A0A096M523_POEFO Loading...

Rubicon like autophagy enhancer

AlphaFold DB , UniProt , Accession A0A096M523, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 729 aa.

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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	33.2	Very low	30.4	Very low	252 Å²	252	124.8 Å²	124.8	100%	1.241	81%	0.807	S	S	*	*				0	121.2	0	-60.7	163.2	80.4	0	0	106.6
2	G	34.1	Very low	30	Very low	72 Å²	72	126.7 Å²	126.7	74%	0.742	81%	0.805	S	S	*	*			cis	-178.4	160.7	-5.4	0	0	0	0	0	111.7
3	S	29.7	Very low	29.8	Very low	110 Å²	110	134.2 Å²	134.2	77%	0.769	81%	0.809	S	S	*	*			trans	56.8	135.1	177	-68.8	0	0	0	0	118.2
4	C	31.6	Very low	29.4	Very low	108 Å²	108	130 Å²	130	73%	0.73	81%	0.806	S	S	*	*			cis	82.8	146.7	19.9	-46.9	0	0	0	0	116.6
5	D	30.1	Very low	29.2	Very low	157 Å²	157	125.7 Å²	125.7	84%	0.84	80%	0.798	S	S	*	*			trans	73.3	140	166.2	-43.4	-40.2	0	0	0	118.2
6	G	28.7	Very low	28.9	Very low	64 Å²	64	130.9 Å²	130.9	66%	0.66	80%	0.799	S	S	*	*			cis	158.9	121.1	-14.1	0	0	0	0	0	115.7
7	L	28.1	Very low	28.5	Very low	178 Å²	178	130.5 Å²	130.5	93%	0.932	80%	0.796	S	S	*	*			trans	66	166.2	163.3	-47	171.7	0	0	0	115.3
8	S	26.3	Very low	28.3	Very low	99 Å²	99	128.1 Å²	128.1	69%	0.692	79%	0.786	S	S	*	*			cis	-153.5	161.2	2.6	-161.3	0	0	0	0	113.6
9	S	26.1	Very low	28	Very low	106 Å²	106	133 Å²	133	74%	0.741	79%	0.789	S	S	*	*			trans	56.7	123.6	145.9	56.5	0	0	0	0	123.4
10	S	29	Very low	27.8	Very low	114 Å²	114	130.8 Å²	130.8	80%	0.797	78%	0.78	S	S	*	*			trans	-78.9	177.5	156.2	-39.5	0	0	0	0	112.3
11	P	37.7	Very low	27.7	Very low	113 Å²	113	130.8 Å²	130.8	73%	0.734	78%	0.781	S	S	*	*				-150.2	165.2	109.3	38.3	-22.3	0	0	0	117.5
12	N	25.7	Very low	27.2	Very low	147 Å²	147	125.7 Å²	125.7	79%	0.786	76%	0.758	S	S	*	*			trans	64	120.6	166.3	-64.3	-19.9	0	0	0	118.9
13	R	26.9	Very low	27.2	Very low	225 Å²	225	127.9 Å²	127.9	85%	0.849	76%	0.762	S	S	*	*			cis	82.8	135.6	24.8	-156	-177.6	-148.3	-105.6	3.7	113.4
14	G	24.9	Very low	27	Very low	75 Å²	75	126.2 Å²	126.2	77%	0.773	76%	0.763	S	S	*	*			cis	-157.4	-159	0.8	0	0	0	0	0	111
15	G	25.8	Very low	26.7	Very low	66 Å²	66	129.8 Å²	129.8	68%	0.68	77%	0.769	S	S	*	*			cis	-151.8	157.4	0.4	0	0	0	0	0	110.6
16	Y	24	Very low	26.5	Very low	209 Å²	209	126.8 Å²	126.8	82%	0.82	76%	0.76	S	S	*	*				52.9	107.9	92.7	-85.9	-102.9	0	0	0	113.9
17	V	23.7	Very low	26.4	Very low	123 Å²	123	134.6 Å²	134.6	75%	0.745	77%	0.77	S	S	*	*				94.1	122.6	54.9	166.9	0	0	0	0	112.7
18	S	23.7	Very low	26.2	Very low	87 Å²	87	134.7 Å²	134.7	61%	0.608	77%	0.766	S	S	*	*			trans	-16.1	139.8	163.3	-173.3	0	0	0	0	118.5
19	W	22.5	Very low	27	Very low	222 Å²	222	135.2 Å²	135.2	84%	0.841	77%	0.767	S	S	*	*				174.5	118.9	100	-97	91.8	0	0	0	112.4
20	S	25.3	Very low	27.8	Very low	89 Å²	89	135.5 Å²	135.5	62%	0.622	77%	0.766	S	S	*	*			trans	50.1	179.3	142.3	-58	0	0	0	0	122.9
21	V	25.1	Very low	27.8	Very low	130 Å²	130	136.4 Å²	136.4	79%	0.788	77%	0.767	S	S	*	*			trans	67.3	147.4	170.3	-115.3	0	0	0	0	113.2
22	D	22.3	Very low	27.3	Very low	145 Å²	145	134 Å²	134	78%	0.775	76%	0.762	S	S	*	*			cis	-143.6	177.6	26.8	-139.7	-38.5	0	0	0	116
23	S	35	Very low	28.2	Very low	118 Å²	118	133.2 Å²	133.2	83%	0.825	77%	0.765	S	S	*	*			trans	-140.8	106.1	172.2	-69.8	0	0	0	0	110.8
24	G	24.7	Very low	29.1	Very low	76 Å²	76	127.8 Å²	127.8	78%	0.784	76%	0.759	S	S	*	*			trans	-143.8	172	174.2	0	0	0	0	0	111.4
25	E	25.2	Very low	30	Very low	182 Å²	182	130 Å²	130	85%	0.85	76%	0.76	S	S	*	*			cis	-164.1	140.8	2.8	-172.6	-170.6	113.7	0	0	110.4
26	S	25.2	Very low	30.1	Very low	95 Å²	95	130.3 Å²	130.3	66%	0.664	76%	0.763	S	S	*	*			trans	163.7	149.1	149.5	-81.9	0	0	0	0	111.7
27	R	27	Very low	30.2	Very low	227 Å²	227	125.8 Å²	125.8	86%	0.857	77%	0.769	S	S	*	*			cis	-159.9	163	-13.2	-111.9	166.9	-169.3	-157.7	0	108.7
28	Q	24.8	Very low	30.3	Very low	181 Å²	181	123.2 Å²	123.2	85%	0.846	77%	0.767	S	S	*	*			trans	-89.4	-158.8	173.1	-61.6	-178.6	-45	0	0	111.6
29	P	43.1	Very low	30.5	Very low	110 Å²	110	127.7 Å²	127.7	71%	0.714	78%	0.779	S	S	*	*				-116.6	-141	-88.7	41.1	-23.3	0	0	0	108.9
30	P	41.8	Very low	30.7	Very low	112 Å²	112	123.1 Å²	123.1	73%	0.727	78%	0.775	S	S	*	*			cis	-106.4	-157.8	-32.9	26.8	-3	0	0	0	109.7
31	T	29.4	Very low	30.8	Very low	133 Å²	133	126.5 Å²	126.5	82%	0.816	78%	0.782	S	S	*	*			cis	-165	178.2	25.8	-28.4	0	0	0	0	108.9
32	G	26.3	Very low	30.9	Very low	62 Å²	62	124.4 Å²	124.4	64%	0.639	78%	0.777	S	S	*	*			trans	-145.6	-169.4	168	0	0	0	0	0	111.9
33	P	45.5	Very low	31.1	Very low	130 Å²	130	125.3 Å²	125.3	84%	0.844	78%	0.775	S	S	*	*			cis	-122.1	-122.1	3.1	25.1	1.1	0	0	0	114.6
34	P	46.9	Very low	30.7	Very low	112 Å²	112	125.5 Å²	125.5	73%	0.727	78%	0.776	S	S	*	*				-107.5	-151.5	-124.9	46.2	-30.6	0	0	0	112.6
35	P	43.7	Very low	30.9	Very low	121 Å²	121	128.5 Å²	128.5	79%	0.786	77%	0.774	S	S	*	*			cis	-128.9	-171.7	-24	41.8	-25.9	0	0	0	113.7
36	G	26.4	Very low	31	Very low	73 Å²	73	128.5 Å²	128.5	75%	0.753	77%	0.774	S	S	*	*			trans	102.7	123.8	135	0	0	0	0	0	122.5
37	A	27.2	Very low	31.1	Very low	113 Å²	113	128.3 Å²	128.3	93%	0.934	77%	0.773	S	S	*	*			trans	18.3	157	144.1	0	0	0	0	0	125.7
38	G	26.3	Very low	31.1	Very low	69 Å²	69	126.5 Å²	126.5	71%	0.711	77%	0.774	S	S	*	*			trans	106.3	115.6	169.3	0	0	0	0	0	112.6
39	E	27.5	Very low	31	Very low	181 Å²	181	125.8 Å²	125.8	85%	0.846	77%	0.771	S	S	*	*			cis	86.8	129.1	38.2	-64.8	-164.7	133.9	0	0	115.9
40	T	26.9	Very low	31.2	Very low	126 Å²	126	125.4 Å²	125.4	77%	0.773	77%	0.768	S	S	*	*			trans	64.4	150.8	153.9	50.6	0	0	0	0	119.7
41	E	27	Very low	30.5	Very low	161 Å²	161	125 Å²	125	75%	0.752	76%	0.764	S	S	*	*			cis	-163.3	-171.8	-27.3	-136.4	-173.4	-178	0	0	110.2
42	A	25.9	Very low	30.6	Very low	85 Å²	85	129.6 Å²	129.6	70%	0.702	77%	0.766	S	S	*	*			trans	74.4	149.9	160.1	0	0	0	0	0	119.7
43	F	27	Very low	30.7	Very low	165 Å²	165	132 Å²	132	72%	0.724	77%	0.773	S	S	*	*			cis	166.9	125.2	-33.9	-118.4	-68.1	0	0	0	105.7
44	S	26.1	Very low	30	Very low	122 Å²	122	128.9 Å²	128.9	85%	0.853	77%	0.765	S	S	*	*			trans	-168.9	149.4	145.6	-88.8	0	0	0	0	110.8
45	N	30.4	Very low	29.2	Very low	139 Å²	139	129.1 Å²	129.1	74%	0.743	77%	0.768	S	S	*	*			trans	-101.4	156.2	-167.3	-59.5	-66.1	0	0	0	112.5
46	Q	26.7	Very low	28.4	Very low	182 Å²	182	130.1 Å²	130.1	85%	0.85	77%	0.771	S	S	*	*				-169.3	137.5	114.2	-106.9	179.8	35.2	0	0	115.7
47	S	26.8	Very low	28.4	Very low	90 Å²	90	130.6 Å²	130.6	63%	0.629	77%	0.768	S	S	*	*			trans	79.6	112.5	137.8	-59.5	0	0	0	0	123.3
48	Q	27.3	Very low	28.3	Very low	190 Å²	190	130.4 Å²	130.4	89%	0.888	76%	0.76	S	S	*	*			trans	90.6	107.8	133.3	-67.3	177.1	-4.4	0	0	122
49	E	23.3	Very low	28.4	Very low	166 Å²	166	134.8 Å²	134.8	78%	0.776	77%	0.766	S	S	*	*			trans	-74.2	-179.8	148.2	-122.7	-154.1	-124.1	0	0	110.5
50	P	46.8	Very low	28.3	Very low	101 Å²	101	133.4 Å²	133.4	66%	0.656	76%	0.763	S	S	*	*			cis	-133.9	-172.6	27.5	41.7	-20.1	0	0	0	115
51	T	27.7	Very low	28.2	Very low	104 Å²	104	138.1 Å²	138.1	64%	0.638	77%	0.767	S	S	*	*			cis	-162	138.8	26.4	-15.9	0	0	0	0	113.7
52	R	31.1	Very low	28.1	Very low	229 Å²	229	134.9 Å²	134.9	86%	0.864	76%	0.762	S	S	*	*			trans	45.7	149.4	134.2	-77.7	178.4	177	-174.2	-2.9	122.6
53	S	28.2	Very low	28.1	Very low	113 Å²	113	136.1 Å²	136.1	79%	0.79	76%	0.761	S	S	*	*			cis	-162.1	156.4	-2.6	177.9	0	0	0	0	111.2
54	G	30.1	Very low	28.1	Very low	64 Å²	64	136.9 Å²	136.9	66%	0.66	77%	0.767	S	S	*	*			trans	-87	-150.8	-179.1	0	0	0	0	0	116.2
55	C	30.3	Very low	28.1	Very low	117 Å²	117	139.1 Å²	139.1	79%	0.791	76%	0.764	S	S	*	*			cis	-166.6	154.9	17.7	-98.7	0	0	0	0	113.7
56	V	28.4	Very low	28.6	Very low	142 Å²	142	137.8 Å²	137.8	86%	0.861	76%	0.762	S	S	*	*			trans	66.1	148	140.1	172.3	0	0	0	0	118.1
57	A	25.7	Very low	28.5	Very low	83 Å²	83	134.3 Å²	134.3	69%	0.686	76%	0.758	S	S	*	*			cis	-142	-167.1	10.9	0	0	0	0	0	113.9
58	S	25.7	Very low	28.5	Very low	110 Å²	110	133.5 Å²	133.5	77%	0.769	77%	0.765	S	S	*	*			trans	-151.7	-177.1	170.7	-70.7	0	0	0	0	111.1
59	L	27.3	Very low	28.5	Very low	161 Å²	161	133.1 Å²	133.1	84%	0.843	76%	0.763	S	S	*	*			trans	84	151.6	172.5	-47.1	174.8	0	0	0	115.2
60	I	25.4	Very low	28.8	Very low	152 Å²	152	133.7 Å²	133.7	78%	0.779	77%	0.765	S	S	*	*			cis	-150.2	174.1	-1.5	-129.3	162.8	0	0	0	114.9
61	R	24.9	Very low	28	Very low	224 Å²	224	136.5 Å²	136.5	85%	0.845	77%	0.77	S	S	*	*			trans	-68.6	176.6	-171.9	-166.4	-174.5	-164.8	170.7	3.1	118.6
62	S	24.6	Very low	28.2	Very low	94 Å²	94	137.4 Å²	137.4	66%	0.657	78%	0.775	S	S	*	*			trans	89.7	152.7	147.3	-109.9	0	0	0	0	119.6
63	T	26.4	Very low	28.1	Very low	110 Å²	110	133.5 Å²	133.5	68%	0.675	77%	0.772	S	S	*	*			cis	-165.6	155.1	-16.9	0.5	0	0	0	0	114.1
64	Q	26.1	Very low	28.1	Very low	182 Å²	182	134.5 Å²	134.5	85%	0.85	77%	0.773	S	S	*	*			trans	81.3	154.3	146.3	-87.3	169.1	-90.2	0	0	126.1
65	E	27.4	Very low	27.9	Very low	169 Å²	169	135.7 Å²	135.7	79%	0.79	78%	0.777	S	S	*	*			trans	-59.7	176.8	176.8	-61.9	-78.5	142.3	0	0	115.4
66	P	40.6	Very low	27.8	Very low	110 Å²	110	140.7 Å²	140.7	71%	0.714	79%	0.785	S	S	*	*			cis	-154.7	176.8	27.9	45	-22.7	0	0	0	122
67	S	24.6	Very low	27.7	Very low	109 Å²	109	140.5 Å²	140.5	76%	0.762	78%	0.78	S	S	*	*			trans	50.8	133.5	139.5	65.6	0	0	0	0	126.3
68	G	26.2	Very low	27.9	Very low	74 Å²	74	143.5 Å²	143.5	76%	0.763	78%	0.784	S	S	*	*			trans	83.7	158.7	150.6	0	0	0	0	0	117.4
69	E	28.4	Very low	28.5	Very low	182 Å²	182	143.5 Å²	143.5	85%	0.85	78%	0.781	S	S	*	*			cis	-168.4	145	-17.8	-127.5	164.4	-158.7	0	0	108.1
70	E	28	Very low	28.5	Very low	177 Å²	177	146.5 Å²	146.5	83%	0.827	78%	0.783	S	S	*	*			trans	56.6	163.8	163.8	-62.9	-174	164	0	0	118.7
71	E	31.1	Very low	29.1	Very low	160 Å²	160	145 Å²	145	75%	0.748	78%	0.783	S	S	*	*			cis	-155.1	-178.6	-20.6	-125.3	-152.7	165.2	0	0	111.1
72	T	31.7	Very low	29.3	Very low	123 Å²	123	144.5 Å²	144.5	76%	0.755	78%	0.781	S	S	*	*			trans	83.6	136.2	161.1	70.9	0	0	0	0	123.3
73	N	28.1	Very low	29.5	Very low	148 Å²	148	150.1 Å²	150.1	79%	0.791	79%	0.793	S	S	*	*			trans	-65.8	160.4	177	-48.4	-82.7	0	0	0	113
74	T	28	Very low	29.5	Very low	134 Å²	134	152.1 Å²	152.1	82%	0.822	80%	0.795	S	S	*	*				-169.9	154.9	59	40.6	0	0	0	0	114.7
75	A	27.3	Very low	29.7	Very low	89 Å²	89	151.6 Å²	151.6	74%	0.736	80%	0.797	S	S	*	*			trans	29	125.3	148	0	0	0	0	0	122.5
76	F	28.6	Very low	29.7	Very low	221 Å²	221	150.3 Å²	150.3	97%	0.969	80%	0.801	S	S	*	*				-159	160.3	110.6	-112.2	-75.7	0	0	0	110.4
77	D	26.4	Very low	29	Very low	138 Å²	138	156.3 Å²	156.3	74%	0.738	81%	0.809	S	S	*	*			trans	-127.6	156.8	-155	-141.8	-27.1	0	0	0	114.8
78	L	30	Very low	29.1	Very low	147 Å²	147	162.5 Å²	162.5	77%	0.77	82%	0.816	S	S	*	*			trans	64	164.8	163.7	-63.5	167.4	0	0	0	119.1
79	P	37.8	Very low	29	Very low	109 Å²	109	168.3 Å²	168.3	71%	0.708	82%	0.82	S	S	*	*			cis	-134.3	156	-35	33.6	-17.3	0	0	0	115.4
80	Y	28	Very low	28.8	Very low	225 Å²	225	165.8 Å²	165.8	88%	0.882	82%	0.821	S	S	*	*			trans	-73.4	140.9	163.8	-108.1	-102	0	0	0	112.5	R82	Y80-R82 PolarHBondContact O-N 2.74Å
81	P	37.3	Very low	28.8	Very low	121 Å²	121	163.1 Å²	163.1	79%	0.786	82%	0.818	S	S	*	*			trans	-78.9	107.4	173.6	30.7	-33.3	0	0	0	112.3
82	R	28.3	Very low	28.6	Very low	213 Å²	213	165 Å²	165	80%	0.804	82%	0.823	S	S	*	*			trans	-104.9	110.6	178.2	-169	-175.3	-166	-176.1	7	110.9	Y80	Y80-R82 PolarHBondContact O-N 2.74Å
83	K	29.4	Very low	28.2	Very low	211 Å²	211	167.3 Å²	167.3	92%	0.917	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-96.2	119.4	173.8	-71.3	-174.2	177.1	179.3	0	111.2
84	Q	27	Very low	28.1	Very low	152 Å²	152	165.1 Å²	165.1	71%	0.71	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-100.8	158.8	176.3	-74	-174.6	-26.7	0	0	112.1
85	L	29.2	Very low	28.3	Very low	171 Å²	171	167.6 Å²	167.6	90%	0.895	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-73.3	144.4	165.8	-77.6	71.2	0	0	0	110.6
86	T	27.7	Very low	28.2	Very low	143 Å²	143	170.2 Å²	170.2	88%	0.877	83%	0.827	S	S	*	*			trans	-130.5	162.5	158.2	59.6	0	0	0	0	110.6
87	R	25.4	Very low	28.1	Very low	235 Å²	235	164.6 Å²	164.6	89%	0.887	82%	0.815	S	S	*	*			trans	-152.1	115.5	-162.5	177.3	-167.2	-176.1	-161.7	5.5	112.3
88	R	27.1	Very low	28.1	Very low	239 Å²	239	169.1 Å²	169.1	90%	0.902	82%	0.821	S	S	*	*			trans	-170.5	124.5	158.3	-96.2	138.1	-167	-129.3	5.5	107.3
89	K	25.3	Very low	27.9	Very low	196 Å²	196	170.5 Å²	170.5	85%	0.852	82%	0.824	S	S	*	*				85.7	118.8	67.3	-98.9	-165.8	172.7	-172.3	0	113.3
90	C	23.2	Very low	27.4	Very low	129 Å²	129	172.9 Å²	172.9	87%	0.872	83%	0.829	S	S	*	*			trans	-145.3	167.1	145.9	-160.5	0	0	0	0	108.8
91	T	27.2	Very low	27.7	Very low	122 Å²	122	168.2 Å²	168.2	75%	0.748	83%	0.826	S	S	*	*			trans	-143.1	155.5	-161	38	0	0	0	0	116.1
92	K	28.5	Very low	27.1	Very low	199 Å²	199	165.3 Å²	165.3	87%	0.865	82%	0.818	S	S	*	*			trans	-36.1	148.4	179.9	-52.4	174.4	179.9	179.9	0	117.9
93	I	23.6	Very low	27	Very low	172 Å²	172	162.6 Å²	162.6	88%	0.882	82%	0.82	S	S	*	*			trans	-124.5	165.4	143.6	-68.3	-175.7	0	0	0	108.3
94	S	25.4	Very low	26.9	Very low	102 Å²	102	156.6 Å²	156.6	71%	0.713	81%	0.805	S	S	*	*			trans	-155	179	-165.7	-177.3	0	0	0	0	112.4
95	K	32.4	Very low	27	Very low	185 Å²	185	158.2 Å²	158.2	80%	0.804	81%	0.809	S	S	*	*			trans	85.5	148.9	176.4	-56.8	179.4	-177.9	-179.6	0	114.8
96	N	25.5	Very low	26.9	Very low	145 Å²	145	156.7 Å²	156.7	78%	0.775	80%	0.801	S	S	*	*			cis	-136.5	168.2	5.4	-99	-29.6	0	0	0	108.8
97	S	25.6	Very low	27	Very low	103 Å²	103	160.4 Å²	160.4	72%	0.72	80%	0.799	S	S	*	*			cis	130	108.7	0.1	-175.4	0	0	0	0	110.2
98	R	25.9	Very low	27.1	Very low	232 Å²	232	156.2 Å²	156.2	88%	0.875	79%	0.794	S	S	*	*			trans	-174.7	146.8	159.2	-87.2	-171.1	-160.8	-172.2	3.9	106.9
99	Q	26.9	Very low	27.3	Very low	177 Å²	177	153.8 Å²	153.8	83%	0.827	79%	0.793	S	S	*	*			cis	-160.9	159.4	-31.1	-143	163.6	-13.6	0	0	107.8
100	I	26.7	Very low	27.4	Very low	159 Å²	159	151.2 Å²	151.2	82%	0.815	79%	0.789	S	S	*	*			trans	-91.8	144.8	-176	-76.1	169.2	0	0	0	108.9
101	P	34.3	Very low	27.7	Very low	127 Å²	127	155.1 Å²	155.1	83%	0.825	79%	0.785	S	S	*	*				-146.2	177.1	63.1	39.3	-18.5	0	0	0	117.5
102	G	25.1	Very low	27.6	Very low	60 Å²	60	154 Å²	154	62%	0.619	78%	0.782	S	S	*	*			cis	133	94.7	-12.9	0	0	0	0	0	116.9
103	N	25.8	Very low	27.6	Very low	155 Å²	155	149.7 Å²	149.7	83%	0.829	78%	0.777	S	S	*	*			trans	-175.1	130.7	149.5	-102.7	-24.9	0	0	0	109.2
104	S	27.9	Very low	27.8	Very low	86 Å²	86	151.5 Å²	151.5	60%	0.601	78%	0.778	S	S	*	*				68.7	128.7	83	107	0	0	0	0	112.6
105	K	28	Very low	28	Very low	185 Å²	185	154.2 Å²	154.2	80%	0.804	78%	0.784	S	S	*	*			cis	-145	142.9	23.7	-89.6	162.7	-170.7	173.3	0	109.9
106	L	26.9	Very low	28.1	Very low	140 Å²	140	151.5 Å²	151.5	73%	0.733	79%	0.786	S	S	*	*				82.9	98.3	62.4	-160	178.1	0	0	0	113.2
107	R	30.3	Very low	28.2	Very low	220 Å²	220	154.6 Å²	154.6	83%	0.83	79%	0.786	S	S	*	*			trans	178	128.9	133.3	-99.8	172.3	-165.9	-103.4	0.1	112.9
108	D	27.9	Very low	28.4	Very low	147 Å²	147	156.4 Å²	156.4	79%	0.786	79%	0.788	S	S	*	*			trans	-74.6	162.7	160.7	-47.9	-94.2	0	0	0	111.1
109	H	30.3	Very low	28.5	Very low	188 Å²	188	149.7 Å²	149.7	87%	0.87	78%	0.782	S	S	*	*				-160.9	165.6	127.3	-102.5	-61.8	0	0	0	111
110	D	28	Very low	28.5	Very low	143 Å²	143	150.5 Å²	150.5	77%	0.765	79%	0.788	S	S	*	*			trans	-121.1	173.8	-163.6	-179.7	28.8	0	0	0	111.1
111	R	29.6	Very low	28.5	Very low	211 Å²	211	146.9 Å²	146.9	80%	0.796	78%	0.782	S	S	*	*			trans	92.1	98.6	147.1	-139.2	170.1	-159.5	-147.8	3.9	120.4
112	S	25.6	Very low	28.1	Very low	98 Å²	98	148.9 Å²	148.9	69%	0.685	79%	0.786	S	S	*	*				62.3	114.8	126.8	-50.9	0	0	0	0	122.7
113	S	28.3	Very low	28.3	Very low	108 Å²	108	155 Å²	155	76%	0.755	80%	0.795	S	S	*	*				56.4	127.4	128.7	67.8	0	0	0	0	122.3
114	K	27	Very low	28.3	Very low	210 Å²	210	157 Å²	157	91%	0.913	80%	0.799	S	S	*	*				-166.9	165.3	120.1	-108.4	165.9	-175.3	179.2	0	113.2
115	L	30.5	Very low	28.2	Very low	159 Å²	159	160 Å²	160	83%	0.832	81%	0.809	S	S	*	*			trans	-79.1	172.1	170.4	-68.7	163.2	0	0	0	110.9
116	P	35	Very low	28.3	Very low	129 Å²	129	157.5 Å²	157.5	84%	0.838	81%	0.812	S	S	*	*				-128.3	176.9	112.4	37.4	-31.9	0	0	0	113.7
117	R	27.2	Very low	28.3	Very low	210 Å²	210	155.8 Å²	155.8	79%	0.792	81%	0.811	S	S	*	*			trans	-148.1	166.1	-179.5	-144.6	-168.8	-162.4	-154.6	5.6	109.3
118	D	28.7	Very low	28	Very low	140 Å²	140	153.9 Å²	153.9	75%	0.749	81%	0.811	S	S	*	*			trans	69.1	143.4	168.5	-43.1	-37.9	0	0	0	113.8
119	A	27.5	Very low	27.9	Very low	91 Å²	91	151.1 Å²	151.1	75%	0.752	80%	0.804	S	S	*	*			cis	-148.2	-165.2	-3.9	0	0	0	0	0	108.4
120	M	28.1	Very low	27.7	Very low	195 Å²	195	150.2 Å²	150.2	96%	0.961	80%	0.797	S	S	*	*			cis	-151.1	-133.5	5.8	-152.1	165.1	-173.5	0	0	112.5
121	A	27.2	Very low	27.6	Very low	82 Å²	82	149.9 Å²	149.9	68%	0.678	80%	0.795	S	S	*	*			trans	-104.6	160.3	-164	0	0	0	0	0	116.1
122	N	26.1	Very low	27.8	Very low	170 Å²	170	148.6 Å²	148.6	91%	0.909	80%	0.798	S	S	*	*				-154.6	161.1	117.9	-115.3	-22.1	0	0	0	112.3
123	K	28.6	Very low	27.9	Very low	189 Å²	189	151.6 Å²	151.6	82%	0.822	81%	0.807	S	S	*	*			trans	-103.3	151.4	-179.9	-60.2	176.4	176.3	-177.4	0	111.3
124	E	25.6	Very low	28	Very low	195 Å²	195	152.6 Å²	152.6	91%	0.911	81%	0.808	S	S	*	*			trans	-149.6	144	132.6	-73.2	-155.4	127.4	0	0	109.6
125	D	25.7	Very low	28.1	Very low	151 Å²	151	147.6 Å²	147.6	81%	0.807	80%	0.797	S	S	*	*			trans	-113.8	148.7	166.7	-75.9	-65.4	0	0	0	107.9
126	P	30.5	Very low	28	Very low	132 Å²	132	147.7 Å²	147.7	86%	0.857	80%	0.798	S	S	*	*				-140.8	152.6	121.8	37.1	-26.1	0	0	0	114.3
127	S	25.6	Very low	27.5	Very low	104 Å²	104	150.4 Å²	150.4	73%	0.727	80%	0.799	S	S	*	*			trans	-88.7	141.1	175.1	51.1	0	0	0	0	112.6
128	H	25.8	Very low	27.5	Very low	180 Å²	180	151.9 Å²	151.9	83%	0.833	80%	0.804	S	S	*	*				-169.5	159.8	119.5	-114.7	-83.3	0	0	0	113.6
129	S	25	Very low	27.5	Very low	89 Å²	89	150.9 Å²	150.9	62%	0.622	81%	0.808	S	S	*	*			trans	-67.5	145.3	179.4	54.4	0	0	0	0	115.1
130	K	26.6	Very low	27.6	Very low	169 Å²	169	151.2 Å²	151.2	74%	0.735	81%	0.805	S	S	*	*				178.3	153.5	109.1	-102.7	-179.1	164.2	-142.1	0	117.1
131	D	25.7	Very low	27.8	Very low	136 Å²	136	148 Å²	148	73%	0.727	80%	0.798	S	S	*	*			trans	59.4	142.4	148.1	-52.3	-19.5	0	0	0	120.8
132	E	33.3	Very low	27.9	Very low	183 Å²	183	150.1 Å²	150.1	86%	0.855	80%	0.803	S	S	*	*			trans	-80	147.3	-175.8	-57	-179	111	0	0	113.3
133	N	27.1	Very low	28	Very low	161 Å²	161	149.2 Å²	149.2	86%	0.861	80%	0.797	S	S	*	*			trans	-169.8	121.3	135.9	-109.8	-77.5	0	0	0	110.7	P135	N133-P135 WeakPolarHBondContact O-CD 3.28Å
134	V	30.9	Very low	28	Very low	130 Å²	130	144.8 Å²	144.8	79%	0.788	79%	0.789	S	S	*	*			trans	-93.6	115.1	175	177.9	0	0	0	0	109.7	L136	V134-L136 PolarHBondContact O-N 3.29Å
135	P	29.8	Very low	28.1	Very low	104 Å²	104	146.6 Å²	146.6	68%	0.675	79%	0.788	S	S	*	*			trans	-79.9	110.8	177.8	-5.7	23.4	0	0	0	110.7	N133 H137	N133-P135 WeakPolarHBondContact O-CD 3.28Å; P135-H137 PolarHBondContact O-N 3.19Å; P135-H137 VanDerWaalsContact O-N 3.15Å
136	L	27.4	Very low	28.1	Very low	162 Å²	162	150.2 Å²	150.2	85%	0.848	79%	0.79	S	S	*	*			trans	-65.8	111.9	168	-71	173.7	0	0	0	109.8	V134 R138	V134-L136 PolarHBondContact O-N 3.29Å; L136-R138 PolarHBondContact O-N 3Å
137	H	25.7	Very low	27.9	Very low	186 Å²	186	149.3 Å²	149.3	86%	0.861	79%	0.787	S	S	*	*			trans	-64.3	104.3	-180	-94.7	-109.9	0	0	0	111.9	P135 S139	P135-H137 PolarHBondContact O-N 3.19Å; P135-H137 VanDerWaalsContact O-N 3.15Å; H137-S139 PolarHBondContact O-N 3.18Å
138	R	27	Very low	28	Very low	240 Å²	240	153.6 Å²	153.6	91%	0.906	79%	0.792	S	S	*	*			trans	-73.8	117	170.2	-74.6	-173.2	173.3	-167.8	-1.6	110.9	L136 S140	L136-R138 PolarHBondContact O-N 3Å; R138-S140 PolarHBondContact O-N 3.39Å; R138-S140 VanDerWaalsContact O-N 3.12Å
139	S	28	Very low	28.1	Very low	120 Å²	120	151 Å²	151	84%	0.839	79%	0.791	S	S	*	*			trans	-81.8	78.5	179.3	55.3	0	0	0	0	113.1	H137	H137-S139 PolarHBondContact O-N 3.18Å
140	S	30.1	Very low	28.1	Very low	97 Å²	97	152.5 Å²	152.5	68%	0.678	80%	0.797	S	S	*	*			trans	-174.9	125.8	154.7	-86.7	0	0	0	0	112.9	R138 V142	R138-S140 PolarHBondContact O-N 3.39Å; R138-S140 VanDerWaalsContact O-N 3.12Å; S140-V142 PolarHBondContact O-N 3.49Å
141	P	33	Very low	28	Very low	127 Å²	127	150.1 Å²	150.1	83%	0.825	80%	0.801	S	S	*	*			trans	-81.3	98	171.9	31.9	-32.1	0	0	0	111.3	I143	P141-I143 PolarHBondContact O-N 3.31Å
142	V	28.5	Very low	27.9	Very low	128 Å²	128	154.5 Å²	154.5	78%	0.776	81%	0.808	S	S	*	*			trans	-73.6	110.7	171.9	178.4	0	0	0	0	109.6	S140 S144	S140-V142 PolarHBondContact O-N 3.49Å; V142-S144 PolarHBondContact O-N 3.03Å
143	I	28.6	Very low	27.6	Very low	151 Å²	151	155 Å²	155	77%	0.774	81%	0.81	S	S	*	*			trans	-72.5	95	176.4	-58.4	177.6	0	0	0	109.3	P141 R145	P141-I143 PolarHBondContact O-N 3.31Å; I143-R145 PolarHBondContact O-N 2.88Å
144	S	27.4	Very low	27.5	Very low	95 Å²	95	154 Å²	154	66%	0.664	80%	0.8	S	S	*	*			trans	-70.2	98.1	177.3	-169.9	0	0	0	0	111.3	V142 R146	V142-S144 PolarHBondContact O-N 3.03Å; S144-R146 VanDerWaalsContact C-N 3.31Å; S144-R146 PolarHBondContact O-N 2.84Å
145	R	28.6	Very low	27.3	Very low	233 Å²	233	155.9 Å²	155.9	88%	0.879	80%	0.798	S	S	*	*			trans	-74	80.8	168.8	-70.1	-170.4	178.4	-149.1	1.5	110.5	I143 S147	I143-R145 PolarHBondContact O-N 2.88Å; R145-S147 PolarHBondContact O-N 3.44Å
146	R	25.8	Very low	27.1	Very low	227 Å²	227	155.9 Å²	155.9	86%	0.857	81%	0.807	S	S	*	*			trans	-73	105.9	162.3	-80.9	-169.4	176.9	-121.9	3	109.7	S144	S144-R146 VanDerWaalsContact C-N 3.31Å; S144-R146 PolarHBondContact O-N 2.84Å
147	S	27	Very low	27.1	Very low	113 Å²	113	152.3 Å²	152.3	79%	0.79	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-62.9	129.2	162	33.8	0	0	0	0	109.8	R145	R145-S147 PolarHBondContact O-N 3.44Å
148	K	27.2	Very low	27.1	Very low	194 Å²	194	148.9 Å²	148.9	84%	0.843	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-80.9	136.4	162.9	-75.5	-175.3	175.3	-178.1	0	108.3
149	P	27.3	Very low	27.8	Very low	125 Å²	125	142.7 Å²	142.7	81%	0.812	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-69.5	144.4	172.6	29.9	-34	0	0	0	110.5
150	V	25	Very low	27.8	Very low	122 Å²	122	141.5 Å²	141.5	74%	0.739	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-90.8	120.7	172.5	176	0	0	0	0	108.6
151	S	24.3	Very low	27.7	Very low	118 Å²	118	144.1 Å²	144.1	83%	0.825	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-96.7	117.1	169.8	54.2	0	0	0	0	110.1
152	W	25	Very low	27.4	Very low	228 Å²	228	142.5 Å²	142.5	86%	0.864	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-86.6	133.3	171.9	-79.6	85.5	0	0	0	111.1
153	Q	26.2	Very low	27.4	Very low	193 Å²	193	144 Å²	144	90%	0.902	78%	0.781	S	S	*	*			trans	-148.5	124.6	157.9	-110.7	176.1	-9.6	0	0	109.7
154	E	25.2	Very low	27.4	Very low	141 Å²	141	141.3 Å²	141.3	66%	0.659	78%	0.776	S	S	*	*			trans	-77	168.6	158.8	-51.4	-168	96.2	0	0	109
155	K	26.3	Very low	27.5	Very low	170 Å²	170	144.8 Å²	144.8	74%	0.739	78%	0.783	S	S	*	*			cis	-162.7	-172.6	12.9	-141.6	152.9	-168.9	145.4	0	109.7
156	A	25.6	Very low	27.3	Very low	104 Å²	104	139.9 Å²	139.9	86%	0.86	77%	0.774	S	S	*	*			trans	93.2	156.6	170.4	0	0	0	0	0	116.9
157	A	27.3	Very low	27.4	Very low	87 Å²	87	134 Å²	134	72%	0.719	77%	0.768	S	S	*	*			trans	-150.5	148.8	-154.7	0	0	0	0	0	115.4
158	S	24.9	Very low	27.4	Very low	114 Å²	114	134.2 Å²	134.2	80%	0.797	77%	0.77	S	S	*	*			trans	63.8	161.4	144.8	-63.5	0	0	0	0	120.4
159	P	42.8	Very low	28.9	Very low	110 Å²	110	130.5 Å²	130.5	71%	0.714	77%	0.765	S	S	*	*			cis	-137.4	-173	-36	35.8	-17.5	0	0	0	113.5
160	S	28.6	Very low	29.7	Very low	95 Å²	95	130.4 Å²	130.4	66%	0.664	77%	0.765	S	S	*	*			trans	121.4	132.3	142.8	-47.4	0	0	0	0	119
161	N	27.3	Very low	30	Very low	152 Å²	152	129.8 Å²	129.8	81%	0.813	77%	0.766	S	S	*	*			trans	65.4	158.7	147.5	-59.2	-6.9	0	0	0	120.9
162	S	27.3	Very low	31.5	Very low	92 Å²	92	130.6 Å²	130.6	64%	0.643	77%	0.768	S	S	*	*			cis	-172.9	164.4	-29.8	-85.8	0	0	0	0	110.2
163	L	28.6	Very low	31.4	Very low	160 Å²	160	123.3 Å²	123.3	84%	0.838	76%	0.764	S	S	*	*			trans	71.3	126.1	168.2	-52	-174.8	0	0	0	115.9
164	S	27.9	Very low	31.7	Very low	95 Å²	95	120 Å²	120	66%	0.664	76%	0.762	S	S	*	*			cis	79	114.1	48	80.7	0	0	0	0	112.9
165	M	29	Very low	31.7	Very low	168 Å²	168	118.4 Å²	118.4	83%	0.828	77%	0.765	S	S	*	*				171.2	174.5	73	-87.1	-146.8	110.8	0	0	107.9
166	D	25	Very low	31.8	Very low	129 Å²	129	116.8 Å²	116.8	69%	0.69	77%	0.765	S	S	*	*			cis	-175.1	-177.9	-23.1	-174.4	18.7	0	0	0	107.9
167	S	27.2	Very low	31.9	Very low	104 Å²	104	118.1 Å²	118.1	73%	0.727	75%	0.753	S	S	*	*			trans	107.6	137.6	162.5	-47.3	0	0	0	0	118.6
168	S	28.3	Very low	31.9	Very low	118 Å²	118	122.5 Å²	122.5	83%	0.825	75%	0.751	S	S	*	*			trans	-160	-163.6	167	-69.5	0	0	0	0	109.6
169	P	58.9	Low	31.9	Very low	116 Å²	116	124.2 Å²	124.2	75%	0.753	75%	0.746	S	S	*	*				-92.2	-168.5	-114.4	41.2	-25.5	0	0	0	115
170	P	44.2	Very low	31	Very low	122 Å²	122	124 Å²	124	79%	0.792	75%	0.747	S	S	*	*				-152.7	-165.2	100	40.8	-21.8	0	0	0	116.6
171	S	31	Very low	30.8	Very low	110 Å²	110	126.8 Å²	126.8	77%	0.769	75%	0.753	S	S	*	*			trans	-142.3	-163.2	174.1	-40	0	0	0	0	108
172	P	54.5	Low	30.7	Very low	135 Å²	135	125.8 Å²	125.8	88%	0.877	75%	0.753	S	S	*	*			cis	-136.1	-166.3	-23.7	41.5	-22.9	0	0	0	113.9
173	G	24.4	Very low	30.6	Very low	75 Å²	75	126.2 Å²	126.2	77%	0.773	76%	0.756	S	S	*	*			trans	129.6	170.6	162.8	0	0	0	0	0	115.6
174	S	30.6	Very low	30.4	Very low	123 Å²	123	125.1 Å²	125.1	86%	0.86	76%	0.756	S	S	*	*			cis	-163.8	176.7	-25.3	-162.5	0	0	0	0	111.1
175	C	25.8	Very low	30.2	Very low	107 Å²	107	123.5 Å²	123.5	72%	0.723	75%	0.754	S	S	*	*			trans	-53.9	150.6	-170.5	-52.7	0	0	0	0	119.6
176	D	28	Very low	30.1	Very low	137 Å²	137	123.7 Å²	123.7	73%	0.733	75%	0.75	S	S	*	*				157.5	-176	108.8	-101.7	-2.5	0	0	0	111.4
177	Q	27.8	Very low	30.3	Very low	132 Å²	132	124.7 Å²	124.7	62%	0.617	75%	0.751	S	S	*	*				-168.9	170.4	-53.9	-160.8	-172.2	112.4	0	0	110.2
178	R	27.8	Very low	30.3	Very low	179 Å²	179	127 Å²	127	68%	0.675	76%	0.755	S	S	*	*			trans	79.1	135.3	155.9	-66.2	-169.5	165.5	-135.2	5	122.8
179	E	25.4	Very low	30.3	Very low	149 Å²	149	125.5 Å²	125.5	70%	0.696	75%	0.75	S	S	*	*			trans	62.6	167	137.2	-70	161.2	-151.5	0	0	121.2
180	C	23.9	Very low	28.7	Very low	106 Å²	106	126.3 Å²	126.3	72%	0.716	74%	0.743	S	S	*	*				-161.6	155.9	-59.7	-138.1	0	0	0	0	111.3
181	L	24.9	Very low	27.8	Very low	154 Å²	154	131 Å²	131	81%	0.806	75%	0.745	S	S	*	*			trans	47.1	123	155.3	-69.5	164.6	0	0	0	121.7
182	T	24	Very low	27.6	Very low	131 Å²	131	135.2 Å²	135.2	80%	0.804	74%	0.744	S	S	*	*				-175.3	124.7	129.3	19.8	0	0	0	0	107.6
183	S	24.5	Very low	26.2	Very low	101 Å²	101	136 Å²	136	71%	0.706	74%	0.74	S	S	*	*				50.2	132.3	89.1	78.4	0	0	0	0	114.3
184	T	25.2	Very low	26.2	Very low	136 Å²	136	138.3 Å²	138.3	83%	0.834	74%	0.74	S	S	*	*			cis	-150.6	157.3	30.4	47.2	0	0	0	0	112.1
185	G	24.6	Very low	25.9	Very low	61 Å²	61	137.4 Å²	137.4	63%	0.629	73%	0.733	S	S	*	*				115.9	127.5	100.8	0	0	0	0	0	110.6
186	K	27.1	Very low	25.9	Very low	173 Å²	173	137.5 Å²	137.5	75%	0.752	73%	0.734	S	S	*	*				61	139.5	88.6	-71.7	-176	158	-81.5	0	113.9
187	E	28.3	Very low	25.8	Very low	150 Å²	150	139.5 Å²	139.5	70%	0.701	74%	0.739	S	S	*	*			cis	-175.7	164.3	-7.3	-109.8	157	-173.9	0	0	106
188	D	26.9	Very low	25.8	Very low	151 Å²	151	141.4 Å²	141.4	81%	0.807	75%	0.748	S	S	*	*			cis	-162	-176.7	-9	-177.9	36.5	0	0	0	108.1
189	A	27.6	Very low	26.3	Very low	87 Å²	87	138.7 Å²	138.7	72%	0.719	75%	0.753	S	S	*	*			trans	144.2	135.4	134.1	0	0	0	0	0	117.4
190	E	25.4	Very low	26.2	Very low	133 Å²	133	140.2 Å²	140.2	62%	0.621	76%	0.758	S	S	*	*			trans	-36.5	148.5	176	-56.8	-179.4	91.9	0	0	121.5	R192	E190-R192 IonicContact OE1-NE 3.77Å
191	R	26.7	Very low	26.1	Very low	220 Å²	220	142.7 Å²	142.7	83%	0.83	76%	0.759	S	S	*	*				-176.3	124	103.5	-91.7	153.3	-159.7	-128.5	0.3	110.7
192	R	26.4	Very low	26	Very low	199 Å²	199	140.9 Å²	140.9	75%	0.751	76%	0.755	S	S	*	*				52.6	120.6	91.9	-69	-168.6	-169	-153.6	2.9	114.2	E190	E190-R192 IonicContact OE1-NE 3.77Å
193	L	24	Very low	26	Very low	151 Å²	151	140.3 Å²	140.3	79%	0.791	75%	0.751	S	S	*	*			cis	-137.3	-157	-8.3	-60.5	102.2	0	0	0	107.9
194	T	25.7	Very low	26.2	Very low	124 Å²	124	141 Å²	141	76%	0.761	75%	0.751	S	S	*	*			cis	-164.9	167.3	10.9	-16.4	0	0	0	0	111
195	S	24.3	Very low	26.3	Very low	104 Å²	104	142.9 Å²	142.9	73%	0.727	75%	0.75	S	S	*	*			trans	36	133.1	137.9	-159.7	0	0	0	0	121.5
196	C	24.4	Very low	26.6	Very low	110 Å²	110	144.6 Å²	144.6	74%	0.743	75%	0.745	S	S	*	*			cis	-165	179.5	-10.4	-113.7	0	0	0	0	111.8
197	H	26	Very low	26.5	Very low	179 Å²	179	144.4 Å²	144.4	83%	0.829	75%	0.746	S	S	*	*			trans	-54.3	166.9	-168.4	-66.9	-97.3	0	0	0	121.6
198	Q	27.6	Very low	26.5	Very low	172 Å²	172	143.8 Å²	143.8	80%	0.804	74%	0.741	S	S	*	*			trans	-69.7	-170.5	160.6	-49.3	173.4	-76.1	0	0	111.4
199	P	38.8	Very low	27.4	Very low	122 Å²	122	141.8 Å²	141.8	79%	0.792	74%	0.737	S	S	*	*			cis	-143.3	-149	8.4	44.5	-21.2	0	0	0	117.1
200	F	23.8	Very low	27.5	Very low	181 Å²	181	148.3 Å²	148.3	79%	0.794	74%	0.743	S	S	*	*			trans	-63.9	174	-166.6	-91.4	-110.2	0	0	0	120.7
201	E	22.2	Very low	27.4	Very low	157 Å²	157	147.8 Å²	147.8	73%	0.734	75%	0.748	S	S	*	*			trans	79.4	113.8	150.7	-85.7	169.9	-158	0	0	119.3
202	T	23.2	Very low	27.3	Very low	117 Å²	117	142.1 Å²	142.1	72%	0.718	74%	0.742	S	S	*	*				62.6	133.1	97.9	64.6	0	0	0	0	114.7
203	T	24.2	Very low	27.3	Very low	119 Å²	119	140.2 Å²	140.2	73%	0.73	75%	0.746	S	S	*	*				-164.3	154.4	56.5	39.5	0	0	0	0	114.2
204	V	28.4	Very low	27.2	Very low	115 Å²	115	137.2 Å²	137.2	70%	0.697	74%	0.738	S	S	*	*				46.5	141.5	127.5	-159.5	0	0	0	0	119.1
205	E	26.6	Very low	27.3	Very low	175 Å²	175	136.5 Å²	136.5	82%	0.818	74%	0.738	S	S	*	*				-159.2	-176.7	56.8	-64.7	-96.6	117.3	0	0	110.6
206	D	31.4	Very low	27.4	Very low	97 Å²	97	137 Å²	137	52%	0.519	74%	0.742	S	S	.	*				-163.9	161.2	-56.9	-172.7	11.4	0	0	0	106.5	K208	D206-K208 IonicContact OD1-NZ 3.19Å; D206-K208 PolarHBondContact OD1-NZ 2.91Å; D206-K208 IonicContact OD2-NZ 2.74Å; D206-K208 PolarHBondContact OD2-NZ 2.89Å
207	E	25.4	Very low	27.7	Very low	169 Å²	169	137.9 Å²	137.9	79%	0.79	75%	0.746	S	S	*	*			trans	173.6	162.4	140.5	-100	-60.5	162.9	0	0	113.1
208	K	26.8	Very low	27.7	Very low	137 Å²	137	137 Å²	137	60%	0.596	75%	0.746	S	S	*	*			trans	-125.1	-163.9	-158.1	-89.4	175.5	-164.7	71.2	0	111.4	D206	D206-K208 IonicContact OD1-NZ 3.19Å; D206-K208 PolarHBondContact OD1-NZ 2.91Å; D206-K208 IonicContact OD2-NZ 2.74Å; D206-K208 PolarHBondContact OD2-NZ 2.89Å
209	P	46.4	Very low	27.6	Very low	109 Å²	109	133.8 Å²	133.8	71%	0.708	74%	0.742	S	S	*	*			cis	-127.4	173.8	0.6	29.9	-7	0	0	0	115.9
210	R	30.2	Very low	26.9	Very low	225 Å²	225	135.3 Å²	135.3	85%	0.849	74%	0.742	S	S	*	*			cis	-139.7	-116.9	-12	-109	157.9	-162.4	173.4	5.2	108.5
211	V	23.1	Very low	26.9	Very low	122 Å²	122	134.7 Å²	134.7	74%	0.739	75%	0.746	S	S	*	*			cis	-150.1	126.4	-5.9	176.7	0	0	0	0	109.9
212	S	24.1	Very low	26.9	Very low	100 Å²	100	131.9 Å²	131.9	70%	0.699	74%	0.743	S	S	*	*			trans	19.1	151.7	145	-47.5	0	0	0	0	124.2
213	L	26.1	Very low	26.9	Very low	160 Å²	160	131.4 Å²	131.4	84%	0.838	75%	0.745	S	S	*	*			cis	-176.2	165.1	-13.9	-93.3	-178.1	0	0	0	105.7
214	S	23.5	Very low	27	Very low	88 Å²	88	133.1 Å²	133.1	62%	0.615	75%	0.745	S	S	*	*			cis	-171.7	141.4	-16.4	53	0	0	0	0	113.6
215	S	26.7	Very low	26.8	Very low	108 Å²	108	132.4 Å²	132.4	76%	0.755	74%	0.737	S	S	*	*			trans	61.1	119.7	136.8	-51.1	0	0	0	0	125.3
216	S	27.3	Very low	26.6	Very low	116 Å²	116	133.4 Å²	133.4	81%	0.811	73%	0.733	S	S	*	*			trans	63.7	145.2	134.9	-52.8	0	0	0	0	123.4
217	P	30.5	Very low	26.2	Very low	127 Å²	127	133.6 Å²	133.6	83%	0.825	74%	0.742	S	S	*	*			trans	-146	166.2	133.4	38.8	-23.9	0	0	0	116.4
218	I	25.7	Very low	26.1	Very low	161 Å²	161	130.5 Å²	130.5	83%	0.826	74%	0.739	S	S	*	*			trans	-136.1	170.7	172.1	-70	178.9	0	0	0	108.7
219	S	24.7	Very low	26	Very low	104 Å²	104	135.2 Å²	135.2	73%	0.727	75%	0.753	S	S	*	*			trans	84.5	139.4	174.9	-52.3	0	0	0	0	114.7
220	I	24.5	Very low	24.7	Very low	154 Å²	154	135.1 Å²	135.1	79%	0.79	76%	0.755	S	S	*	*			cis	73.5	99.4	21.5	-48.2	180	0	0	0	115.3
221	L	23.5	Very low	25.1	Very low	169 Å²	169	129.7 Å²	129.7	89%	0.885	75%	0.749	S	S	*	*			trans	-152.2	176.1	134.3	-138.3	94.5	0	0	0	110.3
222	S	23.2	Very low	25.1	Very low	97 Å²	97	132.8 Å²	132.8	68%	0.678	76%	0.755	S	S	*	*			trans	-141.3	-176	-173.9	-67	0	0	0	0	111.5
223	S	23.4	Very low	25.1	Very low	108 Å²	108	136.4 Å²	136.4	76%	0.755	76%	0.761	S	S	*	*			trans	74.5	147.9	175.3	-50.5	0	0	0	0	114.1
224	Q	26	Very low	25.5	Very low	154 Å²	154	133.6 Å²	133.6	72%	0.72	75%	0.752	S	S	*	*			cis	-153.6	171.7	-4.9	-129.6	171.8	-84.1	0	0	106.9
225	D	23.1	Very low	25.5	Very low	100 Å²	100	136 Å²	136	54%	0.535	75%	0.754	S	S	.	*			cis	-157.7	-156.1	10.2	-149.5	-6.8	0	0	0	107.2
