X2JE07_DROME Loading...

C3H1-type domain-containing protein

AlphaFold DB , UniProt , Accession X2JE07, Species DROME (Drosophila melanogaster, Fruit fly), Gene ZC3H18, Length 999 aa.

						>X2JE07_DROME|X2JE07|ZC3H18
MVLDMESDDSHASSASNSSESRSNSPTNDKDEVVADHGGESPGGGGDPILDRSDRAPSTSSSSSNSSSSSNRSDLSKKQKKSSSSSSGSGSGSGSSSSSGSSSEDEGDQEPEQEVQRLSEQQREQQQHSPINERESESAAGTPVNADQPGSPNAKSQPSSFLSSVRSRSVSPQLYNQAAVDLNISHDDLSDVSDIEGEEKRTSSKNSMRPADENEDGAISNDSLPTLGEEDEVEQKQSTPNGKASSGDEKEPFAKETHTDDASNGLAPATALQEDLVKTHDDDALDFEAEEGECPEQAKEPSPMESTANETNQTKSTTKVSQDEGDDDGEVDKDGDDKDGDDKDTRKDGAGNGCLEDGAGNDSRKDDAGNGCLEEGEEEKDIVSVSTSSSQEKVEEGELEEGEVSDEDEKRPEETEPKPVCRFYTRGQCTWGMSCRFLHPGVTDKGNYTMFDNVIRPVPMQGGSTGASAPAAPSSTAAPRAGGSAYSSHASATADYHDYRTERPLHHRPPLLHAPSIYGAPVHDARTLLPDGAPVVVENAWERGLRTAKEMMRKANKRKEQDMDFEDKKMNLTLSPDEMEKDSYYLKDRGGSSARSPPPPSANVREQPLNPLSMPLSMHPHAVAHANPRALLPLQYSVYGPPPDRYGRPQYMPPQYDDVDAYGRMTRYRELPPHRMPHYEDDRRSRPTREVIVQRVEAAGRGDEWSDPWMRSKSVGRGSYEREDRRRRDRRSYSSNSSYSTSNSSQSDSSSDSSRSSSPSDHKRRYGSHKLATATATSRRHGGRAARSPSQIPRRPRRTSKGSLSPSYKRPAVDKRGVGHSPSSKRKKLSSPAPKKFDKLRRRRSSSSSDSDSSDTSYSDSESGSSSSDSSSGSRETPQKRVRATDKALNERKLISKPEQSTKKRSPISIEIKKTSNMVGVSALASASNSADSDAEKDHDNGKDKEKDHVKEKDKDCKEKDKDKDGMKDKEGKKSRREELLKQLRAVEDAIAKKRSKLN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.4	Very low	34.6	Very low	248 Å²	248	151.7 Å²	151.7	100%	1.222	81%	0.812	S	S	*	*				0	156.5	0	-74.8	172	171.1	0	0	107.3
2	V	39.3	Very low	34.3	Very low	120 Å²	120	146.7 Å²	146.7	73%	0.727	81%	0.807	S	S	*	*			trans	-77.7	135.4	-172.7	-176.7	0	0	0	0	111
3	L	39.5	Very low	34	Very low	157 Å²	157	145 Å²	145	82%	0.822	81%	0.813	S	S	*	*			trans	-144.2	116.1	139.6	-66.1	179.9	0	0	0	103.6
4	D	34.7	Very low	33.7	Very low	102 Å²	102	143.1 Å²	143.1	55%	0.545	81%	0.813	S	S	.	*				66.7	106.5	71.5	-63.5	-58.4	0	0	0	111
5	M	37.1	Very low	33.7	Very low	152 Å²	152	139.2 Å²	139.2	75%	0.749	81%	0.806	S	S	*	*				76.4	140.3	88.9	-119.6	91.3	81.4	0	0	111.8
6	E	34.9	Very low	33.3	Very low	172 Å²	172	136.8 Å²	136.8	80%	0.804	80%	0.8	S	S	*	*			cis	-159.4	-164.9	17.3	-158.8	153.5	-170.1	0	0	111
7	S	34.7	Very low	32.9	Very low	115 Å²	115	137.3 Å²	137.3	80%	0.804	80%	0.798	S	S	*	*			trans	73.7	90.4	171.8	57.8	0	0	0	0	119.1
8	D	30.4	Very low	32.7	Very low	167 Å²	167	136.3 Å²	136.3	89%	0.893	80%	0.801	S	S	*	*			trans	-79.5	145.5	154.6	-84	-85.6	0	0	0	111.3
9	D	33	Very low	32.4	Very low	139 Å²	139	134.2 Å²	134.2	74%	0.743	79%	0.793	S	S	*	*			trans	-142.9	141.8	164.2	-154.9	-38.7	0	0	0	111.8
10	S	31.9	Very low	32.3	Very low	107 Å²	107	136.5 Å²	136.5	75%	0.748	80%	0.796	S	S	*	*			trans	22.9	85.7	167.4	46.5	0	0	0	0	120.6
11	H	32.7	Very low	32.1	Very low	190 Å²	190	134 Å²	134	88%	0.88	79%	0.787	S	S	*	*			trans	-85.7	146.2	155.9	-101.1	-80.5	0	0	0	113.1
12	A	31.5	Very low	32	Very low	91 Å²	91	132.7 Å²	132.7	75%	0.752	77%	0.768	S	S	*	*			trans	-80.7	174.5	-167.3	0	0	0	0	0	115.7
13	S	29.8	Very low	31.6	Very low	125 Å²	125	131.8 Å²	131.8	87%	0.874	77%	0.767	S	S	*	*			trans	-143.1	95.3	172.1	-70.4	0	0	0	0	113.3
14	S	29.4	Very low	31.1	Very low	118 Å²	118	132.3 Å²	132.3	83%	0.825	77%	0.77	S	S	*	*			trans	-74.1	169.4	155.3	-18.2	0	0	0	0	109.6
15	A	33.7	Very low	31.1	Very low	85 Å²	85	132.5 Å²	132.5	70%	0.702	78%	0.78	S	S	*	*			cis	-158	157.3	-2.6	0	0	0	0	0	110.9
16	S	27.3	Very low	31.7	Very low	101 Å²	101	130.7 Å²	130.7	71%	0.706	78%	0.78	S	S	*	*			trans	40.3	138.3	132.9	-51.7	0	0	0	0	124.8
17	N	26.4	Very low	31.5	Very low	145 Å²	145	128.4 Å²	128.4	78%	0.775	78%	0.778	S	S	*	*			trans	78.7	107.2	142.7	-61.1	-13.6	0	0	0	121.6
18	S	29.5	Very low	31.4	Very low	120 Å²	120	129.5 Å²	129.5	84%	0.839	77%	0.774	S	S	*	*				-171.9	130.6	129.7	-76.7	0	0	0	0	107.9
19	S	27.9	Very low	31.6	Very low	95 Å²	95	126.7 Å²	126.7	66%	0.664	76%	0.759	S	S	*	*			cis	75	99.7	25.2	-50	0	0	0	0	115.9
20	E	29.9	Very low	31.7	Very low	181 Å²	181	127.3 Å²	127.3	85%	0.846	76%	0.755	S	S	*	*			trans	68.7	161.5	144.1	-61.1	-155.6	76.6	0	0	118.5
21	S	29	Very low	32	Very low	85 Å²	85	128.2 Å²	128.2	59%	0.594	75%	0.752	S	S	*	*			cis	-150.4	161	-16.6	-122.9	0	0	0	0	114.1
22	R	29.8	Very low	32.2	Very low	219 Å²	219	126.7 Å²	126.7	83%	0.826	75%	0.745	S	S	*	*			trans	-13.4	120.7	161.2	-68	171.6	176.4	145.9	5.5	120.9
23	S	31.3	Very low	32.3	Very low	102 Å²	102	127.6 Å²	127.6	71%	0.713	74%	0.741	S	S	*	*				26.4	131	119.7	65.4	0	0	0	0	121.9
24	N	28.7	Very low	32.5	Very low	167 Å²	167	127.6 Å²	127.6	89%	0.893	74%	0.735	S	S	*	*			trans	-145.3	162.5	145.1	-96.4	-32.8	0	0	0	110.7
25	S	33.8	Very low	32.8	Very low	107 Å²	107	126.4 Å²	126.4	75%	0.748	73%	0.733	S	S	*	*			trans	-138.8	179.9	177.6	-42.6	0	0	0	0	108.4
26	P	49.3	Very low	32.7	Very low	114 Å²	114	128.5 Å²	128.5	74%	0.74	73%	0.732	S	S	*	*				-159.3	-154.2	63.1	40.2	-14.1	0	0	0	116.3
27	T	31.9	Very low	33	Very low	124 Å²	124	132 Å²	132	76%	0.761	74%	0.737	S	S	*	*			trans	80.3	134.4	172.9	65.2	0	0	0	0	116.8
28	N	31.8	Very low	33.3	Very low	138 Å²	138	129 Å²	129	74%	0.738	74%	0.74	S	S	*	*			cis	74.9	139.7	40.4	-77.6	32.7	0	0	0	113.5
29	D	34	Very low	33.4	Very low	107 Å²	107	126.7 Å²	126.7	57%	0.572	74%	0.736	S	S	*	*			cis	-163.6	157.2	21.6	-130.4	-40.8	0	0	0	112.8
30	K	36.8	Very low	33.6	Very low	152 Å²	152	132.1 Å²	132.1	66%	0.661	75%	0.751	S	S	*	*			trans	64.3	165.5	148.9	-77.1	169.6	-170.1	72.7	0	121
31	D	37.9	Very low	33.9	Very low	127 Å²	127	128.8 Å²	128.8	68%	0.679	75%	0.747	S	S	*	*			cis	-158.5	170	-2.2	-121.8	-22.8	0	0	0	114.6
32	E	36.4	Very low	35.1	Very low	157 Å²	157	130.7 Å²	130.7	73%	0.734	76%	0.758	S	S	*	*			trans	60.8	165.1	154.5	-73.4	-73.8	97.8	0	0	120
33	V	33.5	Very low	35.4	Very low	111 Å²	111	124.3 Å²	124.3	67%	0.673	76%	0.759	S	S	*	*			cis	-142.9	-166.5	10.1	-130.5	0	0	0	0	108.4
34	V	33.7	Very low	35.5	Very low	124 Å²	124	123.7 Å²	123.7	75%	0.752	77%	0.769	S	S	*	*			cis	-158	151.1	6.4	-119	0	0	0	0	110.3
35	A	35.3	Very low	35.9	Very low	94 Å²	94	119.8 Å²	119.8	78%	0.777	77%	0.768	S	S	*	*			trans	60.3	162.4	146.8	0	0	0	0	0	120.7
36	D	31.8	Very low	35.9	Very low	129 Å²	129	117.3 Å²	117.3	69%	0.69	76%	0.76	S	S	*	*			cis	-148.8	-178.2	9.9	-163.5	27.4	0	0	0	114.9
37	H	34.4	Very low	35.2	Very low	175 Å²	175	115.7 Å²	115.7	81%	0.81	75%	0.745	S	S	*	*			trans	-33.5	162.5	174	-55.6	-27.9	0	0	0	118.8
38	G	31.7	Very low	36.5	Very low	80 Å²	80	114 Å²	114	83%	0.825	74%	0.736	S	S	*	*			cis	147	156.7	-0.1	0	0	0	0	0	112.5
39	G	33.5	Very low	36.9	Very low	73 Å²	73	114.5 Å²	114.5	75%	0.753	74%	0.737	S	S	*	*			trans	119.6	115.9	157.7	0	0	0	0	0	121.9
40	E	31.9	Very low	37.2	Very low	209 Å²	209	117 Å²	117	98%	0.977	75%	0.75	S	S	*	*			trans	71.7	157.7	133.5	-53.6	-161.2	103.4	0	0	125
41	S	35.9	Very low	37.1	Very low	110 Å²	110	114.9 Å²	114.9	77%	0.769	75%	0.746	S	S	*	*			trans	-165.6	148	180	-173.7	0	0	0	0	109.6
42	P	54.7	Low	37.2	Very low	126 Å²	126	118.9 Å²	118.9	82%	0.818	75%	0.751	S	S	*	*				-161.7	164.8	111.5	39.3	-19.8	0	0	0	119.3
43	G	34	Very low	37.4	Very low	84 Å²	84	115.5 Å²	115.5	87%	0.866	75%	0.745	S	S	*	*			trans	80.3	157.2	154.8	0	0	0	0	0	118
44	G	34.4	Very low	37.6	Very low	89 Å²	89	116.6 Å²	116.6	92%	0.918	75%	0.747	S	S	*	*			cis	136.5	140.4	-2.3	0	0	0	0	0	112
45	G	36.7	Very low	37.6	Very low	85 Å²	85	121.8 Å²	121.8	88%	0.876	75%	0.753	S	S	*	*			cis	169.2	167.4	-5.6	0	0	0	0	0	111.7
46	G	34.2	Very low	37.9	Very low	55 Å²	55	121.4 Å²	121.4	57%	0.567	75%	0.75	S	S	*	*			trans	130.1	133.4	165.7	0	0	0	0	0	118.8	K835	G46-K835 WeakPolarHBondContact O-CE 3.35Å; G46-K835 PolarHBondContact O-NZ 3.28Å
47	D	34.8	Very low	38.9	Very low	81 Å²	81	121 Å²	121	43%	0.433	76%	0.755	S	S	.	*			trans	-94.8	-172.8	177.9	-144.5	-8.8	0	0	0	113.9	P834 K835	D47-P834 VanDerWaalsContact CG-CD 3.44Å; D47-P834 WeakPolarHBondContact OD1-CG 3.39Å; D47-P834 WeakPolarHBondContact OD2-CD 3.48Å; D47-P834 WeakPolarHBondContact OD2-CG 3.43Å; D47-K835 PolarHBondContact O-NZ 3.41Å; D47-K835 VanDerWaalsContact OD1-CE 3.3Å; D47-K835 WeakPolarHBondContact OD1-CE 3.48Å
48	P	60.1	Low	39	Very low	88 Å²	88	117.7 Å²	117.7	57%	0.571	75%	0.751	S	S	*	*				-151.9	-174.7	84.5	41.4	-19.8	0	0	0	117.5	K836	P48-K836 PolarHBondContact O-NZ 2.72Å
49	I	40.1	Very low	38.9	Very low	149 Å²	149	120 Å²	120	76%	0.764	75%	0.749	S	S	*	*			trans	-96.3	166.2	-165	-64.9	158	0	0	0	113.6
50	L	38.7	Very low	38.9	Very low	160 Å²	160	121.1 Å²	121.1	84%	0.838	75%	0.745	S	S	*	*			trans	162.6	153.6	140.3	-83.1	-178.4	0	0	0	109.5
51	D	35.2	Very low	39	Very low	107 Å²	107	116 Å²	116	57%	0.572	73%	0.733	S	S	*	*			cis	-169	143.1	-33.5	-174.6	27.2	0	0	0	110.9
52	R	40.4	Very low	38.8	Very low	211 Å²	211	117 Å²	117	80%	0.796	74%	0.739	S	S	*	*			trans	54.3	173.9	160.8	-82.3	148.9	112.6	179.6	2	119.3
53	S	39.5	Very low	37.8	Very low	86 Å²	86	116.1 Å²	116.1	60%	0.601	74%	0.737	S	S	*	*			cis	-167	167.6	-9	-110.7	0	0	0	0	107.4
54	D	38.1	Very low	37.8	Very low	133 Å²	133	116.9 Å²	116.9	71%	0.711	73%	0.729	S	S	*	*			cis	-164.9	176.1	-11.2	-134.2	-73.6	0	0	0	112.5
55	R	34.9	Very low	37.6	Very low	233 Å²	233	119.7 Å²	119.7	88%	0.879	72%	0.723	S	S	*	*			trans	59.3	142.4	151.6	-91.7	171.4	172.8	156	-1.5	125.6
56	A	41.1	Very low	37.2	Very low	87 Å²	87	120.5 Å²	120.5	72%	0.719	72%	0.715	S	S	*	*			trans	-102.4	-168	159.5	0	0	0	0	0	110.6
57	P	52.2	Low	37	Very low	121 Å²	121	123.2 Å²	123.2	79%	0.786	73%	0.725	S	S	*	*				-155.3	-176.6	71.9	41.7	-19.7	0	0	0	118.2
58	S	36.2	Very low	36.7	Very low	104 Å²	104	124.9 Å²	124.9	73%	0.727	74%	0.743	S	S	*	*			trans	-13.7	162.9	157.4	-41.1	0	0	0	0	120.4
59	T	29.7	Very low	35.4	Very low	129 Å²	129	126 Å²	126	79%	0.791	75%	0.753	S	S	*	*				-171.3	169.4	52.7	43.1	0	0	0	0	112.1
60	S	33.8	Very low	34.9	Very low	96 Å²	96	123.9 Å²	123.9	67%	0.671	75%	0.752	S	S	*	*			cis	-178	152.4	-33.1	59.1	0	0	0	0	112.1
61	S	34	Very low	34.5	Very low	102 Å²	102	122 Å²	122	71%	0.713	74%	0.743	S	S	*	*			trans	50.2	120.4	149.5	61.4	0	0	0	0	122.8
62	S	31.4	Very low	34.4	Very low	130 Å²	130	127.5 Å²	127.5	91%	0.909	76%	0.755	S	S	*	*			trans	-174.8	170.5	130.1	-81.7	0	0	0	0	111.5
63	S	35.1	Very low	34.1	Very low	109 Å²	109	122.6 Å²	122.6	76%	0.762	75%	0.753	S	S	*	*			trans	-140.2	157.5	-157.7	59.3	0	0	0	0	117
64	S	33.6	Very low	33.7	Very low	99 Å²	99	125 Å²	125	69%	0.692	76%	0.759	S	S	*	*			trans	97.6	143.5	150.3	-52.8	0	0	0	0	120.4
65	N	29.4	Very low	33.5	Very low	148 Å²	148	125.7 Å²	125.7	79%	0.791	76%	0.762	S	S	*	*			trans	81.7	108.1	154.8	-60.3	-14.3	0	0	0	121.5
66	S	28.8	Very low	33.5	Very low	103 Å²	103	118.5 Å²	118.5	72%	0.72	75%	0.748	S	S	*	*				42.2	111.3	120.4	-51.2	0	0	0	0	121.9
67	S	29.7	Very low	33.3	Very low	111 Å²	111	122.6 Å²	122.6	78%	0.776	75%	0.749	S	S	*	*				71.5	147.5	126.8	-54.1	0	0	0	0	121.6
68	S	28.9	Very low	32.6	Very low	116 Å²	116	124.5 Å²	124.5	81%	0.811	75%	0.745	S	S	*	*			trans	103.8	100.3	155.8	-42.3	0	0	0	0	117.1
69	S	32.9	Very low	32.5	Very low	112 Å²	112	126.3 Å²	126.3	78%	0.783	74%	0.742	S	S	*	*			trans	-38.7	144.6	155.7	53.3	0	0	0	0	116
70	S	30.2	Very low	32.7	Very low	105 Å²	105	127.9 Å²	127.9	73%	0.734	74%	0.738	S	S	*	*			trans	-161.5	116.8	139.4	-93.7	0	0	0	0	115.5
71	N	30.3	Very low	32.6	Very low	121 Å²	121	132.3 Å²	132.3	65%	0.647	75%	0.745	S	S	*	*				58.6	116.7	130	-74.9	-57.6	0	0	0	122.6
72	R	33	Very low	32.5	Very low	222 Å²	222	132.7 Å²	132.7	84%	0.838	75%	0.748	S	S	*	*				86.3	171.2	120.2	-69.8	174.3	-179.7	-143.1	-6.6	120
73	S	32.5	Very low	32.4	Very low	108 Å²	108	131 Å²	131	76%	0.755	74%	0.736	S	S	*	*			trans	76.2	133.2	177.4	3.1	0	0	0	0	115.4
74	D	32.3	Very low	32.2	Very low	136 Å²	136	131 Å²	131	73%	0.727	74%	0.736	S	S	*	*			cis	-164.4	160.5	-15.8	-127.3	-25.1	0	0	0	113.9
75	L	33.8	Very low	32	Very low	147 Å²	147	131 Å²	131	77%	0.77	74%	0.736	S	S	*	*			trans	55.7	152.1	149.6	-62.6	172.4	0	0	0	121.4
76	S	35	Very low	32	Very low	83 Å²	83	129.5 Å²	129.5	58%	0.58	74%	0.737	S	S	*	*			cis	-176.9	172	-24.3	-160.4	0	0	0	0	110.7
77	K	37.2	Very low	32.1	Very low	173 Å²	173	130.6 Å²	130.6	75%	0.752	75%	0.745	S	S	*	*			trans	72.9	143.5	162	-59.6	149.9	-172.3	169.6	0	115.4
78	K	35.9	Very low	32.2	Very low	161 Å²	161	129 Å²	129	70%	0.7	75%	0.746	S	S	*	*			cis	-158.9	143.7	-6	-120.7	172.2	179.3	-179	0	111.1
79	Q	36	Very low	32.2	Very low	142 Å²	142	129.6 Å²	129.6	66%	0.664	75%	0.75	S	S	*	*				38.5	139	125.6	-71	-178.7	-2.8	0	0	120.1
80	K	32.2	Very low	32.2	Very low	162 Å²	162	127.8 Å²	127.8	70%	0.704	75%	0.749	S	S	*	*			cis	-149	150.9	22.5	-107.3	142.4	-177.6	-173.7	0	109.4
81	K	33.2	Very low	32.1	Very low	188 Å²	188	128.8 Å²	128.8	82%	0.817	76%	0.756	S	S	*	*				46.5	138.1	94	-53.1	-166.5	177.7	-167.5	0	113.8
82	S	30.5	Very low	32	Very low	110 Å²	110	125.9 Å²	125.9	77%	0.769	76%	0.755	S	S	*	*			cis	-176.5	169.9	12.5	23.6	0	0	0	0	107.9
83	S	30.9	Very low	31.8	Very low	95 Å²	95	121.8 Å²	121.8	66%	0.664	76%	0.76	S	S	*	*			cis	-175.9	167.8	-11.1	48.4	0	0	0	0	108.5
84	S	28.9	Very low	31.5	Very low	108 Å²	108	119.6 Å²	119.6	76%	0.755	75%	0.754	S	S	*	*			trans	59.6	153.5	155.7	44.9	0	0	0	0	118.1
85	S	29.9	Very low	31.2	Very low	99 Å²	99	119 Å²	119	69%	0.692	76%	0.761	S	S	*	*			cis	-157.8	141.3	-0.7	30.1	0	0	0	0	106.4
86	S	29.8	Very low	30.9	Very low	117 Å²	117	116.6 Å²	116.6	82%	0.818	76%	0.756	S	S	*	*			cis	79.9	70.8	43.7	82.9	0	0	0	0	115.5
87	S	31.6	Very low	30.5	Very low	126 Å²	126	117.9 Å²	117.9	88%	0.881	77%	0.766	S	S	*	*			trans	-163.8	123.3	159.5	53.9	0	0	0	0	109.7
88	G	31	Very low	30	Very low	78 Å²	78	114.7 Å²	114.7	80%	0.804	77%	0.765	S	S	*	*			cis	114.7	57.5	-6.3	0	0	0	0	0	115.3
89	S	30.1	Very low	29.7	Very low	128 Å²	128	112.4 Å²	112.4	90%	0.895	77%	0.769	S	S	*	*			trans	-155.5	135.9	163.6	-72	0	0	0	0	108.7
90	G	31.4	Very low	29.3	Very low	74 Å²	74	109.2 Å²	109.2	76%	0.763	77%	0.774	S	S	*	*			cis	114.6	57.4	-12.3	0	0	0	0	0	116.4
91	S	29.4	Very low	29.2	Very low	127 Å²	127	107.4 Å²	107.4	89%	0.888	78%	0.782	S	S	*	*			trans	-168.7	150.7	160.2	-84	0	0	0	0	108.8
92	G	28.5	Very low	28.9	Very low	59 Å²	59	103.8 Å²	103.8	61%	0.608	78%	0.78	S	S	*	*			cis	132.7	114.4	-7.6	0	0	0	0	0	113.2
93	S	27.6	Very low	28.8	Very low	137 Å²	137	103.5 Å²	103.5	96%	0.958	78%	0.778	S	S	*	*			trans	59	155.7	176.8	40.1	0	0	0	0	117.2
94	G	26.5	Very low	28.7	Very low	61 Å²	61	108.2 Å²	108.2	63%	0.629	79%	0.79	S	S	*	*			cis	140.5	138.4	-10.2	0	0	0	0	0	113.5
95	S	26.1	Very low	28.6	Very low	124 Å²	124	110.7 Å²	110.7	87%	0.867	80%	0.795	S	S	*	*			trans	65.6	161.8	179.1	9.3	0	0	0	0	114.8
96	S	26.9	Very low	28.7	Very low	96 Å²	96	115.2 Å²	115.2	67%	0.671	81%	0.805	S	S	*	*			cis	-169.7	168.1	-12.1	44.9	0	0	0	0	109.4
97	S	26.1	Very low	28.7	Very low	111 Å²	111	112.7 Å²	112.7	78%	0.776	80%	0.797	S	S	*	*			trans	61.7	159.3	163.7	33.4	0	0	0	0	115.9
98	S	26.7	Very low	28.6	Very low	106 Å²	106	114.5 Å²	114.5	74%	0.741	80%	0.797	S	S	*	*			cis	-161.3	-163.5	-20.2	55.6	0	0	0	0	105.8
99	S	29.8	Very low	28.4	Very low	112 Å²	112	119.6 Å²	119.6	78%	0.783	80%	0.8	S	S	*	*			cis	-167	151.2	1.7	13.6	0	0	0	0	107.2
100	G	27.8	Very low	28.4	Very low	75 Å²	75	121.6 Å²	121.6	77%	0.773	80%	0.795	S	S	*	*			trans	177.4	110.6	173.4	0	0	0	0	0	113.7
101	S	29.6	Very low	29.1	Very low	125 Å²	125	122.6 Å²	122.6	87%	0.874	79%	0.788	S	S	*	*			trans	-149.5	132.1	176.8	-56.3	0	0	0	0	110.3
102	S	27.3	Very low	29	Very low	111 Å²	111	123.6 Å²	123.6	78%	0.776	78%	0.779	S	S	*	*			trans	-157.9	128.5	156.1	-141	0	0	0	0	104.6
103	S	29.2	Very low	28.9	Very low	104 Å²	104	128.6 Å²	128.6	73%	0.727	79%	0.787	S	S	*	*			cis	72.5	103.1	22.1	87.1	0	0	0	0	114.9
104	E	29.6	Very low	28.9	Very low	195 Å²	195	130.9 Å²	130.9	91%	0.911	78%	0.782	S	S	*	*			trans	-134.1	117	159.6	-65.5	-178.2	151.3	0	0	105.9
105	D	26.7	Very low	29.1	Very low	159 Å²	159	132.8 Å²	132.8	85%	0.85	78%	0.781	S	S	*	*			trans	169.2	116.6	141.6	-164.7	-131.7	0	0	0	107.4
106	E	31.4	Very low	29.4	Very low	194 Å²	194	134.3 Å²	134.3	91%	0.907	78%	0.775	S	S	*	*			trans	-138.1	123.4	179.8	-84.8	-77.7	164.1	0	0	107.5
107	G	30.3	Very low	29.6	Very low	64 Å²	64	139.6 Å²	139.6	66%	0.66	78%	0.78	S	S	*	*			trans	-128.3	103.9	-170.9	0	0	0	0	0	113.2
108	D	28.2	Very low	29.8	Very low	165 Å²	165	141.8 Å²	141.8	88%	0.882	78%	0.782	S	S	*	*			trans	54.4	131.8	158.3	-62.6	-37.5	0	0	0	121.7
109	Q	27.2	Very low	29.9	Very low	184 Å²	184	141.6 Å²	141.6	86%	0.86	78%	0.781	S	S	*	*			trans	-153.9	157	153.4	-115.2	177.1	112.5	0	0	110.2
110	E	29.4	Very low	29.9	Very low	170 Å²	170	144 Å²	144	79%	0.794	78%	0.78	S	S	*	*			trans	73.9	154	166.3	-71.3	-71.7	86.7	0	0	117.7
111	P	47.5	Very low	30.1	Very low	95 Å²	95	147.1 Å²	147.1	62%	0.617	77%	0.774	S	S	*	*			trans	-137	-162.8	-131.7	38.7	-17.2	0	0	0	114.5
112	E	26.8	Very low	30.3	Very low	149 Å²	149	147.3 Å²	147.3	70%	0.696	76%	0.761	S	S	*	*			trans	146.8	117	136.8	-74.9	-104.1	82	0	0	114.4
113	Q	26.5	Very low	30.5	Very low	164 Å²	164	151.4 Å²	151.4	77%	0.766	76%	0.76	S	S	*	*			trans	66	165.4	137.1	-59.8	-169.6	46.4	0	0	123.7
114	E	28.3	Very low	30.5	Very low	184 Å²	184	152.2 Å²	152.2	86%	0.86	75%	0.752	S	S	*	*			trans	72	140.4	165.2	-134	168.5	-162.6	0	0	119.8
115	V	29.1	Very low	30.6	Very low	101 Å²	101	149.7 Å²	149.7	61%	0.612	74%	0.74	S	S	*	*				-173.4	135.7	-59.1	136.9	0	0	0	0	108.9
116	Q	32.3	Very low	30.9	Very low	157 Å²	157	149.5 Å²	149.5	73%	0.734	73%	0.734	S	S	*	*			trans	65.3	156.3	163.6	-73.9	177.5	83.8	0	0	118
117	R	31.6	Very low	30.9	Very low	207 Å²	207	147.2 Å²	147.2	78%	0.781	72%	0.723	S	S	*	*			cis	-165.5	179.8	-19.9	-119.5	174.9	-166.3	-137.7	3.6	110.4
118	L	29.9	Very low	30.7	Very low	156 Å²	156	152.4 Å²	152.4	82%	0.817	73%	0.73	S	S	*	*			trans	93.8	138.3	160.5	-52.8	-179.4	0	0	0	117.1
119	S	29.7	Very low	30.4	Very low	102 Å²	102	149.3 Å²	149.3	71%	0.713	72%	0.722	S	S	*	*			cis	177.7	134.7	-49	43.8	0	0	0	0	110.5
120	E	30.1	Very low	31.3	Very low	163 Å²	163	145.5 Å²	145.5	76%	0.762	71%	0.712	S	S	*	*			trans	-151.9	123.8	144.9	-155	160.6	173	0	0	113.8
121	Q	31.2	Very low	31.3	Very low	140 Å²	140	144.4 Å²	144.4	65%	0.654	71%	0.711	S	S	*	*			trans	46.3	140	154	-62.6	-172.1	67.6	0	0	121.4
122	Q	33.1	Very low	30.5	Very low	130 Å²	130	146.2 Å²	146.2	61%	0.607	72%	0.715	S	S	*	*			cis	-158.7	146.7	5.5	-130.1	-169.8	69.8	0	0	112.5
123	R	32	Very low	30.5	Very low	197 Å²	197	146.6 Å²	146.6	74%	0.743	72%	0.717	S	S	*	*			trans	65	142.8	157.3	-67.2	179.8	-178	-102.7	1.8	118.7
124	E	30.5	Very low	31	Very low	120 Å²	120	148.5 Å²	148.5	56%	0.561	72%	0.717	S	S	*	*			cis	-159.4	163.2	-4.5	-130.9	175.9	95.1	0	0	114.3
125	Q	31.6	Very low	31.2	Very low	142 Å²	142	147.9 Å²	147.9	66%	0.664	71%	0.714	S	S	*	*			trans	66.9	105.8	160.3	-62.8	179.3	41.2	0	0	118.5
126	Q	32.8	Very low	31.5	Very low	155 Å²	155	147.2 Å²	147.2	72%	0.724	71%	0.714	S	S	*	*				78.8	132.8	87.4	-74.3	-169.4	57.7	0	0	114.1
127	Q	30.2	Very low	31.4	Very low	146 Å²	146	148.3 Å²	148.3	68%	0.682	72%	0.719	S	S	*	*			cis	-158	146.7	-2.9	-104	-172.7	67.9	0	0	112
128	H	27.1	Very low	31.6	Very low	174 Å²	174	143 Å²	143	81%	0.806	71%	0.714	S	S	*	*			trans	63	160.6	151.9	-81.4	-95.8	0	0	0	123.4
129	S	21	Very low	31.9	Very low	100 Å²	100	140.4 Å²	140.4	70%	0.699	72%	0.715	S	S	*	*			trans	-150.7	-157.2	-169.4	60	0	0	0	0	107.9
130	P	46.3	Very low	32.2	Very low	103 Å²	103	140.6 Å²	140.6	67%	0.669	72%	0.722	S	S	*	*			cis	-141.4	-157.8	-8.8	27.2	0.2	0	0	0	115
131	I	30.3	Very low	32.1	Very low	147 Å²	147	136.5 Å²	136.5	75%	0.754	72%	0.724	S	S	*	*			trans	94.2	143.4	151.4	-36.4	-178.5	0	0	0	119.8
132	N	30.4	Very low	32.3	Very low	134 Å²	134	136.5 Å²	136.5	72%	0.717	73%	0.734	S	S	*	*			trans	-72.2	174	176.2	-41	-40.7	0	0	0	114.5
133	E	26.3	Very low	33.3	Very low	156 Å²	156	135.5 Å²	135.5	73%	0.729	74%	0.739	S	S	*	*				-170.6	-177.5	108.3	-98.3	-48.2	131.9	0	0	112.2
134	R	38.1	Very low	33.4	Very low	204 Å²	204	131.6 Å²	131.6	77%	0.77	74%	0.737	S	S	*	*			trans	-103.2	-178.7	-164	-56.6	168.5	168.5	-174.2	-2	116.3
135	E	31.1	Very low	33.7	Very low	172 Å²	172	133.1 Å²	133.1	80%	0.804	75%	0.748	S	S	*	*			trans	70.8	160.9	154.9	-71.9	170.6	162.3	0	0	118
136	S	35.8	Very low	33.9	Very low	87 Å²	87	130.5 Å²	130.5	61%	0.608	75%	0.751	S	S	*	*			cis	-168.6	178	-34.4	60.7	0	0	0	0	109.8
137	E	31.1	Very low	33.8	Very low	179 Å²	179	130.3 Å²	130.3	84%	0.836	76%	0.755	S	S	*	*			trans	65	169.2	162.3	-65.3	-178.4	-175	0	0	119.2
138	S	35	Very low	34.1	Very low	97 Å²	97	131.4 Å²	131.4	68%	0.678	76%	0.76	S	S	*	*			cis	-163.3	167.3	-43.8	67.1	0	0	0	0	112
139	A	36.5	Very low	35.1	Very low	100 Å²	100	129 Å²	129	83%	0.826	76%	0.76	S	S	*	*			trans	64.2	161.4	159.6	0	0	0	0	0	120.5
140	A	35.1	Very low	35.4	Very low	106 Å²	106	127.1 Å²	127.1	88%	0.876	76%	0.756	S	S	*	*			cis	-169.1	162.4	-30.7	0	0	0	0	0	110.9
141	G	29.5	Very low	34.5	Very low	78 Å²	78	128.1 Å²	128.1	80%	0.804	77%	0.766	S	S	*	*			trans	162.9	131.5	167.3	0	0	0	0	0	116.6
142	T	33.6	Very low	35.9	Very low	139 Å²	139	126.6 Å²	126.6	85%	0.853	77%	0.766	S	S	*	*			trans	-137.3	176.9	-176.7	-0.2	0	0	0	0	110.5
143	P	54.3	Low	35.8	Very low	109 Å²	109	127.9 Å²	127.9	71%	0.708	77%	0.772	S	S	*	*			cis	-126.7	-156.6	36.8	29.8	-3.3	0	0	0	112.5
144	V	35.1	Very low	36.1	Very low	116 Å²	116	123.7 Å²	123.7	70%	0.703	77%	0.765	S	S	*	*			cis	-155.3	164.1	18.8	-132.8	0	0	0	0	113
145	N	35.7	Very low	35.8	Very low	151 Å²	151	123.6 Å²	123.6	81%	0.807	77%	0.77	S	S	*	*			trans	9.3	131.5	149.1	-59.7	-13.8	0	0	0	119.5
146	A	36.4	Very low	35.8	Very low	87 Å²	87	121.1 Å²	121.1	72%	0.719	77%	0.772	S	S	*	*			cis	-162.8	-170	0.6	0	0	0	0	0	109
147	D	30.5	Very low	35.9	Very low	152 Å²	152	125.8 Å²	125.8	81%	0.813	78%	0.784	S	S	*	*			cis	-155.2	-164.5	8.8	-144.4	-44.2	0	0	0	111.6
148	Q	37.5	Very low	36.8	Very low	168 Å²	168	122 Å²	122	79%	0.785	78%	0.775	S	S	*	*			trans	-142	-174	-162.1	-70.6	-155.3	69.5	0	0	114
149	P	46.8	Very low	36.8	Very low	124 Å²	124	122.3 Å²	122.3	81%	0.805	78%	0.777	S	S	*	*			cis	-126.3	-172.8	-3.9	42.9	-27.1	0	0	0	114.1
150	G	28.7	Very low	36.8	Very low	60 Å²	60	121.1 Å²	121.1	62%	0.619	76%	0.762	S	S	*	*			cis	150.5	96.7	-13.2	0	0	0	0	0	116.3
151	S	27	Very low	36.5	Very low	124 Å²	124	124.6 Å²	124.6	87%	0.867	76%	0.758	S	S	*	*			trans	69.5	-161.5	154	-52.8	0	0	0	0	118.9
152	P	58.7	Low	36.8	Very low	116 Å²	116	128 Å²	128	75%	0.753	76%	0.757	S	S	*	*				-139.4	172.9	-97.1	45.2	-28	0	0	0	118.7
153	N	30	Very low	36.7	Very low	160 Å²	160	125.7 Å²	125.7	86%	0.856	75%	0.747	S	S	*	*			trans	55.4	145.5	143.8	-157.2	9.5	0	0	0	123.2
154	A	32.1	Very low	35.5	Very low	69 Å²	69	125.8 Å²	125.8	57%	0.57	75%	0.75	S	S	*	*			trans	101.6	121.6	143.4	0	0	0	0	0	122.8
155	K	30.9	Very low	35.3	Very low	201 Å²	201	126.2 Å²	126.2	87%	0.874	75%	0.752	S	S	*	*			trans	54.6	119.9	135.5	-60.7	172	-177.2	175.2	0	121.2
156	S	31.6	Very low	34.9	Very low	121 Å²	121	129.8 Å²	129.8	85%	0.846	76%	0.755	S	S	*	*				-174.1	151	110.1	38	0	0	0	0	113.9
157	Q	37.1	Very low	34.6	Very low	185 Å²	185	130.9 Å²	130.9	86%	0.864	76%	0.757	S	S	*	*			trans	-110.9	-169.7	161.7	-75	-156.2	-9.1	0	0	106.9
158	P	51.2	Low	34.7	Very low	100 Å²	100	135.9 Å²	135.9	65%	0.649	77%	0.765	S	S	*	*			cis	-144.9	-170.5	6.1	42.7	-21.6	0	0	0	117.3
159	S	35	Very low	34.3	Very low	103 Å²	103	133.1 Å²	133.1	72%	0.72	76%	0.764	S	S	*	*			trans	81.2	145.3	139.3	72.9	0	0	0	0	119.7
160	S	35.3	Very low	33.4	Very low	74 Å²	74	134.1 Å²	134.1	52%	0.517	77%	0.768	S	S	.	*			cis	-179.4	171.7	-15.8	48.7	0	0	0	0	112.6
161	F	30.5	Very low	33.4	Very low	180 Å²	180	136.4 Å²	136.4	79%	0.789	77%	0.774	S	S	*	*			trans	75.8	153.2	152.4	-57.2	-31.4	0	0	0	119
162	L	34.8	Very low	34.7	Very low	148 Å²	148	135.4 Å²	135.4	78%	0.775	77%	0.765	S	S	*	*			cis	-169.5	165.4	-19.4	-93	172.1	0	0	0	105.8
163	S	31.9	Very low	33.5	Very low	92 Å²	92	138.7 Å²	138.7	64%	0.643	77%	0.77	S	S	*	*			cis	-177.8	172.2	-31.4	62.6	0	0	0	0	110.5
164	S	28.6	Very low	33.5	Very low	110 Å²	110	138.5 Å²	138.5	77%	0.769	77%	0.768	S	S	*	*			trans	72.2	160.8	166.9	-133.5	0	0	0	0	114.9
165	V	30.6	Very low	33.2	Very low	125 Å²	125	144 Å²	144	76%	0.758	78%	0.775	S	S	*	*			cis	-142.4	131.9	20.8	-175.9	0	0	0	0	113.8
166	R	28	Very low	33.5	Very low	226 Å²	226	140 Å²	140	85%	0.853	76%	0.764	S	S	*	*			trans	21	120.9	140.5	-134.8	160.4	-175.9	145.7	-3.2	122.5
167	S	29.5	Very low	33.5	Very low	111 Å²	111	143 Å²	143	78%	0.776	76%	0.764	S	S	*	*			trans	51.8	128	133.3	-53.1	0	0	0	0	123.5
168	R	32.5	Very low	33.6	Very low	256 Å²	256	138 Å²	138	97%	0.966	76%	0.755	S	S	*	*			trans	-145	157.1	141.3	-104.8	-170.8	168.9	-179.3	-5	111.9
