A0A087XG89_POEFO Loading...

Exonuclease 3'-5' domain-containing protein 2

AlphaFold DB , UniProt , Accession A0A087XG89, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 639 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	37.7	Very low	248 Å²	248	147.8 Å²	147.8	100%	1.222	84%	0.842	S	S	*	*				0	140.5	0	-70.7	166.6	81.3	0	0	108.4
2	S	29.9	Very low	38	Very low	125 Å²	125	145.8 Å²	145.8	87%	0.874	84%	0.835	S	S	*	*			trans	-56.2	171.4	-166.4	-102.7	0	0	0	0	118.4
3	P	46.2	Very low	38.5	Very low	113 Å²	113	143.1 Å²	143.1	73%	0.734	82%	0.823	S	S	*	*			trans	-106	172.4	-145.6	41.6	-36.9	0	0	0	115.4
4	R	33.8	Very low	38.7	Very low	252 Å²	252	142.2 Å²	142.2	95%	0.951	81%	0.812	S	S	*	*			trans	-138.8	127.4	155.4	-76.6	-172.5	171.8	165.3	-2.5	110.6
5	G	34	Very low	38.9	Very low	74 Å²	74	139.3 Å²	139.3	76%	0.763	80%	0.798	S	S	*	*			trans	-92	-174.2	-173.6	0	0	0	0	0	115.6
6	P	39.3	Very low	38.9	Very low	124 Å²	124	134.3 Å²	134.3	81%	0.805	79%	0.786	S	S	*	*			trans	-99.7	138.3	-163.7	36.5	-29.4	0	0	0	112.9
7	L	36.8	Very low	39.2	Very low	168 Å²	168	131.2 Å²	131.2	88%	0.88	78%	0.78	S	S	*	*			trans	-146.8	61.9	176.5	-140.4	152.2	0	0	0	110.5
8	T	38.8	Very low	39.6	Very low	139 Å²	139	127.6 Å²	127.6	85%	0.853	77%	0.767	S	S	*	*			trans	-155.7	32.6	177.2	25.4	0	0	0	0	114.7
9	T	41	Very low	39.7	Very low	116 Å²	116	127.2 Å²	127.2	71%	0.712	76%	0.759	S	S	*	*	S	Bend	trans	-136.4	37.6	-179.5	-30.3	0	0	0	0	114.8
10	V	41.5	Very low	39.7	Very low	113 Å²	113	122.9 Å²	122.9	69%	0.685	74%	0.743	S	S	*	*	S	Bend	trans	-125.4	-6.3	178.6	-178.6	0	0	0	0	114.4
11	I	40.6	Very low	40	Very low	154 Å²	154	119.4 Å²	119.4	79%	0.79	73%	0.732	S	S	*	*	S	Bend	trans	-93.8	-12.4	-173.9	-63	-179.3	0	0	0	114.1
12	T	40.4	Very low	40.6	Very low	123 Å²	123	112.6 Å²	112.6	76%	0.755	70%	0.7	S	S	*	*	S	Bend	trans	-92.3	-9.1	-177	28	0	0	0	0	116
13	T	44.3	Very low	41.3	Very low	111 Å²	111	112.3 Å²	112.3	68%	0.681	69%	0.688	S	S	*	*	S	Bend	trans	-93.9	-15.8	-176.8	-27.6	0	0	0	0	114
14	I	42.1	Very low	41.5	Very low	131 Å²	131	111.8 Å²	111.8	67%	0.672	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-18.3	-174	-63.9	178	0	0	0	112.6
15	V	40.9	Very low	42	Very low	98 Å²	98	107.2 Å²	107.2	59%	0.594	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-24.5	179.1	-176.6	0	0	0	0	112.7
16	G	39.4	Very low	42.3	Very low	59 Å²	59	109.4 Å²	109.4	61%	0.608	66%	0.656	S	S	*	*	H	α-helix	trans	-72.9	-26.8	-179.8	0	0	0	0	0	115.2
17	A	44.6	Very low	42.5	Very low	83 Å²	83	108.3 Å²	108.3	69%	0.686	65%	0.646	S	S	*	*	H	α-helix	trans	-83.5	-22.6	-177.9	0	0	0	0	0	113.6
18	A	46.2	Very low	42.7	Very low	65 Å²	65	109.7 Å²	109.7	54%	0.537	64%	0.641	S	S	.	*	H	α-helix	trans	-81	-29.2	-178.6	0	0	0	0	0	113.1
19	L	41.4	Very low	42.6	Very low	120 Å²	120	111.9 Å²	111.9	63%	0.628	63%	0.634	S	S	*	*	H	α-helix	trans	-85.8	-26.5	-178.9	-68	171.5	0	0	0	113.4
20	G	40.5	Very low	42.4	Very low	42 Å²	42	111.4 Å²	111.4	43%	0.433	63%	0.631	S	S	.	*	H	α-helix	trans	-71.4	-29.5	176.3	0	0	0	0	0	114.4
21	G	44.3	Very low	42.2	Very low	49 Å²	49	115 Å²	115	51%	0.505	64%	0.637	S	S	.	*	H	α-helix	trans	-75.1	-27.4	-179.7	0	0	0	0	0	114.6	W25	G21-W25 PolarHBondContact O-N 2.95Å
22	L	45.4	Very low	41.9	Very low	105 Å²	105	119.1 Å²	119.1	55%	0.55	64%	0.643	S	S	.	*	H	α-helix	trans	-77.3	-31.5	-177.2	-102.7	146.3	0	0	0	113.1	Q26	L22-Q26 PolarHBondContact O-N 2.89Å
23	L	45.9	Very low	41.4	Very low	120 Å²	120	122.5 Å²	122.5	63%	0.628	65%	0.647	S	S	*	*	H	α-helix	trans	-75.5	-34.2	177.7	-75.8	165	0	0	0	112.7	V27	L23-V27 PolarHBondContact O-N 2.7Å
24	V	50	Low	40.8	Very low	102 Å²	102	126.8 Å²	126.8	62%	0.618	66%	0.656	S	S	*	*	H	α-helix	trans	-71.8	-32.2	177.4	178.1	0	0	0	0	111.7	Y28	V24-Y28 PolarHBondContact O-N 2.99Å
25	W	44.6	Very low	40.1	Very low	156 Å²	156	126.4 Å²	126.4	59%	0.591	66%	0.662	S	S	*	*	H	α-helix	trans	-74	-33	178.4	-170.3	75.3	0	0	0	113.3	G21 Y28 R29	G21-W25 PolarHBondContact O-N 2.95Å; W25-Y28 PolarHBondContact O-N 3.23Å; W25-R29 PolarHBondContact O-N 3.45Å
26	Q	39.5	Very low	39.4	Very low	119 Å²	119	126.5 Å²	126.5	56%	0.556	67%	0.667	S	S	*	*	H	α-helix	trans	-70.8	-32.2	176.3	-77	-175.5	-27.8	0	0	113.3	L22	L22-Q26 PolarHBondContact O-N 2.89Å
27	V	44.7	Very low	38.8	Very low	101 Å²	101	129.3 Å²	129.3	61%	0.612	68%	0.678	S	S	*	*	H	α-helix	trans	-72	-29.6	174.8	175.8	0	0	0	0	112.1	L23 T30	L23-V27 PolarHBondContact O-N 2.7Å; V27-T30 PolarHBondContact O-OG1 3.45Å