226	R	23.6	Very low	25.5	Very low	197 Å²	197	137.2 Å²	137.2	74%	0.743	75%	0.746	S	S	*	*			cis	-154.6	168.8	-1.9	-172.2	150.9	-79.9	-158.4	-3.1	110.3
227	S	23.2	Very low	25.3	Very low	101 Å²	101	138.7 Å²	138.7	71%	0.706	74%	0.74	S	S	*	*			trans	-27.4	159.3	154.4	-45.1	0	0	0	0	116.4
228	S	22.6	Very low	25	Very low	103 Å²	103	140.2 Å²	140.2	72%	0.72	74%	0.736	S	S	*	*			cis	-169.6	178.2	-4.5	45.8	0	0	0	0	107.2
229	R	24.2	Very low	25	Very low	237 Å²	237	144.3 Å²	144.3	89%	0.894	74%	0.741	S	S	*	*			cis	-169.8	158.2	37.4	-142.3	178	-154.3	-161.7	5.3	109.3
230	S	20.4	Very low	24.9	Very low	107 Å²	107	142.8 Å²	142.8	75%	0.748	74%	0.741	S	S	*	*			trans	-88	-170.5	164.8	-35.6	0	0	0	0	110.1
231	P	37	Very low	24.8	Very low	110 Å²	110	147 Å²	147	71%	0.714	75%	0.748	S	S	*	*			cis	-134.9	-178.8	-11.3	29	-5.6	0	0	0	114.2
232	Q	24.7	Very low	24.8	Very low	188 Å²	188	142.9 Å²	142.9	88%	0.879	73%	0.733	S	S	*	*				171.5	153.9	111.5	-91	-177.9	-14.3	0	0	114.7
233	Q	22.3	Very low	25	Very low	175 Å²	175	145.5 Å²	145.5	82%	0.818	74%	0.738	S	S	*	*			trans	-98.4	-171.9	170.8	-118.3	177.5	-24.2	0	0	108.5
234	P	35.6	Very low	25	Very low	101 Å²	101	147.2 Å²	147.2	66%	0.656	74%	0.739	S	S	*	*			cis	-138.6	162	27	42.2	-19.8	0	0	0	115.4
235	E	22.6	Very low	24.9	Very low	140 Å²	140	144.4 Å²	144.4	65%	0.654	74%	0.736	S	S	*	*				73.3	153.9	108.7	-68.7	-166.9	155.9	0	0	117.1
236	K	26.4	Very low	24.9	Very low	133 Å²	133	150.8 Å²	150.8	58%	0.578	75%	0.753	S	S	*	*			cis	-166.8	157.4	-3.3	-117.9	171.6	179.1	141.9	0	111.6
237	E	24	Very low	25	Very low	146 Å²	146	146.5 Å²	146.5	68%	0.682	75%	0.753	S	S	*	*			trans	56.1	172.2	140.2	-68.9	172.2	-147.5	0	0	121.2
238	H	24.7	Very low	25.2	Very low	160 Å²	160	147.8 Å²	147.8	74%	0.741	76%	0.757	S	S	*	*			cis	-162	165.2	-43.1	-110.6	-34.9	0	0	0	110.2
239	R	24.9	Very low	25.8	Very low	247 Å²	247	149 Å²	149	93%	0.932	76%	0.762	S	S	*	*			trans	65.3	167	171.6	-56.4	168	-163.2	-101.2	1.5	115.5
240	G	22.7	Very low	25.9	Very low	72 Å²	72	145.1 Å²	145.1	74%	0.742	76%	0.759	S	S	*	*			cis	150.3	138.2	-17.4	0	0	0	0	0	115.5
241	W	23	Very low	26.1	Very low	243 Å²	243	151.7 Å²	151.7	92%	0.92	77%	0.768	S	S	*	*			trans	84.9	95.9	156.8	-155.2	-86.4	0	0	0	122.2
242	S	23.8	Very low	25.8	Very low	82 Å²	82	153 Å²	153	57%	0.573	77%	0.774	S	S	*	*				83.6	138.5	126.2	-53	0	0	0	0	127.1
243	L	26.3	Very low	25.8	Very low	151 Å²	151	147.6 Å²	147.6	79%	0.791	77%	0.768	S	S	*	*			trans	83.9	153.7	131.2	-88.7	164.5	0	0	0	124.9
244	N	23.5	Very low	26	Very low	145 Å²	145	148.1 Å²	148.1	78%	0.775	77%	0.771	S	S	*	*			trans	75.5	154.3	168.5	-59.8	-21	0	0	0	119.1
245	S	23.8	Very low	25.5	Very low	94 Å²	94	148.3 Å²	148.3	66%	0.657	77%	0.774	S	S	*	*			cis	-172.6	179.7	-35.9	-160.2	0	0	0	0	109.7
246	W	23.5	Very low	25.6	Very low	235 Å²	235	147 Å²	147	89%	0.89	78%	0.78	S	S	*	*			trans	75.2	147.8	168.8	-58.9	-24.1	0	0	0	118.3
247	S	26.3	Very low	25.7	Very low	106 Å²	106	146.7 Å²	146.7	74%	0.741	80%	0.795	S	S	*	*			cis	-162.4	157	-17.7	-97	0	0	0	0	111
248	T	27	Very low	25.9	Very low	128 Å²	128	149 Å²	149	79%	0.785	80%	0.803	S	S	*	*			trans	-102.4	165.6	172.3	42	0	0	0	0	112.8
249	P	34.5	Very low	26.2	Very low	129 Å²	129	147.4 Å²	147.4	84%	0.838	81%	0.806	S	S	*	*			trans	-132.8	157.2	134.4	37.4	-28.4	0	0	0	114
250	N	27.4	Very low	26.2	Very low	155 Å²	155	144.6 Å²	144.6	83%	0.829	80%	0.803	S	S	*	*			trans	-100.8	149.9	179.6	-75.3	-31.4	0	0	0	112.8
251	R	25.2	Very low	26.6	Very low	246 Å²	246	146 Å²	146	93%	0.928	80%	0.802	S	S	*	*				-160.1	165.7	127.2	-125.3	-178.9	178.4	-129.7	-1.6	113.7
252	T	29.3	Very low	26.8	Very low	137 Å²	137	144.2 Å²	144.2	84%	0.84	80%	0.801	S	S	*	*			trans	-104.3	157.9	-167.8	45	0	0	0	0	113.7
253	G	25.7	Very low	27	Very low	74 Å²	74	148 Å²	148	76%	0.763	81%	0.814	S	S	*	*			trans	-170.6	151.4	172.4	0	0	0	0	0	111.6
254	H	26.2	Very low	27	Very low	187 Å²	187	152.1 Å²	152.1	87%	0.866	82%	0.82	S	S	*	*			trans	-113.6	155.2	-171.5	-82	-98.4	0	0	0	114.1
255	S	24.6	Very low	27.2	Very low	104 Å²	104	150 Å²	150	73%	0.727	82%	0.816	S	S	*	*			trans	78.4	125.6	149.4	-62.6	0	0	0	0	122.2
256	S	25.8	Very low	27.3	Very low	112 Å²	112	151.4 Å²	151.4	78%	0.783	83%	0.825	S	S	*	*			trans	54.5	114.7	140.3	62.8	0	0	0	0	122
257	S	27.1	Very low	27.6	Very low	127 Å²	127	144.8 Å²	144.8	89%	0.888	81%	0.814	S	S	*	*				-171.8	172.5	125.3	39.4	0	0	0	0	111.5
258	K	27.9	Very low	28	Very low	196 Å²	196	148.9 Å²	148.9	85%	0.852	82%	0.821	S	S	*	*			trans	-83.5	157.3	-176	-79.7	-178.9	178.9	177.7	0	112.3
259	P	32.2	Very low	28.1	Very low	125 Å²	125	150.6 Å²	150.6	81%	0.812	83%	0.825	S	S	*	*			trans	-75.4	149.1	-170.3	30.8	-36.7	0	0	0	113.6
260	H	25	Very low	27.9	Very low	188 Å²	188	150.9 Å²	150.9	87%	0.87	82%	0.819	S	S	*	*			trans	-118.9	154.1	164	-106	-85.3	0	0	0	110.9
261	S	30	Very low	28.1	Very low	102 Å²	102	151.7 Å²	151.7	71%	0.713	82%	0.823	S	S	*	*			trans	-70.2	147.8	-174.6	46.1	0	0	0	0	114.1
262	K	26.8	Very low	28.3	Very low	205 Å²	205	146.3 Å²	146.3	89%	0.891	81%	0.812	S	S	*	*			trans	-159.7	128	138.2	-114.3	163.9	-173.6	173.6	0	110.7
263	D	28.5	Very low	28.6	Very low	161 Å²	161	143.8 Å²	143.8	86%	0.861	80%	0.798	S	S	*	*			trans	-63.5	146.7	177.1	-56.7	-88	0	0	0	111.7
264	R	27	Very low	28.9	Very low	239 Å²	239	144.1 Å²	144.1	90%	0.902	79%	0.793	S	S	*	*			trans	-132.7	104.5	159.3	-148	175.4	-165.8	-172.6	3.2	108.3	C266	R264-C266 PolarHBondContact O-N 3.15Å
265	S	27.3	Very low	29.5	Very low	99 Å²	99	139.5 Å²	139.5	69%	0.692	78%	0.775	S	S	*	*			trans	-60.9	132	-179.7	-178.7	0	0	0	0	110.9
266	C	25.4	Very low	30.4	Very low	125 Å²	125	137.7 Å²	137.7	85%	0.845	76%	0.757	S	S	*	*			trans	-128.2	86.9	157.6	-73.7	0	0	0	0	107.6	R264	R264-C266 PolarHBondContact O-N 3.15Å
267	S	29.6	Very low	31.3	Very low	95 Å²	95	137 Å²	137	66%	0.664	74%	0.74	S	S	*	*			trans	-57.2	169.5	159.2	-55.3	0	0	0	0	110.8
268	E	34.8	Very low	32	Very low	192 Å²	192	138.2 Å²	138.2	90%	0.897	73%	0.725	S	S	*	*			trans	77.2	56.3	175.6	-50.5	-167.5	161.5	0	0	117.2
269	L	29	Very low	33	Very low	165 Å²	165	131.7 Å²	131.7	86%	0.864	70%	0.701	S	S	*	*	S	Bend	trans	-140.7	86	144.6	-101	-177	0	0	0	112.4
270	L	31.1	Very low	33.6	Very low	135 Å²	135	129.4 Å²	129.4	71%	0.707	69%	0.689	S	S	*	*			trans	33.4	106.5	156.4	-64.1	172.1	0	0	0	118.3	L272	L270-L272 HydrophobicContact CB-CD1 4.47Å; L270-L272 PolarHBondContact O-N 3.17Å; L270-L272 VanDerWaalsContact O-N 3.16Å
271	D	31.8	Very low	34.4	Very low	171 Å²	171	123.6 Å²	123.6	91%	0.914	67%	0.668	S	S	*	*			trans	-55	115.9	165.8	-61.7	-78.3	0	0	0	112.4
272	L	28.9	Very low	35.4	Very low	133 Å²	133	124.1 Å²	124.1	70%	0.696	66%	0.659	S	S	*	*			trans	-113.7	139.3	156.5	-85.7	79.6	0	0	0	108.2	L270 A274	L270-L272 HydrophobicContact CB-CD1 4.47Å; L270-L272 PolarHBondContact O-N 3.17Å; L270-L272 VanDerWaalsContact O-N 3.16Å; L272-A274 PolarHBondContact O-N 3.2Å
273	P	35.3	Very low	36.6	Very low	85 Å²	85	115.7 Å²	115.7	55%	0.552	62%	0.624	S	S	*	*			trans	-67.6	126.9	-169.6	25.7	-34.3	0	0	0	112.4	D275	P273-D275 PolarHBondContact O-N 3.03Å; P273-D275 VanDerWaalsContact O-N 3.11Å
274	A	32.7	Very low	37.5	Very low	80 Å²	80	112.5 Å²	112.5	66%	0.661	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-66	-7.3	174.5	0	0	0	0	0	113.7	L272 I276 F277	L272-A274 PolarHBondContact O-N 3.2Å; A274-I276 VanDerWaalsContact C-N 3.25Å; A274-I276 PolarHBondContact O-N 3.08Å; A274-F277 PolarHBondContact O-N 2.83Å; A274-F277 VanDerWaalsContact O-N 3.16Å
275	D	38.3	Very low	38.8	Very low	90 Å²	90	107.2 Å²	107.2	48%	0.481	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-61.5	-26.5	-175.7	-61.3	-67.2	0	0	0	114.3	P273 F277 R278	P273-D275 PolarHBondContact O-N 3.03Å; P273-D275 VanDerWaalsContact O-N 3.11Å; D275-F277 PolarHBondContact O-N 2.81Å; D275-F277 VanDerWaalsContact O-N 3.11Å; D275-R278 PolarHBondContact O-N 2.92Å; D275-R278 IonicContact OD1-CZ 3.38Å; D275-R278 IonicContact OD1-NE 3.98Å; D275-R278 IonicContact OD1-NH1 3.73Å; D275-R278 PolarHBondContact OD1-NH1 3.12Å
276	I	44.6	Very low	40	Very low	67 Å²	67	105.8 Å²	105.8	34%	0.344	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-64.2	-18.1	178.4	-58	178.8	0	0	0	112.2	A274 P489 R529	A274-I276 VanDerWaalsContact C-N 3.25Å; A274-I276 PolarHBondContact O-N 3.08Å; I276-P489 HydrophobicContact CD1-CG 4.36Å; I276-R529 PolarHBondContact O-NH2 2.89Å
277	F	44.6	Very low	41.5	Very low	98 Å²	98	100.7 Å²	100.7	43%	0.43	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-113.3	12.4	-178	-65.3	-77.5	0	0	0	114.5	A274 D275 T279 L501	A274-F277 PolarHBondContact O-N 2.83Å; A274-F277 VanDerWaalsContact O-N 3.16Å; D275-F277 PolarHBondContact O-N 2.81Å; D275-F277 VanDerWaalsContact O-N 3.11Å; F277-T279 VanDerWaalsContact C-N 3.28Å; F277-T279 PolarHBondContact O-N 2.93Å; F277-L501 HydrophobicContact CD1-CB 4.36Å; F277-L501 HydrophobicContact CE1-CB 3.69Å; F277-L501 HydrophobicContact CE1-CD1 4.29Å; F277-L501 HydrophobicContact CE1-CG 4.41Å; F277-L501 HydrophobicContact CE2-CD1 4.33Å; F277-L501 HydrophobicContact CZ-CB 4.09Å; F277-L501 HydrophobicContact CZ-CD1 3.81Å; F277-L501 HydrophobicContact CZ-CG 4.4Å
278	R	41.6	Very low	43	Very low	151 Å²	151	98 Å²	98	57%	0.57	52%	0.518	S	S	*	.			trans	-74.9	66.6	176.8	-82.6	-177.1	157.8	161.1	-9.8	113.7	D275	D275-R278 PolarHBondContact O-N 2.92Å; D275-R278 IonicContact OD1-CZ 3.38Å; D275-R278 IonicContact OD1-NE 3.98Å; D275-R278 IonicContact OD1-NH1 3.73Å; D275-R278 PolarHBondContact OD1-NH1 3.12Å
279	T	48.7	Very low	44	Very low	59 Å²	59	94 Å²	94	36%	0.362	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	1.7	178.5	56	0	0	0	0	115.5	F277 L283	F277-T279 VanDerWaalsContact C-N 3.28Å; F277-T279 PolarHBondContact O-N 2.93Å; T279-L283 WeakPolarHBondContact O-CB 3.43Å
280	S	44.4	Very low	45.4	Very low	78 Å²	78	91.8 Å²	91.8	55%	0.545	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-61.8	179.9	-177.1	0	0	0	0	112.6	E282 L283 E284	S280-E282 VanDerWaalsContact C-N 3.35Å; S280-E282 PolarHBondContact O-N 3.17Å; S280-L283 WeakPolarHBondContact O-CB 3.46Å; S280-L283 PolarHBondContact O-N 2.72Å; S280-L283 VanDerWaalsContact O-N 3.13Å; S280-E284 PolarHBondContact O-N 3.44Å
281	C	42.2	Very low	46.5	Very low	65 Å²	65	88 Å²	88	44%	0.439	47%	0.465	S	S	.	.	H	α-helix	trans	-67.1	-29.1	-172.7	-174.8	0	0	0	0	114.2	K285	C281-K285 WeakPolarHBondContact O-CG 3.37Å
282	E	51.4	Low	47.8	Very low	113 Å²	113	81.5 Å²	81.5	53%	0.528	43%	0.431	S	S	.	.	H	α-helix	trans	-81.8	-31.1	173.7	-56.6	-147.2	129.1	0	0	111.9	S280 E284 K285 E286	S280-E282 VanDerWaalsContact C-N 3.35Å; S280-E282 PolarHBondContact O-N 3.17Å; E282-E284 PolarHBondContact O-N 2.81Å; E282-K285 WeakPolarHBondContact O-CB 3.43Å; E282-K285 PolarHBondContact O-N 3.24Å; E282-K285 VanDerWaalsContact O-N 3.07Å; E282-E286 PolarHBondContact O-N 2.73Å
283	L	51.4	Low	49.6	Very low	28 Å²	28	78.9 Å²	78.9	15%	0.147	42%	0.421	C	S	.	.	H	α-helix	trans	-65.4	-37.4	173.9	-176.2	65	0	0	0	111.8	T279 S280 K285 N287 A477	T279-L283 WeakPolarHBondContact O-CB 3.43Å; S280-L283 WeakPolarHBondContact O-CB 3.46Å; S280-L283 PolarHBondContact O-N 2.72Å; S280-L283 VanDerWaalsContact O-N 3.13Å; L283-K285 VanDerWaalsContact C-N 3.27Å; L283-K285 PolarHBondContact O-N 3.32Å; L283-N287 VanDerWaalsContact O-CB 3.28Å; L283-N287 WeakPolarHBondContact O-CB 3.31Å; L283-N287 PolarHBondContact O-N 3.04Å; L283-N287 PolarHBondContact O-ND2 2.95Å; L283-A477 HydrophobicContact CD1-CB 4.23Å; L283-A477 HydrophobicContact CD2-CB 4.03Å
284	E	48.4	Very low	50.7	Low	94 Å²	94	79.9 Å²	79.9	44%	0.439	42%	0.421	S	S	.	.	H	α-helix	trans	-63.4	-31	171.2	-73.1	-175.7	133.9	0	0	112.3	S280 E282 A288 R465	S280-E284 PolarHBondContact O-N 3.44Å; E282-E284 PolarHBondContact O-N 2.81Å; E284-A288 PolarHBondContact O-N 3.43Å; E284-R465 IonicContact OE1-CZ 3.59Å; E284-R465 VanDerWaalsContact OE1-CZ 3.31Å; E284-R465 IonicContact OE1-NE 2.63Å; E284-R465 PolarHBondContact OE1-NE 3.48Å; E284-R465 IonicContact OE1-NH2 2.67Å; E284-R465 PolarHBondContact OE1-NH2 3.07Å; E284-R465 IonicContact OE2-NH2 3.87Å
285	K	53.6	Low	52.1	Low	129 Å²	129	81 Å²	81	56%	0.561	41%	0.414	S	S	*	.	H	α-helix	trans	-78.7	-45.4	175.7	-65.5	170.8	-170.9	174.6	0	112.7	C281 E282 L283 N287 A288	C281-K285 WeakPolarHBondContact O-CG 3.37Å; E282-K285 WeakPolarHBondContact O-CB 3.43Å; E282-K285 PolarHBondContact O-N 3.24Å; E282-K285 VanDerWaalsContact O-N 3.07Å; L283-K285 VanDerWaalsContact C-N 3.27Å; L283-K285 PolarHBondContact O-N 3.32Å; K285-N287 VanDerWaalsContact C-N 3.25Å; K285-N287 PolarHBondContact O-N 2.98Å; K285-A288 VanDerWaalsContact O-CB 3.26Å; K285-A288 WeakPolarHBondContact O-CB 3.34Å; K285-A288 PolarHBondContact O-N 3.29Å
286	E	52.9	Low	53.1	Low	68 Å²	68	79.9 Å²	79.9	32%	0.318	41%	0.407	S	S	.	.	H	α-helix	trans	-58.7	-39.7	175.3	-72.7	-171	163.1	0	0	111.1	E282 A288 Q482	E282-E286 PolarHBondContact O-N 2.73Å; E286-A288 VanDerWaalsContact C-N 3.29Å; E286-A288 PolarHBondContact O-N 2.79Å; E286-Q482 PolarHBondContact OE1-NE2 2.86Å
287	N	56.4	Low	54.1	Low	19 Å²	19	81 Å²	81	10%	0.102	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-12.8	-179.9	-70.1	-30.5	0	0	0	114.3	L283 K285 H289 F290 V291	L283-N287 VanDerWaalsContact O-CB 3.28Å; L283-N287 WeakPolarHBondContact O-CB 3.31Å; L283-N287 PolarHBondContact O-N 3.04Å; L283-N287 PolarHBondContact O-ND2 2.95Å; K285-N287 VanDerWaalsContact C-N 3.25Å; K285-N287 PolarHBondContact O-N 2.98Å; N287-H289 PolarHBondContact O-N 3.26Å; N287-F290 HydrophobicContact CB-CD2 4.31Å; N287-F290 PolarHBondContact O-N 3.21Å; N287-V291 PolarHBondContact O-N 3.47Å
288	A	60.7	Low	55.4	Low	39 Å²	39	83.2 Å²	83.2	32%	0.322	43%	0.425	S	S	.	.	H	α-helix	trans	-57.7	-33.7	-178.9	0	0	0	0	0	112.5	E284 K285 E286 F290 V291 V292	E284-A288 PolarHBondContact O-N 3.43Å; K285-A288 VanDerWaalsContact O-CB 3.26Å; K285-A288 WeakPolarHBondContact O-CB 3.34Å; K285-A288 PolarHBondContact O-N 3.29Å; E286-A288 VanDerWaalsContact C-N 3.29Å; E286-A288 PolarHBondContact O-N 2.79Å; A288-F290 PolarHBondContact O-N 3.44Å; A288-V291 WeakPolarHBondContact O-CB 3.35Å; A288-V291 PolarHBondContact O-N 3.13Å; A288-V292 WeakPolarHBondContact O-CG2 3.36Å; A288-V292 PolarHBondContact O-N 3.35Å
289	H	56.8	Low	56.6	Low	108 Å²	108	78.9 Å²	78.9	50%	0.5	42%	0.415	S	S	.	.	H	α-helix	trans	-59.3	-32.3	175.1	-65.4	-76.5	0	0	0	113.2	N287 V293	N287-H289 PolarHBondContact O-N 3.26Å; H289-V293 WeakPolarHBondContact O-CG2 3.33Å; H289-V293 PolarHBondContact O-N 3.05Å
290	F	57.1	Low	57.3	Low	118 Å²	118	79.7 Å²	79.7	52%	0.518	42%	0.417	S	S	.	.	H	α-helix	trans	-76.6	-33.7	177.8	-55.1	-60.3	0	0	0	112.2	N287 A288 V292 V293 D294	N287-F290 HydrophobicContact CB-CD2 4.31Å; N287-F290 PolarHBondContact O-N 3.21Å; A288-F290 PolarHBondContact O-N 3.44Å; F290-V292 VanDerWaalsContact C-N 3.25Å; F290-V292 PolarHBondContact O-N 2.87Å; F290-V293 PolarHBondContact O-N 2.91Å; F290-D294 WeakPolarHBondContact O-CB 3.16Å; F290-D294 PolarHBondContact O-N 3.47Å
291	V	55.5	Low	58.6	Low	55 Å²	55	80.5 Å²	80.5	33%	0.333	41%	0.412	S	S	.	.	H	α-helix	trans	-57.8	-43	172.3	-171.9	0	0	0	0	110.4	N287 A288 D294 M295 T468	N287-V291 PolarHBondContact O-N 3.47Å; A288-V291 WeakPolarHBondContact O-CB 3.35Å; A288-V291 PolarHBondContact O-N 3.13Å; V291-D294 PolarHBondContact O-N 2.95Å; V291-M295 HydrophobicContact CG1-SD 4.09Å; V291-M295 WeakPolarHBondContact O-CB 2.93Å; V291-M295 VanDerWaalsContact O-CG 3.26Å; V291-M295 WeakPolarHBondContact O-CG 3.4Å; V291-M295 PolarHBondContact O-N 2.92Å; V291-T468 HydrophobicContact CG2-CG2 3.88Å
292	V	58.3	Low	59.6	Low	34 Å²	34	79.1 Å²	79.1	21%	0.206	41%	0.409	C	S	.	.	H	α-helix	trans	-65.8	-42.9	178.5	-179.6	0	0	0	0	111.3	A288 F290 M296 A416	A288-V292 WeakPolarHBondContact O-CG2 3.36Å; A288-V292 PolarHBondContact O-N 3.35Å; F290-V292 VanDerWaalsContact C-N 3.25Å; F290-V292 PolarHBondContact O-N 2.87Å; V292-M296 HydrophobicContact CG1-SD 4.21Å; V292-M296 WeakPolarHBondContact O-CB 3.35Å; V292-M296 VanDerWaalsContact O-CG 3.25Å; V292-M296 WeakPolarHBondContact O-CG 3.44Å; V292-M296 PolarHBondContact O-N 3.05Å; V292-A416 HydrophobicContact CB-CB 4.33Å; V292-A416 HydrophobicContact CG1-CB 3.92Å; V292-A416 HydrophobicContact CG2-CB 3.44Å; V292-A416 VanDerWaalsContact CG2-CB 3.44Å
293	V	66.6	Low	60.5	Low	79 Å²	79	76 Å²	76	48%	0.479	40%	0.397	S	S	.	.	H	α-helix	trans	-64.9	-42.7	176.4	170.5	0	0	0	0	111.6	H289 F290 M296 L297	H289-V293 WeakPolarHBondContact O-CG2 3.33Å; H289-V293 PolarHBondContact O-N 3.05Å; F290-V293 PolarHBondContact O-N 2.91Å; V293-M296 PolarHBondContact O-N 2.83Å; V293-L297 HydrophobicContact CG1-CD1 3.94Å; V293-L297 HydrophobicContact CG1-CG 4.39Å; V293-L297 WeakPolarHBondContact O-CG 3.21Å; V293-L297 PolarHBondContact O-N 2.86Å
294	D	57.8	Low	61.1	Low	105 Å²	105	80 Å²	80	56%	0.561	41%	0.413	S	S	*	.	H	α-helix	trans	-66.1	-45.1	-179.6	-151.2	38	0	0	0	111	F290 V291 M296 L297 E298	F290-D294 WeakPolarHBondContact O-CB 3.16Å; F290-D294 PolarHBondContact O-N 3.47Å; V291-D294 PolarHBondContact O-N 2.95Å; D294-M296 VanDerWaalsContact C-N 3.31Å; D294-M296 PolarHBondContact O-N 3.12Å; D294-L297 PolarHBondContact O-N 2.93Å; D294-L297 VanDerWaalsContact O-N 3.16Å; D294-E298 WeakPolarHBondContact O-CB 3.34Å; D294-E298 PolarHBondContact O-N 2.93Å
295	M	62.4	Low	61.5	Low	104 Å²	104	83.2 Å²	83.2	51%	0.512	42%	0.422	S	S	.	.	H	α-helix	trans	-61.1	-36.1	171.8	-71.1	177	70.4	0	0	113	V291 V299	V291-M295 HydrophobicContact CG1-SD 4.09Å; V291-M295 WeakPolarHBondContact O-CB 2.93Å; V291-M295 VanDerWaalsContact O-CG 3.26Å; V291-M295 WeakPolarHBondContact O-CG 3.4Å; V291-M295 PolarHBondContact O-N 2.92Å; M295-V299 VanDerWaalsContact O-CG2 3.29Å; M295-V299 WeakPolarHBondContact O-CG2 3.42Å; M295-V299 PolarHBondContact O-N 2.88Å; M295-V299 VanDerWaalsContact O-N 3.15Å
296	M	60.7	Low	61.8	Low	67 Å²	67	81 Å²	81	33%	0.33	42%	0.419	S	S	.	.	H	α-helix	trans	-69.8	-38	174.5	-76.7	179.8	69.1	0	0	111.9	V292 V293 D294 L300	V292-M296 HydrophobicContact CG1-SD 4.21Å; V292-M296 WeakPolarHBondContact O-CB 3.35Å; V292-M296 VanDerWaalsContact O-CG 3.25Å; V292-M296 WeakPolarHBondContact O-CG 3.44Å; V292-M296 PolarHBondContact O-N 3.05Å; V293-M296 PolarHBondContact O-N 2.83Å; D294-M296 VanDerWaalsContact C-N 3.31Å; D294-M296 PolarHBondContact O-N 3.12Å; M296-L300 WeakPolarHBondContact O-CB 3.44Å; M296-L300 WeakPolarHBondContact O-CD1 3.46Å; M296-L300 WeakPolarHBondContact O-CG 3.39Å; M296-L300 PolarHBondContact O-N 3.4Å
297	L	65.2	Low	62	Low	91 Å²	91	82.7 Å²	82.7	48%	0.476	43%	0.43	S	S	.	.	H	α-helix	trans	-67.1	-43.6	175.3	-72.9	170.3	0	0	0	111.6	V293 D294 V299 L300 E301	V293-L297 HydrophobicContact CG1-CD1 3.94Å; V293-L297 HydrophobicContact CG1-CG 4.39Å; V293-L297 WeakPolarHBondContact O-CG 3.21Å; V293-L297 PolarHBondContact O-N 2.86Å; D294-L297 PolarHBondContact O-N 2.93Å; D294-L297 VanDerWaalsContact O-N 3.16Å; L297-V299 VanDerWaalsContact C-N 3.34Å; L297-V299 PolarHBondContact O-N 3.4Å; L297-L300 PolarHBondContact O-N 2.89Å; L297-E301 WeakPolarHBondContact O-CB 3.45Å; L297-E301 VanDerWaalsContact O-CG 3.28Å; L297-E301 WeakPolarHBondContact O-CG 3.27Å; L297-E301 PolarHBondContact O-N 3.11Å
298	E	71.3	Confident	62	Low	144 Å²	144	84.5 Å²	84.5	67%	0.673	44%	0.444	S	S	*	.	H	α-helix	trans	-57.3	-45.8	174.7	-174.3	-177.1	-164.3	0	0	111.5	D294 E301 G302	D294-E298 WeakPolarHBondContact O-CB 3.34Å; D294-E298 PolarHBondContact O-N 2.93Å; E298-E301 PolarHBondContact O-N 3.43Å; E298-G302 PolarHBondContact O-N 3.49Å
299	V	67.2	Low	61.6	Low	60 Å²	60	89.4 Å²	89.4	36%	0.364	46%	0.458	S	S	.	.	H	α-helix	trans	-66	-41.3	176.1	171.4	0	0	0	0	111.8	M295 L297 G302 V303 F423	M295-V299 VanDerWaalsContact O-CG2 3.29Å; M295-V299 WeakPolarHBondContact O-CG2 3.42Å; M295-V299 PolarHBondContact O-N 2.88Å; M295-V299 VanDerWaalsContact O-N 3.15Å; L297-V299 VanDerWaalsContact C-N 3.34Å; L297-V299 PolarHBondContact O-N 3.4Å; V299-G302 PolarHBondContact O-N 2.91Å; V299-V303 WeakPolarHBondContact O-CG2 3.37Å; V299-V303 PolarHBondContact O-N 3.3Å; V299-F423 HydrophobicContact CG1-CD1 4.5Å; V299-F423 HydrophobicContact CG1-CE1 3.78Å
300	L	63.6	Low	61.4	Low	76 Å²	76	89.1 Å²	89.1	40%	0.398	46%	0.46	S	S	.	.	H	α-helix	trans	-66.5	-37.8	177.2	-76.2	166.9	0	0	0	112.3	M296 L297 K304 F423	M296-L300 WeakPolarHBondContact O-CB 3.44Å; M296-L300 WeakPolarHBondContact O-CD1 3.46Å; M296-L300 WeakPolarHBondContact O-CG 3.39Å; M296-L300 PolarHBondContact O-N 3.4Å; L297-L300 PolarHBondContact O-N 2.89Å; L300-K304 WeakPolarHBondContact O-CB 3.44Å; L300-K304 PolarHBondContact O-N 3.26Å; L300-F423 HydrophobicContact CD2-CE2 4.24Å; L300-F423 HydrophobicContact CD2-CZ 3.83Å; L300-F423 HydrophobicContact CG-CZ 4.37Å
301	E	71.3	Confident	60.9	Low	94 Å²	94	86.1 Å²	86.1	44%	0.439	45%	0.454	S	S	.	.	H	α-helix	trans	-67.5	-42.5	173.1	-68.6	-119.4	114.3	0	0	110.9	L297 E298 V303 K304 W305	L297-E301 WeakPolarHBondContact O-CB 3.45Å; L297-E301 VanDerWaalsContact O-CG 3.28Å; L297-E301 WeakPolarHBondContact O-CG 3.27Å; L297-E301 PolarHBondContact O-N 3.11Å; E298-E301 PolarHBondContact O-N 3.43Å; E301-V303 PolarHBondContact O-N 3.29Å; E301-K304 WeakPolarHBondContact O-CB 3.49Å; E301-K304 PolarHBondContact O-N 3.1Å; E301-K304 IonicContact OE1-NZ 3.86Å; E301-K304 PolarHBondContact OE1-NZ 3Å; E301-W305 PolarHBondContact O-N 2.98Å
302	G	63.2	Low	60.7	Low	37 Å²	37	87.8 Å²	87.8	38%	0.381	46%	0.464	S	S	.	.	H	α-helix	trans	-57.1	-46.6	173.2	0	0	0	0	0	112.9	E298 V299 W305 T306	E298-G302 PolarHBondContact O-N 3.49Å; V299-G302 PolarHBondContact O-N 2.91Å; G302-W305 PolarHBondContact O-N 3.48Å; G302-T306 PolarHBondContact O-N 3.27Å; G302-T306 PolarHBondContact O-OG1 3.06Å
303	V	69.1	Low	60.2	Low	46 Å²	46	91.7 Å²	91.7	28%	0.279	48%	0.481	S	S	.	.	H	α-helix	trans	-65.7	-39.2	175.6	170.3	0	0	0	0	111.9	V299 E301 W305 T306 L307	V299-V303 WeakPolarHBondContact O-CG2 3.37Å; V299-V303 PolarHBondContact O-N 3.3Å; E301-V303 PolarHBondContact O-N 3.29Å; V303-W305 VanDerWaalsContact C-N 3.33Å; V303-W305 PolarHBondContact O-N 3.12Å; V303-T306 PolarHBondContact O-N 3.38Å; V303-T306 PolarHBondContact O-OG1 3.4Å; V303-L307 HydrophobicContact CG1-CD1 3.76Å; V303-L307 HydrophobicContact CG1-CG 4.3Å; V303-L307 WeakPolarHBondContact O-CB 3.35Å; V303-L307 VanDerWaalsContact O-CG 3.25Å; V303-L307 WeakPolarHBondContact O-CG 3.37Å; V303-L307 PolarHBondContact O-N 3.3Å
304	K	65.5	Low	59.2	Low	113 Å²	113	96.7 Å²	96.7	49%	0.491	49%	0.493	S	S	.	.	H	α-helix	trans	-62.2	-39.1	173.5	166.9	-175.6	158.2	-159.7	0	111.7	L300 E301 S308	L300-K304 WeakPolarHBondContact O-CB 3.44Å; L300-K304 PolarHBondContact O-N 3.26Å; E301-K304 WeakPolarHBondContact O-CB 3.49Å; E301-K304 PolarHBondContact O-N 3.1Å; E301-K304 IonicContact OE1-NZ 3.86Å; E301-K304 PolarHBondContact OE1-NZ 3Å; K304-S308 VanDerWaalsContact O-CB 3.26Å; K304-S308 WeakPolarHBondContact O-CB 3.39Å; K304-S308 PolarHBondContact O-N 3.29Å; K304-S308 PolarHBondContact O-OG 2.86Å
305	W	56.3	Low	58.6	Low	161 Å²	161	98.1 Å²	98.1	61%	0.61	49%	0.494	S	S	*	.	H	α-helix	trans	-69.8	-42.3	176.8	-78.2	117	0	0	0	112.7	E301 G302 V303 S308 F309	E301-W305 PolarHBondContact O-N 2.98Å; G302-W305 PolarHBondContact O-N 3.48Å; V303-W305 VanDerWaalsContact C-N 3.33Å; V303-W305 PolarHBondContact O-N 3.12Å; W305-S308 PolarHBondContact O-N 3.33Å; W305-F309 PolarHBondContact O-N 3.19Å
306	T	60.8	Low	57.6	Low	82 Å²	82	98.9 Å²	98.9	50%	0.503	50%	0.496	S	S	.	.	H	α-helix	trans	-65.5	-47.5	175.9	53.8	0	0	0	0	112	G302 V303 S308 F309 D310	G302-T306 PolarHBondContact O-N 3.27Å; G302-T306 PolarHBondContact O-OG1 3.06Å; V303-T306 PolarHBondContact O-N 3.38Å; V303-T306 PolarHBondContact O-OG1 3.4Å; T306-S308 VanDerWaalsContact C-N 3.25Å; T306-S308 PolarHBondContact O-N 3.26Å; T306-F309 WeakPolarHBondContact O-CA 3.42Å; T306-F309 WeakPolarHBondContact O-CB 3.4Å; T306-F309 PolarHBondContact O-N 3.03Å; T306-D310 PolarHBondContact O-N 2.97Å
307	L	57	Low	57	Low	105 Å²	105	99.8 Å²	99.8	55%	0.55	51%	0.508	S	S	.	.	H	α-helix	trans	-61.1	-33.5	176.1	-68.8	172.8	0	0	0	112.7	V303 S311	V303-L307 HydrophobicContact CG1-CD1 3.76Å; V303-L307 HydrophobicContact CG1-CG 4.3Å; V303-L307 WeakPolarHBondContact O-CB 3.35Å; V303-L307 VanDerWaalsContact O-CG 3.25Å; V303-L307 WeakPolarHBondContact O-CG 3.37Å; V303-L307 PolarHBondContact O-N 3.3Å; L307-S311 PolarHBondContact O-N 2.97Å; L307-S311 VanDerWaalsContact O-N 3.09Å
308	S	55.6	Low	55.9	Low	56 Å²	56	100.2 Å²	100.2	39%	0.392	52%	0.515	S	S	.	.	H	α-helix	trans	-68	-41.5	172.9	-61.6	0	0	0	0	111.7	K304 W305 T306 S311 V312	K304-S308 VanDerWaalsContact O-CB 3.26Å; K304-S308 WeakPolarHBondContact O-CB 3.39Å; K304-S308 PolarHBondContact O-N 3.29Å; K304-S308 PolarHBondContact O-OG 2.86Å; W305-S308 PolarHBondContact O-N 3.33Å; T306-S308 VanDerWaalsContact C-N 3.25Å; T306-S308 PolarHBondContact O-N 3.26Å; S308-S311 PolarHBondContact O-N 2.95Å; S308-V312 WeakPolarHBondContact O-CG2 3.24Å; S308-V312 PolarHBondContact O-N 3.32Å; S308-V312 VanDerWaalsContact O-N 3.13Å
309	F	52.3	Low	54.7	Low	142 Å²	142	98.4 Å²	98.4	62%	0.623	51%	0.513	S	S	*	.	H	α-helix	trans	-63.6	-43.9	175.3	-110.8	-91.3	0	0	0	112.4	W305 T306 S311 V312 M313	W305-F309 PolarHBondContact O-N 3.19Å; T306-F309 WeakPolarHBondContact O-CA 3.42Å; T306-F309 WeakPolarHBondContact O-CB 3.4Å; T306-F309 PolarHBondContact O-N 3.03Å; F309-S311 VanDerWaalsContact C-N 3.33Å; F309-S311 PolarHBondContact O-N 3.11Å; F309-V312 PolarHBondContact O-N 3.46Å; F309-V312 VanDerWaalsContact O-N 3.15Å; F309-M313 WeakPolarHBondContact O-CB 3.29Å; F309-M313 WeakPolarHBondContact O-CG 3.41Å; F309-M313 PolarHBondContact O-N 2.9Å
310	D	51.6	Low	53.5	Low	103 Å²	103	99.9 Å²	99.9	55%	0.551	53%	0.525	S	S	*	.	H	α-helix	trans	-61.8	-41	176	-72.5	-31.3	0	0	0	111.4	T306 V312 M313 Y314	T306-D310 PolarHBondContact O-N 2.97Å; D310-V312 VanDerWaalsContact C-N 3.29Å; D310-V312 PolarHBondContact O-N 2.83Å; D310-M313 PolarHBondContact O-N 2.95Å; D310-Y314 WeakPolarHBondContact O-CB 3.33Å; D310-Y314 PolarHBondContact O-N 3.1Å
311	S	48.1	Very low	52.4	Low	54 Å²	54	101 Å²	101	38%	0.378	54%	0.539	S	S	.	.	H	α-helix	trans	-62.7	-32.8	175.1	-164.3	0	0	0	0	113.2	L307 S308 F309 K315	L307-S311 PolarHBondContact O-N 2.97Å; L307-S311 VanDerWaalsContact O-N 3.09Å; S308-S311 PolarHBondContact O-N 2.95Å; F309-S311 VanDerWaalsContact C-N 3.33Å; F309-S311 PolarHBondContact O-N 3.11Å; S311-K315 VanDerWaalsContact O-CD 3.28Å; S311-K315 WeakPolarHBondContact O-CD 3.28Å; S311-K315 VanDerWaalsContact O-CG 3.3Å; S311-K315 WeakPolarHBondContact O-CG 3.44Å; S311-K315 PolarHBondContact OG-NZ 3.19Å; S311-K315 VanDerWaalsContact OG-NZ 3.09Å
312	V	51.2	Low	51.1	Low	91 Å²	91	105.2 Å²	105.2	55%	0.552	56%	0.556	S	S	*	*	H	α-helix	trans	-78.3	-44.3	176.4	172.9	0	0	0	0	111	S308 F309 D310 Y314 K315 H316	S308-V312 WeakPolarHBondContact O-CG2 3.24Å; S308-V312 PolarHBondContact O-N 3.32Å; S308-V312 VanDerWaalsContact O-N 3.13Å; F309-V312 PolarHBondContact O-N 3.46Å; F309-V312 VanDerWaalsContact O-N 3.15Å; D310-V312 VanDerWaalsContact C-N 3.29Å; D310-V312 PolarHBondContact O-N 2.83Å; V312-Y314 PolarHBondContact O-N 2.96Å; V312-K315 PolarHBondContact O-N 3.33Å; V312-H316 PolarHBondContact O-N 3.03Å
313	M	46.7	Very low	49.8	Very low	115 Å²	115	109.7 Å²	109.7	57%	0.567	58%	0.576	S	S	*	*	H	α-helix	trans	-60.8	-43.4	177.4	-79	-97.4	59.2	0	0	112.2	F309 D310 K315 H316 C317	F309-M313 WeakPolarHBondContact O-CB 3.29Å; F309-M313 WeakPolarHBondContact O-CG 3.41Å; F309-M313 PolarHBondContact O-N 2.9Å; D310-M313 PolarHBondContact O-N 2.95Å; M313-K315 VanDerWaalsContact C-N 3.35Å; M313-K315 PolarHBondContact O-N 2.98Å; M313-H316 PolarHBondContact O-N 3.4Å; M313-C317 WeakPolarHBondContact O-CB 3.36Å; M313-C317 PolarHBondContact O-N 3.42Å
314	Y	47	Very low	47.8	Very low	184 Å²	184	116.1 Å²	116.1	72%	0.722	60%	0.603	S	S	*	*	H	α-helix	trans	-63.9	-40.1	178.8	-154.9	-88	0	0	0	111.9	D310 V312 C317 V318	D310-Y314 WeakPolarHBondContact O-CB 3.33Å; D310-Y314 PolarHBondContact O-N 3.1Å; V312-Y314 PolarHBondContact O-N 2.96Å; Y314-C317 PolarHBondContact O-N 3.16Å; Y314-V318 PolarHBondContact O-N 2.86Å
315	K	44.2	Very low	46.7	Very low	136 Å²	136	116 Å²	116	59%	0.591	61%	0.614	S	S	*	*	H	α-helix	trans	-66	-40.7	174.5	-73.2	168.1	-175.1	146.4	0	112.2	S311 V312 M313 C317	S311-K315 VanDerWaalsContact O-CD 3.28Å; S311-K315 WeakPolarHBondContact O-CD 3.28Å; S311-K315 VanDerWaalsContact O-CG 3.3Å; S311-K315 WeakPolarHBondContact O-CG 3.44Å; S311-K315 PolarHBondContact OG-NZ 3.19Å; S311-K315 VanDerWaalsContact OG-NZ 3.09Å; V312-K315 PolarHBondContact O-N 3.33Å; M313-K315 VanDerWaalsContact C-N 3.35Å; M313-K315 PolarHBondContact O-N 2.98Å; K315-C317 VanDerWaalsContact C-N 3.34Å; K315-C317 PolarHBondContact O-N 3.26Å
316	H	42.4	Very low	45.3	Very low	119 Å²	119	113.4 Å²	113.4	55%	0.551	62%	0.621	S	S	*	*	H	α-helix	trans	-71	-29.6	-179.9	-148.1	-57.9	0	0	0	112.9	V312 M313 C320	V312-H316 PolarHBondContact O-N 3.03Å; M313-H316 PolarHBondContact O-N 3.4Å; H316-C320 PolarHBondContact ND1-SG 3.07Å; H316-C320 PolarHBondContact O-N 3.45Å; H316-C320 PolarHBondContact O-SG 3.27Å
317	C	46.5	Very low	43.9	Very low	87 Å²	87	114.7 Å²	114.7	59%	0.588	63%	0.633	S	S	*	*	H	α-helix	trans	-67.7	-41.2	178.2	-164.8	0	0	0	0	112.6	M313 Y314 K315 V319	M313-C317 WeakPolarHBondContact O-CB 3.36Å; M313-C317 PolarHBondContact O-N 3.42Å; Y314-C317 PolarHBondContact O-N 3.16Å; K315-C317 VanDerWaalsContact C-N 3.34Å; K315-C317 PolarHBondContact O-N 3.26Å; C317-V319 VanDerWaalsContact C-N 3.31Å; C317-V319 PolarHBondContact O-N 2.85Å
318	V	43.3	Very low	42.6	Very low	100 Å²	100	117.4 Å²	117.4	61%	0.606	64%	0.643	S	S	*	*	H	α-helix	trans	-69.2	-27.1	-178.5	176.6	0	0	0	0	112.9	Y314	Y314-V318 PolarHBondContact O-N 2.86Å
319	V	46.2	Very low	41.4	Very low	106 Å²	106	123.9 Å²	123.9	64%	0.642	66%	0.659	S	S	*	*	H	α-helix	trans	-82.4	-35.2	-177.9	177.8	0	0	0	0	112.3	C317 S321	C317-V319 VanDerWaalsContact C-N 3.31Å; C317-V319 PolarHBondContact O-N 2.85Å; V319-S321 VanDerWaalsContact C-N 3.27Å; V319-S321 PolarHBondContact O-N 2.93Å
320	C	41.8	Very low	40.3	Very low	90 Å²	90	127 Å²	127	61%	0.608	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-10.6	-175.1	-70.9	0	0	0	0	115.1	H316 K322	H316-C320 PolarHBondContact ND1-SG 3.07Å; H316-C320 PolarHBondContact O-N 3.45Å; H316-C320 PolarHBondContact O-SG 3.27Å; C320-K322 VanDerWaalsContact C-N 3.32Å; C320-K322 PolarHBondContact O-N 3.4Å
321	S	41.2	Very low	39.1	Very low	101 Å²	101	129.3 Å²	129.3	71%	0.706	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	3.4	-178.8	-48.3	0	0	0	0	115.1	V319	V319-S321 VanDerWaalsContact C-N 3.27Å; V319-S321 PolarHBondContact O-N 2.93Å
322	K	42.4	Very low	39	Very low	182 Å²	182	132 Å²	132	79%	0.791	70%	0.695	S	S	*	*	S	Bend	trans	-136.2	30.1	-167.2	-70.5	-166.6	175.3	-175.9	0	117.5	C320	C320-K322 VanDerWaalsContact C-N 3.32Å; C320-K322 PolarHBondContact O-N 3.4Å
323	T	36.3	Very low	37.9	Very low	131 Å²	131	132.2 Å²	132.2	80%	0.804	71%	0.706	S	S	*	*			trans	-162.1	117.2	158.4	7.5	0	0	0	0	116.1
324	Q	28.4	Very low	37.1	Very low	180 Å²	180	137.9 Å²	137.9	84%	0.841	72%	0.721	S	S	*	*			trans	-159.2	156.4	159.5	-77.8	-63	-69	0	0	107
325	P	42.3	Very low	36.2	Very low	110 Å²	110	134.2 Å²	134.2	71%	0.714	72%	0.718	S	S	*	*			cis	-139.9	157.5	-32.4	38.3	-22.1	0	0	0	115.4
326	S	26.8	Very low	35.5	Very low	108 Å²	108	136.8 Å²	136.8	76%	0.755	73%	0.732	S	S	*	*			trans	-165.3	121.5	152.3	44.2	0	0	0	0	107.5
327	S	30.7	Very low	34.7	Very low	109 Å²	109	134.5 Å²	134.5	76%	0.762	74%	0.74	S	S	*	*				57.5	120	76.8	75.7	0	0	0	0	112.6
328	E	30.7	Very low	33.8	Very low	162 Å²	162	135.2 Å²	135.2	76%	0.757	75%	0.746	S	S	*	*			cis	-150.1	149.8	27.6	-71.4	-165.7	93	0	0	117.7
329	R	29.9	Very low	33.1	Very low	192 Å²	192	138 Å²	138	73%	0.725	76%	0.758	S	S	*	*			trans	34.5	123.9	133.6	-60.4	-179.6	170.2	-153.9	-2.1	123.7
330	R	28.5	Very low	32.2	Very low	208 Å²	208	137.2 Å²	137.2	79%	0.785	76%	0.762	S	S	*	*			trans	76.3	107	132.2	-67.3	177.4	-179.7	-163.1	-1	121.5
331	N	26.3	Very low	31.5	Very low	151 Å²	151	138.7 Å²	138.7	81%	0.807	77%	0.774	S	S	*	*				37	152.8	99.9	-70.8	13	0	0	0	121.4
332	P	46.6	Very low	30.8	Very low	111 Å²	111	137 Å²	137	72%	0.721	77%	0.772	S	S	*	*			cis	-144.4	160.5	-21	38	-18.7	0	0	0	117.9
333	A	28.5	Very low	30	Very low	94 Å²	94	140.5 Å²	140.5	78%	0.777	78%	0.781	S	S	*	*			trans	39	132.8	140.3	0	0	0	0	0	123.6
334	R	29.1	Very low	29.6	Very low	234 Å²	234	142.6 Å²	142.6	88%	0.883	79%	0.785	S	S	*	*				-163.7	120.8	122.1	-110.6	171.7	-169.4	-158.1	1.6	116
335	T	27.9	Very low	29.8	Very low	108 Å²	108	138.1 Å²	138.1	66%	0.663	78%	0.779	S	S	*	*			trans	49.4	117.9	136.9	54	0	0	0	0	124.3
336	H	29.9	Very low	29.9	Very low	190 Å²	190	138.1 Å²	138.1	88%	0.88	78%	0.779	S	S	*	*			trans	70.2	131.1	132.6	-73.8	-74.9	0	0	0	123.9
337	G	25	Very low	30	Very low	71 Å²	71	141.2 Å²	141.2	73%	0.732	78%	0.781	S	S	*	*			trans	93.7	139.8	150.4	0	0	0	0	0	116.3