169	S	29.1	Very low	33	Very low	110 Å²	110	138 Å²	138	77%	0.769	76%	0.763	S	S	*	*			trans	-127.1	168.7	-176.4	52.7	0	0	0	0	111.2
170	V	29.3	Very low	33.4	Very low	146 Å²	146	138.9 Å²	138.9	89%	0.885	76%	0.764	S	S	*	*			trans	169	151.3	139.4	150.3	0	0	0	0	111.3
171	S	27.8	Very low	33.6	Very low	107 Å²	107	141 Å²	141	75%	0.748	77%	0.77	S	S	*	*			trans	-153.7	177.1	173.5	-163.7	0	0	0	0	106.3
172	P	54.1	Low	34.3	Very low	104 Å²	104	140.2 Å²	140.2	68%	0.675	77%	0.773	S	S	*	*			cis	-125.1	-171.4	-15.8	42.5	-27.5	0	0	0	112.3
173	Q	32.6	Very low	34.6	Very low	184 Å²	184	140 Å²	140	86%	0.86	77%	0.772	S	S	*	*			trans	167.1	135.7	137.7	-92.8	166.2	-18.1	0	0	108.6
174	L	30.5	Very low	35.2	Very low	156 Å²	156	142.8 Å²	142.8	82%	0.817	78%	0.778	S	S	*	*			cis	79.7	130.2	42.2	-97.2	175.2	0	0	0	116.7
175	Y	26.6	Very low	35.9	Very low	184 Å²	184	141.4 Å²	141.4	72%	0.722	77%	0.769	S	S	*	*			trans	85.8	98.2	157.1	-129	-99.4	0	0	0	121.1
176	N	37	Very low	36.6	Very low	119 Å²	119	144 Å²	144	64%	0.636	77%	0.772	S	S	*	*				21.2	118.6	125.6	-48.2	-15.9	0	0	0	118.3
177	Q	31.4	Very low	37.6	Very low	183 Å²	183	138.7 Å²	138.7	86%	0.855	76%	0.761	S	S	*	*			trans	-150.9	139	151.2	-147.4	100.1	124.5	0	0	110.6
178	A	38.9	Very low	38.7	Very low	80 Å²	80	140.6 Å²	140.6	66%	0.661	76%	0.762	S	S	*	*			trans	54.4	70.6	164.1	0	0	0	0	0	117.1	V180	A178-V180 HydrophobicContact CB-CG2 4.39Å
179	A	38.3	Very low	39.5	Very low	100 Å²	100	135.9 Å²	135.9	83%	0.826	76%	0.755	S	S	*	*				-68.3	137.8	125.1	0	0	0	0	0	107.4
180	V	43.2	Very low	40.3	Very low	122 Å²	122	135 Å²	135	74%	0.739	75%	0.749	S	S	*	*			trans	-148	94	169.9	-99.3	0	0	0	0	108	A178	A178-V180 HydrophobicContact CB-CG2 4.39Å
181	D	40.1	Very low	41.2	Very low	119 Å²	119	135.7 Å²	135.7	64%	0.636	75%	0.748	S	S	*	*			trans	29.1	107.3	148.2	-46.4	-14.5	0	0	0	117.9
182	L	46.3	Very low	42.1	Very low	163 Å²	163	136.6 Å²	136.6	85%	0.853	75%	0.749	S	S	*	*			trans	-110.8	77.9	135.2	-72.6	178.9	0	0	0	107.6	I184	L182-I184 PolarHBondContact O-N 3.33Å
183	N	40	Very low	41.6	Very low	144 Å²	144	136.8 Å²	136.8	77%	0.77	75%	0.752	S	S	*	*			trans	-64.8	99.1	166.6	-78.3	-14.3	0	0	0	108.4
184	I	45.1	Very low	42.1	Very low	149 Å²	149	136 Å²	136	76%	0.764	75%	0.754	S	S	*	*			trans	-108.4	105.2	166.4	-60.8	172.9	0	0	0	104	L182	L182-I184 PolarHBondContact O-N 3.33Å
185	S	42.5	Very low	42.7	Very low	82 Å²	82	136.3 Å²	136.3	57%	0.573	76%	0.755	S	S	*	*			trans	-78.4	171.5	-170.6	66.2	0	0	0	0	112.6	D187	S185-D187 WeakPolarHBondContact CB-OD2 3.25Å; S185-D187 PolarHBondContact O-N 3.36Å; S185-D187 PolarHBondContact OG-OD2 3.49Å
186	H	45	Very low	43.4	Very low	178 Å²	178	137.2 Å²	137.2	82%	0.824	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	1.1	-171.6	-172.2	-95.5	0	0	0	113.5
187	D	49	Very low	43.3	Very low	116 Å²	116	135.5 Å²	135.5	62%	0.62	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-23	-166.8	-49.4	-84.8	0	0	0	114.2	S185 L189 S190	S185-D187 WeakPolarHBondContact CB-OD2 3.25Å; S185-D187 PolarHBondContact O-N 3.36Å; S185-D187 PolarHBondContact OG-OD2 3.49Å; D187-L189 VanDerWaalsContact C-N 3.28Å; D187-L189 PolarHBondContact O-N 2.97Å; D187-S190 PolarHBondContact O-OG 3.25Å
188	D	53	Low	43.4	Very low	151 Å²	151	134 Å²	134	81%	0.807	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	23.5	-168.4	-152.9	32.4	0	0	0	113.8
189	L	49.4	Very low	43.1	Very low	156 Å²	156	136.8 Å²	136.8	82%	0.817	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.9	3	-175.4	-70.2	178.2	0	0	0	115.2	D187	D187-L189 VanDerWaalsContact C-N 3.28Å; D187-L189 PolarHBondContact O-N 2.97Å
190	S	45.9	Very low	43.2	Very low	92 Å²	92	137.2 Å²	137.2	64%	0.643	75%	0.752	S	S	*	*	S	Bend	trans	-94.5	-24.9	-176.4	54	0	0	0	0	114.7	D187 V192	D187-S190 PolarHBondContact O-OG 3.25Å; S190-V192 VanDerWaalsContact C-N 3.33Å; S190-V192 PolarHBondContact O-N 3.18Å
191	D	48	Very low	42.7	Very low	161 Å²	161	139.1 Å²	139.1	86%	0.861	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	56.4	-168.4	-164.5	26.2	0	0	0	114
192	V	47.6	Very low	42.3	Very low	125 Å²	125	139.6 Å²	139.6	76%	0.758	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.1	4.7	178.4	-115.9	0	0	0	0	115.4	S190	S190-V192 VanDerWaalsContact C-N 3.33Å; S190-V192 PolarHBondContact O-N 3.18Å
193	S	43.5	Very low	41.5	Very low	108 Å²	108	137.1 Å²	137.1	76%	0.755	75%	0.75	S	S	*	*	S	Bend	trans	-117.2	4	-165.4	-59.2	0	0	0	0	116.3
194	D	42.8	Very low	41.1	Very low	167 Å²	167	135.8 Å²	135.8	89%	0.893	75%	0.752	S	S	*	*			trans	-131	70.4	-175.1	-102.6	-46.4	0	0	0	113.2
195	I	43.9	Very low	40.6	Very low	164 Å²	164	137.4 Å²	137.4	84%	0.841	75%	0.753	S	S	*	*			trans	-143.4	47.6	171.5	-161.5	160.9	0	0	0	115.3
196	E	40.2	Very low	40	Very low	202 Å²	202	140.6 Å²	140.6	94%	0.944	76%	0.764	S	S	*	*	S	Bend	trans	-158.3	122.9	155.7	-120	169	-158.3	0	0	111.8
197	G	36.1	Very low	39.3	Very low	83 Å²	83	137 Å²	137	86%	0.856	76%	0.758	S	S	*	*			trans	137.2	3.1	157.2	0	0	0	0	0	123
198	E	32.7	Very low	38.3	Very low	152 Å²	152	139.4 Å²	139.4	71%	0.71	77%	0.768	S	S	*	*			trans	-105.7	72.6	-168.9	-147.9	-153.5	-128	0	0	118.3	K200	E198-K200 PolarHBondContact O-NZ 3.48Å; E198-K200 WeakPolarHBondContact OE2-CE 3.39Å; E198-K200 IonicContact OE2-NZ 2.61Å; E198-K200 PolarHBondContact OE2-NZ 2.93Å
199	E	33.2	Very low	37.3	Very low	138 Å²	138	140.1 Å²	140.1	65%	0.645	76%	0.759	S	S	*	*			trans	-134.2	96	155.4	-76.9	-130.1	103.9	0	0	111.1	R977	E199-R977 IonicContact OE1-CZ 3.93Å; E199-R977 IonicContact OE1-NE 2.7Å; E199-R977 PolarHBondContact OE1-NE 3.32Å; E199-R977 IonicContact OE1-NH2 3.15Å; E199-R977 PolarHBondContact OE1-NH2 3.43Å
200	K	38.8	Very low	37	Very low	109 Å²	109	138.7 Å²	138.7	47%	0.474	76%	0.76	S	S	.	*				84.4	102.6	63.7	-74.3	-176.1	-171.6	79.9	0	116.7	E198 R977	E198-K200 PolarHBondContact O-NZ 3.48Å; E198-K200 WeakPolarHBondContact OE2-CE 3.39Å; E198-K200 IonicContact OE2-NZ 2.61Å; E198-K200 PolarHBondContact OE2-NZ 2.93Å; K200-R977 PolarHBondContact O-NH2 3.29Å
201	R	34.4	Very low	36.5	Very low	162 Å²	162	136.5 Å²	136.5	61%	0.611	75%	0.747	S	S	*	*				173.9	132.5	123.7	-87.7	152.2	-163.1	-98	11.3	108.6	L981	R201-L981 VanDerWaalsContact NH2-CD1 3.33Å
202	T	30.1	Very low	35.9	Very low	129 Å²	129	134.7 Å²	134.7	79%	0.791	74%	0.737	S	S	*	*			cis	80.5	128.6	32.4	74.3	0	0	0	0	115.7
203	S	29.8	Very low	35.4	Very low	112 Å²	112	136.6 Å²	136.6	78%	0.783	74%	0.738	S	S	*	*			trans	-110.9	168.9	-158.5	-43.3	0	0	0	0	116.7
204	S	32.9	Very low	35	Very low	116 Å²	116	137.6 Å²	137.6	81%	0.811	73%	0.734	S	S	*	*			trans	71.6	141.5	155.7	-51.9	0	0	0	0	117.9
205	K	34.3	Very low	34.8	Very low	183 Å²	183	137.5 Å²	137.5	80%	0.796	73%	0.729	S	S	*	*				-175.6	157.4	53.9	178.2	158.5	-176.8	168.4	0	113.9
206	N	29	Very low	34.6	Very low	149 Å²	149	137.3 Å²	137.3	80%	0.797	73%	0.729	S	S	*	*			trans	82.2	160	161.6	-82.9	23.2	0	0	0	122.2
207	S	31.7	Very low	34.3	Very low	102 Å²	102	131.1 Å²	131.1	71%	0.713	72%	0.72	S	S	*	*			trans	-158.3	164.7	-158.4	167	0	0	0	0	111.6
208	M	26.9	Very low	34.2	Very low	167 Å²	167	131.9 Å²	131.9	82%	0.823	72%	0.718	S	S	*	*			trans	-156.2	129.7	159.2	-98.6	-54.7	106.8	0	0	115
209	R	33.1	Very low	34.2	Very low	166 Å²	166	131.9 Å²	131.9	63%	0.626	72%	0.722	S	S	*	*			trans	-0.3	175.7	150.8	-83.8	-172.7	165.3	-140	-7.7	122.5	A211 D212	R209-A211 PolarHBondContact NH1-O 3.46Å; R209-A211 PolarHBondContact NH2-O 3.35Å; R209-D212 PolarHBondContact NH1-O 3.19Å; R209-D212 PolarHBondContact NH2-O 2.92Å
210	P	41.7	Very low	34.1	Very low	126 Å²	126	129.5 Å²	129.5	82%	0.818	72%	0.72	S	S	*	*			cis	-61.6	169	17.1	22.9	-36.2	0	0	0	116.7
211	A	35.9	Very low	33.8	Very low	45 Å²	45	131.7 Å²	131.7	37%	0.372	74%	0.737	S	S	.	*			cis	-159.3	-164.8	-17.8	0	0	0	0	0	106.2	R209	R209-A211 PolarHBondContact NH1-O 3.46Å; R209-A211 PolarHBondContact NH2-O 3.35Å
212	D	35	Very low	33.8	Very low	123 Å²	123	131 Å²	131	66%	0.658	75%	0.745	S	S	*	*			cis	-130.3	-165.8	3	-55	-86.2	0	0	0	107	R209	R209-D212 PolarHBondContact NH1-O 3.19Å; R209-D212 PolarHBondContact NH2-O 2.92Å
213	E	37.8	Very low	34	Very low	165 Å²	165	130 Å²	130	77%	0.771	74%	0.743	S	S	*	*			cis	125	119.1	14.1	-68.3	-153.6	170	0	0	113.2
214	N	35.3	Very low	34.2	Very low	129 Å²	129	132.5 Å²	132.5	69%	0.69	75%	0.747	S	S	*	*			trans	68	148.4	167.1	-45.6	-30.4	0	0	0	119.4
215	E	38.5	Very low	35.1	Very low	165 Å²	165	132 Å²	132	77%	0.771	74%	0.741	S	S	*	*			cis	-160.8	150	-22.2	-114.8	172	170.4	0	0	110.8
216	D	38.8	Very low	34.7	Very low	160 Å²	160	128.5 Å²	128.5	86%	0.856	74%	0.736	S	S	*	*			trans	40.1	146.6	156.3	-66.8	-14.3	0	0	0	127.8
217	G	34.6	Very low	34.9	Very low	73 Å²	73	129.8 Å²	129.8	75%	0.753	74%	0.741	S	S	*	*			trans	89.9	121.1	159.7	0	0	0	0	0	117
218	A	34.6	Very low	34.7	Very low	98 Å²	98	128.1 Å²	128.1	81%	0.81	74%	0.74	S	S	*	*			cis	64.4	120.1	30.8	0	0	0	0	0	112.6
219	I	31.6	Very low	35.1	Very low	153 Å²	153	129.5 Å²	129.5	79%	0.785	74%	0.744	S	S	*	*			cis	-159	161.5	30.5	48.8	174.2	0	0	0	114.7
220	S	30.9	Very low	34.9	Very low	88 Å²	88	130.6 Å²	130.6	62%	0.615	76%	0.757	S	S	*	*			trans	43.8	117.6	146.7	64	0	0	0	0	124.9
221	N	32.7	Very low	34.4	Very low	155 Å²	155	131.7 Å²	131.7	83%	0.829	76%	0.756	S	S	*	*				48.9	138.3	122.4	-53.4	-10.1	0	0	0	124.9
222	D	34.5	Very low	34.3	Very low	147 Å²	147	136.6 Å²	136.6	79%	0.786	77%	0.771	S	S	*	*				110.2	136.4	128.4	-132.1	-32.9	0	0	0	121.1
223	S	35.1	Very low	34.1	Very low	107 Å²	107	136.6 Å²	136.6	75%	0.748	78%	0.775	S	S	*	*			trans	63.6	146.8	153.9	-72.6	0	0	0	0	124.1
224	L	34.3	Very low	33.9	Very low	166 Å²	166	136.6 Å²	136.6	87%	0.869	78%	0.775	S	S	*	*			trans	-93.1	-176.8	165.8	-48.2	166.5	0	0	0	108.9
225	P	50.3	Low	34.1	Very low	104 Å²	104	136.3 Å²	136.3	68%	0.675	77%	0.769	S	S	*	*			cis	-135.7	-158.5	-5.6	39.8	-18.7	0	0	0	113.1
226	T	26.9	Very low	34.2	Very low	111 Å²	111	136.5 Å²	136.5	68%	0.681	77%	0.768	S	S	*	*			trans	56.8	112.5	155.2	49.5	0	0	0	0	119.1
227	L	32.3	Very low	34.1	Very low	176 Å²	176	137.8 Å²	137.8	92%	0.921	77%	0.769	S	S	*	*				66.3	117.9	80.9	-69.3	177.8	0	0	0	115.3
228	G	28.4	Very low	34.2	Very low	66 Å²	66	140 Å²	140	68%	0.68	77%	0.773	S	S	*	*			trans	131.9	99.1	153.5	0	0	0	0	0	118.2
229	E	35.8	Very low	33.9	Very low	196 Å²	196	141.5 Å²	141.5	92%	0.916	77%	0.772	S	S	*	*				50.9	121.2	128.9	-67.7	147.3	-139.2	0	0	123.4
230	E	27.4	Very low	34.7	Very low	189 Å²	189	139.8 Å²	139.8	88%	0.883	77%	0.771	S	S	*	*			trans	-136.6	133.2	142	65.6	-172.1	153.4	0	0	105.9
231	D	31	Very low	34.4	Very low	150 Å²	150	143.5 Å²	143.5	80%	0.802	78%	0.784	S	S	*	*			cis	81.6	156.1	4	-144.8	8.2	0	0	0	119.2
232	E	34	Very low	34.2	Very low	147 Å²	147	139.1 Å²	139.1	69%	0.687	78%	0.775	S	S	*	*			trans	78.4	91.8	165.1	-77.5	-99.2	82.4	0	0	121.1
233	V	30.7	Very low	34	Very low	123 Å²	123	141.9 Å²	141.9	75%	0.745	78%	0.78	S	S	*	*			trans	55.2	148.2	131.3	-63	0	0	0	0	124.4
234	E	34	Very low	33.6	Very low	165 Å²	165	140.9 Å²	140.9	77%	0.771	78%	0.779	S	S	*	*	S	Bend	trans	-117.3	115.8	143	-163.7	-178.1	171.3	0	0	113
235	Q	40.2	Very low	33.4	Very low	123 Å²	123	137.8 Å²	137.8	58%	0.575	77%	0.771	S	S	*	*	S	Bend	trans	58.3	113.2	155.3	-67.8	-170.6	79	0	0	123
236	K	39.6	Very low	32.2	Very low	170 Å²	170	138.3 Å²	138.3	74%	0.739	78%	0.777	S	S	*	*			trans	81.6	90.9	133.5	-67.8	169.6	178.8	152.4	0	120.8
237	Q	36.6	Very low	32.3	Very low	187 Å²	187	136.2 Å²	136.2	87%	0.874	78%	0.778	S	S	*	*			trans	70.7	123.9	132.5	-68.7	-170.5	-19.3	0	0	121.6
238	S	36.4	Very low	32.2	Very low	119 Å²	119	134.9 Å²	134.9	83%	0.832	77%	0.771	S	S	*	*			trans	94.7	133.9	141	73.1	0	0	0	0	120.3
239	T	30.2	Very low	32.3	Very low	129 Å²	129	138 Å²	138	79%	0.791	77%	0.768	S	S	*	*			trans	-79.1	175.6	173.9	53.3	0	0	0	0	110
240	P	46.5	Very low	32.1	Very low	117 Å²	117	136.1 Å²	136.1	76%	0.76	76%	0.757	S	S	*	*			cis	-151.8	-172.4	25.2	40.6	-17.1	0	0	0	119.3
241	N	26.1	Very low	32.2	Very low	166 Å²	166	135 Å²	135	89%	0.888	75%	0.752	S	S	*	*			trans	95.1	125.4	137.8	-159.1	20.5	0	0	0	119.8
242	G	27.1	Very low	32.9	Very low	63 Å²	63	132.9 Å²	132.9	65%	0.649	75%	0.746	S	S	*	*			trans	135.5	90.7	145.7	0	0	0	0	0	121.4
243	K	30.2	Very low	32.3	Very low	205 Å²	205	135.1 Å²	135.1	89%	0.891	75%	0.754	S	S	*	*				68.2	128	119	-172.4	172.2	-179.7	177.3	0	122.8
244	A	28.4	Very low	32.3	Very low	87 Å²	87	132.5 Å²	132.5	72%	0.719	75%	0.745	S	S	*	*			trans	74.4	150.8	153.6	0	0	0	0	0	118.6
245	S	28.4	Very low	32.2	Very low	100 Å²	100	131.8 Å²	131.8	70%	0.699	74%	0.739	S	S	*	*			cis	-173.9	148.1	-18.1	48.9	0	0	0	0	111.4
246	S	26.9	Very low	31.7	Very low	115 Å²	115	132.7 Å²	132.7	80%	0.804	74%	0.744	S	S	*	*			trans	39.9	137	151.3	57.5	0	0	0	0	120.2
247	G	28.8	Very low	31.4	Very low	68 Å²	68	130.5 Å²	130.5	70%	0.701	75%	0.745	S	S	*	*			cis	150.5	170.1	25.8	0	0	0	0	0	106.8
248	D	29.3	Very low	31.2	Very low	148 Å²	148	129.2 Å²	129.2	79%	0.791	74%	0.739	S	S	*	*			cis	-138.5	144.6	3.9	-91.5	-154.3	0	0	0	106.5
249	E	31.6	Very low	30.9	Very low	131 Å²	131	127.8 Å²	127.8	61%	0.612	73%	0.725	S	S	*	*				75.1	104.8	56.9	-68.6	-98.6	91.6	0	0	115.2
250	K	31.5	Very low	31	Very low	157 Å²	157	128.3 Å²	128.3	68%	0.683	72%	0.723	S	S	*	*			trans	68.6	123	136.5	-69.8	162.9	-179.4	144.6	0	121.9
251	E	28.7	Very low	30.3	Very low	166 Å²	166	130.2 Å²	130.2	78%	0.776	73%	0.727	S	S	*	*				36.5	149	104.8	-66.3	-73.4	-174.4	0	0	120.3
252	P	46	Very low	30.8	Very low	104 Å²	104	125.8 Å²	125.8	68%	0.675	71%	0.713	S	S	*	*			cis	-142.8	-177.3	-5.6	42	-23.3	0	0	0	116.8
253	F	22.3	Very low	31.2	Very low	194 Å²	194	127.3 Å²	127.3	85%	0.851	71%	0.714	S	S	*	*			trans	82.9	156.3	139.4	-153.3	-112.8	0	0	0	122.1
254	A	29.1	Very low	31.4	Very low	69 Å²	69	125.4 Å²	125.4	57%	0.57	71%	0.713	S	S	*	*			trans	78.7	99.1	163	0	0	0	0	0	121.8
255	K	32.3	Very low	31.5	Very low	149 Å²	149	125.1 Å²	125.1	65%	0.648	72%	0.719	S	S	*	*				57.6	134.3	114.5	-79.8	178.9	158.3	-74.2	0	122.3
256	E	30.5	Very low	31.5	Very low	142 Å²	142	128.5 Å²	128.5	66%	0.664	73%	0.728	S	S	*	*				46.2	130.6	127.2	-61.8	155.8	-156.2	0	0	119
257	T	32.3	Very low	31.6	Very low	124 Å²	124	127.3 Å²	127.3	76%	0.761	73%	0.725	S	S	*	*			cis	-175.6	172.4	14.6	14.2	0	0	0	0	110.4
258	H	33.7	Very low	32.6	Very low	161 Å²	161	130 Å²	130	75%	0.745	73%	0.731	S	S	*	*			trans	87.2	120.9	144	-125.6	-108.6	0	0	0	122
259	T	29.7	Very low	32.5	Very low	89 Å²	89	128 Å²	128	55%	0.546	73%	0.734	S	S	.	*			trans	64.9	118.2	139.3	50.9	0	0	0	0	125
260	D	31.5	Very low	32.6	Very low	139 Å²	139	128.5 Å²	128.5	74%	0.743	75%	0.747	S	S	*	*				68.4	143.3	113.8	-50.1	-7	0	0	0	124.4
261	D	32.5	Very low	32.8	Very low	158 Å²	158	126 Å²	126	85%	0.845	76%	0.755	S	S	*	*			trans	62.3	134.9	154.5	-99.9	-54.6	0	0	0	119.2
262	A	35.6	Very low	33.2	Very low	72 Å²	72	125.6 Å²	125.6	60%	0.595	76%	0.757	S	S	*	*			cis	-172.4	157.8	25.3	0	0	0	0	0	113.6
263	S	37	Very low	32.7	Very low	96 Å²	96	128 Å²	128	67%	0.671	76%	0.76	S	S	*	*			trans	62.6	108.4	142.9	64.1	0	0	0	0	123.8
264	N	33.9	Very low	33.4	Very low	165 Å²	165	126.9 Å²	126.9	88%	0.882	76%	0.757	S	S	*	*				61	120.4	120.6	-57.3	-20.7	0	0	0	122.5
265	G	29.4	Very low	33.8	Very low	81 Å²	81	129.9 Å²	129.9	84%	0.835	76%	0.764	S	S	*	*			trans	-139.7	121.9	163.3	0	0	0	0	0	112.8
266	L	28.8	Very low	34.2	Very low	171 Å²	171	129.7 Å²	129.7	90%	0.895	77%	0.769	S	S	*	*			trans	-59.8	151.4	-172.4	-91.8	59.1	0	0	0	117
267	A	29.2	Very low	34.6	Very low	89 Å²	89	128.1 Å²	128.1	74%	0.736	77%	0.769	S	S	*	*			trans	-95	-174.1	151.6	0	0	0	0	0	109.9
268	P	50	Low	35	Very low	126 Å²	126	131.2 Å²	131.2	82%	0.818	77%	0.772	S	S	*	*			cis	-128.6	178.2	-9.7	41.6	-26.7	0	0	0	113.8
269	A	27.9	Very low	35.5	Very low	105 Å²	105	128 Å²	128	87%	0.868	76%	0.763	S	S	*	*			trans	-148	145.7	163.8	0	0	0	0	0	112
270	T	33.7	Very low	35.9	Very low	142 Å²	142	131 Å²	131	87%	0.871	77%	0.771	S	S	*	*			trans	-116.1	142.2	-177.7	52.7	0	0	0	0	111.6
271	A	35	Very low	36	Very low	105 Å²	105	130.2 Å²	130.2	87%	0.868	77%	0.767	S	S	*	*			trans	-146.2	153.5	164.3	0	0	0	0	0	110.5
272	L	37.6	Very low	36.4	Very low	156 Å²	156	129 Å²	129	82%	0.817	76%	0.76	S	S	*	*			trans	-132.4	137	-171.9	-96.8	171	0	0	0	111.2
273	Q	34.7	Very low	36.6	Very low	155 Å²	155	133 Å²	133	72%	0.724	77%	0.772	S	S	*	*			trans	69.2	164.2	139.5	-138.7	174.2	-47.2	0	0	119.8
274	E	37.3	Very low	36.8	Very low	170 Å²	170	132.2 Å²	132.2	79%	0.794	77%	0.771	S	S	*	*			trans	72.8	139	164.4	-66.1	172.2	-157.8	0	0	117.1
275	D	36.5	Very low	37.3	Very low	133 Å²	133	132.2 Å²	132.2	71%	0.711	77%	0.77	S	S	*	*			cis	-164.9	179	-10.2	-177.2	29.5	0	0	0	110.4
276	L	40.7	Very low	37.8	Very low	145 Å²	145	133.5 Å²	133.5	76%	0.759	76%	0.757	S	S	*	*			trans	115.6	64.5	145.3	-136.9	74.3	0	0	0	121.7
277	V	40.1	Very low	37.8	Very low	109 Å²	109	134.3 Å²	134.3	66%	0.661	75%	0.754	S	S	*	*				57	123	122.1	-179.5	0	0	0	0	122.5	T279	V277-T279 HydrophobicContact CG1-CG2 4.01Å
278	K	41.4	Very low	38.2	Very low	188 Å²	188	138.1 Å²	138.1	82%	0.817	76%	0.757	S	S	*	*			trans	-158.7	106	150.2	-147.4	69.4	-178.9	-179.5	0	107.5
279	T	42.3	Very low	38	Very low	93 Å²	93	136.3 Å²	136.3	57%	0.571	75%	0.752	S	S	*	*				48.2	131.1	76.5	72.5	0	0	0	0	112.8	V277	V277-T279 HydrophobicContact CG1-CG2 4.01Å
280	H	38	Very low	38.4	Very low	154 Å²	154	139.9 Å²	139.9	71%	0.713	75%	0.751	S	S	*	*			cis	-160.1	127.8	12.9	-171	-79.1	0	0	0	104.4
281	D	35	Very low	38.7	Very low	122 Å²	122	141.7 Å²	141.7	65%	0.652	75%	0.75	S	S	*	*				70.1	134.9	71.6	-60	-50.7	0	0	0	115.4
282	D	39.6	Very low	38.7	Very low	132 Å²	132	140.4 Å²	140.4	71%	0.706	75%	0.746	S	S	*	*			trans	68.5	142	155.2	-55.7	-28	0	0	0	124.6
283	D	39.8	Very low	38.3	Very low	157 Å²	157	142.3 Å²	142.3	84%	0.84	75%	0.751	S	S	*	*			trans	51.5	121.6	159	-60.2	-24.2	0	0	0	119.8
284	A	41.1	Very low	38	Very low	78 Å²	78	140.2 Å²	140.2	65%	0.645	75%	0.752	S	S	*	*				-166.8	137.1	56.3	0	0	0	0	0	115
285	L	45.4	Very low	38.4	Very low	166 Å²	166	136.4 Å²	136.4	87%	0.869	74%	0.742	S	S	*	*			trans	59.6	152.6	130.1	-57.5	177.9	0	0	0	120.8
286	D	38.8	Very low	38.2	Very low	107 Å²	107	137.5 Å²	137.5	57%	0.572	74%	0.743	S	S	*	*			cis	-177.5	135.1	-17.9	178.2	25	0	0	0	108.1
287	F	30.3	Very low	37.7	Very low	189 Å²	189	137.8 Å²	137.8	83%	0.829	74%	0.741	S	S	*	*				-178.4	133.2	121.2	-118.6	-99	0	0	0	114.1
288	E	36.6	Very low	37.1	Very low	169 Å²	169	136.7 Å²	136.7	79%	0.79	74%	0.743	S	S	*	*			trans	-77.5	-164.8	161.6	-49	177.1	129.8	0	0	109
289	A	46.8	Very low	36.6	Very low	87 Å²	87	136.4 Å²	136.4	72%	0.719	74%	0.742	S	S	*	*			cis	-138.5	-166.6	-9.3	0	0	0	0	0	105.6
290	E	35.7	Very low	36	Very low	180 Å²	180	140.4 Å²	140.4	84%	0.841	75%	0.754	S	S	*	*			cis	179.3	153	42.3	-124.7	178.7	160.8	0	0	103.4
291	E	39.6	Very low	36	Very low	181 Å²	181	138.4 Å²	138.4	85%	0.846	76%	0.755	S	S	*	*			cis	-132.4	162.7	-5.6	-71	174.4	112.4	0	0	107.3
292	G	35.4	Very low	35.7	Very low	77 Å²	77	137.4 Å²	137.4	79%	0.794	76%	0.757	S	S	*	*			cis	136.1	31.4	0.3	0	0	0	0	0	116.3
293	E	30	Very low	35.5	Very low	197 Å²	197	136.8 Å²	136.8	92%	0.921	76%	0.76	S	S	*	*			trans	-136.5	145.5	165	-155.7	164.9	-160	0	0	113.6
294	C	27.4	Very low	35	Very low	111 Å²	111	138.3 Å²	138.3	75%	0.75	77%	0.765	S	S	*	*			trans	-163.2	175.9	-154.8	-120.4	0	0	0	0	108.3
295	P	46.5	Very low	34.3	Very low	90 Å²	90	144 Å²	144	58%	0.584	78%	0.778	S	S	*	*				-132.4	-155	-52.1	33.6	-13	0	0	0	109.8
296	E	30.8	Very low	33.6	Very low	156 Å²	156	140.5 Å²	140.5	73%	0.729	77%	0.767	S	S	*	*			trans	66	152.5	143.6	-79.6	-171.1	134.6	0	0	120.4
297	Q	30.4	Very low	33.1	Very low	151 Å²	151	142 Å²	142	71%	0.706	78%	0.78	S	S	*	*			cis	-156.9	173.3	-17	-141.7	-174	63.7	0	0	109.5
298	A	28.9	Very low	33	Very low	85 Å²	85	136.6 Å²	136.6	70%	0.702	77%	0.77	S	S	*	*			trans	73	151.8	150.1	0	0	0	0	0	120.2
299	K	30.2	Very low	32.8	Very low	183 Å²	183	135.7 Å²	135.7	80%	0.796	77%	0.771	S	S	*	*			cis	-169.4	112.6	-26.6	-171	165.7	-170.5	168.2	0	109.4
300	E	30.2	Very low	32	Very low	176 Å²	176	139.8 Å²	139.8	82%	0.822	78%	0.776	S	S	*	*			trans	63	165.6	178.2	-73.6	-171.1	-133.6	0	0	115.1
301	P	38.5	Very low	32	Very low	113 Å²	113	136.5 Å²	136.5	73%	0.734	77%	0.768	S	S	*	*			cis	-132.1	-174.4	13.6	42.7	-25	0	0	0	116.7
302	S	26.7	Very low	31.9	Very low	100 Å²	100	134.7 Å²	134.7	70%	0.699	76%	0.764	S	S	*	*			trans	-63.2	176.3	160.1	66.7	0	0	0	0	113.4
303	P	37.2	Very low	31.8	Very low	119 Å²	119	138.8 Å²	138.8	77%	0.773	76%	0.762	S	S	*	*			cis	-131.5	179.9	0.1	42.2	-27	0	0	0	114.3
304	M	27.8	Very low	31.8	Very low	190 Å²	190	135.2 Å²	135.2	94%	0.936	75%	0.754	S	S	*	*			trans	-147.2	152.5	153.3	54.6	178	158.2	0	0	112.6
305	E	26.2	Very low	32.3	Very low	198 Å²	198	138.9 Å²	138.9	93%	0.925	76%	0.757	S	S	*	*			trans	-97.1	-178.6	-163.3	-69.4	-163.7	115.4	0	0	115.3
306	S	31.3	Very low	31.7	Very low	92 Å²	92	138.7 Å²	138.7	64%	0.643	76%	0.758	S	S	*	*			trans	-101.9	142.4	-162.7	54.2	0	0	0	0	115.6
307	T	28.5	Very low	31.7	Very low	137 Å²	137	137.5 Å²	137.5	84%	0.84	76%	0.762	S	S	*	*			trans	71.7	150.5	138.4	57.3	0	0	0	0	122.6
308	A	28.7	Very low	31.8	Very low	76 Å²	76	135.9 Å²	135.9	63%	0.628	76%	0.762	S	S	*	*			trans	103.2	98.6	137.3	0	0	0	0	0	121.1
309	N	31.6	Very low	32	Very low	151 Å²	151	141 Å²	141	81%	0.807	77%	0.768	S	S	*	*				81	158.6	118.8	-59	-8.8	0	0	0	122.9
310	E	29.7	Very low	32.2	Very low	173 Å²	173	138.3 Å²	138.3	81%	0.808	77%	0.767	S	S	*	*			trans	66.2	100.2	162.1	-74.3	-171.5	98.1	0	0	122.3
311	T	37.5	Very low	32.4	Very low	110 Å²	110	134.8 Å²	134.8	68%	0.675	76%	0.762	S	S	*	*				46.1	129.4	127.9	63.5	0	0	0	0	122.8
312	N	36.3	Very low	32.4	Very low	143 Å²	143	136.8 Å²	136.8	77%	0.765	76%	0.762	S	S	*	*			trans	81.8	135.2	140	-80	-45.4	0	0	0	121.7
313	Q	32.5	Very low	32.6	Very low	164 Å²	164	138.4 Å²	138.4	77%	0.766	76%	0.762	S	S	*	*			trans	78.1	110.7	148.7	-72.9	-176.2	86.4	0	0	122.1
314	T	30.8	Very low	32.8	Very low	121 Å²	121	141.1 Å²	141.1	74%	0.742	77%	0.765	S	S	*	*				77.9	118.7	128.2	59.9	0	0	0	0	123.1
315	K	37.9	Very low	33.3	Very low	189 Å²	189	135 Å²	135	82%	0.822	75%	0.75	S	S	*	*				91.7	95.5	119	-171	178.2	177.3	-176.4	0	121.5
316	S	34.2	Very low	33.7	Very low	85 Å²	85	133.2 Å²	133.2	59%	0.594	75%	0.747	S	S	*	*			trans	42.6	136.1	131.7	72.5	0	0	0	0	123.3
317	T	31	Very low	33.9	Very low	132 Å²	132	135.7 Å²	135.7	81%	0.81	75%	0.753	S	S	*	*				165.6	169.3	115.7	37.2	0	0	0	0	110.5
318	T	33	Very low	34.6	Very low	116 Å²	116	136.2 Å²	136.2	71%	0.712	75%	0.751	S	S	*	*			cis	-176.4	153.8	-43.4	-73.6	0	0	0	0	108.2
319	K	32.1	Very low	35	Very low	193 Å²	193	136 Å²	136	84%	0.839	76%	0.756	S	S	*	*			trans	113.8	150.6	160.2	-69.5	-168.2	177.2	-174.3	0	117.1
320	V	35.6	Very low	35.1	Very low	126 Å²	126	137.6 Å²	137.6	76%	0.764	76%	0.759	S	S	*	*			cis	-169.1	164.2	-33.5	105.3	0	0	0	0	111.7
321	S	32.8	Very low	35.7	Very low	103 Å²	103	135.2 Å²	135.2	72%	0.72	76%	0.756	S	S	*	*			trans	113.7	161.3	162.3	-63.5	0	0	0	0	115.8
322	Q	39	Very low	35.6	Very low	155 Å²	155	137.2 Å²	137.2	72%	0.724	76%	0.762	S	S	*	*			cis	162.6	129.2	-47.5	169.9	-172.5	-32	0	0	110
323	D	31.5	Very low	35.7	Very low	134 Å²	134	138.8 Å²	138.8	72%	0.717	76%	0.762	S	S	*	*				176	-177.7	117.5	-138	55.5	0	0	0	112.5
324	E	41.3	Very low	35.9	Very low	175 Å²	175	138.5 Å²	138.5	82%	0.818	77%	0.766	S	S	*	*			trans	-131.7	174.4	-139.9	-60.1	-92.3	168.4	0	0	117.2
325	G	37.1	Very low	36.3	Very low	61 Å²	61	135.7 Å²	135.7	63%	0.629	76%	0.761	S	S	*	*			trans	86.2	160.1	165.6	0	0	0	0	0	117.2
326	D	35.8	Very low	36.2	Very low	161 Å²	161	133 Å²	133	86%	0.861	76%	0.755	S	S	*	*			cis	-158.9	138.9	-17.2	-93.4	-42.3	0	0	0	106.9
327	D	36.1	Very low	36.5	Very low	145 Å²	145	135.6 Å²	135.6	78%	0.775	76%	0.763	S	S	*	*				82.6	152.8	105.3	-153.7	19.2	0	0	0	116.4
328	D	41.4	Very low	37	Very low	148 Å²	148	136.5 Å²	136.5	79%	0.791	76%	0.756	S	S	*	*			trans	37.7	171.5	172.7	85	29.2	0	0	0	122.4
329	G	38.6	Very low	37.3	Very low	71 Å²	71	138.5 Å²	138.5	73%	0.732	76%	0.762	S	S	*	*			cis	147.4	44	-33.9	0	0	0	0	0	119.2
330	E	33.3	Very low	37.5	Very low	185 Å²	185	133.1 Å²	133.1	86%	0.864	76%	0.761	S	S	*	*			trans	-131.5	155.1	172.6	-136.2	170.8	-165.8	0	0	116.4
331	V	42.5	Very low	37.4	Very low	123 Å²	123	135.1 Å²	135.1	75%	0.745	77%	0.768	S	S	*	*			trans	-90.7	159.3	163.6	-76.1	0	0	0	0	108.7
332	D	34.5	Very low	37.8	Very low	152 Å²	152	136.3 Å²	136.3	81%	0.813	77%	0.766	S	S	*	*			trans	-148.1	166.1	149.1	-131.2	-24.5	0	0	0	113.4
