*	 10LysN	9.22790e+06	1.26616e+08	30.42489	62.30734	33.23817	1.00000	None	parabolic	box sum
1032	1252	7.69771	0.75984	120.73314	 10LysH	 11LeuHdb*	 10LysN	6.10010e+06	6.84633e+07	29.60145	149.89869	32.14574	1.00000	None	parabolic	box sum
1033	1253	7.68245	3.03059	122.07059	 21AlaH	 24ArgHda	 21AlaN	1.94177e+06	2.61607e+07	31.96329	163.40686	41.82065	1.00000	None	parabolic	box sum
1034	1254	7.48056	4.05893	121.77793	 47GluH	 45ThrHb	 47GluN	2.48788e+06	2.79945e+07	32.21005	41.80270	38.50353	1.00000	None	parabolic	box sum
1035	1255	7.47898	1.08533	121.74938	 47GluH	 45ThrHg2*	 47GluN	2.06821e+06	3.24025e+07	32.26489	127.70853	36.03941	1.00000	None	parabolic	box sum
1036	1256	7.31559	0.89273	121.69649	 12AlaH	 {*}(Hda*/Hg2*/Hg2*)	 12AlaN	1.24901e+07	1.83414e+08	26.82209	136.34138	39.10857	1.00000	None	parabolic	box sum
1037	1257	7.31594	0.76326	121.69479	 12AlaH	 11LeuHdb*	 12AlaN	1.34224e+07	1.87497e+08	28.07468	72.45350	39.13677	1.00000	None	parabolic	box sum
1038	1258	7.31606	1.45713	121.68896	 12AlaH	 12AlaHb*	 12AlaN	1.57015e+08	2.07126e+09	28.49251	52.73048	39.15900	1.00000	None	parabolic	box sum
1039	1259	7.31565	1.92443	121.68814	 12AlaH	 10LysHba	 12AlaN	1.63675e+07	2.20733e+08	27.45569	54.33541	41.09275	1.00000	None	parabolic	box sum
1040	1260	7.31599	1.77861	121.68620	 12AlaH	 11LeuHbb	 12AlaN	1.80320e+07	2.30865e+08	28.33396	53.93594	38.08886	1.00000	None	parabolic	box sum
1041	1261	7.31620	4.32018	121.68997	 12AlaH	 11LeuHa	 12AlaN	2.99235e+07	4.32033e+08	28.56344	61.53004	39.41882	1.00000	None	parabolic	box sum
1042	1262	7.31581	4.12293	121.68914	 12AlaH	 12AlaHa	 12AlaN	5.16417e+07	6.97501e+08	27.81421	55.44415	39.04134	1.00000	None	parabolic	box sum
1043	1264	7.31536	3.85074	121.69410	 12AlaH	 13GlyHaa	 12AlaN	1.52530e+06	1.39153e+07	24.48142	34.66861	37.43613	1.00000	None	parabolic	box sum
1044	1265	7.31728	3.71726	121.68831	 12AlaH	 8ThrHa	 12AlaN	6.59259e+06	8.36954e+07	28.74136	49.97278	38.27637	1.00000	None	parabolic	box sum
1045	1266	7.31504	7.72201	121.71455	 12AlaH	 10LysH	 12AlaN	4.17194e+06	3.35966e+07	28.98097	35.63031	41.33022	1.00000	None	parabolic	box sum
1046	1267	7.31614	7.58065	121.68272	 12AlaH	 11LeuH	 12AlaN	6.72169e+07	7.68633e+08	28.43499	42.27057	39.04361	1.00000	None	parabolic	box sum
1047	1268	7.31814	8.67210	121.67443	 12AlaH	 13GlyH	 12AlaN	2.91976e+06	3.76848e+07	26.07763	55.16215	38.22786	1.00000	None	parabolic	box sum
1048	1270	7.85128	2.64536	122.13381	 43LeuH	 44AspHb2	 43LeuN	1.42002e+06	1.64091e+07	33.27996	44.10157	37.76658	1.00000	None	parabolic	box sum
1049	1271	7.85324	2.27923	122.12253	 43LeuH	 41GluHga	 43LeuN	1.34513e+06	1.50551e+07	25.19220	56.92522	35.42984	1.00000	None	parabolic	box sum
1050	1272	7.85181	1.28145	122.15156	 43LeuH	 40ThrHg2*	 43LeuN	2.43465e+06	2.42787e+07	27.57818	43.39386	38.92142	1.00000	None	parabolic	box sum
1051	1273	8.09664	8.93623	121.64383	 55AspH	 58ThrH	 55AspN	1.71566e+07	3.03385e+08	29.76507	91.37322	39.02775	1.00000	None	parabolic	box sum
1052	1274	8.10066	7.39273	121.66715	 55AspH	 54PheHd*	 55AspN	1.25762e+07	1.90373e+08	32.13286	57.38445	40.71003	1.00000	None	parabolic	box sum
1053	1275	8.10092	7.22831	121.66929	 55AspH	 60LeuH	 55AspN	4.32026e+06	5.44661e+07	27.35674	51.55392	37.95707	1.00000	None	parabolic	box sum
1054	1277	8.10063	4.10349	121.65359	 55AspH	 54PheHa	 55AspN	1.20867e+08	1.57540e+09	30.33727	49.93661	39.96491	1.00000	None	parabolic	box sum
1055	1278	8.10166	3.84980	121.64227	 55AspH	 59AlaHa	 55AspN	3.24898e+06	2.36154e+07	30.13790	27.79953	40.23153	1.00000	None	parabolic	box sum
1056	1279	8.10071	3.28394	121.65614	 55AspH	 55AspHbb	 55AspN	1.21624e+07	1.58883e+08	29.36989	51.28126	39.41363	1.00000	None	parabolic	box sum
1057	1281	8.10045	2.68729	121.65397	 55AspH	 54PheHba	 55AspN	3.11872e+07	5.06451e+08	30.71249	126.38748	40.07560	1.00000	None	parabolic	box sum
1058	1282	8.10426	2.04327	121.70438	 55AspH	 57LeuHbb	 55AspN	2.57288e+06	3.10633e+07	41.87196	49.43060	36.65024	1.00000	None	parabolic	box sum
1059	1283	8.10049	1.40825	121.66730	 55AspH	 59AlaHb*	 55AspN	7.62167e+06	9.28748e+07	29.53202	47.92554	39.62725	1.00000	None	parabolic	box sum
1060	1284	8.10039	1.24462	121.65372	 55AspH	 58ThrHg2*	 55AspN	8.78011e+06	1.12513e+08	29.14667	49.91577	39.20346	1.00000	None	parabolic	box sum
1061	1285	8.10380	1.00927	121.69168	 55AspH	 57LeuHdb*	 55AspN	3.07331e+06	4.01363e+07	34.37132	48.62382	44.53611	1.00000	None	parabolic	box sum
1062	1286	8.10068	0.11407	121.65552	 55AspH	 35LeuHda*	 55AspN	3.82072e+06	4.95495e+07	29.27899	49.62404	40.19749	1.00000	None	parabolic	box sum
1063	1287	8.10068	0.00199	121.66973	 55AspH	 79IleHd1*	 55AspN	3.45208e+06	4.43080e+07	32.00620	117.50418	42.75513	1.00000	None	parabolic	box sum
1064	1288	8.21508	3.11250	121.64761	 87AlaH	 82HisHbb	 87AlaN	1.96823e+06	2.26244e+07	27.57430	53.58642	39.79808	1.00000	None	parabolic	box sum
1065	1289	8.21539	3.80324	121.63270	 87AlaH	 85ProHdb	 87AlaN	2.99551e+06	4.66898e+07	46.75835	156.99425	39.48814	1.00000	None	parabolic	box sum
1066	1291	8.21256	6.99830	121.69451	 87AlaH	 49PheHe*	 87AlaN	1.81696e+06	2.26303e+07	37.57596	56.73414	42.29528	1.00000	None	parabolic	box sum
1067	1293	8.25656	7.49136	121.84154	 44AspH	 47GluH	 44AspN	3.57034e+06	5.20371e+07	40.12823	56.04491	46.53668	1.00000	None	parabolic	box sum
1068	1294	8.25526	4.49550	121.81825	 44AspH	 43LeuHa	 44AspN	9.94039e+07	1.31150e+09	32.46218	49.17072	40.37267	1.00000	None	parabolic	box sum
1069	1295	8.25540	2.77315	121.81811	 44AspH	 44AspHbb	 44AspN	4.51861e+07	6.06900e+08	30.87014	50.74458	40.28523	1.00000	None	parabolic	box sum
1070	1296	8.25456	2.63470	121.81041	 44AspH	 44AspHba	 44AspN	4.25450e+07	6.04233e+08	31.86733	53.78733	40.70747	1.00000	None	parabolic	box sum
1071	1298	8.25436	0.82902	121.81947	 44AspH	 43LeuHda*	 44AspN	1.57374e+07	2.76258e+08	30.19065	90.60658	40.46577	1.00000	None	parabolic	box sum
1072	1299	8.31941	1.74835	121.91669	 57LeuH	 57Leu(Hg/Hba)	 57LeuN	6.90012e+07	9.41669e+08	30.52562	53.58995	39.97672	1.00000	None	parabolic	box sum
1073	1300	8.31777	1.41595	121.89607	 57LeuH	 59AlaHb*	 57LeuN	5.47364e+06	7.29052e+07	84.68360	58.84547	42.62352	1.00000	None	parabolic	box sum
1074	1301	8.32575	1.25768	121.91692	 41GluH	 40ThrHg2*	 41GluN	9.33440e+06	1.26113e+08	33.60242	53.14606	40.39866	1.00000	None	parabolic	box sum
1075	1302	8.31881	0.99041	121.91843	 57LeuH	 57LeuHdb*	 57LeuN	1.33995e+07	2.40712e+08	71.17242	87.21903	39.38293	1.00000	None	parabolic	box sum
1076	1303	8.32015	3.28787	121.91157	 41GluH	 37TyrHbb	 41GluN	7.61472e+06	9.69728e+07	28.85133	50.74183	38.22428	1.00000	None	parabolic	box sum