338	S	28	Very low	29.9	Very low	101 Å²	101	146.2 Å²	146.2	71%	0.706	78%	0.784	S	S	*	*			cis	159.3	139.2	-25.9	45.3	0	0	0	0	107.6
339	N	27.8	Very low	29.8	Very low	160 Å²	160	143.2 Å²	143.2	86%	0.856	78%	0.781	S	S	*	*			trans	88.8	157.4	162.4	-55.8	-14.9	0	0	0	120.2
340	A	28.3	Very low	29.8	Very low	89 Å²	89	139.1 Å²	139.1	74%	0.736	78%	0.781	S	S	*	*			trans	64.9	125.1	-177.9	0	0	0	0	0	115.8
341	S	27.6	Very low	29.7	Very low	121 Å²	121	133.8 Å²	133.8	85%	0.846	78%	0.775	S	S	*	*			cis	69.5	122.9	34.2	86.3	0	0	0	0	114.6
342	G	25.5	Very low	29.9	Very low	66 Å²	66	135.1 Å²	135.1	68%	0.68	77%	0.773	S	S	*	*			cis	167	174.8	-4.3	0	0	0	0	0	111.8
343	W	26.3	Very low	28.9	Very low	255 Å²	255	141.4 Å²	141.4	97%	0.966	78%	0.783	S	S	*	*			trans	54.1	103.3	165.1	-66.6	82.5	0	0	0	120.2
344	I	28.6	Very low	29.1	Very low	174 Å²	174	148.2 Å²	148.2	89%	0.892	79%	0.788	S	S	*	*			trans	-140	140.6	138.6	-64.7	-171.8	0	0	0	108.9
345	A	30.8	Very low	29.6	Very low	86 Å²	86	143.4 Å²	143.4	71%	0.711	79%	0.788	S	S	*	*			trans	-129.3	161.2	163.4	0	0	0	0	0	108.4
346	P	44.1	Very low	29.8	Very low	110 Å²	110	145.7 Å²	145.7	71%	0.714	80%	0.795	S	S	*	*				-158.7	149.1	108.8	37.4	-18.3	0	0	0	118.5
347	Q	30.4	Very low	30	Very low	174 Å²	174	146.2 Å²	146.2	81%	0.813	79%	0.789	S	S	*	*			trans	64.6	166.1	138.1	-64.4	-76.2	-22	0	0	118.4
348	R	27.3	Very low	30.2	Very low	214 Å²	214	148.9 Å²	148.9	81%	0.808	79%	0.787	S	S	*	*			cis	-158.5	153.8	16.8	-145.1	178.9	-164.4	-144.8	5.6	112.1
349	S	29.2	Very low	30.4	Very low	99 Å²	99	150.9 Å²	150.9	69%	0.692	79%	0.789	S	S	*	*			trans	24.3	159.6	145.7	62.8	0	0	0	0	124.6
350	S	29.2	Very low	30.6	Very low	105 Å²	105	148.7 Å²	148.7	73%	0.734	78%	0.782	S	S	*	*			cis	176.9	153.5	-26.9	-169.5	0	0	0	0	110.5
351	C	26.6	Very low	30.5	Very low	97 Å²	97	154.2 Å²	154.2	66%	0.655	78%	0.784	S	S	*	*			trans	71.3	121.8	153.6	-80	0	0	0	0	124.9
352	K	30.3	Very low	31.1	Very low	179 Å²	179	154.2 Å²	154.2	78%	0.778	78%	0.781	S	S	*	*				91.7	126	124.1	-72.6	172.3	-175.6	171.7	0	124.6
353	R	26.5	Very low	31.2	Very low	242 Å²	242	157.8 Å²	157.8	91%	0.913	78%	0.78	S	S	*	*			trans	86.7	150.6	140.3	-74.6	-178.4	175.1	-173.5	-1.8	122.2
354	R	31.8	Very low	31.3	Very low	237 Å²	237	155.1 Å²	155.1	89%	0.894	77%	0.77	S	S	*	*			trans	-99.5	170	170.6	-58.6	178.9	174.1	-177	-3.3	110.8
355	P	40.8	Very low	31.2	Very low	134 Å²	134	153.8 Å²	153.8	87%	0.87	77%	0.77	S	S	*	*				-141.2	-139.3	95.4	38.5	-21.4	0	0	0	115.4
356	L	31.3	Very low	31	Very low	155 Å²	155	155.6 Å²	155.6	81%	0.812	77%	0.768	S	S	*	*			trans	-150.7	165.8	-155.8	-172.6	72.7	0	0	0	112.6
357	R	34.7	Very low	30	Very low	202 Å²	202	160.8 Å²	160.8	76%	0.762	77%	0.773	S	S	*	*			trans	85.8	156.2	168.9	-69.5	-166.5	171.8	-82.8	1.6	117.3
358	D	29.8	Very low	29.7	Very low	127 Å²	127	163 Å²	163	68%	0.679	77%	0.774	S	S	*	*			cis	-142.5	-133.7	5.3	-124	6	0	0	0	116
359	D	31	Very low	29.7	Very low	142 Å²	142	156.7 Å²	156.7	76%	0.759	77%	0.768	S	S	*	*			trans	-140.3	175.3	-138.7	-158.4	-5.1	0	0	0	118.1
360	T	31.6	Very low	29.6	Very low	115 Å²	115	159.1 Å²	159.1	71%	0.706	77%	0.773	S	S	*	*			trans	96.8	116.6	150.7	7.6	0	0	0	0	126.8
361	R	27.2	Very low	29.3	Very low	204 Å²	204	159.3 Å²	159.3	77%	0.77	77%	0.77	S	S	*	*			trans	57.3	175.2	141.9	-94.8	-164.1	174.7	-149.6	-0.2	122.5
362	P	39.4	Very low	29.4	Very low	122 Å²	122	162.5 Å²	162.5	79%	0.792	78%	0.775	S	S	*	*			cis	-127	-140.8	3.2	43.2	-24.2	0	0	0	114.5
363	Q	29.2	Very low	29.1	Very low	140 Å²	140	160.8 Å²	160.8	65%	0.654	77%	0.77	S	S	*	*				-152.6	137.6	-85.2	170	175.9	-41	0	0	114
364	R	26.6	Very low	29.6	Very low	199 Å²	199	153.4 Å²	153.4	75%	0.751	75%	0.753	S	S	*	*			trans	27.3	143.3	158.6	-74.2	-175.6	171.5	-115.5	6.4	124.9	D366	R364-D366 IonicContact NH1-OD2 3.91Å
365	T	27	Very low	29.3	Very low	147 Å²	147	150.7 Å²	150.7	90%	0.902	75%	0.751	S	S	*	*				-161.6	167.7	128.4	21.1	0	0	0	0	113
366	D	26	Very low	28.5	Very low	124 Å²	124	148.6 Å²	148.6	66%	0.663	75%	0.745	S	S	*	*			trans	-128.6	152.5	-168.8	-57.1	-94.1	0	0	0	114.4	R364	R364-D366 IonicContact NH1-OD2 3.91Å
367	R	25	Very low	28.1	Very low	219 Å²	219	147 Å²	147	83%	0.826	74%	0.741	S	S	*	*				151.9	133.6	128.2	-85.2	176.3	170.4	-169.8	-2.9	118.5
368	R	23.3	Very low	27.5	Very low	219 Å²	219	146 Å²	146	83%	0.826	75%	0.745	S	S	*	*			trans	53.6	127.9	138.7	-62.7	-176.7	178	-156.3	-4.5	120.3
369	A	26.7	Very low	27.2	Very low	82 Å²	82	145.8 Å²	145.8	68%	0.678	74%	0.744	S	S	*	*				77.4	138.7	60.8	0	0	0	0	0	113.2
370	D	26.5	Very low	26.9	Very low	151 Å²	151	145.7 Å²	145.7	81%	0.807	74%	0.739	S	S	*	*			cis	-139.6	176.3	13.5	-95.9	-59.1	0	0	0	111.7
371	T	24.5	Very low	26.7	Very low	109 Å²	109	147.1 Å²	147.1	67%	0.669	74%	0.737	S	S	*	*				176.8	118.6	93.8	-63.7	0	0	0	0	113.6
372	Q	29.1	Very low	26.5	Very low	163 Å²	163	145 Å²	145	76%	0.762	74%	0.736	S	S	*	*			trans	61.4	155	148.4	-69.3	-178.6	-60.7	0	0	121.6
373	E	23.7	Very low	25.8	Very low	143 Å²	143	145.6 Å²	145.6	67%	0.668	74%	0.738	S	S	*	*			cis	-163.3	177.5	-4.8	-113.9	-137.6	134.9	0	0	108.9
374	P	37.4	Very low	25.6	Very low	88 Å²	88	148.2 Å²	148.2	57%	0.571	75%	0.747	S	S	*	*			cis	-142.9	170.2	-47.3	40.1	-21.9	0	0	0	116.9
375	Q	24.3	Very low	25.4	Very low	180 Å²	180	143.6 Å²	143.6	84%	0.841	75%	0.745	S	S	*	*			trans	63.1	153.4	142.6	-78.8	177.5	36.8	0	0	121.9
376	A	23.5	Very low	25.2	Very low	90 Å²	90	147.5 Å²	147.5	74%	0.744	74%	0.743	S	S	*	*			cis	-149.8	167.8	-6.1	0	0	0	0	0	113.4
377	T	23	Very low	25.2	Very low	120 Å²	120	146.3 Å²	146.3	74%	0.736	75%	0.745	S	S	*	*			trans	-92.2	157.6	-172	50.5	0	0	0	0	115.7
378	H	23.6	Very low	25.3	Very low	183 Å²	183	144.2 Å²	144.2	85%	0.847	75%	0.748	S	S	*	*				-162.2	175.1	120.6	-123.6	-92.8	0	0	0	114.5
379	N	23.5	Very low	25.5	Very low	121 Å²	121	141.9 Å²	141.9	65%	0.647	75%	0.751	S	S	*	*			trans	-115.1	155.1	-157.2	-98.7	20.6	0	0	0	116.5
380	E	24.5	Very low	25.5	Very low	141 Å²	141	143.9 Å²	143.9	66%	0.659	76%	0.76	S	S	*	*			trans	85.6	144.4	132.5	-81.5	172.6	115.6	0	0	126.7
381	H	26	Very low	25.7	Very low	145 Å²	145	143 Å²	143	67%	0.671	76%	0.761	S	S	*	*			trans	85.8	120.9	144.2	-73.5	8.8	0	0	0	123.5
382	Q	24.6	Very low	25.8	Very low	158 Å²	158	145.4 Å²	145.4	74%	0.738	77%	0.769	S	S	*	*				29.4	137.6	129.7	-46.8	-172.2	26.6	0	0	120.2
383	T	24.3	Very low	25.9	Very low	135 Å²	135	142.9 Å²	142.9	83%	0.828	77%	0.769	S	S	*	*				-171.5	178.6	76.7	29.3	0	0	0	0	114.3
384	K	23.5	Very low	26.2	Very low	196 Å²	196	139.6 Å²	139.6	85%	0.852	77%	0.774	S	S	*	*			trans	-75.1	161.5	179.6	-55.1	162.5	-176.9	168.2	0	111.1
385	S	23.3	Very low	26	Very low	102 Å²	102	144.3 Å²	144.3	71%	0.713	79%	0.786	S	S	*	*				165.9	166.2	68.6	56.7	0	0	0	0	113.6
386	R	22.8	Very low	26.3	Very low	229 Å²	229	143.2 Å²	143.2	86%	0.864	78%	0.781	S	S	*	*			trans	55.1	120.8	156.1	-69.7	177	134.1	150.6	-4.8	119.2
387	S	25	Very low	26.5	Very low	99 Å²	99	145.4 Å²	145.4	69%	0.692	78%	0.78	S	S	*	*			cis	89.2	106.1	40.4	78.7	0	0	0	0	116
388	I	27.1	Very low	26.8	Very low	175 Å²	175	149.2 Å²	149.2	90%	0.897	78%	0.782	S	S	*	*			trans	-137.8	144.3	152.5	-67	-173.3	0	0	0	108
389	L	27.6	Very low	27	Very low	169 Å²	169	144.1 Å²	144.1	89%	0.885	78%	0.779	S	S	*	*			trans	-94.6	152	175.4	-68.8	160.5	0	0	0	110.6
390	S	26.8	Very low	27.3	Very low	125 Å²	125	144.2 Å²	144.2	87%	0.874	78%	0.784	S	S	*	*			trans	-152.6	148.2	149.7	-158	0	0	0	0	112.2
391	T	32.3	Very low	27.5	Very low	133 Å²	133	141 Å²	141	82%	0.816	79%	0.789	S	S	*	*			trans	-122	134.4	-177.6	49.6	0	0	0	0	110.2
392	D	25.6	Very low	27.5	Very low	159 Å²	159	139.4 Å²	139.4	85%	0.85	79%	0.79	S	S	*	*			trans	-153.4	167.8	137.9	-153.2	-3.7	0	0	0	111.1
393	S	31.8	Very low	27.7	Very low	109 Å²	109	140.2 Å²	140.2	76%	0.762	80%	0.795	S	S	*	*			trans	-106	138	-179.7	61.3	0	0	0	0	111.4
394	G	30.1	Very low	27.9	Very low	74 Å²	74	139.4 Å²	139.4	76%	0.763	79%	0.791	S	S	*	*			trans	-155.3	113.7	178	0	0	0	0	0	111.8
395	F	32.2	Very low	28.3	Very low	188 Å²	188	136 Å²	136	83%	0.825	79%	0.789	S	S	*	*			trans	-88.3	106.2	171.9	171	-91.2	0	0	0	108.6	D397	F395-D397 HydrophobicContact CE1-CB 4.04Å; F395-D397 HydrophobicContact CZ-CB 4.4Å
396	E	32.2	Very low	28.6	Very low	157 Å²	157	137.3 Å²	137.3	73%	0.734	79%	0.787	S	S	*	*			trans	-101.6	131.7	171.1	-61.1	-146.6	133.4	0	0	110.9
397	D	27	Very low	29.7	Very low	136 Å²	136	134.1 Å²	134.1	73%	0.727	79%	0.787	S	S	*	*			trans	-112.9	104.5	175.9	-164.6	11.9	0	0	0	105.8	F395 G399	F395-D397 HydrophobicContact CE1-CB 4.04Å; F395-D397 HydrophobicContact CZ-CB 4.4Å; D397-G399 PolarHBondContact O-N 3.49Å
398	Y	29.2	Very low	30.5	Very low	199 Å²	199	137.3 Å²	137.3	78%	0.78	79%	0.794	S	S	*	*			trans	-67.1	89.4	-169.6	-93	-80	0	0	0	111.8	V400	Y398-V400 PolarHBondContact O-N 3Å
399	G	27.8	Very low	31.3	Very low	76 Å²	76	131 Å²	131	78%	0.784	77%	0.772	S	S	*	*			trans	-70.5	91.3	172.8	0	0	0	0	0	111.5	D397 G401	D397-G399 PolarHBondContact O-N 3.49Å; G399-G401 VanDerWaalsContact C-N 3.35Å; G399-G401 PolarHBondContact O-N 2.97Å
400	V	29.3	Very low	32.4	Very low	123 Å²	123	130.8 Å²	130.8	75%	0.745	77%	0.772	S	S	*	*			trans	-67.5	92.8	171.6	178.7	0	0	0	0	109.5	Y398 T402	Y398-V400 PolarHBondContact O-N 3Å; V400-T402 WeakPolarHBondContact CG1-OG1 3.45Å
401	G	28.4	Very low	33.9	Very low	74 Å²	74	127.6 Å²	127.6	76%	0.763	75%	0.749	S	S	*	*			trans	-74.6	117.7	160.4	0	0	0	0	0	109.1	G399	G399-G401 VanDerWaalsContact C-N 3.35Å; G399-G401 PolarHBondContact O-N 2.97Å
402	T	27.7	Very low	34.5	Very low	112 Å²	112	123.2 Å²	123.2	69%	0.687	73%	0.727	S	S	*	*			trans	-127.5	120	168.9	-61.9	0	0	0	0	108.2	V400	V400-T402 WeakPolarHBondContact CG1-OG1 3.45Å
403	M	28.6	Very low	35.5	Very low	174 Å²	174	121.6 Å²	121.6	86%	0.857	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-66.5	132.6	173.6	-69.9	-69.8	141.2	0	0	109.2	P405	M403-P405 WeakPolarHBondContact O-CD 3.39Å
404	T	28.6	Very low	37	Very low	119 Å²	119	122.6 Å²	122.6	73%	0.73	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-80.2	123.4	173.3	44.3	0	0	0	0	110.8
405	P	30.8	Very low	38.3	Very low	125 Å²	125	123.9 Å²	123.9	81%	0.812	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-83.4	122.2	155.6	-2	22.3	0	0	0	108.3	M403	M403-P405 WeakPolarHBondContact O-CD 3.39Å
406	D	29.7	Very low	39.2	Very low	128 Å²	128	115.6 Å²	115.6	68%	0.684	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-73.7	127.7	-176.3	-87.6	-55.7	0	0	0	113.8	I408	D406-I408 PolarHBondContact O-N 3.36Å; D406-I408 VanDerWaalsContact O-N 3.08Å
407	L	46.2	Very low	40.2	Very low	163 Å²	163	112.5 Å²	112.5	85%	0.853	64%	0.642	S	S	*	*			trans	33.7	63.2	131	-69.6	166.3	0	0	0	118.7
408	I	40.8	Very low	42	Very low	166 Å²	166	109 Å²	109	85%	0.851	62%	0.621	S	S	*	*			trans	-132.6	124	151.7	-55.1	-178.7	0	0	0	109.9	D406	D406-I408 PolarHBondContact O-N 3.36Å; D406-I408 VanDerWaalsContact O-N 3.08Å
409	G	44.6	Very low	43.5	Very low	41 Å²	41	104.1 Å²	104.1	42%	0.423	61%	0.608	S	S	.	*			trans	96.8	12.2	153.3	0	0	0	0	0	119.6	S411 W414	G409-S411 PolarHBondContact O-N 3.28Å; G409-W414 WeakPolarHBondContact O-CB 3.5Å
410	N	50.2	Low	45	Very low	166 Å²	166	102.4 Å²	102.4	89%	0.888	58%	0.582	S	S	*	*			trans	-71.9	54.1	174	-77	-6.7	0	0	0	113.6
411	S	58.8	Low	46.8	Very low	57 Å²	57	100.6 Å²	100.6	40%	0.399	57%	0.568	S	S	.	*			trans	-83.2	142.3	167.4	-177.8	0	0	0	0	110.1	G409 E413 W414 L415	G409-S411 PolarHBondContact O-N 3.28Å; S411-E413 PolarHBondContact O-N 3.21Å; S411-E413 VanDerWaalsContact OG-CB 3.23Å; S411-E413 WeakPolarHBondContact OG-CB 3.4Å; S411-E413 PolarHBondContact OG-N 3.12Å; S411-E413 VanDerWaalsContact OG-N 3.16Å; S411-W414 PolarHBondContact O-N 3.43Å; S411-L415 PolarHBondContact O-N 3.3Å
412	A	44.1	Very low	48.3	Very low	42 Å²	42	99.9 Å²	99.9	35%	0.347	55%	0.545	S	S	.	.	H	α-helix	trans	-55.1	-30.7	167.2	0	0	0	0	0	111.8	A416	A412-A416 VanDerWaalsContact O-CB 3.27Å; A412-A416 WeakPolarHBondContact O-CB 3.27Å; A412-A416 PolarHBondContact O-N 3Å
413	E	47.1	Very low	49.9	Very low	125 Å²	125	96.5 Å²	96.5	58%	0.584	52%	0.521	S	S	*	.	H	α-helix	trans	-62.4	-44.7	173.6	-166.1	-162.9	159.5	0	0	112.3	S411 A416 Q417	S411-E413 PolarHBondContact O-N 3.21Å; S411-E413 VanDerWaalsContact OG-CB 3.23Å; S411-E413 WeakPolarHBondContact OG-CB 3.4Å; S411-E413 PolarHBondContact OG-N 3.12Å; S411-E413 VanDerWaalsContact OG-N 3.16Å; E413-A416 PolarHBondContact O-N 2.65Å; E413-Q417 WeakPolarHBondContact O-CB 3.42Å; E413-Q417 VanDerWaalsContact O-CG 3.23Å; E413-Q417 WeakPolarHBondContact O-CG 3.37Å; E413-Q417 PolarHBondContact O-N 2.87Å; E413-Q417 PolarHBondContact OE1-NE2 2.79Å
414	W	64.8	Low	51.2	Low	129 Å²	129	93.8 Å²	93.8	49%	0.489	50%	0.504	S	S	.	.	H	α-helix	trans	-66.3	-44.1	178.6	-176.3	91	0	0	0	110.9	G409 S411 A416 Q417 Q418	G409-W414 WeakPolarHBondContact O-CB 3.5Å; S411-W414 PolarHBondContact O-N 3.43Å; W414-A416 VanDerWaalsContact C-N 3.32Å; W414-A416 PolarHBondContact O-N 2.66Å; W414-Q417 PolarHBondContact O-N 3.28Å; W414-Q418 HydrophobicContact CD2-CG 3.92Å; W414-Q418 HydrophobicContact CE3-CG 3.91Å; W414-Q418 HydrophobicContact CH2-CG 3.69Å; W414-Q418 HydrophobicContact CZ2-CG 3.68Å; W414-Q418 HydrophobicContact CZ3-CG 3.8Å; W414-Q418 WeakPolarHBondContact O-CG 3.39Å; W414-Q418 PolarHBondContact O-N 3.34Å
415	L	57.2	Low	52.8	Low	101 Å²	101	95.8 Å²	95.8	53%	0.529	50%	0.498	S	S	.	.	H	α-helix	trans	-60.4	-42.9	175.6	-173.7	68.6	0	0	0	111.2	S411 Q418 L419	S411-L415 PolarHBondContact O-N 3.3Å; L415-Q418 PolarHBondContact O-N 3.21Å; L415-L419 HydrophobicContact CG-CD1 4.16Å; L415-L419 WeakPolarHBondContact O-CB 3.47Å; L415-L419 VanDerWaalsContact O-CG 3.29Å; L415-L419 WeakPolarHBondContact O-CG 3.24Å; L415-L419 PolarHBondContact O-N 2.63Å
416	A	49.9	Very low	54.1	Low	14 Å²	14	97 Å²	97	12%	0.116	49%	0.491	C	S	.	.	H	α-helix	trans	-64.1	-43.5	175.4	0	0	0	0	0	112.9	V292 A412 E413 W414 Q418 L419 V420	V292-A416 HydrophobicContact CB-CB 4.33Å; V292-A416 HydrophobicContact CG1-CB 3.92Å; V292-A416 HydrophobicContact CG2-CB 3.44Å; V292-A416 VanDerWaalsContact CG2-CB 3.44Å; A412-A416 VanDerWaalsContact O-CB 3.27Å; A412-A416 WeakPolarHBondContact O-CB 3.27Å; A412-A416 PolarHBondContact O-N 3Å; E413-A416 PolarHBondContact O-N 2.65Å; W414-A416 VanDerWaalsContact C-N 3.32Å; W414-A416 PolarHBondContact O-N 2.66Å; A416-Q418 VanDerWaalsContact C-N 3.35Å; A416-Q418 PolarHBondContact O-N 3.28Å; A416-L419 PolarHBondContact O-N 3.3Å; A416-V420 WeakPolarHBondContact O-CB 3.32Å; A416-V420 WeakPolarHBondContact O-CG2 3.49Å; A416-V420 PolarHBondContact O-N 3.11Å
417	Q	53.1	Low	55	Low	93 Å²	93	98.9 Å²	98.9	44%	0.435	49%	0.488	S	S	.	.	H	α-helix	trans	-58.9	-45.3	174	-73.5	169.9	12.2	0	0	110.9	E413 W414 V420 L421	E413-Q417 WeakPolarHBondContact O-CB 3.42Å; E413-Q417 VanDerWaalsContact O-CG 3.23Å; E413-Q417 WeakPolarHBondContact O-CG 3.37Å; E413-Q417 PolarHBondContact O-N 2.87Å; E413-Q417 PolarHBondContact OE1-NE2 2.79Å; W414-Q417 PolarHBondContact O-N 3.28Å; Q417-V420 PolarHBondContact O-N 3.41Å; Q417-L421 WeakPolarHBondContact O-CB 3.49Å; Q417-L421 WeakPolarHBondContact O-CD1 3.25Å; Q417-L421 WeakPolarHBondContact O-CG 3.26Å; Q417-L421 PolarHBondContact O-N 3.26Å
418	Q	64.9	Low	55	Low	62 Å²	62	96.4 Å²	96.4	29%	0.29	48%	0.476	S	S	.	.	H	α-helix	trans	-63.8	-42.8	175.6	-65.8	-48	-43.9	0	0	112.5	W414 L415 A416 L421 E422	W414-Q418 HydrophobicContact CD2-CG 3.92Å; W414-Q418 HydrophobicContact CE3-CG 3.91Å; W414-Q418 HydrophobicContact CH2-CG 3.69Å; W414-Q418 HydrophobicContact CZ2-CG 3.68Å; W414-Q418 HydrophobicContact CZ3-CG 3.8Å; W414-Q418 WeakPolarHBondContact O-CG 3.39Å; W414-Q418 PolarHBondContact O-N 3.34Å; L415-Q418 PolarHBondContact O-N 3.21Å; A416-Q418 VanDerWaalsContact C-N 3.35Å; A416-Q418 PolarHBondContact O-N 3.28Å; Q418-L421 PolarHBondContact O-N 2.95Å; Q418-E422 WeakPolarHBondContact O-CB 3.47Å; Q418-E422 PolarHBondContact O-N 3.17Å
419	L	60.3	Low	55	Low	96 Å²	96	94.7 Å²	94.7	50%	0.503	48%	0.475	S	S	.	.	H	α-helix	trans	-63.3	-41.9	177.5	-73.7	168.2	0	0	0	112.2	L415 A416 F423	L415-L419 HydrophobicContact CG-CD1 4.16Å; L415-L419 WeakPolarHBondContact O-CB 3.47Å; L415-L419 VanDerWaalsContact O-CG 3.29Å; L415-L419 WeakPolarHBondContact O-CG 3.24Å; L415-L419 PolarHBondContact O-N 2.63Å; A416-L419 PolarHBondContact O-N 3.3Å; L419-F423 VanDerWaalsContact O-CB 3.25Å; L419-F423 WeakPolarHBondContact O-CB 3.46Å; L419-F423 PolarHBondContact O-N 3.28Å
420	V	59.9	Low	54.8	Low	40 Å²	40	98.3 Å²	98.3	24%	0.242	49%	0.494	C	S	.	.	H	α-helix	trans	-68.3	-36.2	175.6	171.2	0	0	0	0	111.6	A416 Q417 K424	A416-V420 WeakPolarHBondContact O-CB 3.32Å; A416-V420 WeakPolarHBondContact O-CG2 3.49Å; A416-V420 PolarHBondContact O-N 3.11Å; Q417-V420 PolarHBondContact O-N 3.41Å; V420-K424 HydrophobicContact CG1-CD 4.25Å; V420-K424 WeakPolarHBondContact O-CB 3.43Å; V420-K424 VanDerWaalsContact O-CG 3.3Å; V420-K424 WeakPolarHBondContact O-CG 3Å; V420-K424 PolarHBondContact O-N 3.17Å
421	L	67.2	Low	54.3	Low	85 Å²	85	97.5 Å²	97.5	45%	0.445	49%	0.485	S	S	.	.	H	α-helix	trans	-68.4	-45.5	174.8	-75.4	167.3	0	0	0	112	Q417 Q418 K424 R425	Q417-L421 WeakPolarHBondContact O-CB 3.49Å; Q417-L421 WeakPolarHBondContact O-CD1 3.25Å; Q417-L421 WeakPolarHBondContact O-CG 3.26Å; Q417-L421 PolarHBondContact O-N 3.26Å; Q418-L421 PolarHBondContact O-N 2.95Å; L421-K424 PolarHBondContact O-N 2.89Å; L421-R425 WeakPolarHBondContact O-CB 3.4Å; L421-R425 PolarHBondContact O-N 3.08Å
422	E	59.9	Low	53.1	Low	60 Å²	60	101.1 Å²	101.1	28%	0.28	50%	0.504	S	S	.	.	H	α-helix	trans	-62.5	-41.8	174.2	-90.8	-75	105.6	0	0	112.1	Q418 R425 K426	Q418-E422 WeakPolarHBondContact O-CB 3.47Å; Q418-E422 PolarHBondContact O-N 3.17Å; E422-R425 PolarHBondContact O-N 3.01Å; E422-R425 WeakPolarHBondContact OE1-CD 3.35Å; E422-R425 IonicContact OE1-CZ 3.87Å; E422-R425 IonicContact OE1-NE 2.68Å; E422-R425 IonicContact OE1-NH1 3.1Å; E422-R425 PolarHBondContact OE1-NH1 2.98Å; E422-K426 WeakPolarHBondContact O-CB 3.4Å; E422-K426 PolarHBondContact O-N 3.42Å; E422-K426 WeakPolarHBondContact OE2-CE 3.31Å; E422-K426 IonicContact OE2-NZ 2.76Å; E422-K426 PolarHBondContact OE2-NZ 3.28Å
423	F	61	Low	52.8	Low	41 Å²	41	106.3 Å²	106.3	18%	0.18	52%	0.521	C	S	.	.	H	α-helix	trans	-60.2	-50.5	174.6	-175.8	-91.9	0	0	0	110.9	V299 L300 L419 R425 K426 W427	V299-F423 HydrophobicContact CG1-CD1 4.5Å; V299-F423 HydrophobicContact CG1-CE1 3.78Å; L300-F423 HydrophobicContact CD2-CE2 4.24Å; L300-F423 HydrophobicContact CD2-CZ 3.83Å; L300-F423 HydrophobicContact CG-CZ 4.37Å; L419-F423 VanDerWaalsContact O-CB 3.25Å; L419-F423 WeakPolarHBondContact O-CB 3.46Å; L419-F423 PolarHBondContact O-N 3.28Å; F423-R425 VanDerWaalsContact C-N 3.3Å; F423-R425 PolarHBondContact O-N 2.89Å; F423-K426 PolarHBondContact O-N 2.98Å; F423-W427 AromaticContact CD2-CD1 3.87Å; F423-W427 HydrophobicContact CD2-CG 4.39Å; F423-W427 HydrophobicContact CE1-CB 4.23Å; F423-W427 HydrophobicContact CE2-CB 4.49Å; F423-W427 AromaticContact CE2-CD1 3.76Å; F423-W427 HydrophobicContact CE2-CD2 4.38Å; F423-W427 AromaticContact CE2-CG 3.97Å; F423-W427 HydrophobicContact CE2-CG 3.97Å; F423-W427 HydrophobicContact CZ-CB 4.18Å; F423-W427 HydrophobicContact CZ-CD2 4.46Å; F423-W427 HydrophobicContact CZ-CG 4.05Å; F423-W427 WeakPolarHBondContact O-CB 3.43Å; F423-W427 PolarHBondContact O-N 3.35Å
424	K	56.2	Low	52.2	Low	116 Å²	116	111.8 Å²	111.8	50%	0.504	54%	0.536	S	S	.	.	H	α-helix	trans	-59	-39.3	175.6	-75.5	174.6	179	179.5	0	112.6	V420 L421 K426 L428	V420-K424 HydrophobicContact CG1-CD 4.25Å; V420-K424 WeakPolarHBondContact O-CB 3.43Å; V420-K424 VanDerWaalsContact O-CG 3.3Å; V420-K424 WeakPolarHBondContact O-CG 3Å; V420-K424 PolarHBondContact O-N 3.17Å; L421-K424 PolarHBondContact O-N 2.89Å; K424-K426 VanDerWaalsContact C-N 3.34Å; K424-L428 HydrophobicContact CB-CD1 4.33Å; K424-L428 HydrophobicContact CG-CD1 4.31Å; K424-L428 PolarHBondContact O-N 3.31Å
425	R	62.5	Low	50.7	Low	162 Å²	162	117.2 Å²	117.2	61%	0.611	56%	0.556	S	S	*	*	H	α-helix	trans	-68.7	-28.1	179	-170.7	-174.4	-64.2	153.1	-5.3	113.2	L421 E422 F423	L421-R425 WeakPolarHBondContact O-CB 3.4Å; L421-R425 PolarHBondContact O-N 3.08Å; E422-R425 PolarHBondContact O-N 3.01Å; E422-R425 WeakPolarHBondContact OE1-CD 3.35Å; E422-R425 IonicContact OE1-CZ 3.87Å; E422-R425 IonicContact OE1-NE 2.68Å; E422-R425 IonicContact OE1-NH1 3.1Å; E422-R425 PolarHBondContact OE1-NH1 2.98Å; F423-R425 VanDerWaalsContact C-N 3.3Å; F423-R425 PolarHBondContact O-N 2.89Å
426	K	57.1	Low	49.5	Very low	150 Å²	150	115.4 Å²	115.4	65%	0.652	56%	0.563	S	S	*	*	H	α-helix	trans	-100.1	-23.2	-177.8	-75.5	170.7	168.8	165.2	0	114.7	E422 F423 K424	E422-K426 WeakPolarHBondContact O-CB 3.4Å; E422-K426 PolarHBondContact O-N 3.42Å; E422-K426 WeakPolarHBondContact OE2-CE 3.31Å; E422-K426 IonicContact OE2-NZ 2.76Å; E422-K426 PolarHBondContact OE2-NZ 3.28Å; F423-K426 PolarHBondContact O-N 2.98Å; K424-K426 VanDerWaalsContact C-N 3.34Å
427	W	49.3	Very low	48.7	Very low	167 Å²	167	126.5 Å²	126.5	63%	0.633	60%	0.601	S	S	*	*	H	α-helix	trans	-114	-6.3	-173.6	-78	82.1	0	0	0	115.9	F423	F423-W427 AromaticContact CD2-CD1 3.87Å; F423-W427 HydrophobicContact CD2-CG 4.39Å; F423-W427 HydrophobicContact CE1-CB 4.23Å; F423-W427 HydrophobicContact CE2-CB 4.49Å; F423-W427 AromaticContact CE2-CD1 3.76Å; F423-W427 HydrophobicContact CE2-CD2 4.38Å; F423-W427 AromaticContact CE2-CG 3.97Å; F423-W427 HydrophobicContact CE2-CG 3.97Å; F423-W427 HydrophobicContact CZ-CB 4.18Å; F423-W427 HydrophobicContact CZ-CD2 4.46Å; F423-W427 HydrophobicContact CZ-CG 4.05Å; F423-W427 WeakPolarHBondContact O-CB 3.43Å; F423-W427 PolarHBondContact O-N 3.35Å
428	L	46.2	Very low	47.8	Very low	112 Å²	112	130.6 Å²	130.6	59%	0.586	62%	0.62	S	S	*	*	S	Bend	trans	-103.8	120.3	168.1	-78.1	83.7	0	0	0	110.7	K424	K424-L428 HydrophobicContact CB-CD1 4.33Å; K424-L428 HydrophobicContact CG-CD1 4.31Å; K424-L428 PolarHBondContact O-N 3.31Å
429	P	40.4	Very low	46.5	Very low	129 Å²	129	131.8 Å²	131.8	84%	0.838	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-59.4	138.1	169.6	-24.6	35	0	0	0	112.2	H431	P429-H431 PolarHBondContact O-N 3.01Å
430	S	41.5	Very low	45.2	Very low	118 Å²	118	135 Å²	135	83%	0.825	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-71.7	119	-177.7	54.6	0	0	0	0	112.7
431	H	38.3	Very low	44.1	Very low	149 Å²	149	143.5 Å²	143.5	69%	0.69	68%	0.68	S	S	*	*			trans	40.2	98	159.6	-98.3	-106.2	0	0	0	118.2	P429 H433	P429-H431 PolarHBondContact O-N 3.01Å; H431-H433 AromaticContact CE1-CE1 3.46Å; H431-H433 PolarHBondContact CE1-CE1 2.95Å; H431-H433 VanDerWaalsContact CE1-CE1 3.46Å; H431-H433 AromaticContact CE1-NE2 3.32Å; H431-H433 PolarHBondContact CE1-NE2 3.02Å; H431-H433 VanDerWaalsContact CE1-NE2 3.32Å; H431-H433 AromaticContact ND1-CD2 3.69Å; H431-H433 AromaticContact ND1-CE1 3.71Å; H431-H433 AromaticContact ND1-NE2 3.33Å; H431-H433 PolarHBondContact ND1-NE2 3.44Å
432	V	33.6	Very low	42.5	Very low	133 Å²	133	143.7 Å²	143.7	81%	0.806	69%	0.688	S	S	*	*			trans	-119.7	110.2	144	178.3	0	0	0	0	108.7	R434	V432-R434 PolarHBondContact O-N 3.12Å
433	H	37.9	Very low	41.4	Very low	150 Å²	150	145.4 Å²	145.4	69%	0.694	71%	0.707	S	S	*	*			trans	-72.8	105.5	172.5	-78.9	-60.7	0	0	0	110.8	H431	H431-H433 AromaticContact CE1-CE1 3.46Å; H431-H433 PolarHBondContact CE1-CE1 2.95Å; H431-H433 VanDerWaalsContact CE1-CE1 3.46Å; H431-H433 AromaticContact CE1-NE2 3.32Å; H431-H433 PolarHBondContact CE1-NE2 3.02Å; H431-H433 VanDerWaalsContact CE1-NE2 3.32Å; H431-H433 AromaticContact ND1-CD2 3.69Å; H431-H433 AromaticContact ND1-CE1 3.71Å; H431-H433 AromaticContact ND1-NE2 3.33Å; H431-H433 PolarHBondContact ND1-NE2 3.44Å
434	R	34.9	Very low	40.3	Very low	240 Å²	240	150.9 Å²	150.9	91%	0.906	74%	0.737	S	S	*	*			trans	-99.3	99.2	152.1	-76.2	-165.9	175.3	-165	0.4	109.7	V432	V432-R434 PolarHBondContact O-N 3.12Å
435	R	33.8	Very low	39.6	Very low	243 Å²	243	153.2 Å²	153.2	92%	0.917	75%	0.75	S	S	*	*			trans	-82.5	108.2	177	-179.6	-173.8	-67.7	-157.9	-0.2	108.8
436	G	31.7	Very low	38.2	Very low	64 Å²	64	153.6 Å²	153.6	66%	0.66	76%	0.759	S	S	*	*			trans	-147	-17.1	-166.9	0	0	0	0	0	120.8
437	R	33.5	Very low	36.7	Very low	247 Å²	247	154.7 Å²	154.7	93%	0.932	77%	0.771	S	S	*	*			trans	64.7	158.8	-171.4	-54	179.1	170.1	-179.1	-3.7	112.5
438	Q	34.3	Very low	35.9	Very low	178 Å²	178	152.8 Å²	152.8	83%	0.832	78%	0.78	S	S	*	*			cis	-120.6	177	11.7	-63.4	172.8	0.9	0	0	112.4
439	S	36.2	Very low	35	Very low	88 Å²	88	151.2 Å²	151.2	62%	0.615	79%	0.791	S	S	*	*			trans	-91.2	144.9	-172.2	-178.3	0	0	0	0	112.9	R441 S442	S439-R441 PolarHBondContact O-N 3.19Å; S439-S442 PolarHBondContact O-N 3.11Å
440	L	34.2	Very low	34.8	Very low	162 Å²	162	152.6 Å²	152.6	85%	0.848	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	17.2	171.4	-73.3	169.7	0	0	0	114.6
441	R	37.4	Very low	34.1	Very low	220 Å²	220	150.2 Å²	150.2	83%	0.83	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-10.5	170	-159.9	169.4	-175.3	164.8	2	113	S439	S439-R441 PolarHBondContact O-N 3.19Å
442	S	33.7	Very low	34	Very low	88 Å²	88	147.2 Å²	147.2	62%	0.615	80%	0.801	S	S	*	*	S	Bend	trans	-97.3	8.5	-176.3	-61.3	0	0	0	0	114.9	S439	S439-S442 PolarHBondContact O-N 3.11Å
443	S	36.9	Very low	33.9	Very low	96 Å²	96	146.9 Å²	146.9	67%	0.671	80%	0.799	S	S	*	*	S	Bend	trans	-97.6	15	175.3	-55.5	0	0	0	0	113.4
444	L	36	Very low	33.5	Very low	156 Å²	156	147.4 Å²	147.4	82%	0.817	80%	0.801	S	S	*	*	S	Bend	trans	-117.7	30.5	-179.9	-76.2	175.1	0	0	0	113.3
445	Q	41.5	Very low	33.5	Very low	165 Å²	165	142.3 Å²	142.3	77%	0.771	80%	0.797	S	S	*	*			trans	-171	134.7	159.6	-104.6	165.1	-49.5	0	0	105.9
446	E	33.4	Very low	33.5	Very low	171 Å²	171	138.7 Å²	138.7	80%	0.799	79%	0.788	S	S	*	*			cis	-141.2	152.5	9.8	-53.2	-177.8	138.1	0	0	111.2
447	L	25.9	Very low	33.9	Very low	172 Å²	172	142.5 Å²	142.5	90%	0.901	80%	0.798	S	S	*	*				-161.1	149.1	127.6	-96	-176.3	0	0	0	108.3
448	P	32.4	Very low	34.3	Very low	127 Å²	127	133.3 Å²	133.3	83%	0.825	78%	0.781	S	S	*	*			trans	-101.1	147.4	-162.9	35.1	-30	0	0	0	115
449	G	27.7	Very low	34.8	Very low	80 Å²	80	127.8 Å²	127.8	83%	0.825	76%	0.762	S	S	*	*			trans	172.8	91.3	173.7	0	0	0	0	0	111.6
450	T	35.4	Very low	35.2	Very low	157 Å²	157	129.4 Å²	129.4	96%	0.963	76%	0.763	S	S	*	*			trans	-79	128.6	-171.3	32.7	0	0	0	0	113.6
451	G	27.6	Very low	35.7	Very low	69 Å²	69	125.5 Å²	125.5	71%	0.711	75%	0.746	S	S	*	*			trans	-164.2	79.3	172.5	0	0	0	0	0	109.5	V453	G451-V453 PolarHBondContact O-N 2.98Å
452	G	35.5	Very low	36.4	Very low	85 Å²	85	119 Å²	119	88%	0.876	73%	0.725	S	S	*	*			trans	-67	124.8	-162	0	0	0	0	0	114.8
453	V	31.5	Very low	37.1	Very low	126 Å²	126	118.7 Å²	118.7	76%	0.764	71%	0.714	S	S	*	*			trans	-123.3	118.8	159	178.9	0	0	0	0	107.2	G451 V455	G451-V453 PolarHBondContact O-N 2.98Å; V453-V455 PolarHBondContact O-N 3.29Å
454	E	30.8	Very low	37.7	Very low	161 Å²	161	118.1 Å²	118.1	75%	0.752	70%	0.702	S	S	*	*			trans	-64.1	105.8	171.7	-68.5	-173.1	126.2	0	0	109.7	K456	E454-K456 HydrophobicContact CB-CG 4.46Å; E454-K456 PolarHBondContact O-N 2.99Å
455	V	34.5	Very low	38.5	Very low	134 Å²	134	115.9 Å²	115.9	81%	0.812	68%	0.683	S	S	*	*			trans	-72	84.7	163.4	-177.1	0	0	0	0	107.3	V453 T457	V453-V455 PolarHBondContact O-N 3.29Å; V455-T457 PolarHBondContact O-N 3.22Å
456	K	33.4	Very low	39	Very low	167 Å²	167	113.4 Å²	113.4	73%	0.726	67%	0.674	S	S	*	*			trans	-56.1	131	174.1	-74.1	-177.9	176	175.6	0	109.1	E454 G458	E454-K456 HydrophobicContact CB-CG 4.46Å; E454-K456 PolarHBondContact O-N 2.99Å; K456-G458 PolarHBondContact O-N 3.44Å
457	T	39.4	Very low	39.7	Very low	143 Å²	143	113.4 Å²	113.4	88%	0.877	67%	0.667	S	S	*	*			trans	-70.9	64.2	-178	-36.5	0	0	0	0	112.1	V455 S459	V455-T457 PolarHBondContact O-N 3.22Å; T457-S459 PolarHBondContact O-N 3.24Å
458	G	42.3	Very low	40.6	Very low	55 Å²	55	106.8 Å²	106.8	57%	0.567	63%	0.634	S	S	*	*			trans	-56.7	128.3	155.1	0	0	0	0	0	107.4	K456 L460	K456-G458 PolarHBondContact O-N 3.44Å; G458-L460 PolarHBondContact O-N 3.5Å
459	S	45	Very low	41.6	Very low	62 Å²	62	104 Å²	104	43%	0.434	61%	0.607	S	S	.	*			trans	-56.2	141.4	-175	-173.5	0	0	0	0	110.3	T457 T461 E462 E463	T457-S459 PolarHBondContact O-N 3.24Å; S459-T461 PolarHBondContact O-N 2.82Å; S459-T461 PolarHBondContact OG-N 3.45Å; S459-T461 PolarHBondContact OG-OG1 2.84Å; S459-E462 PolarHBondContact O-N 3.24Å; S459-E463 PolarHBondContact O-N 2.93Å
460	L	44.4	Very low	42.8	Very low	122 Å²	122	108.2 Å²	108.2	64%	0.639	61%	0.607	S	S	*	*	H	α-helix	trans	-50.8	-30.8	173.2	-163.5	77.1	0	0	0	111.2	G458 E462 E463 I464	G458-L460 PolarHBondContact O-N 3.5Å; L460-E462 PolarHBondContact O-N 3.22Å; L460-E463 PolarHBondContact O-N 3.36Å; L460-I464 HydrophobicContact CD2-CD1 4.21Å; L460-I464 HydrophobicContact CG-CD1 4.01Å; L460-I464 WeakPolarHBondContact O-CB 3.44Å; L460-I464 WeakPolarHBondContact O-CD1 3.48Å; L460-I464 WeakPolarHBondContact O-CG1 3.23Å; L460-I464 PolarHBondContact O-N 3.01Å
461	T	45.5	Very low	43.5	Very low	79 Å²	79	103.7 Å²	103.7	49%	0.485	57%	0.572	S	S	.	*	H	α-helix	trans	-56.9	-41	172.8	-29.4	0	0	0	0	113.7	S459 R465	S459-T461 PolarHBondContact O-N 2.82Å; S459-T461 PolarHBondContact OG-N 3.45Å; S459-T461 PolarHBondContact OG-OG1 2.84Å; T461-R465 WeakPolarHBondContact O-CB 3.46Å; T461-R465 WeakPolarHBondContact O-CG 3.45Å; T461-R465 PolarHBondContact O-N 2.79Å
462	E	51.5	Low	44.9	Very low	83 Å²	83	101.6 Å²	101.6	39%	0.388	55%	0.551	S	S	.	*	H	α-helix	trans	-76.3	-35.5	178.6	-69.4	-56.9	119.3	0	0	111.3	S459 L460 R465 L466	S459-E462 PolarHBondContact O-N 3.24Å; L460-E462 PolarHBondContact O-N 3.22Å; E462-R465 PolarHBondContact O-N 2.86Å; E462-R465 WeakPolarHBondContact OE1-CD 3.44Å; E462-R465 IonicContact OE1-CZ 2.77Å; E462-R465 IonicContact OE1-NE 3.62Å; E462-R465 IonicContact OE1-NH1 2.79Å; E462-R465 PolarHBondContact OE1-NH1 2.83Å; E462-L466 WeakPolarHBondContact O-CB 3.19Å; E462-L466 WeakPolarHBondContact O-CG 3.33Å; E462-L466 PolarHBondContact O-N 3.43Å
463	E	48	Very low	46.2	Very low	82 Å²	82	100.9 Å²	100.9	38%	0.383	53%	0.529	S	S	.	.	H	α-helix	trans	-66	-38.9	173.3	-152.1	-177.5	158.8	0	0	111.6	S459 L460 L466 R467	S459-E463 PolarHBondContact O-N 2.93Å; L460-E463 PolarHBondContact O-N 3.36Å; E463-L466 PolarHBondContact O-N 3.31Å; E463-R467 WeakPolarHBondContact O-CG 3.35Å; E463-R467 PolarHBondContact O-N 3.11Å; E463-R467 IonicContact OE1-CZ 2.72Å; E463-R467 IonicContact OE1-NH1 3.72Å; E463-R467 PolarHBondContact OE1-NH1 2.88Å; E463-R467 IonicContact OE1-NH2 2.83Å; E463-R467 PolarHBondContact OE1-NH2 2.77Å
464	I	50.8	Low	47.6	Very low	84 Å²	84	101.2 Å²	101.2	43%	0.431	53%	0.526	S	S	.	.	H	α-helix	trans	-65	-44.9	171.5	-69.3	163.3	0	0	0	111	L460 L466 R467 T468	L460-I464 HydrophobicContact CD2-CD1 4.21Å; L460-I464 HydrophobicContact CG-CD1 4.01Å; L460-I464 WeakPolarHBondContact O-CB 3.44Å; L460-I464 WeakPolarHBondContact O-CD1 3.48Å; L460-I464 WeakPolarHBondContact O-CG1 3.23Å; L460-I464 PolarHBondContact O-N 3.01Å; I464-L466 VanDerWaalsContact C-N 3.27Å; I464-L466 PolarHBondContact O-N 3.23Å; I464-R467 PolarHBondContact O-N 2.89Å; I464-T468 HydrophobicContact CG2-CG2 4.21Å; I464-T468 WeakPolarHBondContact O-CB 3.13Å; I464-T468 VanDerWaalsContact O-CG2 3.31Å; I464-T468 WeakPolarHBondContact O-CG2 3.41Å; I464-T468 PolarHBondContact O-N 3.3Å; I464-T468 PolarHBondContact O-OG1 2.73Å
465	R	51.2	Low	49.2	Very low	109 Å²	109	97.9 Å²	97.9	41%	0.411	51%	0.513	S	S	.	.	H	α-helix	trans	-61.3	-32.7	173.8	-83.9	171.8	158.1	158	-1	113.4	E284 T461 E462 T468	E284-R465 IonicContact OE1-CZ 3.59Å; E284-R465 VanDerWaalsContact OE1-CZ 3.31Å; E284-R465 IonicContact OE1-NE 2.63Å; E284-R465 PolarHBondContact OE1-NE 3.48Å; E284-R465 IonicContact OE1-NH2 2.67Å; E284-R465 PolarHBondContact OE1-NH2 3.07Å; E284-R465 IonicContact OE2-NH2 3.87Å; T461-R465 WeakPolarHBondContact O-CB 3.46Å; T461-R465 WeakPolarHBondContact O-CG 3.45Å; T461-R465 PolarHBondContact O-N 2.79Å; E462-R465 PolarHBondContact O-N 2.86Å; E462-R465 WeakPolarHBondContact OE1-CD 3.44Å; E462-R465 IonicContact OE1-CZ 2.77Å; E462-R465 IonicContact OE1-NE 3.62Å; E462-R465 IonicContact OE1-NH1 2.79Å; E462-R465 PolarHBondContact OE1-NH1 2.83Å; R465-T468 PolarHBondContact O-OG1 3.13Å
466	L	52	Low	51.3	Low	113 Å²	113	93.6 Å²	93.6	59%	0.592	48%	0.483	S	S	*	.	H	α-helix	trans	-76.4	-37.8	176	-73.4	166.5	0	0	0	112	E462 E463 I464	E462-L466 WeakPolarHBondContact O-CB 3.19Å; E462-L466 WeakPolarHBondContact O-CG 3.33Å; E462-L466 PolarHBondContact O-N 3.43Å; E463-L466 PolarHBondContact O-N 3.31Å; I464-L466 VanDerWaalsContact C-N 3.27Å; I464-L466 PolarHBondContact O-N 3.23Å
467	R	48.3	Very low	53.2	Low	172 Å²	172	86.7 Å²	86.7	65%	0.649	46%	0.457	S	S	*	.	H	α-helix	trans	-73.1	-38.5	177	-75.5	-171.2	176.4	106.5	16	113.8	E463 I464 R469	E463-R467 WeakPolarHBondContact O-CG 3.35Å; E463-R467 PolarHBondContact O-N 3.11Å; E463-R467 IonicContact OE1-CZ 2.72Å; E463-R467 IonicContact OE1-NH1 3.72Å; E463-R467 PolarHBondContact OE1-NH1 2.88Å; E463-R467 IonicContact OE1-NH2 2.83Å; E463-R467 PolarHBondContact OE1-NH2 2.77Å; I464-R467 PolarHBondContact O-N 2.89Å; R467-R469 PolarHBondContact O-N 2.84Å