28	Y	40.2	Very low	38	Very low	198 Å²	198	131.7 Å²	131.7	78%	0.776	68%	0.684	S	S	*	*	H	α-helix	trans	-77.3	-22.3	179.7	-136.9	-94.3	0	0	0	113.2	V24 W25	V24-Y28 PolarHBondContact O-N 2.99Å; W25-Y28 PolarHBondContact O-N 3.23Å
29	R	36.4	Very low	36.9	Very low	184 Å²	184	137.1 Å²	137.1	69%	0.694	70%	0.698	S	S	*	*	H	α-helix	trans	-84	-15.8	-177.3	-146.2	175.1	179.2	-177.1	-1.6	113.8	W25	W25-R29 PolarHBondContact O-N 3.45Å
30	T	38.3	Very low	36.1	Very low	106 Å²	106	141.3 Å²	141.3	65%	0.65	71%	0.711	S	S	*	*	S	Bend	trans	-92.4	-7	-177.4	50.5	0	0	0	0	114.8	V27	V27-T30 PolarHBondContact O-OG1 3.45Å
31	K	37	Very low	35.3	Very low	188 Å²	188	143.7 Å²	143.7	82%	0.817	73%	0.727	S	S	*	*	S	Bend	trans	-100.3	7.1	179.9	-76.6	-164.3	176.3	-175.3	0	116.6
32	R	34.3	Very low	34.4	Very low	241 Å²	241	145.7 Å²	145.7	91%	0.909	74%	0.738	S	S	*	*			trans	-104.3	74.8	165	-83.3	-170.3	173.7	-174	-0.7	110.8
33	K	28.8	Very low	33.5	Very low	194 Å²	194	149.3 Å²	149.3	84%	0.843	75%	0.753	S	S	*	*			trans	-117.2	124.3	157.1	-78.9	-173.7	176.1	-178.9	0	108.4
34	K	32.7	Very low	33.1	Very low	201 Å²	201	148.7 Å²	148.7	87%	0.874	76%	0.756	S	S	*	*			trans	-38.1	150.9	170.4	-101.9	174.1	168.6	178.1	0	112.8
35	P	27.7	Very low	31.9	Very low	123 Å²	123	149.5 Å²	149.5	80%	0.799	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-93.3	138.3	137.7	12.8	6	0	0	0	110.3
36	S	25.5	Very low	31.1	Very low	100 Å²	100	147.9 Å²	147.9	70%	0.699	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-74.8	145.1	178.9	43.7	0	0	0	0	112.8
37	S	27	Very low	30.7	Very low	119 Å²	119	147.3 Å²	147.3	83%	0.832	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-67	127.3	161.5	58.3	0	0	0	0	110
38	V	26.6	Very low	29.7	Very low	133 Å²	133	150.6 Å²	150.6	81%	0.806	79%	0.788	S	S	*	*			trans	-112	125.9	165.5	173.8	0	0	0	0	108
39	Q	25	Very low	28.8	Very low	178 Å²	178	152 Å²	152	83%	0.832	79%	0.792	S	S	*	*			trans	-71.5	150	174.6	-66.5	166.8	-42.3	0	0	111.3
40	K	23.8	Very low	28.9	Very low	208 Å²	208	148.4 Å²	148.4	90%	0.904	79%	0.792	S	S	*	*			trans	-152.7	109.7	138.3	-115.6	-179.6	-179.1	-177	0	110.3
41	A	23.8	Very low	28.3	Very low	93 Å²	93	150.1 Å²	150.1	77%	0.769	80%	0.802	S	S	*	*			trans	-74.3	166.4	150.4	0	0	0	0	0	108.2
42	A	24.7	Very low	27.7	Very low	90 Å²	90	148.7 Å²	148.7	74%	0.744	80%	0.799	S	S	*	*			cis	-161.6	155.1	22.7	0	0	0	0	0	111
43	E	27.3	Very low	27.2	Very low	182 Å²	182	144.6 Å²	144.6	85%	0.85	79%	0.794	S	S	*	*			trans	6.8	166.9	130.8	-87.4	177.9	-171.2	0	0	121.6
44	P	37.9	Very low	26.9	Very low	107 Å²	107	139.6 Å²	139.6	70%	0.695	79%	0.789	S	S	*	*			cis	-142.7	178.6	40	32.8	-6.8	0	0	0	115.1
45	T	23.4	Very low	26.8	Very low	118 Å²	118	135.7 Å²	135.7	72%	0.724	79%	0.785	S	S	*	*				-177.6	117.6	56.4	-43	0	0	0	0	106.4
46	V	27.9	Very low	26.5	Very low	122 Å²	122	134.2 Å²	134.2	74%	0.739	78%	0.783	S	S	*	*				66.7	146.5	86.6	174.1	0	0	0	0	114
47	P	32.6	Very low	26.4	Very low	107 Å²	107	141 Å²	141	70%	0.695	79%	0.793	S	S	*	*			cis	-137.1	-173	-38	37.5	-17.7	0	0	0	112.3
48	L	22.5	Very low	26.2	Very low	170 Å²	170	140.9 Å²	140.9	89%	0.89	79%	0.787	S	S	*	*			trans	-170.1	132	130.5	-96.6	162.3	0	0	0	111.1
49	R	22.3	Very low	26	Very low	228 Å²	228	144.2 Å²	144.2	86%	0.86	79%	0.794	S	S	*	*			trans	-145.2	179.5	166.1	-92	-166.4	-178.6	-174.4	1.5	104.4
50	P	38.9	Very low	25.9	Very low	108 Å²	108	140 Å²	140	70%	0.701	79%	0.785	S	S	*	*			cis	-126.7	-172.6	-35.3	31.4	-11.9	0	0	0	109.4
51	V	24.7	Very low	25.9	Very low	142 Å²	142	138.8 Å²	138.8	86%	0.861	78%	0.782	S	S	*	*			trans	-160.4	132.6	134.6	164.4	0	0	0	0	109.2
52	E	23.5	Very low	26	Very low	159 Å²	159	142.9 Å²	142.9	74%	0.743	79%	0.785	S	S	*	*			trans	-74.3	154.3	172.5	-65	162.3	133.4	0	0	112.5
53	N	24.2	Very low	26.1	Very low	154 Å²	154	145.7 Å²	145.7	82%	0.824	79%	0.794	S	S	*	*				169.5	123.5	114.7	-84.1	-35.4	0	0	0	111.5
54	A	22.4	Very low	26	Very low	89 Å²	89	145.6 Å²	145.6	74%	0.736	79%	0.793	S	S	*	*			trans	-74.6	172.6	152.5	0	0	0	0	0	108.5
55	P	30.3	Very low	25.3	Very low	120 Å²	120	148.8 Å²	148.8	78%	0.779	80%	0.804	S	S	*	*			cis	-152.4	162.5	47.8	38.2	-14.9	0	0	0	119.5
56	A	21.5	Very low	25.3	Very low	92 Å²	92	150.8 Å²	150.8	76%	0.76	81%	0.809	S	S	*	*			trans	72.3	144.9	136.6	0	0	0	0	0	123.7
57	R	23.3	Very low	25.2	Very low	242 Å²	242	150 Å²	150	91%	0.913	81%	0.808	S	S	*	*			trans	84.6	121	169	-70	-177.6	175.9	-179.8	-1.5	115.4