1077	1304	8.32027	7.22387	121.89582	 57LeuH	 60LeuH	 57LeuN	2.66843e+06	3.80027e+07	29.00898	55.42842	35.54696	1.00000	None	parabolic	box sum
1078	1305	8.33693	3.84670	121.90755	 41GluH	 39SerHba	 41GluN	7.32517e+06	8.89845e+07	32.20111	43.90459	39.82031	1.00000	None	parabolic	box sum
1079	1306	8.51201	1.39803	121.32789	 89AlaH	 89AlaHb*	 89AlaN	1.10011e+08	1.52950e+09	32.02617	55.50509	39.87283	1.00000	None	parabolic	box sum
1080	1307	8.51444	1.09489	121.30472	 89AlaH	 92LeuHdb*	 89AlaN	2.49582e+07	4.09542e+08	33.70851	79.21918	40.30591	1.00000	None	parabolic	box sum
1081	1308	8.51400	0.89634	121.32213	 89AlaH	 88ValHga*	 89AlaN	2.20979e+07	3.39902e+08	33.66768	60.24358	40.02333	1.00000	None	parabolic	box sum
1082	1309	8.52018	0.76397	121.28750	 89AlaH	 92LeuHda*	 89AlaN	1.43999e+07	2.21379e+08	36.16661	143.92800	40.96758	1.00000	None	parabolic	box sum
1083	1310	8.51041	2.31284	121.34464	 89AlaH	 88ValHb	 89AlaN	4.30091e+07	6.07176e+08	30.24697	56.31188	39.29955	1.00000	None	parabolic	box sum
1084	1311	8.51318	2.07137	121.33513	 89AlaH	 90GluHga	 89AlaN	9.16488e+06	1.60395e+08	35.42930	284.06899	39.50131	1.00000	None	parabolic	box sum
1085	1312	8.53233	1.91362	121.22511	 24ArgH	 24ArgHbb	 24ArgN	5.66138e+07	8.56999e+08	30.64305	149.38246	39.86162	1.00000	None	parabolic	box sum
1086	1313	8.53193	1.78087	121.22804	 24ArgH	 24ArgHba	 24ArgN	6.60142e+07	1.03981e+09	30.98726	141.16165	40.07918	1.00000	None	parabolic	box sum
1087	1314	8.51067	3.41902	121.35783	 89AlaH	 88ValHa	 89AlaN	1.29924e+07	1.68147e+08	29.91855	50.12691	39.30318	1.00000	None	parabolic	box sum
1088	1315	8.53047	3.03556	121.23193	 24ArgH	 24ArgHd*	 24ArgN	1.08121e+07	1.95561e+08	32.20469	107.52393	39.92152	1.00000	None	parabolic	box sum
1089	1316	8.51451	3.92758	121.31489	 89AlaH	 86HisHa	 89AlaN	1.79006e+07	2.49170e+08	34.17164	168.99460	40.56060	1.00000	None	parabolic	box sum
1090	1317	8.53065	4.10654	121.23439	 24ArgH	 23ThrHa	 24ArgN	5.20022e+07	7.70330e+08	31.75735	61.80722	40.31026	1.00000	None	parabolic	box sum
1091	1318	8.53470	3.75013	121.20559	 24ArgH	 24ArgHa	 24ArgN	5.05585e+07	8.63926e+08	35.30920	79.22901	40.59577	1.00000	None	parabolic	box sum
1092	1319	8.51251	6.59264	121.34786	 89AlaH	 49PheHz	 89AlaN	3.02943e+06	4.00683e+07	32.52715	48.21492	41.77505	1.00000	None	parabolic	box sum
1093	1320	8.53479	1.57037	121.21945	 24ArgH	 21AlaHb*	 24ArgN	5.52899e+06	7.58950e+07	27.15856	57.90068	38.14369	1.00000	None	parabolic	box sum
1094	1321	8.73748	4.02748	121.48245	 64AspH	 62LeuHa	 64AspN	2.97135e+06	4.05876e+07	27.86398	156.67224	36.88926	1.00000	None	parabolic	box sum
1095	1322	8.73944	6.81759	121.50106	 64AspH	 67GlnHe2a	 64AspN	1.71353e+06	2.32378e+07	25.12127	56.98479	40.67761	1.00000	None	parabolic	box sum
1096	1323	8.73693	7.37249	121.48412	 64AspH	 67GlnHe2b	 64AspN	2.17654e+06	2.80462e+07	28.84358	47.71677	43.23459	1.00000	None	parabolic	box sum
1097	1324	8.73888	0.24734	121.51842	 64AspH	 62LeuHda*	 64AspN	1.25806e+06	1.68085e+07	27.76384	54.96369	39.61080	1.00000	None	parabolic	box sum
1098	1325	8.86018	0.62647	122.50005	 31AlaH	 35LeuHdb*	 31AlaN	1.69478e+06	1.46459e+07	27.18091	30.84935	38.24234	1.00000	None	parabolic	box sum
1099	1326	8.86071	2.95235	122.51068	 31AlaH	 29AspHbb	 31AlaN	3.19444e+06	3.40411e+07	27.89408	47.09556	39.60538	1.00000	None	parabolic	box sum
1100	1327	8.85985	3.85231	122.53213	 31AlaH	 32AlaHa	 31AlaN	2.83707e+06	2.75412e+07	26.37535	36.37537	37.72265	1.00000	None	parabolic	box sum
1101	1329	8.85973	7.02430	122.54003	 31AlaH	 49PheHe*	 31AlaN	2.67337e+06	4.17079e+07	29.22714	68.80743	42.65505	1.00000	None	parabolic	box sum
1102	1330	8.86223	8.00549	122.48307	 31AlaH	 34ValH	 31AlaN	2.97594e+06	3.09953e+07	32.20707	42.00528	40.33077	1.00000	None	parabolic	box sum
1103	1332	8.87649	7.63467	123.65285	 67GlnH	 70ThrH	 67GlnN	3.44963e+06	4.51273e+07	29.47271	59.05591	37.69737	1.00000	None	parabolic	box sum
1104	1333	8.87805	7.37700	123.63925	 67GlnH	 67GlnHe2b	 67GlnN	7.56490e+06	9.99778e+07	30.17992	51.95928	38.45370	1.00000	None	parabolic	box sum
1105	1335	8.87622	6.81827	123.60950	 67GlnH	 67GlnHe2a	 67GlnN	3.66031e+06	4.63818e+07	28.02879	48.49073	39.88171	1.00000	None	parabolic	box sum
1106	1336	8.87814	4.38836	123.62377	 67GlnH	 64AspHa	 67GlnN	1.33272e+07	1.97070e+08	30.59268	63.82733	40.30704	1.00000	None	parabolic	box sum
1107	1337	8.87763	4.16003	123.64142	 67GlnH	 67GlnHa	 67GlnN	3.80866e+07	5.24072e+08	30.64245	55.82670	38.34090	1.00000	None	parabolic	box sum
1108	1338	8.87593	3.95157	123.64874	 67GlnH	 68ThrHa	 67GlnN	3.19681e+06	4.20843e+07	28.44602	56.44870	40.29465	1.00000	None	parabolic	box sum
1109	1339	8.87729	3.62517	123.61937	 67GlnH	 63ArgHa	 67GlnN	5.49340e+06	7.78104e+07	29.06859	58.88950	38.83961	1.00000	None	parabolic	box sum
1110	1341	8.87770	2.85751	123.62230	 67GlnH	 67GlnHgb	 67GlnN	3.12669e+07	4.37369e+08	30.19035	55.36591	39.99150	1.00000	None	parabolic	box sum
1111	1342	8.87782	2.55511	123.62230	 67GlnH	 67GlnHga	 67GlnN	3.67180e+07	6.40221e+08	30.08306	83.21891	40.13151	1.00000	None	parabolic	box sum
1112	1343	8.87775	2.27918	123.62722	 67GlnH	 67GlnHba	 67GlnN	2.55512e+07	3.72401e+08	30.23744	56.48369	40.06919	1.00000	None	parabolic	box sum
1113	1344	8.87737	2.02144	123.65029	 67GlnH	 66LeuHbb	 67GlnN	1.95679e+07	2.75834e+08	30.08813	58.93590	37.37238	1.00000	None	parabolic	box sum
1114	1346	8.87821	3.22012	123.64211	 67GlnH	 65HisHba	 67GlnN	3.43765e+06	4.98774e+07	29.79070	65.21365	37.34991	1.00000	None	parabolic	box sum
1115	1347	8.87747	1.53166	123.65331	 67GlnH	 69AlaHb*	 67GlnN	1.19732e+07	1.60386e+08	29.97726	53.13506	37.66173	1.00000	None	parabolic	box sum
1116	1348	8.87785	1.28059	123.62750	 67GlnH	 68ThrHg2*	 67GlnN	4.90387e+06	7.09396e+07	28.92315	103.31583	37.95916	1.00000	None	parabolic	box sum
1117	1349	8.87758	1.07034	123.63044	 67GlnH	 66LeuHdb*	 67GlnN	1.29673e+07	1.78397e+08	29.89322	54.06884	40.18122	1.00000	None	parabolic	box sum
1118	1352	9.00484	2.18637	123.61200	 59AlaH	 61GluHga	 59AlaN	1.64540e+06	2.30928e+07	24.93784	60.15512	36.99404	1.00000	None	parabolic	box sum
1119	1353	9.00606	2.04773	123.55824	 59AlaH	 57LeuHbb	 59AlaN	4.99315e+06	7.46203e+07	27.65954	152.36977	38.87123	1.00000	None	parabolic	box sum
1120	1354	9.00626	1.92842	123.58357	 59AlaH	 60LeuHbb	 59AlaN	7.75832e+06	1.15937e+08	27.59516	68.04527	39.60598	1.00000	None	parabolic	box sum
1121	1355	9.00745	1.76063	123.56361	 59AlaH	 57LeuHba	 59AlaN	4.94474e+06	6.27179e+07	28.72333	59.16236	38.19540	1.00000	None	parabolic	box sum
1122	1356	9.00575	1.40637	123.58097	 59AlaH	 59AlaHb*	 59AlaN	1.06322e+08	1.38501e+09	28.29254	49.52064	40.19508	1.00000	None	parabolic	box sum