468	T	44.9	Very low	54.9	Low	32 Å²	32	81.6 Å²	81.6	20%	0.196	43%	0.426	C	S	.	.	S	Bend	trans	-72.4	-6.2	178.9	51.2	0	0	0	0	113.9	V291 I464 R465 M470	V291-T468 HydrophobicContact CG2-CG2 3.88Å; I464-T468 HydrophobicContact CG2-CG2 4.21Å; I464-T468 WeakPolarHBondContact O-CB 3.13Å; I464-T468 VanDerWaalsContact O-CG2 3.31Å; I464-T468 WeakPolarHBondContact O-CG2 3.41Å; I464-T468 PolarHBondContact O-N 3.3Å; I464-T468 PolarHBondContact O-OG1 2.73Å; R465-T468 PolarHBondContact O-OG1 3.13Å; T468-M470 PolarHBondContact O-N 3.41Å
469	R	54.8	Low	56.7	Low	69 Å²	69	80 Å²	80	26%	0.26	41%	0.406	S	S	.	.			trans	-82	81.2	-176.5	-173.6	-171.2	-115	105.5	26.5	112.9	R467 G472 T473 L474	R467-R469 PolarHBondContact O-N 2.84Å; R469-G472 WeakPolarHBondContact CD-O 3.42Å; R469-G472 WeakPolarHBondContact CG-O 3.38Å; R469-T473 VanDerWaalsContact CZ-C 3.44Å; R469-T473 PolarHBondContact NE-O 3.34Å; R469-T473 VanDerWaalsContact NH2-C 3.34Å; R469-T473 PolarHBondContact NH2-O 3.43Å; R469-L474 VanDerWaalsContact NH2-CA 3.3Å; R469-L474 VanDerWaalsContact NH2-CD2 3.29Å
470	M	52.2	Low	58.1	Low	168 Å²	168	78.7 Å²	78.7	83%	0.828	40%	0.397	S	S	*	.			trans	-93.3	-7.2	169.8	-69.4	-65.5	-76.7	0	0	114.2	T468	T468-M470 PolarHBondContact O-N 3.41Å
471	R	49	Very low	59.6	Low	63 Å²	63	80.2 Å²	80.2	24%	0.238	40%	0.398	C	S	.	.	S	Bend	trans	-120.5	102	174.8	-105.6	-174.2	161.3	-128.4	-16	111.7	P478 P479	R471-P478 HydrophobicContact CG-CG 4.28Å; R471-P478 PolarHBondContact NH1-O 3.4Å; R471-P479 PolarHBondContact NH2-O 3.22Å
472	G	57.1	Low	61.4	Low	25 Å²	25	81.2 Å²	81.2	26%	0.258	40%	0.397	S	S	.	.			trans	79	-154.1	166.6	0	0	0	0	0	116.5	R469 W476	R469-G472 WeakPolarHBondContact CD-O 3.42Å; R469-G472 WeakPolarHBondContact CG-O 3.38Å; G472-W476 CarbonylContact C-O 3.54Å; G472-W476 VanDerWaalsContact CA-O 3.31Å; G472-W476 WeakPolarHBondContact CA-O 3.45Å
473	T	62.8	Low	63	Low	70 Å²	70	78.9 Å²	78.9	43%	0.429	39%	0.387	S	S	.	.			trans	-116	-161.4	-178.3	67.9	0	0	0	0	110.4	R469 N475 W476	R469-T473 VanDerWaalsContact CZ-C 3.44Å; R469-T473 PolarHBondContact NE-O 3.34Å; R469-T473 VanDerWaalsContact NH2-C 3.34Å; R469-T473 PolarHBondContact NH2-O 3.43Å; T473-N475 VanDerWaalsContact C-N 3.33Å; T473-N475 PolarHBondContact OG1-N 3.45Å; T473-W476 PolarHBondContact N-O 2.98Å; T473-W476 PolarHBondContact OG1-N 3.33Å
474	L	60.6	Low	64.7	Low	133 Å²	133	77 Å²	77	70%	0.696	38%	0.38	S	S	*	.	S	Bend	trans	-72.1	-29.9	170.1	-82.6	165.4	0	0	0	112.3	R469	R469-L474 VanDerWaalsContact NH2-CA 3.3Å; R469-L474 VanDerWaalsContact NH2-CD2 3.29Å
475	N	65.6	Low	66.2	Low	90 Å²	90	76.7 Å²	76.7	48%	0.481	38%	0.375	S	S	.	.	S	Bend	trans	-111.3	1.7	-167.3	-55.2	-5.3	0	0	0	112.2	T473 H503 L505	T473-N475 VanDerWaalsContact C-N 3.33Å; T473-N475 PolarHBondContact OG1-N 3.45Å; N475-H503 HydrophobicContact CB-CB 4.32Å; N475-H503 PolarHBondContact O-CD2 3.37Å; N475-L505 HydrophobicContact CB-CD1 4.2Å
476	W	78.4	Confident	67.5	Low	44 Å²	44	75 Å²	75	17%	0.167	38%	0.38	C	S	.	.			trans	-154	142.8	-178.9	172	74.1	0	0	0	111.6	G472 T473 P478 L505 C506 A507 C509 G510	G472-W476 CarbonylContact C-O 3.54Å; G472-W476 VanDerWaalsContact CA-O 3.31Å; G472-W476 WeakPolarHBondContact CA-O 3.45Å; T473-W476 PolarHBondContact N-O 2.98Å; T473-W476 PolarHBondContact OG1-N 3.33Å; W476-P478 HydrophobicContact CH2-CB 4.41Å; W476-P478 HydrophobicContact CH2-CG 3.62Å; W476-P478 HydrophobicContact CZ2-CB 4.13Å; W476-P478 HydrophobicContact CZ2-CG 3.79Å; W476-P478 HydrophobicContact CZ3-CG 4.28Å; W476-L505 HydrophobicContact CB-CD1 3.62Å; W476-C506 PolarHBondContact NE1-O 2.94Å; W476-A507 PolarHBondContact NE1-O 3.38Å; W476-C509 VanDerWaalsContact CH2-C 3.48Å; W476-C509 VanDerWaalsContact CZ2-C 3.44Å; W476-G510 VanDerWaalsContact CE2-N 3.3Å; W476-G510 VanDerWaalsContact CZ2-N 3.31Å
477	A	74.1	Confident	68.7	Low	22 Å²	22	72.3 Å²	72.3	18%	0.182	37%	0.366	C	S	.	.			trans	-135.2	148.3	162.8	0	0	0	0	0	109.3	L283	L283-A477 HydrophobicContact CD1-CB 4.23Å; L283-A477 HydrophobicContact CD2-CB 4.03Å
478	P	73.4	Confident	69.8	Low	36 Å²	36	65.5 Å²	65.5	23%	0.234	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-56	145.8	171.4	-20.8	29.4	0	0	0	111.3	R471 W476 S480	R471-P478 HydrophobicContact CG-CG 4.28Å; R471-P478 PolarHBondContact NH1-O 3.4Å; W476-P478 HydrophobicContact CH2-CB 4.41Å; W476-P478 HydrophobicContact CH2-CG 3.62Å; W476-P478 HydrophobicContact CZ2-CB 4.13Å; W476-P478 HydrophobicContact CZ2-CG 3.79Å; W476-P478 HydrophobicContact CZ3-CG 4.28Å; P478-S480 PolarHBondContact O-N 2.88Å
479	P	79.9	Confident	70.6	Confident	21 Å²	21	68 Å²	68	14%	0.136	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-57.3	140.7	179.4	-23.9	35	0	0	0	112	R471 A507 L527 F531 F561	R471-P479 PolarHBondContact NH2-O 3.22Å; P479-A507 WeakPolarHBondContact CD-O 3.33Å; P479-L527 HydrophobicContact CB-CD1 3.85Å; P479-L527 HydrophobicContact CG-CD1 3.86Å; P479-F531 HydrophobicContact CG-CE1 4.46Å; P479-F531 HydrophobicContact CG-CZ 4.45Å; P479-F561 HydrophobicContact CB-CD1 3.87Å; P479-F561 HydrophobicContact CB-CE1 3.62Å; P479-F561 HydrophobicContact CB-CZ 4.15Å; P479-F561 HydrophobicContact CG-CD1 4.32Å; P479-F561 WeakPolarHBondContact O-CZ 3.29Å
480	S	75.5	Confident	70.7	Confident	35 Å²	35	68 Å²	68	25%	0.245	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-73.4	154.2	178.2	52	0	0	0	0	111.7	P478 Q482 F561	P478-S480 PolarHBondContact O-N 2.88Å; S480-Q482 PolarHBondContact O-N 3.16Å; S480-Q482 PolarHBondContact OG-OE1 3.05Å; S480-F561 WeakPolarHBondContact O-CZ 3.39Å
481	F	76.8	Confident	70.6	Confident	154 Å²	154	67.7 Å²	67.7	68%	0.675	36%	0.357	S	S	*	.	S	Bend	trans	-81.8	55.3	172.1	-71.7	-88.4	0	0	0	110.5	F561 L565	F481-F561 HydrophobicContact CD1-CE2 4.06Å; F481-F561 HydrophobicContact CD1-CZ 4Å; F481-F561 HydrophobicContact CD2-CE2 4.28Å; F481-F561 HydrophobicContact CD2-CZ 4.34Å; F481-F561 AromaticContact CE1-CE2 3.65Å; F481-F561 HydrophobicContact CE1-CE2 3.65Å; F481-F561 HydrophobicContact CE1-CZ 4.08Å; F481-F561 AromaticContact CE2-CE2 3.9Å; F481-F561 HydrophobicContact CE2-CE2 3.9Å; F481-F561 HydrophobicContact CE2-CZ 4.42Å; F481-F561 HydrophobicContact CG-CE2 4.36Å; F481-F561 HydrophobicContact CG-CZ 4.14Å; F481-F561 HydrophobicContact CZ-CD2 4.45Å; F481-F561 AromaticContact CZ-CE2 3.57Å; F481-F561 HydrophobicContact CZ-CE2 3.57Å; F481-F561 HydrophobicContact CZ-CZ 4.3Å; F481-L565 HydrophobicContact CD1-CD1 4.24Å
482	Q	81.3	Confident	70.9	Confident	100 Å²	100	75.6 Å²	75.6	47%	0.467	39%	0.387	S	S	.	.			trans	-116.4	146.4	-178.5	-74.3	157.1	-6.8	0	0	110.5	E286 S480 Y526	E286-Q482 PolarHBondContact OE1-NE2 2.86Å; S480-Q482 PolarHBondContact O-N 3.16Å; S480-Q482 PolarHBondContact OG-OE1 3.05Å; Q482-Y526 PolarHBondContact O-OH 2.91Å
483	I	85.4	Confident	71.4	Confident	34 Å²	34	77.7 Å²	77.7	17%	0.174	40%	0.398	C	S	.	.			trans	-86.9	120.1	177.6	-58.5	-176.6	0	0	0	109.8	F485 Y526 V569 L574 F575	I483-F485 HydrophobicContact CB-CE1 4.15Å; I483-F485 HydrophobicContact CB-CE2 4.49Å; I483-F485 HydrophobicContact CB-CZ 4Å; I483-F485 HydrophobicContact CG2-CD1 3.88Å; I483-F485 HydrophobicContact CG2-CE1 3.54Å; I483-F485 HydrophobicContact CG2-CZ 3.92Å; I483-Y526 WeakPolarHBondContact CA-OH 3.48Å; I483-V569 HydrophobicContact CD1-CB 4.06Å; I483-V569 HydrophobicContact CD1-CG1 4.13Å; I483-V569 HydrophobicContact CD1-CG2 3.9Å; I483-L574 HydrophobicContact CD1-CB 4.5Å; I483-L574 HydrophobicContact CD1-CD1 3.4Å; I483-L574 VanDerWaalsContact CD1-CD1 3.4Å; I483-F575 HydrophobicContact CD1-CZ 4.47Å; I483-F575 HydrophobicContact CG2-CE1 4.08Å; I483-F575 HydrophobicContact CG2-CZ 4.39Å
484	I	84.4	Confident	72.3	Confident	43 Å²	43	83.1 Å²	83.1	22%	0.221	41%	0.411	C	S	.	.			trans	-90.8	107.4	176.1	-56.4	-179.2	0	0	0	108.3	Y526 L527	I484-Y526 HydrophobicContact CB-CE2 3.93Å; I484-Y526 HydrophobicContact CD1-CE1 4.44Å; I484-Y526 PolarHBondContact N-OH 3.19Å; I484-L527 HydrophobicContact CD1-CD2 3.75Å
485	F	81.6	Confident	73.6	Confident	78 Å²	78	80.8 Å²	80.8	34%	0.342	39%	0.393	S	S	.	.			trans	-85.2	-17.9	179.3	-52.7	-74.8	0	0	0	113.6	I483 G545 L548 F575 V580	I483-F485 HydrophobicContact CB-CE1 4.15Å; I483-F485 HydrophobicContact CB-CE2 4.49Å; I483-F485 HydrophobicContact CB-CZ 4Å; I483-F485 HydrophobicContact CG2-CD1 3.88Å; I483-F485 HydrophobicContact CG2-CE1 3.54Å; I483-F485 HydrophobicContact CG2-CZ 3.92Å; F485-G545 WeakPolarHBondContact O-CA 3.48Å; F485-L548 HydrophobicContact CB-CD1 4.44Å; F485-L548 HydrophobicContact CD1-CD1 3.91Å; F485-F575 AromaticContact CD1-CD1 3.93Å; F485-F575 HydrophobicContact CD1-CD1 3.93Å; F485-F575 AromaticContact CD1-CE1 3.83Å; F485-F575 HydrophobicContact CD1-CE1 3.83Å; F485-F575 AromaticContact CE1-CD1 3.64Å; F485-F575 HydrophobicContact CE1-CD1 3.64Å; F485-F575 AromaticContact CE1-CE1 3.53Å; F485-F575 HydrophobicContact CE1-CE1 3.53Å; F485-V580 HydrophobicContact CB-CG1 3.66Å; F485-V580 HydrophobicContact CD1-CG1 4.08Å; F485-V580 HydrophobicContact CG-CG1 3.97Å
486	S	78.8	Confident	74.6	Confident	74 Å²	74	79.5 Å²	79.5	52%	0.517	39%	0.391	S	S	.	.	S	Bend	trans	-80.8	147.1	176.4	48.6	0	0	0	0	111.8	Q488	S486-Q488 PolarHBondContact O-N 3.2Å
487	I	78.3	Confident	75	Confident	55 Å²	55	81.3 Å²	81.3	28%	0.282	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-75.1	122.1	165.5	-63.7	-179.9	0	0	0	107.9	G545 R546 N550	I487-G545 VanDerWaalsContact CG1-O 3.28Å; I487-G545 WeakPolarHBondContact CG1-O 3.16Å; I487-R546 HydrophobicContact CD1-CG 4.18Å; I487-R546 HydrophobicContact CG1-CG 4.14Å; I487-N550 WeakPolarHBondContact CD1-ND2 2.82Å
488	Q	70.4	Confident	75.5	Confident	29 Å²	29	81.1 Å²	81.1	14%	0.136	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-64	129.2	168.5	-65.6	-60.3	-27.2	0	0	109.5	S486 Q490	S486-Q488 PolarHBondContact O-N 3.2Å; Q488-Q490 PolarHBondContact O-N 3.42Å
489	P	62	Low	76.2	Confident	85 Å²	85	79.4 Å²	79.4	55%	0.552	39%	0.387	S	S	*	.			trans	-71.6	89.7	-171.5	28.1	-35	0	0	0	112.1	I276	I276-P489 HydrophobicContact CD1-CG 4.36Å
490	Q	57.2	Low	76.6	Confident	70 Å²	70	80.1 Å²	80.1	33%	0.327	40%	0.395	S	S	.	.			trans	-60.8	163.8	165.5	-70.9	-171	-73.6	0	0	111.6	Q488 E525 R546	Q488-Q490 PolarHBondContact O-N 3.42Å; Q490-E525 WeakPolarHBondContact CG-OE2 3.31Å; Q490-E525 PolarHBondContact NE2-OE1 3.29Å; Q490-E525 PolarHBondContact NE2-OE2 3.31Å; Q490-R546 VanDerWaalsContact CD-NH2 3.27Å
491	Q	50.7	Low	77.1	Confident	160 Å²	160	82.8 Å²	82.8	75%	0.748	41%	0.406	S	S	*	.	S	Bend	trans	71	40.8	164.8	-40.1	-51.6	-17.6	0	0	117.2
492	R	54.7	Low	77.6	Confident	229 Å²	229	76.2 Å²	76.2	86%	0.864	38%	0.377	S	S	*	.	S	Bend	trans	-148.2	-32.7	155.4	-149.8	166.9	-73.3	-163.4	-0.7	117.1
493	S	67.6	Low	77.9	Confident	70 Å²	70	76.3 Å²	76.3	49%	0.49	38%	0.377	S	S	.	.	S	Bend	trans	-80.6	143.6	175.4	48.9	0	0	0	0	112.4	E497 V498	S493-E497 WeakPolarHBondContact CA-OE2 3.35Å; S493-V498 WeakPolarHBondContact OG-CG2 3.34Å
494	R	81.9	Confident	78.1	Confident	183 Å²	183	79.6 Å²	79.6	69%	0.691	39%	0.388	S	S	*	.			trans	-77.6	152	173.3	-58.3	-179.3	173.9	171.4	-3.4	110.3	S496 E497 V498	R494-S496 PolarHBondContact O-N 2.87Å; R494-S496 VanDerWaalsContact O-N 3.13Å; R494-E497 HydrophobicContact CB-CG 4.29Å; R494-E497 VanDerWaalsContact CB-OE1 3.29Å; R494-E497 WeakPolarHBondContact CB-OE1 3.45Å; R494-E497 WeakPolarHBondContact CD-OE1 3.46Å; R494-E497 WeakPolarHBondContact CG-OE1 3.45Å; R494-E497 PolarHBondContact N-OE2 3.01Å; R494-E497 WeakPolarHBondContact O-CB 3.38Å; R494-E497 PolarHBondContact O-N 3.07Å; R494-V498 PolarHBondContact O-N 2.61Å; R494-V498 VanDerWaalsContact O-N 3.16Å
495	R	88.4	Confident	78.4	Confident	84 Å²	84	78.3 Å²	78.3	32%	0.317	38%	0.381	S	S	.	.	H	α-helix	trans	-49.7	-39.4	175.7	177.7	169.3	-177.6	131	-0.7	113.8	V499 I518 K519 L521 Y530	R495-V499 WeakPolarHBondContact O-CB 3.48Å; R495-V499 VanDerWaalsContact O-CG2 3.27Å; R495-V499 WeakPolarHBondContact O-CG2 3.28Å; R495-V499 PolarHBondContact O-N 2.86Å; R495-V499 VanDerWaalsContact O-N 3.12Å; R495-I518 HydrophobicContact CG-CG2 4.21Å; R495-I518 VanDerWaalsContact CZ-O 3.28Å; R495-I518 PolarHBondContact NE-O 3.13Å; R495-I518 PolarHBondContact NH2-O 3.12Å; R495-K519 PolarHBondContact NH2-O 2.77Å; R495-L521 VanDerWaalsContact NH2-C 3.35Å; R495-L521 PolarHBondContact NH2-O 3.17Å; R495-Y530 HydrophobicContact CG-CE1 3.92Å; R495-Y530 HydrophobicContact CG-CE2 4.28Å
496	S	85.3	Confident	78.9	Confident	64 Å²	64	74.6 Å²	74.6	45%	0.448	37%	0.365	S	S	.	.	H	α-helix	trans	-65.8	-36.7	176.2	46.3	0	0	0	0	113.3	R494 A500	R494-S496 PolarHBondContact O-N 2.87Å; R494-S496 VanDerWaalsContact O-N 3.13Å; S496-A500 WeakPolarHBondContact O-CB 3.46Å; S496-A500 PolarHBondContact O-N 3.42Å
497	E	86.2	Confident	79.4	Confident	81 Å²	81	71.4 Å²	71.4	38%	0.379	34%	0.343	S	S	.	.	H	α-helix	trans	-70.4	-47.2	179.9	-66.3	147.4	-151.9	0	0	110.3	S493 R494 V499 A500 L501	S493-E497 WeakPolarHBondContact CA-OE2 3.35Å; R494-E497 HydrophobicContact CB-CG 4.29Å; R494-E497 VanDerWaalsContact CB-OE1 3.29Å; R494-E497 WeakPolarHBondContact CB-OE1 3.45Å; R494-E497 WeakPolarHBondContact CD-OE1 3.46Å; R494-E497 WeakPolarHBondContact CG-OE1 3.45Å; R494-E497 PolarHBondContact N-OE2 3.01Å; R494-E497 WeakPolarHBondContact O-CB 3.38Å; R494-E497 PolarHBondContact O-N 3.07Å; E497-V499 VanDerWaalsContact C-N 3.31Å; E497-V499 PolarHBondContact O-N 2.76Å; E497-A500 PolarHBondContact O-N 2.79Å; E497-L501 WeakPolarHBondContact O-CB 3.1Å; E497-L501 VanDerWaalsContact O-CG 3.27Å; E497-L501 WeakPolarHBondContact O-CG 3.41Å; E497-L501 PolarHBondContact O-N 3.12Å
498	V	86.4	Confident	79.8	Confident	19 Å²	19	69.9 Å²	69.9	12%	0.115	34%	0.341	C	S	.	.	H	α-helix	trans	-60.8	-41.6	176.1	-174.7	0	0	0	0	111.1	S493 R494 L501 Q502 Y530	S493-V498 WeakPolarHBondContact OG-CG2 3.34Å; R494-V498 PolarHBondContact O-N 2.61Å; R494-V498 VanDerWaalsContact O-N 3.16Å; V498-L501 PolarHBondContact O-N 2.93Å; V498-Q502 WeakPolarHBondContact O-CG 3.24Å; V498-Q502 PolarHBondContact O-N 2.96Å; V498-Y530 HydrophobicContact CB-CD2 4.06Å; V498-Y530 HydrophobicContact CB-CE2 3.89Å; V498-Y530 HydrophobicContact CG1-CD2 3.75Å; V498-Y530 HydrophobicContact CG1-CE2 3.91Å; V498-Y530 HydrophobicContact CG2-CE2 4.47Å
499	V	88.4	Confident	80.7	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-68.4	-36.1	177.8	174.4	0	0	0	0	112.3	R495 E497 Q502 Y504 I518 L521 Y530	R495-V499 WeakPolarHBondContact O-CB 3.48Å; R495-V499 VanDerWaalsContact O-CG2 3.27Å; R495-V499 WeakPolarHBondContact O-CG2 3.28Å; R495-V499 PolarHBondContact O-N 2.86Å; R495-V499 VanDerWaalsContact O-N 3.12Å; E497-V499 VanDerWaalsContact C-N 3.31Å; E497-V499 PolarHBondContact O-N 2.76Å; V499-Q502 VanDerWaalsContact O-CG 3.26Å; V499-Q502 WeakPolarHBondContact O-CG 3.35Å; V499-Q502 PolarHBondContact O-N 2.89Å; V499-Y504 HydrophobicContact CG1-CD1 3.89Å; V499-Y504 HydrophobicContact CG1-CE1 4.48Å; V499-Y504 HydrophobicContact CG1-CG 4.5Å; V499-Y504 WeakPolarHBondContact O-CA 3.31Å; V499-Y504 PolarHBondContact O-N 2.94Å; V499-I518 HydrophobicContact CG1-CD1 3.99Å; V499-I518 HydrophobicContact CG1-CG1 4.03Å; V499-I518 HydrophobicContact CG2-CG2 4.27Å; V499-L521 HydrophobicContact CG1-CD1 4.33Å; V499-L521 HydrophobicContact CG2-CD1 3.92Å; V499-Y530 HydrophobicContact CG2-CD2 3.78Å; V499-Y530 HydrophobicContact CG2-CE2 4.5Å; V499-Y530 HydrophobicContact CG2-CG 3.81Å
500	A	86.8	Confident	81.8	Confident	36 Å²	36	67.6 Å²	67.6	30%	0.298	33%	0.333	S	S	.	.	H	α-helix	trans	-66.7	-36.9	172.5	0	0	0	0	0	112.5	S496 E497 Q502 H503 Y504	S496-A500 WeakPolarHBondContact O-CB 3.46Å; S496-A500 PolarHBondContact O-N 3.42Å; E497-A500 PolarHBondContact O-N 2.79Å; A500-Q502 VanDerWaalsContact C-N 3.3Å; A500-Q502 PolarHBondContact O-N 2.87Å; A500-H503 WeakPolarHBondContact O-CA 3.43Å; A500-H503 PolarHBondContact O-N 3.33Å; A500-Y504 HydrophobicContact CB-CE2 4.05Å
501	L	86.4	Confident	83.3	Confident	91 Å²	91	68.2 Å²	68.2	48%	0.476	34%	0.342	S	S	.	.	H	α-helix	trans	-69.9	-21.6	177.2	-72.4	164.5	0	0	0	113.8	F277 E497 V498 H503	F277-L501 HydrophobicContact CD1-CB 4.36Å; F277-L501 HydrophobicContact CE1-CB 3.69Å; F277-L501 HydrophobicContact CE1-CD1 4.29Å; F277-L501 HydrophobicContact CE1-CG 4.41Å; F277-L501 HydrophobicContact CE2-CD1 4.33Å; F277-L501 HydrophobicContact CZ-CB 4.09Å; F277-L501 HydrophobicContact CZ-CD1 3.81Å; F277-L501 HydrophobicContact CZ-CG 4.4Å; E497-L501 WeakPolarHBondContact O-CB 3.1Å; E497-L501 VanDerWaalsContact O-CG 3.27Å; E497-L501 WeakPolarHBondContact O-CG 3.41Å; E497-L501 PolarHBondContact O-N 3.12Å; V498-L501 PolarHBondContact O-N 2.93Å; L501-H503 VanDerWaalsContact C-N 3.3Å
502	Q	86.9	Confident	85.2	Confident	15 Å²	15	68.6 Å²	68.6	7%	0.07	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	25.3	165.1	64	-175.2	64	0	0	112.5	V498 V499 A500 Y504 L505 Y530	V498-Q502 WeakPolarHBondContact O-CG 3.24Å; V498-Q502 PolarHBondContact O-N 2.96Å; V499-Q502 VanDerWaalsContact O-CG 3.26Å; V499-Q502 WeakPolarHBondContact O-CG 3.35Å; V499-Q502 PolarHBondContact O-N 2.89Å; A500-Q502 VanDerWaalsContact C-N 3.3Å; A500-Q502 PolarHBondContact O-N 2.87Å; Q502-Y504 PolarHBondContact O-N 3.04Å; Q502-Y504 VanDerWaalsContact O-N 3.14Å; Q502-L505 PolarHBondContact NE2-O 2.76Å; Q502-L505 WeakPolarHBondContact O-CB 3.33Å; Q502-L505 PolarHBondContact O-N 3.35Å; Q502-Y530 PolarHBondContact NE2-O 3.35Å
503	H	87.4	Confident	86.8	Confident	103 Å²	103	58.5 Å²	58.5	48%	0.477	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	29.9	176.6	-58.3	-73.9	0	0	0	115.3	N475 A500 L501 L505	N475-H503 HydrophobicContact CB-CB 4.32Å; N475-H503 PolarHBondContact O-CD2 3.37Å; A500-H503 WeakPolarHBondContact O-CA 3.43Å; A500-H503 PolarHBondContact O-N 3.33Å; L501-H503 VanDerWaalsContact C-N 3.3Å; H503-L505 HydrophobicContact CB-CD1 4.38Å; H503-L505 HydrophobicContact CB-CG 4.26Å; H503-L505 PolarHBondContact O-N 2.91Å
504	Y	90.6	Very high	87.8	Confident	103 Å²	103	60.1 Å²	60.1	40%	0.404	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	18.1	-172.3	-55.9	-91.9	0	0	0	114.4	V499 A500 Q502 V513 I518	V499-Y504 HydrophobicContact CG1-CD1 3.89Å; V499-Y504 HydrophobicContact CG1-CE1 4.48Å; V499-Y504 HydrophobicContact CG1-CG 4.5Å; V499-Y504 WeakPolarHBondContact O-CA 3.31Å; V499-Y504 PolarHBondContact O-N 2.94Å; A500-Y504 HydrophobicContact CB-CE2 4.05Å; Q502-Y504 PolarHBondContact O-N 3.04Å; Q502-Y504 VanDerWaalsContact O-N 3.14Å; Y504-V513 WeakPolarHBondContact O-CB 3.42Å; Y504-V513 PolarHBondContact O-N 3.27Å; Y504-I518 HydrophobicContact CD1-CD1 3.86Å; Y504-I518 HydrophobicContact CE1-CD1 3.74Å
505	L	90.6	Very high	88	Confident	15 Å²	15	56.1 Å²	56.1	8%	0.079	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-95.7	145.8	178.1	-53.2	-179.3	0	0	0	110.6	N475 W476 Q502 H503 A507 T511 E512	N475-L505 HydrophobicContact CB-CD1 4.2Å; W476-L505 HydrophobicContact CB-CD1 3.62Å; Q502-L505 PolarHBondContact NE2-O 2.76Å; Q502-L505 WeakPolarHBondContact O-CB 3.33Å; Q502-L505 PolarHBondContact O-N 3.35Å; H503-L505 HydrophobicContact CB-CD1 4.38Å; H503-L505 HydrophobicContact CB-CG 4.26Å; H503-L505 PolarHBondContact O-N 2.91Å; L505-A507 PolarHBondContact O-N 3.33Å; L505-T511 CarbonylContact C-O 3.48Å; L505-E512 HydrophobicContact CD2-CB 4.25Å; L505-E512 HydrophobicContact CD2-CG 3.41Å; L505-E512 VanDerWaalsContact CD2-CG 3.41Å
506	C	91.4	Very high	87.9	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.328	C	S	.	.			trans	-64.5	122.4	167.9	174.1	0	0	0	0	109.9	W476 G508 C509 G510 T511 C532	W476-C506 PolarHBondContact NE1-O 2.94Å; C506-G508 PolarHBondContact O-N 2.75Å; C506-G508 VanDerWaalsContact O-N 3.08Å; C506-G508 PolarHBondContact SG-N 3.03Å; C506-C509 PolarHBondContact O-N 3.11Å; C506-C509 PolarHBondContact SG-SG 2.97Å; C506-G510 WeakPolarHBondContact O-CA 3.03Å; C506-G510 PolarHBondContact O-N 2.86Å; C506-T511 PolarHBondContact N-O 3.43Å; C506-C532 HydrophobicContact CB-CB 4.36Å; C506-C532 PolarHBondContact SG-N 3.13Å; C506-C532 PolarHBondContact SG-SG 3.03Å
507	A	89.4	Confident	88	Confident	7 Å²	7	64.6 Å²	64.6	6%	0.058	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-23.2	-177.3	0	0	0	0	0	114	W476 P479 L505 R529 Y530 F531	W476-A507 PolarHBondContact NE1-O 3.38Å; P479-A507 WeakPolarHBondContact CD-O 3.33Å; L505-A507 PolarHBondContact O-N 3.33Å; A507-R529 HydrophobicContact CB-CB 3.81Å; A507-Y530 WeakPolarHBondContact CB-O 3.43Å; A507-Y530 PolarHBondContact N-O 2.93Å; A507-F531 HydrophobicContact CB-CD1 4.37Å; A507-F531 HydrophobicContact CB-CD2 4.38Å; A507-F531 HydrophobicContact CB-CE1 3.89Å; A507-F531 HydrophobicContact CB-CE2 3.85Å; A507-F531 HydrophobicContact CB-CZ 3.57Å
508	G	88.1	Confident	88.1	Confident	23 Å²	23	61.7 Å²	61.7	24%	0.237	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-32.6	-178.8	0	0	0	0	0	115.8	C506 F531	C506-G508 PolarHBondContact O-N 2.75Å; C506-G508 VanDerWaalsContact O-N 3.08Å; C506-G508 PolarHBondContact SG-N 3.03Å; G508-F531 VanDerWaalsContact CA-CE1 3.46Å
509	C	87.3	Confident	88.3	Confident	47 Å²	47	69.8 Å²	69.8	32%	0.318	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.7	-0.9	-172.2	64.3	0	0	0	0	115.2	W476 C506 T511	W476-C509 VanDerWaalsContact CH2-C 3.48Å; W476-C509 VanDerWaalsContact CZ2-C 3.44Å; C506-C509 PolarHBondContact O-N 3.11Å; C506-C509 PolarHBondContact SG-SG 2.97Å; C509-T511 PolarHBondContact O-N 3.43Å; C509-T511 VanDerWaalsContact O-N 3.16Å; C509-T511 PolarHBondContact SG-OG1 2.82Å
510	G	86.6	Confident	88.4	Confident	19 Å²	19	76 Å²	76	20%	0.196	38%	0.375	C	S	.	.			trans	73.4	-0.7	177.2	0	0	0	0	0	115.4	W476 C506 E512	W476-G510 VanDerWaalsContact CE2-N 3.3Å; W476-G510 VanDerWaalsContact CZ2-N 3.31Å; C506-G510 WeakPolarHBondContact O-CA 3.03Å; C506-G510 PolarHBondContact O-N 2.86Å; G510-E512 PolarHBondContact O-N 2.83Å
511	T	88.6	Confident	88.6	Confident	84 Å²	84	74.8 Å²	74.8	52%	0.515	36%	0.364	S	S	.	.			trans	-62.6	130.5	177.9	-50.5	0	0	0	0	111.1	L505 C506 C509	L505-T511 CarbonylContact C-O 3.48Å; C506-T511 PolarHBondContact N-O 3.43Å; C509-T511 PolarHBondContact O-N 3.43Å; C509-T511 VanDerWaalsContact O-N 3.16Å; C509-T511 PolarHBondContact SG-OG1 2.82Å
512	E	89.6	Confident	89	Confident	168 Å²	168	74.4 Å²	74.4	79%	0.785	36%	0.356	S	S	*	.	B	Isolated β-bridge	trans	-62.5	141.4	174.6	-72.4	169.6	-155.9	0	0	111.9	L505 G510	L505-E512 HydrophobicContact CD2-CB 4.25Å; L505-E512 HydrophobicContact CD2-CG 3.41Å; L505-E512 VanDerWaalsContact CD2-CG 3.41Å; G510-E512 PolarHBondContact O-N 2.83Å
513	V	88.4	Confident	89.3	Confident	17 Å²	17	75.7 Å²	75.7	10%	0.103	36%	0.362	C	S	.	.			trans	-121.6	107.7	-178.8	-172.5	0	0	0	0	109.1	Y504 L521	Y504-V513 WeakPolarHBondContact O-CB 3.42Å; Y504-V513 PolarHBondContact O-N 3.27Å; V513-L521 HydrophobicContact CB-CD1 4.49Å; V513-L521 HydrophobicContact CG1-CD1 4.06Å; V513-L521 HydrophobicContact CG1-CD2 3.96Å; V513-L521 HydrophobicContact CG1-CG 4.14Å; V513-L521 HydrophobicContact CG2-CD1 4.23Å; V513-L521 HydrophobicContact CG2-CD2 3.9Å
514	E	88.4	Confident	89.5	Confident	103 Å²	103	70.8 Å²	70.8	48%	0.481	34%	0.339	S	S	.	.			trans	-54	144.9	173.2	-61.8	179.3	-161.6	0	0	111.4	R516 Y517 I518	E514-R516 PolarHBondContact O-N 2.67Å; E514-Y517 HydrophobicContact CB-CD2 3.9Å; E514-Y517 HydrophobicContact CB-CE2 4.4Å; E514-Y517 HydrophobicContact CG-CD2 4.25Å; E514-Y517 HydrophobicContact CG-CE2 4.4Å; E514-Y517 PolarHBondContact O-N 2.82Å; E514-I518 PolarHBondContact O-N 2.99Å
515	P	86.2	Confident	89.6	Confident	99 Å²	99	67.1 Å²	67.1	64%	0.643	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	-29.3	177	-31.6	37.2	0	0	0	115.1	I518	P515-I518 HydrophobicContact CB-CD1 4.34Å; P515-I518 WeakPolarHBondContact O-CG1 3.45Å
516	R	86.7	Confident	89.7	Confident	212 Å²	212	66.6 Å²	66.6	80%	0.8	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-35	176	-66.1	175.4	174.5	176.3	-2.2	113.1	E514	E514-R516 PolarHBondContact O-N 2.67Å
517	Y	87.6	Confident	89.5	Confident	114 Å²	114	67.7 Å²	67.7	45%	0.447	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-1.5	-177	-59.4	-55.9	0	0	0	114.2	E514 K519 K520	E514-Y517 HydrophobicContact CB-CD2 3.9Å; E514-Y517 HydrophobicContact CB-CE2 4.4Å; E514-Y517 HydrophobicContact CG-CD2 4.25Å; E514-Y517 HydrophobicContact CG-CE2 4.4Å; E514-Y517 PolarHBondContact O-N 2.82Å; Y517-K519 PolarHBondContact O-N 2.92Å; Y517-K520 HydrophobicContact CD1-CD 4.05Å; Y517-K520 WeakPolarHBondContact O-CB 3.45Å; Y517-K520 PolarHBondContact O-N 2.89Å
518	I	88.8	Confident	89.5	Confident	21 Å²	21	68.3 Å²	68.3	11%	0.108	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-32.6	174.7	-68.6	-178	0	0	0	112.5	R495 V499 Y504 E514 P515 K520	R495-I518 HydrophobicContact CG-CG2 4.21Å; R495-I518 VanDerWaalsContact CZ-O 3.28Å; R495-I518 PolarHBondContact NE-O 3.13Å; R495-I518 PolarHBondContact NH2-O 3.12Å; V499-I518 HydrophobicContact CG1-CD1 3.99Å; V499-I518 HydrophobicContact CG1-CG1 4.03Å; V499-I518 HydrophobicContact CG2-CG2 4.27Å; Y504-I518 HydrophobicContact CD1-CD1 3.86Å; Y504-I518 HydrophobicContact CE1-CD1 3.74Å; E514-I518 PolarHBondContact O-N 2.99Å; P515-I518 HydrophobicContact CB-CD1 4.34Å; P515-I518 WeakPolarHBondContact O-CG1 3.45Å; I518-K520 VanDerWaalsContact C-N 3.34Å; I518-K520 PolarHBondContact O-N 3.27Å
519	K	89.6	Confident	89.6	Confident	188 Å²	188	70.4 Å²	70.4	82%	0.817	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-20.8	177.4	-68.4	-174.2	179.5	-179.3	0	114.8	R495 Y517	R495-K519 PolarHBondContact NH2-O 2.77Å; Y517-K519 PolarHBondContact O-N 2.92Å
520	K	90.4	Very high	89.9	Confident	131 Å²	131	69.5 Å²	69.5	57%	0.57	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-25.4	179.1	-65.8	-172.7	175.8	-178.2	0	113.8	Y517 I518	Y517-K520 HydrophobicContact CD1-CD 4.05Å; Y517-K520 WeakPolarHBondContact O-CB 3.45Å; Y517-K520 PolarHBondContact O-N 2.89Å; I518-K520 VanDerWaalsContact C-N 3.34Å; I518-K520 PolarHBondContact O-N 3.27Å
521	L	92.4	Very high	90.2	Very high	11 Å²	11	68.6 Å²	68.6	6%	0.058	32%	0.317	C	S	.	.			trans	-56.8	161.4	-179.6	-56	-176.1	0	0	0	113.3	R495 V499 V513 Y530 F531 C532	R495-L521 VanDerWaalsContact NH2-C 3.35Å; R495-L521 PolarHBondContact NH2-O 3.17Å; V499-L521 HydrophobicContact CG1-CD1 4.33Å; V499-L521 HydrophobicContact CG2-CD1 3.92Å; V513-L521 HydrophobicContact CB-CD1 4.49Å; V513-L521 HydrophobicContact CG1-CD1 4.06Å; V513-L521 HydrophobicContact CG1-CD2 3.96Å; V513-L521 HydrophobicContact CG1-CG 4.14Å; V513-L521 HydrophobicContact CG2-CD1 4.23Å; V513-L521 HydrophobicContact CG2-CD2 3.9Å; L521-Y530 HydrophobicContact CB-CD1 3.91Å; L521-Y530 HydrophobicContact CB-CG 4.46Å; L521-F531 CarbonylContact C-O 3.6Å; L521-F531 VanDerWaalsContact CA-O 3.25Å; L521-F531 WeakPolarHBondContact CA-O 3.49Å; L521-F531 WeakPolarHBondContact CB-O 3.23Å; L521-C532 HydrophobicContact CD2-CB 4.3Å
522	R	93.7	Very high	90.5	Very high	83 Å²	83	65.7 Å²	65.7	31%	0.313	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	142.4	-179.5	-61.1	168	-171.8	-148.1	1.8	110	Y530 F531 D533 H536 S537	R522-Y530 WeakPolarHBondContact O-CA 3.37Å; R522-F531 PolarHBondContact N-O 2.85Å; R522-F531 PolarHBondContact O-N 3.35Å; R522-D533 IonicContact CZ-OD1 3.29Å; R522-D533 IonicContact NE-OD1 3.71Å; R522-D533 PolarHBondContact NE-OD1 2.93Å; R522-D533 IonicContact NH2-OD1 2.92Å; R522-D533 PolarHBondContact NH2-OD1 3.45Å; R522-H536 HydrophobicContact CB-CB 3.97Å; R522-H536 VanDerWaalsContact CB-CG 3.5Å; R522-H536 WeakPolarHBondContact CD-O 3.4Å; R522-H536 PolarHBondContact NE-O 3.14Å; R522-H536 PolarHBondContact NH1-O 3Å; R522-S537 PolarHBondContact NH1-O 3.23Å
523	H	92.9	Very high	90.6	Very high	41 Å²	41	61.1 Å²	61.1	19%	0.19	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	123.4	-175.5	-173.5	-118.2	0	0	0	110.4	E525 Y530 H536 S557	H523-E525 IonicContact CE1-OE1 2.8Å; H523-E525 PolarHBondContact CE1-OE1 2.61Å; H523-E525 IonicContact CE1-OE2 2.98Å; H523-E525 VanDerWaalsContact ND1-CD 3.27Å; H523-E525 IonicContact ND1-OE1 2.73Å; H523-E525 PolarHBondContact ND1-OE1 2.79Å; H523-E525 IonicContact ND1-OE2 2.66Å; H523-Y530 HydrophobicContact CB-CD1 4.23Å; H523-Y530 HydrophobicContact CB-CE1 3.79Å; H523-Y530 AromaticContact CD2-CE2 3.71Å; H523-Y530 AromaticContact CD2-CZ 3.91Å; H523-H536 PolarHBondContact O-NE2 3.12Å; H523-H536 VanDerWaalsContact O-NE2 3.16Å; H523-S557 PolarHBondContact O-OG 3.41Å
524	C	93	Very high	90.8	Very high	0 Å²	0	66 Å²	66	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	107.1	171.5	177	0	0	0	0	109.3	Y526 L527 G528 R529 F531 S559 S562	C524-Y526 PolarHBondContact O-N 3.15Å; C524-L527 HydrophobicContact CB-CB 4.43Å; C524-L527 PolarHBondContact O-N 3.21Å; C524-G528 PolarHBondContact O-N 3.11Å; C524-R529 PolarHBondContact N-O 2.88Å; C524-F531 HydrophobicContact CB-CD2 3.71Å; C524-F531 HydrophobicContact CB-CE2 3.48Å; C524-F531 VanDerWaalsContact CB-CE2 3.48Å; C524-F531 HydrophobicContact CB-CZ 4.4Å; C524-S559 PolarHBondContact SG-N 2.87Å; C524-S559 PolarHBondContact SG-OG 3.4Å; C524-S559 VanDerWaalsContact SG-OG 3.39Å; C524-S562 PolarHBondContact SG-OG 3.08Å
525	E	92.3	Very high	91	Very high	26 Å²	26	62.4 Å²	62.4	12%	0.121	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-14.9	-177.3	-71.7	-63.4	159.4	0	0	114.3	Q490 H523 I543 R546 Y556 S557	Q490-E525 WeakPolarHBondContact CG-OE2 3.31Å; Q490-E525 PolarHBondContact NE2-OE1 3.29Å; Q490-E525 PolarHBondContact NE2-OE2 3.31Å; H523-E525 IonicContact CE1-OE1 2.8Å; H523-E525 PolarHBondContact CE1-OE1 2.61Å; H523-E525 IonicContact CE1-OE2 2.98Å; H523-E525 VanDerWaalsContact ND1-CD 3.27Å; H523-E525 IonicContact ND1-OE1 2.73Å; H523-E525 PolarHBondContact ND1-OE1 2.79Å; H523-E525 IonicContact ND1-OE2 2.66Å; E525-I543 HydrophobicContact CB-CD1 3.55Å; E525-R546 IonicContact OE2-NH2 2.65Å; E525-R546 PolarHBondContact OE2-NH2 2.91Å; E525-Y556 HydrophobicContact CB-CG 4.48Å; E525-Y556 HydrophobicContact CG-CD1 4.24Å; E525-S557 WeakPolarHBondContact CB-O 3.35Å; E525-S557 PolarHBondContact N-O 2.74Å
526	Y	91.5	Very high	91.4	Very high	4 Å²	4	57.8 Å²	57.8	2%	0.016	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-40.7	173.5	175.4	-109.2	0	0	0	112.3	Q482 I483 I484 C524 I543 L565 L566	Q482-Y526 PolarHBondContact O-OH 2.91Å; I483-Y526 WeakPolarHBondContact CA-OH 3.48Å; I484-Y526 HydrophobicContact CB-CE2 3.93Å; I484-Y526 HydrophobicContact CD1-CE1 4.44Å; I484-Y526 PolarHBondContact N-OH 3.19Å; C524-Y526 PolarHBondContact O-N 3.15Å; Y526-I543 HydrophobicContact CD2-CG2 4.25Å; Y526-L565 HydrophobicContact CE1-CD2 4.03Å; Y526-L566 HydrophobicContact CD2-CD1 4.14Å; Y526-L566 HydrophobicContact CD2-CD2 4.21Å; Y526-L566 HydrophobicContact CE2-CD2 3.9Å; Y526-L566 HydrophobicContact CG-CD1 4.12Å
527	L	88.9	Confident	91.8	Very high	23 Å²	23	51.3 Å²	51.3	12%	0.12	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-12.7	-177.6	-66.2	177	0	0	0	114.1	P479 I484 C524 R529 F531 S562	P479-L527 HydrophobicContact CB-CD1 3.85Å; P479-L527 HydrophobicContact CG-CD1 3.86Å; I484-L527 HydrophobicContact CD1-CD2 3.75Å; C524-L527 HydrophobicContact CB-CB 4.43Å; C524-L527 PolarHBondContact O-N 3.21Å; L527-R529 VanDerWaalsContact C-N 3.27Å; L527-R529 PolarHBondContact O-N 3.03Å; L527-F531 HydrophobicContact CD1-CE1 4.48Å; L527-F531 HydrophobicContact CD1-CE2 4.25Å; L527-F531 HydrophobicContact CD1-CZ 3.57Å; L527-S562 VanDerWaalsContact CD1-OG 3.22Å; L527-S562 WeakPolarHBondContact CD1-OG 3.48Å; L527-S562 WeakPolarHBondContact CG-OG 3.42Å
528	G	88.9	Confident	92	Very high	21 Å²	21	48 Å²	48	22%	0.216	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	25.9	-177.7	0	0	0	0	0	114.1	C524	C524-G528 PolarHBondContact O-N 3.11Å
529	R	89.9	Confident	92.4	Very high	66 Å²	66	48.3 Å²	48.3	25%	0.249	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	160.6	-170.9	-68.2	-179.9	-170.8	-153.3	-0.1	112	I276 A507 C524 L527 F531	I276-R529 PolarHBondContact O-NH2 2.89Å; A507-R529 HydrophobicContact CB-CB 3.81Å; C524-R529 PolarHBondContact N-O 2.88Å; L527-R529 VanDerWaalsContact C-N 3.27Å; L527-R529 PolarHBondContact O-N 3.03Å; R529-F531 HydrophobicContact CB-CE2 4.04Å; R529-F531 WeakPolarHBondContact O-CD2 3.17Å; R529-F531 WeakPolarHBondContact O-CE2 3.3Å
530	Y	92.6	Very high	92.7	Very high	28 Å²	28	44.2 Å²	44.2	11%	0.11	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	139.7	-178.5	-77.5	-90.9	0	0	0	113.1	R495 V498 V499 Q502 A507 L521 R522 H523	R495-Y530 HydrophobicContact CG-CE1 3.92Å; R495-Y530 HydrophobicContact CG-CE2 4.28Å; V498-Y530 HydrophobicContact CB-CD2 4.06Å; V498-Y530 HydrophobicContact CB-CE2 3.89Å; V498-Y530 HydrophobicContact CG1-CD2 3.75Å; V498-Y530 HydrophobicContact CG1-CE2 3.91Å; V498-Y530 HydrophobicContact CG2-CE2 4.47Å; V499-Y530 HydrophobicContact CG2-CD2 3.78Å; V499-Y530 HydrophobicContact CG2-CE2 4.5Å; V499-Y530 HydrophobicContact CG2-CG 3.81Å; Q502-Y530 PolarHBondContact NE2-O 3.35Å; A507-Y530 WeakPolarHBondContact CB-O 3.43Å; A507-Y530 PolarHBondContact N-O 2.93Å; L521-Y530 HydrophobicContact CB-CD1 3.91Å; L521-Y530 HydrophobicContact CB-CG 4.46Å; R522-Y530 WeakPolarHBondContact O-CA 3.37Å; H523-Y530 HydrophobicContact CB-CD1 4.23Å; H523-Y530 HydrophobicContact CB-CE1 3.79Å; H523-Y530 AromaticContact CD2-CE2 3.71Å; H523-Y530 AromaticContact CD2-CZ 3.91Å