58	T	23.1	Very low	24.8	Very low	116 Å²	116	154.1 Å²	154.1	71%	0.712	82%	0.818	S	S	*	*			cis	-160.4	120.2	7.5	-46.5	0	0	0	0	106.6
59	E	22.7	Very low	24.9	Very low	203 Å²	203	150.2 Å²	150.2	95%	0.949	81%	0.81	S	S	*	*			trans	-112.3	112.2	165.9	-86.1	-174.8	167.8	0	0	108.4
60	S	23.5	Very low	25.1	Very low	91 Å²	91	148.7 Å²	148.7	64%	0.636	81%	0.812	S	S	*	*			trans	-160.8	98.7	164.8	60.4	0	0	0	0	108
61	Q	23.7	Very low	24.3	Very low	181 Å²	181	151.3 Å²	151.3	85%	0.846	82%	0.821	S	S	*	*	S	Bend	trans	176.4	133	133.9	-94.4	163.2	19.4	0	0	110.9
62	Q	25.3	Very low	24.4	Very low	179 Å²	179	153.2 Å²	153.2	84%	0.836	82%	0.82	S	S	*	*			trans	80.7	65.1	159.1	-67.7	172.8	-11.8	0	0	118.8
63	T	27.1	Very low	24.4	Very low	149 Å²	149	154.2 Å²	154.2	91%	0.914	82%	0.822	S	S	*	*			trans	-117.8	82.4	137.6	-45.7	0	0	0	0	108.1
64	Q	25	Very low	24.6	Very low	180 Å²	180	155.4 Å²	155.4	84%	0.841	82%	0.82	S	S	*	*			trans	-162.2	102.7	168.8	-112.8	179	-2	0	0	107.3
65	L	24.1	Very low	24.6	Very low	175 Å²	175	158.3 Å²	158.3	92%	0.916	83%	0.829	S	S	*	*			trans	176.5	73.1	152.4	-95.8	150	0	0	0	108.6
66	L	23.6	Very low	24.5	Very low	159 Å²	159	157.1 Å²	157.1	83%	0.832	83%	0.829	S	S	*	*	S	Bend	trans	-99.1	136.6	148.6	-112.9	155.6	0	0	0	105.6
67	C	25.7	Very low	24.7	Very low	106 Å²	106	161.9 Å²	161.9	72%	0.716	84%	0.836	S	S	*	*			trans	60.9	97.1	157.9	-59.6	0	0	0	0	116.9
68	Q	23.7	Very low	25	Very low	193 Å²	193	156.4 Å²	156.4	90%	0.902	83%	0.833	S	S	*	*			trans	-166.7	97.4	148.7	-108.5	166.9	18.2	0	0	109.8
69	A	23.6	Very low	25.2	Very low	89 Å²	89	159.3 Å²	159.3	74%	0.736	84%	0.838	S	S	*	*	S	Bend	trans	-172.9	87.2	149.6	0	0	0	0	0	107.5
70	H	26.5	Very low	25.6	Very low	195 Å²	195	155.4 Å²	155.4	90%	0.903	83%	0.828	S	S	*	*			trans	173.6	76.7	142.6	-90.3	-63.4	0	0	0	106.6
71	D	23.5	Very low	26.2	Very low	164 Å²	164	160.9 Å²	160.9	88%	0.877	84%	0.844	S	S	*	*			trans	-148.7	100.8	162	-118.3	-16.9	0	0	0	107.6
72	E	25.3	Very low	26.7	Very low	181 Å²	181	156.5 Å²	156.5	85%	0.846	83%	0.833	S	S	*	*			trans	-163.6	98.2	156.8	-109.8	-178.3	-166.4	0	0	106.9
73	F	25.4	Very low	27.5	Very low	181 Å²	181	151.7 Å²	151.7	79%	0.794	82%	0.824	S	S	*	*	S	Bend		-170.2	99.4	122.5	-113.3	-88.5	0	0	0	111.2
74	K	26.6	Very low	28.4	Very low	179 Å²	179	150 Å²	150	78%	0.778	82%	0.816	S	S	*	*			trans	52.1	110.7	141.6	-66	-176.1	178.3	178.9	0	120.4
75	T	24.1	Very low	29.8	Very low	149 Å²	149	151.9 Å²	151.9	91%	0.914	82%	0.815	S	S	*	*			trans	-42.1	129	149.5	28.3	0	0	0	0	114.6
76	A	26.5	Very low	31.7	Very low	95 Å²	95	146.8 Å²	146.8	79%	0.785	80%	0.798	S	S	*	*			trans	-138.6	106.5	150.2	0	0	0	0	0	108.7
77	E	26.5	Very low	33.9	Very low	193 Å²	193	141 Å²	141	90%	0.902	77%	0.77	S	S	*	*			trans	40.9	125.8	151.7	-67.4	177.7	163.5	0	0	123
78	C	30	Very low	36.6	Very low	126 Å²	126	142.3 Å²	142.3	85%	0.851	77%	0.765	S	S	*	*			trans	-35.5	122.9	163.1	-174.7	0	0	0	0	115.6
79	Q	28	Very low	39.6	Very low	177 Å²	177	134.2 Å²	134.2	83%	0.827	73%	0.728	S	S	*	*			trans	-138.2	109	148.2	-67.3	-169.5	-0.8	0	0	109.5
80	T	29.7	Very low	42.7	Very low	121 Å²	121	130.7 Å²	130.7	74%	0.742	70%	0.697	S	S	*	*			trans	31.7	110.4	151.2	49.6	0	0	0	0	117.9	S82	T80-S82 PolarHBondContact O-N 2.68Å
81	E	35.6	Very low	45.8	Very low	207 Å²	207	124.5 Å²	124.5	97%	0.967	67%	0.674	S	S	*	*			trans	-52.3	100	160.7	-70.4	-176	157	0	0	110.1
82	S	35.3	Very low	49.1	Very low	88 Å²	88	117.4 Å²	117.4	62%	0.615	64%	0.636	S	S	*	*			trans	-76.4	127.1	167.9	70.5	0	0	0	0	108.1	T80	T80-S82 PolarHBondContact O-N 2.68Å
83	A	41.9	Very low	52.3	Low	79 Å²	79	117.2 Å²	117.2	65%	0.653	63%	0.633	S	S	*	*			trans	-39.8	146.2	169.1	0	0	0	0	0	111.8	R85	A83-R85 PolarHBondContact O-N 2.92Å
84	P	46.6	Very low	55.6	Low	114 Å²	114	113.3 Å²	113.3	74%	0.74	62%	0.617	S	S	*	*			trans	-53.3	111.5	-178.6	20.2	-31	0	0	0	109.4	A86	P84-A86 PolarHBondContact O-N 3.5Å
85	R	54.7	Low	58.8	Low	218 Å²	218	104.8 Å²	104.8	82%	0.823	58%	0.58	S	S	*	*			trans	-56.8	126.8	178.8	-78.4	-179.4	175.6	176.8	-1	107.9	A83 V87	A83-R85 PolarHBondContact O-N 2.92Å; R85-V87 PolarHBondContact O-N 3.08Å
86	A	62.7	Low	62.2	Low	68 Å²	68	99.6 Å²	99.6	56%	0.562	55%	0.546	S	S	*	.			trans	-54.4	123.7	176	0	0	0	0	0	109.5	P84 H88	P84-A86 PolarHBondContact O-N 3.5Å; A86-H88 PolarHBondContact O-N 2.83Å