1123	1357	9.00639	1.25497	123.58102	 59AlaH	 58ThrHg2*	 59AlaN	1.09479e+07	9.78230e+07	28.42844	46.37173	40.48243	1.00000	None	parabolic	box sum
1124	1358	9.00626	1.00895	123.58499	 59AlaH	 34ValHgb*	 59AlaN	4.82479e+06	7.56519e+07	27.16869	69.88531	39.55004	1.00000	None	parabolic	box sum
1125	1359	9.00678	0.63082	123.59171	 59AlaH	 (35Leu/79Ile)(Hdb*/Hg1b)	 59AlaN	2.69806e+06	3.50281e+07	24.76141	49.48053	41.02916	1.00000	None	parabolic	box sum
1126	1360	9.00567	2.82399	123.60442	 59AlaH	 54PheHbb	 59AlaN	3.13118e+06	4.61779e+07	28.53096	58.12714	44.05597	1.00000	None	parabolic	box sum
1127	1361	9.00516	2.68305	123.56916	 59AlaH	 54PheHba	 59AlaN	6.55548e+06	9.66819e+07	27.17361	59.27796	39.06494	1.00000	None	parabolic	box sum
1128	1362	9.17576	7.37854	124.72862	 74LeuH	 67GlnHe2b	 74LeuN	2.03125e+06	2.40712e+07	26.77932	46.50698	36.33764	1.00000	None	parabolic	box sum
1129	1364	9.17486	6.82557	124.71118	 74LeuH	 67GlnHe2a	 74LeuN	2.64856e+06	3.74663e+07	31.99235	57.66635	40.54773	1.00000	None	parabolic	box sum
1130	1365	9.17377	4.40755	124.68993	 74LeuH	 72LeuHa	 74LeuN	4.23040e+06	4.97133e+07	32.94811	40.19935	40.51301	1.00000	None	parabolic	box sum
1131	1366	9.17616	4.17075	124.66686	 74LeuH	 67GlnHa	 74LeuN	3.11490e+06	4.12699e+07	32.72891	52.07271	39.44263	1.00000	None	parabolic	box sum
1132	1367	9.17380	1.24101	124.68668	 74LeuH	 72LeuHba	 74LeuN	2.26825e+06	3.78472e+07	33.61836	261.52733	38.71959	1.00000	None	parabolic	box sum
1133	1368	9.17390	1.05877	124.68820	 74LeuH	 78LeuHdb*	 74LeuN	2.70149e+06	2.05872e+07	35.21681	28.51431	38.98400	1.00000	None	parabolic	box sum
1134	1369	7.99684	0.62562	120.74482	 34ValH	 35LeuHdb*	 34ValN	3.84331e+06	3.96770e+07	30.01571	35.53556	41.04394	1.00000	None	parabolic	box sum
1135	1370	7.99806	0.24187	120.74399	 34ValH	 62LeuHda*	 34ValN	2.18596e+06	2.38721e+07	29.79726	36.84717	43.46603	1.00000	None	parabolic	box sum
1136	1371	7.99658	0.11591	120.76864	 34ValH	 35LeuHda*	 34ValN	3.08919e+06	3.80058e+07	31.44532	46.22154	38.74850	1.00000	None	parabolic	box sum
1137	1372	7.99689	1.01119	120.76925	 34ValH	 34ValHgb*	 34ValN	2.62492e+07	2.91356e+08	29.33860	39.81443	39.56139	1.00000	None	parabolic	box sum
1138	1373	7.99674	0.87842	120.76329	 34ValH	 34ValHga*	 34ValN	7.57582e+07	1.01807e+09	29.39522	51.53131	40.41553	1.00000	None	parabolic	box sum
1139	1375	7.99732	1.41534	120.76573	 34ValH	 35LeuHbb	 34ValN	8.36021e+06	1.25663e+08	28.10776	108.46990	39.87920	1.00000	None	parabolic	box sum
1140	1378	7.99662	1.66957	120.77962	 34ValH	 31AlaHb*	 34ValN	4.98600e+06	6.68534e+07	31.86941	50.19139	42.59139	1.00000	None	parabolic	box sum
1141	1379	7.99665	2.24895	120.76370	 34ValH	 34ValHb	 34ValN	6.48931e+07	8.90402e+08	29.25336	53.60883	40.18617	1.00000	None	parabolic	box sum
1142	1380	7.99815	1.51583	120.80158	 34ValH	 32AlaHb*	 34ValN	6.18643e+06	8.69642e+07	28.90140	120.50879	59.70961	1.00000	None	parabolic	box sum
1143	1382	7.99724	4.30931	120.81439	 34ValH	 33SerHa	 34ValN	1.23030e+07	1.44019e+08	29.58745	52.22015	43.01012	1.00000	None	parabolic	box sum
1144	1383	7.99677	4.18026	120.75148	 34ValH	 31AlaHa	 34ValN	1.47319e+07	2.00442e+08	29.59669	142.19412	40.61025	1.00000	None	parabolic	box sum
1145	1384	7.99679	4.05478	120.76921	 34ValH	 33SerHba	 34ValN	4.92413e+07	6.94579e+08	29.16723	55.40955	39.77007	1.00000	None	parabolic	box sum
1146	1385	7.99821	3.87895	120.65641	 34ValH	 32AlaHa	 34ValN	4.46949e+06	5.43620e+07	30.53814	39.56044	134.00984	1.00000	None	parabolic	box sum
1147	1386	7.99654	3.71959	120.76748	 34ValH	 34ValHa	 34ValN	4.05775e+07	5.07252e+08	29.33353	45.42734	40.29584	1.00000	None	parabolic	box sum
1148	1387	7.99868	7.08521	120.82176	 34ValH	 37TyrHd*	 34ValN	2.22635e+06	3.45786e+07	26.32797	141.92617	49.07793	1.00000	None	parabolic	box sum
1149	1388	7.99485	7.66872	120.81072	 34ValH	 33SerH	 34ValN	5.42420e+07	8.60719e+08	29.78802	63.37194	41.44758	1.00000	None	parabolic	box sum
1150	1389	7.99576	7.35463	120.77615	 34ValH	 54PheHz	 34ValN	4.97617e+06	6.60961e+07	29.74510	49.48368	57.34450	1.00000	None	parabolic	box sum
1151	1390	7.99646	7.20821	120.74537	 34ValH	 54PheHe*	 34ValN	2.90062e+06	4.52077e+07	28.12743	129.11215	40.91358	1.00000	None	parabolic	box sum
1152	1391	7.99779	8.73886	120.80493	 34ValH	 32AlaH	 34ValN	4.02496e+06	3.61788e+07	26.39741	36.23992	37.61411	1.00000	None	parabolic	box sum
1153	1392	7.99724	8.87273	120.73336	 34ValH	 31AlaH	 34ValN	2.11820e+06	1.55687e+07	27.34274	29.20025	39.97254	1.00000	None	parabolic	box sum
1154	1393	8.75805	2.97033	120.12011	 50LysH	 51AspHbb	 50LysN	1.98969e+06	3.47823e+07	30.05028	71.15132	58.83485	1.00000	None	parabolic	box sum
1155	1395	8.75701	2.30991	120.25412	 50LysH	 47GluHga	 50LysN	1.93268e+06	2.94381e+07	35.56222	56.65354	103.67835	1.00000	None	parabolic	box sum
1156	1396	8.76382	8.73136e-05	120.14079	 50LysH	 79IleHd1*	 50LysN	1.34428e+06	1.86254e+07	31.16667	51.75739	41.78149	1.00000	None	parabolic	box sum
1157	1398	8.75107	0.77798	120.29794	 50LysH	 52LeuHda*	 50LysN	1.76165e+06	2.00485e+07	32.97597	96.43849	26.01868	1.00000	None	parabolic	box sum
1158	1399	8.76223	1.00808	120.14651	 50LysH	 52LeuHdb*	 50LysN	2.13131e+06	2.59556e+07	31.31479	54.21274	36.89378	1.00000	None	parabolic	box sum
1159	1400	7.94247	3.19078	120.02554	 20ArgH	 20ArgHda	 20ArgN	1.14604e+07	2.01813e+08	45.24618	74.55146	43.23089	1.00000	None	parabolic	box sum
1160	1402	7.55382	3.84225	123.85853	 18GluH	 19GlnHa	 18GluN	3.81642e+06	3.36752e+07	27.26018	33.24573	39.83063	1.00000	None	parabolic	box sum
1161	1403	7.55412	4.39573	123.86292	 18GluH	 15ThrHa	 18GluN	2.77236e+06	3.44164e+07	27.65626	49.41134	36.84485	1.00000	None	parabolic	box sum
1162	1404	7.55582	1.07572	123.86594	 18GluH	 22ValHgb*	 18GluN	1.44908e+06	1.71808e+07	26.32171	61.39203	39.67986	1.00000	None	parabolic	box sum
1163	1405	7.32569	0.65169	123.72985	 78LeuH	 79IleHg1b	 78LeuN	1.88764e+06	2.33751e+07	25.90179	65.41850	39.76974	1.00000	None	parabolic	box sum
1164	1408	7.55091	6.68559	118.50044	 80PheH	 82HisHd2	 80PheN	2.19444e+06	2.59497e+07	30.39509	49.00578	37.61184	1.00000	None	parabolic	box sum
1165	1409	7.55215	7.31151	118.47582	 80PheH	 78LeuH	 80PheN	4.96454e+06	5.64799e+07	37.63825	55.60751	49.01135	1.00000	None	parabolic	box sum
1166	1410	8.59542	7.68870	111.20674	 71GlyH	 72LeuH	 71GlyN	3.58757e+07	6.99854e+08	31.87656	111.58254	39.59656	1.00000	None	None	box sum
1167	1411	7.74665	7.03373	106.96289	 36GlyH	 37TyrHd*	 36GlyN	3.32819e+06	3.86640e+07	30.70861	46.39100	37.98878	1.00000	None	parabolic	box sum