531	F	93.8	Very high	93	Very high	1 Å²	1	38.2 Å²	38.2	0%	0.004	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	151	-174.8	-68	-102.9	0	0	0	110.4	P479 A507 G508 L521 R522 C524 L527 R529 C535 H536 S559	P479-F531 HydrophobicContact CG-CE1 4.46Å; P479-F531 HydrophobicContact CG-CZ 4.45Å; A507-F531 HydrophobicContact CB-CD1 4.37Å; A507-F531 HydrophobicContact CB-CD2 4.38Å; A507-F531 HydrophobicContact CB-CE1 3.89Å; A507-F531 HydrophobicContact CB-CE2 3.85Å; A507-F531 HydrophobicContact CB-CZ 3.57Å; G508-F531 VanDerWaalsContact CA-CE1 3.46Å; L521-F531 CarbonylContact C-O 3.6Å; L521-F531 VanDerWaalsContact CA-O 3.25Å; L521-F531 WeakPolarHBondContact CA-O 3.49Å; L521-F531 WeakPolarHBondContact CB-O 3.23Å; R522-F531 PolarHBondContact N-O 2.85Å; R522-F531 PolarHBondContact O-N 3.35Å; C524-F531 HydrophobicContact CB-CD2 3.71Å; C524-F531 HydrophobicContact CB-CE2 3.48Å; C524-F531 VanDerWaalsContact CB-CE2 3.48Å; C524-F531 HydrophobicContact CB-CZ 4.4Å; L527-F531 HydrophobicContact CD1-CE1 4.48Å; L527-F531 HydrophobicContact CD1-CE2 4.25Å; L527-F531 HydrophobicContact CD1-CZ 3.57Å; R529-F531 HydrophobicContact CB-CE2 4.04Å; R529-F531 WeakPolarHBondContact O-CD2 3.17Å; R529-F531 WeakPolarHBondContact O-CE2 3.3Å; F531-C535 HydrophobicContact CB-CB 4.36Å; F531-C535 HydrophobicContact CD1-CB 3.96Å; F531-H536 HydrophobicContact CB-CB 3.78Å; F531-S559 WeakPolarHBondContact CZ-OG 3.34Å
532	C	93.9	Very high	93.2	Very high	23 Å²	23	38.5 Å²	38.5	16%	0.155	22%	0.223	C	C	.	.			trans	-74	163.7	168.9	66.9	0	0	0	0	111	C506 L521 C534 C535 H536	C506-C532 HydrophobicContact CB-CB 4.36Å; C506-C532 PolarHBondContact SG-N 3.13Å; C506-C532 PolarHBondContact SG-SG 3.03Å; L521-C532 HydrophobicContact CD2-CB 4.3Å; C532-C534 PolarHBondContact O-N 2.97Å; C532-C534 VanDerWaalsContact O-N 3.16Å; C532-C535 PolarHBondContact O-N 3.24Å; C532-H536 PolarHBondContact O-N 3.16Å
533	D	93.3	Very high	93.2	Very high	71 Å²	71	34.9 Å²	34.9	38%	0.38	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-54.6	-34.9	179.9	-59.9	-84.2	0	0	0	112.8	R522 C535 H536	R522-D533 IonicContact CZ-OD1 3.29Å; R522-D533 IonicContact NE-OD1 3.71Å; R522-D533 PolarHBondContact NE-OD1 2.93Å; R522-D533 IonicContact NH2-OD1 2.92Å; R522-D533 PolarHBondContact NH2-OD1 3.45Å; D533-C535 VanDerWaalsContact C-N 3.25Å; D533-C535 PolarHBondContact O-N 3.31Å; D533-H536 CarbonylContact O-C 3.51Å; D533-H536 PolarHBondContact O-N 3.02Å
534	C	92.1	Very high	93.2	Very high	120 Å²	120	32.9 Å²	32.9	81%	0.811	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-69.6	-13.6	179.1	-51.6	0	0	0	0	115	C532	C532-C534 PolarHBondContact O-N 2.97Å; C532-C534 VanDerWaalsContact O-N 3.16Å
535	C	91.9	Very high	93.1	Very high	28 Å²	28	32.9 Å²	32.9	19%	0.189	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-116.5	4.8	177.4	-61.5	0	0	0	0	112.7	F531 C532 D533 S559 D560	F531-C535 HydrophobicContact CB-CB 4.36Å; F531-C535 HydrophobicContact CD1-CB 3.96Å; C532-C535 PolarHBondContact O-N 3.24Å; D533-C535 VanDerWaalsContact C-N 3.25Å; D533-C535 PolarHBondContact O-N 3.31Å; C535-S559 WeakPolarHBondContact O-CA 3.38Å; C535-S559 VanDerWaalsContact O-CB 3.27Å; C535-S559 WeakPolarHBondContact O-CB 3.35Å; C535-D560 PolarHBondContact O-N 3.37Å
536	H	95.8	Very high	93.1	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.009	20%	0.198	C	C	.	.			trans	-153	67.6	-174.3	-165.9	-38.4	0	0	0	110.9	R522 H523 F531 C532 D533 G538 S557 V558 D560	R522-H536 HydrophobicContact CB-CB 3.97Å; R522-H536 VanDerWaalsContact CB-CG 3.5Å; R522-H536 WeakPolarHBondContact CD-O 3.4Å; R522-H536 PolarHBondContact NE-O 3.14Å; R522-H536 PolarHBondContact NH1-O 3Å; H523-H536 PolarHBondContact O-NE2 3.12Å; H523-H536 VanDerWaalsContact O-NE2 3.16Å; F531-H536 HydrophobicContact CB-CB 3.78Å; C532-H536 PolarHBondContact O-N 3.16Å; D533-H536 CarbonylContact O-C 3.51Å; D533-H536 PolarHBondContact O-N 3.02Å; H536-G538 PolarHBondContact O-N 3.4Å; H536-S557 PolarHBondContact CE1-OG 3.1Å; H536-S557 PolarHBondContact NE2-OG 3.42Å; H536-V558 VanDerWaalsContact CE1-C 3.44Å; H536-V558 PolarHBondContact CE1-O 3.04Å; H536-V558 PolarHBondContact ND1-O 3.17Å; H536-V558 VanDerWaalsContact NE2-C 3.27Å; H536-V558 PolarHBondContact NE2-O 2.88Å; H536-D560 VanDerWaalsContact CA-OD2 3.26Å; H536-D560 WeakPolarHBondContact CA-OD2 3.33Å; H536-D560 PolarHBondContact N-OD2 3.46Å
537	S	94.1	Very high	93.2	Very high	76 Å²	76	32.3 Å²	32.3	53%	0.531	20%	0.197	S	C	.	.	S	Bend	trans	-47.3	-28.6	-179.3	67.2	0	0	0	0	115	R522 S539 D560	R522-S537 PolarHBondContact NH1-O 3.23Å; S537-S539 PolarHBondContact OG-N 3.36Å; S537-S539 PolarHBondContact OG-OG 2.85Å; S537-D560 WeakPolarHBondContact CB-OD1 3.43Å; S537-D560 PolarHBondContact N-OD1 2.86Å; S537-D560 PolarHBondContact N-OD2 3.04Å; S537-D560 PolarHBondContact OG-OD1 2.8Å
538	G	93.3	Very high	93.3	Very high	44 Å²	44	31.4 Å²	31.4	45%	0.454	19%	0.193	S	C	.	.	S	Bend	trans	127.9	-2.5	-172.6	0	0	0	0	0	112.5	H536	H536-G538 PolarHBondContact O-N 3.4Å
539	S	95.8	Very high	93.3	Very high	28 Å²	28	32.5 Å²	32.5	20%	0.196	20%	0.197	C	C	.	.			trans	-36	136.7	172.8	-69.5	0	0	0	0	114.8	S537 V558 D560	S537-S539 PolarHBondContact OG-N 3.36Å; S537-S539 PolarHBondContact OG-OG 2.85Å; S539-V558 PolarHBondContact O-N 2.91Å; S539-V558 VanDerWaalsContact O-O 3.09Å; S539-D560 WeakPolarHBondContact CB-OD1 3.21Å; S539-D560 PolarHBondContact OG-OD1 2.94Å
540	E	96.8	Very high	93.3	Very high	102 Å²	102	34.2 Å²	34.2	48%	0.477	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	146.9	170.5	-56	-169.1	135	0	0	112.5	R555 Y556 K563	E540-R555 HydrophobicContact CB-CB 4.02Å; E540-Y556 VanDerWaalsContact CA-O 3.25Å; E540-Y556 WeakPolarHBondContact CA-O 3.43Å; E540-K563 WeakPolarHBondContact O-CE 3.11Å; E540-K563 PolarHBondContact O-NZ 3.38Å
541	A	96.4	Very high	93.3	Very high	5 Å²	5	35 Å²	35	4%	0.041	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	163.3	174.8	0	0	0	0	0	111.6	R555 Y556 V558 K563 L566	A541-R555 WeakPolarHBondContact O-CA 3.37Å; A541-Y556 PolarHBondContact N-O 3.41Å; A541-Y556 PolarHBondContact O-N 3.43Å; A541-V558 HydrophobicContact CB-CG1 4.35Å; A541-V558 HydrophobicContact CB-CG2 3.73Å; A541-K563 HydrophobicContact CB-CD 4.22Å; A541-L566 HydrophobicContact CB-CB 4.39Å; A541-L566 HydrophobicContact CB-CD1 3.68Å
542	V	95.9	Very high	93.2	Very high	17 Å²	17	36.6 Å²	36.6	10%	0.103	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	133.2	166.1	173.5	0	0	0	0	108.1	V547 F553 R555 W570 M637	V542-V547 HydrophobicContact CG1-CG2 3.62Å; V542-F553 HydrophobicContact CG1-CB 4.22Å; V542-F553 HydrophobicContact CG1-CD1 4.28Å; V542-F553 WeakPolarHBondContact CG2-O 3.39Å; V542-R555 HydrophobicContact CG2-CG 4.18Å; V542-W570 HydrophobicContact CB-CH2 4.11Å; V542-W570 HydrophobicContact CB-CZ3 3.94Å; V542-W570 HydrophobicContact CG1-CH2 4.39Å; V542-W570 HydrophobicContact CG1-CZ3 4.38Å; V542-W570 HydrophobicContact CG2-CH2 4.4Å; V542-M637 HydrophobicContact CG1-CE 4.06Å
543	I	94.6	Very high	93.3	Very high	6 Å²	6	36.2 Å²	36.2	3%	0.031	22%	0.218	C	C	.	.			trans	-96.4	121	-173.1	-70.2	168.5	0	0	0	110.4	E525 Y526 G545 R546 V547 Y556	E525-I543 HydrophobicContact CB-CD1 3.55Å; Y526-I543 HydrophobicContact CD2-CG2 4.25Å; I543-G545 PolarHBondContact O-N 3.05Å; I543-R546 HydrophobicContact CB-CB 4.33Å; I543-R546 HydrophobicContact CB-CG 4.06Å; I543-R546 HydrophobicContact CG2-CB 4.4Å; I543-R546 HydrophobicContact CG2-CG 3.9Å; I543-R546 PolarHBondContact O-N 3.1Å; I543-V547 PolarHBondContact O-N 3.16Å; I543-Y556 HydrophobicContact CD1-CD2 4.09Å; I543-Y556 HydrophobicContact CD1-CG 4.02Å
544	P	93.3	Very high	93.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-52.7	-48.6	-177.6	-30	36	0	0	0	113.9	R546 V547 L548 L566 F575 M637	P544-R546 PolarHBondContact O-N 2.59Å; P544-R546 VanDerWaalsContact O-N 3.16Å; P544-V547 PolarHBondContact O-N 3.04Å; P544-V547 VanDerWaalsContact O-N 3.13Å; P544-L548 HydrophobicContact CB-CD1 4.3Å; P544-L548 WeakPolarHBondContact O-CB 3.37Å; P544-L548 WeakPolarHBondContact O-CD1 3.32Å; P544-L548 VanDerWaalsContact O-CG 3.22Å; P544-L548 WeakPolarHBondContact O-CG 3.2Å; P544-L548 PolarHBondContact O-N 2.92Å; P544-L566 VanDerWaalsContact CD-CD2 3.46Å; P544-L566 HydrophobicContact CG-CD2 3.64Å; P544-F575 HydrophobicContact CB-CE1 3.85Å; P544-F575 HydrophobicContact CB-CZ 4.07Å; P544-F575 HydrophobicContact CG-CZ 4.27Å; P544-M637 HydrophobicContact CB-CE 4.34Å; P544-M637 HydrophobicContact CB-SD 3.84Å; P544-M637 HydrophobicContact CG-CE 4.26Å; P544-M637 HydrophobicContact CG-CG 4.45Å; P544-M637 HydrophobicContact CG-SD 3.92Å
545	G	90.9	Very high	93.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60	-28	179.2	0	0	0	0	0	114.9	F485 I487 I543 S549	F485-G545 WeakPolarHBondContact O-CA 3.48Å; I487-G545 VanDerWaalsContact CG1-O 3.28Å; I487-G545 WeakPolarHBondContact CG1-O 3.16Å; I543-G545 PolarHBondContact O-N 3.05Å; G545-S549 WeakPolarHBondContact O-CB 3.16Å; G545-S549 PolarHBondContact O-N 3.06Å; G545-S549 PolarHBondContact O-OG 3.09Å
546	R	91.6	Very high	93.7	Very high	17 Å²	17	39.8 Å²	39.8	6%	0.064	22%	0.215	C	C	.	.	H	α-helix	trans	-75.1	-40.9	175.8	-64.8	-175.8	-169.4	-112.7	-2.3	111.8	I487 Q490 E525 I543 P544 N550 W551 D552 Y556	I487-R546 HydrophobicContact CD1-CG 4.18Å; I487-R546 HydrophobicContact CG1-CG 4.14Å; Q490-R546 VanDerWaalsContact CD-NH2 3.27Å; E525-R546 IonicContact OE2-NH2 2.65Å; E525-R546 PolarHBondContact OE2-NH2 2.91Å; I543-R546 HydrophobicContact CB-CB 4.33Å; I543-R546 HydrophobicContact CB-CG 4.06Å; I543-R546 HydrophobicContact CG2-CB 4.4Å; I543-R546 HydrophobicContact CG2-CG 3.9Å; I543-R546 PolarHBondContact O-N 3.1Å; P544-R546 PolarHBondContact O-N 2.59Å; P544-R546 VanDerWaalsContact O-N 3.16Å; R546-N550 WeakPolarHBondContact O-CA 3.34Å; R546-N550 WeakPolarHBondContact O-CB 3.47Å; R546-N550 PolarHBondContact O-N 3Å; R546-W551 PolarHBondContact O-N 3.26Å; R546-D552 HydrophobicContact CB-CB 4.37Å; R546-D552 PolarHBondContact O-N 3.35Å; R546-Y556 PolarHBondContact NH1-OH 2.8Å
547	V	93.4	Very high	93.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.6	-48.8	170.2	173.8	0	0	0	0	110.5	V542 I543 P544 S549 W551 D552 F553 M637 L640	V542-V547 HydrophobicContact CG1-CG2 3.62Å; I543-V547 PolarHBondContact O-N 3.16Å; P544-V547 PolarHBondContact O-N 3.04Å; P544-V547 VanDerWaalsContact O-N 3.13Å; V547-S549 PolarHBondContact O-N 3.3Å; V547-W551 HydrophobicContact CG1-CE3 4.06Å; V547-W551 HydrophobicContact CG1-CZ3 4.11Å; V547-W551 WeakPolarHBondContact O-CA 3.43Å; V547-W551 PolarHBondContact O-N 2.77Å; V547-D552 WeakPolarHBondContact CG2-O 3.05Å; V547-D552 PolarHBondContact N-O 3.47Å; V547-F553 HydrophobicContact CB-CE1 4.46Å; V547-F553 HydrophobicContact CB-CZ 4.45Å; V547-F553 HydrophobicContact CG1-CD1 4.39Å; V547-F553 HydrophobicContact CG1-CE1 3.72Å; V547-F553 HydrophobicContact CG1-CE2 3.91Å; V547-F553 HydrophobicContact CG1-CZ 3.45Å; V547-F553 VanDerWaalsContact CG1-CZ 3.45Å; V547-F553 HydrophobicContact CG2-CB 4.49Å; V547-F553 HydrophobicContact CG2-CD1 3.63Å; V547-F553 HydrophobicContact CG2-CD2 4.11Å; V547-F553 HydrophobicContact CG2-CE1 3.81Å; V547-F553 HydrophobicContact CG2-CE2 4.27Å; V547-F553 HydrophobicContact CG2-CG 3.79Å; V547-F553 HydrophobicContact CG2-CZ 4.14Å; V547-M637 HydrophobicContact CB-CE 4.02Å; V547-M637 HydrophobicContact CG1-CE 4.4Å; V547-M637 HydrophobicContact CG2-CE 3.68Å; V547-L640 HydrophobicContact CG1-CB 4.29Å; V547-L640 HydrophobicContact CG1-CD1 3.87Å
548	L	91.6	Very high	93.8	Very high	5 Å²	5	38.1 Å²	38.1	3%	0.026	20%	0.203	C	C	.	.	H	α-helix	trans	-68.1	-33.1	-173.6	-66.7	164.7	0	0	0	113.5	F485 P544 F575 L577 V580 L584 L640	F485-L548 HydrophobicContact CB-CD1 4.44Å; F485-L548 HydrophobicContact CD1-CD1 3.91Å; P544-L548 HydrophobicContact CB-CD1 4.3Å; P544-L548 WeakPolarHBondContact O-CB 3.37Å; P544-L548 WeakPolarHBondContact O-CD1 3.32Å; P544-L548 VanDerWaalsContact O-CG 3.22Å; P544-L548 WeakPolarHBondContact O-CG 3.2Å; P544-L548 PolarHBondContact O-N 2.92Å; L548-F575 HydrophobicContact CD1-CD1 3.71Å; L548-F575 HydrophobicContact CD1-CE1 4.04Å; L548-F575 HydrophobicContact CD2-CB 4.38Å; L548-F575 HydrophobicContact CD2-CD1 4.32Å; L548-L577 HydrophobicContact CD2-CD2 3.6Å; L548-V580 HydrophobicContact CD1-CG1 3.92Å; L548-L584 WeakPolarHBondContact O-CG 3.33Å; L548-L640 HydrophobicContact CD2-CD1 4.23Å
549	S	89	Confident	93.9	Very high	44 Å²	44	36 Å²	36	31%	0.308	18%	0.182	S	C	.	.	H	α-helix	trans	-90.3	-44.2	178.6	-47	0	0	0	0	112.8	G545 V547 K587	G545-S549 WeakPolarHBondContact O-CB 3.16Å; G545-S549 PolarHBondContact O-N 3.06Å; G545-S549 PolarHBondContact O-OG 3.09Å; V547-S549 PolarHBondContact O-N 3.3Å; S549-K587 PolarHBondContact O-NZ 3.46Å
550	N	88.8	Confident	93.8	Very high	102 Å²	102	36.2 Å²	36.2	55%	0.545	18%	0.181	S	C	.	.	H	α-helix	trans	-121.6	-0.8	-163.2	-66.4	-19.1	0	0	0	114.2	I487 R546 D552	I487-N550 WeakPolarHBondContact CD1-ND2 2.82Å; R546-N550 WeakPolarHBondContact O-CA 3.34Å; R546-N550 WeakPolarHBondContact O-CB 3.47Å; R546-N550 PolarHBondContact O-N 3Å; N550-D552 HydrophobicContact CB-CB 4.33Å; N550-D552 PolarHBondContact O-N 2.99Å
551	W	92.6	Very high	93.6	Very high	43 Å²	43	33.4 Å²	33.4	16%	0.163	17%	0.167	C	C	.	.			trans	57.2	27.7	-172.8	-154.6	-118.2	0	0	0	113.9	R546 V547 F553 L584 V588 L591 L640 V643 K644	R546-W551 PolarHBondContact O-N 3.26Å; V547-W551 HydrophobicContact CG1-CE3 4.06Å; V547-W551 HydrophobicContact CG1-CZ3 4.11Å; V547-W551 WeakPolarHBondContact O-CA 3.43Å; V547-W551 PolarHBondContact O-N 2.77Å; W551-F553 AromaticContact CD2-CE2 3.66Å; W551-F553 HydrophobicContact CD2-CE2 3.66Å; W551-F553 HydrophobicContact CD2-CZ 4.17Å; W551-F553 AromaticContact CE2-CE2 3.65Å; W551-F553 HydrophobicContact CE3-CE2 4.05Å; W551-F553 HydrophobicContact CE3-CZ 4.18Å; W551-F553 HydrophobicContact CG-CE2 4.02Å; W551-F553 HydrophobicContact CH2-CE2 4.42Å; W551-F553 AromaticContact CH2-CZ 3.99Å; W551-F553 HydrophobicContact CH2-CZ 3.99Å; W551-F553 HydrophobicContact CZ2-CE2 4.05Å; W551-F553 AromaticContact CZ2-CZ 3.94Å; W551-F553 HydrophobicContact CZ2-CZ 3.94Å; W551-F553 HydrophobicContact CZ3-CE2 4.41Å; W551-F553 HydrophobicContact CZ3-CZ 4.1Å; W551-F553 AromaticContact NE1-CE2 3.95Å; W551-F553 VanDerWaalsContact O-CD2 3.3Å; W551-F553 WeakPolarHBondContact O-CD2 3.44Å; W551-L584 HydrophobicContact CB-CD2 4.17Å; W551-L584 HydrophobicContact CD2-CD2 4.45Å; W551-L584 HydrophobicContact CE3-CD1 3.7Å; W551-L584 HydrophobicContact CE3-CD2 3.78Å; W551-L584 HydrophobicContact CE3-CG 4.3Å; W551-L584 HydrophobicContact CZ3-CD1 3.75Å; W551-V588 HydrophobicContact CB-CG2 4.18Å; W551-V588 HydrophobicContact CD2-CG1 4.29Å; W551-V588 HydrophobicContact CD2-CG2 3.57Å; W551-V588 HydrophobicContact CE3-CG2 4.05Å; W551-V588 HydrophobicContact CG-CG2 3.63Å; W551-V588 HydrophobicContact CZ2-CG1 3.79Å; W551-V588 HydrophobicContact CZ2-CG2 4.48Å; W551-L591 HydrophobicContact CH2-CD1 4.3Å; W551-L640 HydrophobicContact CH2-CB 4.01Å; W551-L640 HydrophobicContact CH2-CD2 4.05Å; W551-L640 HydrophobicContact CZ3-CB 4.22Å; W551-L640 HydrophobicContact CZ3-CD2 4.07Å; W551-V643 HydrophobicContact CH2-CB 4.36Å; W551-V643 HydrophobicContact CH2-CG1 4.25Å; W551-V643 HydrophobicContact CZ2-CB 4.23Å; W551-V643 HydrophobicContact CZ2-CG1 3.92Å; W551-K644 HydrophobicContact CZ2-CB 4.31Å
552	D	92.8	Very high	93.5	Very high	35 Å²	35	33.2 Å²	33.2	19%	0.187	17%	0.165	C	C	.	.			trans	-93.8	116.3	-177.4	173.9	33.7	0	0	0	111.5	R546 V547 N550 S554 Y556	R546-D552 HydrophobicContact CB-CB 4.37Å; R546-D552 PolarHBondContact O-N 3.35Å; V547-D552 WeakPolarHBondContact CG2-O 3.05Å; V547-D552 PolarHBondContact N-O 3.47Å; N550-D552 HydrophobicContact CB-CB 4.33Å; N550-D552 PolarHBondContact O-N 2.99Å; D552-S554 WeakPolarHBondContact OD1-CB 3.46Å; D552-S554 PolarHBondContact OD1-N 2.76Å; D552-S554 PolarHBondContact OD1-OG 3.35Å; D552-Y556 WeakPolarHBondContact OD2-CE2 3.33Å; D552-Y556 PolarHBondContact OD2-OH 3.11Å
553	F	95.1	Very high	93.5	Very high	15 Å²	15	35 Å²	35	7%	0.066	17%	0.171	C	C	.	.			trans	-108.9	25.4	176.9	-57.6	-110.8	0	0	0	111.5	V542 V547 W551 L640 Y641 K644	V542-F553 HydrophobicContact CG1-CB 4.22Å; V542-F553 HydrophobicContact CG1-CD1 4.28Å; V542-F553 WeakPolarHBondContact CG2-O 3.39Å; V547-F553 HydrophobicContact CB-CE1 4.46Å; V547-F553 HydrophobicContact CB-CZ 4.45Å; V547-F553 HydrophobicContact CG1-CD1 4.39Å; V547-F553 HydrophobicContact CG1-CE1 3.72Å; V547-F553 HydrophobicContact CG1-CE2 3.91Å; V547-F553 HydrophobicContact CG1-CZ 3.45Å; V547-F553 VanDerWaalsContact CG1-CZ 3.45Å; V547-F553 HydrophobicContact CG2-CB 4.49Å; V547-F553 HydrophobicContact CG2-CD1 3.63Å; V547-F553 HydrophobicContact CG2-CD2 4.11Å; V547-F553 HydrophobicContact CG2-CE1 3.81Å; V547-F553 HydrophobicContact CG2-CE2 4.27Å; V547-F553 HydrophobicContact CG2-CG 3.79Å; V547-F553 HydrophobicContact CG2-CZ 4.14Å; W551-F553 AromaticContact CD2-CE2 3.66Å; W551-F553 HydrophobicContact CD2-CE2 3.66Å; W551-F553 HydrophobicContact CD2-CZ 4.17Å; W551-F553 AromaticContact CE2-CE2 3.65Å; W551-F553 HydrophobicContact CE3-CE2 4.05Å; W551-F553 HydrophobicContact CE3-CZ 4.18Å; W551-F553 HydrophobicContact CG-CE2 4.02Å; W551-F553 HydrophobicContact CH2-CE2 4.42Å; W551-F553 AromaticContact CH2-CZ 3.99Å; W551-F553 HydrophobicContact CH2-CZ 3.99Å; W551-F553 HydrophobicContact CZ2-CE2 4.05Å; W551-F553 AromaticContact CZ2-CZ 3.94Å; W551-F553 HydrophobicContact CZ2-CZ 3.94Å; W551-F553 HydrophobicContact CZ3-CE2 4.41Å; W551-F553 HydrophobicContact CZ3-CZ 4.1Å; W551-F553 AromaticContact NE1-CE2 3.95Å; W551-F553 VanDerWaalsContact O-CD2 3.3Å; W551-F553 WeakPolarHBondContact O-CD2 3.44Å; F553-L640 HydrophobicContact CE1-CB 4.03Å; F553-L640 HydrophobicContact CZ-CB 3.99Å; F553-L640 WeakPolarHBondContact CZ-O 3.43Å; F553-Y641 AromaticContact CD1-CD2 3.87Å; F553-Y641 HydrophobicContact CD1-CD2 3.87Å; F553-Y641 HydrophobicContact CD1-CG 4.48Å; F553-Y641 HydrophobicContact CE1-CD2 4.33Å; F553-Y641 HydrophobicContact CG-CD2 4.43Å; F553-K644 HydrophobicContact CB-CD 4.22Å; F553-K644 HydrophobicContact CD2-CB 4.36Å; F553-K644 HydrophobicContact CD2-CD 3.47Å; F553-K644 VanDerWaalsContact CD2-CD 3.47Å; F553-K644 HydrophobicContact CD2-CG 3.89Å; F553-K644 HydrophobicContact CE2-CB 3.88Å; F553-K644 HydrophobicContact CE2-CD 3.86Å; F553-K644 HydrophobicContact CE2-CG 3.73Å; F553-K644 HydrophobicContact CG-CD 3.88Å; F553-K644 HydrophobicContact CZ-CB 3.98Å; F553-K644 HydrophobicContact CZ-CG 4.35Å
554	S	95.5	Very high	93.5	Very high	58 Å²	58	41.1 Å²	41.1	41%	0.406	20%	0.2	S	C	.	.			trans	-62.7	149.9	169.2	-56.2	0	0	0	0	109.9	D552 Y556	D552-S554 WeakPolarHBondContact OD1-CB 3.46Å; D552-S554 PolarHBondContact OD1-N 2.76Å; D552-S554 PolarHBondContact OD1-OG 3.35Å; S554-Y556 WeakPolarHBondContact O-CD2 3.5Å
555	R	95.4	Very high	93.5	Very high	178 Å²	178	41.4 Å²	41.4	67%	0.672	20%	0.201	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	144.4	172.8	-74.7	-175.7	178	171.6	-1.2	109.7	E540 A541 V542	E540-R555 HydrophobicContact CB-CB 4.02Å; A541-R555 WeakPolarHBondContact O-CA 3.37Å; V542-R555 HydrophobicContact CG2-CG 4.18Å
556	Y	95.1	Very high	93.7	Very high	58 Å²	58	41.6 Å²	41.6	23%	0.227	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	145	-176.2	-73.5	-80.4	0	0	0	111.1	E525 E540 A541 I543 R546 D552 S554 V558	E525-Y556 HydrophobicContact CB-CG 4.48Å; E525-Y556 HydrophobicContact CG-CD1 4.24Å; E540-Y556 VanDerWaalsContact CA-O 3.25Å; E540-Y556 WeakPolarHBondContact CA-O 3.43Å; A541-Y556 PolarHBondContact N-O 3.41Å; A541-Y556 PolarHBondContact O-N 3.43Å; I543-Y556 HydrophobicContact CD1-CD2 4.09Å; I543-Y556 HydrophobicContact CD1-CG 4.02Å; R546-Y556 PolarHBondContact NH1-OH 2.8Å; D552-Y556 WeakPolarHBondContact OD2-CE2 3.33Å; D552-Y556 PolarHBondContact OD2-OH 3.11Å; S554-Y556 WeakPolarHBondContact O-CD2 3.5Å; Y556-V558 PolarHBondContact O-N 3.49Å
557	S	95.7	Very high	93.8	Very high	43 Å²	43	44.6 Å²	44.6	30%	0.301	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-49.4	119.5	171.2	176.8	0	0	0	0	111.8	H523 E525 H536	H523-S557 PolarHBondContact O-OG 3.41Å; E525-S557 WeakPolarHBondContact CB-O 3.35Å; E525-S557 PolarHBondContact N-O 2.74Å; H536-S557 PolarHBondContact CE1-OG 3.1Å; H536-S557 PolarHBondContact NE2-OG 3.42Å
558	V	95.9	Very high	93.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.242	C	C	.	.			trans	-135.3	149.8	176.9	-69.1	0	0	0	0	111.5	H536 S539 A541 Y556 K563	H536-V558 VanDerWaalsContact CE1-C 3.44Å; H536-V558 PolarHBondContact CE1-O 3.04Å; H536-V558 PolarHBondContact ND1-O 3.17Å; H536-V558 VanDerWaalsContact NE2-C 3.27Å; H536-V558 PolarHBondContact NE2-O 2.88Å; S539-V558 PolarHBondContact O-N 2.91Å; S539-V558 VanDerWaalsContact O-O 3.09Å; A541-V558 HydrophobicContact CB-CG1 4.35Å; A541-V558 HydrophobicContact CB-CG2 3.73Å; Y556-V558 PolarHBondContact O-N 3.49Å; V558-K563 HydrophobicContact CG2-CB 4.04Å
559	S	95.3	Very high	93.9	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.244	C	C	.	.			trans	-66	155.1	170.7	52.9	0	0	0	0	111	C524 F531 C535 F561 S562 K563	C524-S559 PolarHBondContact SG-N 2.87Å; C524-S559 PolarHBondContact SG-OG 3.4Å; C524-S559 VanDerWaalsContact SG-OG 3.39Å; F531-S559 WeakPolarHBondContact CZ-OG 3.34Å; C535-S559 WeakPolarHBondContact O-CA 3.38Å; C535-S559 VanDerWaalsContact O-CB 3.27Å; C535-S559 WeakPolarHBondContact O-CB 3.35Å; S559-F561 VanDerWaalsContact C-N 3.25Å; S559-F561 PolarHBondContact O-N 2.95Å; S559-S562 CarbonylContact O-C 3.6Å; S559-S562 WeakPolarHBondContact O-CA 3.47Å; S559-S562 WeakPolarHBondContact O-CB 3.49Å; S559-S562 PolarHBondContact O-N 3.16Å; S559-S562 PolarHBondContact OG-OG 3.26Å; S559-K563 PolarHBondContact O-N 3.23Å
560	D	94.7	Very high	94.1	Very high	33 Å²	33	48.9 Å²	48.9	18%	0.176	24%	0.24	C	C	.	.	H	α-helix	trans	-67.3	-29.6	-170.8	-56.3	-54.4	0	0	0	112.2	C535 H536 S537 S539 K563 Q564	C535-D560 PolarHBondContact O-N 3.37Å; H536-D560 VanDerWaalsContact CA-OD2 3.26Å; H536-D560 WeakPolarHBondContact CA-OD2 3.33Å; H536-D560 PolarHBondContact N-OD2 3.46Å; S537-D560 WeakPolarHBondContact CB-OD1 3.43Å; S537-D560 PolarHBondContact N-OD1 2.86Å; S537-D560 PolarHBondContact N-OD2 3.04Å; S537-D560 PolarHBondContact OG-OD1 2.8Å; S539-D560 WeakPolarHBondContact CB-OD1 3.21Å; S539-D560 PolarHBondContact OG-OD1 2.94Å; D560-K563 PolarHBondContact O-N 3.28Å; D560-Q564 VanDerWaalsContact O-CG 3.31Å; D560-Q564 WeakPolarHBondContact O-CG 3.43Å; D560-Q564 PolarHBondContact O-N 3.35Å
561	F	92.9	Very high	94.4	Very high	43 Å²	43	47.9 Å²	47.9	19%	0.189	24%	0.241	C	C	.	.	H	α-helix	trans	-57.2	-49.4	166.8	172	-89.1	0	0	0	111.8	P479 S480 F481 S559 K563 Q564 L565	P479-F561 HydrophobicContact CB-CD1 3.87Å; P479-F561 HydrophobicContact CB-CE1 3.62Å; P479-F561 HydrophobicContact CB-CZ 4.15Å; P479-F561 HydrophobicContact CG-CD1 4.32Å; P479-F561 WeakPolarHBondContact O-CZ 3.29Å; S480-F561 WeakPolarHBondContact O-CZ 3.39Å; F481-F561 HydrophobicContact CD1-CE2 4.06Å; F481-F561 HydrophobicContact CD1-CZ 4Å; F481-F561 HydrophobicContact CD2-CE2 4.28Å; F481-F561 HydrophobicContact CD2-CZ 4.34Å; F481-F561 AromaticContact CE1-CE2 3.65Å; F481-F561 HydrophobicContact CE1-CE2 3.65Å; F481-F561 HydrophobicContact CE1-CZ 4.08Å; F481-F561 AromaticContact CE2-CE2 3.9Å; F481-F561 HydrophobicContact CE2-CE2 3.9Å; F481-F561 HydrophobicContact CE2-CZ 4.42Å; F481-F561 HydrophobicContact CG-CE2 4.36Å; F481-F561 HydrophobicContact CG-CZ 4.14Å; F481-F561 HydrophobicContact CZ-CD2 4.45Å; F481-F561 AromaticContact CZ-CE2 3.57Å; F481-F561 HydrophobicContact CZ-CE2 3.57Å; F481-F561 HydrophobicContact CZ-CZ 4.3Å; S559-F561 VanDerWaalsContact C-N 3.25Å; S559-F561 PolarHBondContact O-N 2.95Å; F561-K563 VanDerWaalsContact C-N 3.33Å; F561-K563 PolarHBondContact O-N 3.19Å; F561-Q564 PolarHBondContact O-N 3.4Å; F561-L565 HydrophobicContact CE1-CD2 4.2Å; F561-L565 WeakPolarHBondContact O-CB 3.22Å; F561-L565 PolarHBondContact O-N 2.74Å
562	S	93.9	Very high	94.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-68.7	-33.8	-179.4	-62.9	0	0	0	0	111.7	C524 L527 S559 L566	C524-S562 PolarHBondContact SG-OG 3.08Å; L527-S562 VanDerWaalsContact CD1-OG 3.22Å; L527-S562 WeakPolarHBondContact CD1-OG 3.48Å; L527-S562 WeakPolarHBondContact CG-OG 3.42Å; S559-S562 CarbonylContact O-C 3.6Å; S559-S562 WeakPolarHBondContact O-CA 3.47Å; S559-S562 WeakPolarHBondContact O-CB 3.49Å; S559-S562 PolarHBondContact O-N 3.16Å; S559-S562 PolarHBondContact OG-OG 3.26Å; S562-L566 VanDerWaalsContact O-CB 3.28Å; S562-L566 WeakPolarHBondContact O-CB 3.5Å; S562-L566 WeakPolarHBondContact O-CG 3.11Å; S562-L566 PolarHBondContact O-N 2.98Å
563	K	95.5	Very high	94.5	Very high	55 Å²	55	50.1 Å²	50.1	24%	0.239	26%	0.256	C	S	.	.	H	α-helix	trans	-60.2	-52.1	171.1	179.7	55.5	175.9	153.1	0	111.3	E540 A541 V558 S559 D560 F561 L565 L566 D567	E540-K563 WeakPolarHBondContact O-CE 3.11Å; E540-K563 PolarHBondContact O-NZ 3.38Å; A541-K563 HydrophobicContact CB-CD 4.22Å; V558-K563 HydrophobicContact CG2-CB 4.04Å; S559-K563 PolarHBondContact O-N 3.23Å; D560-K563 PolarHBondContact O-N 3.28Å; F561-K563 VanDerWaalsContact C-N 3.33Å; F561-K563 PolarHBondContact O-N 3.19Å; K563-L565 PolarHBondContact O-N 3.16Å; K563-L566 PolarHBondContact O-N 3.01Å; K563-D567 WeakPolarHBondContact CD-OD2 3.28Å; K563-D567 WeakPolarHBondContact CE-OD2 3.09Å; K563-D567 IonicContact NZ-OD1 2.77Å; K563-D567 PolarHBondContact NZ-OD1 3.21Å; K563-D567 IonicContact NZ-OD2 3.31Å; K563-D567 PolarHBondContact NZ-OD2 3.18Å; K563-D567 WeakPolarHBondContact O-CB 3.44Å; K563-D567 VanDerWaalsContact O-CG 3.28Å; K563-D567 PolarHBondContact O-N 3Å
564	Q	94.7	Very high	94.3	Very high	134 Å²	134	52.7 Å²	52.7	63%	0.626	27%	0.27	S	S	*	.	H	α-helix	trans	-59.7	-44.8	178	-73	171.8	-1.7	0	0	112.5	D560 F561 S568	D560-Q564 VanDerWaalsContact O-CG 3.31Å; D560-Q564 WeakPolarHBondContact O-CG 3.43Å; D560-Q564 PolarHBondContact O-N 3.35Å; F561-Q564 PolarHBondContact O-N 3.4Å; Q564-S568 VanDerWaalsContact O-CB 3.32Å; Q564-S568 WeakPolarHBondContact O-CB 3.19Å; Q564-S568 PolarHBondContact O-N 3.48Å; Q564-S568 PolarHBondContact O-OG 3.12Å
565	L	92.7	Very high	94.1	Very high	6 Å²	6	50 Å²	50	3%	0.031	25%	0.251	C	S	.	.	H	α-helix	trans	-59	-54.5	175.4	172.8	60.6	0	0	0	111.3	F481 Y526 F561 K563 D567 S568 V569	F481-L565 HydrophobicContact CD1-CD1 4.24Å; Y526-L565 HydrophobicContact CE1-CD2 4.03Å; F561-L565 HydrophobicContact CE1-CD2 4.2Å; F561-L565 WeakPolarHBondContact O-CB 3.22Å; F561-L565 PolarHBondContact O-N 2.74Å; K563-L565 PolarHBondContact O-N 3.16Å; L565-D567 VanDerWaalsContact C-N 3.33Å; L565-D567 PolarHBondContact O-N 2.86Å; L565-S568 PolarHBondContact O-N 3.39Å; L565-S568 VanDerWaalsContact O-N 3.16Å; L565-S568 PolarHBondContact O-OG 2.81Å; L565-V569 HydrophobicContact CD1-CG1 4.28Å; L565-V569 WeakPolarHBondContact O-CG2 3.26Å; L565-V569 PolarHBondContact O-N 3.39Å
566	L	94.7	Very high	93.8	Very high	5 Å²	5	43.2 Å²	43.2	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-64	-36.2	-175.8	-71.7	174.5	0	0	0	112.8	Y526 A541 P544 S562 K563 W570	Y526-L566 HydrophobicContact CD2-CD1 4.14Å; Y526-L566 HydrophobicContact CD2-CD2 4.21Å; Y526-L566 HydrophobicContact CE2-CD2 3.9Å; Y526-L566 HydrophobicContact CG-CD1 4.12Å; A541-L566 HydrophobicContact CB-CB 4.39Å; A541-L566 HydrophobicContact CB-CD1 3.68Å; P544-L566 VanDerWaalsContact CD-CD2 3.46Å; P544-L566 HydrophobicContact CG-CD2 3.64Å; S562-L566 VanDerWaalsContact O-CB 3.28Å; S562-L566 WeakPolarHBondContact O-CB 3.5Å; S562-L566 WeakPolarHBondContact O-CG 3.11Å; S562-L566 PolarHBondContact O-N 2.98Å; K563-L566 PolarHBondContact O-N 3.01Å; L566-W570 PolarHBondContact O-N 2.93Å
567	D	94.9	Very high	93.5	Very high	79 Å²	79	40.4 Å²	40.4	42%	0.422	22%	0.217	S	C	.	.	H	α-helix	trans	-69.2	-40.8	174.2	-68.9	-15.1	0	0	0	111.3	K563 L565 V569 W570	K563-D567 WeakPolarHBondContact CD-OD2 3.28Å; K563-D567 WeakPolarHBondContact CE-OD2 3.09Å; K563-D567 IonicContact NZ-OD1 2.77Å; K563-D567 PolarHBondContact NZ-OD1 3.21Å; K563-D567 IonicContact NZ-OD2 3.31Å; K563-D567 PolarHBondContact NZ-OD2 3.18Å; K563-D567 WeakPolarHBondContact O-CB 3.44Å; K563-D567 VanDerWaalsContact O-CG 3.28Å; K563-D567 PolarHBondContact O-N 3Å; L565-D567 VanDerWaalsContact C-N 3.33Å; L565-D567 PolarHBondContact O-N 2.86Å; D567-V569 VanDerWaalsContact C-N 3.26Å; D567-V569 PolarHBondContact O-N 2.9Å; D567-W570 WeakPolarHBondContact O-CB 3.46Å; D567-W570 PolarHBondContact O-N 3.16Å
568	S	93.6	Very high	93	Very high	68 Å²	68	41.8 Å²	41.8	48%	0.476	23%	0.227	S	C	.	.	H	α-helix	trans	-63.9	-28.2	179.9	78.3	0	0	0	0	113.9	Q564 L565 Q572	Q564-S568 VanDerWaalsContact O-CB 3.32Å; Q564-S568 WeakPolarHBondContact O-CB 3.19Å; Q564-S568 PolarHBondContact O-N 3.48Å; Q564-S568 PolarHBondContact O-OG 3.12Å; L565-S568 PolarHBondContact O-N 3.39Å; L565-S568 VanDerWaalsContact O-N 3.16Å; L565-S568 PolarHBondContact O-OG 2.81Å; S568-Q572 PolarHBondContact O-NE2 3.13Å
569	V	92.9	Very high	92.4	Very high	11 Å²	11	45 Å²	45	7%	0.067	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	0.2	-179.8	-54.4	0	0	0	0	113.5	I483 L565 D567 S571 Q572 L574	I483-V569 HydrophobicContact CD1-CB 4.06Å; I483-V569 HydrophobicContact CD1-CG1 4.13Å; I483-V569 HydrophobicContact CD1-CG2 3.9Å; L565-V569 HydrophobicContact CD1-CG1 4.28Å; L565-V569 WeakPolarHBondContact O-CG2 3.26Å; L565-V569 PolarHBondContact O-N 3.39Å; D567-V569 VanDerWaalsContact C-N 3.26Å; D567-V569 PolarHBondContact O-N 2.9Å; V569-S571 VanDerWaalsContact C-N 3.33Å; V569-S571 PolarHBondContact O-N 2.91Å; V569-Q572 PolarHBondContact O-N 3.23Å; V569-Q572 VanDerWaalsContact O-N 3.09Å; V569-L574 HydrophobicContact CB-CD1 4.07Å; V569-L574 HydrophobicContact CG1-CD1 4.33Å
570	W	94.4	Very high	91.7	Very high	61 Å²	61	47.9 Å²	47.9	23%	0.231	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-43	-171.5	-176.4	-100.2	0	0	0	113.8	V542 L566 D567 M637 E638 Y641	V542-W570 HydrophobicContact CB-CH2 4.11Å; V542-W570 HydrophobicContact CB-CZ3 3.94Å; V542-W570 HydrophobicContact CG1-CH2 4.39Å; V542-W570 HydrophobicContact CG1-CZ3 4.38Å; V542-W570 HydrophobicContact CG2-CH2 4.4Å; L566-W570 PolarHBondContact O-N 2.93Å; D567-W570 WeakPolarHBondContact O-CB 3.46Å; D567-W570 PolarHBondContact O-N 3.16Å; W570-M637 HydrophobicContact CD2-CB 3.74Å; W570-M637 HydrophobicContact CE3-CB 3.43Å; W570-M637 VanDerWaalsContact CE3-CB 3.43Å; W570-M637 HydrophobicContact CE3-CG 4.04Å; W570-M637 HydrophobicContact CG-CB 4.45Å; W570-M637 HydrophobicContact CH2-CB 3.89Å; W570-M637 HydrophobicContact CH2-CE 4.5Å; W570-M637 HydrophobicContact CZ2-CB 4.18Å; W570-M637 HydrophobicContact CZ3-CB 3.5Å; W570-M637 HydrophobicContact CZ3-CE 4.09Å; W570-M637 HydrophobicContact CZ3-CG 4.1Å; W570-M637 WeakPolarHBondContact O-CB 3.36Å; W570-M637 PolarHBondContact O-N 3.12Å; W570-E638 PolarHBondContact NE1-OE2 3.39Å; W570-E638 PolarHBondContact O-N 3.4Å; W570-E638 VanDerWaalsContact O-N 3.08Å; W570-Y641 HydrophobicContact CZ2-CD1 4.32Å; W570-Y641 HydrophobicContact CZ2-CG 4.36Å
571	S	94.2	Very high	90.9	Very high	80 Å²	80	46.3 Å²	46.3	56%	0.559	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	1.6	179.8	53.7	0	0	0	0	114.1	V569 S636	V569-S571 VanDerWaalsContact C-N 3.33Å; V569-S571 PolarHBondContact O-N 2.91Å; S571-S636 VanDerWaalsContact C-CB 3.47Å
572	Q	93.5	Very high	90.4	Very high	81 Å²	81	51.3 Å²	51.3	38%	0.379	28%	0.28	S	S	.	.	S	Bend	trans	-84.1	131.7	-177.6	-61.2	-172.8	31.2	0	0	110.8	S568 V569 L574 S636	S568-Q572 PolarHBondContact O-NE2 3.13Å; V569-Q572 PolarHBondContact O-N 3.23Å; V569-Q572 VanDerWaalsContact O-N 3.09Å; Q572-L574 HydrophobicContact CB-CD1 3.73Å; Q572-L574 HydrophobicContact CB-CD2 4.33Å; Q572-L574 HydrophobicContact CB-CG 3.73Å; Q572-L574 PolarHBondContact O-N 3.4Å; Q572-S636 VanDerWaalsContact O-CA 3.26Å; Q572-S636 WeakPolarHBondContact O-CA 3.46Å; Q572-S636 WeakPolarHBondContact O-CB 3.46Å
573	P	93.2	Very high	90	Very high	44 Å²	44	53.7 Å²	53.7	29%	0.286	30%	0.3	S	S	.	.			trans	-78.5	86.3	-179.9	31.8	-34.5	0	0	0	110.9	H627 L634 F635	P573-H627 HydrophobicContact CB-CB 4.04Å; P573-H627 HydrophobicContact CG-CB 4.12Å; P573-L634 HydrophobicContact CB-CB 4.02Å; P573-L634 WeakPolarHBondContact O-CD1 3.37Å; P573-F635 CarbonylContact C-O 3.6Å; P573-F635 WeakPolarHBondContact CA-O 3.26Å