87	V	70.4	Confident	65.5	Low	39 Å²	39	98.7 Å²	98.7	24%	0.236	54%	0.539	C	S	.	.			trans	-73	114.5	177.6	178.3	0	0	0	0	107.8	R85 I89 V122 Y150	R85-V87 PolarHBondContact O-N 3.08Å; V87-I89 PolarHBondContact O-N 2.82Å; V87-V122 HydrophobicContact CB-CG1 4.2Å; V87-V122 HydrophobicContact CG1-CG1 3.45Å; V87-V122 VanDerWaalsContact CG1-CG1 3.45Å; V87-V122 HydrophobicContact CG2-CG1 3.61Å; V87-Y150 HydrophobicContact CG1-CE2 4.04Å
88	H	82.6	Confident	68.8	Low	132 Å²	132	92 Å²	92	61%	0.611	51%	0.511	S	S	*	.			trans	-77.1	115.1	173.6	-176.3	66.3	0	0	0	109.4	A86	A86-H88 PolarHBondContact O-N 2.83Å
89	I	85.6	Confident	71.9	Confident	23 Å²	23	94.5 Å²	94.5	12%	0.118	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-85.8	117.7	172.3	-64.7	172.5	0	0	0	107.6	V87 L276 L281 Q282 L289	V87-I89 PolarHBondContact O-N 2.82Å; I89-L276 HydrophobicContact CD1-CD2 4.3Å; I89-L276 HydrophobicContact CG2-CD1 3.72Å; I89-L276 HydrophobicContact CG2-CD2 4.39Å; I89-L281 HydrophobicContact CD1-CB 4.01Å; I89-L281 WeakPolarHBondContact CD1-O 3.36Å; I89-Q282 HydrophobicContact CG2-CG 4.03Å; I89-L289 HydrophobicContact CD1-CD1 3.63Å
90	P	89.6	Confident	75.2	Confident	15 Å²	15	88 Å²	88	10%	0.097	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-65.9	152.5	179	27.1	-33.5	0	0	0	111.5	Q94 M95 Y150 Q282	P90-Q94 HydrophobicContact CB-CB 3.88Å; P90-M95 HydrophobicContact CB-CG 4.08Å; P90-M95 HydrophobicContact CG-CG 3.62Å; P90-M95 HydrophobicContact CG-SD 4.38Å; P90-Y150 WeakPolarHBondContact CD-O 3.42Å; P90-Y150 WeakPolarHBondContact CG-O 3.47Å; P90-Q282 PolarHBondContact O-NE2 3.01Å
91	T	90.9	Very high	78.4	Confident	66 Å²	66	85 Å²	85	41%	0.405	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-65.2	156.4	170.7	61.9	0	0	0	0	110.5	K93 Q94 M95	T91-K93 PolarHBondContact O-N 3.37Å; T91-Q94 WeakPolarHBondContact O-CB 3.27Å; T91-Q94 PolarHBondContact O-N 2.74Å; T91-Q94 WeakPolarHBondContact OG1-CG 3.34Å; T91-Q94 PolarHBondContact OG1-N 3.04Å; T91-Q94 PolarHBondContact OG1-OE1 3.49Å; T91-M95 WeakPolarHBondContact O-CG 3.3Å; T91-M95 PolarHBondContact O-N 3.06Å
92	C	93	Very high	81.3	Confident	14 Å²	14	78 Å²	78	10%	0.095	43%	0.434	C	S	.	.	H	α-helix	trans	-50.1	-43.9	174.5	-176.4	0	0	0	0	112	Q94 M95 L96 A273	C92-Q94 PolarHBondContact O-N 3.49Å; C92-M95 PolarHBondContact O-N 3.37Å; C92-L96 VanDerWaalsContact O-CG 3.27Å; C92-L96 WeakPolarHBondContact O-CG 3.17Å; C92-L96 PolarHBondContact O-N 2.99Å; C92-A273 HydrophobicContact CB-CB 4.3Å
93	K	93.1	Very high	84.1	Confident	178 Å²	178	73.9 Å²	73.9	77%	0.774	41%	0.405	S	S	*	.	H	α-helix	trans	-61.6	-39.4	177.7	-172.6	178.1	179.3	-179.7	0	113.1	T91 A97	T91-K93 PolarHBondContact O-N 3.37Å; K93-A97 PolarHBondContact O-N 3.45Å
94	Q	94.1	Very high	86.5	Confident	98 Å²	98	72.3 Å²	72.3	46%	0.458	39%	0.389	S	S	.	.	H	α-helix	trans	-67.9	-41.4	176	-74.4	164.9	-45.9	0	0	111.3	P90 T91 C92 L96 A97	P90-Q94 HydrophobicContact CB-CB 3.88Å; T91-Q94 WeakPolarHBondContact O-CB 3.27Å; T91-Q94 PolarHBondContact O-N 2.74Å; T91-Q94 WeakPolarHBondContact OG1-CG 3.34Å; T91-Q94 PolarHBondContact OG1-N 3.04Å; T91-Q94 PolarHBondContact OG1-OE1 3.49Å; C92-Q94 PolarHBondContact O-N 3.49Å; Q94-L96 PolarHBondContact O-N 3.07Å; Q94-A97 PolarHBondContact O-N 3.4Å
95	M	94.7	Very high	88.6	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-60.5	-46.1	177	-65.6	176.8	71.5	0	0	111.7	P90 T91 C92 A97 V98 Q269 V272 A273 L276	P90-M95 HydrophobicContact CB-CG 4.08Å; P90-M95 HydrophobicContact CG-CG 3.62Å; P90-M95 HydrophobicContact CG-SD 4.38Å; T91-M95 WeakPolarHBondContact O-CG 3.3Å; T91-M95 PolarHBondContact O-N 3.06Å; C92-M95 PolarHBondContact O-N 3.37Å; M95-A97 PolarHBondContact O-N 3.36Å; M95-V98 PolarHBondContact O-N 3.32Å; M95-Q269 PolarHBondContact O-NE2 3.1Å; M95-V272 HydrophobicContact CE-CB 3.79Å; M95-V272 HydrophobicContact CE-CG1 3.76Å; M95-A273 HydrophobicContact CE-CB 4.49Å; M95-A273 HydrophobicContact SD-CB 4.06Å; M95-L276 HydrophobicContact CE-CD1 4.49Å; M95-L276 HydrophobicContact SD-CD1 4.26Å
96	L	94.9	Very high	90.3	Very high	40 Å²	40	60.7 Å²	60.7	21%	0.209	34%	0.337	C	S	.	.	H	α-helix	trans	-71.7	-13.7	-179.5	-59.9	175.3	0	0	0	113.8	C92 Q94 V238 R266 Q269 I270	C92-L96 VanDerWaalsContact O-CG 3.27Å; C92-L96 WeakPolarHBondContact O-CG 3.17Å; C92-L96 PolarHBondContact O-N 2.99Å; Q94-L96 PolarHBondContact O-N 3.07Å; L96-V238 HydrophobicContact CD1-CG1 4.03Å; L96-V238 HydrophobicContact CD1-CG2 4.28Å; L96-R266 HydrophobicContact CD2-CG 4.25Å; L96-Q269 HydrophobicContact CD2-CB 3.82Å; L96-I270 HydrophobicContact CD1-CD1 4.01Å; L96-I270 HydrophobicContact CD2-CD1 4.01Å; L96-I270 HydrophobicContact CD2-CG1 4.01Å