1168	1412	8.73399	8.88166	118.82212	 66LeuH	 67GlnH	 66LeuN	4.16368e+07	2.91012e+08	28.77712	31.83862	55.90338	1.00000	None	parabolic	box sum
1169	1413	7.93329	7.78042	117.21495	 27ValH	 26LeuH	 27ValN	2.89296e+07	2.61113e+08	30.57569	49.71123	41.04835	1.00000	None	parabolic	box sum
1170	1414	7.76755	7.63832	119.54552	 26LeuH	 25LysH	 26LeuN	4.23549e+07	5.40865e+08	134.74256	141.76458	43.32179	1.00000	None	parabolic	box sum
1171	1415	7.96995	7.83817	111.36904	 8ThrH	 9SerH	 8ThrN	1.69786e+07	1.20645e+08	30.20138	25.12744	44.94047	1.00000	None	parabolic	box sum
1172	1418	7.35441	9.11185	120.01394	 14LeuH	 19GlnH	 14LeuN	2.14343e+06	3.00302e+07	28.29492	53.95315	38.02049	1.00000	None	parabolic	box sum
1173	1419	7.35536	8.78126	119.97842	 14LeuH	 15ThrH	 14LeuN	8.42232e+06	1.08529e+08	28.87547	110.87394	38.33234	1.00000	None	parabolic	box sum
1174	1420	7.35540	8.66940	119.98959	 14LeuH	 13GlyH	 14LeuN	6.44974e+06	9.31529e+07	28.87100	121.50292	39.96485	1.00000	None	parabolic	box sum
1175	1421	7.44071	7.58767	114.41452	 95GlnH	 94GluH	 95GlnN	3.83043e+07	2.53170e+08	27.46999	27.15129	38.12528	1.00000	None	parabolic	box sum
1176	1424	7.97454	7.66984	119.70872	 81AspH	 82HisH	 81AspN	4.49796e+07	7.67389e+08	37.27853	130.12309	50.81677	1.00000	None	None	box sum
1177	1425	7.97232	7.54998	119.70872	 81AspH	 80PheH	 81AspN	7.71031e+07	1.06735e+09	30.73543	61.95515	39.94262	1.00000	None	None	box sum
1178	1426	7.74510	8.01066	106.96163	 36GlyH	 34ValH	 36GlyN	6.74701e+06	3.19973e+07	31.70729	22.76340	40.81595	1.00000	None	parabolic	box sum
1179	1427	7.96509	7.70915	111.39896	 8ThrH	 10LysH	 8ThrN	5.06258e+06	5.03872e+07	32.90653	33.97457	43.64300	1.00000	None	parabolic	box sum
1180	1428	7.66250	8.22169	111.53781	 33SerH	 37TyrH	 33SerN	2.69311e+06	2.62707e+07	29.75821	34.35811	41.72432	1.00000	None	parabolic	box sum
1181	1430	7.80595	7.67599	115.06643	 90GluH	 91HisH	 90GluN	2.12398e+07	2.14228e+08	30.00319	35.95880	42.96368	1.00000	None	parabolic	box sum
1182	1431	7.99549	7.74582	117.07461	 23ThrH	 26LeuH	 23ThrN	6.18099e+06	1.07288e+08	82.01778	119.76363	99.10309	1.00000	None	parabolic	box sum
1183	1432	7.92830	7.64268	117.28167	 27ValH	 25LysH	 27ValN	5.76060e+06	1.02183e+08	44.12949	137.31654	80.19423	1.00000	None	parabolic	box sum
1184	1433	8.25700	7.63139	117.44278	 68ThrH	 70ThrH	 68ThrN	7.45856e+06	1.19241e+08	36.66401	53.76138	64.48054	1.00000	None	parabolic	box sum
1185	1435	7.71563	7.83757	118.84572	 91HisH	 90GluH	 91HisN	2.17780e+07	1.94254e+08	29.64318	32.06179	35.02643	1.00000	None	parabolic	box sum
1186	1438	8.28413	7.71179	119.14398	 7LeuH	 10LysH	 7LeuN	4.69881e+06	1.01101e+08	285.96610	107.72740	119.96132	1.00000	None	parabolic	box sum
1187	1439	7.76178	8.54685	119.53041	 26LeuH	 24ArgH	 26LeuN	3.68018e+06	6.25902e+07	26.71063	80.17714	37.04721	1.00000	None	None	box sum
1188	1440	7.63204	7.06359	119.48888	 63ArgH	 63ArgHe	 63ArgN	4.53126e+06	4.27062e+07	27.19909	34.96821	38.31559	1.00000	None	parabolic	box sum
1189	1444	7.94059	7.69015	119.96992	 20ArgH	 21AlaH	 20ArgN	3.76261e+07	6.09017e+08	50.46189	54.98443	46.75299	1.00000	None	None	box sum
1190	1445	7.70042	7.85790	120.66132	 10LysH	 9SerH	 10LysN	9.89152e+06	-2.50092e+07	26.25227	34.94088	37.31835	1.00000	None	parabolic	box sum
1191	1446	7.99929	7.63543	120.81072	 34ValH	 35LeuH	 34ValN	5.33357e+07	8.48512e+08	29.58864	64.54507	41.32110	1.00000	None	None	box sum
1192	1447	8.74076	8.62939	121.51090	 64AspH	 65HisH	 64AspN	1.27157e+07	1.46001e+08	29.14488	135.55681	40.14516	1.00000	None	parabolic	box sum
1193	1448	8.32526	8.09196	121.89247	 57LeuH	 55AspH	 57LeuN	7.54017e+06	5.06969e+07	72.47090	26.64606	43.21206	1.00000	None	parabolic	box sum
1194	1449	8.86049	9.22872	122.53532	 31AlaH	 29AspH	 31AlaN	4.40985e+06	2.21401e+07	32.43238	37.22668	37.99623	1.00000	None	parabolic	box sum
1195	1450	7.55388	7.94427	123.86488	 18GluH	 20ArgH	 18GluN	4.05297e+06	4.52172e+07	29.40059	51.26052	40.12743	1.00000	None	parabolic	box sum
1196	1453	7.37565	8.74205	108.28893	 67GlnHe2b	 66LeuH	 67GlnNe2	2.14860e+06	2.31168e+07	28.66596	31.73055	52.37806	1.00000	None	parabolic	box sum
1197	1454	7.37702	8.26570	108.31527	 67GlnHe2b	 68ThrH	 67GlnNe2	3.42804e+06	4.39191e+07	29.27244	48.75091	40.49456	1.00000	None	parabolic	box sum
1198	1455	7.85003	8.31900	122.17235	 43LeuH	 42SerH	 43LeuN	1.47834e+07	2.38624e+08	30.25502	74.38043	38.76907	1.00000	None	None	box sum
1199	1456	7.73332	4.33617	102.75502	 53GlyH	 52LeuHa	 53GlyN	2.36505e+07	5.06888e+08	30.76732	101.03465	42.67240	1.00000	None	None	box sum
1200	1457	8.43381	8.09166	117.81613	 46HisH	 45ThrH	 46HisN	6.45132e+06	8.97362e+07	252.22450	45.86189	49.84474	1.00000	None	parabolic	box sum
1201	1458	7.63259	4.22700	115.38707	 93LeuH	 91HisHa	 93LeuN	3.62135e+06	5.22102e+07	51.77379	45.50479	54.56579	1.00000	None	None	box sum
1202	1459	7.71260	7.57774	118.87102	 91HisH	 93LeuH	 91HisN	1.34557e+07	1.36954e+08	31.99697	26.42215	88.75662	1.00000	None	parabolic	box sum
1203	1460	7.80627	8.41286	115.07950	 90GluH	 92LeuH	 90GluN	3.70805e+06	7.34422e+07	35.20191	146.41786	41.21006	1.00000	None	None	box sum
1204	1461	7.80432	3.76817	115.07950	 90GluH	 89AlaHa	 90GluN	5.02572e+06	1.16088e+08	29.83928	137.47922	38.91045	1.00000	None	None	box sum
1205	1463	8.46665	4.47283	115.69091	 86HisH	 84ThrHa	 86HisN	3.77246e+06	7.52476e+07	30.28780	124.22818	41.03982	1.00000	None	None	box sum
1206	1464	7.30836	4.38888	109.58141	 84ThrH	 84ThrHb	 84ThrN	1.04089e+07	2.57592e+08	29.55824	113.37707	39.37018	1.00000	None	None	box sum
1207	1465	7.97269	8.27063	119.83288	 20ArgH	 17ThrH	 20ArgN	-8.58650e+06	-9.81409e+07	43.87558	46.70652	28.31614	1.00000	None	parabolic	box sum
1208	1467	7.98031	4.51968	119.72366	 81AspH	 80PheHa	 81AspN	1.37277e+07	1.86582e+08	28.90080	47.77496	48.68430	1.00000	None	None	box sum
1209	1468	7.97447	4.11843	119.72366	 81AspH	 81AspHa	 81AspN	2.86163e+07	4.57895e+08	31.23730	61.18444	55.72289	1.00000	None	None	box sum
1210	1469	7.97057	3.87300	119.72366	 81AspH	 79IleHa	 81AspN	7.88538e+06	1.86533e+08	51.21410	59.54099	67.04015	1.00000	None	None	box sum
1211	1470	7.83930	7.58235	110.80811	 77ThrH	 80PheH	 77ThrN	4.02060e+06	1.71271e+07	28.95206	21.90787	38.30421	1.00000	None	parabolic	box sum
1212	1472	9.17487	4.85676	124.70280	 74LeuH	 74LeuHa	 74LeuN	2.79118e+07	9.07857e+08	31.89728	111.80320	39.39542	1.00000	None	None	box sum
1213	1473	8.59146	8.26274	111.24704	 71GlyH	 68ThrH	 71GlyN	3.42330e+06	3.48278e+07	32.71252	39.72499	38.93328	1.00000	None	parabolic	box sum
1214	1474	8.87979	4.50977	123.64066	 67GlnH	 65HisHa	 67GlnN	2.79708e+06	5.81437e+07	28.04786	285.18441	41.77544	1.00000	None	None	box sum