333	K	39.3	Very low	37.9	Very low	176 Å²	176	138.9 Å²	138.9	77%	0.765	78%	0.775	S	S	*	*			trans	-130.4	-166.9	-171.9	-79.2	-172.7	170.8	-174.5	0	111.6
334	D	37.3	Very low	38.2	Very low	157 Å²	157	136.5 Å²	136.5	84%	0.84	76%	0.762	S	S	*	*			trans	75.5	154.9	161.9	-53	-18.6	0	0	0	114.7
335	G	38.4	Very low	38	Very low	63 Å²	63	135.1 Å²	135.1	65%	0.649	77%	0.766	S	S	*	*			cis	159.4	162.2	-3	0	0	0	0	0	110.8
336	D	35.3	Very low	38.1	Very low	131 Å²	131	141.7 Å²	141.7	70%	0.701	77%	0.772	S	S	*	*			trans	59.2	126.1	-174.1	-80.4	-122.5	0	0	0	115	K338	D336-K338 IonicContact OD1-NZ 2.78Å; D336-K338 PolarHBondContact OD1-NZ 3.4Å
337	D	40.7	Very low	38.2	Very low	140 Å²	140	142 Å²	142	75%	0.749	77%	0.765	S	S	*	*			cis	78.7	116.6	40.8	-68.5	-56.2	0	0	0	116
338	K	42.1	Very low	37.9	Very low	152 Å²	152	141.2 Å²	141.2	66%	0.661	76%	0.761	S	S	*	*				-176	131.6	127.5	-96.8	153.1	-151.6	81.1	0	115.2	D336	D336-K338 IonicContact OD1-NZ 2.78Å; D336-K338 PolarHBondContact OD1-NZ 3.4Å
339	D	38.7	Very low	37.5	Very low	157 Å²	157	136.8 Å²	136.8	84%	0.84	75%	0.75	S	S	*	*			trans	29	118.8	134.3	-42.5	-27	0	0	0	118.4
340	G	37.1	Very low	37.3	Very low	80 Å²	80	139 Å²	139	83%	0.825	76%	0.761	S	S	*	*				143.3	168.3	73	0	0	0	0	0	107.9
341	D	33.9	Very low	37.1	Very low	169 Å²	169	133.3 Å²	133.3	90%	0.904	75%	0.752	S	S	*	*			cis	-147.5	-166.3	18.6	-163.2	-88.5	0	0	0	109.7
342	D	40.9	Very low	36.6	Very low	128 Å²	128	135.9 Å²	135.9	68%	0.684	76%	0.762	S	S	*	*			trans	-96.1	150.3	-156.8	-136.9	-45.8	0	0	0	115.9
343	K	39.6	Very low	36.4	Very low	209 Å²	209	132.2 Å²	132.2	91%	0.909	76%	0.76	S	S	*	*				-169.5	128.9	125.8	-107.6	158.8	-169	161.5	0	117.2
344	D	39.3	Very low	35.9	Very low	84 Å²	84	129.9 Å²	129.9	45%	0.449	76%	0.764	S	S	.	*			trans	-91.8	145.8	-176.7	-172	1.8	0	0	0	113.2	R346	D344-R346 VanDerWaalsContact CG-NE 3.33Å; D344-R346 WeakPolarHBondContact OD1-CG 3.49Å; D344-R346 IonicContact OD1-NE 2.62Å; D344-R346 PolarHBondContact OD1-NE 3.14Å; D344-R346 VanDerWaalsContact OD1-NE 3.09Å; D344-R346 IonicContact OD2-CZ 3.18Å; D344-R346 IonicContact OD2-NE 3.24Å; D344-R346 PolarHBondContact OD2-NE 3.26Å; D344-R346 IonicContact OD2-NH2 2.71Å; D344-R346 PolarHBondContact OD2-NH2 2.84Å
345	T	37.1	Very low	35.5	Very low	146 Å²	146	129.9 Å²	129.9	90%	0.896	76%	0.764	S	S	*	*			trans	-151.7	139.3	151.7	14.8	0	0	0	0	112.7
346	R	38.5	Very low	35.1	Very low	199 Å²	199	134.8 Å²	134.8	75%	0.751	77%	0.77	S	S	*	*			trans	-138.5	166	-169	-33.2	177.9	-171.6	174.3	1.6	109	D344	D344-R346 VanDerWaalsContact CG-NE 3.33Å; D344-R346 WeakPolarHBondContact OD1-CG 3.49Å; D344-R346 IonicContact OD1-NE 2.62Å; D344-R346 PolarHBondContact OD1-NE 3.14Å; D344-R346 VanDerWaalsContact OD1-NE 3.09Å; D344-R346 IonicContact OD2-CZ 3.18Å; D344-R346 IonicContact OD2-NE 3.24Å; D344-R346 PolarHBondContact OD2-NE 3.26Å; D344-R346 IonicContact OD2-NH2 2.71Å; D344-R346 PolarHBondContact OD2-NH2 2.84Å
347	K	37	Very low	34.9	Very low	166 Å²	166	136.2 Å²	136.2	72%	0.722	78%	0.778	S	S	*	*			cis	-166	-178.3	-3.9	-128.6	173.2	169.5	-74.5	0	105.5
348	D	31.3	Very low	34.4	Very low	130 Å²	130	132.8 Å²	132.8	70%	0.695	78%	0.775	S	S	*	*			cis	-155.7	-163.9	3.1	-133.8	-21.7	0	0	0	106.4
349	G	33.1	Very low	33.8	Very low	54 Å²	54	131.1 Å²	131.1	56%	0.557	79%	0.79	S	S	*	*			cis	151.7	150.5	-1.1	0	0	0	0	0	112.5
350	A	33	Very low	33.4	Very low	117 Å²	117	127.3 Å²	127.3	97%	0.967	79%	0.788	S	S	*	*			trans	67.2	152.4	175.9	0	0	0	0	0	118.4
351	G	30.4	Very low	33.1	Very low	66 Å²	66	131.1 Å²	131.1	68%	0.68	79%	0.789	S	S	*	*			cis	165.4	156.9	-10.9	0	0	0	0	0	114.7
352	N	31.8	Very low	32.8	Very low	178 Å²	178	128.3 Å²	128.3	95%	0.952	77%	0.774	S	S	*	*			trans	59.4	156.6	169.2	-56.6	-15	0	0	0	117.8
353	G	30.4	Very low	32.5	Very low	75 Å²	75	126.1 Å²	126.1	77%	0.773	77%	0.769	S	S	*	*			cis	126.7	139.6	3.7	0	0	0	0	0	111.4
354	C	27.8	Very low	32.5	Very low	126 Å²	126	125.5 Å²	125.5	85%	0.851	76%	0.761	S	S	*	*			cis	-166.7	-162	-1	-160.2	0	0	0	0	109.7
355	L	29	Very low	32.4	Very low	157 Å²	157	129 Å²	129	82%	0.822	77%	0.772	S	S	*	*			trans	74.8	176.2	171.1	-47.7	171.3	0	0	0	117.4
356	E	30.9	Very low	32.1	Very low	166 Å²	166	127.8 Å²	127.8	78%	0.776	76%	0.76	S	S	*	*				-163.7	-178.2	-67.3	-147.8	173.6	-178.5	0	0	108.6
357	D	30.3	Very low	31.8	Very low	162 Å²	162	125.6 Å²	125.6	87%	0.866	76%	0.763	S	S	*	*			trans	65.2	153.8	174.1	-63.1	-39.8	0	0	0	119.5
358	G	29.7	Very low	31.6	Very low	68 Å²	68	122.2 Å²	122.2	70%	0.701	77%	0.766	S	S	*	*			cis	159.4	131.4	-10.5	0	0	0	0	0	115.2
359	A	30	Very low	31.8	Very low	117 Å²	117	119.5 Å²	119.5	97%	0.967	77%	0.769	S	S	*	*			trans	64.2	164.2	176.5	0	0	0	0	0	117.5
360	G	31.3	Very low	31.7	Very low	77 Å²	77	125 Å²	125	79%	0.794	79%	0.786	S	S	*	*			cis	148	157.1	-5.5	0	0	0	0	0	111.8
361	N	29.4	Very low	31.6	Very low	159 Å²	159	122.7 Å²	122.7	85%	0.85	77%	0.774	S	S	*	*			cis	-171.7	166.1	-10.4	-176	45.3	0	0	0	111.8
362	D	27.2	Very low	31.5	Very low	110 Å²	110	125.5 Å²	125.5	59%	0.588	78%	0.781	S	S	*	*			trans	84.2	150.7	158.3	-153.2	-124.9	0	0	0	122.7	R364	D362-R364 IonicContact OD1-NH2 3.26Å; D362-R364 PolarHBondContact OD1-NH2 3.28Å; D362-R364 VanDerWaalsContact OD1-NH2 3.15Å
363	S	35.9	Very low	31.4	Very low	83 Å²	83	123.8 Å²	123.8	58%	0.58	77%	0.771	S	S	*	*			trans	73.1	154.3	152.7	-81.9	0	0	0	0	122.5
364	R	39.4	Very low	31.3	Very low	195 Å²	195	127.5 Å²	127.5	74%	0.736	77%	0.768	S	S	*	*			cis	-174.3	151.7	-27.6	-123.5	179.5	-97.3	-153.7	-8.8	111.5	D362	D362-R364 IonicContact OD1-NH2 3.26Å; D362-R364 PolarHBondContact OD1-NH2 3.28Å; D362-R364 VanDerWaalsContact OD1-NH2 3.15Å
365	K	35.9	Very low	31.4	Very low	158 Å²	158	130.1 Å²	130.1	69%	0.687	77%	0.768	S	S	*	*			trans	70.8	142.4	143.6	-84.4	-170	142.1	-71.5	0	124.4
366	D	31	Very low	31.5	Very low	121 Å²	121	125.8 Å²	125.8	65%	0.647	76%	0.762	S	S	*	*			trans	68.8	150.1	135.4	-59.7	2.6	0	0	0	122.1
367	D	32.8	Very low	31.4	Very low	152 Å²	152	125.4 Å²	125.4	81%	0.813	76%	0.76	S	S	*	*			cis	-171.3	161.3	-20	-175.9	29.2	0	0	0	111.4
368	A	33.6	Very low	31.5	Very low	95 Å²	95	121.6 Å²	121.6	79%	0.785	74%	0.737	S	S	*	*			trans	60.2	163.2	173.5	0	0	0	0	0	118.3
369	G	34.7	Very low	32	Very low	74 Å²	74	122.6 Å²	122.6	76%	0.763	72%	0.723	S	S	*	*			cis	151.5	163.4	-1.9	0	0	0	0	0	110.6
370	N	31.9	Very low	32.4	Very low	169 Å²	169	120.8 Å²	120.8	90%	0.904	69%	0.693	S	S	*	*			cis	-174.7	122	-8.7	172.9	104.2	0	0	0	111
371	G	31	Very low	32.6	Very low	69 Å²	69	123.3 Å²	123.3	71%	0.711	69%	0.689	S	S	*	*			trans	146	139.4	167.9	0	0	0	0	0	113.8
372	C	28.4	Very low	32.9	Very low	124 Å²	124	123.7 Å²	123.7	84%	0.838	69%	0.689	S	S	*	*			cis	98.9	121.6	16.2	-167.6	0	0	0	0	115.9
373	L	28.1	Very low	33.4	Very low	142 Å²	142	124.8 Å²	124.8	74%	0.743	70%	0.699	S	S	*	*			trans	158.2	111.3	154.9	-87.4	162.4	0	0	0	108.1
374	E	29.6	Very low	33	Very low	153 Å²	153	126.7 Å²	126.7	72%	0.715	71%	0.713	S	S	*	*				73.8	109.7	96.1	-78.9	-178.8	-167.7	0	0	114.2
375	E	29	Very low	32.6	Very low	182 Å²	182	123.5 Å²	123.5	85%	0.85	72%	0.715	S	S	*	*				82.7	138.4	96.4	-73.6	-175.9	-167.1	0	0	114
376	G	30.5	Very low	32.1	Very low	66 Å²	66	120.6 Å²	120.6	68%	0.68	71%	0.714	S	S	*	*			cis	-164.9	166.3	0.6	0	0	0	0	0	115.9
377	E	30.2	Very low	31.9	Very low	158 Å²	158	121.1 Å²	121.1	74%	0.738	72%	0.722	S	S	*	*			trans	7.9	148.5	158.7	52.1	-165.4	137.4	0	0	126.2
378	E	32	Very low	31.8	Very low	82 Å²	82	118.6 Å²	118.6	38%	0.383	72%	0.716	S	S	.	*				157.6	-139.8	122.7	-76.3	-179.4	-31.7	0	0	120.1	D660 A661 Y662	E378-D660 WeakPolarHBondContact OE1-CB 3.49Å; E378-A661 HydrophobicContact CB-CB 3.92Å; E378-A661 PolarHBondContact OE1-N 2.86Å; E378-Y662 HydrophobicContact CB-CD1 3.46Å; E378-Y662 VanDerWaalsContact CB-CD1 3.46Å; E378-Y662 HydrophobicContact CB-CE1 4.2Å; E378-Y662 HydrophobicContact CB-CG 3.89Å; E378-Y662 HydrophobicContact CG-CD1 3.42Å; E378-Y662 VanDerWaalsContact CG-CD1 3.42Å; E378-Y662 HydrophobicContact CG-CD2 4.41Å; E378-Y662 HydrophobicContact CG-CE1 3.82Å; E378-Y662 HydrophobicContact CG-CG 3.7Å; E378-Y662 WeakPolarHBondContact OE1-CB 3.45Å; E378-Y662 PolarHBondContact OE1-N 2.91Å; E378-Y662 WeakPolarHBondContact OE2-CB 3.42Å; E378-Y662 WeakPolarHBondContact OE2-CD2 3.36Å; E378-Y662 WeakPolarHBondContact OE2-CE2 3.49Å
379	E	40.6	Very low	31.7	Very low	89 Å²	89	118.6 Å²	118.6	42%	0.416	71%	0.711	S	S	.	*			trans	-160.7	166.1	-162.7	-54.2	-175.6	87.9	0	0	118.8	A661 Y662 G663 R664	E379-A661 CarbonylContact C-O 3.57Å; E379-A661 WeakPolarHBondContact CA-O 3.49Å; E379-A661 VanDerWaalsContact N-C 3.32Å; E379-A661 PolarHBondContact N-O 3.43Å; E379-A661 CarbonylContact O-C 3.46Å; E379-Y662 HydrophobicContact CB-CD1 3.92Å; E379-Y662 HydrophobicContact CG-CD1 3.85Å; E379-Y662 HydrophobicContact CG-CE1 3.94Å; E379-Y662 CarbonylContact O-C 2.71Å; E379-Y662 WeakPolarHBondContact O-CA 3.4Å; E379-Y662 VanDerWaalsContact OE2-CE1 3.32Å; E379-Y662 WeakPolarHBondContact OE2-CE1 3.16Å; E379-G663 PolarHBondContact O-N 3.03Å; E379-R664 IonicContact OE2-CZ 2.62Å; E379-R664 IonicContact OE2-NH1 2.63Å; E379-R664 IonicContact OE2-NH2 3.08Å; E379-R664 PolarHBondContact OE2-NH2 2.84Å
380	K	37.5	Very low	31.5	Very low	78 Å²	78	119.4 Å²	119.4	34%	0.339	70%	0.704	S	S	.	*				105.2	116.8	129.8	-144	155.8	-59.8	-48.5	0	127	R664	K380-R664 HydrophobicContact CD-CG 4.41Å; K380-R664 VanDerWaalsContact CE-NH1 3.32Å
381	D	36.3	Very low	31.6	Very low	131 Å²	131	118.3 Å²	118.3	70%	0.701	69%	0.694	S	S	*	*			trans	32.8	152.5	132.4	-38.2	-23.5	0	0	0	123.6
382	I	36.2	Very low	32	Very low	167 Å²	167	121.2 Å²	121.2	86%	0.856	69%	0.689	S	S	*	*			cis	-153.8	150.8	24.9	-12.5	174.4	0	0	0	115.3
383	V	37.8	Very low	32.5	Very low	132 Å²	132	122 Å²	122	80%	0.8	68%	0.678	S	S	*	*			trans	-31.4	143.5	168.4	-179.5	0	0	0	0	121.2
384	S	26.2	Very low	33	Very low	123 Å²	123	120.7 Å²	120.7	86%	0.86	68%	0.676	S	S	*	*			trans	-156.6	166.7	137.5	59.6	0	0	0	0	111.5
385	V	30.6	Very low	33.2	Very low	129 Å²	129	119.6 Å²	119.6	78%	0.782	67%	0.671	S	S	*	*			trans	-141.7	164.7	-156.8	78.6	0	0	0	0	115.4
386	S	27.2	Very low	33.4	Very low	97 Å²	97	119.9 Å²	119.9	68%	0.678	67%	0.672	S	S	*	*			trans	128.7	115.3	164.6	-57.8	0	0	0	0	110.8
387	T	26.6	Very low	33.5	Very low	131 Å²	131	120.3 Å²	120.3	80%	0.804	68%	0.676	S	S	*	*				69.7	144.4	60.8	69.9	0	0	0	0	113.9
388	S	30.2	Very low	34	Very low	99 Å²	99	121.9 Å²	121.9	69%	0.692	68%	0.684	S	S	*	*			cis	-159.7	166	23.3	59.9	0	0	0	0	115.9
389	S	30.8	Very low	34.3	Very low	96 Å²	96	126.1 Å²	126.1	67%	0.671	71%	0.708	S	S	*	*			trans	65	167.4	142.3	78.2	0	0	0	0	119.6
390	S	31	Very low	34.1	Very low	90 Å²	90	129.8 Å²	129.8	63%	0.629	73%	0.725	S	S	*	*			cis	-145.5	141	18.4	-84.3	0	0	0	0	111
391	Q	34.5	Very low	34.3	Very low	146 Å²	146	135.2 Å²	135.2	68%	0.682	75%	0.752	S	S	*	*				73.1	163.6	75.6	-65.4	165.2	-80.6	0	0	114.7
392	E	37.8	Very low	34.5	Very low	130 Å²	130	132.6 Å²	132.6	61%	0.607	76%	0.756	S	S	*	*			cis	-151.6	179.7	-10	-125.9	176.3	83.9	0	0	107
393	K	39.2	Very low	34.3	Very low	141 Å²	141	134.1 Å²	134.1	61%	0.613	76%	0.759	S	S	*	*			cis	-137.9	-139.2	8.4	-152.3	168.9	176	76.6	0	108.8	E395	K393-E395 WeakPolarHBondContact CD-OE1 3.39Å; K393-E395 WeakPolarHBondContact CE-OE1 3.31Å
394	V	38.5	Very low	34.2	Very low	115 Å²	115	134.1 Å²	134.1	70%	0.697	76%	0.759	S	S	*	*			cis	-165.5	156.8	1.2	-112.1	0	0	0	0	105.5
395	E	34.7	Very low	34.7	Very low	129 Å²	129	132.6 Å²	132.6	60%	0.603	75%	0.749	S	S	*	*			cis	-162.9	122.8	-18.9	-148.4	124.4	-108.3	0	0	104.7	K393	K393-E395 WeakPolarHBondContact CD-OE1 3.39Å; K393-E395 WeakPolarHBondContact CE-OE1 3.31Å
396	E	33	Very low	35	Very low	189 Å²	189	134.1 Å²	134.1	88%	0.883	75%	0.752	S	S	*	*				63.1	131.3	97.9	-160.8	163.2	-128.8	0	0	117.3
397	G	32.6	Very low	35.8	Very low	74 Å²	74	137.4 Å²	137.4	76%	0.763	76%	0.757	S	S	*	*			trans	166.8	110	178.1	0	0	0	0	0	112.6
398	E	40.1	Very low	36.7	Very low	192 Å²	192	138.9 Å²	138.9	90%	0.897	76%	0.76	S	S	*	*			trans	-77.5	145.2	-174.3	-55.2	170.5	121.6	0	0	113
399	L	39.8	Very low	37.8	Very low	170 Å²	170	141.3 Å²	141.3	89%	0.89	76%	0.76	S	S	*	*			trans	-159.9	164.5	148.7	-113.5	171.5	0	0	0	112.6
400	E	35.1	Very low	38.5	Very low	167 Å²	167	144.2 Å²	144.2	78%	0.78	76%	0.761	S	S	*	*			trans	-71.5	171.6	-164.7	-109.1	165.9	129.8	0	0	116.7
401	E	42	Very low	38.9	Very low	192 Å²	192	148.8 Å²	148.8	90%	0.897	76%	0.764	S	S	*	*			trans	69.3	142.9	166.7	-66.6	174	162.3	0	0	117.8
402	G	39.6	Very low	39.5	Very low	76 Å²	76	147.6 Å²	147.6	78%	0.784	77%	0.769	S	S	*	*			cis	162	-6	-3.2	0	0	0	0	0	117.7
403	E	33.4	Very low	40.3	Very low	199 Å²	199	147.9 Å²	147.9	93%	0.93	77%	0.77	S	S	*	*			trans	-135.3	133.3	-175.4	-90.4	169.7	-162.5	0	0	112.9
404	V	35.2	Very low	41	Very low	132 Å²	132	149.7 Å²	149.7	80%	0.8	78%	0.781	S	S	*	*			trans	-99	122.1	167.5	174.9	0	0	0	0	106.8	D406	V404-D406 PolarHBondContact O-N 2.88Å
405	S	36.9	Very low	41.7	Very low	91 Å²	91	149.9 Å²	149.9	64%	0.636	78%	0.783	S	S	*	*			trans	-72.8	112.2	177.5	-165.3	0	0	0	0	110.7	E407	S405-E407 VanDerWaalsContact C-N 3.29Å; S405-E407 PolarHBondContact O-N 3.05Å; S405-E407 PolarHBondContact OG-OE2 3.14Å
406	D	37.5	Very low	43.3	Very low	160 Å²	160	152 Å²	152	86%	0.856	79%	0.793	S	S	*	*			trans	-73.8	76.2	169.5	-80.6	-56.2	0	0	0	110.5	V404	V404-D406 PolarHBondContact O-N 2.88Å
407	E	43.9	Very low	45.2	Very low	166 Å²	166	148.5 Å²	148.5	78%	0.776	79%	0.786	S	S	*	*			trans	-111.5	35.2	-175	-149	171.8	142.6	0	0	114.3	S405 E409	S405-E407 VanDerWaalsContact C-N 3.29Å; S405-E407 PolarHBondContact O-N 3.05Å; S405-E407 PolarHBondContact OG-OE2 3.14Å; E407-E409 PolarHBondContact O-N 3.32Å
408	D	43.9	Very low	47.2	Very low	163 Å²	163	152 Å²	152	87%	0.872	78%	0.781	S	S	*	*			trans	-98.6	57.3	176.6	-152.1	-25.6	0	0	0	111.8	K410	D408-K410 PolarHBondContact O-N 3.18Å; D408-K410 VanDerWaalsContact O-N 3.12Å
409	E	54.1	Low	49.4	Very low	149 Å²	149	147.1 Å²	147.1	70%	0.696	77%	0.765	S	S	*	*			trans	-80.4	92.5	-175.2	-82.6	-113.3	80.7	0	0	113.8	E407	E407-E409 PolarHBondContact O-N 3.32Å
410	K	45.9	Very low	51.6	Low	157 Å²	157	142.5 Å²	142.5	68%	0.683	74%	0.744	S	S	*	*			trans	68.7	85.1	145.8	-59.1	-172.4	174.8	79.1	0	118.3	D408 P412	D408-K410 PolarHBondContact O-N 3.18Å; D408-K410 VanDerWaalsContact O-N 3.12Å; K410-P412 WeakPolarHBondContact O-CD 3.44Å
411	R	38.7	Very low	54.3	Low	186 Å²	186	134.6 Å²	134.6	70%	0.702	71%	0.707	S	S	*	*			trans	-50.9	121.7	143.9	-176.7	-173.9	-176.6	92.3	1.9	110.6	E413	R411-E413 HydrophobicContact CG-CB 4.17Å; R411-E413 IonicContact CZ-OE2 3.09Å; R411-E413 IonicContact NE-OE2 3.12Å; R411-E413 PolarHBondContact NE-OE2 2.99Å; R411-E413 IonicContact NH2-OE2 2.87Å; R411-E413 PolarHBondContact NH2-OE2 3.01Å; R411-E413 PolarHBondContact O-N 2.7Å
412	P	48.3	Very low	56.7	Low	122 Å²	122	133.4 Å²	133.4	79%	0.792	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	22.5	-174.6	-23.1	35.5	0	0	0	117.8	K410	K410-P412 WeakPolarHBondContact O-CD 3.44Å
413	E	54.2	Low	59.1	Low	135 Å²	135	134.7 Å²	134.7	63%	0.631	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	-16.1	-169.6	-163.7	168.7	-163.7	0	0	114	R411	R411-E413 HydrophobicContact CG-CB 4.17Å; R411-E413 IonicContact CZ-OE2 3.09Å; R411-E413 IonicContact NE-OE2 3.12Å; R411-E413 PolarHBondContact NE-OE2 2.99Å; R411-E413 IonicContact NH2-OE2 2.87Å; R411-E413 PolarHBondContact NH2-OE2 3.01Å; R411-E413 PolarHBondContact O-N 2.7Å
414	E	53.8	Low	61.7	Low	180 Å²	180	128 Å²	128	84%	0.841	65%	0.645	S	S	*	*	S	Bend	trans	-88	-12.8	-177.7	-64.1	-153	113.1	0	0	114.8	E416	E414-E416 VanDerWaalsContact C-N 3.26Å; E414-E416 PolarHBondContact O-N 3.3Å
415	T	53.7	Low	64.2	Low	118 Å²	118	125.9 Å²	125.9	72%	0.724	63%	0.633	S	S	*	*			trans	-79.1	3.9	-169.6	-21.1	0	0	0	0	115.2	P417	T415-P417 VanDerWaalsContact O-CD 3.24Å; T415-P417 WeakPolarHBondContact O-CD 3.32Å
416	E	66.6	Low	66.6	Low	174 Å²	174	128 Å²	128	81%	0.813	63%	0.627	S	S	*	*	S	Bend	trans	-95.9	101.7	170	-75	-160.6	-169.9	0	0	111.4	E414 K418	E414-E416 VanDerWaalsContact C-N 3.26Å; E414-E416 PolarHBondContact O-N 3.3Å; E416-K418 PolarHBondContact O-N 3.13Å
417	P	74.8	Confident	69.1	Low	115 Å²	115	124 Å²	124	75%	0.747	62%	0.623	S	S	*	*			trans	-65	110.8	179	25.6	-33.8	0	0	0	110.8	T415	T415-P417 VanDerWaalsContact O-CD 3.24Å; T415-P417 WeakPolarHBondContact O-CD 3.32Å
418	K	73.3	Confident	71.3	Confident	149 Å²	149	122.4 Å²	122.4	65%	0.648	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-46	121.2	-175	-72.2	163.9	-176.3	156.8	0	111.3	E416 L438	E416-K418 PolarHBondContact O-N 3.13Å; K418-L438 HydrophobicContact CB-CD1 4.29Å; K418-L438 HydrophobicContact CB-CD2 4.5Å; K418-L438 HydrophobicContact CB-CG 3.98Å; K418-L438 WeakPolarHBondContact O-CD1 3.41Å; K418-L438 VanDerWaalsContact O-CG 3.3Å; K418-L438 WeakPolarHBondContact O-CG 3.28Å
419	P	86.3	Confident	73.5	Confident	89 Å²	89	115.7 Å²	115.7	58%	0.578	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-61.2	142.3	-169	16.4	-27.6	0	0	0	113.2	F437 L438	P419-F437 HydrophobicContact CG-CD1 4.07Å; P419-F437 HydrophobicContact CG-CE1 4.27Å; P419-F437 WeakPolarHBondContact O-CA 3.34Å; P419-F437 VanDerWaalsContact O-CB 3.28Å; P419-F437 WeakPolarHBondContact O-CB 3.41Å; P419-L438 PolarHBondContact O-N 2.77Å; P419-L438 VanDerWaalsContact O-N 3.14Å
420	V	86.8	Confident	75.2	Confident	73 Å²	73	114.9 Å²	114.9	44%	0.442	59%	0.587	S	S	.	*	B	Isolated β-bridge	trans	-64.7	137.9	-177.7	170.3	0	0	0	0	111.8	R422 T425 L438 P440	V420-R422 PolarHBondContact O-N 2.89Å; V420-T425 HydrophobicContact CG1-CG2 3.67Å; V420-L438 HydrophobicContact CG2-CB 4.47Å; V420-P440 HydrophobicContact CG1-CG 3.83Å; V420-P440 HydrophobicContact CG2-CG 3.91Å
421	C	91.7	Very high	77	Confident	0 Å²	0	114.5 Å²	114.5	0%	0	58%	0.581	C	S	.	*			trans	-65.4	108.2	-176.7	-177.8	0	0	0	0	112.6	F423 Y424 T425 F437 L438 H439	C421-F423 PolarHBondContact O-N 2.74Å; C421-Y424 PolarHBondContact O-N 3.06Å; C421-Y424 VanDerWaalsContact O-N 3.14Å; C421-Y424 PolarHBondContact SG-N 3.43Å; C421-T425 PolarHBondContact O-N 3.11Å; C421-T425 PolarHBondContact O-OG1 3.29Å; C421-F437 VanDerWaalsContact CA-CB 3.48Å; C421-F437 HydrophobicContact CB-CB 3.53Å; C421-L438 VanDerWaalsContact CB-O 3.26Å; C421-L438 WeakPolarHBondContact CB-O 3.31Å; C421-L438 PolarHBondContact N-O 2.97Å; C421-H439 WeakPolarHBondContact CB-CD2 3.22Å; C421-H439 PolarHBondContact SG-NE2 2.84Å; C421-H439 VanDerWaalsContact SG-NE2 3.43Å
422	R	91.5	Very high	79.1	Confident	168 Å²	168	106.8 Å²	106.8	63%	0.634	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-15.9	176.9	-171.4	169.1	174.3	82.3	-11	114.2	V420 T425 R426	V420-R422 PolarHBondContact O-N 2.89Å; R422-T425 WeakPolarHBondContact CA-OG1 3.49Å; R422-T425 PolarHBondContact O-OG1 3.19Å; R422-R426 VanDerWaalsContact O-CD 3.25Å; R422-R426 WeakPolarHBondContact O-CD 3.19Å; R422-R426 WeakPolarHBondContact O-CG 3.37Å
423	F	90	Very high	80.6	Confident	102 Å²	102	107.9 Å²	107.9	45%	0.447	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.2	-36.4	172.4	-64	-79.8	0	0	0	112	C421 R426 G427 Q428 C429	C421-F423 PolarHBondContact O-N 2.74Å; F423-R426 CarbonylContact O-C 3.55Å; F423-R426 WeakPolarHBondContact O-CA 3.28Å; F423-R426 WeakPolarHBondContact O-CB 3.26Å; F423-R426 PolarHBondContact O-N 3.35Å; F423-R426 VanDerWaalsContact O-N 3.14Å; F423-G427 PolarHBondContact O-N 3.49Å; F423-Q428 WeakPolarHBondContact O-CA 3.3Å; F423-Q428 PolarHBondContact O-N 3.23Å; F423-C429 HydrophobicContact CB-CB 3.85Å; F423-C429 PolarHBondContact O-N 3.42Å
424	Y	89.3	Confident	81.9	Confident	58 Å²	58	106.4 Å²	106.4	23%	0.227	56%	0.56	C	S	.	*	G	3₁₀ helix	trans	-70.4	-43.5	179.7	169	-103.9	0	0	0	112.4	C421 R426 G427 H439 P440 V442	C421-Y424 PolarHBondContact O-N 3.06Å; C421-Y424 VanDerWaalsContact O-N 3.14Å; C421-Y424 PolarHBondContact SG-N 3.43Å; Y424-R426 PolarHBondContact O-N 2.91Å; Y424-G427 PolarHBondContact O-N 2.79Å; Y424-H439 WeakPolarHBondContact CB-NE2 3.45Å; Y424-H439 HydrophobicContact CD1-CB 3.98Å; Y424-H439 AromaticContact CD1-CG 3.95Å; Y424-H439 HydrophobicContact CD2-CB 4.19Å; Y424-H439 AromaticContact CD2-CE1 3.69Å; Y424-H439 AromaticContact CD2-CG 3.67Å; Y424-H439 AromaticContact CD2-ND1 3.31Å; Y424-H439 VanDerWaalsContact CD2-ND1 3.31Å; Y424-H439 WeakPolarHBondContact CD2-ND1 3.42Å; Y424-H439 VanDerWaalsContact CE1-C 3.47Å; Y424-H439 HydrophobicContact CE1-CB 4.05Å; Y424-H439 HydrophobicContact CE2-CB 4.25Å; Y424-H439 AromaticContact CE2-ND1 3.88Å; Y424-H439 HydrophobicContact CG-CB 4.05Å; Y424-H439 AromaticContact CG-CD2 3.73Å; Y424-H439 AromaticContact CG-CE1 3.88Å; Y424-H439 AromaticContact CG-CG 3.54Å; Y424-H439 AromaticContact CG-ND1 3.64Å; Y424-H439 AromaticContact CG-NE2 3.92Å; Y424-P440 WeakPolarHBondContact CE1-O 3.49Å; Y424-P440 PolarHBondContact OH-O 2.7Å; Y424-V442 HydrophobicContact CE2-CB 3.74Å; Y424-V442 HydrophobicContact CE2-CG2 3.65Å; Y424-V442 VanDerWaalsContact OH-CG2 3.32Å; Y424-V442 WeakPolarHBondContact OH-CG2 3.35Å; Y424-V442 PolarHBondContact OH-N 3.02Å
425	T	86.3	Confident	83.5	Confident	89 Å²	89	98.8 Å²	98.8	55%	0.546	53%	0.527	S	S	.	.	G	3₁₀ helix	trans	-58	-7.8	168.8	47	0	0	0	0	113.9	V420 C421 R422	V420-T425 HydrophobicContact CG1-CG2 3.67Å; C421-T425 PolarHBondContact O-N 3.11Å; C421-T425 PolarHBondContact O-OG1 3.29Å; R422-T425 WeakPolarHBondContact CA-OG1 3.49Å; R422-T425 PolarHBondContact O-OG1 3.19Å
426	R	88.8	Confident	85.1	Confident	136 Å²	136	103.5 Å²	103.5	51%	0.513	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-115.2	6.6	174.7	-63.9	179.1	171.3	179.2	-9	113.8	R422 F423 Y424 Q428	R422-R426 VanDerWaalsContact O-CD 3.25Å; R422-R426 WeakPolarHBondContact O-CD 3.19Å; R422-R426 WeakPolarHBondContact O-CG 3.37Å; F423-R426 CarbonylContact O-C 3.55Å; F423-R426 WeakPolarHBondContact O-CA 3.28Å; F423-R426 WeakPolarHBondContact O-CB 3.26Å; F423-R426 PolarHBondContact O-N 3.35Å; F423-R426 VanDerWaalsContact O-N 3.14Å; Y424-R426 PolarHBondContact O-N 2.91Å; R426-Q428 PolarHBondContact O-N 2.89Å
427	G	88.6	Confident	86.2	Confident	75 Å²	75	99.2 Å²	99.2	77%	0.773	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	19.8	-176.1	0	0	0	0	0	114.8	F423 Y424	F423-G427 PolarHBondContact O-N 3.49Å; Y424-G427 PolarHBondContact O-N 2.79Å
428	Q	90.3	Very high	86.8	Confident	132 Å²	132	97.5 Å²	97.5	62%	0.617	49%	0.494	S	S	*	.			trans	-118.3	0.2	-171	-73.2	170	45.2	0	0	114	F423 R426 T430	F423-Q428 WeakPolarHBondContact O-CA 3.3Å; F423-Q428 PolarHBondContact O-N 3.23Å; R426-Q428 PolarHBondContact O-N 2.89Å; Q428-T430 PolarHBondContact O-N 3.03Å
429	C	90.6	Very high	87.5	Confident	22 Å²	22	91 Å²	91	15%	0.149	47%	0.466	C	S	.	.			trans	-78.8	113.6	174.6	-171	0	0	0	0	110.8	F423 W431 H439	F423-C429 HydrophobicContact CB-CB 3.85Å; F423-C429 PolarHBondContact O-N 3.42Å; C429-W431 VanDerWaalsContact C-N 3.34Å; C429-W431 PolarHBondContact SG-N 2.81Å; C429-H439 PolarHBondContact SG-CE1 3.14Å; C429-H439 PolarHBondContact SG-NE2 2.94Å
430	T	89	Confident	87.4	Confident	133 Å²	133	90 Å²	90	82%	0.816	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-10.1	175.7	51.8	0	0	0	0	113.8	Q428	Q428-T430 PolarHBondContact O-N 3.03Å
431	W	84.6	Confident	86.7	Confident	148 Å²	148	89.4 Å²	89.4	56%	0.561	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-14.9	-176.2	-62.7	-57.9	0	0	0	114.3	C429 M433 S434 C435	C429-W431 VanDerWaalsContact C-N 3.34Å; C429-W431 PolarHBondContact SG-N 2.81Å; W431-M433 PolarHBondContact O-N 3.04Å; W431-S434 PolarHBondContact O-N 3.15Å; W431-S434 VanDerWaalsContact O-N 3.15Å; W431-S434 PolarHBondContact O-OG 3.3Å; W431-C435 HydrophobicContact CB-CB 3.95Å
432	G	83.1	Confident	85.4	Confident	25 Å²	25	92.4 Å²	92.4	26%	0.258	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	51.7	-130.9	178.9	0	0	0	0	0	112.5	S434 C435 H439	G432-S434 PolarHBondContact O-N 3.05Å; G432-C435 WeakPolarHBondContact O-CB 3.22Å; G432-C435 PolarHBondContact O-N 3.23Å; G432-H439 PolarHBondContact O-CE1 3.04Å; G432-H439 PolarHBondContact O-ND1 2.79Å; G432-H439 VanDerWaalsContact O-ND1 3.11Å
433	M	79.7	Confident	83.6	Confident	145 Å²	145	87.4 Å²	87.4	71%	0.714	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-63.8	-23.3	-177.6	-58.2	172.7	54	0	0	114.2	W431 C435 T443	W431-M433 PolarHBondContact O-N 3.04Å; M433-C435 VanDerWaalsContact C-N 3.31Å; M433-T443 HydrophobicContact CE-CG2 4.34Å; M433-T443 WeakPolarHBondContact CE-OG1 3.24Å; M433-T443 HydrophobicContact CG-CG2 4.4Å; M433-T443 VanDerWaalsContact CG-OG1 3.28Å; M433-T443 WeakPolarHBondContact CG-OG1 3.47Å; M433-T443 HydrophobicContact SD-CG2 3.99Å