97	A	95.6	Very high	91.7	Very high	77 Å²	77	63.2 Å²	63.2	64%	0.636	34%	0.337	S	S	*	.	H	α-helix	trans	-83.2	-14.1	174.9	0	0	0	0	0	112.9	K93 Q94 M95 K99	K93-A97 PolarHBondContact O-N 3.45Å; Q94-A97 PolarHBondContact O-N 3.4Å; M95-A97 PolarHBondContact O-N 3.36Å; A97-K99 PolarHBondContact O-N 3.04Å
98	V	96.3	Very high	92.8	Very high	51 Å²	51	64.1 Å²	64.1	31%	0.309	34%	0.34	S	S	.	.	S	Bend	trans	-72.9	125.6	176.1	-176.8	0	0	0	0	109.3	M95 G152 Q269	M95-V98 PolarHBondContact O-N 3.32Å; V98-G152 WeakPolarHBondContact CB-O 3.42Å; V98-Q269 PolarHBondContact O-NE2 3.43Å
99	K	95.8	Very high	93.4	Very high	179 Å²	179	57.9 Å²	57.9	78%	0.778	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-71	136	178.3	-68.2	-175.9	178.6	-179.4	0	110.2	A97	A97-K99 PolarHBondContact O-N 3.04Å
100	P	97	Very high	93.9	Very high	40 Å²	40	61.1 Å²	61.1	26%	0.26	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-70.3	152.7	175.8	29	-33.6	0	0	0	111.8	C154 L156 A265	P100-C154 CarbonylContact C-O 3.5Å; P100-C154 WeakPolarHBondContact CA-O 3.39Å; P100-C154 HydrophobicContact CB-CB 4.32Å; P100-L156 HydrophobicContact CB-CD1 3.88Å; P100-L156 HydrophobicContact CB-CG 4Å; P100-L156 HydrophobicContact CG-CD1 4.19Å; P100-A265 HydrophobicContact CB-CB 3.69Å; P100-A265 HydrophobicContact CG-CB 3.84Å
101	V	96.8	Very high	94.1	Very high	59 Å²	59	68.3 Å²	68.3	36%	0.358	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	124.3	174.9	-179.3	0	0	0	0	108.5	M112 L153 C154 V155 L156	V101-M112 HydrophobicContact CG1-CG 4.32Å; V101-L153 HydrophobicContact CG2-CD1 4Å; V101-C154 PolarHBondContact N-O 2.7Å; V101-V155 CarbonylContact O-C 3.46Å; V101-V155 WeakPolarHBondContact O-CA 3.33Å; V101-L156 PolarHBondContact O-N 2.92Å
102	T	95.9	Very high	94.4	Very high	60 Å²	60	65.9 Å²	65.9	37%	0.368	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	129	176.1	-56.2	0	0	0	0	109.7	L156 R158	T102-L156 WeakPolarHBondContact CA-O 3.23Å; T102-R158 HydrophobicContact CG2-CG 3.67Å
103	V	94.6	Very high	94.5	Very high	1 Å²	1	66.9 Å²	66.9	1%	0.006	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	118.3	175.6	166.5	0	0	0	0	107.9	D108 W109 M112 V155 L156 V157 R158	V103-D108 HydrophobicContact CB-CB 4.31Å; V103-D108 HydrophobicContact CG1-CB 4Å; V103-D108 HydrophobicContact CG2-CB 4.28Å; V103-W109 HydrophobicContact CG1-CB 3.86Å; V103-W109 HydrophobicContact CG1-CE3 4.29Å; V103-W109 HydrophobicContact CG2-CE3 4.5Å; V103-M112 HydrophobicContact CG2-CE 4.41Å; V103-V155 HydrophobicContact CB-CG1 4.29Å; V103-V155 HydrophobicContact CG2-CG1 3.64Å; V103-L156 PolarHBondContact N-O 3.14Å; V103-V157 HydrophobicContact CB-CG2 4.42Å; V103-V157 HydrophobicContact CG1-CG1 4.49Å; V103-R158 WeakPolarHBondContact O-CB 3.46Å; V103-R158 PolarHBondContact O-N 3.46Å
104	S	91.6	Very high	94.7	Very high	47 Å²	47	62 Å²	62	33%	0.329	33%	0.333	S	S	.	.			trans	-114.8	-15.7	-179.8	-53.8	0	0	0	0	113.3	D108 T161	S104-D108 WeakPolarHBondContact CA-OD2 3.47Å; S104-D108 PolarHBondContact N-OD2 2.89Å; S104-T161 VanDerWaalsContact O-CB 3.28Å; S104-T161 WeakPolarHBondContact O-CB 3.36Å; S104-T161 WeakPolarHBondContact O-CG2 3.13Å; S104-T161 PolarHBondContact O-OG1 3.35Å
105	S	90.8	Very high	94.8	Very high	20 Å²	20	61.7 Å²	61.7	14%	0.14	33%	0.334	C	S	.	.	S	Bend	trans	-130.5	170	-179.3	72.8	0	0	0	0	112.5	E107 D108 W109	S105-E107 VanDerWaalsContact C-N 3.28Å; S105-E107 WeakPolarHBondContact CB-OE2 3.34Å; S105-E107 PolarHBondContact OG-N 2.99Å; S105-E107 PolarHBondContact OG-OE2 3.49Å; S105-D108 PolarHBondContact N-OD2 3.05Å; S105-D108 VanDerWaalsContact N-OD2 3.08Å; S105-D108 PolarHBondContact OG-N 2.76Å; S105-D108 PolarHBondContact OG-OD1 3.3Å; S105-D108 PolarHBondContact OG-OD2 3.38Å; S105-W109 PolarHBondContact O-N 3.27Å
106	Q	91.4	Very high	94.9	Very high	68 Å²	68	61.7 Å²	61.7	32%	0.318	33%	0.334	S	S	.	.	H	α-helix	trans	-63.5	-36.5	169.6	165.2	164.1	-0.2	0	0	111.4	W109 L110 P170	Q106-W109 WeakPolarHBondContact O-CB 3.24Å; Q106-W109 PolarHBondContact O-N 3.19Å; Q106-L110 HydrophobicContact CG-CD1 4.1Å; Q106-L110 WeakPolarHBondContact O-CG 3.49Å; Q106-L110 PolarHBondContact O-N 3.01Å; Q106-P170 HydrophobicContact CB-CG 4.25Å; Q106-P170 HydrophobicContact CG-CG 4.01Å