574	L	91.3	Very high	89.6	Confident	70 Å²	70	51 Å²	51	37%	0.366	29%	0.289	S	S	.	.			trans	-118.5	-10.2	-171.5	-58.8	177	0	0	0	113.8	I483 V569 Q572 F635	I483-L574 HydrophobicContact CD1-CB 4.5Å; I483-L574 HydrophobicContact CD1-CD1 3.4Å; I483-L574 VanDerWaalsContact CD1-CD1 3.4Å; V569-L574 HydrophobicContact CB-CD1 4.07Å; V569-L574 HydrophobicContact CG1-CD1 4.33Å; Q572-L574 HydrophobicContact CB-CD1 3.73Å; Q572-L574 HydrophobicContact CB-CD2 4.33Å; Q572-L574 HydrophobicContact CB-CG 3.73Å; Q572-L574 PolarHBondContact O-N 3.4Å; L574-F635 PolarHBondContact N-O 3.31Å
575	F	91.2	Very high	89.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	97	-170.7	-54.1	-77.4	0	0	0	111.5	I483 F485 P544 L548 L577 F635 M637	I483-F575 HydrophobicContact CD1-CZ 4.47Å; I483-F575 HydrophobicContact CG2-CE1 4.08Å; I483-F575 HydrophobicContact CG2-CZ 4.39Å; F485-F575 AromaticContact CD1-CD1 3.93Å; F485-F575 HydrophobicContact CD1-CD1 3.93Å; F485-F575 AromaticContact CD1-CE1 3.83Å; F485-F575 HydrophobicContact CD1-CE1 3.83Å; F485-F575 AromaticContact CE1-CD1 3.64Å; F485-F575 HydrophobicContact CE1-CD1 3.64Å; F485-F575 AromaticContact CE1-CE1 3.53Å; F485-F575 HydrophobicContact CE1-CE1 3.53Å; P544-F575 HydrophobicContact CB-CE1 3.85Å; P544-F575 HydrophobicContact CB-CZ 4.07Å; P544-F575 HydrophobicContact CG-CZ 4.27Å; L548-F575 HydrophobicContact CD1-CD1 3.71Å; L548-F575 HydrophobicContact CD1-CE1 4.04Å; L548-F575 HydrophobicContact CD2-CB 4.38Å; L548-F575 HydrophobicContact CD2-CD1 4.32Å; F575-L577 PolarHBondContact O-N 3.22Å; F575-F635 HydrophobicContact CB-CB 4.49Å; F575-F635 WeakPolarHBondContact CB-O 3.38Å; F575-F635 VanDerWaalsContact CD2-O 3.26Å; F575-F635 WeakPolarHBondContact CD2-O 3.33Å; F575-F635 PolarHBondContact N-O 3.15Å; F575-F635 PolarHBondContact O-N 3.03Å; F575-M637 HydrophobicContact CD2-CG 4.47Å; F575-M637 HydrophobicContact CD2-SD 4.24Å; F575-M637 HydrophobicContact CE1-SD 4.29Å; F575-M637 HydrophobicContact CE2-CG 3.57Å; F575-M637 HydrophobicContact CE2-SD 3.67Å; F575-M637 HydrophobicContact CZ-CG 3.86Å; F575-M637 HydrophobicContact CZ-SD 3.68Å
576	D	90.6	Very high	88.9	Confident	36 Å²	36	51.1 Å²	51.1	19%	0.193	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	112.8	162.8	170.4	39	0	0	0	110.1	S578 S579 V580 L634	D576-S578 PolarHBondContact O-N 2.91Å; D576-S578 WeakPolarHBondContact OD1-CA 3.18Å; D576-S578 WeakPolarHBondContact OD1-CB 3.18Å; D576-S578 PolarHBondContact OD1-N 3.29Å; D576-S578 PolarHBondContact OD1-OG 2.66Å; D576-S578 WeakPolarHBondContact OD2-CB 3.26Å; D576-S579 PolarHBondContact O-OG 3.16Å; D576-S579 WeakPolarHBondContact OD2-CB 3.21Å; D576-S579 PolarHBondContact OD2-N 3.08Å; D576-S579 PolarHBondContact OD2-OG 2.73Å; D576-V580 PolarHBondContact O-N 3.11Å; D576-L634 HydrophobicContact CB-CD2 3.74Å
577	L	87.9	Confident	88.6	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-9.2	176.8	-54.7	-176.4	0	0	0	112.8	L548 F575 G581 K582 L584 W585 L591 F635 L640	L548-L577 HydrophobicContact CD2-CD2 3.6Å; F575-L577 PolarHBondContact O-N 3.22Å; L577-G581 CarbonylContact O-C 3.59Å; L577-G581 PolarHBondContact O-N 2.87Å; L577-K582 WeakPolarHBondContact O-CA 3.18Å; L577-K582 PolarHBondContact O-N 2.91Å; L577-K582 VanDerWaalsContact O-N 3.11Å; L577-L584 HydrophobicContact CD2-CD1 4.25Å; L577-W585 HydrophobicContact CB-CZ2 3.87Å; L577-W585 HydrophobicContact CD1-CZ2 4.17Å; L577-W585 PolarHBondContact O-NE1 2.77Å; L577-L591 HydrophobicContact CD1-CD1 3.7Å; L577-L591 HydrophobicContact CD1-CD2 3.65Å; L577-L591 HydrophobicContact CD1-CG 4.2Å; L577-F635 HydrophobicContact CD1-CD2 3.61Å; L577-F635 HydrophobicContact CD1-CE2 3.56Å; L577-F635 HydrophobicContact CD1-CG 4.23Å; L577-F635 HydrophobicContact CD1-CZ 4.17Å; L577-F635 HydrophobicContact CG-CD2 3.7Å; L577-F635 HydrophobicContact CG-CE2 4Å; L577-F635 HydrophobicContact CG-CG 4.49Å; L577-L640 HydrophobicContact CD1-CD2 3.88Å; L577-L640 HydrophobicContact CD2-CD2 4.33Å
578	S	85.9	Confident	88.5	Confident	72 Å²	72	53.4 Å²	53.4	50%	0.503	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-30	176.2	-34.8	0	0	0	0	112.1	D576 K582	D576-S578 PolarHBondContact O-N 2.91Å; D576-S578 WeakPolarHBondContact OD1-CA 3.18Å; D576-S578 WeakPolarHBondContact OD1-CB 3.18Å; D576-S578 PolarHBondContact OD1-N 3.29Å; D576-S578 PolarHBondContact OD1-OG 2.66Å; D576-S578 WeakPolarHBondContact OD2-CB 3.26Å; S578-K582 WeakPolarHBondContact O-CE 3.37Å; S578-K582 WeakPolarHBondContact O-CG 3.29Å
579	S	83.3	Confident	88.4	Confident	68 Å²	68	58.8 Å²	58.8	48%	0.476	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-58	174.8	51.5	0	0	0	0	111.9	D576	D576-S579 PolarHBondContact O-OG 3.16Å; D576-S579 WeakPolarHBondContact OD2-CB 3.21Å; D576-S579 PolarHBondContact OD2-N 3.08Å; D576-S579 PolarHBondContact OD2-OG 2.73Å
580	V	79.6	Confident	88.4	Confident	59 Å²	59	61.4 Å²	61.4	36%	0.358	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-36.9	-170.4	-169.3	0	0	0	0	112.7	F485 L548 D576	F485-V580 HydrophobicContact CB-CG1 3.66Å; F485-V580 HydrophobicContact CD1-CG1 4.08Å; F485-V580 HydrophobicContact CG-CG1 3.97Å; L548-V580 HydrophobicContact CD1-CG1 3.92Å; D576-V580 PolarHBondContact O-N 3.11Å
581	G	77.6	Confident	88.3	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.01	32%	0.324	C	S	.	.			trans	-106.6	18.6	-166.9	0	0	0	0	0	116.3	L577 A583 L584	L577-G581 CarbonylContact O-C 3.59Å; L577-G581 PolarHBondContact O-N 2.87Å; G581-A583 PolarHBondContact O-N 2.78Å; G581-L584 WeakPolarHBondContact O-CB 3.37Å; G581-L584 PolarHBondContact O-N 2.59Å
582	K	82.9	Confident	88.1	Confident	147 Å²	147	57 Å²	57	64%	0.639	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.6	-40	-165.2	-70.4	176.4	-179.4	174.2	0	115.3	L577 S578 L584	L577-K582 WeakPolarHBondContact O-CA 3.18Å; L577-K582 PolarHBondContact O-N 2.91Å; L577-K582 VanDerWaalsContact O-N 3.11Å; S578-K582 WeakPolarHBondContact O-CE 3.37Å; S578-K582 WeakPolarHBondContact O-CG 3.29Å; K582-L584 VanDerWaalsContact C-N 3.3Å; K582-L584 PolarHBondContact O-N 3.14Å
583	A	84.6	Confident	88.1	Confident	50 Å²	50	58.1 Å²	58.1	41%	0.413	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-11.8	-178.3	0	0	0	0	0	114.6	G581 S586 K587	G581-A583 PolarHBondContact O-N 2.78Å; A583-S586 PolarHBondContact O-OG 2.68Å; A583-K587 VanDerWaalsContact O-CG 3.24Å; A583-K587 WeakPolarHBondContact O-CG 3.37Å; A583-K587 PolarHBondContact O-N 2.64Å
584	L	88	Confident	88.1	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-72.7	-33.8	178.5	-66	-179.1	0	0	0	112.6	L548 W551 L577 G581 K582 S586 K587 V588 L591	L548-L584 WeakPolarHBondContact O-CG 3.33Å; W551-L584 HydrophobicContact CB-CD2 4.17Å; W551-L584 HydrophobicContact CD2-CD2 4.45Å; W551-L584 HydrophobicContact CE3-CD1 3.7Å; W551-L584 HydrophobicContact CE3-CD2 3.78Å; W551-L584 HydrophobicContact CE3-CG 4.3Å; W551-L584 HydrophobicContact CZ3-CD1 3.75Å; L577-L584 HydrophobicContact CD2-CD1 4.25Å; G581-L584 WeakPolarHBondContact O-CB 3.37Å; G581-L584 PolarHBondContact O-N 2.59Å; K582-L584 VanDerWaalsContact C-N 3.3Å; K582-L584 PolarHBondContact O-N 3.14Å; L584-S586 PolarHBondContact O-N 3.37Å; L584-K587 PolarHBondContact O-N 2.86Å; L584-K587 VanDerWaalsContact O-N 3.12Å; L584-V588 HydrophobicContact CB-CG2 4.46Å; L584-V588 HydrophobicContact CD2-CG2 4.27Å; L584-V588 WeakPolarHBondContact O-CB 3.45Å; L584-V588 PolarHBondContact O-N 3.05Å; L584-L591 HydrophobicContact CB-CD2 3.9Å
585	W	86.6	Confident	88.1	Confident	32 Å²	32	57.3 Å²	57.3	12%	0.121	30%	0.297	C	S	.	.	H	α-helix	trans	-57.5	-33.1	178.6	-65.7	111.7	0	0	0	113.3	L577 L591 R595 L633 F635	L577-W585 HydrophobicContact CB-CZ2 3.87Å; L577-W585 HydrophobicContact CD1-CZ2 4.17Å; L577-W585 PolarHBondContact O-NE1 2.77Å; W585-L591 HydrophobicContact CD2-CD2 3.86Å; W585-L591 HydrophobicContact CE3-CD2 3.64Å; W585-L591 HydrophobicContact CE3-CG 3.85Å; W585-L591 HydrophobicContact CG-CD2 4.45Å; W585-L591 HydrophobicContact CH2-CD2 4.27Å; W585-L591 HydrophobicContact CH2-CG 4.15Å; W585-L591 HydrophobicContact CZ2-CD2 4.48Å; W585-L591 HydrophobicContact CZ3-CD2 3.85Å; W585-L591 HydrophobicContact CZ3-CG 3.62Å; W585-L591 WeakPolarHBondContact CZ3-O 3.25Å; W585-R595 HydrophobicContact CE3-CB 4.37Å; W585-R595 HydrophobicContact CH2-CB 3.97Å; W585-R595 HydrophobicContact CZ3-CB 3.48Å; W585-R595 VanDerWaalsContact CZ3-CB 3.48Å; W585-R595 HydrophobicContact CZ3-CG 4.2Å; W585-L633 HydrophobicContact CH2-CD2 4.26Å; W585-F635 HydrophobicContact CH2-CE2 4.18Å; W585-F635 HydrophobicContact CH2-CZ 4.23Å; W585-F635 HydrophobicContact CZ2-CE2 4.37Å
586	S	86.9	Confident	88.1	Confident	110 Å²	110	62.4 Å²	62.4	77%	0.769	32%	0.321	S	S	*	.	H	α-helix	trans	-92.8	-21.4	176.1	56.3	0	0	0	0	114.1	A583 L584	A583-S586 PolarHBondContact O-OG 2.68Å; L584-S586 PolarHBondContact O-N 3.37Å
587	K	87.9	Confident	88.2	Confident	120 Å²	120	60.9 Å²	60.9	52%	0.522	31%	0.312	S	S	.	.	H	α-helix	trans	-81.8	-35.1	176.2	-72	175.2	-174.8	-171.8	0	113.1	S549 A583 L584	S549-K587 PolarHBondContact O-NZ 3.46Å; A583-K587 VanDerWaalsContact O-CG 3.24Å; A583-K587 WeakPolarHBondContact O-CG 3.37Å; A583-K587 PolarHBondContact O-N 2.64Å; L584-K587 PolarHBondContact O-N 2.86Å; L584-K587 VanDerWaalsContact O-N 3.12Å
588	V	92.3	Very high	88.5	Confident	12 Å²	12	61.6 Å²	61.6	7%	0.073	32%	0.315	C	S	.	.			trans	-117.4	96.4	-164.2	-171.2	0	0	0	0	110.8	W551 L584 D590 L591 D592	W551-V588 HydrophobicContact CB-CG2 4.18Å; W551-V588 HydrophobicContact CD2-CG1 4.29Å; W551-V588 HydrophobicContact CD2-CG2 3.57Å; W551-V588 HydrophobicContact CE3-CG2 4.05Å; W551-V588 HydrophobicContact CG-CG2 3.63Å; W551-V588 HydrophobicContact CZ2-CG1 3.79Å; W551-V588 HydrophobicContact CZ2-CG2 4.48Å; L584-V588 HydrophobicContact CB-CG2 4.46Å; L584-V588 HydrophobicContact CD2-CG2 4.27Å; L584-V588 WeakPolarHBondContact O-CB 3.45Å; L584-V588 PolarHBondContact O-N 3.05Å; V588-D590 VanDerWaalsContact C-N 3.29Å; V588-D590 PolarHBondContact O-N 3.04Å; V588-L591 HydrophobicContact CB-CB 3.87Å; V588-L591 HydrophobicContact CG1-CB 3.81Å; V588-L591 WeakPolarHBondContact O-CB 3.37Å; V588-L591 PolarHBondContact O-N 2.8Å; V588-L591 VanDerWaalsContact O-N 3.07Å; V588-D592 PolarHBondContact O-N 3.46Å
589	K	91.8	Very high	88.7	Confident	181 Å²	181	61.9 Å²	61.9	79%	0.787	31%	0.309	S	S	*	.	H	α-helix	trans	-57.5	-37.7	-177.5	-63.5	-175.6	179.2	-177.1	0	113.7	L591 D592 R593	K589-L591 VanDerWaalsContact C-N 3.32Å; K589-L591 PolarHBondContact O-N 3.05Å; K589-D592 PolarHBondContact O-N 3.32Å; K589-R593 VanDerWaalsContact O-CB 3.25Å; K589-R593 WeakPolarHBondContact O-CB 3.38Å; K589-R593 PolarHBondContact O-N 2.95Å
590	D	93	Very high	89.2	Confident	65 Å²	65	60 Å²	60	35%	0.348	29%	0.293	S	S	.	.	H	α-helix	trans	-71.7	-25.7	179.4	-69	-57.2	0	0	0	113.2	V588 F594 V643 V649	V588-D590 VanDerWaalsContact C-N 3.29Å; V588-D590 PolarHBondContact O-N 3.04Å; D590-F594 WeakPolarHBondContact O-CB 3.5Å; D590-F594 PolarHBondContact O-N 3.4Å; D590-V643 HydrophobicContact CB-CG1 4.18Å; D590-V649 HydrophobicContact CB-CG2 3.96Å; D590-V649 WeakPolarHBondContact O-CG2 3.28Å
591	L	92.1	Very high	89.9	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-69.9	-47.2	172.5	-170.9	81.5	0	0	0	110.1	W551 L577 L584 W585 V588 K589 F594 R595 F635 L640 V643	W551-L591 HydrophobicContact CH2-CD1 4.3Å; L577-L591 HydrophobicContact CD1-CD1 3.7Å; L577-L591 HydrophobicContact CD1-CD2 3.65Å; L577-L591 HydrophobicContact CD1-CG 4.2Å; L584-L591 HydrophobicContact CB-CD2 3.9Å; W585-L591 HydrophobicContact CD2-CD2 3.86Å; W585-L591 HydrophobicContact CE3-CD2 3.64Å; W585-L591 HydrophobicContact CE3-CG 3.85Å; W585-L591 HydrophobicContact CG-CD2 4.45Å; W585-L591 HydrophobicContact CH2-CD2 4.27Å; W585-L591 HydrophobicContact CH2-CG 4.15Å; W585-L591 HydrophobicContact CZ2-CD2 4.48Å; W585-L591 HydrophobicContact CZ3-CD2 3.85Å; W585-L591 HydrophobicContact CZ3-CG 3.62Å; W585-L591 WeakPolarHBondContact CZ3-O 3.25Å; V588-L591 HydrophobicContact CB-CB 3.87Å; V588-L591 HydrophobicContact CG1-CB 3.81Å; V588-L591 WeakPolarHBondContact O-CB 3.37Å; V588-L591 PolarHBondContact O-N 2.8Å; V588-L591 VanDerWaalsContact O-N 3.07Å; K589-L591 VanDerWaalsContact C-N 3.32Å; K589-L591 PolarHBondContact O-N 3.05Å; L591-F594 WeakPolarHBondContact O-CB 3.44Å; L591-F594 PolarHBondContact O-N 2.95Å; L591-R595 PolarHBondContact O-N 2.88Å; L591-F635 HydrophobicContact CD1-CE1 4.18Å; L591-F635 HydrophobicContact CD1-CZ 4.09Å; L591-L640 HydrophobicContact CD1-CD2 4.34Å; L591-V643 HydrophobicContact CB-CG1 4.16Å; L591-V643 HydrophobicContact CD1-CG1 4.17Å; L591-V643 HydrophobicContact CD1-CG2 4.34Å
592	D	90.9	Very high	90.5	Very high	50 Å²	50	59 Å²	59	27%	0.267	28%	0.284	S	S	.	.	H	α-helix	trans	-61.7	-47.2	177.2	-165.3	14.7	0	0	0	111.9	V588 K589 F594 R595 E596	V588-D592 PolarHBondContact O-N 3.46Å; K589-D592 PolarHBondContact O-N 3.32Å; D592-F594 VanDerWaalsContact C-N 3.26Å; D592-F594 PolarHBondContact O-N 3.36Å; D592-R595 WeakPolarHBondContact O-CA 3.44Å; D592-R595 VanDerWaalsContact O-CB 3.31Å; D592-R595 WeakPolarHBondContact O-CB 2.95Å; D592-R595 PolarHBondContact O-N 3.5Å; D592-R595 IonicContact OD1-CZ 2.73Å; D592-R595 IonicContact OD1-NE 3.66Å; D592-R595 PolarHBondContact OD1-NE 3.26Å; D592-R595 IonicContact OD1-NH2 3.98Å; D592-R595 PolarHBondContact OD1-NH2 3Å; D592-R595 IonicContact OD2-NH2 3.82Å; D592-E596 PolarHBondContact O-N 2.7Å
593	R	92.4	Very high	90.9	Very high	104 Å²	104	53.2 Å²	53.2	39%	0.392	27%	0.267	S	S	.	.	H	α-helix	trans	-60.9	-32.2	174.6	-167.9	177.8	-173.4	-155.5	5.6	113	K589 L597 V649	K589-R593 VanDerWaalsContact O-CB 3.25Å; K589-R593 WeakPolarHBondContact O-CB 3.38Å; K589-R593 PolarHBondContact O-N 2.95Å; R593-L597 WeakPolarHBondContact O-CD1 3.27Å; R593-L597 VanDerWaalsContact O-CG 3.26Å; R593-L597 WeakPolarHBondContact O-CG 3.42Å; R593-L597 PolarHBondContact O-N 2.92Å; R593-V649 HydrophobicContact CG-CG1 4.19Å
594	F	93.4	Very high	91.3	Very high	1 Å²	1	50.9 Å²	50.9	0%	0.004	25%	0.247	C	C	.	.	H	α-helix	trans	-69.7	-38.6	170.9	177.2	-105.8	0	0	0	112	D590 L591 D592 L597 R598 L628 F635 L648 V649 A652	D590-F594 WeakPolarHBondContact O-CB 3.5Å; D590-F594 PolarHBondContact O-N 3.4Å; L591-F594 WeakPolarHBondContact O-CB 3.44Å; L591-F594 PolarHBondContact O-N 2.95Å; D592-F594 VanDerWaalsContact C-N 3.26Å; D592-F594 PolarHBondContact O-N 3.36Å; F594-L597 PolarHBondContact O-N 2.82Å; F594-R598 WeakPolarHBondContact O-CB 3.28Å; F594-R598 PolarHBondContact O-N 3.46Å; F594-L628 HydrophobicContact CE1-CD2 4.44Å; F594-L628 HydrophobicContact CZ-CB 4.15Å; F594-L628 HydrophobicContact CZ-CD1 4.16Å; F594-F635 HydrophobicContact CD1-CE1 4.02Å; F594-F635 HydrophobicContact CD1-CZ 4.12Å; F594-F635 AromaticContact CE1-CE1 3.95Å; F594-F635 HydrophobicContact CE1-CE1 3.95Å; F594-F635 HydrophobicContact CE1-CZ 4.16Å; F594-L648 HydrophobicContact CD1-CD2 4Å; F594-L648 HydrophobicContact CD2-CD2 3.87Å; F594-L648 HydrophobicContact CD2-CG 3.83Å; F594-L648 HydrophobicContact CE1-CD2 3.79Å; F594-L648 HydrophobicContact CE2-CD1 4.43Å; F594-L648 HydrophobicContact CE2-CD2 3.66Å; F594-L648 HydrophobicContact CE2-CG 3.59Å; F594-L648 HydrophobicContact CG-CD2 4.04Å; F594-L648 HydrophobicContact CG-CG 4.46Å; F594-L648 HydrophobicContact CZ-CD2 3.63Å; F594-L648 HydrophobicContact CZ-CG 4.02Å; F594-V649 HydrophobicContact CB-CG2 4.08Å; F594-A652 HydrophobicContact CD2-CB 3.95Å; F594-A652 HydrophobicContact CE2-CB 3.92Å
595	R	91.4	Very high	91.6	Very high	96 Å²	96	53.4 Å²	53.4	36%	0.362	26%	0.256	S	S	.	.	H	α-helix	trans	-60.7	-45.9	174.3	162.2	178.5	75.8	164.3	9.1	111.9	W585 L591 D592 R598 E599	W585-R595 HydrophobicContact CE3-CB 4.37Å; W585-R595 HydrophobicContact CH2-CB 3.97Å; W585-R595 HydrophobicContact CZ3-CB 3.48Å; W585-R595 VanDerWaalsContact CZ3-CB 3.48Å; W585-R595 HydrophobicContact CZ3-CG 4.2Å; L591-R595 PolarHBondContact O-N 2.88Å; D592-R595 WeakPolarHBondContact O-CA 3.44Å; D592-R595 VanDerWaalsContact O-CB 3.31Å; D592-R595 WeakPolarHBondContact O-CB 2.95Å; D592-R595 PolarHBondContact O-N 3.5Å; D592-R595 IonicContact OD1-CZ 2.73Å; D592-R595 IonicContact OD1-NE 3.66Å; D592-R595 PolarHBondContact OD1-NE 3.26Å; D592-R595 IonicContact OD1-NH2 3.98Å; D592-R595 PolarHBondContact OD1-NH2 3Å; D592-R595 IonicContact OD2-NH2 3.82Å; R595-R598 PolarHBondContact O-N 3.31Å; R595-E599 WeakPolarHBondContact O-CG 3.18Å; R595-E599 PolarHBondContact O-N 2.9Å; R595-E599 VanDerWaalsContact O-N 3.13Å
596	E	90.9	Very high	91.8	Very high	106 Å²	106	59.2 Å²	59.2	50%	0.495	28%	0.283	S	S	.	.	H	α-helix	trans	-57.2	-51.3	174.5	-65.1	178.7	140.9	0	0	111.1	D592 R598 E599 Q600	D592-E596 PolarHBondContact O-N 2.7Å; E596-R598 PolarHBondContact O-N 2.84Å; E596-E599 PolarHBondContact O-N 2.87Å; E596-Q600 WeakPolarHBondContact O-CG 3.46Å; E596-Q600 PolarHBondContact O-N 3.21Å
597	L	93.3	Very high	92	Very high	4 Å²	4	55.1 Å²	55.1	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-60.6	-41	177.8	-71.7	169.5	0	0	0	112.3	R593 F594 E599 Q600 L601 V649 A652 R653 L656	R593-L597 WeakPolarHBondContact O-CD1 3.27Å; R593-L597 VanDerWaalsContact O-CG 3.26Å; R593-L597 WeakPolarHBondContact O-CG 3.42Å; R593-L597 PolarHBondContact O-N 2.92Å; F594-L597 PolarHBondContact O-N 2.82Å; L597-E599 PolarHBondContact O-N 3.19Å; L597-Q600 PolarHBondContact O-N 2.73Å; L597-L601 WeakPolarHBondContact O-CB 3.43Å; L597-L601 VanDerWaalsContact O-CG 3.28Å; L597-L601 WeakPolarHBondContact O-CG 3.35Å; L597-L601 PolarHBondContact O-N 3.02Å; L597-V649 HydrophobicContact CD1-CG1 4.09Å; L597-A652 HydrophobicContact CB-CB 4.07Å; L597-A652 HydrophobicContact CD1-CB 4.05Å; L597-R653 HydrophobicContact CD1-CB 4.3Å; L597-L656 HydrophobicContact CD2-CD2 3.6Å
598	R	92.9	Very high	92.3	Very high	15 Å²	15	49.4 Å²	49.4	6%	0.057	23%	0.227	C	C	.	.	H	α-helix	trans	-56.6	-47.7	176.1	173.9	-168.8	172.3	-98.1	2.1	111.1	F594 R595 E596 Q600 L601 I602 L628 D630 E631	F594-R598 WeakPolarHBondContact O-CB 3.28Å; F594-R598 PolarHBondContact O-N 3.46Å; R595-R598 PolarHBondContact O-N 3.31Å; E596-R598 PolarHBondContact O-N 2.84Å; R598-Q600 VanDerWaalsContact C-N 3.3Å; R598-Q600 PolarHBondContact O-N 2.94Å; R598-L601 PolarHBondContact O-N 3.17Å; R598-I602 HydrophobicContact CG-CD1 3.73Å; R598-I602 HydrophobicContact CG-CG1 4.34Å; R598-I602 VanDerWaalsContact CZ-CD1 3.42Å; R598-I602 VanDerWaalsContact O-CG1 3.31Å; R598-I602 WeakPolarHBondContact O-CG1 3.47Å; R598-I602 PolarHBondContact O-N 3.43Å; R598-L628 WeakPolarHBondContact CD-O 3.49Å; R598-L628 WeakPolarHBondContact CG-O 3.46Å; R598-L628 PolarHBondContact NE-O 3.37Å; R598-D630 PolarHBondContact NH2-O 2.95Å; R598-E631 IonicContact NH1-OE1 2.74Å; R598-E631 IonicContact NH2-OE1 2.8Å; R598-E631 PolarHBondContact NH2-OE1 3.16Å
599	E	90.9	Very high	92.3	Very high	78 Å²	78	55.5 Å²	55.5	36%	0.364	25%	0.253	S	S	.	.	H	α-helix	trans	-65.1	-36.1	-179	-66.5	-180	96.4	0	0	112.1	R595 E596 L597 G603 K690	R595-E599 WeakPolarHBondContact O-CG 3.18Å; R595-E599 PolarHBondContact O-N 2.9Å; R595-E599 VanDerWaalsContact O-N 3.13Å; E596-E599 PolarHBondContact O-N 2.87Å; L597-E599 PolarHBondContact O-N 3.19Å; E599-G603 PolarHBondContact O-N 2.76Å; E599-G603 VanDerWaalsContact O-N 3.11Å; E599-K690 IonicContact OE1-NZ 3.82Å; E599-K690 PolarHBondContact OE1-NZ 3.21Å; E599-K690 IonicContact OE2-NZ 2.72Å; E599-K690 PolarHBondContact OE2-NZ 3.36Å
600	Q	93.3	Very high	92.3	Very high	30 Å²	30	49.6 Å²	49.6	14%	0.14	24%	0.238	C	C	.	.	H	α-helix	trans	-66.4	-44.8	172.8	-62.4	-178.8	-36.1	0	0	111.1	E596 L597 R598 G603 I604 L656 F688	E596-Q600 WeakPolarHBondContact O-CG 3.46Å; E596-Q600 PolarHBondContact O-N 3.21Å; L597-Q600 PolarHBondContact O-N 2.73Å; R598-Q600 VanDerWaalsContact C-N 3.3Å; R598-Q600 PolarHBondContact O-N 2.94Å; Q600-G603 PolarHBondContact O-N 3.16Å; Q600-I604 PolarHBondContact O-N 3.43Å; Q600-L656 HydrophobicContact CB-CD1 3.93Å; Q600-L656 HydrophobicContact CB-CD2 4.04Å; Q600-F688 WeakPolarHBondContact CG-O 3.48Å
601	L	94.3	Very high	92.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.4	-42.4	176.8	-74.8	171.3	0	0	0	112.8	L597 R598 G603 I604 R605 F621 L624 L629 A652 L655 L656	L597-L601 WeakPolarHBondContact O-CB 3.43Å; L597-L601 VanDerWaalsContact O-CG 3.28Å; L597-L601 WeakPolarHBondContact O-CG 3.35Å; L597-L601 PolarHBondContact O-N 3.02Å; R598-L601 PolarHBondContact O-N 3.17Å; L601-G603 VanDerWaalsContact C-N 3.33Å; L601-G603 PolarHBondContact O-N 3.37Å; L601-I604 PolarHBondContact O-N 2.7Å; L601-R605 WeakPolarHBondContact O-CB 3.33Å; L601-R605 PolarHBondContact O-N 2.75Å; L601-F621 HydrophobicContact CB-CE1 4.32Å; L601-F621 HydrophobicContact CD2-CE1 3.83Å; L601-F621 HydrophobicContact CD2-CZ 3.96Å; L601-L624 HydrophobicContact CD1-CD2 4.22Å; L601-L629 HydrophobicContact CB-CD2 4.04Å; L601-A652 HydrophobicContact CD1-CB 3.77Å; L601-L655 HydrophobicContact CD2-CB 4Å; L601-L656 HydrophobicContact CD2-CB 4.03Å; L601-L656 HydrophobicContact CD2-CD1 4.47Å
602	I	91.9	Very high	92.5	Very high	38 Å²	38	56.9 Å²	56.9	20%	0.195	26%	0.261	C	S	.	.	H	α-helix	trans	-63.7	-41.4	174.7	-69.2	170.5	0	0	0	110.4	R598 K606 L629	R598-I602 HydrophobicContact CG-CD1 3.73Å; R598-I602 HydrophobicContact CG-CG1 4.34Å; R598-I602 VanDerWaalsContact CZ-CD1 3.42Å; R598-I602 VanDerWaalsContact O-CG1 3.31Å; R598-I602 WeakPolarHBondContact O-CG1 3.47Å; R598-I602 PolarHBondContact O-N 3.43Å; I602-K606 WeakPolarHBondContact O-CG 3.46Å; I602-K606 PolarHBondContact O-N 2.88Å; I602-L629 WeakPolarHBondContact CD1-O 3.47Å; I602-L629 HydrophobicContact CG1-CD2 4.35Å; I602-L629 VanDerWaalsContact CG1-O 3.32Å; I602-L629 WeakPolarHBondContact CG1-O 3.5Å
603	G	90.5	Very high	92.6	Very high	26 Å²	26	59.3 Å²	59.3	27%	0.268	27%	0.274	S	S	.	.	H	α-helix	trans	-62.5	-45.6	176.4	0	0	0	0	0	113.3	E599 Q600 L601	E599-G603 PolarHBondContact O-N 2.76Å; E599-G603 VanDerWaalsContact O-N 3.11Å; Q600-G603 PolarHBondContact O-N 3.16Å; L601-G603 VanDerWaalsContact C-N 3.33Å; L601-G603 PolarHBondContact O-N 3.37Å
604	I	93.3	Very high	92.6	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-77	-37.7	-179	-152.3	161.9	0	0	0	112	Q600 L601 K606 L607 L608 F621 L656 A659 V660 V663 F688	Q600-I604 PolarHBondContact O-N 3.43Å; L601-I604 PolarHBondContact O-N 2.7Å; I604-K606 PolarHBondContact O-N 3.32Å; I604-L607 WeakPolarHBondContact O-CA 3.27Å; I604-L607 WeakPolarHBondContact O-CB 3.4Å; I604-L607 PolarHBondContact O-N 3.27Å; I604-L608 WeakPolarHBondContact O-CG 3.26Å; I604-L608 PolarHBondContact O-N 3.31Å; I604-F621 HydrophobicContact CG2-CZ 4.27Å; I604-L656 HydrophobicContact CG2-CD1 4.39Å; I604-A659 HydrophobicContact CD1-CB 3.68Å; I604-A659 WeakPolarHBondContact CD1-O 3.19Å; I604-A659 HydrophobicContact CG1-CB 4.1Å; I604-A659 HydrophobicContact CG2-CB 3.78Å; I604-V660 HydrophobicContact CD1-CG2 3.77Å; I604-V663 HydrophobicContact CD1-CG2 3.96Å; I604-V663 HydrophobicContact CG1-CG2 3.98Å; I604-F688 HydrophobicContact CB-CD1 3.92Å; I604-F688 HydrophobicContact CB-CE1 4.19Å; I604-F688 HydrophobicContact CB-CG 4.13Å; I604-F688 HydrophobicContact CD1-CD1 4.27Å; I604-F688 HydrophobicContact CD1-CD2 4.19Å; I604-F688 HydrophobicContact CD1-CE1 3.79Å; I604-F688 HydrophobicContact CD1-CE2 3.71Å; I604-F688 HydrophobicContact CD1-CG 4.47Å; I604-F688 HydrophobicContact CD1-CZ 3.5Å; I604-F688 VanDerWaalsContact CD1-CZ 3.5Å; I604-F688 HydrophobicContact CG1-CD1 3.95Å; I604-F688 HydrophobicContact CG1-CE1 3.68Å; I604-F688 HydrophobicContact CG1-CE2 4.43Å; I604-F688 HydrophobicContact CG1-CG 4.44Å; I604-F688 HydrophobicContact CG1-CZ 3.96Å
605	R	92.9	Very high	92.5	Very high	53 Å²	53	62 Å²	62	20%	0.2	29%	0.291	C	S	.	.	H	α-helix	trans	-57.5	-34.5	174.6	-170.5	-178.3	-170.8	-149.3	7.2	112	L601 K609 L618 F621 D630	L601-R605 WeakPolarHBondContact O-CB 3.33Å; L601-R605 PolarHBondContact O-N 2.75Å; R605-K609 WeakPolarHBondContact O-CB 3.41Å; R605-K609 WeakPolarHBondContact O-CG 2.92Å; R605-K609 PolarHBondContact O-N 3.02Å; R605-L618 HydrophobicContact CG-CD2 4.45Å; R605-F621 HydrophobicContact CB-CE1 3.92Å; R605-F621 HydrophobicContact CB-CZ 4.23Å; R605-F621 HydrophobicContact CG-CD1 4.26Å; R605-F621 HydrophobicContact CG-CE1 4.16Å; R605-D630 IonicContact NH1-OD1 3Å
606	K	91.3	Very high	92.5	Very high	155 Å²	155	67.7 Å²	67.7	67%	0.674	31%	0.312	S	S	*	.	H	α-helix	trans	-67	-36.7	172.7	-73.4	-177	-179.3	-167.4	0	112.9	I602 I604	I602-K606 WeakPolarHBondContact O-CG 3.46Å; I602-K606 PolarHBondContact O-N 2.88Å; I604-K606 PolarHBondContact O-N 3.32Å
607	L	91.9	Very high	92.6	Very high	23 Å²	23	63.4 Å²	63.4	12%	0.12	29%	0.293	C	S	.	.	H	α-helix	trans	-71.1	-44.7	174.3	176	60.9	0	0	0	111.8	I604 A610 V663 C669 R672 F686 F688	I604-L607 WeakPolarHBondContact O-CA 3.27Å; I604-L607 WeakPolarHBondContact O-CB 3.4Å; I604-L607 PolarHBondContact O-N 3.27Å; L607-A610 PolarHBondContact O-N 3.46Å; L607-V663 HydrophobicContact CD2-CG1 4.21Å; L607-V663 HydrophobicContact CD2-CG2 3.72Å; L607-C669 HydrophobicContact CD2-CB 4.31Å; L607-R672 HydrophobicContact CD1-CB 3.88Å; L607-F686 HydrophobicContact CD2-CD1 3.77Å; L607-F686 HydrophobicContact CD2-CE1 3.65Å; L607-F688 HydrophobicContact CD2-CE1 4.08Å
608	L	93.4	Very high	92.5	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.8	-48.5	177.7	-64.1	179.3	0	0	0	111.2	I604 A610 C611 S614 V617 L618 F621 A659 H662 V663	I604-L608 WeakPolarHBondContact O-CG 3.26Å; I604-L608 PolarHBondContact O-N 3.31Å; L608-A610 PolarHBondContact O-N 2.95Å; L608-C611 WeakPolarHBondContact O-CA 3.49Å; L608-C611 WeakPolarHBondContact O-CB 3.27Å; L608-C611 PolarHBondContact O-N 2.85Å; L608-S614 PolarHBondContact O-OG 3.49Å; L608-V617 HydrophobicContact CD1-CG1 4.01Å; L608-L618 HydrophobicContact CB-CD2 3.64Å; L608-L618 HydrophobicContact CB-CG 4.05Å; L608-L618 HydrophobicContact CD1-CD2 4.29Å; L608-F621 HydrophobicContact CD1-CE2 3.79Å; L608-F621 HydrophobicContact CD1-CZ 4.19Å; L608-A659 HydrophobicContact CD1-CB 3.93Å; L608-H662 WeakPolarHBondContact CD2-CD2 3.34Å; L608-V663 HydrophobicContact CD2-CG2 4.38Å
609	K	92.8	Very high	92.5	Very high	141 Å²	141	66.9 Å²	66.9	61%	0.613	32%	0.319	S	S	*	.	H	α-helix	trans	-52.5	-26.9	178.2	-84.7	-172.7	173.4	-168.2	0	114.6	R605 L618	R605-K609 WeakPolarHBondContact O-CB 3.41Å; R605-K609 WeakPolarHBondContact O-CG 2.92Å; R605-K609 PolarHBondContact O-N 3.02Å; K609-L618 HydrophobicContact CG-CD2 4.27Å
610	A	91.8	Very high	92.5	Very high	57 Å²	57	67 Å²	67	47%	0.471	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-2.3	176.5	0	0	0	0	0	113.8	L607 L608 R672	L607-A610 PolarHBondContact O-N 3.46Å; L608-A610 PolarHBondContact O-N 2.95Å; A610-R672 VanDerWaalsContact O-CZ 3.28Å; A610-R672 PolarHBondContact O-NH1 2.87Å; A610-R672 PolarHBondContact O-NH2 3.15Å
611	C	94.4	Very high	92.4	Very high	6 Å²	6	65.9 Å²	65.9	4%	0.041	32%	0.315	C	S	.	.			trans	-104	113.3	-177.8	-178.5	0	0	0	0	111.4	L608 L613 S614 C666 C669	L608-C611 WeakPolarHBondContact O-CA 3.49Å; L608-C611 WeakPolarHBondContact O-CB 3.27Å; L608-C611 PolarHBondContact O-N 2.85Å; C611-L613 PolarHBondContact O-N 3.48Å; C611-S614 WeakPolarHBondContact O-CB 3.31Å; C611-S614 PolarHBondContact O-N 3.24Å; C611-S614 VanDerWaalsContact O-N 3.12Å; C611-S614 PolarHBondContact O-OG 3.08Å; C611-C666 VanDerWaalsContact SG-SG 3.65Å; C611-C669 VanDerWaalsContact SG-SG 3.64Å
612	R	94.1	Very high	92.1	Very high	211 Å²	211	73.6 Å²	73.6	80%	0.796	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-7.5	-179.9	70.4	178.6	179	130.3	0.8	116.1	L668	R612-L668 HydrophobicContact CG-CD1 3.72Å
613	L	92.8	Very high	91.9	Very high	102 Å²	102	76 Å²	76	53%	0.534	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-1.6	179.7	-60.6	179.1	0	0	0	112.9	C611 H662 L668	C611-L613 PolarHBondContact O-N 3.48Å; L613-H662 PolarHBondContact O-CE1 3.02Å; L613-H662 VanDerWaalsContact O-CE1 3.26Å; L613-L668 HydrophobicContact CD1-CD1 3.81Å; L613-L668 HydrophobicContact CD1-CG 4.38Å; L613-L668 HydrophobicContact CG-CD1 3.94Å
614	S	92.8	Very high	91.8	Very high	1 Å²	1	75 Å²	75	1%	0.007	36%	0.357	C	S	.	.			trans	-91.4	-2.3	-171.7	69.8	0	0	0	0	115.1	L608 C611 R616 V617 L618	L608-S614 PolarHBondContact O-OG 3.49Å; C611-S614 WeakPolarHBondContact O-CB 3.31Å; C611-S614 PolarHBondContact O-N 3.24Å; C611-S614 VanDerWaalsContact O-N 3.12Å; C611-S614 PolarHBondContact O-OG 3.08Å; S614-R616 VanDerWaalsContact C-N 3.32Å; S614-R616 PolarHBondContact O-N 2.82Å; S614-R616 VanDerWaalsContact O-N 3.16Å; S614-V617 CarbonylContact O-C 3.53Å; S614-V617 WeakPolarHBondContact O-CA 3.43Å; S614-V617 WeakPolarHBondContact O-CB 3.32Å; S614-V617 PolarHBondContact O-N 3.32Å; S614-L618 PolarHBondContact O-N 3.45Å; S614-L618 VanDerWaalsContact OG-CD1 3.31Å; S614-L618 WeakPolarHBondContact OG-CD1 3.4Å
615	E	92.1	Very high	91.6	Very high	159 Å²	159	76.5 Å²	76.5	74%	0.743	37%	0.367	S	S	*	.	H	α-helix	trans	-49.1	-46.3	-170	-175.9	174.9	-144.9	0	0	113.8	V617 L618 A619	E615-V617 VanDerWaalsContact C-N 3.33Å; E615-V617 PolarHBondContact O-N 2.93Å; E615-L618 PolarHBondContact O-N 2.8Å; E615-A619 PolarHBondContact O-N 3.24Å
616	R	91.7	Very high	91.4	Very high	216 Å²	216	76.4 Å²	76.4	82%	0.815	38%	0.378	S	S	*	.	H	α-helix	trans	-59.2	-43	176.4	-62.7	-177.1	-179	-172.5	-0.7	112.6	S614 A619 E620	S614-R616 VanDerWaalsContact C-N 3.32Å; S614-R616 PolarHBondContact O-N 2.82Å; S614-R616 VanDerWaalsContact O-N 3.16Å; R616-A619 WeakPolarHBondContact O-CB 3.44Å; R616-A619 PolarHBondContact O-N 2.93Å; R616-E620 PolarHBondContact O-N 3.49Å
617	V	92.7	Very high	91.3	Very high	17 Å²	17	71.2 Å²	71.2	10%	0.103	36%	0.356	C	S	.	.	H	α-helix	trans	-75.5	-28.3	-178.9	-172.8	0	0	0	0	110.9	L608 S614 E615 E620 F621 A659 H662	L608-V617 HydrophobicContact CD1-CG1 4.01Å; S614-V617 CarbonylContact O-C 3.53Å; S614-V617 WeakPolarHBondContact O-CA 3.43Å; S614-V617 WeakPolarHBondContact O-CB 3.32Å; S614-V617 PolarHBondContact O-N 3.32Å; E615-V617 VanDerWaalsContact C-N 3.33Å; E615-V617 PolarHBondContact O-N 2.93Å; V617-E620 PolarHBondContact O-N 2.81Å; V617-F621 VanDerWaalsContact O-CD2 3.23Å; V617-F621 WeakPolarHBondContact O-CD2 3.22Å; V617-A659 HydrophobicContact CG1-CB 4.29Å; V617-H662 HydrophobicContact CG1-CB 4.45Å; V617-H662 HydrophobicContact CG2-CB 3.99Å
618	L	91.9	Very high	91.3	Very high	44 Å²	44	70.1 Å²	70.1	23%	0.23	35%	0.35	C	S	.	.	H	α-helix	trans	-70.3	-34.8	170.6	-74.8	173.5	0	0	0	112.1	R605 L608 K609 S614 E615 E620 F621	R605-L618 HydrophobicContact CG-CD2 4.45Å; L608-L618 HydrophobicContact CB-CD2 3.64Å; L608-L618 HydrophobicContact CB-CG 4.05Å; L608-L618 HydrophobicContact CD1-CD2 4.29Å; K609-L618 HydrophobicContact CG-CD2 4.27Å; S614-L618 PolarHBondContact O-N 3.45Å; S614-L618 VanDerWaalsContact OG-CD1 3.31Å; S614-L618 WeakPolarHBondContact OG-CD1 3.4Å; E615-L618 PolarHBondContact O-N 2.8Å; L618-E620 VanDerWaalsContact C-N 3.27Å; L618-E620 PolarHBondContact O-N 2.77Å; L618-F621 WeakPolarHBondContact O-CB 3.47Å; L618-F621 PolarHBondContact O-N 3.14Å
619	A	91.9	Very high	91.1	Very high	47 Å²	47	70.5 Å²	70.5	39%	0.388	35%	0.352	S	S	.	.	H	α-helix	trans	-63.5	-32.1	173	0	0	0	0	0	112.1	E615 R616 F621 E622	E615-A619 PolarHBondContact O-N 3.24Å; R616-A619 WeakPolarHBondContact O-CB 3.44Å; R616-A619 PolarHBondContact O-N 2.93Å; A619-F621 PolarHBondContact O-N 3.42Å; A619-F621 VanDerWaalsContact O-N 3.12Å; A619-E622 WeakPolarHBondContact O-CB 3.43Å; A619-E622 WeakPolarHBondContact O-CG 3.25Å; A619-E622 PolarHBondContact O-N 2.87Å
620	E	91.6	Very high	90.8	Very high	82 Å²	82	67.8 Å²	67.8	38%	0.383	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-17	172.5	-62.3	177.1	-125.9	0	0	113.4	R616 V617 L618 P623 L655 A658	R616-E620 PolarHBondContact O-N 3.49Å; V617-E620 PolarHBondContact O-N 2.81Å; L618-E620 VanDerWaalsContact C-N 3.27Å; L618-E620 PolarHBondContact O-N 2.77Å; E620-P623 WeakPolarHBondContact O-CD 3.37Å; E620-L655 HydrophobicContact CB-CD2 3.65Å; E620-L655 WeakPolarHBondContact O-CD2 3.29Å; E620-A658 WeakPolarHBondContact OE2-CB 3.43Å
621	F	90.1	Very high	90.4	Very high	6 Å²	6	72.7 Å²	72.7	3%	0.026	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-16.2	172.4	-73.4	-109.4	0	0	0	113.4	L601 I604 R605 L608 V617 L618 A619 L624 L629	L601-F621 HydrophobicContact CB-CE1 4.32Å; L601-F621 HydrophobicContact CD2-CE1 3.83Å; L601-F621 HydrophobicContact CD2-CZ 3.96Å; I604-F621 HydrophobicContact CG2-CZ 4.27Å; R605-F621 HydrophobicContact CB-CE1 3.92Å; R605-F621 HydrophobicContact CB-CZ 4.23Å; R605-F621 HydrophobicContact CG-CD1 4.26Å; R605-F621 HydrophobicContact CG-CE1 4.16Å; L608-F621 HydrophobicContact CD1-CE2 3.79Å; L608-F621 HydrophobicContact CD1-CZ 4.19Å; V617-F621 VanDerWaalsContact O-CD2 3.23Å; V617-F621 WeakPolarHBondContact O-CD2 3.22Å; L618-F621 WeakPolarHBondContact O-CB 3.47Å; L618-F621 PolarHBondContact O-N 3.14Å; A619-F621 PolarHBondContact O-N 3.42Å; A619-F621 VanDerWaalsContact O-N 3.12Å; F621-L624 PolarHBondContact O-N 3.47Å; F621-L624 VanDerWaalsContact O-N 3.14Å; F621-L629 HydrophobicContact CD1-CD1 3.84Å
622	E	87.9	Confident	89.9	Confident	162 Å²	162	76.9 Å²	76.9	76%	0.757	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-38.5	-177	-64	-174.6	157.7	0	0	114.5	A619 L624	A619-E622 WeakPolarHBondContact O-CB 3.43Å; A619-E622 WeakPolarHBondContact O-CG 3.25Å; A619-E622 PolarHBondContact O-N 2.87Å; E622-L624 PolarHBondContact O-N 3.13Å