434	S	81.4	Confident	82	Confident	103 Å²	103	86.6 Å²	86.6	72%	0.72	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-93.2	18.5	178.5	60.4	0	0	0	0	113.3	W431 G432	W431-S434 PolarHBondContact O-N 3.15Å; W431-S434 VanDerWaalsContact O-N 3.15Å; W431-S434 PolarHBondContact O-OG 3.3Å; G432-S434 PolarHBondContact O-N 3.05Å
435	C	87.9	Confident	80.4	Confident	20 Å²	20	92.7 Å²	92.7	14%	0.135	50%	0.503	C	S	.	.			trans	-69.8	139.7	173.6	-164.2	0	0	0	0	111.9	W431 G432 M433 F437 H439	W431-C435 HydrophobicContact CB-CB 3.95Å; G432-C435 WeakPolarHBondContact O-CB 3.22Å; G432-C435 PolarHBondContact O-N 3.23Å; M433-C435 VanDerWaalsContact C-N 3.31Å; C435-F437 PolarHBondContact O-N 3.27Å; C435-H439 WeakPolarHBondContact CB-NE2 3.46Å
436	R	87.3	Confident	79	Confident	217 Å²	217	91.5 Å²	91.5	82%	0.819	51%	0.508	S	S	*	.	S	Bend	trans	-56.2	-18.3	171.4	-173.2	69.1	112.4	81.2	0.7	114.1
437	F	88.2	Confident	76.9	Confident	85 Å²	85	92.4 Å²	92.4	37%	0.373	52%	0.523	S	S	.	.	S	Bend	trans	-124.9	143.3	-171.1	-61	-74.4	0	0	0	109.3	P419 C421 C435 H439	P419-F437 HydrophobicContact CG-CD1 4.07Å; P419-F437 HydrophobicContact CG-CE1 4.27Å; P419-F437 WeakPolarHBondContact O-CA 3.34Å; P419-F437 VanDerWaalsContact O-CB 3.28Å; P419-F437 WeakPolarHBondContact O-CB 3.41Å; C421-F437 VanDerWaalsContact CA-CB 3.48Å; C421-F437 HydrophobicContact CB-CB 3.53Å; C435-F437 PolarHBondContact O-N 3.27Å; F437-H439 PolarHBondContact O-CD2 2.83Å; F437-H439 VanDerWaalsContact O-CD2 3.29Å
438	L	89.3	Confident	75.1	Confident	78 Å²	78	98.6 Å²	98.6	41%	0.408	53%	0.525	S	S	.	.	B	Isolated β-bridge	trans	-61.9	146.3	-173.1	-70.3	180	0	0	0	113.3	K418 P419 V420 C421 P440	K418-L438 HydrophobicContact CB-CD1 4.29Å; K418-L438 HydrophobicContact CB-CD2 4.5Å; K418-L438 HydrophobicContact CB-CG 3.98Å; K418-L438 WeakPolarHBondContact O-CD1 3.41Å; K418-L438 VanDerWaalsContact O-CG 3.3Å; K418-L438 WeakPolarHBondContact O-CG 3.28Å; P419-L438 PolarHBondContact O-N 2.77Å; P419-L438 VanDerWaalsContact O-N 3.14Å; V420-L438 HydrophobicContact CG2-CB 4.47Å; C421-L438 VanDerWaalsContact CB-O 3.26Å; C421-L438 WeakPolarHBondContact CB-O 3.31Å; C421-L438 PolarHBondContact N-O 2.97Å; L438-P440 VanDerWaalsContact O-CD 3.31Å; L438-P440 WeakPolarHBondContact O-CD 3.3Å
439	H	87.9	Confident	73.2	Confident	13 Å²	13	97.8 Å²	97.8	6%	0.06	53%	0.529	C	S	.	.			trans	-117	78.6	-179.4	-84.9	-150	0	0	0	111.4	C421 Y424 C429 G432 C435 F437 G441 V442	C421-H439 WeakPolarHBondContact CB-CD2 3.22Å; C421-H439 PolarHBondContact SG-NE2 2.84Å; C421-H439 VanDerWaalsContact SG-NE2 3.43Å; Y424-H439 WeakPolarHBondContact CB-NE2 3.45Å; Y424-H439 HydrophobicContact CD1-CB 3.98Å; Y424-H439 AromaticContact CD1-CG 3.95Å; Y424-H439 HydrophobicContact CD2-CB 4.19Å; Y424-H439 AromaticContact CD2-CE1 3.69Å; Y424-H439 AromaticContact CD2-CG 3.67Å; Y424-H439 AromaticContact CD2-ND1 3.31Å; Y424-H439 VanDerWaalsContact CD2-ND1 3.31Å; Y424-H439 WeakPolarHBondContact CD2-ND1 3.42Å; Y424-H439 VanDerWaalsContact CE1-C 3.47Å; Y424-H439 HydrophobicContact CE1-CB 4.05Å; Y424-H439 HydrophobicContact CE2-CB 4.25Å; Y424-H439 AromaticContact CE2-ND1 3.88Å; Y424-H439 HydrophobicContact CG-CB 4.05Å; Y424-H439 AromaticContact CG-CD2 3.73Å; Y424-H439 AromaticContact CG-CE1 3.88Å; Y424-H439 AromaticContact CG-CG 3.54Å; Y424-H439 AromaticContact CG-ND1 3.64Å; Y424-H439 AromaticContact CG-NE2 3.92Å; C429-H439 PolarHBondContact SG-CE1 3.14Å; C429-H439 PolarHBondContact SG-NE2 2.94Å; G432-H439 PolarHBondContact O-CE1 3.04Å; G432-H439 PolarHBondContact O-ND1 2.79Å; G432-H439 VanDerWaalsContact O-ND1 3.11Å; C435-H439 WeakPolarHBondContact CB-NE2 3.46Å; F437-H439 PolarHBondContact O-CD2 2.83Å; F437-H439 VanDerWaalsContact O-CD2 3.29Å; H439-G441 PolarHBondContact O-N 2.67Å; H439-V442 HydrophobicContact CB-CB 4.31Å; H439-V442 PolarHBondContact O-N 2.86Å
440	P	83.3	Confident	71.1	Confident	68 Å²	68	104.6 Å²	104.6	44%	0.442	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-48.7	113.2	-178.1	-30.2	35.1	0	0	0	113.3	V420 Y424 L438	V420-P440 HydrophobicContact CG1-CG 3.83Å; V420-P440 HydrophobicContact CG2-CG 3.91Å; Y424-P440 WeakPolarHBondContact CE1-O 3.49Å; Y424-P440 PolarHBondContact OH-O 2.7Å; L438-P440 VanDerWaalsContact O-CD 3.31Å; L438-P440 WeakPolarHBondContact O-CD 3.3Å
441	G	73.1	Confident	68.9	Low	61 Å²	61	107.1 Å²	107.1	63%	0.629	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	84.6	-3.6	178.9	0	0	0	0	0	117	H439 D444	H439-G441 PolarHBondContact O-N 2.67Å; G441-D444 PolarHBondContact N-OD2 3.02Å
442	V	64.2	Low	67	Low	63 Å²	63	107.1 Å²	107.1	38%	0.382	57%	0.572	S	S	.	*	S	Bend	trans	-105.3	75	164	165	0	0	0	0	108.2	Y424 H439	Y424-V442 HydrophobicContact CE2-CB 3.74Å; Y424-V442 HydrophobicContact CE2-CG2 3.65Å; Y424-V442 VanDerWaalsContact OH-CG2 3.32Å; Y424-V442 WeakPolarHBondContact OH-CG2 3.35Å; Y424-V442 PolarHBondContact OH-N 3.02Å; H439-V442 HydrophobicContact CB-CB 4.31Å; H439-V442 PolarHBondContact O-N 2.86Å
443	T	53.6	Low	65.1	Low	63 Å²	63	112.2 Å²	112.2	39%	0.387	59%	0.593	S	S	.	*			trans	68	67.8	177.3	77.3	0	0	0	0	117.8	M433 K445	M433-T443 HydrophobicContact CE-CG2 4.34Å; M433-T443 WeakPolarHBondContact CE-OG1 3.24Å; M433-T443 HydrophobicContact CG-CG2 4.4Å; M433-T443 VanDerWaalsContact CG-OG1 3.28Å; M433-T443 WeakPolarHBondContact CG-OG1 3.47Å; M433-T443 HydrophobicContact SD-CG2 3.99Å; T443-K445 PolarHBondContact O-N 3.18Å
444	D	55.2	Low	63.4	Low	85 Å²	85	112.3 Å²	112.3	46%	0.455	60%	0.602	S	S	.	*			trans	-74.1	45.9	140.5	-45	-71.7	0	0	0	109.5	G441	G441-D444 PolarHBondContact N-OD2 3.02Å
445	K	55.4	Low	61.7	Low	186 Å²	186	114 Å²	114	81%	0.809	60%	0.601	S	S	*	*			trans	-137.8	36.4	-163.4	-63.1	-162.8	176.5	-163.3	0	113.4	T443	T443-K445 PolarHBondContact O-N 3.18Å
446	G	56.6	Low	59.2	Low	64 Å²	64	124.4 Å²	124.4	66%	0.66	64%	0.637	S	S	*	*	S	Bend	trans	-134.7	114.7	166.7	0	0	0	0	0	108.3
447	N	45.8	Very low	57.3	Low	154 Å²	154	119.5 Å²	119.5	82%	0.824	63%	0.634	S	S	*	*			trans	45	86.4	-176.8	-74.2	23.4	0	0	0	116.6
448	Y	51.2	Low	54.7	Low	205 Å²	205	121.7 Å²	121.7	80%	0.804	65%	0.654	S	S	*	*			trans	-88	115.3	145.5	-98.9	-85.5	0	0	0	108.5	M450	Y448-M450 PolarHBondContact O-N 3.21Å
449	T	50.8	Low	52.4	Low	116 Å²	116	123.8 Å²	123.8	71%	0.712	67%	0.672	S	S	*	*			trans	-87.9	74.9	177.2	42.5	0	0	0	0	111.6	F451	T449-F451 VanDerWaalsContact C-N 3.26Å; T449-F451 PolarHBondContact O-N 2.86Å
450	M	46.6	Very low	49.8	Very low	164 Å²	164	131.5 Å²	131.5	81%	0.808	71%	0.71	S	S	*	*	S	Bend	trans	52.4	-21.7	156.1	-69.7	-69.1	-73.7	0	0	122.3	Y448	Y448-M450 PolarHBondContact O-N 3.21Å
451	F	41.9	Very low	47.3	Very low	187 Å²	187	137.4 Å²	137.4	82%	0.82	73%	0.732	S	S	*	*			trans	-134.1	81.5	-168.9	-59.7	-68.8	0	0	0	113.8	T449	T449-F451 VanDerWaalsContact C-N 3.26Å; T449-F451 PolarHBondContact O-N 2.86Å
452	D	45.3	Very low	45.1	Very low	148 Å²	148	138.5 Å²	138.5	79%	0.791	74%	0.743	S	S	*	*			trans	-153.6	96.2	139.7	-172	8.4	0	0	0	109.4
453	N	42.4	Very low	43.5	Very low	132 Å²	132	138.8 Å²	138.8	71%	0.706	76%	0.759	S	S	*	*			trans	-178.6	44	162.7	-104.1	-65.6	0	0	0	112.2	I455	N453-I455 PolarHBondContact O-N 3.04Å
454	V	43.4	Very low	42.4	Very low	147 Å²	147	141.1 Å²	141.1	89%	0.891	78%	0.778	S	S	*	*			trans	-82.5	76.2	167.4	-175.4	0	0	0	0	109
455	I	46.2	Very low	41.3	Very low	137 Å²	137	144 Å²	144	70%	0.703	80%	0.799	S	S	*	*			trans	-72.3	145.5	169.5	-62.5	176.9	0	0	0	108.8	N453	N453-I455 PolarHBondContact O-N 3.04Å
456	R	35.9	Very low	40.2	Very low	239 Å²	239	138.7 Å²	138.7	90%	0.902	80%	0.796	S	S	*	*			trans	-56.9	148.9	-173.4	-66.8	176.8	179.9	148.8	-0.9	113.5
457	P	47	Very low	39.2	Very low	115 Å²	115	140.2 Å²	140.2	75%	0.747	80%	0.803	S	S	*	*			trans	-94.6	-179.7	-162.8	38	-39.4	0	0	0	116.5
458	V	33.9	Very low	38.6	Very low	131 Å²	131	138.9 Å²	138.9	79%	0.794	81%	0.806	S	S	*	*			trans	83.8	140.9	163.6	-174.2	0	0	0	0	116.5
459	P	40.6	Very low	37.7	Very low	122 Å²	122	133.5 Å²	133.5	79%	0.792	80%	0.803	S	S	*	*			cis	-119.2	179.5	-7.5	26.7	-5.4	0	0	0	115.4
460	M	32.5	Very low	37.8	Very low	175 Å²	175	133.8 Å²	133.8	86%	0.862	81%	0.808	S	S	*	*			trans	-102.7	163.1	176.8	-57.7	-164	78.6	0	0	114.2
461	Q	31.1	Very low	37	Very low	192 Å²	192	130.9 Å²	130.9	90%	0.897	81%	0.809	S	S	*	*			trans	-159.8	107.6	155.2	-155.3	80.6	51.1	0	0	115
462	G	28.4	Very low	36.5	Very low	84 Å²	84	126.4 Å²	126.4	87%	0.866	81%	0.807	S	S	*	*			trans	68.9	156.8	159.4	0	0	0	0	0	119.7
463	G	29	Very low	36.7	Very low	69 Å²	69	125.6 Å²	125.6	71%	0.711	81%	0.81	S	S	*	*			cis	178.4	120.2	-9.4	0	0	0	0	0	115.7
464	S	32.1	Very low	36.2	Very low	111 Å²	111	124.6 Å²	124.6	78%	0.776	81%	0.813	S	S	*	*			trans	52.8	154.2	144.3	62.4	0	0	0	0	125.6
465	T	32	Very low	36	Very low	146 Å²	146	122.8 Å²	122.8	90%	0.896	81%	0.807	S	S	*	*			trans	76.8	148.9	167.5	74.2	0	0	0	0	118.5
466	G	31.8	Very low	35.3	Very low	74 Å²	74	122.5 Å²	122.5	76%	0.763	81%	0.812	S	S	*	*			cis	164	90.7	-10.9	0	0	0	0	0	117.2
467	A	35.3	Very low	35.1	Very low	97 Å²	97	116 Å²	116	80%	0.802	81%	0.809	S	S	*	*			trans	57.4	130.2	150.4	0	0	0	0	0	124.1
468	S	33.6	Very low	34.3	Very low	126 Å²	126	115 Å²	115	88%	0.881	81%	0.811	S	S	*	*			trans	79.8	148	140	-60.6	0	0	0	0	123.4
469	A	30.9	Very low	35.2	Very low	91 Å²	91	114 Å²	114	75%	0.752	81%	0.807	S	S	*	*			trans	-114.7	-167.6	173.8	0	0	0	0	0	109.2
470	P	53.7	Low	34.8	Very low	123 Å²	123	119.7 Å²	119.7	80%	0.799	81%	0.813	S	S	*	*			cis	-144.8	-162.8	9.6	44.7	-23.4	0	0	0	117.1
471	A	30.4	Very low	34.8	Very low	102 Å²	102	116.1 Å²	116.1	84%	0.843	81%	0.81	S	S	*	*			trans	89.7	157.3	156.2	0	0	0	0	0	121
472	A	31.3	Very low	34.9	Very low	93 Å²	93	110.9 Å²	110.9	77%	0.769	81%	0.808	S	S	*	*			trans	-140.5	171.3	-177	0	0	0	0	0	110.7
473	P	49.1	Very low	35	Very low	132 Å²	132	110.1 Å²	110.1	86%	0.857	80%	0.801	S	S	*	*				-153.5	-175.2	107.6	39.7	-20.8	0	0	0	117.2
474	S	32.7	Very low	35.1	Very low	111 Å²	111	113 Å²	113	78%	0.776	81%	0.809	S	S	*	*			trans	-72.2	158.4	-167.3	-38.2	0	0	0	0	119.7
475	S	37.8	Very low	35.2	Very low	109 Å²	109	112 Å²	112	76%	0.762	81%	0.808	S	S	*	*			trans	173.7	159.1	135.4	-84	0	0	0	0	112.9
476	T	32.6	Very low	35.3	Very low	130 Å²	130	115.4 Å²	115.4	80%	0.798	81%	0.806	S	S	*	*			cis	-165	175.5	-34.1	30.1	0	0	0	0	109.6
477	A	31.3	Very low	35.2	Very low	103 Å²	103	116.5 Å²	116.5	85%	0.851	80%	0.802	S	S	*	*			trans	88.2	142.4	159.1	0	0	0	0	0	121.4
478	A	29.3	Very low	34.9	Very low	95 Å²	95	117.2 Å²	117.2	79%	0.785	80%	0.801	S	S	*	*			trans	-147.7	-157.1	-175.8	0	0	0	0	0	108.8
479	P	53.1	Low	34.7	Very low	108 Å²	108	119.2 Å²	119.2	70%	0.701	80%	0.796	S	S	*	*			cis	-152.9	-175.2	28.8	47.4	-25.8	0	0	0	119.5
480	R	33.1	Very low	34.6	Very low	243 Å²	243	119 Å²	119	92%	0.917	79%	0.794	S	S	*	*			trans	72.7	137.7	161.1	-65.9	178	176.8	-161.5	-5.2	117.7
481	A	32.5	Very low	33.4	Very low	99 Å²	99	118.7 Å²	118.7	82%	0.818	80%	0.795	S	S	*	*			cis	-142.4	164.2	-3.9	0	0	0	0	0	109
482	G	33	Very low	33.5	Very low	82 Å²	82	118 Å²	118	85%	0.845	79%	0.79	S	S	*	*			cis	118.5	115	9.8	0	0	0	0	0	110.5
483	G	31.1	Very low	33.5	Very low	69 Å²	69	120 Å²	120	71%	0.711	79%	0.793	S	S	*	*			cis	-139.2	168.7	-0.2	0	0	0	0	0	112.3
484	S	30.8	Very low	32.7	Very low	128 Å²	128	117.8 Å²	117.8	90%	0.895	79%	0.785	S	S	*	*				78.8	130	81.6	-161.5	0	0	0	0	112.4
485	A	34.7	Very low	32.6	Very low	91 Å²	91	119.5 Å²	119.5	75%	0.752	79%	0.786	S	S	*	*			cis	-142.3	170.9	6.4	0	0	0	0	0	110.1
486	Y	33.7	Very low	32.1	Very low	217 Å²	217	123.6 Å²	123.6	85%	0.851	79%	0.786	S	S	*	*			cis	-135.8	154.3	9.9	73.3	-78.9	0	0	0	112.7
487	S	29	Very low	32.1	Very low	97 Å²	97	126 Å²	126	68%	0.678	79%	0.787	S	S	*	*			trans	-132.2	140.4	173.9	-76.7	0	0	0	0	110
488	S	30.3	Very low	32	Very low	112 Å²	112	126.2 Å²	126.2	78%	0.783	78%	0.775	S	S	*	*			trans	-159.9	115.7	153.5	-75.7	0	0	0	0	105.2
489	H	28.7	Very low	32.3	Very low	168 Å²	168	133.1 Å²	133.1	78%	0.778	78%	0.782	S	S	*	*			cis	58.6	125.7	22.8	-71.4	-88.1	0	0	0	113.5
490	A	28.5	Very low	31.2	Very low	86 Å²	86	137.4 Å²	137.4	71%	0.711	78%	0.784	S	S	*	*			cis	-156.1	173.8	-4	0	0	0	0	0	113.1
491	S	29.6	Very low	31.3	Very low	117 Å²	117	131.2 Å²	131.2	82%	0.818	77%	0.774	S	S	*	*			trans	-47	161.6	166.9	53.4	0	0	0	0	114.7
492	A	31.6	Very low	31.2	Very low	88 Å²	88	134.7 Å²	134.7	73%	0.727	77%	0.773	S	S	*	*			cis	-145	-174.9	21.5	0	0	0	0	0	110.1
493	T	30.7	Very low	31.2	Very low	136 Å²	136	139.9 Å²	139.9	83%	0.834	77%	0.767	S	S	*	*			cis	-153.1	177.8	33.8	49.8	0	0	0	0	113.2
494	A	32.3	Very low	31.4	Very low	84 Å²	84	141.3 Å²	141.3	69%	0.694	76%	0.764	S	S	*	*			trans	100.7	125.6	160.6	0	0	0	0	0	119.2
495	D	30.6	Very low	31.4	Very low	148 Å²	148	142.6 Å²	142.6	79%	0.791	76%	0.76	S	S	*	*			trans	54	124.6	146.6	-66.1	-71	0	0	0	126.1
496	Y	27.7	Very low	31.4	Very low	194 Å²	194	145.6 Å²	145.6	76%	0.761	76%	0.758	S	S	*	*			trans	57.5	118.8	137.8	-103.1	-132.2	0	0	0	122.8
497	H	32	Very low	31.3	Very low	180 Å²	180	144 Å²	144	83%	0.833	76%	0.758	S	S	*	*			trans	51.4	125.6	152.8	-59.1	-43.3	0	0	0	121.9
498	D	30.8	Very low	31.7	Very low	109 Å²	109	150 Å²	150	58%	0.583	77%	0.766	S	S	*	*				-178.9	125.7	108.4	-173.8	9.5	0	0	0	108.9	R500	D498-R500 HydrophobicContact CB-CB 4.43Å; D498-R500 PolarHBondContact O-N 3.01Å; D498-R500 WeakPolarHBondContact OD2-CD 3.41Å; D498-R500 IonicContact OD2-NH1 3.19Å; D498-R500 PolarHBondContact OD2-NH1 2.95Å
499	Y	34.9	Very low	31.9	Very low	240 Å²	240	150 Å²	150	94%	0.941	76%	0.763	S	S	*	*			trans	-83.9	61.1	-179.2	-111.8	-76.3	0	0	0	111.3	T501	Y499-T501 PolarHBondContact O-N 3.39Å
500	R	30.3	Very low	32.2	Very low	197 Å²	197	147.3 Å²	147.3	74%	0.743	76%	0.76	S	S	*	*			trans	-94	92.6	-164	-158.8	179.2	-169.6	115.7	-6.9	114.5	D498	D498-R500 HydrophobicContact CB-CB 4.43Å; D498-R500 PolarHBondContact O-N 3.01Å; D498-R500 WeakPolarHBondContact OD2-CD 3.41Å; D498-R500 IonicContact OD2-NH1 3.19Å; D498-R500 PolarHBondContact OD2-NH1 2.95Å
501	T	35.5	Very low	32.5	Very low	114 Å²	114	151.6 Å²	151.6	70%	0.699	77%	0.77	S	S	*	*			trans	65.6	77.6	152.1	-41.7	0	0	0	0	116.8	Y499 R503	Y499-T501 PolarHBondContact O-N 3.39Å; T501-R503 HydrophobicContact CG2-CB 4.41Å
502	E	29.4	Very low	32.7	Very low	172 Å²	172	153.3 Å²	153.3	80%	0.804	77%	0.769	S	S	*	*			trans	-87.6	122.6	142.1	-99.9	-63.2	177.1	0	0	109.4	P504	E502-P504 WeakPolarHBondContact OE2-CD 3.26Å
503	R	34	Very low	32.6	Very low	191 Å²	191	158.5 Å²	158.5	72%	0.721	78%	0.778	S	S	*	*			trans	-160.5	93.3	174.8	-169.9	176.4	-177.4	150.6	1	113.8	T501 H506	T501-R503 HydrophobicContact CG2-CB 4.41Å; R503-H506 PolarHBondContact NH2-NE2 2.8Å
504	P	34.8	Very low	32.5	Very low	98 Å²	98	156.1 Å²	156.1	64%	0.636	77%	0.773	S	S	*	*			trans	-106.7	129.1	149.3	-9.6	29.5	0	0	0	113	E502	E502-P504 WeakPolarHBondContact OE2-CD 3.26Å
505	L	29.8	Very low	33	Very low	156 Å²	156	157.6 Å²	157.6	82%	0.817	78%	0.775	S	S	*	*			trans	69.3	129.1	148.5	-55	175.6	0	0	0	120.6
506	H	35.4	Very low	32.9	Very low	153 Å²	153	155.6 Å²	155.6	71%	0.708	77%	0.773	S	S	*	*			trans	-75.3	137.4	163.3	-71.1	-107.8	0	0	0	110.7	R503	R503-H506 PolarHBondContact NH2-NE2 2.8Å
507	H	31	Very low	33.5	Very low	184 Å²	184	152.9 Å²	152.9	85%	0.852	77%	0.77	S	S	*	*			trans	-122.2	112.7	152.3	-90.9	-70.8	0	0	0	111.1
508	R	38.1	Very low	33.7	Very low	224 Å²	224	155.4 Å²	155.4	85%	0.845	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-103	122.2	170.7	175.4	-179.1	-175.8	166.6	4.7	108.5
509	P	33.9	Very low	33.8	Very low	112 Å²	112	153.4 Å²	153.4	73%	0.727	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-72.4	136.4	165.1	30.1	-31.9	0	0	0	109.5
510	P	36.4	Very low	33.8	Very low	111 Å²	111	146.8 Å²	146.8	72%	0.721	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-88.6	140.7	176.7	34.1	-32.4	0	0	0	111.4
511	L	34.4	Very low	34.2	Very low	176 Å²	176	143 Å²	143	92%	0.921	78%	0.775	S	S	*	*			trans	-127	113.7	150.9	-76	179.2	0	0	0	108.8
512	L	33.8	Very low	34.2	Very low	152 Å²	152	144.2 Å²	144.2	80%	0.796	78%	0.782	S	S	*	*			trans	-78	144.6	155.6	-64	167.7	0	0	0	107.4
513	H	28.1	Very low	34.3	Very low	197 Å²	197	145.3 Å²	145.3	91%	0.912	79%	0.786	S	S	*	*				-165.1	159.2	119.2	-96.3	91.7	0	0	0	108.4
514	A	28.8	Very low	34.4	Very low	87 Å²	87	143.1 Å²	143.1	72%	0.719	79%	0.789	S	S	*	*			trans	-132.4	-157.7	-179.4	0	0	0	0	0	107.6
515	P	43.4	Very low	34.2	Very low	114 Å²	114	143.2 Å²	143.2	74%	0.74	80%	0.798	S	S	*	*			cis	-122.3	162.5	-44.8	35.2	-22.6	0	0	0	112.1
516	S	28.5	Very low	34.5	Very low	107 Å²	107	146.7 Å²	146.7	75%	0.748	80%	0.8	S	S	*	*			trans	-160.2	116.7	152.7	-148.7	0	0	0	0	107.8
517	I	40.9	Very low	34.7	Very low	137 Å²	137	145.6 Å²	145.6	70%	0.703	81%	0.805	S	S	*	*				59.9	78.7	71.7	-50	166.8	0	0	0	111.8
518	Y	36.1	Very low	35.1	Very low	233 Å²	233	144.7 Å²	144.7	91%	0.914	81%	0.805	S	S	*	*				-165.2	177.6	119.6	-109.6	-77.9	0	0	0	109.5
519	G	32.5	Very low	35.3	Very low	67 Å²	67	141.3 Å²	141.3	69%	0.691	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-66.4	155.6	-159.8	0	0	0	0	0	117
520	A	34.2	Very low	36	Very low	101 Å²	101	141.9 Å²	141.9	84%	0.835	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-77.7	130.7	172.2	0	0	0	0	0	111.2
521	P	39.6	Very low	36.3	Very low	118 Å²	118	144.3 Å²	144.3	77%	0.766	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-83	149.5	170.4	33.5	-32.9	0	0	0	111.4
522	V	36.1	Very low	36.9	Very low	138 Å²	138	139.1 Å²	139.1	84%	0.836	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-84.6	137.2	171.2	-172.3	0	0	0	0	108.5	D524	V522-D524 PolarHBondContact O-N 3.37Å
523	H	31.3	Very low	37.3	Very low	195 Å²	195	136 Å²	136	90%	0.903	80%	0.799	S	S	*	*			trans	-79.1	94.9	171.6	-80.1	-79.9	0	0	0	110.7
524	D	35	Very low	38.1	Very low	145 Å²	145	132 Å²	132	78%	0.775	79%	0.791	S	S	*	*			trans	-149.1	123.6	151.9	-155.2	-12.9	0	0	0	110.1	V522	V522-D524 PolarHBondContact O-N 3.37Å
525	A	30.9	Very low	39.3	Very low	101 Å²	101	133.8 Å²	133.8	84%	0.835	79%	0.792	S	S	*	*			trans	-167.9	67.1	-178.1	0	0	0	0	0	109.7
526	R	35.5	Very low	39.9	Very low	228 Å²	228	133.4 Å²	133.4	86%	0.86	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-65	140.9	174.4	-164.8	174.6	-171.6	143.4	-1.9	110.4	L528	R526-L528 PolarHBondContact O-N 3.33Å
527	T	40.8	Very low	41.4	Very low	131 Å²	131	134 Å²	134	80%	0.804	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-55.4	132.5	-176.9	-41	0	0	0	0	112.1
528	L	39	Very low	42.5	Very low	164 Å²	164	129.8 Å²	129.8	86%	0.859	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-75.9	129.1	176.2	-63.9	170.2	0	0	0	110.5	R526	R526-L528 PolarHBondContact O-N 3.33Å
529	L	41.9	Very low	45	Very low	154 Å²	154	123.5 Å²	123.5	81%	0.806	75%	0.746	S	S	*	*			trans	-107.8	154.8	154.6	-104.6	73	0	0	0	108.4
530	P	49.3	Very low	47.3	Very low	124 Å²	124	124.3 Å²	124.3	81%	0.805	75%	0.746	S	S	*	*			trans	-79.2	132.4	-172	31.1	-34.4	0	0	0	113.5
531	D	42.8	Very low	49.5	Very low	161 Å²	161	128.9 Å²	128.9	86%	0.861	74%	0.742	S	S	*	*	S	Bend	trans	49	152.6	142.3	-144.4	5.7	0	0	0	123.2	A533	D531-A533 PolarHBondContact O-N 2.89Å
532	G	46.6	Very low	51.9	Low	68 Å²	68	127.8 Å²	127.8	70%	0.701	73%	0.727	S	S	*	*			trans	79.8	-43.4	151.7	0	0	0	0	0	118.8	P534	G532-P534 WeakPolarHBondContact O-CD 3.3Å
533	A	42.4	Very low	54.6	Low	85 Å²	85	126.4 Å²	126.4	70%	0.702	71%	0.706	S	S	*	*			trans	-72	123.3	-169.3	0	0	0	0	0	112.7	D531 V535	D531-A533 PolarHBondContact O-N 2.89Å; A533-V535 PolarHBondContact O-N 3.07Å; A533-V535 VanDerWaalsContact O-N 3.13Å
534	P	44.7	Very low	57.7	Low	115 Å²	115	119 Å²	119	75%	0.747	68%	0.683	S	S	*	*			trans	-66	117.3	173.3	27.2	-32.8	0	0	0	109	G532 V536	G532-P534 WeakPolarHBondContact O-CD 3.3Å; P534-V536 PolarHBondContact O-N 3.16Å
535	V	54	Low	60.5	Low	123 Å²	123	116.9 Å²	116.9	75%	0.745	67%	0.671	S	S	*	*			trans	-64.1	99.8	175.9	179.7	0	0	0	0	108.2	A533 V537	A533-V535 PolarHBondContact O-N 3.07Å; A533-V535 VanDerWaalsContact O-N 3.13Å; V535-V537 HydrophobicContact CG1-CG2 4.3Å; V535-V537 PolarHBondContact O-N 2.71Å
536	V	57	Low	63.4	Low	106 Å²	106	118.4 Å²	118.4	64%	0.642	66%	0.655	S	S	*	*			trans	-61.6	103.9	167.1	-177.6	0	0	0	0	106.1	P534 E538	P534-V536 PolarHBondContact O-N 3.16Å; V536-E538 HydrophobicContact CB-CG 4.43Å; V536-E538 HydrophobicContact CG1-CG 3.94Å; V536-E538 WeakPolarHBondContact O-CG 3.24Å; V536-E538 PolarHBondContact O-N 2.84Å
537	V	58.6	Low	66.1	Low	121 Å²	121	111.3 Å²	111.3	73%	0.733	64%	0.637	S	S	*	*			trans	-76.9	72.2	173.3	-174.3	0	0	0	0	107	V535 N539	V535-V537 HydrophobicContact CG1-CG2 4.3Å; V535-V537 PolarHBondContact O-N 2.71Å; V537-N539 PolarHBondContact O-N 2.93Å
538	E	65.3	Low	68.6	Low	47 Å²	47	107.8 Å²	107.8	22%	0.22	62%	0.621	C	S	.	*			trans	-51.9	125.6	177.9	-41.3	170.9	115.8	0	0	107.9	V536 E542 R543 R546	V536-E538 HydrophobicContact CB-CG 4.43Å; V536-E538 HydrophobicContact CG1-CG 3.94Å; V536-E538 WeakPolarHBondContact O-CG 3.24Å; V536-E538 PolarHBondContact O-N 2.84Å; E538-E542 WeakPolarHBondContact CA-OE2 3.37Å; E538-R543 HydrophobicContact CB-CG 3.88Å; E538-R543 PolarHBondContact O-NH1 3.01Å; E538-R543 IonicContact OE2-CZ 3.19Å; E538-R543 IonicContact OE2-NE 2.79Å; E538-R543 PolarHBondContact OE2-NE 3.18Å; E538-R543 IonicContact OE2-NH2 2.89Å; E538-R543 PolarHBondContact OE2-NH2 3.07Å; E538-R546 VanDerWaalsContact CD-NH1 3.26Å; E538-R546 IonicContact OE1-CZ 3.68Å; E538-R546 IonicContact OE1-NH1 2.67Å; E538-R546 PolarHBondContact OE1-NH1 3.23Å; E538-R546 IonicContact OE1-NH2 2.7Å; E538-R546 PolarHBondContact OE1-NH2 2.9Å; E538-R546 IonicContact OE2-NH1 3.53Å
539	N	88	Confident	71.3	Confident	101 Å²	101	106.8 Å²	106.8	54%	0.54	61%	0.61	S	S	.	*			trans	-61.4	149.9	-168.8	-159.3	-9.8	0	0	0	109.4	V537 W541 E542 R543	V537-N539 PolarHBondContact O-N 2.93Å; N539-W541 PolarHBondContact O-N 3.38Å; N539-E542 HydrophobicContact CB-CB 4.36Å; N539-E542 HydrophobicContact CB-CG 3.93Å; N539-E542 PolarHBondContact N-OE2 2.83Å; N539-E542 WeakPolarHBondContact O-CA 3.34Å; N539-E542 WeakPolarHBondContact O-CB 3.37Å; N539-E542 PolarHBondContact O-N 3.38Å; N539-R543 PolarHBondContact O-N 2.8Å
540	A	81.1	Confident	73.8	Confident	84 Å²	84	104.9 Å²	104.9	69%	0.694	60%	0.597	S	S	*	*	H	α-helix	trans	-55.9	-32.8	-176.5	0	0	0	0	0	111.7	G544	A540-G544 PolarHBondContact O-N 3.47Å
541	W	79.6	Confident	75.8	Confident	197 Å²	197	105.3 Å²	105.3	75%	0.746	59%	0.59	S	S	*	*	H	α-helix	trans	-71.1	-38.3	172.7	-174	52.9	0	0	0	114	N539 G544 L545	N539-W541 PolarHBondContact O-N 3.38Å; W541-G544 PolarHBondContact O-N 3.22Å; W541-L545 VanDerWaalsContact O-CB 3.26Å; W541-L545 WeakPolarHBondContact O-CB 3.44Å; W541-L545 PolarHBondContact O-N 2.98Å
542	E	90.5	Very high	78	Confident	95 Å²	95	103.8 Å²	103.8	44%	0.444	58%	0.579	S	S	.	*	H	α-helix	trans	-65.9	-40.7	175.8	-66.7	172	155.3	0	0	111.2	E538 N539 L545 R546	E538-E542 WeakPolarHBondContact CA-OE2 3.37Å; N539-E542 HydrophobicContact CB-CB 4.36Å; N539-E542 HydrophobicContact CB-CG 3.93Å; N539-E542 PolarHBondContact N-OE2 2.83Å; N539-E542 WeakPolarHBondContact O-CA 3.34Å; N539-E542 WeakPolarHBondContact O-CB 3.37Å; N539-E542 PolarHBondContact O-N 3.38Å; E542-L545 PolarHBondContact O-N 3.44Å; E542-R546 WeakPolarHBondContact O-CG 3.45Å; E542-R546 PolarHBondContact O-N 3.32Å
543	R	92.3	Very high	80.2	Confident	109 Å²	109	108.1 Å²	108.1	41%	0.411	57%	0.574	S	S	.	*	H	α-helix	trans	-62.1	-50.8	172.7	-68.9	-172.8	163.6	121.4	-1.9	110.8	E538 N539 L545 R546 T547	E538-R543 HydrophobicContact CB-CG 3.88Å; E538-R543 PolarHBondContact O-NH1 3.01Å; E538-R543 IonicContact OE2-CZ 3.19Å; E538-R543 IonicContact OE2-NE 2.79Å; E538-R543 PolarHBondContact OE2-NE 3.18Å; E538-R543 IonicContact OE2-NH2 2.89Å; E538-R543 PolarHBondContact OE2-NH2 3.07Å; N539-R543 PolarHBondContact O-N 2.8Å; R543-L545 VanDerWaalsContact C-N 3.3Å; R543-L545 PolarHBondContact O-N 3.24Å; R543-R546 PolarHBondContact O-N 2.85Å; R543-R546 VanDerWaalsContact O-N 3.16Å; R543-T547 PolarHBondContact O-N 2.71Å; R543-T547 PolarHBondContact O-OG1 2.78Å; R543-T547 VanDerWaalsContact O-OG1 3.07Å
544	G	95.9	Very high	82.7	Confident	39 Å²	39	109.9 Å²	109.9	40%	0.402	57%	0.566	S	S	.	*	H	α-helix	trans	-55.4	-42.2	174.4	0	0	0	0	0	113.3	A540 W541 T547 A548	A540-G544 PolarHBondContact O-N 3.47Å; W541-G544 PolarHBondContact O-N 3.22Å; G544-T547 PolarHBondContact O-N 2.79Å; G544-A548 VanDerWaalsContact O-CB 3.3Å; G544-A548 WeakPolarHBondContact O-CB 3.29Å; G544-A548 PolarHBondContact O-N 3.44Å