107	E	91.8	Very high	95	Very high	121 Å²	121	64.2 Å²	64.2	57%	0.565	35%	0.345	S	S	*	.	H	α-helix	trans	-64.9	-46.6	178.5	-65.1	71.2	-157	0	0	111.3	S105 W109 L110 E111	S105-E107 VanDerWaalsContact C-N 3.28Å; S105-E107 WeakPolarHBondContact CB-OE2 3.34Å; S105-E107 PolarHBondContact OG-N 2.99Å; S105-E107 PolarHBondContact OG-OE2 3.49Å; E107-W109 PolarHBondContact O-N 2.9Å; E107-L110 PolarHBondContact O-N 2.99Å; E107-L110 VanDerWaalsContact O-N 3.1Å; E107-E111 PolarHBondContact O-N 2.86Å
108	D	93.9	Very high	95	Very high	57 Å²	57	67.7 Å²	67.7	31%	0.305	35%	0.345	S	S	.	.	H	α-helix	trans	-57.4	-39.9	176.4	-58.9	-8.2	0	0	0	110.8	V103 S104 S105 M112	V103-D108 HydrophobicContact CB-CB 4.31Å; V103-D108 HydrophobicContact CG1-CB 4Å; V103-D108 HydrophobicContact CG2-CB 4.28Å; S104-D108 WeakPolarHBondContact CA-OD2 3.47Å; S104-D108 PolarHBondContact N-OD2 2.89Å; S105-D108 PolarHBondContact N-OD2 3.05Å; S105-D108 VanDerWaalsContact N-OD2 3.08Å; S105-D108 PolarHBondContact OG-N 2.76Å; S105-D108 PolarHBondContact OG-OD1 3.3Å; S105-D108 PolarHBondContact OG-OD2 3.38Å; D108-M112 WeakPolarHBondContact O-CB 3.45Å; D108-M112 PolarHBondContact O-N 3.1Å; D108-M112 VanDerWaalsContact O-N 3.11Å
109	W	95	Very high	94.9	Very high	2 Å²	2	66.6 Å²	66.6	1%	0.008	34%	0.337	C	S	.	.	H	α-helix	trans	-65.5	-45.9	177	178	-96.1	0	0	0	111.6	V103 S105 Q106 E107 E111 M112 W113 M116 M147 V155 V157 P170 S172 F173 V176	V103-W109 HydrophobicContact CG1-CB 3.86Å; V103-W109 HydrophobicContact CG1-CE3 4.29Å; V103-W109 HydrophobicContact CG2-CE3 4.5Å; S105-W109 PolarHBondContact O-N 3.27Å; Q106-W109 WeakPolarHBondContact O-CB 3.24Å; Q106-W109 PolarHBondContact O-N 3.19Å; E107-W109 PolarHBondContact O-N 2.9Å; W109-E111 VanDerWaalsContact C-N 3.29Å; W109-E111 PolarHBondContact O-N 3.48Å; W109-M112 HydrophobicContact CD2-CE 4.21Å; W109-M112 HydrophobicContact CE3-CE 3.5Å; W109-M112 VanDerWaalsContact CE3-CE 3.5Å; W109-M112 HydrophobicContact CH2-CE 3.95Å; W109-M112 HydrophobicContact CZ3-CE 3.34Å; W109-M112 PolarHBondContact O-N 3.03Å; W109-W113 AromaticContact CE2-CE3 3.97Å; W109-W113 AromaticContact CH2-CE3 3.85Å; W109-W113 HydrophobicContact CH2-CE3 3.85Å; W109-W113 HydrophobicContact CH2-CZ3 4.21Å; W109-W113 HydrophobicContact CZ2-CD2 4.04Å; W109-W113 AromaticContact CZ2-CE3 3.26Å; W109-W113 HydrophobicContact CZ2-CE3 3.26Å; W109-W113 AromaticContact CZ2-CZ3 3.78Å; W109-W113 HydrophobicContact CZ2-CZ3 3.78Å; W109-W113 WeakPolarHBondContact O-CA 3.22Å; W109-W113 WeakPolarHBondContact O-CB 3.44Å; W109-W113 PolarHBondContact O-N 2.78Å; W109-M116 HydrophobicContact CH2-SD 4.2Å; W109-M147 HydrophobicContact CH2-CE 3.45Å; W109-M147 VanDerWaalsContact CH2-CE 3.45Å; W109-M147 HydrophobicContact CZ3-CE 3.31Å; W109-V155 HydrophobicContact CZ3-CG1 4.26Å; W109-V157 HydrophobicContact CE3-CG2 4.25Å; W109-V157 HydrophobicContact CZ3-CG2 4.01Å; W109-P170 HydrophobicContact CB-CG 3.99Å; W109-P170 VanDerWaalsContact CD1-CG 3.47Å; W109-P170 HydrophobicContact CG-CB 4.17Å; W109-P170 HydrophobicContact CG-CG 3.82Å; W109-S172 PolarHBondContact NE1-OG 2.99Å; W109-F173 HydrophobicContact CD2-CB 4.17Å; W109-F173 HydrophobicContact CD2-CD2 4.34Å; W109-F173 HydrophobicContact CE3-CD2 4.16Å; W109-F173 HydrophobicContact CH2-CB 4.39Å; W109-F173 AromaticContact CH2-CD2 3.62Å; W109-F173 HydrophobicContact CH2-CD2 3.62Å; W109-F173 HydrophobicContact CH2-CE2 4.48Å; W109-F173 HydrophobicContact CH2-CG 4.5Å; W109-F173 HydrophobicContact CZ2-CB 3.66Å; W109-F173 AromaticContact CZ2-CD2 3.78Å; W109-F173 HydrophobicContact CZ2-CD2 3.78Å; W109-F173 HydrophobicContact CZ2-CG 4.22Å; W109-F173 AromaticContact CZ3-CD2 3.82Å; W109-F173 HydrophobicContact CZ3-CD2 3.82Å; W109-F173 HydrophobicContact CZ3-CE2 4.43Å; W109-V176 HydrophobicContact CZ2-CG1 4.47Å
110	L	94.3	Very high	94.8	Very high	91 Å²	91	58.9 Å²	58.9	48%	0.476	30%	0.304	S	S	.	.	H	α-helix	trans	-65.4	-32.7	-179.4	-71	172.8	0	0	0	112.4	Q106 E107 P114	Q106-L110 HydrophobicContact CG-CD1 4.1Å; Q106-L110 WeakPolarHBondContact O-CG 3.49Å; Q106-L110 PolarHBondContact O-N 3.01Å; E107-L110 PolarHBondContact O-N 2.99Å; E107-L110 VanDerWaalsContact O-N 3.1Å; L110-P114 WeakPolarHBondContact O-CD 3.27Å
111	E	95.8	Very high	94.6	Very high	166 Å²	166	64 Å²	64	78%	0.776	33%	0.328	S	S	*	.	H	α-helix	trans	-69.9	-43.1	174.5	-173.4	178.2	173.3	0	0	111.9	E107 W109	E107-E111 PolarHBondContact O-N 2.86Å; W109-E111 VanDerWaalsContact C-N 3.29Å; W109-E111 PolarHBondContact O-N 3.48Å