1215	1475	8.25961	8.62094	117.36069	 68ThrH	 65HisH	 68ThrN	3.06935e+06	-2.66209e+06	25.95305	19.38715	36.43882	1.00000	None	parabolic	box sum
1216	1476	8.25958	3.58394	117.30842	 68ThrH	 65HisHbb	 68ThrN	2.25433e+06	3.76120e+07	29.54721	70.37284	44.52318	1.00000	None	parabolic	box sum
1217	1477	8.65495	4.13423	119.55834	 65HisH	 61GluHa	 65HisN	1.20784e+07	2.38650e+08	27.30668	121.13393	41.38350	1.00000	None	None	box sum
1218	1479	8.43371	4.14160	117.86487	 62LeuH	 {*}H*	 62LeuN	2.66861e+07	5.31095e+08	29.66523	109.33409	42.58317	1.00000	None	None	box sum
1219	1481	8.32290	7.67762	121.92925	 57LeuH	 61GluH	 57LeuN	2.84010e+06	4.01999e+07	49.27784	47.44165	52.88142	1.00000	None	parabolic	box sum
1220	1482	8.32587	4.90035	121.96276	 57LeuH	 55AspHa	 57LeuN	5.51483e+06	8.97436e+07	33.77229	152.45430	40.42602	1.00000	None	None	box sum
1221	1483	8.10054	8.99661	121.64383	 55AspH	 59AlaH	 55AspN	1.35887e+07	2.48573e+08	30.78789	97.00731	39.53183	1.00000	None	None	box sum
1222	1484	8.10363	4.38660	119.12733	 54PheH	 53GlyHab	 54PheN	1.36990e+07	2.70242e+08	140.41245	114.78422	38.09881	1.00000	None	None	box sum
1223	1485	8.76120	4.42504	120.10794	 50LysH	 48SerHbb	 50LysN	6.79993e+06	1.82875e+08	29.92898	114.52827	39.42311	1.00000	None	None	box sum
1224	1486	8.21887	4.48038	119.18523	 49PheH	 (80Phe/84Thr)Ha	 49PheN	2.32953e+07	3.43952e+08	30.96014	166.45433	40.61222	1.00000	None	None	box sum
1225	1488	7.67074	4.13719	111.56609	 33SerH	 30GlnHa	 33SerN	1.44977e+07	4.30353e+08	28.47791	126.61473	41.65971	1.00000	None	None	box sum
1226	1489	8.73398	4.17819	118.59401	 32AlaH	 31AlaHa	 32AlaN	1.64560e+07	3.05301e+08	28.08362	140.60492	56.68592	1.00000	None	None	box sum
1227	1490	7.76978	3.72021	119.55808	 26LeuH	 22ValHa	 26LeuN	9.04418e+06	2.02639e+08	28.22608	120.15454	39.68281	1.00000	None	None	box sum
1228	1491	7.94139	3.97361	120.03262	 20ArgH	 17ThrHa	 20ArgN	1.24510e+07	2.80866e+08	29.89203	126.66348	39.63715	1.00000	None	None	box sum
1229	1493	8.66692	4.10998	109.39019	 13GlyH	 12AlaHa	 13GlyN	8.93811e+06	1.26286e+08	41.86302	55.21532	39.51681	1.00000	None	parabolic	box sum
1230	1494	9.00823	1.52511	123.93596	 16AlaH	 16AlaHb*	 16AlaN	6.51041e+06	8.42022e+07	37.24873	49.14437	36.46812	1.00000	None	parabolic	box sum
1231	1495	7.62137	8.87152	101.55304	 70ThrH	 67GlnH	 70ThrN	1.64464e+06	1.52236e+07	30.06697	34.54231	36.20338	1.00000	None	parabolic	box sum
1232	1496	7.62514	0.89049	101.37186	 70ThrH	 {*}(Hd*/Hda*/Hba)	 70ThrN	7.18229e+06	1.53280e+08	32.87524	146.30354	42.65356	1.00000	None	None	box sum
1233	1497	7.73351	0.10878	102.88897	 53GlyH	 35LeuHda*	 53GlyN	1.90638e+06	2.06635e+07	28.59354	46.03950	32.75526	1.00000	None	parabolic	box sum
1234	1498	7.74483	1.51985	106.84953	 36GlyH	 32AlaHb*	 36GlyN	3.42373e+06	5.35948e+07	29.50996	141.24461	41.20135	1.00000	None	None	box sum
1235	1499	7.74509	1.00478	106.96580	 36GlyH	 34ValHgb*	 36GlyN	2.81490e+06	3.40281e+07	28.89454	132.06880	37.40072	1.00000	None	parabolic	box sum
1236	1500	7.57250	4.53146	108.60525	 79IleH	 80PheHa	 79IleN	2.25995e+06	2.51379e+07	32.94080	40.37863	41.04495	1.00000	None	parabolic	box sum
1237	1501	7.30889	6.59041	109.58261	 84ThrH	 49PheHz	 84ThrN	2.78920e+06	3.24117e+07	31.69388	44.63195	40.65931	1.00000	None	parabolic	box sum
1238	1502	7.30359	4.07553	109.57358	 84ThrH	 85ProHa	 84ThrN	2.02677e+06	2.43407e+07	27.15290	138.19439	34.57475	1.00000	None	parabolic	box sum
1239	1504	7.30451	2.04878	109.67578	 84ThrH	 83ProHgb	 84ThrN	5.57930e+06	1.13991e+08	29.58387	123.72257	38.23185	1.00000	None	None	box sum
1240	1505	8.66890	7.35439	109.34754	 13GlyH	 14LeuH	 13GlyN	1.92624e+06	2.64906e+07	35.84921	53.27109	43.51580	1.00000	None	parabolic	box sum
1241	1506	8.66576	3.84376	109.39572	 13GlyH	 13GlyHaa	 13GlyN	4.09380e+06	5.62883e+07	39.68298	54.05901	40.70246	1.00000	None	parabolic	box sum
1242	1507	8.66707	1.45232	109.34144	 13GlyH	 11LeuHba	 13GlyN	2.65049e+06	3.43295e+07	45.28701	48.61359	39.19744	1.00000	None	parabolic	box sum
1243	1508	6.57043	7.57153	112.46383	 95GlnHe2b	 94GluH	 95GlnNe2	2.05146e+06	2.78240e+07	22.58241	134.70589	38.39970	1.00000	None	parabolic	box sum
1244	1509	6.56817	4.06405	112.47788	 95GlnHe2b	 94GluHa	 95GlnNe2	1.43424e+06	1.17445e+07	23.32687	30.10430	38.23864	1.00000	None	parabolic	box sum
1245	1510	7.07686	1.64274	111.93151	 30GlnHe2b	 26LeuHg	 30GlnNe2	2.32704e+06	4.03751e+07	29.47092	132.16945	45.28344	1.00000	None	None	box sum
1246	1511	7.83780	9.18206	110.69893	 77ThrH	 76SerH	 77ThrN	1.39482e+06	1.85046e+07	30.62785	54.60807	36.83281	1.00000	None	parabolic	box sum
1247	1512	7.84058	7.10573	110.78507	 77ThrH	 80PheHd*	 77ThrN	1.84184e+06	2.16544e+07	30.88713	41.08968	51.35119	1.00000	None	parabolic	box sum
1248	1513	7.84208	1.01328	110.73537	 77ThrH	 60LeuHda*	 77ThrN	2.93091e+06	2.86587e+07	30.63411	33.22096	40.00688	1.00000	None	parabolic	box sum
1249	1514	7.97148	1.94701	111.57079	 8ThrH	 10LysHbb	 8ThrN	1.41204e+06	2.27706e+07	25.46996	336.02060	49.59965	1.00000	None	None	box sum
1250	1516	8.92627	3.98322	113.59568	 58ThrH	 56SerHa	 58ThrN	2.17849e+06	1.14277e+07	29.17856	24.76346	41.05926	1.00000	None	parabolic	box sum
1251	1517	8.92508	2.19997	113.60694	 58ThrH	 61GluHga	 58ThrN	2.09081e+06	1.97103e+07	29.27125	44.85606	37.95552	1.00000	None	parabolic	box sum
1252	1518	8.80899	3.79788	115.22158	 48SerH	 85ProHdb	 48SerN	1.62538e+06	1.70029e+07	26.98332	40.74232	39.91485	1.00000	None	parabolic	box sum
1253	1519	8.81318	2.31115	115.27135	 48SerH	 47GluHga	 48SerN	1.05380e+07	1.89679e+08	30.66421	104.25275	39.21163	1.00000	None	None	box sum
1254	1521	8.46241	6.99619	115.72736	 86HisH	 49PheHe*	 86HisN	1.34117e+06	2.04889e+07	26.47132	58.49948	39.80374	1.00000	None	parabolic	box sum
1255	1522	8.46692	4.22327	115.75878	 86HisH	 87AlaHa	 86HisN	1.70276e+06	8.33941e+06	26.96663	29.86328	44.41035	1.00000	None	parabolic	box sum
1256	1523	8.06188	8.26396	114.08962	 45ThrH	 44AspH	 45ThrN	3.01739e+06	4.82711e+07	28.51605	57.78774	46.82338	1.00000	None	parabolic	box sum
1257	1524	8.05606	4.48465	113.90767	 45ThrH	 43LeuHa	 45ThrN	1.44252e+06	2.00432e+07	27.81421	45.59444	51.50640	1.00000	None	parabolic	box sum
1258	1526	7.57265	2.26206	114.96292	 11LeuH	 19GlnHga	 11LeuN	2.14626e+06	2.19179e+07	61.21755	44.79944	33.37502	1.00000	None	parabolic	box sum
1259	1527	7.57561	1.59929	115.03545	 11LeuH	 10LysHgb	 11LeuN	8.02321e+06	1.43859e+08	30.25234	148.61381	38.23787	1.00000	None	None	box sum
1260	1528	7.63010	2.25089	115.20315	 93LeuH	 90GluHgb	 93LeuN	3.07445e+06	3.20403e+07	32.69762	353.13100	25.57212	1.00000	None	parabolic	box sum
1261	1529	7.80425	1.81524	114.91699	 90GluH	 20ArgHba	 90GluN	5.24770e+06	7.76227e+07	32.68778	95.71269	45.91817	1.00000	None	None	box sum