545	L	94.4	Very high	84.7	Confident	101 Å²	101	106.9 Å²	106.9	53%	0.529	55%	0.551	S	S	.	*	H	α-helix	trans	-68.7	-35.4	179.1	-163.5	71.7	0	0	0	112.1	W541 E542 R543 K549	W541-L545 VanDerWaalsContact O-CB 3.26Å; W541-L545 WeakPolarHBondContact O-CB 3.44Å; W541-L545 PolarHBondContact O-N 2.98Å; E542-L545 PolarHBondContact O-N 3.44Å; R543-L545 VanDerWaalsContact C-N 3.3Å; R543-L545 PolarHBondContact O-N 3.24Å; L545-K549 VanDerWaalsContact O-CB 3.24Å; L545-K549 WeakPolarHBondContact O-CB 3.3Å; L545-K549 PolarHBondContact O-N 3.44Å
546	R	91.7	Very high	86.4	Confident	134 Å²	134	104.7 Å²	104.7	51%	0.506	54%	0.535	S	S	.	.	H	α-helix	trans	-70	-44	171.5	-66.4	-148.9	-147.4	93.7	-10.9	112.2	E538 E542 R543 A548 K549 E550	E538-R546 VanDerWaalsContact CD-NH1 3.26Å; E538-R546 IonicContact OE1-CZ 3.68Å; E538-R546 IonicContact OE1-NH1 2.67Å; E538-R546 PolarHBondContact OE1-NH1 3.23Å; E538-R546 IonicContact OE1-NH2 2.7Å; E538-R546 PolarHBondContact OE1-NH2 2.9Å; E538-R546 IonicContact OE2-NH1 3.53Å; E542-R546 WeakPolarHBondContact O-CG 3.45Å; E542-R546 PolarHBondContact O-N 3.32Å; R543-R546 PolarHBondContact O-N 2.85Å; R543-R546 VanDerWaalsContact O-N 3.16Å; R546-A548 VanDerWaalsContact C-N 3.32Å; R546-A548 PolarHBondContact O-N 2.83Å; R546-K549 PolarHBondContact O-N 3.15Å; R546-E550 WeakPolarHBondContact O-CB 3.46Å; R546-E550 PolarHBondContact O-N 2.87Å
547	T	93.3	Very high	87.9	Confident	79 Å²	79	105.3 Å²	105.3	49%	0.485	53%	0.529	S	S	.	.	H	α-helix	trans	-61.3	-41.3	175.8	-51.5	0	0	0	0	111.3	R543 G544 E550 M551	R543-T547 PolarHBondContact O-N 2.71Å; R543-T547 PolarHBondContact O-OG1 2.78Å; R543-T547 VanDerWaalsContact O-OG1 3.07Å; G544-T547 PolarHBondContact O-N 2.79Å; T547-E550 PolarHBondContact O-N 3.1Å; T547-M551 WeakPolarHBondContact O-CB 3.25Å; T547-M551 WeakPolarHBondContact O-CG 3.46Å; T547-M551 PolarHBondContact O-N 2.73Å
548	A	92.4	Very high	89	Confident	57 Å²	57	107 Å²	107	47%	0.471	52%	0.522	S	S	.	.	H	α-helix	trans	-63.6	-43.8	173.9	0	0	0	0	0	112.3	G544 R546 E550 M551 M552	G544-A548 VanDerWaalsContact O-CB 3.3Å; G544-A548 WeakPolarHBondContact O-CB 3.29Å; G544-A548 PolarHBondContact O-N 3.44Å; R546-A548 VanDerWaalsContact C-N 3.32Å; R546-A548 PolarHBondContact O-N 2.83Å; A548-E550 VanDerWaalsContact C-N 3.32Å; A548-E550 PolarHBondContact O-N 2.94Å; A548-M551 PolarHBondContact O-N 2.92Å; A548-M552 WeakPolarHBondContact O-CB 3.34Å; A548-M552 PolarHBondContact O-N 3.12Å
549	K	95.9	Very high	89.8	Confident	142 Å²	142	111.1 Å²	111.1	62%	0.617	54%	0.539	S	S	*	.	H	α-helix	trans	-68.2	-30.6	177.2	-168.3	166.1	-172.3	168.1	0	112.8	L545 R546 R553	L545-K549 VanDerWaalsContact O-CB 3.24Å; L545-K549 WeakPolarHBondContact O-CB 3.3Å; L545-K549 PolarHBondContact O-N 3.44Å; R546-K549 PolarHBondContact O-N 3.15Å; K549-R553 WeakPolarHBondContact O-CB 3.36Å; K549-R553 PolarHBondContact O-N 3.24Å
550	E	93.7	Very high	89.2	Confident	114 Å²	114	112.1 Å²	112.1	53%	0.533	54%	0.541	S	S	.	.	H	α-helix	trans	-71.8	-44.8	171.2	-169.4	-174.2	155.1	0	0	111.3	R546 T547 A548 M552 R553 K554	R546-E550 WeakPolarHBondContact O-CB 3.46Å; R546-E550 PolarHBondContact O-N 2.87Å; T547-E550 PolarHBondContact O-N 3.1Å; A548-E550 VanDerWaalsContact C-N 3.32Å; A548-E550 PolarHBondContact O-N 2.94Å; E550-M552 VanDerWaalsContact C-N 3.34Å; E550-M552 PolarHBondContact O-N 3.25Å; E550-R553 PolarHBondContact O-N 3.44Å; E550-K554 VanDerWaalsContact O-CB 3.29Å; E550-K554 WeakPolarHBondContact O-CB 3.33Å; E550-K554 PolarHBondContact O-N 3.45Å
551	M	92	Very high	89.1	Confident	134 Å²	134	114.3 Å²	114.3	66%	0.66	54%	0.537	S	S	*	.	H	α-helix	trans	-59.2	-43.4	173.1	-77.5	-173.8	69.8	0	0	111.7	T547 A548 K554 A555	T547-M551 WeakPolarHBondContact O-CB 3.25Å; T547-M551 WeakPolarHBondContact O-CG 3.46Å; T547-M551 PolarHBondContact O-N 2.73Å; A548-M551 PolarHBondContact O-N 2.92Å; M551-K554 CarbonylContact O-C 3.47Å; M551-K554 PolarHBondContact O-N 3.03Å; M551-A555 WeakPolarHBondContact O-CB 3.35Å; M551-A555 PolarHBondContact O-N 2.9Å
552	M	88.7	Confident	89.1	Confident	128 Å²	128	107.8 Å²	107.8	63%	0.631	52%	0.516	S	S	*	.	H	α-helix	trans	-61.6	-45.1	174.8	-171.7	-175.1	-175.2	0	0	111.5	A548 E550 K554 A555 N556	A548-M552 WeakPolarHBondContact O-CB 3.34Å; A548-M552 PolarHBondContact O-N 3.12Å; E550-M552 VanDerWaalsContact C-N 3.34Å; E550-M552 PolarHBondContact O-N 3.25Å; M552-K554 VanDerWaalsContact C-N 3.33Å; M552-K554 PolarHBondContact O-N 2.89Å; M552-A555 PolarHBondContact O-N 2.91Å; M552-N556 PolarHBondContact O-N 2.91Å
553	R	93.7	Very high	88	Confident	159 Å²	159	111.3 Å²	111.3	60%	0.6	54%	0.535	S	S	*	.	H	α-helix	trans	-62.7	-38.8	174.5	-170.3	-174.3	-62.7	121.5	-2.5	112.1	K549 E550 A555 K557	K549-R553 WeakPolarHBondContact O-CB 3.36Å; K549-R553 PolarHBondContact O-N 3.24Å; E550-R553 PolarHBondContact O-N 3.44Å; R553-A555 VanDerWaalsContact C-N 3.32Å; R553-K557 VanDerWaalsContact O-CB 3.27Å; R553-K557 WeakPolarHBondContact O-CB 3.27Å; R553-K557 PolarHBondContact O-N 3.02Å
554	K	93.8	Very high	87	Confident	123 Å²	123	109.8 Å²	109.8	54%	0.535	54%	0.535	S	S	.	.	H	α-helix	trans	-76.3	-18.2	178.2	-159.5	175.6	-176.6	172.5	0	112.5	E550 M551 M552 R558	E550-K554 VanDerWaalsContact O-CB 3.29Å; E550-K554 WeakPolarHBondContact O-CB 3.33Å; E550-K554 PolarHBondContact O-N 3.45Å; M551-K554 CarbonylContact O-C 3.47Å; M551-K554 PolarHBondContact O-N 3.03Å; M552-K554 VanDerWaalsContact C-N 3.33Å; M552-K554 PolarHBondContact O-N 2.89Å; K554-R558 WeakPolarHBondContact O-CG 3.35Å; K554-R558 PolarHBondContact O-N 2.88Å; K554-R558 PolarHBondContact O-NH1 3.27Å
555	A	87.9	Confident	85.9	Confident	51 Å²	51	111.3 Å²	111.3	42%	0.421	53%	0.531	S	S	.	.	H	α-helix	trans	-80.7	-51.4	169.6	0	0	0	0	0	110.3	M551 M552 R553 K557 R558 K559	M551-A555 WeakPolarHBondContact O-CB 3.35Å; M551-A555 PolarHBondContact O-N 2.9Å; M552-A555 PolarHBondContact O-N 2.91Å; R553-A555 VanDerWaalsContact C-N 3.32Å; A555-K557 PolarHBondContact O-N 2.86Å; A555-R558 PolarHBondContact O-N 3.22Å; A555-R558 VanDerWaalsContact O-N 3.07Å; A555-K559 PolarHBondContact O-N 2.77Å
556	N	88.2	Confident	84.9	Confident	78 Å²	78	111.9 Å²	111.9	42%	0.417	53%	0.531	S	S	.	.	H	α-helix	trans	-56.9	-47	174.1	-80.6	31.2	0	0	0	111.6	M552 R558 K559 E560	M552-N556 PolarHBondContact O-N 2.91Å; N556-R558 VanDerWaalsContact C-N 3.28Å; N556-R558 PolarHBondContact O-N 3.42Å; N556-K559 CarbonylContact O-C 3.59Å; N556-K559 WeakPolarHBondContact O-CA 3.36Å; N556-K559 WeakPolarHBondContact O-CB 3.25Å; N556-K559 PolarHBondContact O-N 3.03Å; N556-E560 WeakPolarHBondContact O-CB 3.46Å; N556-E560 VanDerWaalsContact O-CG 3.31Å; N556-E560 WeakPolarHBondContact O-CG 3.02Å; N556-E560 PolarHBondContact O-N 3.01Å
557	K	88.7	Confident	84.2	Confident	118 Å²	118	110.4 Å²	110.4	51%	0.513	53%	0.533	S	S	.	.	H	α-helix	trans	-60.9	-33.5	176.1	-178.5	164	-178.3	169.6	0	113.1	R553 A555 Q561	R553-K557 VanDerWaalsContact O-CB 3.27Å; R553-K557 WeakPolarHBondContact O-CB 3.27Å; R553-K557 PolarHBondContact O-N 3.02Å; A555-K557 PolarHBondContact O-N 2.86Å; K557-Q561 HydrophobicContact CG-CG 4.31Å; K557-Q561 VanDerWaalsContact O-CB 3.25Å; K557-Q561 WeakPolarHBondContact O-CB 3.18Å; K557-Q561 WeakPolarHBondContact O-CG 3.25Å; K557-Q561 PolarHBondContact O-N 3.07Å
558	R	81.2	Confident	83.6	Confident	158 Å²	158	110.8 Å²	110.8	60%	0.596	53%	0.528	S	S	*	.	H	α-helix	trans	-71.4	-31.4	171.3	-78.4	-171.6	-160.2	100.1	-23.7	112.8	K554 A555 N556 Q561 D562	K554-R558 WeakPolarHBondContact O-CG 3.35Å; K554-R558 PolarHBondContact O-N 2.88Å; K554-R558 PolarHBondContact O-NH1 3.27Å; A555-R558 PolarHBondContact O-N 3.22Å; A555-R558 VanDerWaalsContact O-N 3.07Å; N556-R558 VanDerWaalsContact C-N 3.28Å; N556-R558 PolarHBondContact O-N 3.42Å; R558-Q561 CarbonylContact O-C 3.49Å; R558-D562 PolarHBondContact O-N 3.45Å
559	K	82	Confident	83	Confident	132 Å²	132	113.4 Å²	113.4	57%	0.574	53%	0.528	S	S	*	.	H	α-helix	trans	-72.5	-37.5	175.4	-161	-177.4	-178.7	-176.5	0	111.5	A555 N556 Q561 D562 F565	A555-K559 PolarHBondContact O-N 2.77Å; N556-K559 CarbonylContact O-C 3.59Å; N556-K559 WeakPolarHBondContact O-CA 3.36Å; N556-K559 WeakPolarHBondContact O-CB 3.25Å; N556-K559 PolarHBondContact O-N 3.03Å; K559-Q561 VanDerWaalsContact C-N 3.3Å; K559-D562 WeakPolarHBondContact O-CB 3.24Å; K559-D562 PolarHBondContact O-N 3.47Å; K559-F565 HydrophobicContact CD-CE2 4.13Å; K559-F565 HydrophobicContact CG-CD2 3.9Å; K559-F565 HydrophobicContact CG-CE2 3.91Å; K559-F565 VanDerWaalsContact O-CB 3.29Å; K559-F565 WeakPolarHBondContact O-CB 3.47Å; K559-F565 WeakPolarHBondContact O-CD2 3.31Å; K559-F565 VanDerWaalsContact O-CG 3.23Å; K559-F565 WeakPolarHBondContact O-CG 3.4Å
560	E	75.8	Confident	81.6	Confident	122 Å²	122	112.4 Å²	112.4	57%	0.57	53%	0.528	S	S	*	.	H	α-helix	trans	-74.8	-17.6	174.8	-67.3	154	-165.2	0	0	112.9	N556	N556-E560 WeakPolarHBondContact O-CB 3.46Å; N556-E560 VanDerWaalsContact O-CG 3.31Å; N556-E560 WeakPolarHBondContact O-CG 3.02Å; N556-E560 PolarHBondContact O-N 3.01Å
561	Q	80.3	Confident	80.4	Confident	130 Å²	130	112.9 Å²	112.9	61%	0.607	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	5.6	173.7	-67	-174.7	-64.9	0	0	113	K557 R558 K559	K557-Q561 HydrophobicContact CG-CG 4.31Å; K557-Q561 VanDerWaalsContact O-CB 3.25Å; K557-Q561 WeakPolarHBondContact O-CB 3.18Å; K557-Q561 WeakPolarHBondContact O-CG 3.25Å; K557-Q561 PolarHBondContact O-N 3.07Å; R558-Q561 CarbonylContact O-C 3.49Å; K559-Q561 VanDerWaalsContact C-N 3.3Å
562	D	78.9	Confident	79	Confident	60 Å²	60	113.1 Å²	113.1	32%	0.321	54%	0.537	S	S	.	.			trans	-70.9	124.8	167.9	-167.1	4.6	0	0	0	106.7	R558 K559 D564 F565 K568	R558-D562 PolarHBondContact O-N 3.45Å; K559-D562 WeakPolarHBondContact O-CB 3.24Å; K559-D562 PolarHBondContact O-N 3.47Å; D562-D564 PolarHBondContact O-N 3.24Å; D562-F565 HydrophobicContact CB-CB 4.41Å; D562-F565 WeakPolarHBondContact O-CB 3.38Å; D562-F565 PolarHBondContact O-N 3.32Å; D562-K568 VanDerWaalsContact CG-NZ 3.3Å; D562-K568 IonicContact OD1-NZ 2.56Å; D562-K568 PolarHBondContact OD1-NZ 3.25Å; D562-K568 IonicContact OD2-NZ 2.66Å; D562-K568 PolarHBondContact OD2-NZ 3.32Å
563	M	67.3	Low	77.5	Confident	169 Å²	169	111.7 Å²	111.7	83%	0.833	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-32.4	-175.5	-71.7	-90.4	60	0	0	111	F565	M563-F565 PolarHBondContact O-N 3.35Å
564	D	70.9	Confident	75.5	Confident	77 Å²	77	109 Å²	109	41%	0.412	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	19.3	170.5	-19	-36.2	0	0	0	112.6	D562 E566 D567 K568	D562-D564 PolarHBondContact O-N 3.24Å; D564-E566 VanDerWaalsContact C-N 3.32Å; D564-E566 PolarHBondContact O-N 2.96Å; D564-D567 HydrophobicContact CB-CB 4.18Å; D564-D567 PolarHBondContact O-N 3.47Å; D564-K568 HydrophobicContact CB-CD 4.23Å; D564-K568 HydrophobicContact CB-CG 3.93Å; D564-K568 WeakPolarHBondContact O-CA 3.23Å; D564-K568 WeakPolarHBondContact O-CB 3.29Å; D564-K568 VanDerWaalsContact O-CG 3.29Å; D564-K568 WeakPolarHBondContact O-CG 3.45Å; D564-K568 PolarHBondContact O-N 2.81Å; D564-K568 WeakPolarHBondContact OD2-CE 3.31Å; D564-K568 IonicContact OD2-NZ 2.86Å; D564-K568 PolarHBondContact OD2-NZ 2.7Å
565	F	73.8	Confident	73.5	Confident	71 Å²	71	105.8 Å²	105.8	31%	0.311	53%	0.526	S	S	.	.	H	α-helix	trans	-63.1	-41	179.9	-178.7	-116.9	0	0	0	112	K559 D562 M563 K569	K559-F565 HydrophobicContact CD-CE2 4.13Å; K559-F565 HydrophobicContact CG-CD2 3.9Å; K559-F565 HydrophobicContact CG-CE2 3.91Å; K559-F565 VanDerWaalsContact O-CB 3.29Å; K559-F565 WeakPolarHBondContact O-CB 3.47Å; K559-F565 WeakPolarHBondContact O-CD2 3.31Å; K559-F565 VanDerWaalsContact O-CG 3.23Å; K559-F565 WeakPolarHBondContact O-CG 3.4Å; D562-F565 HydrophobicContact CB-CB 4.41Å; D562-F565 WeakPolarHBondContact O-CB 3.38Å; D562-F565 PolarHBondContact O-N 3.32Å; M563-F565 PolarHBondContact O-N 3.35Å; F565-K569 WeakPolarHBondContact O-CB 3.4Å; F565-K569 PolarHBondContact O-N 2.78Å; F565-K569 VanDerWaalsContact O-N 3.16Å
566	E	72.1	Confident	72.1	Confident	113 Å²	113	107.6 Å²	107.6	53%	0.528	53%	0.533	S	S	.	.	H	α-helix	trans	-75.6	-42.3	176.2	-59.5	-114.5	88.2	0	0	110.4	D564 K569 M570	D564-E566 VanDerWaalsContact C-N 3.32Å; D564-E566 PolarHBondContact O-N 2.96Å; E566-K569 CarbonylContact O-C 3.11Å; E566-K569 WeakPolarHBondContact O-CA 3.34Å; E566-K569 WeakPolarHBondContact O-CB 3.43Å; E566-K569 PolarHBondContact O-N 3.24Å; E566-K569 VanDerWaalsContact O-N 3.13Å; E566-K569 IonicContact OE1-NZ 3.62Å; E566-K569 PolarHBondContact OE1-NZ 3.44Å; E566-M570 WeakPolarHBondContact O-CG 3.47Å; E566-M570 PolarHBondContact O-N 3.33Å
567	D	78.4	Confident	70.5	Confident	103 Å²	103	109.9 Å²	109.9	55%	0.551	55%	0.545	S	S	*	.	H	α-helix	trans	-65.5	-44.5	177.8	-92.3	30.4	0	0	0	113	D564 K569 M570 N571	D564-D567 HydrophobicContact CB-CB 4.18Å; D564-D567 PolarHBondContact O-N 3.47Å; D567-K569 VanDerWaalsContact C-N 3.27Å; D567-K569 PolarHBondContact O-N 2.88Å; D567-M570 PolarHBondContact O-N 3.2Å; D567-N571 VanDerWaalsContact O-CB 3.24Å; D567-N571 WeakPolarHBondContact O-CB 3.3Å; D567-N571 PolarHBondContact O-N 2.92Å; D567-N571 PolarHBondContact O-ND2 2.86Å
568	K	80.5	Confident	69.2	Low	88 Å²	88	110 Å²	110	38%	0.383	55%	0.548	S	S	.	.	H	α-helix	trans	-65.1	-32.3	171.5	-69.6	176.3	-174.2	108	0	111.1	D562 D564 L572	D562-K568 VanDerWaalsContact CG-NZ 3.3Å; D562-K568 IonicContact OD1-NZ 2.56Å; D562-K568 PolarHBondContact OD1-NZ 3.25Å; D562-K568 IonicContact OD2-NZ 2.66Å; D562-K568 PolarHBondContact OD2-NZ 3.32Å; D564-K568 HydrophobicContact CB-CD 4.23Å; D564-K568 HydrophobicContact CB-CG 3.93Å; D564-K568 WeakPolarHBondContact O-CA 3.23Å; D564-K568 WeakPolarHBondContact O-CB 3.29Å; D564-K568 VanDerWaalsContact O-CG 3.29Å; D564-K568 WeakPolarHBondContact O-CG 3.45Å; D564-K568 PolarHBondContact O-N 2.81Å; D564-K568 WeakPolarHBondContact OD2-CE 3.31Å; D564-K568 IonicContact OD2-NZ 2.86Å; D564-K568 PolarHBondContact OD2-NZ 2.7Å; K568-L572 HydrophobicContact CB-CD1 4.46Å; K568-L572 WeakPolarHBondContact O-CB 3.41Å; K568-L572 WeakPolarHBondContact O-CD1 3.11Å; K568-L572 PolarHBondContact O-N 3.03Å
569	K	78.8	Confident	68	Low	111 Å²	111	108.1 Å²	108.1	48%	0.483	55%	0.547	S	S	.	.	H	α-helix	trans	-68.3	-33.5	175	161.9	-172.8	149.6	-157.6	0	112.2	F565 E566 D567	F565-K569 WeakPolarHBondContact O-CB 3.4Å; F565-K569 PolarHBondContact O-N 2.78Å; F565-K569 VanDerWaalsContact O-N 3.16Å; E566-K569 CarbonylContact O-C 3.11Å; E566-K569 WeakPolarHBondContact O-CA 3.34Å; E566-K569 WeakPolarHBondContact O-CB 3.43Å; E566-K569 PolarHBondContact O-N 3.24Å; E566-K569 VanDerWaalsContact O-N 3.13Å; E566-K569 IonicContact OE1-NZ 3.62Å; E566-K569 PolarHBondContact OE1-NZ 3.44Å; D567-K569 VanDerWaalsContact C-N 3.27Å; D567-K569 PolarHBondContact O-N 2.88Å
570	M	66.9	Low	67	Low	122 Å²	122	108.9 Å²	108.9	60%	0.601	55%	0.552	S	S	*	*	H	α-helix	trans	-85.3	-33.5	175.8	-65.8	-60.4	-65.8	0	0	113.1	E566 D567 T573	E566-M570 WeakPolarHBondContact O-CG 3.47Å; E566-M570 PolarHBondContact O-N 3.33Å; D567-M570 PolarHBondContact O-N 3.2Å; M570-T573 PolarHBondContact O-OG1 3.31Å
571	N	68.8	Low	66.1	Low	123 Å²	123	111.4 Å²	111.4	66%	0.658	56%	0.562	S	S	*	*	H	α-helix	trans	-89.1	-10.4	-179.9	-67.2	-64.5	0	0	0	113.7	D567	D567-N571 VanDerWaalsContact O-CB 3.24Å; D567-N571 WeakPolarHBondContact O-CB 3.3Å; D567-N571 PolarHBondContact O-N 2.92Å; D567-N571 PolarHBondContact O-ND2 2.86Å
572	L	63.4	Low	64.5	Low	140 Å²	140	110 Å²	110	73%	0.733	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-4	164.4	-90	63.2	0	0	0	113.4	K568 L574	K568-L572 HydrophobicContact CB-CD1 4.46Å; K568-L572 WeakPolarHBondContact O-CB 3.41Å; K568-L572 WeakPolarHBondContact O-CD1 3.11Å; K568-L572 PolarHBondContact O-N 3.03Å; L572-L574 PolarHBondContact O-N 3.48Å
573	T	55.7	Low	63.3	Low	98 Å²	98	110.4 Å²	110.4	60%	0.601	57%	0.566	S	S	*	*	S	Bend	trans	-76.9	86.2	159.4	54	0	0	0	0	108.5	M570 S575	M570-T573 PolarHBondContact O-OG1 3.31Å; T573-S575 PolarHBondContact O-N 3.01Å
574	L	52	Low	62.4	Low	103 Å²	103	111.5 Å²	111.5	54%	0.539	56%	0.562	S	S	.	*			trans	-35.6	122.9	167.9	-105.1	154.8	0	0	0	110.1	L572 E578 M579	L572-L574 PolarHBondContact O-N 3.48Å; L574-E578 HydrophobicContact CD2-CB 4.08Å; L574-M579 HydrophobicContact CB-CE 4.49Å
575	S	52	Low	61.3	Low	55 Å²	55	116.5 Å²	116.5	39%	0.385	58%	0.577	S	S	.	*			trans	-58.9	136.1	-179.4	-175.4	0	0	0	0	109.6	T573 D577 E578 M579	T573-S575 PolarHBondContact O-N 3.01Å; S575-D577 PolarHBondContact O-N 2.87Å; S575-D577 VanDerWaalsContact O-N 3.11Å; S575-E578 PolarHBondContact O-N 3.29Å; S575-M579 PolarHBondContact O-N 2.6Å
576	P	58.3	Low	60.2	Low	89 Å²	89	119.9 Å²	119.9	58%	0.578	60%	0.597	S	S	*	*	H	α-helix	trans	-50.1	-36.1	174.4	-29	36.6	0	0	0	113	E578 M579 E580	P576-E578 VanDerWaalsContact C-N 3.34Å; P576-E578 PolarHBondContact O-N 2.92Å; P576-M579 PolarHBondContact O-N 3.5Å; P576-E580 PolarHBondContact O-N 2.62Å
577	D	55.3	Low	59	Low	125 Å²	125	122.3 Å²	122.3	67%	0.668	61%	0.606	S	S	*	*	H	α-helix	trans	-67	-27.9	179	-68.8	23.8	0	0	0	113.6	S575 K581	S575-D577 PolarHBondContact O-N 2.87Å; S575-D577 VanDerWaalsContact O-N 3.11Å; D577-K581 PolarHBondContact O-N 2.61Å
578	E	60.3	Low	57.4	Low	122 Å²	122	124.8 Å²	124.8	57%	0.57	62%	0.619	S	S	*	*	H	α-helix	trans	-76.4	-37.6	171.6	-84.6	-169.6	131.4	0	0	111.4	L574 S575 P576 E580 K581 D582	L574-E578 HydrophobicContact CD2-CB 4.08Å; S575-E578 PolarHBondContact O-N 3.29Å; P576-E578 VanDerWaalsContact C-N 3.34Å; P576-E578 PolarHBondContact O-N 2.92Å; E578-E580 VanDerWaalsContact C-N 3.26Å; E578-E580 PolarHBondContact O-N 3.16Å; E578-K581 VanDerWaalsContact O-CB 3.25Å; E578-K581 WeakPolarHBondContact O-CB 3.5Å; E578-K581 PolarHBondContact O-N 2.87Å; E578-D582 PolarHBondContact O-N 2.72Å
579	M	57.2	Low	55.5	Low	118 Å²	118	132.6 Å²	132.6	58%	0.581	65%	0.646	S	S	*	*	H	α-helix	trans	-64.7	-27.7	171.9	-77.4	-175.5	-74.3	0	0	112.9	L574 S575 P576	L574-M579 HydrophobicContact CB-CE 4.49Å; S575-M579 PolarHBondContact O-N 2.6Å; P576-M579 PolarHBondContact O-N 3.5Å
580	E	60.5	Low	53.8	Low	147 Å²	147	130.6 Å²	130.6	69%	0.687	66%	0.658	S	S	*	*	H	α-helix	trans	-82.4	-21.2	169.8	-68.3	-157.2	155.5	0	0	113.4	P576 E578 D582 S583	P576-E580 PolarHBondContact O-N 2.62Å; E578-E580 VanDerWaalsContact C-N 3.26Å; E578-E580 PolarHBondContact O-N 3.16Å; E580-D582 VanDerWaalsContact C-N 3.25Å; E580-D582 PolarHBondContact O-N 3.45Å; E580-S583 VanDerWaalsContact O-CB 3.27Å; E580-S583 WeakPolarHBondContact O-CB 3.07Å; E580-S583 PolarHBondContact O-N 3.44Å; E580-S583 VanDerWaalsContact O-N 3.08Å; E580-S583 PolarHBondContact O-OG 3.17Å
581	K	56.8	Low	52.2	Low	176 Å²	176	128.2 Å²	128.2	77%	0.765	66%	0.664	S	S	*	*	H	α-helix	trans	-62.8	-33.5	173.8	-151.3	77.4	173.2	-165.8	0	112.1	D577 E578 S583	D577-K581 PolarHBondContact O-N 2.61Å; E578-K581 VanDerWaalsContact O-CB 3.25Å; E578-K581 WeakPolarHBondContact O-CB 3.5Å; E578-K581 PolarHBondContact O-N 2.87Å; K581-S583 PolarHBondContact O-N 2.62Å
582	D	47.2	Very low	50.5	Low	99 Å²	99	128.2 Å²	128.2	53%	0.529	67%	0.673	S	S	.	*	G	3₁₀ helix	trans	-71.1	17.1	171.7	-84.7	-22.5	0	0	0	114.5	E578 E580 Y584 Y585 L586	E578-D582 PolarHBondContact O-N 2.72Å; E580-D582 VanDerWaalsContact C-N 3.25Å; E580-D582 PolarHBondContact O-N 3.45Å; D582-Y584 PolarHBondContact O-N 2.63Å; D582-Y585 PolarHBondContact O-N 2.96Å; D582-L586 PolarHBondContact O-N 3.21Å
583	S	53.8	Low	49.3	Very low	70 Å²	70	127.9 Å²	127.9	49%	0.49	68%	0.683	S	S	.	*	G	3₁₀ helix	trans	-52.1	-14.3	165.9	-75.2	0	0	0	0	114.7	E580 K581	E580-S583 VanDerWaalsContact O-CB 3.27Å; E580-S583 WeakPolarHBondContact O-CB 3.07Å; E580-S583 PolarHBondContact O-N 3.44Å; E580-S583 VanDerWaalsContact O-N 3.08Å; E580-S583 PolarHBondContact O-OG 3.17Å; K581-S583 PolarHBondContact O-N 2.62Å
584	Y	48.2	Very low	48.3	Very low	191 Å²	191	128 Å²	128	75%	0.749	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-65.6	-48	168	-168.8	-103.4	0	0	0	111.7	D582 L586 K587	D582-Y584 PolarHBondContact O-N 2.63Å; Y584-L586 PolarHBondContact O-N 3.26Å; Y584-K587 VanDerWaalsContact O-CB 3.26Å; Y584-K587 WeakPolarHBondContact O-CB 3.18Å; Y584-K587 PolarHBondContact O-N 2.86Å
585	Y	46.9	Very low	47.6	Very low	183 Å²	183	134.7 Å²	134.7	72%	0.718	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-21.2	178.8	-77	-73.2	0	0	0	113.8	D582 K587	D582-Y585 PolarHBondContact O-N 2.96Å; Y585-K587 PolarHBondContact O-N 3.4Å
586	L	51.7	Low	46.7	Very low	142 Å²	142	137.1 Å²	137.1	74%	0.743	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-8.1	174.6	-154.2	66.9	0	0	0	113.3	D582 Y584	D582-L586 PolarHBondContact O-N 3.21Å; Y584-L586 PolarHBondContact O-N 3.26Å
587	K	46.4	Very low	46.2	Very low	163 Å²	163	138.5 Å²	138.5	71%	0.709	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-67.9	-39	-175.1	-154.1	74.6	172.8	-170.3	0	113.5	Y584 Y585 R589 G590	Y584-K587 VanDerWaalsContact O-CB 3.26Å; Y584-K587 WeakPolarHBondContact O-CB 3.18Å; Y584-K587 PolarHBondContact O-N 2.86Å; Y585-K587 PolarHBondContact O-N 3.4Å; K587-R589 PolarHBondContact O-N 3.06Å; K587-G590 PolarHBondContact O-N 3Å
588	D	44	Very low	45.6	Very low	156 Å²	156	137.8 Å²	137.8	83%	0.834	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-78.9	13	-168.7	-73.4	-25.9	0	0	0	115.5
589	R	42.2	Very low	44.9	Very low	251 Å²	251	137.8 Å²	137.8	95%	0.947	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-129.8	18.5	173.3	-143	170.2	-174.5	150.1	6.3	115.3	K587	K587-R589 PolarHBondContact O-N 3.06Å
590	G	41.5	Very low	44.3	Very low	70 Å²	70	137.9 Å²	137.9	72%	0.722	76%	0.761	S	S	*	*	S	Bend	trans	-145.3	37.9	-170	0	0	0	0	0	117.9	K587	K587-G590 PolarHBondContact O-N 3Å
591	G	33.7	Very low	43.1	Very low	71 Å²	71	136.7 Å²	136.7	73%	0.732	77%	0.768	S	S	*	*			trans	-141.5	67.7	-170.8	0	0	0	0	0	117.9
592	S	34	Very low	42	Very low	123 Å²	123	133 Å²	133	86%	0.86	77%	0.771	S	S	*	*	S	Bend	trans	-157.5	35.3	169.9	-88.4	0	0	0	0	117.2
593	S	36.8	Very low	41.4	Very low	133 Å²	133	135.9 Å²	135.9	93%	0.93	79%	0.786	S	S	*	*			trans	-164.9	67	158.7	-90.3	0	0	0	0	114.6
594	A	36.7	Very low	40.4	Very low	102 Å²	102	139 Å²	139	84%	0.843	80%	0.802	S	S	*	*			trans	-133.6	125.2	155.3	0	0	0	0	0	107.9
595	R	35.6	Very low	39.7	Very low	242 Å²	242	139.8 Å²	139.8	91%	0.913	80%	0.803	S	S	*	*			trans	-107	98.8	-162.3	-175.4	177.8	-177.2	-117.9	7.8	111.3
596	S	33.6	Very low	39	Very low	107 Å²	107	138.6 Å²	138.6	75%	0.748	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-61.3	151.5	170.7	-66.5	0	0	0	0	112.1
597	P	46.9	Very low	38	Very low	118 Å²	118	140.4 Å²	140.4	77%	0.766	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-79.2	152.9	-170.9	31.8	-36.3	0	0	0	113.4
598	P	43.6	Very low	38.5	Very low	110 Å²	110	137 Å²	137	71%	0.714	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-79.8	147.4	175.7	32.9	-34.7	0	0	0	112.5
599	P	44.7	Very low	38	Very low	121 Å²	121	137.2 Å²	137.2	79%	0.786	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-77.2	158.2	173.9	32.9	-35.5	0	0	0	112.5
600	P	45.2	Very low	37.4	Very low	121 Å²	121	132.5 Å²	132.5	79%	0.786	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-86.6	137.3	-179.4	33.7	-34	0	0	0	113.1
601	S	35	Very low	38.3	Very low	122 Å²	122	134.4 Å²	134.4	85%	0.853	80%	0.797	S	S	*	*			trans	-164.6	140.3	155.2	-89.2	0	0	0	0	113.8
602	A	33.9	Very low	38.1	Very low	99 Å²	99	138.6 Å²	138.6	82%	0.818	80%	0.802	S	S	*	*			trans	37.3	125	157.2	0	0	0	0	0	121.1
603	N	34.6	Very low	38.1	Very low	158 Å²	158	137.6 Å²	137.6	85%	0.845	80%	0.795	S	S	*	*			trans	-61.3	147.8	163.7	-53.9	-74.8	0	0	0	112.2
604	V	34.1	Very low	37.9	Very low	136 Å²	136	139.5 Å²	139.5	82%	0.824	79%	0.791	S	S	*	*				179.4	111.6	122.1	148.4	0	0	0	0	112.4
605	R	32.9	Very low	38.7	Very low	207 Å²	207	139.6 Å²	139.6	78%	0.781	78%	0.783	S	S	*	*			trans	59	114	131	-157.6	174.1	176.6	130.9	20.6	123.1
606	E	31.2	Very low	38.6	Very low	158 Å²	158	135.8 Å²	135.8	74%	0.738	78%	0.78	S	S	*	*			trans	71.3	147.9	144	-68.2	-179.8	126.9	0	0	122.9
607	Q	30.7	Very low	38.7	Very low	181 Å²	181	134.9 Å²	134.9	85%	0.846	77%	0.774	S	S	*	*			trans	-102	-174.9	175.2	-114.7	-172.1	82.2	0	0	108.8
608	P	57	Low	38.1	Very low	91 Å²	91	137.2 Å²	137.2	59%	0.591	78%	0.776	S	S	*	*			cis	-137.4	-169.9	-13	24.1	1.7	0	0	0	114.8