112	M	95.4	Very high	94.3	Very high	15 Å²	15	63.9 Å²	63.9	7%	0.074	33%	0.328	C	S	.	.	H	α-helix	trans	-78.7	-36.5	-177.5	-177.6	-72.7	-54.9	0	0	112.8	V101 V103 D108 W109 P114 L115 M116 V155	V101-M112 HydrophobicContact CG1-CG 4.32Å; V103-M112 HydrophobicContact CG2-CE 4.41Å; D108-M112 WeakPolarHBondContact O-CB 3.45Å; D108-M112 PolarHBondContact O-N 3.1Å; D108-M112 VanDerWaalsContact O-N 3.11Å; W109-M112 HydrophobicContact CD2-CE 4.21Å; W109-M112 HydrophobicContact CE3-CE 3.5Å; W109-M112 VanDerWaalsContact CE3-CE 3.5Å; W109-M112 HydrophobicContact CH2-CE 3.95Å; W109-M112 HydrophobicContact CZ3-CE 3.34Å; W109-M112 PolarHBondContact O-N 3.03Å; M112-P114 VanDerWaalsContact C-CD 3.45Å; M112-L115 WeakPolarHBondContact O-CB 3.47Å; M112-L115 PolarHBondContact O-N 2.9Å; M112-M116 HydrophobicContact CE-SD 4.47Å; M112-M116 PolarHBondContact O-N 3.23Å; M112-M116 HydrophobicContact SD-CB 3.75Å; M112-M116 HydrophobicContact SD-CE 4.43Å; M112-V155 HydrophobicContact CE-CB 4.25Å; M112-V155 HydrophobicContact CE-CG1 3.71Å; M112-V155 HydrophobicContact CE-CG2 3.63Å; M112-V155 HydrophobicContact CG-CG2 4.07Å; M112-V155 HydrophobicContact SD-CG1 4.49Å; M112-V155 HydrophobicContact SD-CG2 3.38Å; M112-V155 WeakPolarHBondContact SD-CG2 3.45Å
113	W	96.9	Very high	94.2	Very high	35 Å²	35	61.2 Å²	61.2	13%	0.133	31%	0.311	C	S	.	.	H	α-helix	trans	-50.8	-43.9	-170.8	171.8	-109.5	0	0	0	114.9	W109 L115 M116 Q117 L120 V176	W109-W113 AromaticContact CE2-CE3 3.97Å; W109-W113 AromaticContact CH2-CE3 3.85Å; W109-W113 HydrophobicContact CH2-CE3 3.85Å; W109-W113 HydrophobicContact CH2-CZ3 4.21Å; W109-W113 HydrophobicContact CZ2-CD2 4.04Å; W109-W113 AromaticContact CZ2-CE3 3.26Å; W109-W113 HydrophobicContact CZ2-CE3 3.26Å; W109-W113 AromaticContact CZ2-CZ3 3.78Å; W109-W113 HydrophobicContact CZ2-CZ3 3.78Å; W109-W113 WeakPolarHBondContact O-CA 3.22Å; W109-W113 WeakPolarHBondContact O-CB 3.44Å; W109-W113 PolarHBondContact O-N 2.78Å; W113-L115 PolarHBondContact O-N 3.47Å; W113-M116 HydrophobicContact CE3-CB 4.43Å; W113-M116 HydrophobicContact CE3-CG 4.49Å; W113-M116 HydrophobicContact CE3-SD 4.5Å; W113-M116 HydrophobicContact CZ3-CG 4.26Å; W113-M116 HydrophobicContact CZ3-SD 4.28Å; W113-M116 PolarHBondContact O-N 3.14Å; W113-M116 VanDerWaalsContact O-N 3.17Å; W113-Q117 HydrophobicContact CD2-CB 4.43Å; W113-Q117 HydrophobicContact CZ2-CB 4.03Å; W113-Q117 HydrophobicContact CZ2-CG 4.07Å; W113-Q117 WeakPolarHBondContact O-CB 3.32Å; W113-Q117 PolarHBondContact O-N 2.89Å; W113-L120 HydrophobicContact CH2-CD1 4.49Å; W113-V176 HydrophobicContact CH2-CB 3.56Å; W113-V176 HydrophobicContact CH2-CG1 4.1Å; W113-V176 HydrophobicContact CH2-CG2 3.71Å; W113-V176 HydrophobicContact CZ3-CB 3.86Å; W113-V176 HydrophobicContact CZ3-CG1 3.88Å; W113-V176 HydrophobicContact CZ3-CG2 3.97Å
114	P	97.2	Very high	94.2	Very high	74 Å²	74	62.1 Å²	62.1	48%	0.481	32%	0.317	S	S	.	.	H	α-helix	trans	-56.7	-34.5	178.3	-26.7	35.5	0	0	0	113.7	L110 M112 K118	L110-P114 WeakPolarHBondContact O-CD 3.27Å; M112-P114 VanDerWaalsContact C-CD 3.45Å; P114-K118 WeakPolarHBondContact O-CB 3.49Å; P114-K118 PolarHBondContact O-N 3.37Å; P114-K118 VanDerWaalsContact O-N 3.09Å
115	L	95.8	Very high	94.4	Very high	93 Å²	93	59.9 Å²	59.9	49%	0.487	30%	0.301	S	S	.	.	H	α-helix	trans	-68.2	-50.4	176.8	-179.1	64.6	0	0	0	110.9	M112 W113 Q117 K118 E119 L153	M112-L115 WeakPolarHBondContact O-CB 3.47Å; M112-L115 PolarHBondContact O-N 2.9Å; W113-L115 PolarHBondContact O-N 3.47Å; L115-Q117 VanDerWaalsContact C-N 3.33Å; L115-Q117 PolarHBondContact O-N 3.46Å; L115-K118 WeakPolarHBondContact O-CB 3.33Å; L115-K118 PolarHBondContact O-N 3.29Å; L115-E119 PolarHBondContact O-N 2.97Å; L115-E119 VanDerWaalsContact O-N 3.15Å; L115-L153 HydrophobicContact CD2-CD1 4.45Å; L115-L153 HydrophobicContact CD2-CD2 3.82Å; L115-L153 HydrophobicContact CG-CD2 3.94Å