1262	1530	7.80183	0.90468	114.91699	 90GluH	 88ValHga*	 90GluN	3.03981e+06	6.86617e+07	32.15790	151.29720	42.88596	1.00000	None	None	box sum
1263	1531	7.85567	1.28875	115.32592	 9SerH	 8ThrHg2*	 9SerN	4.54555e+06	6.80340e+07	53.78991	153.72385	39.71827	1.00000	None	parabolic	box sum
1264	1532	7.85910	0.77708	115.27237	 9SerH	 11LeuHdb*	 9SerN	2.19644e+06	3.65492e+07	221.05306	147.77243	48.20347	1.00000	None	None	box sum
1265	1535	9.00689	7.05688	123.62953	 59AlaH	 80PheHz	 59AlaN	1.76313e+06	1.40590e+06	34.53717	25.78649	41.43521	1.00000	None	parabolic	box sum
1266	1536	8.75544	1.49026	124.19582	 38AlaH	 38AlaHb*	 38AlaN	2.31174e+06	3.26703e+07	40.01290	52.03182	41.03774	1.00000	None	parabolic	box sum
1267	1537	8.86265	2.60029	122.43136	 31AlaH	 29AspHba	 31AlaN	2.12300e+06	8.02238e+06	30.51072	59.79851	15.06847	1.00000	None	parabolic	box sum
1268	1539	8.86093	2.26151	122.45326	 31AlaH	 34ValHb	 31AlaN	2.67660e+06	1.34289e+07	28.75656	35.50371	21.54553	1.00000	None	parabolic	box sum
1269	1540	8.73930	4.52951	121.47923	 64AspH	 65HisHa	 64AspN	2.50244e+06	1.00502e+07	31.36724	22.78503	43.25503	1.00000	None	parabolic	box sum
1270	1541	8.74085	2.58228	121.46494	 64AspH	 67GlnHga	 64AspN	1.88889e+06	1.83364e+07	26.86203	72.99843	39.08992	1.00000	None	parabolic	box sum
1271	1545	8.76042	7.39227	120.10403	 50LysH	 54PheHd*	 50LysN	1.42685e+06	2.43750e+07	29.74480	58.92843	48.83116	1.00000	None	parabolic	box sum
1272	1546	8.76206	2.85155	120.02241	 50LysH	 51AspHba	 50LysN	2.40706e+06	3.96027e+07	29.83868	171.79555	43.55729	1.00000	None	None	box sum
1273	1547	8.76288	1.76414	120.05780	 50LysH	 50LysHda	 50LysN	2.38465e+06	4.08901e+07	37.49281	211.79635	53.47103	1.00000	None	parabolic	box sum
1274	1549	8.65372	1.52249	119.61513	 65HisH	 62LeuHba	 65HisN	2.79590e+06	3.60908e+07	24.50138	61.05116	35.86119	1.00000	None	parabolic	box sum
1275	1550	8.73402	3.41249	118.94067	 66LeuH	 27ValHa	 66LeuN	1.33561e+06	1.41734e+07	30.39032	35.26387	60.93079	1.00000	None	parabolic	box sum
1276	1551	8.51118	7.00071	121.39053	 89AlaH	 49PheHe*	 89AlaN	1.59792e+06	1.91883e+07	27.72093	55.92460	35.23797	1.00000	None	parabolic	box sum
1277	1552	8.53409	3.10676	121.14401	 24ArgH	 24ArgHdb	 24ArgN	8.69955e+06	1.45804e+08	31.92097	117.01154	40.13145	1.00000	None	None	box sum
1278	1553	8.51266	2.86884	121.33963	 89AlaH	 86HisHbb	 89AlaN	2.27630e+06	2.70487e+07	37.86266	211.25967	38.80864	1.00000	None	parabolic	box sum
1279	1554	8.51069	2.70160	121.32332	 89AlaH	 86HisHba	 89AlaN	1.68632e+06	2.13409e+07	36.15677	51.36422	39.30211	1.00000	None	parabolic	box sum
1280	1555	8.53409	1.25424	121.14401	 24ArgH	 23ThrHg2*	 24ArgN	1.68934e+07	3.75662e+08	37.05442	260.87388	41.42356	1.00000	None	None	box sum
1281	1556	7.21814	4.01377	119.50564	 60LeuH	 56SerHa	 60LeuN	2.41931e+06	2.39132e+07	28.81795	36.69934	40.42548	1.00000	None	parabolic	box sum
1282	1558	7.31864	8.99347	123.67551	 78LeuH	 75SerH	 78LeuN	1.39109e+06	1.62652e+07	29.72692	45.06474	40.28302	1.00000	None	parabolic	box sum
1283	1560	7.31775	6.76719	121.72894	 12AlaH	 19GlnHe2a	 12AlaN	1.74953e+06	5.46430e+06	26.86024	20.68157	40.10713	1.00000	None	parabolic	box sum
1284	1563	7.28321	6.55934	119.91522	 96IleH	 95GlnHe2b	 96IleN	1.66797e+06	1.65891e+07	30.98369	38.14601	38.91188	1.00000	None	parabolic	box sum
1285	1564	7.48143	2.31327	121.76658	 47GluH	 47GluHga	 47GluN	8.74168e+06	1.51293e+08	33.57679	99.60862	38.67000	1.00000	None	None	box sum
1286	1565	7.68385	2.44659	121.87545	 21AlaH	 19GlnHbb	 21AlaN	2.28421e+06	4.50291e+07	26.53003	153.29726	37.77516	1.00000	None	None	box sum
1287	1566	7.68385	2.08092	121.87545	 21AlaH	 18GluHba	 21AlaN	4.59468e+06	7.60173e+07	27.10968	236.97854	44.62773	1.00000	None	None	box sum
1288	1568	7.70325	8.28342	120.66787	 10LysH	 7LeuH	 10LysN	1.34014e+06	1.25290e+07	33.97405	46.12079	33.46628	1.00000	None	parabolic	box sum
1289	1569	7.69645	4.31515	120.73230	 10LysH	 9SerHa	 10LysN	1.24238e+07	2.57398e+08	29.65271	123.73633	36.11958	1.00000	None	None	box sum
1290	1570	7.55041	1.03222	118.53602	 80PheH	 78LeuHdb*	 80PheN	1.86177e+06	2.15849e+07	26.67636	278.29842	36.07923	1.00000	None	parabolic	box sum
1291	1571	7.63501	2.74821	119.49356	 63ArgH	 64AspHba	 63ArgN	2.01351e+06	2.12931e+07	26.48890	48.33995	37.54681	1.00000	None	parabolic	box sum
1292	1572	7.76808	2.97482	119.42673	 26LeuH	 29AspHbb	 26LeuN	3.21768e+06	6.70713e+07	68.24285	71.30465	83.00388	1.00000	None	None	box sum
1293	1573	7.76609	1.92651	119.42673	 26LeuH	 25LysHba	 26LeuN	1.85855e+07	4.07868e+08	31.75884	168.19843	46.65405	1.00000	None	None	box sum
1294	1574	7.76808	1.23656	119.42673	 26LeuH	 23ThrHg2*	 26LeuN	7.19220e+06	1.16787e+08	110.59791	63.54111	48.41918	1.00000	None	None	box sum
1295	1575	7.69976	8.88046	119.61831	 72LeuH	 67GlnH	 72LeuN	1.34923e+06	1.47184e+07	26.34317	47.21921	40.21263	1.00000	None	parabolic	box sum
1296	1576	7.70104	1.54863	119.49072	 72LeuH	 72LeuHbb	 72LeuN	3.39154e+07	7.60636e+08	32.56291	114.09814	48.02668	1.00000	None	None	box sum
1297	1577	7.71245	2.35361	118.92598	 91HisH	 88ValHb	 91HisN	3.86327e+06	2.49536e+07	31.24088	27.70281	41.74703	1.00000	None	parabolic	box sum
1298	1578	7.71180	0.90989	118.80423	 91HisH	 88ValHga*	 91HisN	3.32937e+06	6.38910e+07	20.85268	51.24862	155.90620	1.00000	None	None	box sum
1299	1579	7.71405	0.76170	118.80423	 91HisH	 93LeuHda*	 91HisN	5.84835e+06	1.12546e+08	25.15227	48.43509	95.50303	1.00000	None	None	box sum
1300	1580	7.65441	7.01131	117.78527	 82HisH	 49PheHe*	 82HisN	2.27400e+06	2.15322e+07	24.42658	73.84120	42.01549	1.00000	None	parabolic	box sum
1301	1581	7.66231	6.94926	117.80171	 82HisH	 49PheHd*	 82HisN	2.05833e+06	3.03631e+07	31.78239	78.68624	48.64717	1.00000	None	parabolic	box sum
1302	1582	7.66400	2.06833	117.52413	 82HisH	 81AspHba	 82HisN	1.78329e+07	3.20113e+08	30.44993	170.88693	43.88326	1.00000	None	None	box sum
1303	1583	7.66464	0.63378	117.73318	 82HisH	 79IleHg1b	 82HisN	1.52998e+06	1.84873e+07	29.67268	39.67446	55.78959	1.00000	None	parabolic	box sum
1304	1584	7.65067	1.98136	117.87398	 25LysH	 25LysHbb	 25LysN	5.14793e+07	1.00746e+09	29.91974	198.89091	43.62142	1.00000	None	None	box sum
1305	1585	7.56741	1.22328	116.78543	 94GluH	 96IleHg1a	 94GluN	3.54911e+06	4.92827e+07	70.11414	53.51014	41.19080	1.00000	None	parabolic	box sum
1306	1586	7.56680	1.07144	116.77751	 94GluH	 93LeuHdb*	 94GluN	2.25719e+06	2.73599e+07	55.33636	53.96032	35.21794	1.00000	None	parabolic	box sum
1307	1587	7.61556	8.74760	116.47770	 35LeuH	 32AlaH	 35LeuN	1.88566e+06	1.88033e+07	21.44158	42.45713	36.40401	1.00000	None	parabolic	box sum