609	L	33.3	Very low	37.8	Very low	160 Å²	160	140.3 Å²	140.3	84%	0.838	78%	0.781	S	S	*	*			trans	117.7	143.8	142.5	-59.5	-179	0	0	0	119.7
610	N	31.1	Very low	37.9	Very low	153 Å²	153	139.4 Å²	139.4	82%	0.818	78%	0.775	S	S	*	*			trans	-92	-169.9	176.8	-60.8	-42.9	0	0	0	111.1
611	P	59.3	Low	37.3	Very low	110 Å²	110	142.2 Å²	142.2	71%	0.714	78%	0.778	S	S	*	*				-126.6	-175	-66.7	37.9	-22.5	0	0	0	111.5
612	L	31	Very low	37	Very low	159 Å²	159	140.5 Å²	140.5	83%	0.832	77%	0.771	S	S	*	*			trans	161.1	161.2	136	-88.8	162.3	0	0	0	115.8
613	S	32.5	Very low	37.1	Very low	101 Å²	101	142.3 Å²	142.3	71%	0.706	77%	0.771	S	S	*	*			trans	57	103	149.9	58.7	0	0	0	0	122.7
614	M	33.1	Very low	36.9	Very low	174 Å²	174	139.5 Å²	139.5	86%	0.857	77%	0.77	S	S	*	*				14.7	158.7	102.9	-68.2	-68.8	-173.1	0	0	119.6
615	P	53.1	Low	36.9	Very low	104 Å²	104	141.8 Å²	141.8	68%	0.675	77%	0.771	S	S	*	*			cis	-145	-176.8	-25.8	38.6	-18.9	0	0	0	115.8
616	L	33.4	Very low	36.9	Very low	162 Å²	162	136.8 Å²	136.8	85%	0.848	77%	0.774	S	S	*	*			trans	78.8	129.8	142	-124.5	76.2	0	0	0	123
617	S	35.2	Very low	37.3	Very low	88 Å²	88	136.4 Å²	136.4	62%	0.615	78%	0.777	S	S	*	*			trans	79.8	120.4	134.9	-141.9	0	0	0	0	121.5
618	M	34.5	Very low	37.8	Very low	166 Å²	166	133.7 Å²	133.7	82%	0.818	78%	0.775	S	S	*	*				177.9	133.9	111.1	-94	-75.1	105.1	0	0	112.4
619	H	37	Very low	36.7	Very low	176 Å²	176	140.9 Å²	140.9	82%	0.815	79%	0.791	S	S	*	*			trans	-121.8	141.1	163.3	-140.6	5.1	0	0	0	105.7
620	P	47.6	Very low	36.7	Very low	101 Å²	101	137.4 Å²	137.4	66%	0.656	79%	0.785	S	S	*	*				-159.2	159.4	104.5	38.4	-18.6	0	0	0	118.8
621	H	32.5	Very low	37	Very low	181 Å²	181	138.2 Å²	138.2	84%	0.838	79%	0.789	S	S	*	*			trans	48.7	117.4	138.4	-63	-49	0	0	0	125
622	A	30.1	Very low	36	Very low	86 Å²	86	140.8 Å²	140.8	71%	0.711	80%	0.796	S	S	*	*				90.1	115.3	113.3	0	0	0	0	0	123.9
623	V	34.2	Very low	37.1	Very low	137 Å²	137	138.2 Å²	138.2	83%	0.83	79%	0.789	S	S	*	*				45.5	115	127.1	-171.2	0	0	0	0	120.6
624	A	31.5	Very low	37.2	Very low	99 Å²	99	140.8 Å²	140.8	82%	0.818	79%	0.793	S	S	*	*			trans	-162.7	155.3	135.7	0	0	0	0	0	113.4
625	H	34.3	Very low	37.3	Very low	183 Å²	183	140.8 Å²	140.8	85%	0.847	79%	0.791	S	S	*	*			trans	-80.8	154.9	-177.2	-46.1	-98.5	0	0	0	114.1
626	A	32.1	Very low	36.4	Very low	103 Å²	103	146.6 Å²	146.6	85%	0.851	80%	0.801	S	S	*	*				162.7	155.8	115.4	0	0	0	0	0	113.1
627	N	40	Very low	36.4	Very low	149 Å²	149	142.5 Å²	142.5	80%	0.797	79%	0.786	S	S	*	*			trans	-134	125	176.9	176.6	-6.8	0	0	0	110.2
628	P	41.6	Very low	36.4	Very low	124 Å²	124	143.5 Å²	143.5	81%	0.805	79%	0.789	S	S	*	*			trans	-116	124.8	165.4	34.7	-22.4	0	0	0	112.7
629	R	34.3	Very low	36.5	Very low	242 Å²	242	146.8 Å²	146.8	91%	0.913	79%	0.793	S	S	*	*			trans	-112.4	113.5	174.4	175.3	-164.2	-179.3	113.9	-1.5	110.8
630	A	32.8	Very low	36.3	Very low	88 Å²	88	141.6 Å²	141.6	73%	0.727	79%	0.788	S	S	*	*			trans	177.7	132.3	147.8	0	0	0	0	0	112.1
631	L	37.7	Very low	36.4	Very low	169 Å²	169	143 Å²	143	89%	0.885	80%	0.797	S	S	*	*				-159.5	145.3	118.1	-82.9	-161	0	0	0	110
632	L	36.7	Very low	37.7	Very low	165 Å²	165	139.8 Å²	139.8	86%	0.864	79%	0.792	S	S	*	*			trans	-134.5	-168	170.3	-68	170.8	0	0	0	105.2
633	P	54.3	Low	38.8	Very low	105 Å²	105	140.8 Å²	140.8	68%	0.682	79%	0.791	S	S	*	*			cis	-136.4	-176.3	-7.3	38.8	-19	0	0	0	115
634	L	35	Very low	38.9	Very low	154 Å²	154	140.8 Å²	140.8	81%	0.806	79%	0.787	S	S	*	*			trans	170	115.8	134.2	-110.1	73.2	0	0	0	106.6
635	Q	36.3	Very low	39	Very low	175 Å²	175	145.4 Å²	145.4	82%	0.818	78%	0.783	S	S	*	*				80.2	111.5	62.8	-81.8	-163.8	-25	0	0	117
636	Y	32.8	Very low	39	Very low	225 Å²	225	147 Å²	147	88%	0.882	78%	0.783	S	S	*	*			trans	66.6	141.9	151	-118.4	-126	0	0	0	118.3
637	S	34.8	Very low	39	Very low	76 Å²	76	146.1 Å²	146.1	53%	0.531	78%	0.784	S	S	.	*			cis	-176.5	161.7	-13.7	-120.7	0	0	0	0	113.9
638	V	34.7	Very low	38.8	Very low	110 Å²	110	148.7 Å²	148.7	67%	0.667	78%	0.782	S	S	*	*			trans	76.8	136	141.3	164.7	0	0	0	0	122.2
639	Y	36.6	Very low	39	Very low	234 Å²	234	147.5 Å²	147.5	92%	0.918	78%	0.775	S	S	*	*			trans	70.2	146.6	172	-69.9	-57.1	0	0	0	120.5
640	G	32.4	Very low	39.2	Very low	68 Å²	68	142.9 Å²	142.9	70%	0.701	76%	0.763	S	S	*	*			trans	-123.4	-151.5	173.6	0	0	0	0	0	111.1
641	P	49.7	Very low	39.2	Very low	130 Å²	130	149.7 Å²	149.7	84%	0.844	77%	0.772	S	S	*	*			cis	-134.3	-137	18.5	46	-23.8	0	0	0	112.6
642	P	60.4	Low	39.4	Very low	114 Å²	114	148.4 Å²	148.4	74%	0.74	76%	0.763	S	S	*	*			trans	-99.7	-159.8	-163.2	47.7	-45.1	0	0	0	113.4
643	P	53.7	Low	39.5	Very low	106 Å²	106	145.9 Å²	145.9	69%	0.688	76%	0.756	S	S	*	*			cis	-137.9	-173.6	-2.5	45.2	-27.5	0	0	0	115.9
644	D	35.1	Very low	39.2	Very low	137 Å²	137	145.5 Å²	145.5	73%	0.733	75%	0.754	S	S	*	*			trans	-178.8	164	141.1	-99.3	-6.4	0	0	0	109.3
645	R	34.8	Very low	39.3	Very low	196 Å²	196	147 Å²	147	74%	0.74	76%	0.757	S	S	*	*			cis	113.6	121	8	-76.8	-174.8	164.8	-100.5	-1.8	115.4
646	Y	34.2	Very low	39.5	Very low	217 Å²	217	148.5 Å²	148.5	85%	0.851	76%	0.757	S	S	*	*			trans	47.3	129.8	156.1	-72.6	-91.1	0	0	0	122.2
647	G	32.2	Very low	40.2	Very low	84 Å²	84	143.3 Å²	143.3	87%	0.866	74%	0.744	S	S	*	*			trans	171.6	94.8	163.9	0	0	0	0	0	117
648	R	35	Very low	40.8	Very low	204 Å²	204	146.6 Å²	146.6	77%	0.77	76%	0.756	S	S	*	*			trans	-143.1	147.5	161	-138.1	-152.3	170	-108	-2	105.5
649	P	46	Very low	41.4	Very low	99 Å²	99	145.9 Å²	145.9	64%	0.643	75%	0.752	S	S	*	*				-154	178.5	66	43.9	-24.3	0	0	0	116.7
650	Q	37.9	Very low	42.3	Very low	145 Å²	145	139.6 Å²	139.6	68%	0.678	73%	0.734	S	S	*	*			trans	51.4	140.1	164.2	-33.8	-46.2	26.6	0	0	118.6
651	Y	33.8	Very low	43.2	Very low	231 Å²	231	139.4 Å²	139.4	91%	0.906	73%	0.725	S	S	*	*			cis	-152.9	167.8	43.8	-168.9	-100.2	0	0	0	110.7
652	M	41.9	Very low	43.4	Very low	142 Å²	142	137.7 Å²	137.7	70%	0.7	70%	0.703	S	S	*	*			trans	-106.2	147.1	-178	-110.7	-76.5	179.7	0	0	111.6
653	P	38.5	Very low	43.2	Very low	111 Å²	111	134.2 Å²	134.2	72%	0.721	69%	0.688	S	S	*	*				-133.9	160.8	109.7	38.1	-29.2	0	0	0	112.7
654	P	48.2	Very low	43.3	Very low	98 Å²	98	134 Å²	134	64%	0.636	67%	0.673	S	S	*	*			trans	-77.2	148.2	-163.5	30.9	-36.5	0	0	0	113.8
655	Q	37.2	Very low	43.7	Very low	186 Å²	186	133.5 Å²	133.5	87%	0.869	67%	0.668	S	S	*	*			trans	-117.7	117.5	153.1	-60.3	-70.7	-107.5	0	0	105.8
656	Y	40.2	Very low	44.3	Very low	205 Å²	205	130.3 Å²	130.3	80%	0.804	67%	0.67	S	S	*	*			trans	-71.7	152.5	164.4	-121.4	-130.4	0	0	0	107.8
657	D	46.9	Very low	45.1	Very low	117 Å²	117	129.7 Å²	129.7	63%	0.626	67%	0.666	S	S	*	*			trans	43.8	97.9	160.4	-47.1	-26.8	0	0	0	117.7
658	D	48.4	Very low	45.3	Very low	144 Å²	144	137 Å²	137	77%	0.77	67%	0.67	S	S	*	*			trans	-117.2	56.3	146.1	-142.1	11.9	0	0	0	106.8	M665	D658-M665 WeakPolarHBondContact O-CE 3.42Å
659	V	46.6	Very low	45.6	Very low	96 Å²	96	138.5 Å²	138.5	58%	0.582	68%	0.675	S	S	*	*			trans	-110.6	96.7	175.1	-178.2	0	0	0	0	104.1
660	D	54.9	Low	45.8	Very low	102 Å²	102	142.2 Å²	142.2	55%	0.545	68%	0.684	S	S	.	*			trans	-47.5	145.6	159.8	-51.3	-58.9	0	0	0	106.9	E378 Y662 G663	E378-D660 WeakPolarHBondContact OE1-CB 3.49Å; D660-Y662 PolarHBondContact O-N 3.35Å; D660-G663 PolarHBondContact O-N 2.87Å
661	A	51.3	Low	46	Very low	63 Å²	63	143.3 Å²	143.3	52%	0.521	69%	0.694	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.5	-8.7	-171.1	0	0	0	0	0	112.8	E378 E379 G663	E378-A661 HydrophobicContact CB-CB 3.92Å; E378-A661 PolarHBondContact OE1-N 2.86Å; E379-A661 CarbonylContact C-O 3.57Å; E379-A661 WeakPolarHBondContact CA-O 3.49Å; E379-A661 VanDerWaalsContact N-C 3.32Å; E379-A661 PolarHBondContact N-O 3.43Å; E379-A661 CarbonylContact O-C 3.46Å; A661-G663 VanDerWaalsContact C-N 3.34Å
662	Y	54.4	Low	46.5	Very low	94 Å²	94	137.6 Å²	137.6	37%	0.369	69%	0.685	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.8	-10.6	169.6	-116.5	15.1	0	0	0	116.2	E378 E379 D660 R664	E378-Y662 HydrophobicContact CB-CD1 3.46Å; E378-Y662 VanDerWaalsContact CB-CD1 3.46Å; E378-Y662 HydrophobicContact CB-CE1 4.2Å; E378-Y662 HydrophobicContact CB-CG 3.89Å; E378-Y662 HydrophobicContact CG-CD1 3.42Å; E378-Y662 VanDerWaalsContact CG-CD1 3.42Å; E378-Y662 HydrophobicContact CG-CD2 4.41Å; E378-Y662 HydrophobicContact CG-CE1 3.82Å; E378-Y662 HydrophobicContact CG-CG 3.7Å; E378-Y662 WeakPolarHBondContact OE1-CB 3.45Å; E378-Y662 PolarHBondContact OE1-N 2.91Å; E378-Y662 WeakPolarHBondContact OE2-CB 3.42Å; E378-Y662 WeakPolarHBondContact OE2-CD2 3.36Å; E378-Y662 WeakPolarHBondContact OE2-CE2 3.49Å; E379-Y662 HydrophobicContact CB-CD1 3.92Å; E379-Y662 HydrophobicContact CG-CD1 3.85Å; E379-Y662 HydrophobicContact CG-CE1 3.94Å; E379-Y662 CarbonylContact O-C 2.71Å; E379-Y662 WeakPolarHBondContact O-CA 3.4Å; E379-Y662 VanDerWaalsContact OE2-CE1 3.32Å; E379-Y662 WeakPolarHBondContact OE2-CE1 3.16Å; D660-Y662 PolarHBondContact O-N 3.35Å; Y662-R664 VanDerWaalsContact CD2-NH2 3.32Å; Y662-R664 WeakPolarHBondContact O-CB 3.38Å; Y662-R664 VanDerWaalsContact O-CG 3.28Å; Y662-R664 WeakPolarHBondContact O-CG 3.29Å; Y662-R664 PolarHBondContact O-N 3.27Å; Y662-R664 PolarHBondContact O-NE 3.43Å
663	G	55.1	Low	46.8	Very low	41 Å²	41	136.8 Å²	136.8	42%	0.423	69%	0.69	S	S	.	*			trans	63.4	5.7	-179.2	0	0	0	0	0	114.8	E379 D660 A661	E379-G663 PolarHBondContact O-N 3.03Å; D660-G663 PolarHBondContact O-N 2.87Å; A661-G663 VanDerWaalsContact C-N 3.34Å
664	R	56.6	Low	47.1	Very low	103 Å²	103	140.5 Å²	140.5	39%	0.389	70%	0.697	S	S	.	*			trans	-120.2	82.6	-159.3	-82.7	-175.7	-64.8	-163.2	-2.9	114.7	E379 K380 Y662 T666	E379-R664 IonicContact OE2-CZ 2.62Å; E379-R664 IonicContact OE2-NH1 2.63Å; E379-R664 IonicContact OE2-NH2 3.08Å; E379-R664 PolarHBondContact OE2-NH2 2.84Å; K380-R664 HydrophobicContact CD-CG 4.41Å; K380-R664 VanDerWaalsContact CE-NH1 3.32Å; Y662-R664 VanDerWaalsContact CD2-NH2 3.32Å; Y662-R664 WeakPolarHBondContact O-CB 3.38Å; Y662-R664 VanDerWaalsContact O-CG 3.28Å; Y662-R664 WeakPolarHBondContact O-CG 3.29Å; Y662-R664 PolarHBondContact O-N 3.27Å; Y662-R664 PolarHBondContact O-NE 3.43Å; R664-T666 WeakPolarHBondContact O-CG2 3.34Å; R664-T666 PolarHBondContact O-N 3.13Å; R664-T666 VanDerWaalsContact O-N 3.16Å
665	M	42.8	Very low	47.1	Very low	125 Å²	125	146.7 Å²	146.7	62%	0.616	71%	0.708	S	S	*	*			trans	-59.4	112.1	170.5	-166.4	58.4	53.9	0	0	112.5	D658 R667	D658-M665 WeakPolarHBondContact O-CE 3.42Å; M665-R667 PolarHBondContact O-N 2.93Å; M665-R667 VanDerWaalsContact O-N 3.1Å
666	T	47.3	Very low	47.1	Very low	129 Å²	129	146.2 Å²	146.2	79%	0.791	71%	0.708	S	S	*	*			trans	-83.8	79	-162.8	61.7	0	0	0	0	114.8	R664	R664-T666 WeakPolarHBondContact O-CG2 3.34Å; R664-T666 PolarHBondContact O-N 3.13Å; R664-T666 VanDerWaalsContact O-N 3.16Å
667	R	51.3	Low	47.2	Very low	204 Å²	204	142 Å²	142	77%	0.77	71%	0.706	S	S	*	*			trans	-144.3	9.3	-175.5	-125.6	-178.7	-68.3	163.8	0.6	122.7	M665	M665-R667 PolarHBondContact O-N 2.93Å; M665-R667 VanDerWaalsContact O-N 3.1Å
668	Y	37.3	Very low	47.1	Very low	239 Å²	239	143.5 Å²	143.5	94%	0.937	71%	0.709	S	S	*	*			trans	-134.2	98.7	171.2	-99.9	-87.6	0	0	0	113.8
669	R	41	Very low	46.5	Very low	234 Å²	234	147.7 Å²	147.7	88%	0.883	72%	0.715	S	S	*	*			trans	-148.3	48.8	170.2	-157.7	-166	-173.4	-108.9	3	114
670	E	50.2	Low	46.2	Very low	177 Å²	177	150.3 Å²	150.3	83%	0.827	72%	0.721	S	S	*	*			trans	-163.5	115.2	160.3	-118.5	159	-142.4	0	0	113.3
671	L	42.1	Very low	45.7	Very low	169 Å²	169	153.1 Å²	153.1	89%	0.885	74%	0.736	S	S	*	*				-168.8	146.4	120.9	-96.3	176.1	0	0	0	109.6
672	P	44.3	Very low	45.4	Very low	110 Å²	110	155.4 Å²	155.4	71%	0.714	74%	0.74	S	S	*	*			trans	-84.3	160.5	-166.2	-14.9	33	0	0	0	116.4	H674	P672-H674 PolarHBondContact O-N 2.77Å
673	P	48.7	Very low	44.6	Very low	126 Å²	126	160.6 Å²	160.6	82%	0.818	76%	0.759	S	S	*	*			trans	-91.5	4.8	-154.8	35.7	-39.1	0	0	0	117.5	R675	P673-R675 PolarHBondContact O-N 2.78Å
674	H	43.8	Very low	44	Very low	188 Å²	188	170.4 Å²	170.4	87%	0.87	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	45.8	-167	-166.1	16.1	0	0	0	114.5	P672	P672-H674 PolarHBondContact O-N 2.77Å
675	R	49.6	Very low	43	Very low	229 Å²	229	170.8 Å²	170.8	86%	0.864	80%	0.801	S	S	*	*	T	Hydrogen-bonded Turn	trans	-150.2	13.5	-175.6	-132.7	-172.3	-170.1	85.5	2.6	120.1	P673	P673-R675 PolarHBondContact O-N 2.78Å
676	M	36.6	Very low	43	Very low	175 Å²	175	176 Å²	176	86%	0.862	81%	0.814	S	S	*	*			trans	-111	120.3	167.5	-79	-54.6	-54.3	0	0	111.4
677	P	41.8	Very low	42.5	Very low	117 Å²	117	175.4 Å²	175.4	76%	0.76	81%	0.813	S	S	*	*			trans	-72.1	165.9	-179.8	-21.8	35	0	0	0	115.7
678	H	45.4	Very low	41.7	Very low	148 Å²	148	171.2 Å²	171.2	69%	0.685	81%	0.81	S	S	*	*			trans	-88.9	155.7	179.7	-138.1	-110.8	0	0	0	112.5	E680	H678-E680 IonicContact CE1-OE1 2.78Å; H678-E680 PolarHBondContact CE1-OE1 3.09Å; H678-E680 VanDerWaalsContact CE1-OE1 3.26Å; H678-E680 WeakPolarHBondContact ND1-CG 3.47Å; H678-E680 IonicContact ND1-OE1 2.7Å
679	Y	35.3	Very low	41.9	Very low	233 Å²	233	171.4 Å²	171.4	91%	0.914	81%	0.809	S	S	*	*			trans	-150.4	131	153.8	-117.8	-83.8	0	0	0	109.3
680	E	39.6	Very low	41.9	Very low	151 Å²	151	167.4 Å²	167.4	71%	0.706	80%	0.8	S	S	*	*			trans	-114.6	170.6	172.9	-49.2	177.7	142.8	0	0	107.5	H678	H678-E680 IonicContact CE1-OE1 2.78Å; H678-E680 PolarHBondContact CE1-OE1 3.09Å; H678-E680 VanDerWaalsContact CE1-OE1 3.26Å; H678-E680 WeakPolarHBondContact ND1-CG 3.47Å; H678-E680 IonicContact ND1-OE1 2.7Å
681	D	46.2	Very low	41.1	Very low	161 Å²	161	164.7 Å²	164.7	86%	0.861	80%	0.795	S	S	*	*			cis	-123.6	-129	-16.7	-165.5	15.8	0	0	0	107.6
682	D	44	Very low	41.1	Very low	111 Å²	111	164.1 Å²	164.1	59%	0.594	79%	0.791	S	S	*	*			cis	-147.8	165.9	0.6	160.3	37.3	0	0	0	106.4
683	R	37.4	Very low	40.6	Very low	202 Å²	202	165.2 Å²	165.2	76%	0.762	80%	0.796	S	S	*	*	S	Bend	trans	74.4	77	166.1	-41.3	-173.6	177.3	-167.3	-7.4	119.1
684	R	42.8	Very low	40.2	Very low	248 Å²	248	166.7 Å²	166.7	94%	0.936	79%	0.792	S	S	*	*				172.3	87.8	104.1	-90.5	161.9	-178.5	-128.3	-0.7	112.9
685	S	36.3	Very low	39.4	Very low	111 Å²	111	169.3 Å²	169.3	78%	0.776	79%	0.794	S	S	*	*			trans	-74.3	155	157.2	-25.5	0	0	0	0	109.1
686	R	41	Very low	38.9	Very low	234 Å²	234	163.4 Å²	163.4	88%	0.883	78%	0.783	S	S	*	*			cis	-156.1	-177	14.6	-65.9	-175.3	175.2	-177.6	-2.9	108.1
687	P	37.8	Very low	38.7	Very low	117 Å²	117	164 Å²	164	76%	0.76	78%	0.784	S	S	*	*			cis	-131.6	116.5	-43	30	-10.6	0	0	0	112.1
688	T	34.4	Very low	38.7	Very low	115 Å²	115	163.3 Å²	163.3	71%	0.706	79%	0.788	S	S	*	*			trans	-79.6	134.6	163.9	48	0	0	0	0	110.1	E690	T688-E690 WeakPolarHBondContact CB-OE1 3.42Å; T688-E690 PolarHBondContact OG1-OE1 3.21Å
689	R	42	Very low	38.4	Very low	244 Å²	244	160.8 Å²	160.8	92%	0.921	79%	0.793	S	S	*	*			trans	-102.6	80.9	174.5	-177.1	169.9	160.7	66.9	4.6	110
690	E	40.3	Very low	38.8	Very low	150 Å²	150	154 Å²	154	70%	0.701	79%	0.793	S	S	*	*			trans	-83.1	-172.9	-177.5	-73.2	163.4	-133.6	0	0	113.5	T688	T688-E690 WeakPolarHBondContact CB-OE1 3.42Å; T688-E690 PolarHBondContact OG1-OE1 3.21Å
691	V	34.2	Very low	39	Very low	120 Å²	120	158.9 Å²	158.9	73%	0.727	81%	0.805	S	S	*	*			trans	-129.8	114.1	-142.3	171.1	0	0	0	0	112.8
692	I	42	Very low	38.4	Very low	156 Å²	156	154.4 Å²	154.4	80%	0.8	80%	0.797	S	S	*	*			trans	74.8	167.1	155.5	-58.2	167.1	0	0	0	116.7
693	V	33.4	Very low	38.7	Very low	134 Å²	134	156.4 Å²	156.4	81%	0.812	81%	0.808	S	S	*	*			trans	88	141.2	174.4	-172.1	0	0	0	0	116.2
694	Q	40.4	Very low	39.1	Very low	156 Å²	156	154.8 Å²	154.8	73%	0.729	81%	0.809	S	S	*	*			cis	-162.5	136.1	-46.4	-173.7	178.2	21.1	0	0	110.5	V696	Q694-V696 HydrophobicContact CG-CG2 4.3Å
695	R	26.4	Very low	39.5	Very low	244 Å²	244	154.4 Å²	154.4	92%	0.921	81%	0.808	S	S	*	*			trans	-154.8	149.7	146.7	-162.4	158.9	-68.4	171.8	1.7	110.7
696	V	39.4	Very low	40.4	Very low	104 Å²	104	151.8 Å²	151.8	63%	0.63	79%	0.79	S	S	*	*			trans	-121.5	136.6	-163.4	168.9	0	0	0	0	111	Q694	Q694-V696 HydrophobicContact CG-CG2 4.3Å
697	E	31.8	Very low	41.4	Very low	189 Å²	189	144.2 Å²	144.2	88%	0.883	77%	0.766	S	S	*	*				-162.3	132	124.9	-112.5	177.7	-172.1	0	0	114.4
698	A	42.6	Very low	42.5	Very low	101 Å²	101	143.9 Å²	143.9	84%	0.835	76%	0.764	S	S	*	*			trans	45.3	65.8	151.2	0	0	0	0	0	121.3
699	A	39.3	Very low	43.7	Very low	96 Å²	96	149.9 Å²	149.9	79%	0.793	77%	0.774	S	S	*	*			trans	-146.5	132.3	146.2	0	0	0	0	0	110.5	R701	A699-R701 PolarHBondContact O-N 3.01Å
700	G	42.5	Very low	44.1	Very low	89 Å²	89	145.9 Å²	145.9	92%	0.918	77%	0.768	S	S	*	*			trans	-58.6	123.2	-163.7	0	0	0	0	0	115.4
701	R	44.8	Very low	44.7	Very low	254 Å²	254	147.7 Å²	147.7	96%	0.958	77%	0.768	S	S	*	*			trans	-111	134.3	150.8	-76.2	-170.1	178.3	-167	0.5	108.4	A699	A699-R701 PolarHBondContact O-N 3.01Å
702	G	34.3	Very low	45.3	Very low	68 Å²	68	147 Å²	147	70%	0.701	77%	0.769	S	S	*	*			trans	-168.6	129.8	170	0	0	0	0	0	107.3	E704	G702-E704 PolarHBondContact O-N 3.29Å
703	D	48.8	Very low	45.4	Very low	152 Å²	152	150 Å²	150	81%	0.813	78%	0.776	S	S	*	*			trans	-76.9	72.9	171.9	-173.6	17.4	0	0	0	108.4	W705	D703-W705 PolarHBondContact O-N 3.3Å
704	E	47.5	Very low	45.5	Very low	168 Å²	168	149.4 Å²	149.4	79%	0.785	78%	0.778	S	S	*	*			trans	-82.5	69.5	-171.4	-162.6	171.6	-117.3	0	0	110.1	G702 S706	G702-E704 PolarHBondContact O-N 3.29Å; E704-S706 PolarHBondContact O-N 3.46Å; E704-S706 PolarHBondContact O-OG 3.03Å
705	W	50.8	Low	45.3	Very low	241 Å²	241	149.3 Å²	149.3	91%	0.913	79%	0.787	S	S	*	*			trans	-59	84.6	168.8	-120.6	62.4	0	0	0	109.1	D703 D707	D703-W705 PolarHBondContact O-N 3.3Å; W705-D707 PolarHBondContact O-N 3.31Å
706	S	54	Low	45.6	Very low	56 Å²	56	140.5 Å²	140.5	39%	0.392	77%	0.773	S	S	.	*			trans	-66.3	96.1	-176.2	-77.6	0	0	0	0	110.4	E704 P708 R711	E704-S706 PolarHBondContact O-N 3.46Å; E704-S706 PolarHBondContact O-OG 3.03Å; S706-P708 VanDerWaalsContact O-CD 3.3Å; S706-P708 WeakPolarHBondContact O-CD 3.4Å; S706-P708 VanDerWaalsContact O-N 3.12Å; S706-R711 PolarHBondContact OG-NH1 3.16Å
707	D	62	Low	45.3	Very low	74 Å²	74	147.6 Å²	147.6	40%	0.396	79%	0.788	S	S	.	*			trans	-48.6	118.5	167.2	174.4	5.9	0	0	0	109.6	W705 W709 M710	W705-D707 PolarHBondContact O-N 3.31Å; D707-W709 PolarHBondContact O-N 3.47Å; D707-W709 VanDerWaalsContact O-N 3.1Å; D707-W709 PolarHBondContact OD1-N 3.01Å; D707-M710 HydrophobicContact CB-CB 4.26Å; D707-M710 PolarHBondContact O-N 2.81Å; D707-M710 WeakPolarHBondContact OD2-CG 3.27Å
708	P	60.8	Low	45.2	Very low	110 Å²	110	142 Å²	142	71%	0.714	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-21.5	178.3	-26.4	36.2	0	0	0	114.5	S706	S706-P708 VanDerWaalsContact O-CD 3.3Å; S706-P708 WeakPolarHBondContact O-CD 3.4Å; S706-P708 VanDerWaalsContact O-N 3.12Å
709	W	59.4	Low	44.7	Very low	242 Å²	242	143 Å²	143	92%	0.917	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-14.2	-177.4	-65.1	-15.1	0	0	0	114.3	D707	D707-W709 PolarHBondContact O-N 3.47Å; D707-W709 VanDerWaalsContact O-N 3.1Å; D707-W709 PolarHBondContact OD1-N 3.01Å
710	M	51.6	Low	44.2	Very low	159 Å²	159	149 Å²	149	78%	0.783	79%	0.786	S	S	*	*	S	Bend	trans	-99.5	19.9	179.3	-76.2	-120.5	-74.8	0	0	115.1	D707 S712	D707-M710 HydrophobicContact CB-CB 4.26Å; D707-M710 PolarHBondContact O-N 2.81Å; D707-M710 WeakPolarHBondContact OD2-CG 3.27Å; M710-S712 PolarHBondContact O-N 2.87Å; M710-S712 VanDerWaalsContact O-N 3.15Å
711	R	53.7	Low	43.7	Very low	188 Å²	188	153.8 Å²	153.8	71%	0.709	78%	0.784	S	S	*	*			trans	-90.9	52.4	-168.1	-150.8	177.8	-169.1	82.8	4.3	116.1	S706	S706-R711 PolarHBondContact OG-NH1 3.16Å
712	S	46.5	Very low	43.1	Very low	106 Å²	106	153 Å²	153	74%	0.741	78%	0.781	S	S	*	*			trans	-149.4	85.1	175.9	63.2	0	0	0	0	116.8	M710	M710-S712 PolarHBondContact O-N 2.87Å; M710-S712 VanDerWaalsContact O-N 3.15Å
713	K	42.6	Very low	42.9	Very low	219 Å²	219	155.9 Å²	155.9	95%	0.952	78%	0.777	S	S	*	*			trans	-157.1	113.6	152.5	-107.9	159.6	-173.7	171.8	0	109.4
714	S	36.3	Very low	42.1	Very low	121 Å²	121	155.6 Å²	155.6	85%	0.846	78%	0.775	S	S	*	*			trans	-108.8	129.7	-170.9	53.6	0	0	0	0	113.6
715	V	35.2	Very low	41.4	Very low	154 Å²	154	158.3 Å²	158.3	93%	0.933	78%	0.778	S	S	*	*			trans	-102.7	128.1	163.2	175	0	0	0	0	107.5
716	G	34.4	Very low	40.8	Very low	60 Å²	60	157 Å²	157	62%	0.619	77%	0.773	S	S	*	*			cis	146.2	131.8	-8.5	0	0	0	0	0	111.9
717	R	31.8	Very low	39.9	Very low	253 Å²	253	165.4 Å²	165.4	96%	0.955	80%	0.796	S	S	*	*			trans	-176.7	137.6	163	-110.1	-178.7	-153.8	-67.4	-2.2	114.2
718	G	30.4	Very low	38.4	Very low	72 Å²	72	172.4 Å²	172.4	74%	0.742	82%	0.817	S	S	*	*			trans	74.7	112.6	161.1	0	0	0	0	0	115.8
719	S	32.3	Very low	37	Very low	122 Å²	122	172.8 Å²	172.8	85%	0.853	81%	0.813	S	S	*	*			cis	70	94.7	14.7	-162.6	0	0	0	0	116.8
720	Y	28.2	Very low	35.7	Very low	222 Å²	222	172.7 Å²	172.7	87%	0.871	81%	0.813	S	S	*	*			trans	-152.2	166.8	141.1	59.8	-91.5	0	0	0	110.6
721	E	31.3	Very low	34.8	Very low	188 Å²	188	175.5 Å²	175.5	88%	0.879	82%	0.815	S	S	*	*			trans	78.1	55.7	178.9	-153.8	153.1	-111.2	0	0	118.6
722	R	33.2	Very low	33.5	Very low	237 Å²	237	171.3 Å²	171.3	89%	0.894	81%	0.814	S	S	*	*			trans	-114.1	106.6	134.4	175.1	-169.2	-105.8	-164.1	-1.2	108.4
723	E	29.2	Very low	32.7	Very low	130 Å²	130	176.8 Å²	176.8	61%	0.607	82%	0.82	S	S	*	*			trans	-175.5	96.2	130.8	-168.7	63.4	-161.2	0	0	110.7
724	D	32.3	Very low	31.9	Very low	146 Å²	146	171.1 Å²	171.1	78%	0.781	81%	0.808	S	S	*	*			trans	-145.4	157.7	150.1	-160.5	-4.9	0	0	0	109.1
725	R	33.7	Very low	31.4	Very low	224 Å²	224	170.5 Å²	170.5	85%	0.845	80%	0.804	S	S	*	*			trans	72.8	49.3	176.8	-50.3	-178.1	-169.1	160.4	6.7	116.9
726	R	38.7	Very low	30.9	Very low	214 Å²	214	170.6 Å²	170.6	81%	0.808	80%	0.799	S	S	*	*			trans	-109.2	62.3	146.5	-88.3	-170.6	172.9	157.3	-5.9	113.4
727	R	33.5	Very low	30.5	Very low	233 Å²	233	173 Å²	173	88%	0.879	81%	0.806	S	S	*	*			trans	-148.2	136.9	152.7	-75.7	-154.3	179.1	-139.5	-5.2	114.1
728	R	31.5	Very low	30.2	Very low	220 Å²	220	165.9 Å²	165.9	83%	0.83	80%	0.795	S	S	*	*			trans	74	74.6	154.7	-161.2	176.7	-69.7	141.6	-4.4	117.7
729	D	31.8	Very low	30.1	Very low	118 Å²	118	173 Å²	173	63%	0.631	80%	0.802	S	S	*	*				18.8	111.9	111	-178.1	-0.4	0	0	0	116.2
730	R	32.3	Very low	29.8	Very low	241 Å²	241	171.4 Å²	171.4	91%	0.909	79%	0.79	S	S	*	*			trans	-153.9	134.3	131.7	-110.9	165.6	-166.1	-144.6	-1.4	112.7
731	R	31.9	Very low	29.8	Very low	218 Å²	218	167.4 Å²	167.4	82%	0.823	79%	0.789	S	S	*	*			trans	-75.4	155.4	-169.4	-63.8	169.5	162.4	129.6	-6.9	114.9
732	S	27.2	Very low	29.5	Very low	99 Å²	99	163.1 Å²	163.1	69%	0.692	78%	0.78	S	S	*	*			trans	84.7	122.2	142.8	-64.9	0	0	0	0	121.5
733	Y	28.6	Very low	29	Very low	221 Å²	221	158.4 Å²	158.4	87%	0.867	77%	0.773	S	S	*	*			trans	57.6	131.7	138.8	-78.8	-97.7	0	0	0	118.6
734	S	25.9	Very low	28.9	Very low	100 Å²	100	156.5 Å²	156.5	70%	0.699	77%	0.774	S	S	*	*			cis	-169.8	158.7	42.1	34.7	0	0	0	0	114
735	S	27.3	Very low	28.7	Very low	109 Å²	109	154.6 Å²	154.6	76%	0.762	77%	0.771	S	S	*	*			trans	58.2	121.9	144.9	-58	0	0	0	0	122.4
736	N	24.7	Very low	28.4	Very low	155 Å²	155	152.6 Å²	152.6	83%	0.829	77%	0.772	S	S	*	*			trans	-4.9	135.8	142.4	-56.9	16.9	0	0	0	117.3
737	S	24.4	Very low	27.9	Very low	111 Å²	111	147.5 Å²	147.5	78%	0.776	77%	0.769	S	S	*	*				-179.5	143.8	80.1	41.4	0	0	0	0	114.3
738	S	25.7	Very low	27.5	Very low	104 Å²	104	143.2 Å²	143.2	73%	0.727	76%	0.763	S	S	*	*			trans	26.3	157.6	140.6	-50.5	0	0	0	0	123.2
739	Y	29	Very low	27.2	Very low	222 Å²	222	137.3 Å²	137.3	87%	0.871	76%	0.756	S	S	*	*			trans	73.2	147	168.6	103.4	-101.4	0	0	0	116
740	S	25.7	Very low	27	Very low	88 Å²	88	137 Å²	137	62%	0.615	76%	0.763	S	S	*	*			cis	171.9	144.1	-32.6	-98.3	0	0	0	0	106.1
741	T	27.6	Very low	27.1	Very low	137 Å²	137	130.9 Å²	130.9	84%	0.84	76%	0.757	S	S	*	*			trans	64.2	155.2	167.2	63	0	0	0	0	115.4
742	S	24.9	Very low	26.8	Very low	99 Å²	99	127.6 Å²	127.6	69%	0.692	76%	0.756	S	S	*	*			cis	-160	144.4	-3	-125.8	0	0	0	0	112.9
743	N	23.3	Very low	26.9	Very low	138 Å²	138	128 Å²	128	74%	0.738	76%	0.759	S	S	*	*				66.4	162.2	126.2	-161.4	75.7	0	0	0	121.3
744	S	27.2	Very low	26.9	Very low	90 Å²	90	121.8 Å²	121.8	63%	0.629	75%	0.747	S	S	*	*			trans	74.6	112.1	173	-6.9	0	0	0	0	113.1
745	S	27.4	Very low	27.2	Very low	105 Å²	105	127.7 Å²	127.7	73%	0.734	75%	0.754	S	S	*	*			cis	77.9	147.3	36.8	-44.4	0	0	0	0	114.6