623	P	87.8	Confident	89.6	Confident	89 Å²	89	67.8 Å²	67.8	58%	0.578	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-6.5	175.6	-21.1	35.3	0	0	0	114.6	E620 Q651	E620-P623 WeakPolarHBondContact O-CD 3.37Å; P623-Q651 PolarHBondContact O-NE2 3.5Å
624	L	88.7	Confident	89.6	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.021	34%	0.34	C	S	.	.	S	Bend	trans	-98.3	118.3	174.6	-172.6	68.5	0	0	0	109.1	L601 F621 E622 A626 L628 L629 L648 L655	L601-L624 HydrophobicContact CD1-CD2 4.22Å; F621-L624 PolarHBondContact O-N 3.47Å; F621-L624 VanDerWaalsContact O-N 3.14Å; E622-L624 PolarHBondContact O-N 3.13Å; L624-A626 PolarHBondContact O-N 3.07Å; L624-L628 HydrophobicContact CD1-CD1 4.09Å; L624-L629 HydrophobicContact CD2-CD1 4.13Å; L624-L629 HydrophobicContact CD2-CD2 3.92Å; L624-L629 HydrophobicContact CD2-CG 4.06Å; L624-L648 HydrophobicContact CD1-CD1 3.7Å; L624-L655 HydrophobicContact CB-CD1 4.07Å; L624-L655 HydrophobicContact CD2-CD1 4.18Å
625	P	88.4	Confident	89.7	Confident	31 Å²	31	65.5 Å²	65.5	20%	0.201	34%	0.339	C	S	.	.			trans	-52.6	127.8	-176.3	-28.3	33.8	0	0	0	113.5	H627 L628	P625-H627 VanDerWaalsContact C-N 3.27Å; P625-H627 WeakPolarHBondContact CB-CE1 3.46Å; P625-H627 PolarHBondContact O-N 2.83Å; P625-L628 HydrophobicContact CB-CD1 4.16Å; P625-L628 HydrophobicContact CB-CG 4.32Å; P625-L628 HydrophobicContact CG-CD1 4.21Å; P625-L628 WeakPolarHBondContact O-CB 3.35Å; P625-L628 PolarHBondContact O-N 3.49Å
626	A	88.5	Confident	89.8	Confident	52 Å²	52	58 Å²	58	43%	0.43	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-55.5	-40.3	-170.7	0	0	0	0	0	113.2	L624 L628 L629 D630	L624-A626 PolarHBondContact O-N 3.07Å; A626-L628 PolarHBondContact O-N 3.17Å; A626-L629 PolarHBondContact O-N 3.01Å; A626-D630 VanDerWaalsContact O-CG 3.31Å; A626-D630 PolarHBondContact O-N 3.3Å; A626-D630 VanDerWaalsContact O-N 3.12Å
627	H	91	Very high	89.9	Confident	45 Å²	45	47.9 Å²	47.9	21%	0.208	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-58.3	-20.5	179.4	63.2	-101.6	0	0	0	114.6	P573 P625 L634 D639	P573-H627 HydrophobicContact CB-CB 4.04Å; P573-H627 HydrophobicContact CG-CB 4.12Å; P625-H627 VanDerWaalsContact C-N 3.27Å; P625-H627 WeakPolarHBondContact CB-CE1 3.46Å; P625-H627 PolarHBondContact O-N 2.83Å; H627-L634 PolarHBondContact CD2-O 3.18Å; H627-D639 IonicContact CD2-OD2 3.8Å; H627-D639 IonicContact CE1-OD2 2.66Å; H627-D639 IonicContact NE2-OD1 3.14Å; H627-D639 IonicContact NE2-OD2 3.49Å; H627-D639 PolarHBondContact NE2-OD2 3.37Å
628	L	91.3	Very high	90.1	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-78.2	-22.1	174.8	-60.2	174.4	0	0	0	112.8	F594 R598 L624 P625 A626 L633 F635 D639 L648	F594-L628 HydrophobicContact CE1-CD2 4.44Å; F594-L628 HydrophobicContact CZ-CB 4.15Å; F594-L628 HydrophobicContact CZ-CD1 4.16Å; R598-L628 WeakPolarHBondContact CD-O 3.49Å; R598-L628 WeakPolarHBondContact CG-O 3.46Å; R598-L628 PolarHBondContact NE-O 3.37Å; L624-L628 HydrophobicContact CD1-CD1 4.09Å; P625-L628 HydrophobicContact CB-CD1 4.16Å; P625-L628 HydrophobicContact CB-CG 4.32Å; P625-L628 HydrophobicContact CG-CD1 4.21Å; P625-L628 WeakPolarHBondContact O-CB 3.35Å; P625-L628 PolarHBondContact O-N 3.49Å; A626-L628 PolarHBondContact O-N 3.17Å; L628-L633 HydrophobicContact CD2-CD1 4.35Å; L628-F635 HydrophobicContact CD2-CD1 4.03Å; L628-F635 HydrophobicContact CD2-CE1 4.21Å; L628-D639 HydrophobicContact CD2-CB 4.29Å; L628-L648 HydrophobicContact CD1-CD1 3.83Å; L628-L648 HydrophobicContact CD1-CD2 4.07Å; L628-L648 HydrophobicContact CD1-CG 4.5Å
629	L	88.8	Confident	90.2	Very high	9 Å²	9	47.2 Å²	47.2	5%	0.047	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-16.7	178.7	-62.8	172.2	0	0	0	112.8	L601 I602 F621 L624 A626	L601-L629 HydrophobicContact CB-CD2 4.04Å; I602-L629 WeakPolarHBondContact CD1-O 3.47Å; I602-L629 HydrophobicContact CG1-CD2 4.35Å; I602-L629 VanDerWaalsContact CG1-O 3.32Å; I602-L629 WeakPolarHBondContact CG1-O 3.5Å; F621-L629 HydrophobicContact CD1-CD1 3.84Å; L624-L629 HydrophobicContact CD2-CD1 4.13Å; L624-L629 HydrophobicContact CD2-CD2 3.92Å; L624-L629 HydrophobicContact CD2-CG 4.06Å; A626-L629 PolarHBondContact O-N 3.01Å
630	D	86.6	Confident	90.4	Very high	83 Å²	83	45 Å²	45	44%	0.444	24%	0.243	S	C	.	.	S	Bend	trans	-88.5	178.2	176.6	-56.7	-32.4	0	0	0	110.4	R598 R605 A626	R598-D630 PolarHBondContact NH2-O 2.95Å; R605-D630 IonicContact NH1-OD1 3Å; A626-D630 VanDerWaalsContact O-CG 3.31Å; A626-D630 PolarHBondContact O-N 3.3Å; A626-D630 VanDerWaalsContact O-N 3.12Å
631	E	83.5	Confident	90.5	Very high	160 Å²	160	44.9 Å²	44.9	75%	0.748	24%	0.239	S	C	*	.	S	Bend	trans	-138.9	130.6	-172	-166.8	145.7	-100.9	0	0	109.9	R598	R598-E631 IonicContact NH1-OE1 2.74Å; R598-E631 IonicContact NH2-OE1 2.8Å; R598-E631 PolarHBondContact NH2-OE1 3.16Å
632	P	83.7	Confident	90.8	Very high	94 Å²	94	48 Å²	48	61%	0.61	25%	0.251	S	S	*	.	S	Bend	cis	-67.6	152.4	6.7	30.2	-37.3	0	0	0	114.6	L634	P632-L634 HydrophobicContact CG-CG 4.46Å; P632-L634 PolarHBondContact O-N 3.19Å; P632-L634 VanDerWaalsContact O-N 3.1Å
633	L	88.8	Confident	91.1	Very high	21 Å²	21	40.3 Å²	40.3	11%	0.11	22%	0.215	C	C	.	.			trans	-75.3	97.9	176.6	175.3	56.1	0	0	0	110.7	W585 L628 F635	W585-L633 HydrophobicContact CH2-CD2 4.26Å; L628-L633 HydrophobicContact CD2-CD1 4.35Å; L633-F635 HydrophobicContact CD1-CD2 4.42Å; L633-F635 HydrophobicContact CD1-CE2 3.93Å; L633-F635 HydrophobicContact CD1-CZ 4.11Å; L633-F635 HydrophobicContact CD2-CE2 3.72Å; L633-F635 HydrophobicContact CD2-CZ 3.96Å; L633-F635 HydrophobicContact CG-CD2 4.24Å; L633-F635 HydrophobicContact CG-CE2 3.6Å; L633-F635 HydrophobicContact CG-CZ 4.13Å
634	L	92.3	Very high	91.4	Very high	54 Å²	54	41.1 Å²	41.1	28%	0.283	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	140.5	171.5	-57.7	179.3	0	0	0	109.9	P573 D576 H627 P632	P573-L634 HydrophobicContact CB-CB 4.02Å; P573-L634 WeakPolarHBondContact O-CD1 3.37Å; D576-L634 HydrophobicContact CB-CD2 3.74Å; H627-L634 PolarHBondContact CD2-O 3.18Å; P632-L634 HydrophobicContact CG-CG 4.46Å; P632-L634 PolarHBondContact O-N 3.19Å; P632-L634 VanDerWaalsContact O-N 3.1Å
635	F	93.6	Very high	91.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	154.6	171.8	-69.7	-97.4	0	0	0	110.6	P573 L574 F575 L577 W585 L591 F594 L628 L633 D639 L640	P573-F635 CarbonylContact C-O 3.6Å; P573-F635 WeakPolarHBondContact CA-O 3.26Å; L574-F635 PolarHBondContact N-O 3.31Å; F575-F635 HydrophobicContact CB-CB 4.49Å; F575-F635 WeakPolarHBondContact CB-O 3.38Å; F575-F635 VanDerWaalsContact CD2-O 3.26Å; F575-F635 WeakPolarHBondContact CD2-O 3.33Å; F575-F635 PolarHBondContact N-O 3.15Å; F575-F635 PolarHBondContact O-N 3.03Å; L577-F635 HydrophobicContact CD1-CD2 3.61Å; L577-F635 HydrophobicContact CD1-CE2 3.56Å; L577-F635 HydrophobicContact CD1-CG 4.23Å; L577-F635 HydrophobicContact CD1-CZ 4.17Å; L577-F635 HydrophobicContact CG-CD2 3.7Å; L577-F635 HydrophobicContact CG-CE2 4Å; L577-F635 HydrophobicContact CG-CG 4.49Å; W585-F635 HydrophobicContact CH2-CE2 4.18Å; W585-F635 HydrophobicContact CH2-CZ 4.23Å; W585-F635 HydrophobicContact CZ2-CE2 4.37Å; L591-F635 HydrophobicContact CD1-CE1 4.18Å; L591-F635 HydrophobicContact CD1-CZ 4.09Å; F594-F635 HydrophobicContact CD1-CE1 4.02Å; F594-F635 HydrophobicContact CD1-CZ 4.12Å; F594-F635 AromaticContact CE1-CE1 3.95Å; F594-F635 HydrophobicContact CE1-CE1 3.95Å; F594-F635 HydrophobicContact CE1-CZ 4.16Å; L628-F635 HydrophobicContact CD2-CD1 4.03Å; L628-F635 HydrophobicContact CD2-CE1 4.21Å; L633-F635 HydrophobicContact CD1-CD2 4.42Å; L633-F635 HydrophobicContact CD1-CE2 3.93Å; L633-F635 HydrophobicContact CD1-CZ 4.11Å; L633-F635 HydrophobicContact CD2-CE2 3.72Å; L633-F635 HydrophobicContact CD2-CZ 3.96Å; L633-F635 HydrophobicContact CG-CD2 4.24Å; L633-F635 HydrophobicContact CG-CE2 3.6Å; L633-F635 HydrophobicContact CG-CZ 4.13Å; F635-D639 HydrophobicContact CB-CB 4.46Å; F635-D639 HydrophobicContact CD1-CB 3.95Å; F635-L640 HydrophobicContact CB-CD2 3.81Å; F635-L640 HydrophobicContact CB-CG 4.1Å; F635-L640 HydrophobicContact CD1-CD2 3.83Å; F635-L640 HydrophobicContact CG-CD2 3.82Å
636	S	95.1	Very high	91.9	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.021	23%	0.234	C	C	.	.			trans	-97.4	168.5	160.6	70.2	0	0	0	0	111.5	S571 Q572 E638 D639 L640	S571-S636 VanDerWaalsContact C-CB 3.47Å; Q572-S636 VanDerWaalsContact O-CA 3.26Å; Q572-S636 WeakPolarHBondContact O-CA 3.46Å; Q572-S636 WeakPolarHBondContact O-CB 3.46Å; S636-E638 PolarHBondContact O-N 3.17Å; S636-D639 WeakPolarHBondContact CB-OD2 3.45Å; S636-D639 PolarHBondContact N-OD2 3.32Å; S636-D639 PolarHBondContact O-N 3.45Å; S636-D639 PolarHBondContact OG-N 3.16Å; S636-D639 VanDerWaalsContact OG-N 3.11Å; S636-D639 PolarHBondContact OG-OD2 2.96Å; S636-L640 WeakPolarHBondContact O-CG 3.48Å; S636-L640 PolarHBondContact O-N 2.99Å; S636-L640 VanDerWaalsContact O-N 3.15Å
637	M	94.8	Very high	92.1	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-62.9	-35.7	173.7	-68.2	-58.5	-64.1	0	0	111.6	V542 P544 V547 W570 F575 L640 Y641	V542-M637 HydrophobicContact CG1-CE 4.06Å; P544-M637 HydrophobicContact CB-CE 4.34Å; P544-M637 HydrophobicContact CB-SD 3.84Å; P544-M637 HydrophobicContact CG-CE 4.26Å; P544-M637 HydrophobicContact CG-CG 4.45Å; P544-M637 HydrophobicContact CG-SD 3.92Å; V547-M637 HydrophobicContact CB-CE 4.02Å; V547-M637 HydrophobicContact CG1-CE 4.4Å; V547-M637 HydrophobicContact CG2-CE 3.68Å; W570-M637 HydrophobicContact CD2-CB 3.74Å; W570-M637 HydrophobicContact CE3-CB 3.43Å; W570-M637 VanDerWaalsContact CE3-CB 3.43Å; W570-M637 HydrophobicContact CE3-CG 4.04Å; W570-M637 HydrophobicContact CG-CB 4.45Å; W570-M637 HydrophobicContact CH2-CB 3.89Å; W570-M637 HydrophobicContact CH2-CE 4.5Å; W570-M637 HydrophobicContact CZ2-CB 4.18Å; W570-M637 HydrophobicContact CZ3-CB 3.5Å; W570-M637 HydrophobicContact CZ3-CE 4.09Å; W570-M637 HydrophobicContact CZ3-CG 4.1Å; W570-M637 WeakPolarHBondContact O-CB 3.36Å; W570-M637 PolarHBondContact O-N 3.12Å; F575-M637 HydrophobicContact CD2-CG 4.47Å; F575-M637 HydrophobicContact CD2-SD 4.24Å; F575-M637 HydrophobicContact CE1-SD 4.29Å; F575-M637 HydrophobicContact CE2-CG 3.57Å; F575-M637 HydrophobicContact CE2-SD 3.67Å; F575-M637 HydrophobicContact CZ-CG 3.86Å; F575-M637 HydrophobicContact CZ-SD 3.68Å; M637-L640 PolarHBondContact O-N 3.04Å; M637-Y641 WeakPolarHBondContact O-CB 3.43Å; M637-Y641 PolarHBondContact O-N 3.43Å
638	E	95.8	Very high	92.3	Very high	45 Å²	45	46.1 Å²	46.1	21%	0.21	23%	0.227	C	C	.	.	H	α-helix	trans	-60.1	-43.4	173	178.8	58.2	-165.7	0	0	111.9	W570 S636 Y641 R642	W570-E638 PolarHBondContact NE1-OE2 3.39Å; W570-E638 PolarHBondContact O-N 3.4Å; W570-E638 VanDerWaalsContact O-N 3.08Å; S636-E638 PolarHBondContact O-N 3.17Å; E638-Y641 WeakPolarHBondContact O-CB 3.35Å; E638-Y641 PolarHBondContact O-N 3.02Å; E638-R642 WeakPolarHBondContact O-CG 3.26Å; E638-R642 PolarHBondContact O-N 3.49Å; E638-R642 IonicContact OE1-CZ 3.82Å; E638-R642 VanDerWaalsContact OE1-CZ 3.29Å; E638-R642 IonicContact OE1-NE 2.63Å; E638-R642 PolarHBondContact OE1-NE 2.95Å; E638-R642 IonicContact OE1-NH2 3.18Å; E638-R642 PolarHBondContact OE1-NH2 3.18Å
639	D	95.2	Very high	92.4	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.011	23%	0.228	C	C	.	.	H	α-helix	trans	-65.2	-44.4	178.2	-59.7	-52.2	0	0	0	111.8	H627 L628 F635 S636 Y641 R642 V643	H627-D639 IonicContact CD2-OD2 3.8Å; H627-D639 IonicContact CE1-OD2 2.66Å; H627-D639 IonicContact NE2-OD1 3.14Å; H627-D639 IonicContact NE2-OD2 3.49Å; H627-D639 PolarHBondContact NE2-OD2 3.37Å; L628-D639 HydrophobicContact CD2-CB 4.29Å; F635-D639 HydrophobicContact CB-CB 4.46Å; F635-D639 HydrophobicContact CD1-CB 3.95Å; S636-D639 WeakPolarHBondContact CB-OD2 3.45Å; S636-D639 PolarHBondContact N-OD2 3.32Å; S636-D639 PolarHBondContact O-N 3.45Å; S636-D639 PolarHBondContact OG-N 3.16Å; S636-D639 VanDerWaalsContact OG-N 3.11Å; S636-D639 PolarHBondContact OG-OD2 2.96Å; D639-Y641 PolarHBondContact O-N 2.79Å; D639-R642 WeakPolarHBondContact O-CB 3.46Å; D639-R642 PolarHBondContact O-N 3.49Å; D639-R642 VanDerWaalsContact O-N 3.13Å; D639-V643 WeakPolarHBondContact O-CG2 3.41Å; D639-V643 PolarHBondContact O-N 3.27Å
640	L	94.4	Very high	92.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.7	-36.4	175.6	-60	179.4	0	0	0	111.1	V547 L548 W551 F553 L577 L591 F635 S636 M637 V643 K644	V547-L640 HydrophobicContact CG1-CB 4.29Å; V547-L640 HydrophobicContact CG1-CD1 3.87Å; L548-L640 HydrophobicContact CD2-CD1 4.23Å; W551-L640 HydrophobicContact CH2-CB 4.01Å; W551-L640 HydrophobicContact CH2-CD2 4.05Å; W551-L640 HydrophobicContact CZ3-CB 4.22Å; W551-L640 HydrophobicContact CZ3-CD2 4.07Å; F553-L640 HydrophobicContact CE1-CB 4.03Å; F553-L640 HydrophobicContact CZ-CB 3.99Å; F553-L640 WeakPolarHBondContact CZ-O 3.43Å; L577-L640 HydrophobicContact CD1-CD2 3.88Å; L577-L640 HydrophobicContact CD2-CD2 4.33Å; L591-L640 HydrophobicContact CD1-CD2 4.34Å; F635-L640 HydrophobicContact CB-CD2 3.81Å; F635-L640 HydrophobicContact CB-CG 4.1Å; F635-L640 HydrophobicContact CD1-CD2 3.83Å; F635-L640 HydrophobicContact CG-CD2 3.82Å; S636-L640 WeakPolarHBondContact O-CG 3.48Å; S636-L640 PolarHBondContact O-N 2.99Å; S636-L640 VanDerWaalsContact O-N 3.15Å; M637-L640 PolarHBondContact O-N 3.04Å; L640-V643 PolarHBondContact O-N 3.05Å; L640-K644 PolarHBondContact O-N 3.18Å
641	Y	95.1	Very high	93.1	Very high	80 Å²	80	47.3 Å²	47.3	31%	0.314	24%	0.24	S	C	.	.	H	α-helix	trans	-70.8	-35.4	175.6	-174.3	-126.4	0	0	0	112.6	F553 W570 M637 E638 D639 K644 K645	F553-Y641 AromaticContact CD1-CD2 3.87Å; F553-Y641 HydrophobicContact CD1-CD2 3.87Å; F553-Y641 HydrophobicContact CD1-CG 4.48Å; F553-Y641 HydrophobicContact CE1-CD2 4.33Å; F553-Y641 HydrophobicContact CG-CD2 4.43Å; W570-Y641 HydrophobicContact CZ2-CD1 4.32Å; W570-Y641 HydrophobicContact CZ2-CG 4.36Å; M637-Y641 WeakPolarHBondContact O-CB 3.43Å; M637-Y641 PolarHBondContact O-N 3.43Å; E638-Y641 WeakPolarHBondContact O-CB 3.35Å; E638-Y641 PolarHBondContact O-N 3.02Å; D639-Y641 PolarHBondContact O-N 2.79Å; Y641-K644 WeakPolarHBondContact O-CB 3.45Å; Y641-K644 PolarHBondContact O-N 3.39Å; Y641-K645 HydrophobicContact CE1-CD 4.38Å; Y641-K645 VanDerWaalsContact CE1-CE 3.44Å; Y641-K645 PolarHBondContact O-N 3.27Å; Y641-K645 WeakPolarHBondContact OH-CE 3.23Å
642	R	94.9	Very high	93.7	Very high	73 Å²	73	39.7 Å²	39.7	28%	0.275	21%	0.205	S	C	.	.	H	α-helix	trans	-67.6	-35.2	170.8	-70.5	171.9	-174	-165.6	4.8	112.7	E638 D639 K645 G646 Q647 L648	E638-R642 WeakPolarHBondContact O-CG 3.26Å; E638-R642 PolarHBondContact O-N 3.49Å; E638-R642 IonicContact OE1-CZ 3.82Å; E638-R642 VanDerWaalsContact OE1-CZ 3.29Å; E638-R642 IonicContact OE1-NE 2.63Å; E638-R642 PolarHBondContact OE1-NE 2.95Å; E638-R642 IonicContact OE1-NH2 3.18Å; E638-R642 PolarHBondContact OE1-NH2 3.18Å; D639-R642 WeakPolarHBondContact O-CB 3.46Å; D639-R642 PolarHBondContact O-N 3.49Å; D639-R642 VanDerWaalsContact O-N 3.13Å; R642-K645 PolarHBondContact O-N 2.98Å; R642-G646 PolarHBondContact O-N 2.84Å; R642-Q647 PolarHBondContact O-N 2.9Å; R642-L648 HydrophobicContact CB-CB 4.1Å; R642-L648 PolarHBondContact O-N 3.29Å
643	V	94.6	Very high	94.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-46.1	168.9	175.4	0	0	0	0	110	W551 D590 L591 D639 L640 K645 G646 L648	W551-V643 HydrophobicContact CH2-CB 4.36Å; W551-V643 HydrophobicContact CH2-CG1 4.25Å; W551-V643 HydrophobicContact CZ2-CB 4.23Å; W551-V643 HydrophobicContact CZ2-CG1 3.92Å; D590-V643 HydrophobicContact CB-CG1 4.18Å; L591-V643 HydrophobicContact CB-CG1 4.16Å; L591-V643 HydrophobicContact CD1-CG1 4.17Å; L591-V643 HydrophobicContact CD1-CG2 4.34Å; D639-V643 WeakPolarHBondContact O-CG2 3.41Å; D639-V643 PolarHBondContact O-N 3.27Å; L640-V643 PolarHBondContact O-N 3.05Å; V643-K645 PolarHBondContact O-N 2.77Å; V643-G646 PolarHBondContact O-N 2.93Å; V643-L648 HydrophobicContact CG2-CB 4.09Å; V643-L648 HydrophobicContact CG2-CD2 3.56Å; V643-L648 HydrophobicContact CG2-CG 4.47Å
644	K	94.1	Very high	94.5	Very high	105 Å²	105	42.1 Å²	42.1	46%	0.457	21%	0.213	S	C	.	.	H	α-helix	trans	-58.8	-30.4	177.1	-158.9	-144.2	-171.8	179.8	0	113.2	W551 F553 L640 Y641	W551-K644 HydrophobicContact CZ2-CB 4.31Å; F553-K644 HydrophobicContact CB-CD 4.22Å; F553-K644 HydrophobicContact CD2-CB 4.36Å; F553-K644 HydrophobicContact CD2-CD 3.47Å; F553-K644 VanDerWaalsContact CD2-CD 3.47Å; F553-K644 HydrophobicContact CD2-CG 3.89Å; F553-K644 HydrophobicContact CE2-CB 3.88Å; F553-K644 HydrophobicContact CE2-CD 3.86Å; F553-K644 HydrophobicContact CE2-CG 3.73Å; F553-K644 HydrophobicContact CG-CD 3.88Å; F553-K644 HydrophobicContact CZ-CB 3.98Å; F553-K644 HydrophobicContact CZ-CG 4.35Å; L640-K644 PolarHBondContact O-N 3.18Å; Y641-K644 WeakPolarHBondContact O-CB 3.45Å; Y641-K644 PolarHBondContact O-N 3.39Å
645	K	94.4	Very high	94.6	Very high	109 Å²	109	40.2 Å²	40.2	47%	0.474	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-2.3	174.3	-72.1	178.2	173.7	171.2	0	114.2	Y641 R642 V643 Q647	Y641-K645 HydrophobicContact CE1-CD 4.38Å; Y641-K645 VanDerWaalsContact CE1-CE 3.44Å; Y641-K645 PolarHBondContact O-N 3.27Å; Y641-K645 WeakPolarHBondContact OH-CE 3.23Å; R642-K645 PolarHBondContact O-N 2.98Å; V643-K645 PolarHBondContact O-N 2.77Å; K645-Q647 HydrophobicContact CB-CB 4.42Å; K645-Q647 HydrophobicContact CB-CG 3.85Å; K645-Q647 PolarHBondContact O-N 3.26Å; K645-Q647 VanDerWaalsContact O-N 3.08Å
646	G	92.8	Very high	94.7	Very high	26 Å²	26	41.2 Å²	41.2	27%	0.268	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.6	-4	-171.7	0	0	0	0	0	114.9	R642 V643 L648 V649 A650	R642-G646 PolarHBondContact O-N 2.84Å; V643-G646 PolarHBondContact O-N 2.93Å; G646-L648 PolarHBondContact O-N 3.43Å; G646-V649 PolarHBondContact O-N 3.35Å; G646-A650 PolarHBondContact O-N 3.37Å
647	Q	94.3	Very high	94.7	Very high	103 Å²	103	44.4 Å²	44.4	48%	0.481	23%	0.227	S	C	.	.	H	α-helix	trans	-61.7	-43.7	-174.7	-71.9	177	-50.1	0	0	111.8	R642 K645 V649 A650 Q651	R642-Q647 PolarHBondContact O-N 2.9Å; K645-Q647 HydrophobicContact CB-CB 4.42Å; K645-Q647 HydrophobicContact CB-CG 3.85Å; K645-Q647 PolarHBondContact O-N 3.26Å; K645-Q647 VanDerWaalsContact O-N 3.08Å; Q647-V649 VanDerWaalsContact C-N 3.33Å; Q647-V649 PolarHBondContact O-N 3.29Å; Q647-A650 PolarHBondContact O-N 2.89Å; Q647-Q651 WeakPolarHBondContact O-CB 3.46Å; Q647-Q651 PolarHBondContact O-N 3.07Å
648	L	93.5	Very high	94.7	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.8	-35.5	-178.9	-159.3	70.9	0	0	0	112.2	F594 L624 L628 R642 V643 G646 A652	F594-L648 HydrophobicContact CD1-CD2 4Å; F594-L648 HydrophobicContact CD2-CD2 3.87Å; F594-L648 HydrophobicContact CD2-CG 3.83Å; F594-L648 HydrophobicContact CE1-CD2 3.79Å; F594-L648 HydrophobicContact CE2-CD1 4.43Å; F594-L648 HydrophobicContact CE2-CD2 3.66Å; F594-L648 HydrophobicContact CE2-CG 3.59Å; F594-L648 HydrophobicContact CG-CD2 4.04Å; F594-L648 HydrophobicContact CG-CG 4.46Å; F594-L648 HydrophobicContact CZ-CD2 3.63Å; F594-L648 HydrophobicContact CZ-CG 4.02Å; L624-L648 HydrophobicContact CD1-CD1 3.7Å; L628-L648 HydrophobicContact CD1-CD1 3.83Å; L628-L648 HydrophobicContact CD1-CD2 4.07Å; L628-L648 HydrophobicContact CD1-CG 4.5Å; R642-L648 HydrophobicContact CB-CB 4.1Å; R642-L648 PolarHBondContact O-N 3.29Å; V643-L648 HydrophobicContact CG2-CB 4.09Å; V643-L648 HydrophobicContact CG2-CD2 3.56Å; V643-L648 HydrophobicContact CG2-CG 4.47Å; G646-L648 PolarHBondContact O-N 3.43Å; L648-A652 WeakPolarHBondContact O-CB 3.31Å; L648-A652 PolarHBondContact O-N 2.81Å
649	V	95	Very high	94.7	Very high	5 Å²	5	43.1 Å²	43.1	3%	0.03	23%	0.225	C	C	.	.	H	α-helix	trans	-70.6	-41	175.6	176.3	0	0	0	0	111.2	D590 R593 F594 L597 G646 Q647 R653	D590-V649 HydrophobicContact CB-CG2 3.96Å; D590-V649 WeakPolarHBondContact O-CG2 3.28Å; R593-V649 HydrophobicContact CG-CG1 4.19Å; F594-V649 HydrophobicContact CB-CG2 4.08Å; L597-V649 HydrophobicContact CD1-CG1 4.09Å; G646-V649 PolarHBondContact O-N 3.35Å; Q647-V649 VanDerWaalsContact C-N 3.33Å; Q647-V649 PolarHBondContact O-N 3.29Å; V649-R653 VanDerWaalsContact O-CB 3.24Å; V649-R653 WeakPolarHBondContact O-CB 3.44Å; V649-R653 PolarHBondContact O-N 3Å
650	A	95.1	Very high	94.7	Very high	61 Å²	61	44.9 Å²	44.9	50%	0.504	24%	0.236	S	C	.	.	H	α-helix	trans	-64.8	-46.2	176.6	0	0	0	0	0	111.4	G646 Q647 R653 A654	G646-A650 PolarHBondContact O-N 3.37Å; Q647-A650 PolarHBondContact O-N 2.89Å; A650-R653 PolarHBondContact O-N 3.27Å; A650-A654 PolarHBondContact O-N 3.25Å
651	Q	94.4	Very high	94.7	Very high	51 Å²	51	50.4 Å²	50.4	24%	0.238	26%	0.261	C	S	.	.	H	α-helix	trans	-59.5	-54.7	175.2	-175	179.9	10	0	0	111.1	P623 Q647 R653 A654 L655	P623-Q651 PolarHBondContact O-NE2 3.5Å; Q647-Q651 WeakPolarHBondContact O-CB 3.46Å; Q647-Q651 PolarHBondContact O-N 3.07Å; Q651-R653 PolarHBondContact O-N 2.72Å; Q651-A654 PolarHBondContact O-N 2.96Å; Q651-A654 VanDerWaalsContact O-N 3.12Å; Q651-L655 HydrophobicContact CG-CD1 4.26Å; Q651-L655 WeakPolarHBondContact O-CG 3.27Å; Q651-L655 PolarHBondContact O-N 3.48Å
652	A	95.1	Very high	94.8	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.6	-32.9	179.5	0	0	0	0	0	113.2	F594 L597 L601 L648 L656	F594-A652 HydrophobicContact CD2-CB 3.95Å; F594-A652 HydrophobicContact CE2-CB 3.92Å; L597-A652 HydrophobicContact CB-CB 4.07Å; L597-A652 HydrophobicContact CD1-CB 4.05Å; L601-A652 HydrophobicContact CD1-CB 3.77Å; L648-A652 WeakPolarHBondContact O-CB 3.31Å; L648-A652 PolarHBondContact O-N 2.81Å; A652-L656 WeakPolarHBondContact O-CB 3.46Å; A652-L656 PolarHBondContact O-N 3.22Å; A652-L656 VanDerWaalsContact O-N 3.11Å
653	R	95.1	Very high	94.8	Very high	106 Å²	106	44.5 Å²	44.5	40%	0.4	24%	0.24	S	C	.	.	H	α-helix	trans	-70	-46.3	174.4	179.8	166.7	-61.8	-75.7	-16.3	112.6	L597 V649 A650 Q651 L656 T657	L597-R653 HydrophobicContact CD1-CB 4.3Å; V649-R653 VanDerWaalsContact O-CB 3.24Å; V649-R653 WeakPolarHBondContact O-CB 3.44Å; V649-R653 PolarHBondContact O-N 3Å; A650-R653 PolarHBondContact O-N 3.27Å; Q651-R653 PolarHBondContact O-N 2.72Å; R653-L656 PolarHBondContact O-N 3.23Å; R653-T657 PolarHBondContact O-N 3.19Å; R653-T657 PolarHBondContact O-OG1 2.96Å
654	A	95.3	Very high	94.7	Very high	59 Å²	59	48.3 Å²	48.3	49%	0.488	26%	0.26	S	S	.	.	H	α-helix	trans	-60.6	-46	178.6	0	0	0	0	0	111.2	A650 Q651 L656 T657 A658	A650-A654 PolarHBondContact O-N 3.25Å; Q651-A654 PolarHBondContact O-N 2.96Å; Q651-A654 VanDerWaalsContact O-N 3.12Å; A654-L656 VanDerWaalsContact C-N 3.33Å; A654-L656 PolarHBondContact O-N 3.38Å; A654-T657 WeakPolarHBondContact O-CB 3.23Å; A654-T657 PolarHBondContact O-N 2.86Å; A654-T657 VanDerWaalsContact O-N 3.17Å; A654-A658 PolarHBondContact O-N 3.29Å
655	L	94.9	Very high	94.7	Very high	14 Å²	14	49.8 Å²	49.8	7%	0.073	27%	0.273	C	S	.	.	H	α-helix	trans	-61.7	-38.5	176.1	-62.5	-177.5	0	0	0	112.7	L601 E620 L624 Q651 A659	L601-L655 HydrophobicContact CD2-CB 4Å; E620-L655 HydrophobicContact CB-CD2 3.65Å; E620-L655 WeakPolarHBondContact O-CD2 3.29Å; L624-L655 HydrophobicContact CB-CD1 4.07Å; L624-L655 HydrophobicContact CD2-CD1 4.18Å; Q651-L655 HydrophobicContact CG-CD1 4.26Å; Q651-L655 WeakPolarHBondContact O-CG 3.27Å; Q651-L655 PolarHBondContact O-N 3.48Å; L655-A659 WeakPolarHBondContact O-CB 3.44Å; L655-A659 PolarHBondContact O-N 2.9Å
656	L	94.8	Very high	94.7	Very high	22 Å²	22	45.1 Å²	45.1	12%	0.115	25%	0.254	C	S	.	.	H	α-helix	trans	-67.3	-40.1	175.3	-177.5	64.7	0	0	0	111.6	L597 Q600 L601 I604 A652 R653 A654 A659 V660	L597-L656 HydrophobicContact CD2-CD2 3.6Å; Q600-L656 HydrophobicContact CB-CD1 3.93Å; Q600-L656 HydrophobicContact CB-CD2 4.04Å; L601-L656 HydrophobicContact CD2-CB 4.03Å; L601-L656 HydrophobicContact CD2-CD1 4.47Å; I604-L656 HydrophobicContact CG2-CD1 4.39Å; A652-L656 WeakPolarHBondContact O-CB 3.46Å; A652-L656 PolarHBondContact O-N 3.22Å; A652-L656 VanDerWaalsContact O-N 3.11Å; R653-L656 PolarHBondContact O-N 3.23Å; A654-L656 VanDerWaalsContact C-N 3.33Å; A654-L656 PolarHBondContact O-N 3.38Å; L656-A659 PolarHBondContact O-N 2.87Å; L656-V660 HydrophobicContact CD1-CG2 4.2Å; L656-V660 HydrophobicContact CG-CG2 4.41Å; L656-V660 WeakPolarHBondContact O-CB 3.36Å; L656-V660 VanDerWaalsContact O-CG2 3.27Å; L656-V660 WeakPolarHBondContact O-CG2 3.31Å; L656-V660 PolarHBondContact O-N 3Å
657	T	95.5	Very high	94.7	Very high	69 Å²	69	51.8 Å²	51.8	42%	0.423	28%	0.278	S	S	.	.	H	α-helix	trans	-60.9	-53.9	175.5	-70	0	0	0	0	111.1	R653 A654 A659 V660 E661	R653-T657 PolarHBondContact O-N 3.19Å; R653-T657 PolarHBondContact O-OG1 2.96Å; A654-T657 WeakPolarHBondContact O-CB 3.23Å; A654-T657 PolarHBondContact O-N 2.86Å; A654-T657 VanDerWaalsContact O-N 3.17Å; T657-A659 VanDerWaalsContact C-N 3.29Å; T657-A659 PolarHBondContact O-N 3.45Å; T657-V660 PolarHBondContact O-N 2.63Å; T657-V660 VanDerWaalsContact O-N 3.11Å; T657-E661 HydrophobicContact CG2-CG 4.4Å; T657-E661 WeakPolarHBondContact CG2-OE1 3.39Å; T657-E661 WeakPolarHBondContact O-CG 3.25Å; T657-E661 PolarHBondContact O-N 2.67Å
658	A	95.3	Very high	94.7	Very high	20 Å²	20	50 Å²	50	17%	0.165	27%	0.271	C	S	.	.	H	α-helix	trans	-59	-39.5	177.8	0	0	0	0	0	112.5	E620 A654 H662	E620-A658 WeakPolarHBondContact OE2-CB 3.43Å; A654-A658 PolarHBondContact O-N 3.29Å; A658-H662 WeakPolarHBondContact O-CB 3.41Å; A658-H662 PolarHBondContact O-N 2.87Å
659	A	95.3	Very high	94.7	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.8	-36.7	175.8	0	0	0	0	0	113.4	I604 L608 V617 L655 L656 T657 V663	I604-A659 HydrophobicContact CD1-CB 3.68Å; I604-A659 WeakPolarHBondContact CD1-O 3.19Å; I604-A659 HydrophobicContact CG1-CB 4.1Å; I604-A659 HydrophobicContact CG2-CB 3.78Å; L608-A659 HydrophobicContact CD1-CB 3.93Å; V617-A659 HydrophobicContact CG1-CB 4.29Å; L655-A659 WeakPolarHBondContact O-CB 3.44Å; L655-A659 PolarHBondContact O-N 2.9Å; L656-A659 PolarHBondContact O-N 2.87Å; T657-A659 VanDerWaalsContact C-N 3.29Å; T657-A659 PolarHBondContact O-N 3.45Å; A659-V663 WeakPolarHBondContact O-CG2 3.46Å; A659-V663 PolarHBondContact O-N 2.76Å; A659-V663 VanDerWaalsContact O-N 3.1Å
660	V	94.6	Very high	94.6	Very high	40 Å²	40	55.8 Å²	55.8	24%	0.242	29%	0.293	C	S	.	.	H	α-helix	trans	-71.9	-45	174.9	168.7	0	0	0	0	111	I604 L656 T657 H662 V663 D664 F688	I604-V660 HydrophobicContact CD1-CG2 3.77Å; L656-V660 HydrophobicContact CD1-CG2 4.2Å; L656-V660 HydrophobicContact CG-CG2 4.41Å; L656-V660 WeakPolarHBondContact O-CB 3.36Å; L656-V660 VanDerWaalsContact O-CG2 3.27Å; L656-V660 WeakPolarHBondContact O-CG2 3.31Å; L656-V660 PolarHBondContact O-N 3Å; T657-V660 PolarHBondContact O-N 2.63Å; T657-V660 VanDerWaalsContact O-N 3.11Å; V660-H662 PolarHBondContact O-N 2.98Å; V660-V663 WeakPolarHBondContact O-CA 3.42Å; V660-V663 PolarHBondContact O-N 2.92Å; V660-D664 PolarHBondContact O-N 2.92Å; V660-F688 HydrophobicContact CG2-CE2 3.98Å
661	E	95.4	Very high	94.4	Very high	115 Å²	115	56.2 Å²	56.2	54%	0.537	30%	0.303	S	S	.	.	H	α-helix	trans	-57.5	-38.4	174.8	-72.9	172.8	-174.2	0	0	111.6	T657 N665	T657-E661 HydrophobicContact CG2-CG 4.4Å; T657-E661 WeakPolarHBondContact CG2-OE1 3.39Å; T657-E661 WeakPolarHBondContact O-CG 3.25Å; T657-E661 PolarHBondContact O-N 2.67Å; E661-N665 WeakPolarHBondContact O-CB 3.41Å; E661-N665 PolarHBondContact O-N 2.97Å; E661-N665 VanDerWaalsContact O-N 3.13Å; E661-N665 PolarHBondContact O-ND2 3.16Å
662	H	95.6	Very high	94.2	Very high	30 Å²	30	59.5 Å²	59.5	14%	0.139	31%	0.313	C	S	.	.	H	α-helix	trans	-64.2	-44.4	170.4	-179.5	82.5	0	0	0	112.7	L608 L613 V617 A658 V660 D664 N665 C666	L608-H662 WeakPolarHBondContact CD2-CD2 3.34Å; L613-H662 PolarHBondContact O-CE1 3.02Å; L613-H662 VanDerWaalsContact O-CE1 3.26Å; V617-H662 HydrophobicContact CG1-CB 4.45Å; V617-H662 HydrophobicContact CG2-CB 3.99Å; A658-H662 WeakPolarHBondContact O-CB 3.41Å; A658-H662 PolarHBondContact O-N 2.87Å; V660-H662 PolarHBondContact O-N 2.98Å; H662-D664 VanDerWaalsContact C-N 3.34Å; H662-D664 PolarHBondContact O-N 3.28Å; H662-N665 PolarHBondContact O-N 2.85Å; H662-C666 WeakPolarHBondContact O-CA 3.39Å; H662-C666 WeakPolarHBondContact O-CB 3.21Å; H662-C666 PolarHBondContact O-N 3.37Å
663	V	94.9	Very high	94	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-64.4	-38	-180	166.4	0	0	0	0	112.1	I604 L607 L608 A659 V660 C669 R670 F686 F688	I604-V663 HydrophobicContact CD1-CG2 3.96Å; I604-V663 HydrophobicContact CG1-CG2 3.98Å; L607-V663 HydrophobicContact CD2-CG1 4.21Å; L607-V663 HydrophobicContact CD2-CG2 3.72Å; L608-V663 HydrophobicContact CD2-CG2 4.38Å; A659-V663 WeakPolarHBondContact O-CG2 3.46Å; A659-V663 PolarHBondContact O-N 2.76Å; A659-V663 VanDerWaalsContact O-N 3.1Å; V660-V663 WeakPolarHBondContact O-CA 3.42Å; V660-V663 PolarHBondContact O-N 2.92Å; V663-C669 HydrophobicContact CB-CB 4.21Å; V663-C669 HydrophobicContact CG1-CB 4.14Å; V663-C669 HydrophobicContact CG2-CB 4.02Å; V663-R670 VanDerWaalsContact O-CG 3.27Å; V663-R670 WeakPolarHBondContact O-CG 3.41Å; V663-F686 HydrophobicContact CG1-CD1 4.42Å; V663-F686 HydrophobicContact CG1-CD2 4.08Å; V663-F686 HydrophobicContact CG1-CE1 3.87Å; V663-F686 HydrophobicContact CG1-CE2 3.48Å; V663-F686 VanDerWaalsContact CG1-CE2 3.48Å; V663-F686 HydrophobicContact CG1-CZ 3.35Å; V663-F688 HydrophobicContact CG1-CZ 4.24Å
664	D	92.6	Very high	93.8	Very high	80 Å²	80	58.6 Å²	58.6	43%	0.428	32%	0.318	S	S	.	.	H	α-helix	trans	-76.2	-27.9	-179.4	-69.3	-23.1	0	0	0	112.9	V660 H662 R670	V660-D664 PolarHBondContact O-N 2.92Å; H662-D664 VanDerWaalsContact C-N 3.34Å; H662-D664 PolarHBondContact O-N 3.28Å; D664-R670 WeakPolarHBondContact O-CD 3.39Å; D664-R670 PolarHBondContact O-NH1 2.94Å
665	N	93.9	Very high	93.7	Very high	136 Å²	136	60.8 Å²	60.8	73%	0.727	32%	0.321	S	S	*	.	H	α-helix	trans	-93.2	-18.4	175.7	-70.3	-70.4	0	0	0	114.2	E661 H662	E661-N665 WeakPolarHBondContact O-CB 3.41Å; E661-N665 PolarHBondContact O-N 2.97Å; E661-N665 VanDerWaalsContact O-N 3.13Å; E661-N665 PolarHBondContact O-ND2 3.16Å; H662-N665 PolarHBondContact O-N 2.85Å
666	C	94.9	Very high	93.6	Very high	10 Å²	10	60.1 Å²	60.1	7%	0.068	32%	0.317	C	S	.	.			trans	-96.7	111.2	-177.2	-171.8	0	0	0	0	112.8	C611 H662 L668 C669 R670	C611-C666 VanDerWaalsContact SG-SG 3.65Å; H662-C666 WeakPolarHBondContact O-CA 3.39Å; H662-C666 WeakPolarHBondContact O-CB 3.21Å; H662-C666 PolarHBondContact O-N 3.37Å; C666-L668 PolarHBondContact O-N 2.93Å; C666-L668 VanDerWaalsContact O-N 3.16Å; C666-C669 HydrophobicContact CB-CB 4.11Å; C666-C669 WeakPolarHBondContact O-CB 3.26Å; C666-C669 PolarHBondContact O-N 2.86Å; C666-R670 WeakPolarHBondContact O-CG 3.36Å; C666-R670 PolarHBondContact O-N 3.44Å
667	E	93.7	Very high	93.4	Very high	167 Å²	167	62 Å²	62	78%	0.78	33%	0.326	S	S	*	.	H	α-helix	trans	-54.4	-35.5	177.2	-59.5	-173.4	150.1	0	0	113.6	C669 R670 G671	E667-C669 VanDerWaalsContact C-N 3.3Å; E667-C669 PolarHBondContact O-N 3.37Å; E667-R670 PolarHBondContact O-N 2.86Å; E667-G671 PolarHBondContact O-N 3.24Å
668	L	93.6	Very high	93.1	Very high	65 Å²	65	62 Å²	62	34%	0.34	32%	0.32	S	S	.	.	H	α-helix	trans	-68.9	-27	178.1	-55.1	179.8	0	0	0	113	R612 L613 C666	R612-L668 HydrophobicContact CG-CD1 3.72Å; L613-L668 HydrophobicContact CD1-CD1 3.81Å; L613-L668 HydrophobicContact CD1-CG 4.38Å; L613-L668 HydrophobicContact CG-CD1 3.94Å; C666-L668 PolarHBondContact O-N 2.93Å; C666-L668 VanDerWaalsContact O-N 3.16Å
669	C	94.3	Very high	92.9	Very high	0 Å²	0	64 Å²	64	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-80	-45.4	171.2	-70.8	0	0	0	0	110.6	L607 C611 V663 C666 E667 G671 R672 G673 F686	L607-C669 HydrophobicContact CD2-CB 4.31Å; C611-C669 VanDerWaalsContact SG-SG 3.64Å; V663-C669 HydrophobicContact CB-CB 4.21Å; V663-C669 HydrophobicContact CG1-CB 4.14Å; V663-C669 HydrophobicContact CG2-CB 4.02Å; C666-C669 HydrophobicContact CB-CB 4.11Å; C666-C669 WeakPolarHBondContact O-CB 3.26Å; C666-C669 PolarHBondContact O-N 2.86Å; E667-C669 VanDerWaalsContact C-N 3.3Å; E667-C669 PolarHBondContact O-N 3.37Å; C669-G671 VanDerWaalsContact C-N 3.35Å; C669-G671 PolarHBondContact O-N 3.34Å; C669-R672 PolarHBondContact O-N 2.91Å; C669-G673 PolarHBondContact O-N 3.36Å; C669-F686 WeakPolarHBondContact O-CE1 3.38Å
670	R	92.6	Very high	92.5	Very high	126 Å²	126	73.7 Å²	73.7	48%	0.475	37%	0.368	S	S	.	.	H	α-helix	trans	-57.9	-43	177.6	-65.4	175	69.6	168.3	-5.4	112.8	V663 D664 C666 E667 R672 G673 I684	V663-R670 VanDerWaalsContact O-CG 3.27Å; V663-R670 WeakPolarHBondContact O-CG 3.41Å; D664-R670 WeakPolarHBondContact O-CD 3.39Å; D664-R670 PolarHBondContact O-NH1 2.94Å; C666-R670 WeakPolarHBondContact O-CG 3.36Å; C666-R670 PolarHBondContact O-N 3.44Å; E667-R670 PolarHBondContact O-N 2.86Å; R670-R672 PolarHBondContact O-N 3.31Å; R670-G673 PolarHBondContact O-N 3.31Å; R670-I684 HydrophobicContact CB-CD1 4.25Å