1308	1589	7.62159	6.84344	116.43552	 35LeuH	 37TyrHe*	 35LeuN	1.86606e+06	2.75720e+07	28.13578	68.56091	38.69206	1.00000	None	parabolic	box sum
1309	1590	7.61576	2.91654	116.38323	 35LeuH	 37TyrHba	 35LeuN	1.86654e+06	2.53228e+07	32.46903	53.37057	44.77495	1.00000	None	parabolic	box sum
1310	1591	7.61776	1.67618	116.39952	 35LeuH	 31AlaHb*	 35LeuN	3.44613e+06	3.12626e+07	32.68600	42.70542	40.84194	1.00000	None	parabolic	box sum
1311	1592	7.84994	7.02449	122.15461	 43LeuH	 37TyrHd*	 43LeuN	1.65831e+06	1.55239e+07	26.59380	32.01176	40.36713	1.00000	None	parabolic	box sum
1312	1593	7.84788	6.82840	122.16538	 43LeuH	 37TyrHe*	 43LeuN	1.41097e+06	1.89646e+07	34.91729	54.43409	43.34038	1.00000	None	parabolic	box sum
1313	1594	8.00588	6.91485	122.30698	 51AspH	 49PheHd*	 51AspN	1.32753e+06	1.31521e+07	25.43002	59.92944	37.20146	1.00000	None	parabolic	box sum
1314	1596	8.01260	1.98656	122.33214	 51AspH	 50LysHbb	 51AspN	1.42958e+07	2.34510e+08	28.97024	141.38065	44.79504	1.00000	None	None	box sum
1315	1597	8.19596	3.98652	123.42247	 6LeuH	 9SerHba	 6LeuN	1.46246e+06	2.10266e+07	32.82100	53.76806	45.34405	1.00000	None	parabolic	box sum
1316	1598	8.22213	4.38025	121.57969	 87AlaH	 84ThrHb	 87AlaN	7.23845e+06	6.63430e+07	33.61762	132.17928	39.82157	1.00000	None	None	box sum
1317	1599	8.21350	3.65647	121.57450	 87AlaH	 83ProHdb	 87AlaN	1.33212e+06	1.96546e+07	30.36082	58.91152	50.78351	1.00000	None	parabolic	box sum
1318	1600	8.21390	1.00638	121.57969	 87AlaH	 84ThrHg2*	 87AlaN	1.00228e+07	1.49534e+08	91.01242	63.65984	40.12400	1.00000	None	None	box sum
1319	1601	8.17537	6.84530	119.85116	 37TyrH	 37TyrHe*	 37TyrN	1.90816e+06	1.75595e+07	25.66785	39.52840	35.70676	1.00000	None	parabolic	box sum
1320	1602	7.99653	2.08060	120.84197	 34ValH	 30GlnHbb	 34ValN	4.10414e+06	3.54020e+07	33.18518	42.50765	33.26738	1.00000	None	parabolic	box sum
1321	1605	7.94080	2.84534	120.02554	 20ArgH	 19GlnHgb	 20ArgN	7.15853e+06	1.15140e+08	50.33582	54.90039	50.68517	1.00000	None	None	box sum
1322	1606	7.93579	2.27499	120.02554	 20ArgH	 19GlnHga	 20ArgN	3.37034e+06	7.23097e+07	23.45294	199.68236	82.32898	1.00000	None	None	box sum
1323	1607	7.93877	1.78182	120.02554	 20ArgH	 20Arg(Hba/Hgb)	 20ArgN	3.20694e+07	6.66256e+08	29.84047	168.12098	40.32850	1.00000	None	None	box sum
1324	1608	7.94483	1.31651	119.92378	 20ArgH	 17ThrHg2*	 20ArgN	3.47506e+06	5.70601e+07	41.58109	69.37419	87.78971	1.00000	None	parabolic	box sum
1325	1609	7.97826	4.95970	119.66564	 81AspH	 82HisHa	 81AspN	2.42117e+06	2.48846e+07	26.47102	45.97561	34.14810	1.00000	None	parabolic	box sum
1326	1610	7.97454	4.38679	119.74197	 81AspH	 77ThrHa	 81AspN	2.83436e+06	6.37899e+07	28.49191	44.55568	29.62768	1.00000	None	parabolic	box sum
1327	1612	7.98307	1.53519	119.85414	 20ArgH	 20ArgHga	 20ArgN	-7.12238e+06	1.20966e+07	18.27031	45.71592	11.41649	1.00000	None	parabolic	box sum
1328	1613	7.97780	1.14111	119.65265	 81AspH	 77ThrHg2*	 81AspN	3.19619e+06	4.35182e+07	26.38698	115.13100	32.52858	1.00000	None	parabolic	box sum
1329	1615	7.98062	1.03601	119.58069	 81AspH	 78LeuHdb*	 81AspN	2.83519e+06	2.52460e+07	25.25240	120.95779	21.93177	1.00000	None	parabolic	box sum
1330	1616	8.10452	2.83166	119.11835	 54PheH	 54PheHbb	 54PheN	5.09349e+07	7.17742e+08	32.66037	56.18095	39.54083	1.00000	None	parabolic	box sum
1331	1617	8.10437	2.68033	119.12120	 54PheH	 (54Phe/49Phe)Hb*	 54PheN	4.52672e+07	6.21271e+08	31.61460	55.38910	39.53356	1.00000	None	parabolic	box sum
1332	1618	8.10605	2.30774	119.05011	 54PheH	 52LeuHbb	 54PheN	1.18292e+07	1.88709e+08	90.61396	55.98436	42.48440	1.00000	None	None	box sum
1333	1619	8.10199	1.40932	119.11867	 54PheH	 59AlaHb*	 54PheN	2.78867e+06	3.60590e+07	26.85189	155.34372	38.55795	1.00000	None	parabolic	box sum
1334	1620	8.10526	0.62844	119.11081	 54PheH	 35LeuHdb*	 54PheN	3.87238e+06	4.31940e+07	50.90743	40.48951	40.49796	1.00000	None	parabolic	box sum
1335	1621	8.35727	8.86576	119.35803	 28LeuH	 31AlaH	 28LeuN	1.69329e+06	1.55536e+07	27.35287	35.79195	39.12878	1.00000	None	parabolic	box sum
1336	1622	8.28412	7.83861	119.08758	 7LeuH	 9SerH	 7LeuN	2.40979e+06	1.82833e+07	24.89209	27.68571	38.99550	1.00000	None	parabolic	box sum
1337	1623	8.28004	2.95083	119.31099	 28LeuH	 29AspHbb	 28LeuN	1.48193e+06	2.41957e+07	149.58501	54.59175	95.20477	1.00000	None	parabolic	box sum
1338	1625	8.24204	8.73422	118.11600	 30GlnH	 32AlaH	 30GlnN	2.96679e+06	4.34910e+07	22.45545	50.08061	151.26282	1.00000	None	parabolic	box sum
1339	1626	8.24300	4.03421	118.10991	 30GlnH	 28LeuHa	 30GlnN	5.41892e+06	9.93066e+07	28.75268	135.71742	49.77739	1.00000	None	parabolic	box sum
1340	1628	8.24423	0.23686	118.10696	 30GlnH	 62LeuHda*	 30GlnN	1.34307e+06	1.41410e+07	24.66857	44.79669	36.81839	1.00000	None	parabolic	box sum
1341	1629	8.25842	3.19812	117.40961	 68ThrH	 65HisHba	 68ThrN	1.67826e+06	2.38322e+07	26.52556	65.94495	37.48715	1.00000	None	parabolic	box sum
1342	1630	8.25667	0.91559	117.14362	 68ThrH	 66LeuHba	 68ThrN	1.69804e+06	2.22140e+07	33.93888	162.64686	169.32863	1.00000	None	parabolic	box sum
1343	1632	8.10739	1.83635	119.06246	 54PheH	 52LeuHba	 54PheN	1.50003e+07	2.50985e+08	186.91599	60.00060	42.05942	1.00000	None	None	box sum
1344	1633	8.10497	1.26757	119.20099	 54PheH	 58ThrHg2*	 54PheN	1.75482e+06	2.58149e+07	145.48987	268.01740	42.79828	1.00000	None	parabolic	box sum
1345	1639	8.12481	1.51460	118.01983	 100GlyH	 93LeuHba	 100GlyN	2.41012e+06	4.16289e+07	25.98822	121.15752	40.16989	1.00000	None	None	box sum
1346	1640	8.12481	0.80368	118.01983	 100GlyH	 99IleHd1*	 100GlyN	3.94798e+06	9.40518e+07	24.70970	119.69217	104.78956	1.00000	None	None	box sum
1347	1641	7.93362	4.10918	117.04203	 27ValH	 23ThrHa	 27ValN	5.37737e+06	8.45179e+07	126.32340	147.20823	37.42427	1.00000	None	None	box sum
1348	1642	7.93625	2.97560	117.33461	 27ValH	 29AspHbb	 27ValN	1.48191e+06	2.36863e+07	38.31327	60.66388	42.81867	1.00000	None	parabolic	box sum
1349	1643	7.93682	1.19952	117.04203	 23ThrH	 23ThrHg2*	 23ThrN	7.31260e+06	2.83716e+08	77.79956	153.53198	42.88954	1.00000	None	None	box sum
1350	1651	7.32685	7.07442	123.72406	 78LeuH	 80PheHd*	 78LeuN	2.99129e+06	1.17527e+07	29.01405	23.01779	38.79291	1.00000	None	parabolic	box sum
1351	1652	7.30895	6.90301	109.62020	 84ThrH	 49PheHd*	 84ThrN	5.73026e+06	9.45670e+07	29.17379	125.87242	40.80200	1.00000	None	None	box sum
1352	1657	8.11313	1.75184	121.66453	 55AspH	 57LeuHba	 55AspN	3.50013e+06	4.80297e+07	206.63351	60.08710	36.82154	1.00000	None	parabolic	box sum
1353	1659	9.17351	8.91250	124.75585	 74LeuH	 67GlnH	 74LeuN	1.74560e+06	2.12290e+07	31.57571	39.30759	45.19680	1.00000	None	parabolic	box sum