746	Q	28.7	Very low	27.2	Very low	182 Å²	182	127.2 Å²	127.2	85%	0.85	75%	0.751	S	S	*	*			trans	76.8	118	-169.8	-57.4	179.4	-11.7	0	0	111.7
747	S	26.6	Very low	27.2	Very low	107 Å²	107	126.1 Å²	126.1	75%	0.748	76%	0.756	S	S	*	*				61.4	117	66.3	-52	0	0	0	0	109.2
748	D	25.7	Very low	27.7	Very low	143 Å²	143	125.6 Å²	125.6	77%	0.765	75%	0.752	S	S	*	*				-170.5	168.8	61.9	-130.5	-62.7	0	0	0	114.5
749	S	25.3	Very low	28.1	Very low	96 Å²	96	127 Å²	127	67%	0.671	76%	0.758	S	S	*	*			trans	56.5	110.4	145.8	-68.8	0	0	0	0	122.7
750	S	26.8	Very low	28.2	Very low	112 Å²	112	122.2 Å²	122.2	78%	0.783	76%	0.758	S	S	*	*				119.6	153.9	113.4	77.1	0	0	0	0	119.8
751	S	34.3	Very low	28.3	Very low	112 Å²	112	123.1 Å²	123.1	78%	0.783	76%	0.756	S	S	*	*			trans	66.2	97.4	178.5	-48.5	0	0	0	0	114.2
752	D	27.6	Very low	28.3	Very low	149 Å²	149	120.3 Å²	120.3	80%	0.797	73%	0.733	S	S	*	*			cis	66.6	143.6	33.2	-152.5	-1.8	0	0	0	114.7
753	S	27.7	Very low	28.7	Very low	109 Å²	109	125.3 Å²	125.3	76%	0.762	74%	0.742	S	S	*	*			trans	66.3	106.4	-159.2	72.4	0	0	0	0	114.2
754	S	29.4	Very low	29.4	Very low	89 Å²	89	129.7 Å²	129.7	62%	0.622	75%	0.748	S	S	*	*			cis	66	93.5	10.1	-143.5	0	0	0	0	114.7
755	R	31.9	Very low	29.6	Very low	224 Å²	224	135.3 Å²	135.3	85%	0.845	76%	0.756	S	S	*	*				130.3	138.8	128.4	-70.9	156.7	177.5	-157.7	-4.7	117.9
756	S	28	Very low	29.8	Very low	100 Å²	100	139.9 Å²	139.9	70%	0.699	76%	0.758	S	S	*	*			trans	45.3	114.8	141.4	66.8	0	0	0	0	120.4	S758	S756-S758 PolarHBondContact O-N 2.66Å
757	S	25	Very low	29.9	Very low	132 Å²	132	134.8 Å²	134.8	92%	0.923	76%	0.755	S	S	*	*			trans	-76.7	112.1	145.8	-71.4	0	0	0	0	109.8
758	S	33.8	Very low	30.1	Very low	100 Å²	100	134.7 Å²	134.7	70%	0.699	75%	0.754	S	S	*	*			trans	-134.8	160.7	165.8	-92.2	0	0	0	0	108.3	S756	S756-S758 PolarHBondContact O-N 2.66Å
759	P	34.3	Very low	30.5	Very low	132 Å²	132	136.8 Å²	136.8	86%	0.857	76%	0.759	S	S	*	*			trans	-65	133.5	-131	20.1	-33.2	0	0	0	114.9
760	S	30.1	Very low	31	Very low	122 Å²	122	141 Å²	141	85%	0.853	77%	0.765	S	S	*	*			trans	-88.7	127.7	176.9	70	0	0	0	0	112.1
761	D	28.4	Very low	31.3	Very low	107 Å²	107	143.3 Å²	143.3	57%	0.572	77%	0.768	S	S	*	*			trans	-145	169.9	151	-148.7	-23.7	0	0	0	109.7
762	H	28.7	Very low	31.2	Very low	79 Å²	79	141.7 Å²	141.7	37%	0.366	76%	0.761	S	S	.	*			trans	103.4	57.9	167.8	-60.9	-8	0	0	0	119.5	R797 R798	H762-R797 VanDerWaalsContact C-NH2 3.3Å; H762-R797 PolarHBondContact CD2-NH1 2.86Å; H762-R797 WeakPolarHBondContact ND1-CD 3.35Å; H762-R797 WeakPolarHBondContact ND1-CG 3.22Å; H762-R797 PolarHBondContact ND1-NE 2.77Å; H762-R797 PolarHBondContact ND1-NH1 3.49Å; H762-R797 PolarHBondContact O-NH2 3.01Å; H762-R798 PolarHBondContact NE2-O 2.98Å
763	K	32.5	Very low	31.3	Very low	204 Å²	204	140.9 Å²	140.9	89%	0.887	76%	0.762	S	S	*	*			trans	-72.1	150.7	158.9	-101.4	-178.4	178.7	175.4	0	113.3	R797	K763-R797 PolarHBondContact O-NH2 2.77Å
764	R	37.7	Very low	31.4	Very low	229 Å²	229	139.6 Å²	139.6	86%	0.864	76%	0.758	S	S	*	*			trans	-110.4	157.9	-153.6	-41.4	176.5	-170.5	-164.6	2.4	115.6
765	R	32.5	Very low	31.5	Very low	209 Å²	209	142.4 Å²	142.4	79%	0.789	77%	0.771	S	S	*	*			trans	-173.4	155.4	134.8	-99.2	173.4	-169.4	-148.6	3.1	106.9
766	Y	30.1	Very low	31.6	Very low	201 Å²	201	135.3 Å²	135.3	79%	0.788	76%	0.761	S	S	*	*			cis	-107.5	178.7	1.3	-77.9	-86	0	0	0	110
767	G	30.7	Very low	32	Very low	75 Å²	75	137.2 Å²	137.2	77%	0.773	77%	0.769	S	S	*	*			cis	98.7	107.2	24.5	0	0	0	0	0	108.7
768	S	31.4	Very low	32.4	Very low	105 Å²	105	135.2 Å²	135.2	73%	0.734	75%	0.754	S	S	*	*			trans	-99.2	131.7	-172.2	174.5	0	0	0	0	111.2
769	H	34.9	Very low	32.6	Very low	187 Å²	187	140.7 Å²	140.7	87%	0.866	76%	0.76	S	S	*	*			trans	-156.8	119.7	144.4	-84.1	-52.5	0	0	0	112.2
770	K	34.7	Very low	32.7	Very low	184 Å²	184	144.3 Å²	144.3	80%	0.8	76%	0.756	S	S	*	*			trans	22.8	137.5	141.3	-75.1	-173.9	175.4	-176.5	0	122.1
771	L	33.8	Very low	32.9	Very low	160 Å²	160	146.3 Å²	146.3	84%	0.838	75%	0.752	S	S	*	*			trans	98	129.8	142.5	-72.7	158.6	0	0	0	121.6
772	A	31.7	Very low	33	Very low	79 Å²	79	145.1 Å²	145.1	65%	0.653	77%	0.765	S	S	*	*			trans	74.3	137.7	139.2	0	0	0	0	0	122.7
773	T	29.3	Very low	33.2	Very low	131 Å²	131	144.8 Å²	144.8	80%	0.804	78%	0.783	S	S	*	*			trans	35.5	114.8	144.2	54.7	0	0	0	0	119.6
774	A	31	Very low	33.3	Very low	83 Å²	83	147 Å²	147	69%	0.686	79%	0.786	S	S	*	*				100.6	141.8	54.9	0	0	0	0	0	113.3
775	T	32	Very low	33.1	Very low	147 Å²	147	141 Å²	141	90%	0.902	78%	0.784	S	S	*	*			trans	63.5	155.6	172.4	60.1	0	0	0	0	118.3
776	A	33.8	Very low	33.1	Very low	75 Å²	75	135.4 Å²	135.4	62%	0.62	78%	0.783	S	S	*	*			cis	-168.3	152.6	-30.2	0	0	0	0	0	111.8
777	T	36.3	Very low	33.3	Very low	141 Å²	141	137.8 Å²	137.8	87%	0.865	79%	0.79	S	S	*	*			trans	66.1	167.5	169	76.8	0	0	0	0	116.5
778	S	33.1	Very low	33.4	Very low	89 Å²	89	139.7 Å²	139.7	62%	0.622	79%	0.792	S	S	*	*			cis	-157	142	8.5	-150.9	0	0	0	0	114.9
779	R	37.6	Very low	33.9	Very low	215 Å²	215	140.9 Å²	140.9	81%	0.811	80%	0.797	S	S	*	*			trans	52.3	125.3	141.1	-70.1	174.8	-172.2	-167.1	2.7	124.9
780	R	36.1	Very low	33.7	Very low	208 Å²	208	136.9 Å²	136.9	79%	0.785	79%	0.791	S	S	*	*			trans	95.5	152.9	130.5	-75.5	-177.6	177.9	-146.3	-1.5	122.7
781	H	35.5	Very low	33.8	Very low	164 Å²	164	136.5 Å²	136.5	76%	0.759	79%	0.791	S	S	*	*			trans	-30.3	160	-179.7	-39.4	-80.8	0	0	0	118.2
782	G	30.4	Very low	33.8	Very low	82 Å²	82	135.6 Å²	135.6	85%	0.845	79%	0.786	S	S	*	*			cis	99.2	132.4	21.3	0	0	0	0	0	111.2
783	G	32.6	Very low	34.6	Very low	72 Å²	72	136.6 Å²	136.6	74%	0.742	79%	0.786	S	S	*	*			cis	177.3	-157.8	-0.2	0	0	0	0	0	111.1
784	R	34.7	Very low	34.8	Very low	252 Å²	252	141.8 Å²	141.8	95%	0.951	79%	0.791	S	S	*	*			trans	87.4	132.2	170.1	-60	179.8	167.9	-108.4	-0.7	121.1
785	A	32.7	Very low	34.9	Very low	101 Å²	101	148.6 Å²	148.6	84%	0.835	80%	0.799	S	S	*	*			trans	87.6	148.2	133.8	0	0	0	0	0	124.3
786	A	32.9	Very low	35.4	Very low	92 Å²	92	146.8 Å²	146.8	76%	0.76	79%	0.79	S	S	*	*			trans	81.9	108.4	153.6	0	0	0	0	0	122.5
787	R	34.6	Very low	35.4	Very low	251 Å²	251	149.8 Å²	149.8	95%	0.947	79%	0.785	S	S	*	*			trans	50.4	145.4	135.8	-69	-179.7	170.4	172.8	-4.2	122.4
788	S	32.7	Very low	35.4	Very low	116 Å²	116	153.2 Å²	153.2	81%	0.811	78%	0.782	S	S	*	*			trans	-63.7	159.2	-179.3	-31.1	0	0	0	0	114.1
789	P	42.2	Very low	35.5	Very low	129 Å²	129	154.9 Å²	154.9	84%	0.838	79%	0.788	S	S	*	*				-142.8	-168.7	75.2	40.9	-24	0	0	0	115.7
790	S	30.9	Very low	35.4	Very low	104 Å²	104	149.8 Å²	149.8	73%	0.727	79%	0.785	S	S	*	*			trans	-59.4	148.1	178.3	179.5	0	0	0	0	114.9
791	Q	35.8	Very low	35.9	Very low	175 Å²	175	150.2 Å²	150.2	82%	0.818	79%	0.793	S	S	*	*			trans	-178	171.6	135.5	-93	-65	-9.6	0	0	110.2
792	I	33.5	Very low	36	Very low	141 Å²	141	145.8 Å²	145.8	72%	0.723	79%	0.792	S	S	*	*			trans	-121.2	163.1	-161.4	-62.5	168.8	0	0	0	110.5
793	P	48.5	Very low	36.4	Very low	100 Å²	100	147.6 Å²	147.6	65%	0.649	79%	0.792	S	S	*	*			cis	-129.1	171.7	-26.5	33.2	-15.6	0	0	0	115.4
794	R	33.2	Very low	36.8	Very low	240 Å²	240	152 Å²	152	91%	0.906	80%	0.797	S	S	*	*				165.9	138.8	122.3	-88.9	159.4	-166.9	-123.7	-0.2	116.5
795	R	34.4	Very low	37.3	Very low	227 Å²	227	144.9 Å²	144.9	86%	0.857	79%	0.786	S	S	*	*			trans	5.1	134	163.2	-84.5	-175.6	169.1	146	1.2	122
796	P	41.1	Very low	38.5	Very low	109 Å²	109	145.9 Å²	145.9	71%	0.708	78%	0.784	S	S	*	*			trans	-100.3	171.5	160.8	39.2	-32.8	0	0	0	114.5
797	R	35	Very low	38.7	Very low	137 Å²	137	146 Å²	146	52%	0.517	78%	0.78	S	S	.	*			trans	-137.6	153.7	163.1	-107	-140.8	-179.5	-146.8	11.1	108	H762 K763	H762-R797 VanDerWaalsContact C-NH2 3.3Å; H762-R797 PolarHBondContact CD2-NH1 2.86Å; H762-R797 WeakPolarHBondContact ND1-CD 3.35Å; H762-R797 WeakPolarHBondContact ND1-CG 3.22Å; H762-R797 PolarHBondContact ND1-NE 2.77Å; H762-R797 PolarHBondContact ND1-NH1 3.49Å; H762-R797 PolarHBondContact O-NH2 3.01Å; K763-R797 PolarHBondContact O-NH2 2.77Å
798	R	36	Very low	38.6	Very low	214 Å²	214	143.5 Å²	143.5	81%	0.808	77%	0.772	S	S	*	*			trans	-136.1	161.8	173.6	-82.7	-167.6	-179.6	-93.2	3.9	115.2	H762	H762-R798 PolarHBondContact NE2-O 2.98Å
799	T	35	Very low	38.7	Very low	124 Å²	124	147.2 Å²	147.2	76%	0.761	77%	0.773	S	S	*	*			trans	-138.8	-175.5	171.8	55.5	0	0	0	0	107.6
800	S	36.6	Very low	38.3	Very low	107 Å²	107	152 Å²	152	75%	0.748	77%	0.774	S	S	*	*			cis	-153.4	-166.8	23.6	-56.4	0	0	0	0	111.4
801	K	44.9	Very low	39.1	Very low	217 Å²	217	153 Å²	153	94%	0.943	78%	0.778	S	S	*	*			trans	-142.8	162.5	166	-75.3	-171.3	175.9	-175.2	0	111.4
802	G	38.6	Very low	39.1	Very low	72 Å²	72	148.4 Å²	148.4	74%	0.742	77%	0.771	S	S	*	*			trans	131.1	159.7	172.8	0	0	0	0	0	112.4
803	S	37.9	Very low	39.2	Very low	119 Å²	119	148.5 Å²	148.5	83%	0.832	78%	0.777	S	S	*	*			cis	176.5	159.2	-7.9	45.6	0	0	0	0	107.7
804	L	42.6	Very low	38.5	Very low	164 Å²	164	150.4 Å²	150.4	86%	0.859	78%	0.782	S	S	*	*			cis	-158.6	-161.4	4.6	-130.1	172.8	0	0	0	109.5
805	S	43.8	Very low	38.5	Very low	104 Å²	104	147.8 Å²	147.8	73%	0.727	78%	0.777	S	S	*	*			trans	-146.2	170.6	180	61	0	0	0	0	114.2
806	P	57.5	Low	38.4	Very low	121 Å²	121	148.1 Å²	148.1	79%	0.786	78%	0.779	S	S	*	*			trans	-138.4	138.4	172.2	38.1	-20.9	0	0	0	118.7
807	S	37.9	Very low	37.8	Very low	95 Å²	95	146 Å²	146	66%	0.664	78%	0.776	S	S	*	*			trans	39.7	142.1	143.6	-133.9	0	0	0	0	122.5
808	Y	32.8	Very low	37.8	Very low	199 Å²	199	147.2 Å²	147.2	78%	0.78	80%	0.798	S	S	*	*			cis	-160	142.9	44.5	-106.1	-76.7	0	0	0	116
809	K	35.2	Very low	37.5	Very low	194 Å²	194	140.1 Å²	140.1	84%	0.843	79%	0.792	S	S	*	*			trans	63.3	170.3	150	-87.2	172.8	-177.3	-178.7	0	122.2
810	R	33.8	Very low	37.4	Very low	229 Å²	229	143.5 Å²	143.5	86%	0.864	80%	0.799	S	S	*	*			trans	-153.1	173.7	-155.2	-124	-171.2	-177.3	-164.4	0.9	108.3
811	P	47.5	Very low	37.6	Very low	125 Å²	125	143.7 Å²	143.7	81%	0.812	80%	0.8	S	S	*	*			cis	-137.5	-169.1	44.8	40.1	-20	0	0	0	115.5
812	A	35.3	Very low	38	Very low	79 Å²	79	139.1 Å²	139.1	65%	0.653	79%	0.793	S	S	*	*			trans	-129.9	169.9	-176.7	0	0	0	0	0	111.8
813	V	35.3	Very low	37.6	Very low	142 Å²	142	140.7 Å²	140.7	86%	0.861	79%	0.792	S	S	*	*			trans	-148.9	135.5	163.1	-117.2	0	0	0	0	112
814	D	33.5	Very low	37.5	Very low	141 Å²	141	140.1 Å²	140.1	75%	0.754	79%	0.789	S	S	*	*			trans	-88.6	177.7	-177.8	-52.4	-98.9	0	0	0	115.1
815	K	33.2	Very low	37	Very low	184 Å²	184	141.6 Å²	141.6	80%	0.8	79%	0.788	S	S	*	*			trans	116.1	132.8	158.3	-65	149.9	-167.9	166.9	0	112.8
816	R	33	Very low	36.8	Very low	235 Å²	235	146 Å²	146	89%	0.887	79%	0.789	S	S	*	*			cis	-158.1	166.3	-4.3	-92.6	167.1	-61.3	176.3	4.4	107.3
817	G	29.2	Very low	35.9	Very low	64 Å²	64	147.2 Å²	147.2	66%	0.66	78%	0.782	S	S	*	*			cis	131.7	125.8	-5.8	0	0	0	0	0	114.4
818	V	33.3	Very low	36	Very low	162 Å²	162	150.8 Å²	150.8	98%	0.982	79%	0.785	S	S	*	*			trans	75.4	130.2	173.4	-171.5	0	0	0	0	117.6
819	G	31.3	Very low	36.1	Very low	66 Å²	66	147.8 Å²	147.8	68%	0.68	78%	0.782	S	S	*	*			trans	133.6	106.9	141.1	0	0	0	0	0	119.1
820	H	33	Very low	35.8	Very low	194 Å²	194	143.4 Å²	143.4	90%	0.898	78%	0.776	S	S	*	*			trans	-34.1	145.8	162.7	-67.6	68.5	0	0	0	118
821	S	39.5	Very low	36	Very low	111 Å²	111	137.5 Å²	137.5	78%	0.776	77%	0.77	S	S	*	*			trans	-60.8	170.4	156.2	-45.7	0	0	0	0	112.3
822	P	54.5	Low	35.9	Very low	121 Å²	121	137.8 Å²	137.8	79%	0.786	77%	0.771	S	S	*	*			cis	-139.5	-171.4	9.6	41.1	-21.3	0	0	0	116.4
823	S	29.8	Very low	36	Very low	105 Å²	105	138.2 Å²	138.2	73%	0.734	78%	0.775	S	S	*	*			trans	115.5	127.8	138.2	-152.5	0	0	0	0	121.1
824	S	35.7	Very low	36.9	Very low	108 Å²	108	134.7 Å²	134.7	76%	0.755	76%	0.755	S	S	*	*			trans	54.2	113.4	146	-64.5	0	0	0	0	123.8
825	K	32.6	Very low	37.1	Very low	195 Å²	195	133 Å²	133	85%	0.848	74%	0.741	S	S	*	*			trans	-132.4	119.4	135	-76.3	-176.2	-174.9	167.8	0	107.3
826	R	39.4	Very low	37.3	Very low	196 Å²	196	131.5 Å²	131.5	74%	0.74	73%	0.734	S	S	*	*				73.8	133.7	81.6	-77.3	170.9	122.3	-106.5	14.1	112.1
827	K	38.8	Very low	37.2	Very low	147 Å²	147	129.8 Å²	129.8	64%	0.639	73%	0.734	S	S	*	*			cis	-175.8	167.9	-0.8	-131.4	179.7	-173.5	-167.4	0	112.2
828	K	39	Very low	37.4	Very low	169 Å²	169	131.1 Å²	131.1	74%	0.735	73%	0.726	S	S	*	*			trans	71.2	149.6	151.5	-74.4	-175.1	155.9	-160.8	0	116.3
829	L	34.6	Very low	37.5	Very low	137 Å²	137	130.7 Å²	130.7	72%	0.717	71%	0.711	S	S	*	*			cis	-156.2	165.4	-4	-103.8	159.6	0	0	0	106.5
830	S	30.3	Very low	37.6	Very low	102 Å²	102	133.1 Å²	133.1	71%	0.713	71%	0.708	S	S	*	*			cis	-150.6	171.5	-0.4	-164.9	0	0	0	0	110
831	S	36.7	Very low	37.8	Very low	105 Å²	105	132.4 Å²	132.4	73%	0.734	70%	0.697	S	S	*	*			trans	-112.9	173.1	166.2	-50.5	0	0	0	0	110.8
832	P	46.8	Very low	37.6	Very low	130 Å²	130	135 Å²	135	84%	0.844	69%	0.69	S	S	*	*				-145.2	174.9	96.3	39.8	-24.7	0	0	0	116.3
833	A	35.3	Very low	36.5	Very low	88 Å²	88	138.1 Å²	138.1	73%	0.727	69%	0.686	S	S	*	*			trans	-132	-155.4	167.7	0	0	0	0	0	106.8
834	P	56.3	Low	36.6	Very low	68 Å²	68	143 Å²	143	44%	0.442	69%	0.688	S	S	.	*			cis	-128.9	-166.3	-13.7	38	-16.3	0	0	0	112.2	D47	D47-P834 VanDerWaalsContact CG-CD 3.44Å; D47-P834 WeakPolarHBondContact OD1-CG 3.39Å; D47-P834 WeakPolarHBondContact OD2-CD 3.48Å; D47-P834 WeakPolarHBondContact OD2-CG 3.43Å
835	K	37.6	Very low	36.3	Very low	106 Å²	106	143 Å²	143	46%	0.461	69%	0.688	S	S	.	*				-175.3	138.3	83.4	-89.4	175.4	174.6	144.8	0	112.8	G46 D47	G46-K835 WeakPolarHBondContact O-CE 3.35Å; G46-K835 PolarHBondContact O-NZ 3.28Å; D47-K835 PolarHBondContact O-NZ 3.41Å; D47-K835 VanDerWaalsContact OD1-CE 3.3Å; D47-K835 WeakPolarHBondContact OD1-CE 3.48Å
836	K	37.2	Very low	36.2	Very low	153 Å²	153	138.9 Å²	138.9	67%	0.665	68%	0.684	S	S	*	*				44.5	132.8	127.6	-51.5	167.6	-169.2	172.5	0	117.8	P48	P48-K836 PolarHBondContact O-NZ 2.72Å
837	F	31.1	Very low	35.7	Very low	198 Å²	198	135.2 Å²	135.2	87%	0.868	69%	0.688	S	S	*	*			cis	-149.2	174.4	31.4	-163.5	-102.3	0	0	0	114
838	D	33.2	Very low	35.2	Very low	93 Å²	93	133.1 Å²	133.1	50%	0.497	69%	0.692	S	S	.	*			trans	-58.5	163.4	177.1	-134.9	-4.3	0	0	0	112.7
839	K	35.6	Very low	34.7	Very low	153 Å²	153	130 Å²	130	67%	0.665	69%	0.691	S	S	*	*			cis	-167	127	27.3	-161	165.9	-158.8	83.2	0	114.1
840	L	33.3	Very low	34.5	Very low	117 Å²	117	130.6 Å²	130.6	61%	0.613	70%	0.695	S	S	*	*			trans	47.2	149	147.7	-50	175.2	0	0	0	120.5
841	R	37.3	Very low	34.5	Very low	179 Å²	179	131 Å²	131	68%	0.675	70%	0.698	S	S	*	*			cis	-177.3	158.5	-5.7	-109.4	-179.6	177.9	166.1	5	107
842	R	33.7	Very low	34.2	Very low	165 Å²	165	132.7 Å²	132.7	62%	0.623	70%	0.699	S	S	*	*			cis	-169.9	162.8	-8.5	-144.7	-170	-35.9	-157.1	11	110
843	R	32.7	Very low	33.5	Very low	187 Å²	187	131 Å²	131	71%	0.706	69%	0.69	S	S	*	*			trans	79.6	146.1	154.2	-73.9	-169.8	174.1	-155.6	-2.7	118.5
844	R	31.6	Very low	33.6	Very low	206 Å²	206	132.5 Å²	132.5	78%	0.777	70%	0.695	S	S	*	*			cis	-169	156	-21.6	-133.7	-178	-177.8	-157.5	-4.5	110.4
845	S	28.6	Very low	32.4	Very low	108 Å²	108	136.5 Å²	136.5	76%	0.755	71%	0.713	S	S	*	*			trans	-142	163.5	160.5	-65.1	0	0	0	0	111.4
846	S	32.1	Very low	32.2	Very low	110 Å²	110	137 Å²	137	77%	0.769	73%	0.725	S	S	*	*			trans	57.1	137.6	163.7	47.1	0	0	0	0	122.5
847	S	28.3	Very low	32	Very low	118 Å²	118	135.1 Å²	135.1	83%	0.825	73%	0.731	S	S	*	*			trans	60.2	148.6	146.9	-63.1	0	0	0	0	120.9
848	S	29.1	Very low	32	Very low	103 Å²	103	135.8 Å²	135.8	72%	0.72	73%	0.73	S	S	*	*			cis	-165	-175.1	-12.3	53.1	0	0	0	0	109.9
849	S	28	Very low	31.9	Very low	103 Å²	103	135.6 Å²	135.6	72%	0.72	74%	0.735	S	S	*	*			trans	91.2	157.6	154.8	-52.5	0	0	0	0	118.6
850	D	30.3	Very low	31.5	Very low	150 Å²	150	134.3 Å²	134.3	80%	0.802	74%	0.736	S	S	*	*			trans	-111.5	161.5	-141.5	-41.9	-98.2	0	0	0	114.4
851	S	29.8	Very low	31.4	Very low	110 Å²	110	133.1 Å²	133.1	77%	0.769	74%	0.738	S	S	*	*				163.3	128	127.2	-94.2	0	0	0	0	113.7
852	D	30.7	Very low	31.1	Very low	141 Å²	141	133.5 Å²	133.5	75%	0.754	75%	0.747	S	S	*	*			trans	46.1	114	145.7	-80	-72.2	0	0	0	124.5
853	S	31	Very low	31	Very low	95 Å²	95	131.4 Å²	131.4	66%	0.664	76%	0.758	S	S	*	*				74.4	103.6	117.8	-62.3	0	0	0	0	121.8
854	S	39	Very low	30.9	Very low	119 Å²	119	126 Å²	126	83%	0.832	76%	0.759	S	S	*	*			trans	68.5	112.4	131.6	-53.9	0	0	0	0	121.7
855	D	29.4	Very low	30.9	Very low	153 Å²	153	121.1 Å²	121.1	82%	0.818	76%	0.757	S	S	*	*				-151.7	-176.2	124.3	-145	-30.9	0	0	0	111.1
856	T	34.4	Very low	31.1	Very low	116 Å²	116	121.5 Å²	121.5	71%	0.712	76%	0.76	S	S	*	*			trans	-128.2	-178.2	-155	56.6	0	0	0	0	113.7
857	S	32.8	Very low	31.2	Very low	113 Å²	113	121.5 Å²	121.5	79%	0.79	76%	0.76	S	S	*	*			trans	89.8	109.7	-172.6	-42.6	0	0	0	0	113
858	Y	30	Very low	31.4	Very low	213 Å²	213	120.6 Å²	120.6	84%	0.835	75%	0.753	S	S	*	*			cis	88.2	134	35.2	-158.1	-87.5	0	0	0	113.7
859	S	31.2	Very low	31.3	Very low	88 Å²	88	122.8 Å²	122.8	62%	0.615	76%	0.757	S	S	*	*			trans	66.6	150.3	177.1	-76.1	0	0	0	0	119.3
860	D	28.9	Very low	31.3	Very low	126 Å²	126	122.3 Å²	122.3	67%	0.674	75%	0.754	S	S	*	*			cis	-173.1	-177.1	-27.7	-113.9	-55.9	0	0	0	109.7
861	S	30	Very low	31.3	Very low	93 Å²	93	120.2 Å²	120.2	65%	0.65	75%	0.751	S	S	*	*			trans	76.4	162.8	154.6	-51.8	0	0	0	0	118
862	E	31.1	Very low	31.2	Very low	186 Å²	186	121 Å²	121	87%	0.869	76%	0.756	S	S	*	*			cis	-132.5	151.3	2.2	-30.6	-120.9	109.2	0	0	111.6
863	S	31.1	Very low	31	Very low	122 Å²	122	117.8 Å²	117.8	85%	0.853	76%	0.756	S	S	*	*			trans	-96.1	160.8	170.2	51.6	0	0	0	0	112.1
864	G	32	Very low	30.8	Very low	72 Å²	72	118.2 Å²	118.2	74%	0.742	76%	0.759	S	S	*	*			trans	169.6	79.9	-179	0	0	0	0	0	112.2
865	S	31.1	Very low	30.4	Very low	105 Å²	105	121.9 Å²	121.9	73%	0.734	76%	0.755	S	S	*	*				81.6	86.9	68.3	-59.4	0	0	0	0	114.8
866	S	32.6	Very low	30.5	Very low	116 Å²	116	122 Å²	122	81%	0.811	75%	0.751	S	S	*	*			trans	66	137.8	130.6	-53.5	0	0	0	0	123.5
867	S	34.4	Very low	30.5	Very low	109 Å²	109	122.4 Å²	122.4	76%	0.762	75%	0.753	S	S	*	*			trans	106.6	126.9	140.3	74.1	0	0	0	0	120.1
868	S	32.4	Very low	31.6	Very low	99 Å²	99	121.8 Å²	121.8	69%	0.692	75%	0.747	S	S	*	*			trans	15.5	140	148	48.6	0	0	0	0	119.9
869	D	26.9	Very low	31.7	Very low	149 Å²	149	118.1 Å²	118.1	80%	0.797	74%	0.737	S	S	*	*			cis	-158.8	-160.3	49.6	-141.2	-50.5	0	0	0	114.8
870	S	28.4	Very low	31.9	Very low	93 Å²	93	121.5 Å²	121.5	65%	0.65	74%	0.741	S	S	*	*			trans	-103	162.6	-151.7	-51.1	0	0	0	0	116.6
871	S	29.6	Very low	32.1	Very low	107 Å²	107	125.4 Å²	125.4	75%	0.748	75%	0.746	S	S	*	*			trans	99.4	123.7	148.3	-52.1	0	0	0	0	121
872	S	28	Very low	32.2	Very low	126 Å²	126	126.5 Å²	126.5	88%	0.881	75%	0.749	S	S	*	*			trans	67.2	121.6	135.9	-61.6	0	0	0	0	121.8
873	G	26.1	Very low	32.3	Very low	73 Å²	73	128 Å²	128	75%	0.753	75%	0.746	S	S	*	*			trans	150.3	97.6	137.3	0	0	0	0	0	118.8
874	S	26.8	Very low	32.6	Very low	104 Å²	104	126.4 Å²	126.4	73%	0.727	74%	0.74	S	S	*	*			trans	43.4	119.6	134.7	-78.9	0	0	0	0	122.5
875	R	31.8	Very low	33.3	Very low	196 Å²	196	129.5 Å²	129.5	74%	0.74	75%	0.745	S	S	*	*				92.3	153.9	122.3	-70.5	171.7	178.1	-132	7.7	122.5
876	E	31.1	Very low	33.5	Very low	155 Å²	155	130 Å²	130	72%	0.724	74%	0.739	S	S	*	*			trans	70.9	81.7	143.5	-76	144.1	-175.7	0	0	119.7
877	T	33.7	Very low	33.7	Very low	126 Å²	126	132.8 Å²	132.8	77%	0.773	74%	0.737	S	S	*	*			trans	-57.8	179.2	136.3	77.5	0	0	0	0	111.7
878	P	55.4	Low	33.8	Very low	100 Å²	100	131.5 Å²	131.5	65%	0.649	73%	0.733	S	S	*	*			cis	-126.5	-164.5	-23	32.5	-13.7	0	0	0	111
879	Q	34.1	Very low	34	Very low	135 Å²	135	134.6 Å²	134.6	63%	0.631	74%	0.741	S	S	*	*				166.6	134.8	115.7	-91.2	172.8	57.2	0	0	116.7
880	K	33.8	Very low	34.2	Very low	159 Å²	159	134.5 Å²	134.5	69%	0.691	74%	0.74	S	S	*	*			trans	68.3	155	139.1	-70.3	168.6	-169.4	163.7	0	116.7
881	R	33.8	Very low	34.6	Very low	209 Å²	209	136.2 Å²	136.2	79%	0.789	74%	0.738	S	S	*	*			cis	-160.7	148.4	0.6	156	-168.3	-54.8	-117	9.9	105.4
882	V	31	Very low	35	Very low	116 Å²	116	140.1 Å²	140.1	70%	0.703	74%	0.736	S	S	*	*			cis	112.8	85.7	48.7	-59.9	0	0	0	0	113.7
883	R	35.1	Very low	35.7	Very low	218 Å²	218	141.1 Å²	141.1	82%	0.823	73%	0.725	S	S	*	*			trans	87.1	137.4	167.8	-58.5	169.8	171.4	77.1	2.8	115.3
884	A	37.1	Very low	36.1	Very low	88 Å²	88	144.2 Å²	144.2	73%	0.727	72%	0.723	S	S	*	*			cis	91	159.5	28.5	0	0	0	0	0	115.3
885	T	46.1	Very low	36.5	Very low	136 Å²	136	146 Å²	146	83%	0.834	72%	0.723	S	S	*	*			trans	120.9	141.4	177.3	54.6	0	0	0	0	113.6
886	D	34.2	Very low	36.4	Very low	115 Å²	115	141.6 Å²	141.6	62%	0.615	72%	0.722	S	S	*	*			cis	-170.1	166.8	-26.3	-147.7	-8.8	0	0	0	113.1
887	K	38.2	Very low	36.5	Very low	176 Å²	176	143.6 Å²	143.6	77%	0.765	73%	0.729	S	S	*	*			trans	69.4	154.6	156.6	-69.9	153.3	-177.8	116	0	118.4
888	A	36.1	Very low	37.1	Very low	82 Å²	82	143 Å²	143	68%	0.678	73%	0.727	S	S	*	*			cis	-143.9	144.6	13.6	0	0	0	0	0	114.5
889	L	36.7	Very low	35.8	Very low	164 Å²	164	145.1 Å²	145.1	86%	0.859	73%	0.729	S	S	*	*			trans	46.2	145.9	139	-52.9	175.8	0	0	0	120.2
890	N	30.8	Very low	35.6	Very low	146 Å²	146	146 Å²	146	78%	0.781	73%	0.733	S	S	*	*			cis	-150.8	176.3	34.9	-161.6	5	0	0	0	113.4
891	E	36.2	Very low	35.5	Very low	130 Å²	130	142.6 Å²	142.6	61%	0.607	73%	0.729	S	S	*	*			trans	-87.6	176.6	-168.5	-59	178.1	160.2	0	0	116.9
892	R	39.2	Very low	35.5	Very low	188 Å²	188	137.6 Å²	137.6	71%	0.709	72%	0.722	S	S	*	*			trans	105.3	136.4	143.6	-52	-155.5	170.3	170.8	1.3	117.8
893	K	42.1	Very low	35.6	Very low	147 Å²	147	140.8 Å²	140.8	64%	0.639	73%	0.726	S	S	*	*			cis	-168.7	147.3	-7.9	-119.7	-173.2	-178.9	-173	0	113.9
894	L	35.4	Very low	35.6	Very low	138 Å²	138	139.9 Å²	139.9	72%	0.723	73%	0.728	S	S	*	*			trans	70.5	153.7	150.4	-55	174	0	0	0	118.3
895	I	35.3	Very low	35.5	Very low	141 Å²	141	146.5 Å²	146.5	72%	0.723	73%	0.734	S	S	*	*			cis	-151.8	152.2	-4.8	-126.2	164.6	0	0	0	114.5
896	S	28.3	Very low	35.3	Very low	104 Å²	104	144.6 Å²	144.6	73%	0.727	73%	0.726	S	S	*	*			trans	17.3	128.3	162.4	76.1	0	0	0	0	125.3
897	K	34	Very low	35.7	Very low	197 Å²	197	145.2 Å²	145.2	86%	0.857	74%	0.736	S	S	*	*			trans	-72.2	166.8	133.8	-73.3	-177.3	177	-179.6	0	109.6
898	P	46.2	Very low	35.9	Very low	115 Å²	115	144.4 Å²	144.4	75%	0.747	74%	0.739	S	S	*	*			cis	-155.2	-157.9	37.4	38.2	-11.4	0	0	0	117.2
899	E	28.2	Very low	35.9	Very low	144 Å²	144	145.2 Å²	145.2	67%	0.673	74%	0.739	S	S	*	*			trans	87.7	122.8	152.7	-65.9	-96.1	75.7	0	0	121.4
900	Q	30.3	Very low	36	Very low	154 Å²	154	144 Å²	144	72%	0.72	73%	0.732	S	S	*	*			trans	60.8	147.3	135.5	-66.7	-174	40.9	0	0	121.6
901	S	31.1	Very low	36.3	Very low	86 Å²	86	143.8 Å²	143.8	60%	0.601	73%	0.727	S	S	*	*			cis	-169.1	179.4	-12.5	56.5	0	0	0	0	112.4
902	T	33.4	Very low	36.4	Very low	105 Å²	105	144.2 Å²	144.2	64%	0.644	73%	0.732	S	S	*	*			trans	82.1	116.8	157.4	61.2	0	0	0	0	123.3
903	K	33.8	Very low	36.2	Very low	183 Å²	183	142.5 Å²	142.5	80%	0.796	73%	0.729	S	S	*	*				64	108.1	122.5	-60.2	169.4	-174.8	168.3	0	121.8
904	K	35.1	Very low	36	Very low	198 Å²	198	144.7 Å²	144.7	86%	0.861	74%	0.739	S	S	*	*				60	117.6	122.3	-65.1	-169.8	177.8	-173.7	0	121.4
905	R	35.7	Very low	36.1	Very low	228 Å²	228	144 Å²	144	86%	0.86	74%	0.741	S	S	*	*				65.3	99.8	121.2	-168.8	176.2	-170.5	-173.4	5.9	119.2
906	S	41.6	Very low	36.1	Very low	95 Å²	95	142.7 Å²	142.7	66%	0.664	74%	0.744	S	S	*	*			trans	32.3	140	138.2	67.9	0	0	0	0	121.7
907	P	43	Very low	36.5	Very low	128 Å²	128	144.6 Å²	144.6	83%	0.831	75%	0.746	S	S	*	*			trans	-123.8	156.9	137.3	37.4	-28.2	0	0	0	113.8
908	I	41	Very low	36.5	Very low	160 Å²	160	142.4 Å²	142.4	82%	0.821	74%	0.741	S	S	*	*			trans	-120.3	157.6	162.2	-60.3	173.4	0	0	0	106.3
909	S	37.1	Very low	35.9	Very low	98 Å²	98	143.8 Å²	143.8	69%	0.685	75%	0.746	S	S	*	*			trans	110.7	153.3	146.9	80	0	0	0	0	120.6
910	I	37.5	Very low	36	Very low	139 Å²	139	139.9 Å²	139.9	71%	0.713	75%	0.745	S	S	*	*			trans	92.3	100.4	158.2	-57.6	159	0	0	0	119.5
911	E	38.3	Very low	36.1	Very low	142 Å²	142	139.2 Å²	139.2	66%	0.664	75%	0.751	S	S	*	*			trans	19.6	152.1	131.4	-52.5	-178.3	-165.9	0	0	124.1	K913	E911-K913 IonicContact OE2-NZ 2.8Å; E911-K913 PolarHBondContact OE2-NZ 3.43Å
912	I	37.8	Very low	36.2	Very low	139 Å²	139	140 Å²	140	71%	0.713	76%	0.757	S	S	*	*				175.8	109.3	106	-86.7	160.8	0	0	0	114.7
913	K	34.8	Very low	36.1	Very low	151 Å²	151	139 Å²	139	66%	0.657	76%	0.759	S	S	*	*			trans	45.3	137.7	131	-61.3	156	-176.7	132.3	0	125.3	E911	E911-K913 IonicContact OE2-NZ 2.8Å; E911-K913 PolarHBondContact OE2-NZ 3.43Å