671	G	90.8	Very high	92.1	Very high	71 Å²	71	73.9 Å²	73.9	73%	0.732	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-6.5	175.9	0	0	0	0	0	115.3	E667 C669	E667-G671 PolarHBondContact O-N 3.24Å; C669-G671 VanDerWaalsContact C-N 3.35Å; C669-G671 PolarHBondContact O-N 3.34Å
672	R	90.1	Very high	91.6	Very high	119 Å²	119	78 Å²	78	45%	0.449	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	1	174.4	-67.2	175.9	174.9	157.3	-4.6	113.9	L607 A610 C669 R670	L607-R672 HydrophobicContact CD1-CB 3.88Å; A610-R672 VanDerWaalsContact O-CZ 3.28Å; A610-R672 PolarHBondContact O-NH1 2.87Å; A610-R672 PolarHBondContact O-NH2 3.15Å; C669-R672 PolarHBondContact O-N 2.91Å; R670-R672 PolarHBondContact O-N 3.31Å
673	G	91.2	Very high	91.2	Very high	20 Å²	20	79.8 Å²	79.8	21%	0.206	40%	0.401	C	S	.	.	S	Bend	trans	-72.2	172.6	167.5	0	0	0	0	0	111.7	C669 R670	C669-G673 PolarHBondContact O-N 3.36Å; R670-G673 PolarHBondContact O-N 3.31Å
674	F	91.3	Very high	91.1	Very high	67 Å²	67	81.9 Å²	81.9	29%	0.294	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	-109.6	145.5	-179.9	-65.5	-101.2	0	0	0	110.6	I685 T701 C702	F674-I685 HydrophobicContact CB-CG1 4.17Å; F674-I685 PolarHBondContact N-O 3.45Å; F674-I685 WeakPolarHBondContact O-CG1 3.25Å; F674-I685 PolarHBondContact O-N 2.86Å; F674-T701 HydrophobicContact CE1-CG2 4.19Å; F674-C702 HydrophobicContact CB-CB 3.76Å; F674-C702 HydrophobicContact CD1-CB 4.25Å; F674-C702 HydrophobicContact CD2-CB 3.78Å; F674-C702 WeakPolarHBondContact CD2-SG 3.2Å; F674-C702 HydrophobicContact CE2-CB 4.45Å; F674-C702 VanDerWaalsContact CE2-SG 3.56Å; F674-C702 HydrophobicContact CG-CB 3.67Å
675	I	92.4	Very high	91.1	Very high	106 Å²	106	78 Å²	78	54%	0.544	39%	0.391	S	S	.	.			trans	-101.2	132.3	166.6	-62.9	173.9	0	0	0	107.7	E677	I675-E677 PolarHBondContact O-N 2.9Å
676	C	92.8	Very high	91	Very high	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.357	C	S	.	.			trans	-73.6	112.3	-176.3	-175.9	0	0	0	0	111.6	F678 C679 R680 I685 H704	C676-F678 PolarHBondContact O-N 3.39Å; C676-C679 PolarHBondContact O-N 2.81Å; C676-R680 WeakPolarHBondContact O-CA 3.3Å; C676-R680 PolarHBondContact O-N 3.45Å; C676-I685 HydrophobicContact CB-CD1 4.05Å; C676-H704 VanDerWaalsContact CB-ND1 3.28Å; C676-H704 WeakPolarHBondContact CB-ND1 3.43Å; C676-H704 PolarHBondContact SG-N 2.85Å; C676-H704 VanDerWaalsContact SG-N 3.44Å
677	E	90.8	Very high	90.8	Very high	62 Å²	62	73 Å²	73	29%	0.29	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-23.4	-176.1	-59.9	-172.9	170.5	0	0	114.8	I675 R680 F703 P714 R718	I675-E677 PolarHBondContact O-N 2.9Å; E677-R680 WeakPolarHBondContact O-CG 3.42Å; E677-R680 PolarHBondContact O-NE 3.43Å; E677-F703 HydrophobicContact CB-CE1 4Å; E677-F703 HydrophobicContact CG-CE1 3.99Å; E677-P714 HydrophobicContact CB-CG 4.18Å; E677-P714 WeakPolarHBondContact OE2-CG 3.48Å; E677-R718 IonicContact OE1-CZ 2.77Å; E677-R718 IonicContact OE1-NH2 3.35Å; E677-R718 PolarHBondContact OE1-NH2 3.19Å; E677-R718 IonicContact OE2-CZ 3.79Å; E677-R718 IonicContact OE2-NH2 2.93Å; E677-R718 PolarHBondContact OE2-NH2 3.35Å
678	F	89.4	Confident	90.6	Very high	69 Å²	69	65.5 Å²	65.5	30%	0.303	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-60.4	-179.6	-68.6	-80.7	0	0	0	112.8	C676 F703 C707 F708 K711 P714	C676-F678 PolarHBondContact O-N 3.39Å; F678-F703 HydrophobicContact CD2-CB 4.3Å; F678-F703 AromaticContact CD2-CD1 3.72Å; F678-F703 HydrophobicContact CD2-CD1 3.72Å; F678-F703 HydrophobicContact CD2-CE1 4.27Å; F678-F703 HydrophobicContact CD2-CG 4.07Å; F678-F703 HydrophobicContact CE2-CB 4.36Å; F678-F703 AromaticContact CE2-CD1 3.8Å; F678-F703 HydrophobicContact CE2-CD1 3.8Å; F678-F703 HydrophobicContact CE2-CD2 4.28Å; F678-F703 HydrophobicContact CE2-CE1 4.13Å; F678-F703 AromaticContact CE2-CG 3.89Å; F678-F703 HydrophobicContact CE2-CG 3.89Å; F678-C707 HydrophobicContact CB-CB 3.84Å; F678-C707 HydrophobicContact CD2-CB 3.99Å; F678-C707 HydrophobicContact CG-CB 4.13Å; F678-F708 HydrophobicContact CE2-CB 4.32Å; F678-F708 AromaticContact CE2-CD2 3.88Å; F678-F708 HydrophobicContact CE2-CD2 3.88Å; F678-F708 HydrophobicContact CZ-CD2 4.09Å; F678-K711 HydrophobicContact CD1-CD 4.42Å; F678-K711 HydrophobicContact CE1-CB 4.2Å; F678-K711 HydrophobicContact CE1-CD 3.95Å; F678-K711 HydrophobicContact CZ-CB 4.13Å; F678-P714 HydrophobicContact CE1-CG 4.38Å; F678-P714 HydrophobicContact CE2-CG 4.17Å; F678-P714 VanDerWaalsContact CZ-CD 3.44Å; F678-P714 HydrophobicContact CZ-CG 4.03Å
679	C	90	Very high	90.5	Very high	61 Å²	61	64.2 Å²	64.2	41%	0.412	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-21.9	-177.7	64.2	0	0	0	0	113.4	C676 A681 H704	C676-C679 PolarHBondContact O-N 2.81Å; C679-A681 PolarHBondContact O-N 2.99Å; C679-H704 VanDerWaalsContact SG-CE1 3.56Å; C679-H704 PolarHBondContact SG-ND1 3.48Å
680	R	86.8	Confident	90	Very high	203 Å²	203	68.4 Å²	68.4	77%	0.766	34%	0.34	S	S	*	.			trans	52.8	21.5	-177.6	-51.9	-177.1	-174	177	2.8	114.6	C676 E677	C676-R680 WeakPolarHBondContact O-CA 3.3Å; C676-R680 PolarHBondContact O-N 3.45Å; E677-R680 WeakPolarHBondContact O-CG 3.42Å; E677-R680 PolarHBondContact O-NE 3.43Å
681	A	87.3	Confident	89.7	Confident	44 Å²	44	68 Å²	68	36%	0.364	35%	0.348	S	S	.	.			trans	-60.3	151.4	171.7	0	0	0	0	0	110.4	C679 D683	C679-A681 PolarHBondContact O-N 2.99Å; A681-D683 PolarHBondContact O-N 3.37Å
682	K	84.1	Confident	89.6	Confident	202 Å²	202	69.4 Å²	69.4	88%	0.878	33%	0.334	S	S	*	.	S	Bend	trans	-74.7	5.3	178.7	-60.4	-177.6	-179.2	179.1	0	114
683	D	88.6	Confident	89.7	Confident	68 Å²	68	64.2 Å²	64.2	36%	0.364	32%	0.316	S	S	.	.			trans	-69.8	132.6	173.1	-164.4	5.9	0	0	0	109.5	A681 K692	A681-D683 PolarHBondContact O-N 3.37Å; D683-K692 IonicContact OD1-NZ 3.9Å; D683-K692 IonicContact OD2-NZ 2.92Å; D683-K692 PolarHBondContact OD2-NZ 2.9Å
684	I	90.9	Very high	89.6	Confident	43 Å²	43	66.8 Å²	66.8	22%	0.221	32%	0.322	C	S	.	.			trans	-101.4	103.9	-175.5	-59.3	179	0	0	0	107.6	R670 F686	R670-I684 HydrophobicContact CB-CD1 4.25Å; I684-F686 HydrophobicContact CG2-CD2 4.47Å; I684-F686 HydrophobicContact CG2-CE2 3.77Å; I684-F686 HydrophobicContact CG2-CZ 3.87Å
685	I	93.3	Very high	89.6	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-90.5	134.4	-178.4	46.9	169	0	0	0	112	F674 C676 C693 C702 F703 H704	F674-I685 HydrophobicContact CB-CG1 4.17Å; F674-I685 PolarHBondContact N-O 3.45Å; F674-I685 WeakPolarHBondContact O-CG1 3.25Å; F674-I685 PolarHBondContact O-N 2.86Å; C676-I685 HydrophobicContact CB-CD1 4.05Å; I685-C693 HydrophobicContact CB-CB 4.41Å; I685-C702 HydrophobicContact CD1-CB 4.05Å; I685-C702 HydrophobicContact CG1-CB 4.4Å; I685-F703 VanDerWaalsContact CD1-CA 3.41Å; I685-H704 WeakPolarHBondContact CG2-NE2 3.18Å
686	F	92.9	Very high	89.5	Confident	5 Å²	5	65.3 Å²	65.3	2%	0.022	31%	0.308	C	S	.	.			trans	-111.3	145.3	176.6	-67.1	-86.4	0	0	0	112	L607 V663 C669 I684 F688 Q689 C693	L607-F686 HydrophobicContact CD2-CD1 3.77Å; L607-F686 HydrophobicContact CD2-CE1 3.65Å; V663-F686 HydrophobicContact CG1-CD1 4.42Å; V663-F686 HydrophobicContact CG1-CD2 4.08Å; V663-F686 HydrophobicContact CG1-CE1 3.87Å; V663-F686 HydrophobicContact CG1-CE2 3.48Å; V663-F686 VanDerWaalsContact CG1-CE2 3.48Å; V663-F686 HydrophobicContact CG1-CZ 3.35Å; C669-F686 WeakPolarHBondContact O-CE1 3.38Å; I684-F686 HydrophobicContact CG2-CD2 4.47Å; I684-F686 HydrophobicContact CG2-CE2 3.77Å; I684-F686 HydrophobicContact CG2-CZ 3.87Å; F686-F688 HydrophobicContact CB-CD1 3.7Å; F686-F688 HydrophobicContact CB-CE1 3.31Å; F686-F688 HydrophobicContact CB-CE2 4.2Å; F686-F688 HydrophobicContact CB-CG 4.28Å; F686-F688 HydrophobicContact CB-CZ 3.58Å; F686-F688 AromaticContact CD1-CE1 3.9Å; F686-F688 HydrophobicContact CD1-CE1 3.9Å; F686-F688 HydrophobicContact CD1-CZ 4.43Å; F686-F688 HydrophobicContact CD2-CE1 4.35Å; F686-F688 HydrophobicContact CD2-CZ 4.09Å; F686-F688 HydrophobicContact CG-CD1 4.43Å; F686-F688 AromaticContact CG-CE1 3.61Å; F686-F688 HydrophobicContact CG-CE1 3.61Å; F686-F688 AromaticContact CG-CZ 3.79Å; F686-F688 HydrophobicContact CG-CZ 3.79Å; F686-F688 PolarHBondContact O-N 2.99Å; F686-F688 VanDerWaalsContact O-N 3.12Å; F686-Q689 HydrophobicContact CB-CG 4.16Å; F686-Q689 WeakPolarHBondContact O-CB 3.21Å; F686-Q689 PolarHBondContact O-N 3.25Å; F686-C693 WeakPolarHBondContact O-CB 3.48Å
687	P	90.1	Very high	89.3	Confident	35 Å²	35	69.9 Å²	69.9	23%	0.227	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-13.9	-177.8	23.6	-32.8	0	0	0	115.6	R695	P687-R695 HydrophobicContact CB-CG 4.26Å; P687-R695 VanDerWaalsContact CB-NE 3.32Å
688	F	89.6	Confident	89.3	Confident	10 Å²	10	72 Å²	72	4%	0.044	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-20.7	171	62.1	-102.8	0	0	0	112.4	Q600 I604 L607 V660 V663 F686 K690	Q600-F688 WeakPolarHBondContact CG-O 3.48Å; I604-F688 HydrophobicContact CB-CD1 3.92Å; I604-F688 HydrophobicContact CB-CE1 4.19Å; I604-F688 HydrophobicContact CB-CG 4.13Å; I604-F688 HydrophobicContact CD1-CD1 4.27Å; I604-F688 HydrophobicContact CD1-CD2 4.19Å; I604-F688 HydrophobicContact CD1-CE1 3.79Å; I604-F688 HydrophobicContact CD1-CE2 3.71Å; I604-F688 HydrophobicContact CD1-CG 4.47Å; I604-F688 HydrophobicContact CD1-CZ 3.5Å; I604-F688 VanDerWaalsContact CD1-CZ 3.5Å; I604-F688 HydrophobicContact CG1-CD1 3.95Å; I604-F688 HydrophobicContact CG1-CE1 3.68Å; I604-F688 HydrophobicContact CG1-CE2 4.43Å; I604-F688 HydrophobicContact CG1-CG 4.44Å; I604-F688 HydrophobicContact CG1-CZ 3.96Å; L607-F688 HydrophobicContact CD2-CE1 4.08Å; V660-F688 HydrophobicContact CG2-CE2 3.98Å; V663-F688 HydrophobicContact CG1-CZ 4.24Å; F686-F688 HydrophobicContact CB-CD1 3.7Å; F686-F688 HydrophobicContact CB-CE1 3.31Å; F686-F688 HydrophobicContact CB-CE2 4.2Å; F686-F688 HydrophobicContact CB-CG 4.28Å; F686-F688 HydrophobicContact CB-CZ 3.58Å; F686-F688 AromaticContact CD1-CE1 3.9Å; F686-F688 HydrophobicContact CD1-CE1 3.9Å; F686-F688 HydrophobicContact CD1-CZ 4.43Å; F686-F688 HydrophobicContact CD2-CE1 4.35Å; F686-F688 HydrophobicContact CD2-CZ 4.09Å; F686-F688 HydrophobicContact CG-CD1 4.43Å; F686-F688 AromaticContact CG-CE1 3.61Å; F686-F688 HydrophobicContact CG-CE1 3.61Å; F686-F688 AromaticContact CG-CZ 3.79Å; F686-F688 HydrophobicContact CG-CZ 3.79Å; F686-F688 PolarHBondContact O-N 2.99Å; F686-F688 VanDerWaalsContact O-N 3.12Å; F688-K690 PolarHBondContact O-N 2.8Å
689	Q	90.4	Very high	89.3	Confident	37 Å²	37	70.1 Å²	70.1	17%	0.173	35%	0.35	C	S	.	.			trans	-77.7	61.7	178.2	-61.3	168.7	-28.1	0	0	110.6	F686 D691 K692 C693	F686-Q689 HydrophobicContact CB-CG 4.16Å; F686-Q689 WeakPolarHBondContact O-CB 3.21Å; F686-Q689 PolarHBondContact O-N 3.25Å; Q689-D691 PolarHBondContact O-N 2.94Å; Q689-K692 PolarHBondContact O-N 3.43Å; Q689-K692 VanDerWaalsContact O-N 3.08Å; Q689-C693 WeakPolarHBondContact O-CB 3.33Å; Q689-C693 PolarHBondContact O-N 3.45Å
690	K	84.4	Confident	89.3	Confident	89 Å²	89	73.3 Å²	73.3	39%	0.387	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-24.9	-177	-76.8	-168.4	170.1	-163.2	0	114.2	E599 F688 K705	E599-K690 IonicContact OE1-NZ 3.82Å; E599-K690 PolarHBondContact OE1-NZ 3.21Å; E599-K690 IonicContact OE2-NZ 2.72Å; E599-K690 PolarHBondContact OE2-NZ 3.36Å; F688-K690 PolarHBondContact O-N 2.8Å; K690-K705 WeakPolarHBondContact O-CE 3.47Å; K690-K705 PolarHBondContact O-NZ 3Å
691	D	86.9	Confident	89.5	Confident	117 Å²	117	64.2 Å²	64.2	63%	0.626	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-43.2	-178.8	-54.6	-62.1	0	0	0	112.6	Q689 K705	Q689-D691 PolarHBondContact O-N 2.94Å; D691-K705 WeakPolarHBondContact O-CD 3.21Å; D691-K705 VanDerWaalsContact O-CE 3.31Å; D691-K705 WeakPolarHBondContact O-CE 3.32Å; D691-K705 PolarHBondContact O-NZ 2.89Å
692	K	89	Confident	89.8	Confident	101 Å²	101	62.2 Å²	62.2	44%	0.439	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-38.7	176.9	-68.4	-175.3	169.9	-166.7	0	113.3	D683 Q689 H704 K705	D683-K692 IonicContact OD1-NZ 3.9Å; D683-K692 IonicContact OD2-NZ 2.92Å; D683-K692 PolarHBondContact OD2-NZ 2.9Å; Q689-K692 PolarHBondContact O-N 3.43Å; Q689-K692 VanDerWaalsContact O-N 3.08Å; K692-H704 CarbonylContact O-C 3.15Å; K692-H704 WeakPolarHBondContact O-CA 3.29Å; K692-K705 PolarHBondContact O-N 3.29Å
693	C	90.7	Very high	90.2	Very high	10 Å²	10	52.6 Å²	52.6	7%	0.068	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	134.5	-164.6	167.1	0	0	0	0	112.9	I685 F686 Q689 C702 F703	I685-C693 HydrophobicContact CB-CB 4.41Å; F686-C693 WeakPolarHBondContact O-CB 3.48Å; Q689-C693 WeakPolarHBondContact O-CB 3.33Å; Q689-C693 PolarHBondContact O-N 3.45Å; C693-C702 WeakPolarHBondContact SG-CB 3.36Å; C693-F703 CarbonylContact C-O 3.58Å; C693-F703 WeakPolarHBondContact CA-O 3.21Å
694	Q	89.5	Confident	90.4	Very high	74 Å²	74	50.6 Å²	50.6	35%	0.346	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	130	164.4	-166.7	171.2	-0.6	0	0	110.4	F703 K705 F708	Q694-F703 PolarHBondContact N-O 2.83Å; Q694-F703 PolarHBondContact O-N 3.33Å; Q694-K705 HydrophobicContact CB-CG 4.09Å; Q694-F708 HydrophobicContact CB-CD1 4.24Å; Q694-F708 HydrophobicContact CG-CD1 3.86Å; Q694-F708 HydrophobicContact CG-CE1 4.34Å
695	R	90.8	Very high	90.4	Very high	137 Å²	137	52 Å²	52	52%	0.517	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	140.5	173.4	-85.3	175.8	146.6	157.5	-3.7	111.1	P687 T701	P687-R695 HydrophobicContact CB-CG 4.26Å; P687-R695 VanDerWaalsContact CB-NE 3.32Å; R695-T701 CarbonylContact C-O 3.52Å; R695-T701 WeakPolarHBondContact CA-O 3.5Å
696	C	91.2	Very high	90.2	Very high	4 Å²	4	58.1 Å²	58.1	3%	0.027	29%	0.291	C	S	.	.			trans	-65.4	128.9	164	178.8	0	0	0	0	110	V698 K700 T701 F703 F708 C713	C696-V698 PolarHBondContact O-N 2.72Å; C696-K700 VanDerWaalsContact O-CA 3.23Å; C696-K700 WeakPolarHBondContact O-CA 3.46Å; C696-K700 PolarHBondContact O-N 3.29Å; C696-K700 VanDerWaalsContact O-N 3.11Å; C696-T701 PolarHBondContact N-O 2.68Å; C696-F703 HydrophobicContact CB-CE2 4.17Å; C696-F708 HydrophobicContact CB-CZ 4.44Å; C696-C713 HydrophobicContact CB-CB 4.31Å; C696-C713 VanDerWaalsContact SG-CB 3.58Å
697	P	88.5	Confident	90.1	Very high	96 Å²	96	59 Å²	59	62%	0.623	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-29	-178.1	24.5	-33.9	0	0	0	113.1	K700	P697-K700 WeakPolarHBondContact O-CE 3.34Å; P697-K700 PolarHBondContact O-NZ 2.73Å
698	V	90.3	Very high	90.1	Very high	108 Å²	108	58.3 Å²	58.3	66%	0.655	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-77.2	-179.9	-178.6	0	0	0	0	110.8	C696 K700	C696-V698 PolarHBondContact O-N 2.72Å; V698-K700 VanDerWaalsContact C-N 3.29Å; V698-K700 PolarHBondContact O-N 3.36Å
699	C	90.9	Very high	89.9	Confident	28 Å²	28	63 Å²	63	19%	0.189	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	10	-171.8	68.9	0	0	0	0	115.5	T701 C716 I719	C699-T701 PolarHBondContact O-N 3.32Å; C699-T701 PolarHBondContact SG-OG1 3.46Å; C699-T701 VanDerWaalsContact SG-OG1 3.4Å; C699-C716 PolarHBondContact SG-SG 2.83Å; C699-I719 HydrophobicContact CB-CD1 4.27Å
700	K	89.6	Confident	89.1	Confident	128 Å²	128	65.6 Å²	65.6	56%	0.557	35%	0.352	S	S	*	.			trans	56.4	2.7	174	-45	-56.1	-176.9	-174.3	0	117.6	C696 P697 V698	C696-K700 VanDerWaalsContact O-CA 3.23Å; C696-K700 WeakPolarHBondContact O-CA 3.46Å; C696-K700 PolarHBondContact O-N 3.29Å; C696-K700 VanDerWaalsContact O-N 3.11Å; P697-K700 WeakPolarHBondContact O-CE 3.34Å; P697-K700 PolarHBondContact O-NZ 2.73Å; V698-K700 VanDerWaalsContact C-N 3.29Å; V698-K700 PolarHBondContact O-N 3.36Å
701	T	91.3	Very high	89	Confident	12 Å²	12	66.4 Å²	66.4	7%	0.074	36%	0.356	C	S	.	.			trans	-65.8	148.2	175.7	52.3	0	0	0	0	112.2	F674 R695 C696 C699 F703 K715	F674-T701 HydrophobicContact CE1-CG2 4.19Å; R695-T701 CarbonylContact C-O 3.52Å; R695-T701 WeakPolarHBondContact CA-O 3.5Å; C696-T701 PolarHBondContact N-O 2.68Å; C699-T701 PolarHBondContact O-N 3.32Å; C699-T701 PolarHBondContact SG-OG1 3.46Å; C699-T701 VanDerWaalsContact SG-OG1 3.4Å; T701-F703 WeakPolarHBondContact OG1-CE2 3.21Å; T701-F703 WeakPolarHBondContact OG1-CZ 3.4Å; T701-K715 HydrophobicContact CG2-CD 3.45Å; T701-K715 VanDerWaalsContact CG2-CD 3.45Å
702	C	91.9	Very high	89	Confident	2 Å²	2	71.6 Å²	71.6	1%	0.014	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	141.5	-179.2	-55.4	0	0	0	0	111.3	F674 I685 C693	F674-C702 HydrophobicContact CB-CB 3.76Å; F674-C702 HydrophobicContact CD1-CB 4.25Å; F674-C702 HydrophobicContact CD2-CB 3.78Å; F674-C702 WeakPolarHBondContact CD2-SG 3.2Å; F674-C702 HydrophobicContact CE2-CB 4.45Å; F674-C702 VanDerWaalsContact CE2-SG 3.56Å; F674-C702 HydrophobicContact CG-CB 3.67Å; I685-C702 HydrophobicContact CD1-CB 4.05Å; I685-C702 HydrophobicContact CG1-CB 4.4Å; C693-C702 WeakPolarHBondContact SG-CB 3.36Å
703	F	92.7	Very high	89.1	Confident	1 Å²	1	67.2 Å²	67.2	0%	0.004	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	160.6	171.4	-55.4	-71.9	0	0	0	108.8	E677 F678 I685 C693 Q694 C696 T701 F708 C713 P714	E677-F703 HydrophobicContact CB-CE1 4Å; E677-F703 HydrophobicContact CG-CE1 3.99Å; F678-F703 HydrophobicContact CD2-CB 4.3Å; F678-F703 AromaticContact CD2-CD1 3.72Å; F678-F703 HydrophobicContact CD2-CD1 3.72Å; F678-F703 HydrophobicContact CD2-CE1 4.27Å; F678-F703 HydrophobicContact CD2-CG 4.07Å; F678-F703 HydrophobicContact CE2-CB 4.36Å; F678-F703 AromaticContact CE2-CD1 3.8Å; F678-F703 HydrophobicContact CE2-CD1 3.8Å; F678-F703 HydrophobicContact CE2-CD2 4.28Å; F678-F703 HydrophobicContact CE2-CE1 4.13Å; F678-F703 AromaticContact CE2-CG 3.89Å; F678-F703 HydrophobicContact CE2-CG 3.89Å; I685-F703 VanDerWaalsContact CD1-CA 3.41Å; C693-F703 CarbonylContact C-O 3.58Å; C693-F703 WeakPolarHBondContact CA-O 3.21Å; Q694-F703 PolarHBondContact N-O 2.83Å; Q694-F703 PolarHBondContact O-N 3.33Å; C696-F703 HydrophobicContact CB-CE2 4.17Å; T701-F703 WeakPolarHBondContact OG1-CE2 3.21Å; T701-F703 WeakPolarHBondContact OG1-CZ 3.4Å; F703-F708 HydrophobicContact CB-CB 3.91Å; F703-F708 HydrophobicContact CB-CG 4.43Å; F703-F708 HydrophobicContact CD2-CB 4.46Å; F703-F708 AromaticContact CD2-CD2 3.88Å; F703-F708 HydrophobicContact CD2-CD2 3.88Å; F703-F708 HydrophobicContact CD2-CE2 4.31Å; F703-F708 HydrophobicContact CD2-CG 4.09Å; F703-F708 HydrophobicContact CE2-CD2 4.35Å; F703-F708 HydrophobicContact CE2-CE2 4.42Å; F703-F708 HydrophobicContact CG-CB 4.5Å; F703-C713 HydrophobicContact CE2-CB 4.45Å; F703-C713 VanDerWaalsContact CE2-SG 3.58Å; F703-P714 HydrophobicContact CE1-CG 4.15Å; F703-P714 HydrophobicContact CZ-CG 4.16Å
704	H	93.4	Very high	89.1	Confident	25 Å²	25	68.3 Å²	68.3	12%	0.116	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	142.3	165.8	-58.1	108.5	0	0	0	109.2	C676 C679 I685 K692 D706 C707 F708	C676-H704 VanDerWaalsContact CB-ND1 3.28Å; C676-H704 WeakPolarHBondContact CB-ND1 3.43Å; C676-H704 PolarHBondContact SG-N 2.85Å; C676-H704 VanDerWaalsContact SG-N 3.44Å; C679-H704 VanDerWaalsContact SG-CE1 3.56Å; C679-H704 PolarHBondContact SG-ND1 3.48Å; I685-H704 WeakPolarHBondContact CG2-NE2 3.18Å; K692-H704 CarbonylContact O-C 3.15Å; K692-H704 WeakPolarHBondContact O-CA 3.29Å; H704-D706 VanDerWaalsContact C-N 3.34Å; H704-D706 PolarHBondContact O-N 3.46Å; H704-C707 HydrophobicContact CB-CB 3.97Å; H704-C707 WeakPolarHBondContact O-CB 3.42Å; H704-C707 PolarHBondContact O-N 3.23Å; H704-C707 VanDerWaalsContact O-N 3.17Å; H704-F708 PolarHBondContact O-N 3.46Å; H704-F708 VanDerWaalsContact O-N 3.12Å
705	K	90.6	Very high	89	Confident	74 Å²	74	68.7 Å²	68.7	32%	0.322	36%	0.356	S	S	.	.	H	α-helix	trans	-48	-57.7	174.9	-80.3	-179.7	-178.5	157.2	0	111	K690 D691 K692 Q694 C707 F708 L709	K690-K705 WeakPolarHBondContact O-CE 3.47Å; K690-K705 PolarHBondContact O-NZ 3Å; D691-K705 WeakPolarHBondContact O-CD 3.21Å; D691-K705 VanDerWaalsContact O-CE 3.31Å; D691-K705 WeakPolarHBondContact O-CE 3.32Å; D691-K705 PolarHBondContact O-NZ 2.89Å; K692-K705 PolarHBondContact O-N 3.29Å; Q694-K705 HydrophobicContact CB-CG 4.09Å; K705-C707 PolarHBondContact O-N 3.04Å; K705-C707 VanDerWaalsContact O-N 3.15Å; K705-F708 PolarHBondContact O-N 3.41Å; K705-L709 WeakPolarHBondContact O-CG 3.28Å; K705-L709 PolarHBondContact O-N 2.87Å
706	D	90.1	Very high	89.1	Confident	127 Å²	127	63 Å²	63	68%	0.679	34%	0.337	S	S	*	.	H	α-helix	trans	-64.2	-26.4	-173.9	-39.9	-63.6	0	0	0	112.4	H704	H704-D706 VanDerWaalsContact C-N 3.34Å; H704-D706 PolarHBondContact O-N 3.46Å
707	C	90.6	Very high	89	Confident	24 Å²	24	66.2 Å²	66.2	16%	0.162	36%	0.357	C	S	.	.	H	α-helix	trans	-71.6	-36.9	171.9	-75.2	0	0	0	0	112.8	F678 H704 K705 K711	F678-C707 HydrophobicContact CB-CB 3.84Å; F678-C707 HydrophobicContact CD2-CB 3.99Å; F678-C707 HydrophobicContact CG-CB 4.13Å; H704-C707 HydrophobicContact CB-CB 3.97Å; H704-C707 WeakPolarHBondContact O-CB 3.42Å; H704-C707 PolarHBondContact O-N 3.23Å; H704-C707 VanDerWaalsContact O-N 3.17Å; K705-C707 PolarHBondContact O-N 3.04Å; K705-C707 VanDerWaalsContact O-N 3.15Å; C707-K711 WeakPolarHBondContact O-CD 3.35Å; C707-K711 WeakPolarHBondContact O-CE 3.43Å; C707-K711 PolarHBondContact O-NZ 3.29Å
708	F	89.9	Confident	89.2	Confident	21 Å²	21	67.4 Å²	67.4	9%	0.092	35%	0.349	C	S	.	.	H	α-helix	trans	-98.5	-18.4	-170.4	-174.1	-121.3	0	0	0	114.7	F678 Q694 C696 F703 H704 K705 G710 K711 C713	F678-F708 HydrophobicContact CE2-CB 4.32Å; F678-F708 AromaticContact CE2-CD2 3.88Å; F678-F708 HydrophobicContact CE2-CD2 3.88Å; F678-F708 HydrophobicContact CZ-CD2 4.09Å; Q694-F708 HydrophobicContact CB-CD1 4.24Å; Q694-F708 HydrophobicContact CG-CD1 3.86Å; Q694-F708 HydrophobicContact CG-CE1 4.34Å; C696-F708 HydrophobicContact CB-CZ 4.44Å; F703-F708 HydrophobicContact CB-CB 3.91Å; F703-F708 HydrophobicContact CB-CG 4.43Å; F703-F708 HydrophobicContact CD2-CB 4.46Å; F703-F708 AromaticContact CD2-CD2 3.88Å; F703-F708 HydrophobicContact CD2-CD2 3.88Å; F703-F708 HydrophobicContact CD2-CE2 4.31Å; F703-F708 HydrophobicContact CD2-CG 4.09Å; F703-F708 HydrophobicContact CE2-CD2 4.35Å; F703-F708 HydrophobicContact CE2-CE2 4.42Å; F703-F708 HydrophobicContact CG-CB 4.5Å; H704-F708 PolarHBondContact O-N 3.46Å; H704-F708 VanDerWaalsContact O-N 3.12Å; K705-F708 PolarHBondContact O-N 3.41Å; F708-G710 PolarHBondContact O-N 3.35Å; F708-G710 VanDerWaalsContact O-N 3.17Å; F708-K711 WeakPolarHBondContact CE2-O 3.21Å; F708-K711 PolarHBondContact O-N 3.04Å; F708-C713 HydrophobicContact CE2-CB 3.92Å; F708-C713 HydrophobicContact CZ-CB 4.45Å
709	L	84.7	Confident	89.2	Confident	108 Å²	108	66 Å²	66	57%	0.565	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.1	121.2	175.1	-77.8	175	0	0	0	111.8	K705 K711	K705-L709 WeakPolarHBondContact O-CG 3.28Å; K705-L709 PolarHBondContact O-N 2.87Å; L709-K711 PolarHBondContact O-N 2.66Å
710	G	74.1	Confident	89.1	Confident	91 Å²	91	70.1 Å²	70.1	94%	0.938	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	-2.3	177.4	0	0	0	0	0	116.9	F708	F708-G710 PolarHBondContact O-N 3.35Å; F708-G710 VanDerWaalsContact O-N 3.17Å
711	K	82.3	Confident	89	Confident	107 Å²	107	66.9 Å²	66.9	47%	0.465	35%	0.347	S	S	.	.			trans	-105	148.5	-169.3	-65.6	172.7	-147.2	157	0	113.3	F678 C707 F708 L709	F678-K711 HydrophobicContact CD1-CD 4.42Å; F678-K711 HydrophobicContact CE1-CB 4.2Å; F678-K711 HydrophobicContact CE1-CD 3.95Å; F678-K711 HydrophobicContact CZ-CB 4.13Å; C707-K711 WeakPolarHBondContact O-CD 3.35Å; C707-K711 WeakPolarHBondContact O-CE 3.43Å; C707-K711 PolarHBondContact O-NZ 3.29Å; F708-K711 WeakPolarHBondContact CE2-O 3.21Å; F708-K711 PolarHBondContact O-N 3.04Å; L709-K711 PolarHBondContact O-N 2.66Å
712	R	86.1	Confident	88.9	Confident	225 Å²	225	74.8 Å²	74.8	85%	0.849	38%	0.375	S	S	*	.			trans	-69.1	141.5	170.1	-66.4	-177.7	179	174.7	0.8	109.7	P714	R712-P714 WeakPolarHBondContact O-CD 3.25Å
713	C	92.1	Very high	88.5	Confident	9 Å²	9	78 Å²	78	6%	0.061	40%	0.395	C	S	.	.			trans	-70.6	120.9	-178.9	172.5	0	0	0	0	111.4	C696 F703 F708 K715 C716 T717	C696-C713 HydrophobicContact CB-CB 4.31Å; C696-C713 VanDerWaalsContact SG-CB 3.58Å; F703-C713 HydrophobicContact CE2-CB 4.45Å; F703-C713 VanDerWaalsContact CE2-SG 3.58Å; F708-C713 HydrophobicContact CE2-CB 3.92Å; F708-C713 HydrophobicContact CZ-CB 4.45Å; C713-K715 VanDerWaalsContact C-N 3.32Å; C713-K715 PolarHBondContact O-N 2.97Å; C713-C716 HydrophobicContact CB-CB 3.89Å; C713-C716 WeakPolarHBondContact O-CB 3.45Å; C713-C716 PolarHBondContact O-N 3.39Å; C713-C716 VanDerWaalsContact O-N 3.07Å; C713-T717 PolarHBondContact O-N 3.03Å; C713-T717 PolarHBondContact O-OG1 3.04Å
714	P	90.1	Very high	87.9	Confident	34 Å²	34	84.7 Å²	84.7	22%	0.221	42%	0.424	C	S	.	.	H	α-helix	trans	-63.3	-34.5	-176.2	22.4	-32.9	0	0	0	113.2	E677 F678 F703 R712 R718	E677-P714 HydrophobicContact CB-CG 4.18Å; E677-P714 WeakPolarHBondContact OE2-CG 3.48Å; F678-P714 HydrophobicContact CE1-CG 4.38Å; F678-P714 HydrophobicContact CE2-CG 4.17Å; F678-P714 VanDerWaalsContact CZ-CD 3.44Å; F678-P714 HydrophobicContact CZ-CG 4.03Å; F703-P714 HydrophobicContact CE1-CG 4.15Å; F703-P714 HydrophobicContact CZ-CG 4.16Å; R712-P714 WeakPolarHBondContact O-CD 3.25Å; P714-R718 WeakPolarHBondContact O-CG 3.37Å; P714-R718 PolarHBondContact O-N 2.9Å; P714-R718 PolarHBondContact O-NE 3.02Å
715	K	88.9	Confident	87.1	Confident	82 Å²	82	88 Å²	88	36%	0.357	45%	0.446	S	S	.	.	H	α-helix	trans	-67	-41.7	172.6	-171.6	178.2	179.1	-178.4	0	111.9	T701 C713 T717 R718 I719	T701-K715 HydrophobicContact CG2-CD 3.45Å; T701-K715 VanDerWaalsContact CG2-CD 3.45Å; C713-K715 VanDerWaalsContact C-N 3.32Å; C713-K715 PolarHBondContact O-N 2.97Å; K715-T717 PolarHBondContact O-N 3.09Å; K715-R718 PolarHBondContact O-N 3.4Å; K715-I719 HydrophobicContact CG-CD1 3.98Å; K715-I719 VanDerWaalsContact O-CG1 3.29Å; K715-I719 WeakPolarHBondContact O-CG1 3.26Å; K715-I719 PolarHBondContact O-N 2.87Å
716	C	92.2	Very high	86.1	Confident	16 Å²	16	91.4 Å²	91.4	11%	0.108	46%	0.463	C	S	.	.	H	α-helix	trans	-61.8	-43.2	174.6	-72.3	0	0	0	0	112.1	C699 C713 R718 I719 Q720	C699-C716 PolarHBondContact SG-SG 2.83Å; C713-C716 HydrophobicContact CB-CB 3.89Å; C713-C716 WeakPolarHBondContact O-CB 3.45Å; C713-C716 PolarHBondContact O-N 3.39Å; C713-C716 VanDerWaalsContact O-N 3.07Å; C716-R718 VanDerWaalsContact C-N 3.35Å; C716-R718 PolarHBondContact O-N 3.13Å; C716-I719 PolarHBondContact O-N 3.19Å; C716-Q720 WeakPolarHBondContact O-CB 3.49Å; C716-Q720 WeakPolarHBondContact O-CG 3.41Å; C716-Q720 PolarHBondContact O-N 3.09Å
717	T	89.8	Confident	84.9	Confident	72 Å²	72	90.3 Å²	90.3	44%	0.442	46%	0.461	S	S	.	.	H	α-helix	trans	-60.6	-43.3	175.8	-57.4	0	0	0	0	111.6	C713 K715 Q720 S721	C713-T717 PolarHBondContact O-N 3.03Å; C713-T717 PolarHBondContact O-OG1 3.04Å; K715-T717 PolarHBondContact O-N 3.09Å; T717-Q720 PolarHBondContact O-N 3.15Å; T717-S721 PolarHBondContact O-N 3.45Å; T717-S721 PolarHBondContact O-OG 3.38Å
718	R	91.9	Very high	83.3	Confident	121 Å²	121	98 Å²	98	46%	0.457	49%	0.492	S	S	.	.	H	α-helix	trans	-68.2	-30	176.2	-73	-175.9	-67.2	152.4	2.4	114.1	E677 P714 K715 C716 S721 R722	E677-R718 IonicContact OE1-CZ 2.77Å; E677-R718 IonicContact OE1-NH2 3.35Å; E677-R718 PolarHBondContact OE1-NH2 3.19Å; E677-R718 IonicContact OE2-CZ 3.79Å; E677-R718 IonicContact OE2-NH2 2.93Å; E677-R718 PolarHBondContact OE2-NH2 3.35Å; P714-R718 WeakPolarHBondContact O-CG 3.37Å; P714-R718 PolarHBondContact O-N 2.9Å; P714-R718 PolarHBondContact O-NE 3.02Å; K715-R718 PolarHBondContact O-N 3.4Å; C716-R718 VanDerWaalsContact C-N 3.35Å; C716-R718 PolarHBondContact O-N 3.13Å; R718-S721 PolarHBondContact O-OG 3.37Å; R718-R722 WeakPolarHBondContact O-CD 3.28Å; R718-R722 VanDerWaalsContact O-CG 3.28Å; R718-R722 WeakPolarHBondContact O-CG 3.44Å; R718-R722 PolarHBondContact O-N 3.27Å
719	I	89.8	Confident	81.3	Confident	79 Å²	79	104.6 Å²	104.6	41%	0.405	54%	0.541	S	S	.	.	H	α-helix	trans	-70.3	-52.9	171.8	-69.3	163.6	0	0	0	109.3	C699 K715 C716 S721 R722 T723	C699-I719 HydrophobicContact CB-CD1 4.27Å; K715-I719 HydrophobicContact CG-CD1 3.98Å; K715-I719 VanDerWaalsContact O-CG1 3.29Å; K715-I719 WeakPolarHBondContact O-CG1 3.26Å; K715-I719 PolarHBondContact O-N 2.87Å; C716-I719 PolarHBondContact O-N 3.19Å; I719-S721 VanDerWaalsContact C-N 3.3Å; I719-S721 PolarHBondContact O-N 2.92Å; I719-R722 PolarHBondContact O-N 2.95Å; I719-R722 VanDerWaalsContact O-N 3.11Å; I719-T723 PolarHBondContact O-N 3.38Å; I719-T723 PolarHBondContact O-OG1 3.35Å; I719-T723 VanDerWaalsContact O-OG1 3.1Å
720	Q	89	Confident	81.1	Confident	114 Å²	114	104.4 Å²	104.4	53%	0.533	54%	0.539	S	S	.	.	H	α-helix	trans	-60	-36.1	-178.6	-72.4	176	0.3	0	0	113.1	C716 T717 K724	C716-Q720 WeakPolarHBondContact O-CB 3.49Å; C716-Q720 WeakPolarHBondContact O-CG 3.41Å; C716-Q720 PolarHBondContact O-N 3.09Å; T717-Q720 PolarHBondContact O-N 3.15Å; Q720-K724 WeakPolarHBondContact O-CB 3.47Å; Q720-K724 VanDerWaalsContact O-CG 3.24Å; Q720-K724 WeakPolarHBondContact O-CG 3.46Å; Q720-K724 PolarHBondContact O-N 3.47Å
721	S	87.8	Confident	81.5	Confident	61 Å²	61	105.1 Å²	105.1	43%	0.427	52%	0.518	S	S	.	.	H	α-helix	trans	-68.1	-40.7	175.6	62	0	0	0	0	112.1	T717 R718 I719 K724 V725	T717-S721 PolarHBondContact O-N 3.45Å; T717-S721 PolarHBondContact O-OG 3.38Å; R718-S721 PolarHBondContact O-OG 3.37Å; I719-S721 VanDerWaalsContact C-N 3.3Å; I719-S721 PolarHBondContact O-N 2.92Å; S721-K724 PolarHBondContact O-N 2.97Å; S721-V725 WeakPolarHBondContact O-CG2 3.36Å; S721-V725 PolarHBondContact O-N 3.48Å
722	R	88.8	Confident	81.4	Confident	177 Å²	177	105 Å²	105	67%	0.668	52%	0.521	S	S	*	.	H	α-helix	trans	-62.4	-48.4	175	-73.2	171.5	174.9	-174.6	-5.2	111.9	R718 I719 K724 V725 Q726	R718-R722 WeakPolarHBondContact O-CD 3.28Å; R718-R722 VanDerWaalsContact O-CG 3.28Å; R718-R722 WeakPolarHBondContact O-CG 3.44Å; R718-R722 PolarHBondContact O-N 3.27Å; I719-R722 PolarHBondContact O-N 2.95Å; I719-R722 VanDerWaalsContact O-N 3.11Å; R722-K724 VanDerWaalsContact C-N 3.32Å; R722-K724 PolarHBondContact O-N 3.5Å; R722-V725 PolarHBondContact O-N 3.49Å; R722-V725 VanDerWaalsContact O-N 3.12Å; R722-Q726 PolarHBondContact O-N 3.46Å
723	T	84.7	Confident	81.2	Confident	70 Å²	70	97.9 Å²	97.9	43%	0.429	50%	0.502	S	S	.	.	H	α-helix	trans	-59.7	-42.5	177.2	-45.1	0	0	0	0	111.5	I719 V725 Q726 T727	I719-T723 PolarHBondContact O-N 3.38Å; I719-T723 PolarHBondContact O-OG1 3.35Å; I719-T723 VanDerWaalsContact O-OG1 3.1Å; T723-V725 PolarHBondContact O-N 3.47Å; T723-Q726 PolarHBondContact O-N 3.42Å; T723-Q726 VanDerWaalsContact O-N 3.17Å; T723-T727 HydrophobicContact CG2-CG2 4.46Å; T723-T727 WeakPolarHBondContact O-CG2 3.3Å; T723-T727 PolarHBondContact O-N 3.25Å; T723-T727 PolarHBondContact O-OG1 3.31Å
724	K	79.4	Confident	80.5	Confident	141 Å²	141	103.5 Å²	103.5	61%	0.613	53%	0.53	S	S	*	.	H	α-helix	trans	-65.9	-20.1	177.4	-77.4	177.1	177.5	-173.3	0	115	Q720 S721 R722 K728	Q720-K724 WeakPolarHBondContact O-CB 3.47Å; Q720-K724 VanDerWaalsContact O-CG 3.24Å; Q720-K724 WeakPolarHBondContact O-CG 3.46Å; Q720-K724 PolarHBondContact O-N 3.47Å; S721-K724 PolarHBondContact O-N 2.97Å; R722-K724 VanDerWaalsContact C-N 3.32Å; R722-K724 PolarHBondContact O-N 3.5Å; K724-K728 WeakPolarHBondContact O-CG 3.43Å
725	V	76.4	Confident	79.9	Confident	96 Å²	96	108.1 Å²	108.1	58%	0.582	55%	0.55	S	S	*	*	H	α-helix	trans	-82.9	-44.1	170.8	172.1	0	0	0	0	109.7	S721 R722 T723 T727 K728 S729	S721-V725 WeakPolarHBondContact O-CG2 3.36Å; S721-V725 PolarHBondContact O-N 3.48Å; R722-V725 PolarHBondContact O-N 3.49Å; R722-V725 VanDerWaalsContact O-N 3.12Å; T723-V725 PolarHBondContact O-N 3.47Å; V725-T727 VanDerWaalsContact C-N 3.26Å; V725-T727 PolarHBondContact O-N 3.46Å; V725-K728 PolarHBondContact O-N 3.48Å; V725-S729 PolarHBondContact O-N 3.39Å
726	Q	68.6	Low	79.2	Confident	145 Å²	145	110 Å²	110	68%	0.678	56%	0.564	S	S	*	*	H	α-helix	trans	-64.7	-24.4	177.7	-70.3	175.2	-46.5	0	0	114	R722 T723 K728	R722-Q726 PolarHBondContact O-N 3.46Å; T723-Q726 PolarHBondContact O-N 3.42Å; T723-Q726 VanDerWaalsContact O-N 3.17Å; Q726-K728 VanDerWaalsContact C-N 3.31Å
727	T	64.9	Low	78.2	Confident	104 Å²	104	117.2 Å²	117.2	64%	0.638	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	17.8	171.9	64.9	0	0	0	0	113.4	T723 V725	T723-T727 HydrophobicContact CG2-CG2 4.46Å; T723-T727 WeakPolarHBondContact O-CG2 3.3Å; T723-T727 PolarHBondContact O-N 3.25Å; T723-T727 PolarHBondContact O-OG1 3.31Å; V725-T727 VanDerWaalsContact C-N 3.26Å; V725-T727 PolarHBondContact O-N 3.46Å
728	K	57.8	Low	77.2	Confident	184 Å²	184	121 Å²	121	80%	0.8	61%	0.612	S	S	*	*			trans	-129.3	5.6	176.5	-80.3	-170	169.8	-160.5	0	112.7	K724 V725 Q726	K724-K728 WeakPolarHBondContact O-CG 3.43Å; V725-K728 PolarHBondContact O-N 3.48Å; Q726-K728 VanDerWaalsContact C-N 3.31Å
729	S	47.9	Very low	75.9	Confident	160 Å²	160	121 Å²	121	100%	1.119	63%	0.626	S	S	*	*			trans	-114.5	0	163.4	-58.5	0	0	0	0	108	V725	V725-S729 PolarHBondContact O-N 3.39Å

Retrieved 729 of 729 residues in 96.4 ms (Link to these results)

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