1354	1661	9.25121	4.35591	121.14290	 76SerH	 77ThrHa	 76SerN	1.43499e+06	1.35604e+07	44.28014	60.12131	19.80013	1.00000	None	parabolic	box sum
1355	1662	9.10232	4.34113	118.54720	 19GlnH	 11LeuHa	 19GlnN	1.89831e+06	4.23092e+06	27.38565	68.42782	32.15337	1.00000	None	parabolic	box sum
1356	1663	8.77740	2.29951	111.72539	 15ThrH	 18GluHga	 15ThrN	1.57045e+07	3.90342e+08	29.65599	116.43043	39.10673	1.00000	None	None	box sum
1357	1666	8.43562	2.07229	107.79873	 98GlyH	 97ProHgb	 98GlyN	1.42236e+06	2.25577e+07	39.38556	160.67511	35.44700	1.00000	None	parabolic	box sum
1358	1668	7.57278	6.93288	108.57676	 79IleH	 49PheHe*	 79IleN	2.79338e+06	4.13320e+07	29.82736	147.83022	38.66887	1.00000	None	parabolic	box sum
1359	1669	7.85649	1.64160	115.30503	 9SerH	 6LeuHbb	 9SerN	3.17433e+06	5.79160e+07	31.40241	310.64340	37.27239	1.00000	None	parabolic	box sum
1360	1670	7.85094	0.80291	122.11703	 43LeuH	 43LeuHda*	 43LeuN	1.25190e+07	2.26647e+08	29.11299	108.32915	39.83867	1.00000	None	None	box sum
1361	1671	8.24930	7.70172	121.97424	 87AlaH	 91HisH	 87AlaN	2.58342e+06	2.58337e+07	45.82912	48.27114	46.25750	1.00000	None	parabolic	box sum
1362	1672	8.44333	2.76486	117.74552	 62LeuH	 64AspHba	 62LeuN	3.65080e+06	4.11053e+07	41.69375	62.31402	33.56314	1.00000	None	parabolic	box sum
1363	1673	7.73744	7.39770	102.83335	 53GlyH	 54PheHd*	 53GlyN	1.02020e+07	1.28115e+08	31.51625	48.76850	40.16030	1.00000	None	parabolic	box sum
1364	1675	7.30540	0.89046	109.59323	 84ThrH	 88ValHga*	 84ThrN	1.62779e+06	2.23872e+07	31.82620	144.96126	45.30680	1.00000	None	parabolic	box sum
1365	1676	6.56898	6.16995	112.42716	 95GlnHe2b	 91HisHd2	 95GlnNe2	4.87984e+06	4.23296e+07	30.19989	27.03697	52.30248	1.00000	None	parabolic	box sum
1366	1678	8.07824	4.27536	112.45211	 5ThrH	 3ThrHb	 5ThrN	1.50447e+06	1.69415e+07	32.76467	40.57915	41.46445	1.00000	None	parabolic	box sum
1367	1679	8.16806	0.86426	111.38704	 17ThrH	 14LeuHda*	 17ThrN	1.33342e+06	2.50443e+07	198.00901	61.07435	55.23825	1.00000	None	parabolic	box sum
1368	1681	7.61908	7.36023	116.37228	 35LeuH	 54PheHz	 35LeuN	7.28668e+06	7.81883e+07	30.58255	42.04980	38.62464	1.00000	None	parabolic	box sum
1369	1682	7.61478	7.20364	116.38795	 35LeuH	 54PheHe*	 35LeuN	3.96626e+06	4.66579e+07	30.80219	48.01204	42.43702	1.00000	None	parabolic	box sum
1370	1683	7.57228	7.30912	116.87131	 94GluH	 96IleH	 94GluN	5.25892e+06	2.15708e+07	32.69553	60.91689	51.24885	1.00000	None	parabolic	box sum
1371	1684	8.40599	6.58452	117.08918	 92LeuH	 95GlnHe2b	 92LeuN	1.39973e+06	1.85785e+07	25.32870	52.94437	37.13071	1.00000	None	parabolic	box sum
1372	1686	8.73311	8.39686	118.69733	 32AlaH	 40ThrH	 32AlaN	2.90268e+06	9.07439e+06	30.76136	18.99673	64.51494	1.00000	None	parabolic	box sum
1373	1688	8.51282	8.25728	121.36785	 89AlaH	 87AlaH	 89AlaN	8.00283e+06	7.47854e+07	40.11393	68.16912	48.96897	1.00000	None	parabolic	box sum
1374	1690	8.51231	3.78778	121.16472	 89AlaH	 89AlaHa	 89AlaN	4.13073e+07	6.95298e+08	35.31814	74.26955	41.71389	1.00000	None	None	box sum
1375	1691	8.52035	3.00848	119.48436	 88ValH	 91HisHbb	 88ValN	1.79772e+06	2.69603e+07	28.92524	143.65986	36.51923	1.00000	None	parabolic	box sum
1376	1692	8.52160	2.87060	119.48982	 88ValH	 86HisHbb	 88ValN	3.24844e+06	3.81489e+07	31.75676	48.98671	43.21796	1.00000	None	parabolic	box sum
1377	1693	8.51848	2.69475	119.53039	 88ValH	 86HisHba	 88ValN	2.34585e+06	4.29606e+07	29.96147	49.52732	83.83209	1.00000	None	None	box sum
1378	1694	8.52250	2.16201	119.46236	 88ValH	 91HisHba	 88ValN	2.68482e+06	2.90081e+07	30.12359	154.43588	46.54104	1.00000	None	parabolic	box sum
1379	1695	8.52268	1.08145	119.53039	 88ValH	 27ValHga*	 88ValN	9.00912e+06	1.81514e+08	34.50543	93.88327	40.73095	1.00000	None	None	box sum
1380	1696	8.49005	7.54271	118.37121	 22ValH	 18GluH	 22ValN	2.46715e+06	2.50892e+07	27.93044	25.92116	55.73344	1.00000	None	parabolic	box sum
1381	1697	8.48281	9.12999	118.47921	 22ValH	 19GlnH	 22ValN	2.35636e+06	3.50162e+07	64.83227	47.77781	46.22328	1.00000	None	parabolic	box sum
1382	1698	8.48692	2.38603	118.35116	 22ValH	 18GluHbb	 22ValN	2.32484e+06	3.13776e+07	35.31814	139.65031	36.83245	1.00000	None	parabolic	box sum
1383	1699	8.48161	1.43817	118.50235	 22ValH	 89AlaHb*	 22ValN	4.24885e+06	6.18148e+07	28.31399	39.22625	84.58477	1.00000	None	parabolic	box sum
1384	1700	8.45128	4.33426	117.73081	 46HisH	 47GluHa	 46HisN	1.99139e+06	2.71457e+07	46.16559	55.86287	56.64027	1.00000	None	parabolic	box sum
1385	1703	8.17145	2.25680	119.93708	 37TyrH	 34ValHb	 37TyrN	1.65395e+06	2.30027e+07	33.38188	53.97998	121.52767	1.00000	None	parabolic	box sum
1386	1705	7.98108	8.74457	119.06143	 69AlaH	 66LeuH	 69AlaN	2.03403e+06	7.58197e+06	20.89471	25.48434	29.31964	1.00000	None	parabolic	box sum
1387	1706	7.98029	3.57809	119.07791	 69AlaH	 65HisHbb	 69AlaN	1.66979e+06	2.23169e+07	28.62930	61.03032	34.96301	1.00000	None	parabolic	box sum
1388	1707	7.98055	2.55768	119.06076	 69AlaH	 67GlnHga	 69AlaN	2.73161e+06	4.30459e+07	27.68576	86.92965	37.38463	1.00000	None	parabolic	box sum
1389	1708	7.98178	2.25388	118.88626	 69AlaH	 67GlnHba	 69AlaN	2.41431e+06	2.99183e+07	47.71918	37.70311	59.48877	1.00000	None	parabolic	box sum
1390	1710	7.97938	0.63768	119.66392	 81AspH	 79IleHg1b	 81AspN	1.43645e+06	1.68415e+07	30.52831	52.37663	39.78115	1.00000	None	parabolic	box sum
1391	1712	7.35671	0.76846	119.84687	 14LeuH	 11LeuHdb*	 14LeuN	5.09248e+06	1.08972e+08	83.83185	149.75833	39.86114	1.00000	None	None	box sum
1392	1716	8.88005	0.90349	123.56780	 67GlnH	 66LeuHba	 67GlnN	2.41066e+06	1.46556e+08	21.59953	166.27072	37.11954	1.00000	None	None	box sum
;

   loop_
      _Spectral_dim.ID
      _Spectral_dim.Axis_code
      _Spectral_dim.Spectrometer_frequency
      _Spectral_dim.Atom_type
      _Spectral_dim.Atom_isotope_number
      _Spectral_dim.Spectral_region
      _Spectral_dim.Magnetization_linkage_ID
      _Spectral_dim.Under_sampling_type
      _Spectral_dim.Sweep_width
      _Spectral_dim.Sweep_width_units
      _Spectral_dim.Value_first_point
      _Spectral_dim.Absolute_peak_positions
      _Spectral_dim.Acquisition
      _Spectral_dim.Center_frequency_offset
      _Spectral_dim.Encoding_code
      _Spectral_dim.Encoded_reduced_dimension_ID
      _Spectral_dim.Entry_ID
      _Spectral_dim.Spectral_peak_list_ID

      1   .   .   H   1    HN   3   .         10000     Hz   .   .   .   4.79   .   .   34299   1
      2   .   .   H   1    H    1   .         6596.31   Hz   .   .   .   4.75   .   .   34299   1
      3   .   .   N   15   N    1   aliased   2000      Hz   .   .   .   115    .   .   34299   1
   stop_
save_