914	K	38.8	Very low	36.3	Very low	194 Å²	194	138.4 Å²	138.4	84%	0.843	76%	0.763	S	S	*	*			trans	79.6	152.8	147.7	-73.5	-179.7	173.7	-175.3	0	119.7
915	T	37.3	Very low	36.2	Very low	123 Å²	123	132.4 Å²	132.4	76%	0.755	75%	0.751	S	S	*	*			cis	-163.2	139.5	2.2	20.1	0	0	0	0	114
916	S	35.2	Very low	36.2	Very low	113 Å²	113	127.1 Å²	127.1	79%	0.79	75%	0.749	S	S	*	*			trans	173.6	128.5	140.9	55	0	0	0	0	109.5
917	N	37.2	Very low	35.9	Very low	144 Å²	144	126.7 Å²	126.7	77%	0.77	75%	0.751	S	S	*	*				54.5	132.5	62.9	-92.3	24.7	0	0	0	114.9
918	M	32.5	Very low	35.2	Very low	152 Å²	152	126.1 Å²	126.1	75%	0.749	75%	0.75	S	S	*	*			cis	-164.6	-172.4	-7.8	-140.6	177.1	76.4	0	0	110.2
919	V	34.9	Very low	35	Very low	143 Å²	143	125.4 Å²	125.4	87%	0.867	75%	0.748	S	S	*	*			trans	76.7	137.7	-179.6	-168.7	0	0	0	0	114
920	G	30.3	Very low	35.2	Very low	62 Å²	62	125.5 Å²	125.5	64%	0.639	75%	0.749	S	S	*	*			cis	171.8	140	-11.2	0	0	0	0	0	114.4
921	V	31.5	Very low	35	Very low	141 Å²	141	123.5 Å²	123.5	86%	0.855	75%	0.753	S	S	*	*			trans	20	133	135.3	178.7	0	0	0	0	118.2
922	S	33.1	Very low	34.4	Very low	103 Å²	103	123.9 Å²	123.9	72%	0.72	76%	0.759	S	S	*	*			cis	-176.8	-173.5	-9.2	-91.7	0	0	0	0	108.5
923	A	32.4	Very low	34.5	Very low	82 Å²	82	121.5 Å²	121.5	68%	0.678	76%	0.755	S	S	*	*				93.7	114.8	128.1	0	0	0	0	0	122.1
924	L	37.9	Very low	34.5	Very low	171 Å²	171	122.1 Å²	122.1	90%	0.895	77%	0.766	S	S	*	*				76.1	150.8	129.9	-58.3	170.7	0	0	0	120.1
925	A	32.4	Very low	34.4	Very low	73 Å²	73	117.1 Å²	117.1	60%	0.603	76%	0.76	S	S	*	*			cis	-172.5	169.3	-22.6	0	0	0	0	0	113.6
926	S	35.4	Very low	34.4	Very low	117 Å²	117	119 Å²	119	82%	0.818	76%	0.76	S	S	*	*			trans	92.2	149.8	142.2	-60.6	0	0	0	0	120.3
927	A	35	Very low	34.5	Very low	86 Å²	86	120.6 Å²	120.6	71%	0.711	75%	0.753	S	S	*	*			cis	-177.9	150.4	-26.2	0	0	0	0	0	110.2
928	S	29.8	Very low	34.3	Very low	115 Å²	115	119 Å²	119	80%	0.804	75%	0.745	S	S	*	*			trans	-166.7	142.1	157.4	55.7	0	0	0	0	112.5
929	N	36	Very low	34.4	Very low	145 Å²	145	119.9 Å²	119.9	78%	0.775	75%	0.747	S	S	*	*			trans	-154.5	161.8	-164.9	-82.8	95	0	0	0	112.2
930	S	40.2	Very low	34.2	Very low	101 Å²	101	118.9 Å²	118.9	71%	0.706	74%	0.736	S	S	*	*			cis	177.9	126.1	-34.8	49.6	0	0	0	0	109.1
931	A	34.1	Very low	34.2	Very low	96 Å²	96	121.6 Å²	121.6	79%	0.793	74%	0.736	S	S	*	*			trans	-158.7	160.3	179.3	0	0	0	0	0	110.1
932	D	26.5	Very low	34.4	Very low	151 Å²	151	118.1 Å²	118.1	81%	0.807	73%	0.729	S	S	*	*			cis	-142.5	-157.6	4.1	-143	-42	0	0	0	112.6
933	S	38.4	Very low	34.2	Very low	88 Å²	88	121.3 Å²	121.3	62%	0.615	73%	0.73	S	S	*	*			trans	-124.9	178.2	-146.8	-44.6	0	0	0	0	117.2
934	D	36	Very low	34.2	Very low	165 Å²	165	123.5 Å²	123.5	88%	0.882	73%	0.73	S	S	*	*			trans	69	152.8	168.7	-61.9	-43.1	0	0	0	117.9
935	A	36.1	Very low	34.1	Very low	89 Å²	89	124.5 Å²	124.5	74%	0.736	73%	0.727	S	S	*	*			cis	-173.1	171.9	-22.9	0	0	0	0	0	107.3
936	E	38.2	Very low	34.4	Very low	161 Å²	161	129.5 Å²	129.5	75%	0.752	74%	0.738	S	S	*	*			cis	-165.5	163.5	-2.9	-131.1	-77.1	75.8	0	0	109.9
937	K	37.4	Very low	34.3	Very low	147 Å²	147	132.5 Å²	132.5	64%	0.639	74%	0.737	S	S	*	*			trans	76.7	118	140.7	-153.4	151	-172.1	163.4	0	127
938	D	33.1	Very low	34.2	Very low	112 Å²	112	133.9 Å²	133.9	60%	0.599	73%	0.732	S	S	*	*			trans	74.1	137.8	140.6	-73.2	-10.4	0	0	0	127
939	H	34.3	Very low	34.3	Very low	170 Å²	170	136.1 Å²	136.1	79%	0.787	73%	0.729	S	S	*	*			trans	67.4	151.3	149.8	-70	-50.5	0	0	0	121.7
940	D	29.7	Very low	34.2	Very low	121 Å²	121	134.6 Å²	134.6	65%	0.647	73%	0.725	S	S	*	*			cis	-168.2	156.4	-23.6	-174.6	28.2	0	0	0	111.4
941	N	31.6	Very low	33.8	Very low	120 Å²	120	138.1 Å²	138.1	64%	0.642	73%	0.728	S	S	*	*			trans	62.6	155.6	178.1	-60.6	-78.1	0	0	0	117.3
942	G	33.7	Very low	33.9	Very low	68 Å²	68	138.6 Å²	138.6	70%	0.701	71%	0.714	S	S	*	*			cis	116.7	136	7.1	0	0	0	0	0	111.2
943	K	30.4	Very low	34.4	Very low	169 Å²	169	139.2 Å²	139.2	74%	0.735	71%	0.709	S	S	*	*			cis	-155.9	153.2	21.1	-77.8	168.4	175.6	136.8	0	113.6
944	D	32.4	Very low	34.2	Very low	128 Å²	128	140 Å²	140	68%	0.684	71%	0.706	S	S	*	*				16.2	141.5	124	-18.8	-41.4	0	0	0	118.9
945	K	35.2	Very low	34.4	Very low	192 Å²	192	139.4 Å²	139.4	84%	0.835	70%	0.696	S	S	*	*				-170.1	164.2	60.5	-78.8	-159	170.4	-177.8	0	115.2
946	E	38.1	Very low	34.3	Very low	178 Å²	178	141.7 Å²	141.7	83%	0.832	70%	0.696	S	S	*	*			trans	-61.9	154.8	157.4	-50.3	159.8	106.6	0	0	112.8
947	K	33.8	Very low	34.1	Very low	181 Å²	181	140.3 Å²	140.3	79%	0.787	70%	0.702	S	S	*	*				-176.3	128.2	116.2	-106.1	-160.1	165.4	-164	0	117.6
948	D	32.3	Very low	34.3	Very low	114 Å²	114	142.3 Å²	142.3	61%	0.61	71%	0.711	S	S	*	*				40.6	128	117.5	-69.2	-19.5	0	0	0	123.8
949	H	33.2	Very low	34.8	Very low	162 Å²	162	145 Å²	145	75%	0.75	72%	0.72	S	S	*	*				75	104.1	129.7	-82.1	-68.5	0	0	0	123.3
950	V	33.9	Very low	34.9	Very low	113 Å²	113	146.4 Å²	146.4	69%	0.685	72%	0.724	S	S	*	*				82.9	131.7	111.6	150.4	0	0	0	0	121.8
951	K	32.3	Very low	35.8	Very low	175 Å²	175	147.9 Å²	147.9	76%	0.761	73%	0.732	S	S	*	*			trans	70.9	157.9	154.9	-92.9	177.2	174.6	-132	0	118.1
952	E	34.6	Very low	36.7	Very low	107 Å²	107	151 Å²	151	50%	0.5	74%	0.74	S	S	.	*			cis	-158	153.2	-13.2	-154.2	177.8	114.3	0	0	109.1
953	K	36.9	Very low	37.4	Very low	163 Å²	163	155.3 Å²	155.3	71%	0.709	75%	0.747	S	S	*	*			trans	65.2	162.4	162	-83.4	164.1	-180	140.6	0	117.2
954	D	35.9	Very low	38.4	Very low	104 Å²	104	155.7 Å²	155.7	56%	0.556	75%	0.748	S	S	*	*			cis	-142.2	177.3	-1.4	-132.7	-38.6	0	0	0	111.7
955	K	38.4	Very low	39.3	Very low	153 Å²	153	156.4 Å²	156.4	67%	0.665	75%	0.752	S	S	*	*			trans	-15.3	157.2	157.1	-68.6	172.2	-146.4	82.2	0	118.7
956	D	35.1	Very low	40.1	Very low	137 Å²	137	150 Å²	150	73%	0.733	74%	0.741	S	S	*	*			cis	-151.7	150.7	2.3	-110	-50.9	0	0	0	106.1
957	C	33.9	Very low	40.7	Very low	132 Å²	132	148.3 Å²	148.3	89%	0.892	73%	0.734	S	S	*	*				-177.4	163.1	84.7	-114.1	0	0	0	0	110.6
958	K	41.8	Very low	41.6	Very low	189 Å²	189	147.4 Å²	147.4	82%	0.822	73%	0.731	S	S	*	*			trans	-127	119.9	-178.1	169.8	-159.1	171.8	-168.5	0	110.6
959	E	43.6	Very low	42.8	Very low	170 Å²	170	147.2 Å²	147.2	79%	0.794	73%	0.729	S	S	*	*			trans	173.7	117.5	135.8	-103.4	-174.2	171.6	0	0	113.4
960	K	36.7	Very low	44	Very low	199 Å²	199	146.2 Å²	146.2	87%	0.865	72%	0.723	S	S	*	*				164.1	98.3	120.7	-90.8	177.6	-177.6	-177.8	0	110
961	D	47.9	Very low	45.1	Very low	151 Å²	151	147.5 Å²	147.5	81%	0.807	72%	0.721	S	S	*	*			trans	-141.6	91.3	173.7	-137	-19.3	0	0	0	109.4
962	K	50.8	Low	46.6	Very low	186 Å²	186	141 Å²	141	81%	0.809	71%	0.705	S	S	*	*			trans	-150	161.6	164.7	-72.2	-162	176.5	-174.6	0	106.7
963	D	48.4	Very low	48.2	Very low	159 Å²	159	143.2 Å²	143.2	85%	0.85	71%	0.713	S	S	*	*			trans	86.9	43.4	-179.4	-48.1	-21.8	0	0	0	116.4
964	K	50.3	Low	49.7	Very low	177 Å²	177	142.7 Å²	142.7	77%	0.77	71%	0.71	S	S	*	*			trans	-124.1	1.9	168.3	-88.7	-175.5	177.1	172	0	116.9
965	D	52.2	Low	51.9	Low	142 Å²	142	141 Å²	141	76%	0.759	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-78.3	-28.9	-178.3	-61.7	-64.1	0	0	0	113.8	M967	D965-M967 PolarHBondContact O-N 2.88Å
966	G	51.2	Low	54.3	Low	58 Å²	58	142 Å²	142	60%	0.598	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-71.6	2.2	-175.6	0	0	0	0	0	117
967	M	52.6	Low	57	Low	142 Å²	142	138.7 Å²	138.7	70%	0.7	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-90	-38.3	-176.7	-162	66.7	152.6	0	0	112.9	D965 D969 K970	D965-M967 PolarHBondContact O-N 2.88Å; M967-D969 PolarHBondContact O-N 3.19Å; M967-K970 PolarHBondContact O-N 3.2Å
968	K	52.4	Low	59.7	Low	163 Å²	163	139.1 Å²	139.1	71%	0.709	67%	0.672	S	S	*	*	H	α-helix	trans	-64	-38.1	-172.1	-77.9	-179.4	173.4	175	0	113.6	K970 E971 G972	K968-K970 PolarHBondContact O-N 2.79Å; K968-E971 WeakPolarHBondContact O-CB 3.12Å; K968-E971 PolarHBondContact O-N 3.14Å; K968-G972 PolarHBondContact O-N 2.56Å
969	D	56.5	Low	62.2	Low	109 Å²	109	135.3 Å²	135.3	58%	0.583	66%	0.657	S	S	*	*	H	α-helix	trans	-66.4	-24.8	-179.2	-66.3	-25.2	0	0	0	113.2	M967 E971 K973	M967-D969 PolarHBondContact O-N 3.19Å; D969-E971 VanDerWaalsContact C-N 3.33Å; D969-K973 WeakPolarHBondContact O-CB 3.24Å; D969-K973 VanDerWaalsContact O-CD 3.29Å; D969-K973 WeakPolarHBondContact O-CD 3.44Å; D969-K973 WeakPolarHBondContact O-CG 3.28Å; D969-K973 PolarHBondContact O-N 3.42Å
970	K	57.9	Low	64.7	Low	141 Å²	141	131 Å²	131	61%	0.613	64%	0.639	S	S	*	*	H	α-helix	trans	-75.4	-26.3	173.6	-65.1	-177.4	-179.2	178.4	0	111.7	M967 K968 K974	M967-K970 PolarHBondContact O-N 3.2Å; K968-K970 PolarHBondContact O-N 2.79Å; K970-K974 VanDerWaalsContact O-CG 3.28Å; K970-K974 WeakPolarHBondContact O-CG 3.36Å; K970-K974 PolarHBondContact O-N 3.25Å
971	E	58	Low	67.5	Low	140 Å²	140	124.2 Å²	124.2	65%	0.654	61%	0.612	S	S	*	*	H	α-helix	trans	-80.2	-45.4	177.2	-157.1	156.8	-120.7	0	0	111	K968 D969 K973 K974 S975	K968-E971 WeakPolarHBondContact O-CB 3.12Å; K968-E971 PolarHBondContact O-N 3.14Å; D969-E971 VanDerWaalsContact C-N 3.33Å; E971-K973 VanDerWaalsContact C-N 3.27Å; E971-K973 PolarHBondContact O-N 2.95Å; E971-K974 WeakPolarHBondContact O-CB 3.32Å; E971-K974 PolarHBondContact O-N 2.58Å; E971-S975 PolarHBondContact O-N 2.79Å; E971-S975 PolarHBondContact O-OG 3.08Å
972	G	63.8	Low	69.7	Low	40 Å²	40	124.6 Å²	124.6	41%	0.412	61%	0.607	S	S	.	*	H	α-helix	trans	-60.9	-30.7	172.4	0	0	0	0	0	114.2	K968 S975 R976	K968-G972 PolarHBondContact O-N 2.56Å; G972-S975 WeakPolarHBondContact CA-OG 3.43Å; G972-S975 PolarHBondContact O-OG 3.09Å; G972-S975 VanDerWaalsContact O-OG 3.09Å; G972-R976 WeakPolarHBondContact O-CB 3.38Å; G972-R976 PolarHBondContact O-N 3.48Å; G972-R976 VanDerWaalsContact O-N 3.08Å
973	K	67.6	Low	71.9	Confident	153 Å²	153	120.4 Å²	120.4	67%	0.665	59%	0.59	S	S	*	*	H	α-helix	trans	-75	-30	172.9	-72.3	167.8	-170.4	172.7	0	112.7	D969 E971 R977	D969-K973 WeakPolarHBondContact O-CB 3.24Å; D969-K973 VanDerWaalsContact O-CD 3.29Å; D969-K973 WeakPolarHBondContact O-CD 3.44Å; D969-K973 WeakPolarHBondContact O-CG 3.28Å; D969-K973 PolarHBondContact O-N 3.42Å; E971-K973 VanDerWaalsContact C-N 3.27Å; E971-K973 PolarHBondContact O-N 2.95Å; K973-R977 PolarHBondContact O-N 3.03Å
974	K	69.6	Low	74.2	Confident	152 Å²	152	117.8 Å²	117.8	66%	0.661	58%	0.575	S	S	*	*	H	α-helix	trans	-71.1	-48.4	172.3	-74.5	169.6	-177.9	-177.6	0	111.2	K970 E971 R976 R977 E978	K970-K974 VanDerWaalsContact O-CG 3.28Å; K970-K974 WeakPolarHBondContact O-CG 3.36Å; K970-K974 PolarHBondContact O-N 3.25Å; E971-K974 WeakPolarHBondContact O-CB 3.32Å; E971-K974 PolarHBondContact O-N 2.58Å; K974-R976 VanDerWaalsContact C-N 3.34Å; K974-R976 PolarHBondContact O-N 2.92Å; K974-R977 PolarHBondContact O-N 3.32Å; K974-R977 VanDerWaalsContact O-N 3.14Å; K974-E978 PolarHBondContact O-N 3.41Å
975	S	80.9	Confident	76.4	Confident	67 Å²	67	118.2 Å²	118.2	47%	0.469	57%	0.572	S	S	.	*	H	α-helix	trans	-61.4	-41.4	177.4	62.8	0	0	0	0	111.8	E971 G972 R977 E978 E979	E971-S975 PolarHBondContact O-N 2.79Å; E971-S975 PolarHBondContact O-OG 3.08Å; G972-S975 WeakPolarHBondContact CA-OG 3.43Å; G972-S975 PolarHBondContact O-OG 3.09Å; G972-S975 VanDerWaalsContact O-OG 3.09Å; S975-R977 PolarHBondContact O-N 2.7Å; S975-E978 PolarHBondContact O-N 3.46Å; S975-E979 WeakPolarHBondContact O-CB 3.27Å; S975-E979 PolarHBondContact O-N 3.43Å
976	R	88.3	Confident	78.5	Confident	174 Å²	174	114.3 Å²	114.3	66%	0.657	56%	0.56	S	S	*	*	H	α-helix	trans	-61.6	-38.1	173.7	-171.7	178.5	179.6	-136.8	-2.2	113.2	G972 K974 L980	G972-R976 WeakPolarHBondContact O-CB 3.38Å; G972-R976 PolarHBondContact O-N 3.48Å; G972-R976 VanDerWaalsContact O-N 3.08Å; K974-R976 VanDerWaalsContact C-N 3.34Å; K974-R976 PolarHBondContact O-N 2.92Å; R976-L980 HydrophobicContact CG-CD1 4.32Å; R976-L980 WeakPolarHBondContact O-CB 3.15Å; R976-L980 VanDerWaalsContact O-CG 3.28Å; R976-L980 WeakPolarHBondContact O-CG 2.76Å; R976-L980 PolarHBondContact O-N 3Å
977	R	92.6	Very high	80.7	Confident	69 Å²	69	115.6 Å²	115.6	26%	0.26	56%	0.556	S	S	.	*	H	α-helix	trans	-67.4	-39.3	174.3	-174.2	177.1	178.9	-128.9	-4.5	111.3	E199 K200 K973 K974 S975 L981	E199-R977 IonicContact OE1-CZ 3.93Å; E199-R977 IonicContact OE1-NE 2.7Å; E199-R977 PolarHBondContact OE1-NE 3.32Å; E199-R977 IonicContact OE1-NH2 3.15Å; E199-R977 PolarHBondContact OE1-NH2 3.43Å; K200-R977 PolarHBondContact O-NH2 3.29Å; K973-R977 PolarHBondContact O-N 3.03Å; K974-R977 PolarHBondContact O-N 3.32Å; K974-R977 VanDerWaalsContact O-N 3.14Å; S975-R977 PolarHBondContact O-N 2.7Å; R977-L981 HydrophobicContact CG-CD1 4.17Å; R977-L981 WeakPolarHBondContact O-CB 3.38Å; R977-L981 WeakPolarHBondContact O-CD1 3.49Å; R977-L981 VanDerWaalsContact O-CG 3.27Å; R977-L981 WeakPolarHBondContact O-CG 3.33Å; R977-L981 PolarHBondContact O-N 3.42Å
978	E	91.6	Very high	82.8	Confident	140 Å²	140	114.8 Å²	114.8	65%	0.654	55%	0.55	S	S	*	*	H	α-helix	trans	-67.9	-40.6	176.8	-168.8	175.2	154.2	0	0	112.3	K974 S975 L981 K982	K974-E978 PolarHBondContact O-N 3.41Å; S975-E978 PolarHBondContact O-N 3.46Å; E978-L981 PolarHBondContact O-N 3.3Å; E978-K982 WeakPolarHBondContact O-CB 3.43Å; E978-K982 PolarHBondContact O-N 3.11Å
979	E	93.4	Very high	84.9	Confident	110 Å²	110	111 Å²	111	51%	0.514	54%	0.537	S	S	.	.	H	α-helix	trans	-63.8	-44.3	174.7	-168	-174.3	172.4	0	0	111.6	S975 L981 K982 Q983	S975-E979 WeakPolarHBondContact O-CB 3.27Å; S975-E979 PolarHBondContact O-N 3.43Å; E979-L981 VanDerWaalsContact C-N 3.35Å; E979-L981 PolarHBondContact O-N 2.96Å; E979-K982 CarbonylContact O-C 3.51Å; E979-K982 WeakPolarHBondContact O-CB 3.49Å; E979-K982 PolarHBondContact O-N 3.38Å; E979-K982 VanDerWaalsContact O-N 3.16Å; E979-Q983 VanDerWaalsContact O-CG 3.32Å; E979-Q983 WeakPolarHBondContact O-CG 3.12Å; E979-Q983 PolarHBondContact O-N 3.36Å; E979-Q983 PolarHBondContact OE1-NE2 2.99Å
980	L	95.3	Very high	86.7	Confident	79 Å²	79	108.6 Å²	108.6	41%	0.414	53%	0.533	S	S	.	.	H	α-helix	trans	-61.4	-41.2	173.8	-74.6	168.7	0	0	0	112	R976 K982 Q983 L984	R976-L980 HydrophobicContact CG-CD1 4.32Å; R976-L980 WeakPolarHBondContact O-CB 3.15Å; R976-L980 VanDerWaalsContact O-CG 3.28Å; R976-L980 WeakPolarHBondContact O-CG 2.76Å; R976-L980 PolarHBondContact O-N 3Å; L980-K982 VanDerWaalsContact C-N 3.32Å; L980-K982 PolarHBondContact O-N 3.05Å; L980-Q983 PolarHBondContact O-N 3.2Å; L980-L984 WeakPolarHBondContact O-CB 3.32Å; L980-L984 WeakPolarHBondContact O-CG 3.48Å; L980-L984 PolarHBondContact O-N 3.16Å
981	L	95.4	Very high	88.5	Confident	56 Å²	56	105.6 Å²	105.6	29%	0.293	52%	0.523	S	S	.	.	H	α-helix	trans	-65.7	-34.1	174.4	-72.5	166.1	0	0	0	112.3	R201 R977 E978 E979 R985	R201-L981 VanDerWaalsContact NH2-CD1 3.33Å; R977-L981 HydrophobicContact CG-CD1 4.17Å; R977-L981 WeakPolarHBondContact O-CB 3.38Å; R977-L981 WeakPolarHBondContact O-CD1 3.49Å; R977-L981 VanDerWaalsContact O-CG 3.27Å; R977-L981 WeakPolarHBondContact O-CG 3.33Å; R977-L981 PolarHBondContact O-N 3.42Å; E978-L981 PolarHBondContact O-N 3.3Å; E979-L981 VanDerWaalsContact C-N 3.35Å; E979-L981 PolarHBondContact O-N 2.96Å; L981-R985 WeakPolarHBondContact O-CG 3.18Å; L981-R985 PolarHBondContact O-N 2.77Å
982	K	96	Very high	90.2	Very high	160 Å²	160	101.5 Å²	101.5	70%	0.696	51%	0.513	S	S	*	.	H	α-helix	trans	-69.7	-38.9	173.7	-171.9	176.9	-178.2	177.6	0	112	E978 E979 L980 A986	E978-K982 WeakPolarHBondContact O-CB 3.43Å; E978-K982 PolarHBondContact O-N 3.11Å; E979-K982 CarbonylContact O-C 3.51Å; E979-K982 WeakPolarHBondContact O-CB 3.49Å; E979-K982 PolarHBondContact O-N 3.38Å; E979-K982 VanDerWaalsContact O-N 3.16Å; L980-K982 VanDerWaalsContact C-N 3.32Å; L980-K982 PolarHBondContact O-N 3.05Å; K982-A986 WeakPolarHBondContact O-CB 3.29Å; K982-A986 PolarHBondContact O-N 2.94Å
983	Q	96.1	Very high	91.5	Very high	98 Å²	98	105.8 Å²	105.8	46%	0.458	52%	0.52	S	S	.	.	H	α-helix	trans	-66.7	-44.5	173.9	-71.5	174.2	11	0	0	111.4	E979 L980 A986 V987	E979-Q983 VanDerWaalsContact O-CG 3.32Å; E979-Q983 WeakPolarHBondContact O-CG 3.12Å; E979-Q983 PolarHBondContact O-N 3.36Å; E979-Q983 PolarHBondContact OE1-NE2 2.99Å; L980-Q983 PolarHBondContact O-N 3.2Å; Q983-A986 PolarHBondContact O-N 3.15Å; Q983-V987 WeakPolarHBondContact O-CG2 3.43Å; Q983-V987 PolarHBondContact O-N 3.44Å
984	L	97.4	Very high	92.8	Very high	104 Å²	104	105.2 Å²	105.2	55%	0.545	52%	0.518	S	S	.	.	H	α-helix	trans	-59.2	-49.4	174.9	-74.7	170	0	0	0	111.4	L980 A986 V987 E988	L980-L984 WeakPolarHBondContact O-CB 3.32Å; L980-L984 WeakPolarHBondContact O-CG 3.48Å; L980-L984 PolarHBondContact O-N 3.16Å; L984-A986 VanDerWaalsContact C-N 3.31Å; L984-A986 PolarHBondContact O-N 2.92Å; L984-V987 WeakPolarHBondContact O-CB 3.47Å; L984-V987 PolarHBondContact O-N 3.27Å; L984-E988 WeakPolarHBondContact O-CG 3.46Å; L984-E988 PolarHBondContact O-N 3.39Å
985	R	96	Very high	93.6	Very high	185 Å²	185	106.4 Å²	106.4	70%	0.698	52%	0.518	S	S	*	.	H	α-helix	trans	-57.1	-42.6	174	-76.4	-178.5	178	-163.6	-0.9	112.4	L981 V987 E988 D989	L981-R985 WeakPolarHBondContact O-CG 3.18Å; L981-R985 PolarHBondContact O-N 2.77Å; R985-V987 VanDerWaalsContact C-N 3.29Å; R985-V987 PolarHBondContact O-N 3.21Å; R985-E988 PolarHBondContact O-N 3.36Å; R985-D989 VanDerWaalsContact O-CB 3.27Å; R985-D989 WeakPolarHBondContact O-CB 3.38Å; R985-D989 PolarHBondContact O-N 3.35Å
986	A	95.8	Very high	93.8	Very high	61 Å²	61	107.3 Å²	107.3	50%	0.504	52%	0.524	S	S	.	.	H	α-helix	trans	-64.4	-32.4	176.9	0	0	0	0	0	113.1	K982 Q983 L984 A990	K982-A986 WeakPolarHBondContact O-CB 3.29Å; K982-A986 PolarHBondContact O-N 2.94Å; Q983-A986 PolarHBondContact O-N 3.15Å; L984-A986 VanDerWaalsContact C-N 3.31Å; L984-A986 PolarHBondContact O-N 2.92Å; A986-A990 VanDerWaalsContact O-CB 3.3Å; A986-A990 WeakPolarHBondContact O-CB 3.34Å; A986-A990 PolarHBondContact O-N 2.99Å
987	V	97.3	Very high	93.6	Very high	84 Å²	84	107.4 Å²	107.4	51%	0.509	53%	0.53	S	S	.	.	H	α-helix	trans	-72	-42.4	173.1	170	0	0	0	0	111.4	Q983 L984 R985 D989 A990 I991	Q983-V987 WeakPolarHBondContact O-CG2 3.43Å; Q983-V987 PolarHBondContact O-N 3.44Å; L984-V987 WeakPolarHBondContact O-CB 3.47Å; L984-V987 PolarHBondContact O-N 3.27Å; R985-V987 VanDerWaalsContact C-N 3.29Å; R985-V987 PolarHBondContact O-N 3.21Å; V987-D989 VanDerWaalsContact C-N 3.34Å; V987-D989 PolarHBondContact O-N 3.49Å; V987-A990 PolarHBondContact O-N 3.25Å; V987-I991 HydrophobicContact CG1-CD1 3.81Å; V987-I991 HydrophobicContact CG1-CG1 4.48Å; V987-I991 WeakPolarHBondContact O-CB 2.96Å; V987-I991 VanDerWaalsContact O-CG1 3.25Å; V987-I991 WeakPolarHBondContact O-CG1 3.43Å; V987-I991 PolarHBondContact O-N 3.34Å
988	E	96.8	Very high	92.9	Very high	125 Å²	125	110.7 Å²	110.7	58%	0.584	55%	0.551	S	S	*	*	H	α-helix	trans	-59.6	-45.2	173.7	-69.2	171.8	148	0	0	111.2	L984 R985 A990 I991 A992	L984-E988 WeakPolarHBondContact O-CG 3.46Å; L984-E988 PolarHBondContact O-N 3.39Å; R985-E988 PolarHBondContact O-N 3.36Å; E988-A990 PolarHBondContact O-N 3.24Å; E988-I991 PolarHBondContact O-N 2.89Å; E988-A992 WeakPolarHBondContact O-CB 3.25Å; E988-A992 PolarHBondContact O-N 2.93Å
989	D	96.6	Very high	91.5	Very high	83 Å²	83	113 Å²	113	44%	0.444	57%	0.568	S	S	.	*	H	α-helix	trans	-64.4	-38.4	177.8	-144.5	54.9	0	0	0	111.9	R985 V987 A992 K993	R985-D989 VanDerWaalsContact O-CB 3.27Å; R985-D989 WeakPolarHBondContact O-CB 3.38Å; R985-D989 PolarHBondContact O-N 3.35Å; V987-D989 VanDerWaalsContact C-N 3.34Å; V987-D989 PolarHBondContact O-N 3.49Å; D989-A992 PolarHBondContact O-N 2.67Å; D989-K993 WeakPolarHBondContact O-CB 3.05Å; D989-K993 WeakPolarHBondContact O-CD 3.19Å; D989-K993 VanDerWaalsContact O-CG 3.31Å; D989-K993 WeakPolarHBondContact O-CG 3.33Å; D989-K993 PolarHBondContact O-N 3Å; D989-K993 WeakPolarHBondContact OD2-CE 3.28Å; D989-K993 IonicContact OD2-NZ 3.11Å; D989-K993 PolarHBondContact OD2-NZ 3Å
990	A	94.6	Very high	91.4	Very high	59 Å²	59	113.1 Å²	113.1	49%	0.488	57%	0.571	S	S	.	*	H	α-helix	trans	-69.4	-35.8	173.1	0	0	0	0	0	112.7	A986 V987 E988 K994	A986-A990 VanDerWaalsContact O-CB 3.3Å; A986-A990 WeakPolarHBondContact O-CB 3.34Å; A986-A990 PolarHBondContact O-N 2.99Å; V987-A990 PolarHBondContact O-N 3.25Å; E988-A990 PolarHBondContact O-N 3.24Å; A990-K994 VanDerWaalsContact O-CB 3.24Å; A990-K994 WeakPolarHBondContact O-CB 3.41Å; A990-K994 PolarHBondContact O-N 3.08Å
991	I	95.4	Very high	91.2	Very high	79 Å²	79	114.9 Å²	114.9	41%	0.405	58%	0.579	S	S	.	*	H	α-helix	trans	-68.5	-41.4	173.4	-70.9	165	0	0	0	110.3	V987 E988 K994 R995	V987-I991 HydrophobicContact CG1-CD1 3.81Å; V987-I991 HydrophobicContact CG1-CG1 4.48Å; V987-I991 WeakPolarHBondContact O-CB 2.96Å; V987-I991 VanDerWaalsContact O-CG1 3.25Å; V987-I991 WeakPolarHBondContact O-CG1 3.43Å; V987-I991 PolarHBondContact O-N 3.34Å; E988-I991 PolarHBondContact O-N 2.89Å; I991-K994 PolarHBondContact O-N 3.06Å; I991-R995 WeakPolarHBondContact O-CG 3.26Å; I991-R995 PolarHBondContact O-N 2.77Å
992	A	92.9	Very high	91	Very high	53 Å²	53	118.2 Å²	118.2	44%	0.438	60%	0.595	S	S	.	*	H	α-helix	trans	-60.8	-52.1	174.9	0	0	0	0	0	111	E988 D989 K994 R995 S996	E988-A992 WeakPolarHBondContact O-CB 3.25Å; E988-A992 PolarHBondContact O-N 2.93Å; D989-A992 PolarHBondContact O-N 2.67Å; A992-K994 PolarHBondContact O-N 3.28Å; A992-R995 PolarHBondContact O-N 2.95Å; A992-S996 PolarHBondContact O-N 3.42Å; A992-S996 PolarHBondContact O-OG 3.1Å
993	K	91.9	Very high	90.7	Very high	130 Å²	130	115.7 Å²	115.7	57%	0.565	59%	0.589	S	S	*	*	H	α-helix	trans	-62.6	-25.5	176.4	-74.2	163.3	178.2	160.3	0	113.9	D989 K997	D989-K993 WeakPolarHBondContact O-CB 3.05Å; D989-K993 WeakPolarHBondContact O-CD 3.19Å; D989-K993 VanDerWaalsContact O-CG 3.31Å; D989-K993 WeakPolarHBondContact O-CG 3.33Å; D989-K993 PolarHBondContact O-N 3Å; D989-K993 WeakPolarHBondContact OD2-CE 3.28Å; D989-K993 IonicContact OD2-NZ 3.11Å; D989-K993 PolarHBondContact OD2-NZ 3Å; K993-K997 WeakPolarHBondContact O-CB 3.4Å
994	K	94.1	Very high	90.3	Very high	142 Å²	142	116.8 Å²	116.8	62%	0.617	60%	0.597	S	S	*	*	H	α-helix	trans	-79.3	-33.5	171.7	-173.7	174.3	-179.9	-179.9	0	112.4	A990 I991 A992 L998	A990-K994 VanDerWaalsContact O-CB 3.24Å; A990-K994 WeakPolarHBondContact O-CB 3.41Å; A990-K994 PolarHBondContact O-N 3.08Å; I991-K994 PolarHBondContact O-N 3.06Å; A992-K994 PolarHBondContact O-N 3.28Å; K994-L998 HydrophobicContact CG-CD1 4.15Å; K994-L998 WeakPolarHBondContact O-CD1 3.27Å; K994-L998 VanDerWaalsContact O-CG 3.25Å; K994-L998 WeakPolarHBondContact O-CG 3.28Å
995	R	88.1	Confident	89.9	Confident	176 Å²	176	117.7 Å²	117.7	66%	0.664	60%	0.601	S	S	*	*	H	α-helix	trans	-72.1	-41.7	174.9	-74.6	174.7	176.7	-173.8	0.1	111.7	I991 A992 K997 L998 N999	I991-R995 WeakPolarHBondContact O-CG 3.26Å; I991-R995 PolarHBondContact O-N 2.77Å; A992-R995 PolarHBondContact O-N 2.95Å; R995-K997 PolarHBondContact O-N 3.06Å; R995-L998 PolarHBondContact O-N 3.44Å; R995-N999 PolarHBondContact O-N 3.05Å
996	S	85.2	Confident	89.4	Confident	86 Å²	86	112.9 Å²	112.9	60%	0.601	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	25.6	172.9	74.2	0	0	0	0	114	A992	A992-S996 PolarHBondContact O-N 3.42Å; A992-S996 PolarHBondContact O-OG 3.1Å
997	K	84.3	Confident	88.9	Confident	177 Å²	177	116.8 Å²	116.8	77%	0.77	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148	26.1	174.9	-165.2	163.3	-178.8	166.6	0	110.4	K993 R995 N999	K993-K997 WeakPolarHBondContact O-CB 3.4Å; R995-K997 PolarHBondContact O-N 3.06Å; K997-N999 WeakPolarHBondContact CA-OXT 3.49Å; K997-N999 PolarHBondContact N-OXT 2.8Å
998	L	76.4	Confident	88.2	Confident	137 Å²	137	119.6 Å²	119.6	72%	0.717	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.7	-35.9	-178.9	-78.2	176.6	0	0	0	108.5	K994 R995	K994-L998 HydrophobicContact CG-CD1 4.15Å; K994-L998 WeakPolarHBondContact O-CD1 3.27Å; K994-L998 VanDerWaalsContact O-CG 3.25Å; K994-L998 WeakPolarHBondContact O-CG 3.28Å; R995-L998 PolarHBondContact O-N 3.44Å
999	N	62.6	Low	87.5	Confident	188 Å²	188	119.1 Å²	119.1	100%	1.005	61%	0.61	S	S	*	*			trans	-77.2	0	135.6	-57.3	23	0	0	0	109.3	R995 K997	R995-N999 PolarHBondContact O-N 3.05Å; K997-N999 WeakPolarHBondContact CA-OXT 3.49Å; K997-N999 PolarHBondContact N-OXT 2.8Å

Retrieved 999 of 999 residues in 870.7 ms (Link to these results)

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