116	M	96.4	Very high	94.8	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-62.1	-41.1	177.8	177.4	169.7	-81.4	0	0	111.6	W109 M112 W113 K118 E119 L120 L126 M147 T149 V155	W109-M116 HydrophobicContact CH2-SD 4.2Å; M112-M116 HydrophobicContact CE-SD 4.47Å; M112-M116 PolarHBondContact O-N 3.23Å; M112-M116 HydrophobicContact SD-CB 3.75Å; M112-M116 HydrophobicContact SD-CE 4.43Å; W113-M116 HydrophobicContact CE3-CB 4.43Å; W113-M116 HydrophobicContact CE3-CG 4.49Å; W113-M116 HydrophobicContact CE3-SD 4.5Å; W113-M116 HydrophobicContact CZ3-CG 4.26Å; W113-M116 HydrophobicContact CZ3-SD 4.28Å; W113-M116 PolarHBondContact O-N 3.14Å; W113-M116 VanDerWaalsContact O-N 3.17Å; M116-K118 VanDerWaalsContact C-N 3.33Å; M116-K118 PolarHBondContact O-N 2.81Å; M116-E119 PolarHBondContact O-N 3.4Å; M116-L120 HydrophobicContact CG-CD1 4.02Å; M116-L120 HydrophobicContact CG-CG 4.38Å; M116-L120 WeakPolarHBondContact O-CG 3.41Å; M116-L120 PolarHBondContact O-N 2.69Å; M116-L126 HydrophobicContact CE-CD2 4.33Å; M116-L126 HydrophobicContact SD-CD2 4.3Å; M116-M147 HydrophobicContact CE-CB 4.05Å; M116-M147 HydrophobicContact SD-CE 4.49Å; M116-T149 HydrophobicContact CE-CG2 4.05Å; M116-T149 HydrophobicContact CG-CG2 4.06Å; M116-V155 HydrophobicContact CE-CB 3.92Å; M116-V155 HydrophobicContact CE-CG2 3.29Å
117	Q	96.4	Very high	95.1	Very high	92 Å²	92	55.7 Å²	55.7	43%	0.43	28%	0.279	S	S	.	.	H	α-helix	trans	-59.9	-43.7	176.8	-171.1	178.3	28	0	0	111.3	W113 L115 E119 L120 L121	W113-Q117 HydrophobicContact CD2-CB 4.43Å; W113-Q117 HydrophobicContact CZ2-CB 4.03Å; W113-Q117 HydrophobicContact CZ2-CG 4.07Å; W113-Q117 WeakPolarHBondContact O-CB 3.32Å; W113-Q117 PolarHBondContact O-N 2.89Å; L115-Q117 VanDerWaalsContact C-N 3.33Å; L115-Q117 PolarHBondContact O-N 3.46Å; Q117-E119 VanDerWaalsContact C-N 3.31Å; Q117-E119 PolarHBondContact O-N 3.45Å; Q117-L120 PolarHBondContact O-N 2.66Å; Q117-L121 WeakPolarHBondContact O-CG 3.06Å; Q117-L121 PolarHBondContact O-N 3.14Å
118	K	95.2	Very high	95.4	Very high	150 Å²	150	50.3 Å²	50.3	65%	0.652	25%	0.254	S	S	*	.	H	α-helix	trans	-60.5	-39.6	175.8	-174.2	179.3	179.9	179.9	0	112.2	P114 L115 M116 V122	P114-K118 WeakPolarHBondContact O-CB 3.49Å; P114-K118 PolarHBondContact O-N 3.37Å; P114-K118 VanDerWaalsContact O-N 3.09Å; L115-K118 WeakPolarHBondContact O-CB 3.33Å; L115-K118 PolarHBondContact O-N 3.29Å; M116-K118 VanDerWaalsContact C-N 3.33Å; M116-K118 PolarHBondContact O-N 2.81Å; K118-V122 PolarHBondContact O-N 3.31Å
119	E	94.8	Very high	95.6	Very high	29 Å²	29	48.8 Å²	48.8	14%	0.136	25%	0.247	C	C	.	.	H	α-helix	trans	-70	-37.3	177.2	-67.6	-174.5	154.4	0	0	112.5	L115 M116 Q117 L121 V122 F123 T149 Y150 S151 L153	L115-E119 PolarHBondContact O-N 2.97Å; L115-E119 VanDerWaalsContact O-N 3.15Å; M116-E119 PolarHBondContact O-N 3.4Å; Q117-E119 VanDerWaalsContact C-N 3.31Å; Q117-E119 PolarHBondContact O-N 3.45Å; E119-L121 VanDerWaalsContact C-N 3.32Å; E119-L121 PolarHBondContact O-N 2.75Å; E119-V122 WeakPolarHBondContact O-CB 3.16Å; E119-V122 PolarHBondContact O-N 3.2Å; E119-V122 VanDerWaalsContact O-N 3.09Å; E119-F123 PolarHBondContact O-N 3.1Å; E119-T149 HydrophobicContact CB-CG2 4.17Å; E119-T149 WeakPolarHBondContact OE2-CB 3.25Å; E119-T149 VanDerWaalsContact OE2-CG2 3.24Å; E119-T149 WeakPolarHBondContact OE2-CG2 3.39Å; E119-T149 PolarHBondContact OE2-OG1 3.49Å; E119-Y150 HydrophobicContact CB-CD1 4.41Å; E119-Y150 HydrophobicContact CB-CE1 4Å; E119-Y150 HydrophobicContact CG-CE1 4.41Å; E119-Y150 WeakPolarHBondContact O-CE1 3.36Å; E119-S151 WeakPolarHBondContact OE1-CB 3.47Å; E119-S151 PolarHBondContact OE1-OG 3.37Å; E119-S151 PolarHBondContact OE2-OG 3.31Å; E119-L153 WeakPolarHBondContact OE2-CB 3.28Å; E119-L153 WeakPolarHBondContact OE2-CD2 3.48Å
120	L	94.8	Very high	95.6	Very high	17 Å²	17	48.8 Å²	48.8	9%	0.089	25%	0.247	C	C	.	.	H	α-helix	trans	-69.4	-28.3	176.4	-68.3	174.8	0	0	0	113.3	W113 M116 Q117 V122 F123 P124 L126 V176 V182	W113-L120 HydrophobicContact CH2-CD1 4.49Å; M116-L120 HydrophobicContact CG-CD1 4.02Å; M116-L120 HydrophobicContact CG-CG 4.38Å; M116-L120 WeakPolarHBondContact O-CG 3.41Å; M116-L120 PolarHBondContact O-N 2.69Å; Q117-L120 PolarHBondContact O-N 2.66Å; L120-V122 PolarHBondContact O-N 3.33Å; L120-F123 CarbonylContact O-C 3.59Å; L120-P124 WeakPolarHBondContact O-CA 3.2Å; L120-P124 WeakPolarHBondContact O-CB 3.33Å; L120-L126 HydrophobicContact CD1-CD1 4.26Å; L120-L126 HydrophobicContact CD1-CD2 4.3Å; L120-L126 HydrophobicContact CD1-CG 4.37Å; L120-L126 HydrophobicContact CD2-CD1 4.47Å; L120-L126 HydrophobicContact CD2-CD2 3.74Å; L120-L126 HydrophobicContact CD2-CG 3.74Å; L120-L126 HydrophobicContact CG-CD2 4.42Å; L120-V176 HydrophobicContact CD1-CG2 3.67Å; L120-V182 HydrophobicContact CD2-CG1 3.99Å
121	L	92.8	Very high	95.7	Very high	146 Å²	146	45 Å²	45	76%	0.764	23%	0.227	S	C	*	.	H	α-helix	trans	-65.7	-29.2	169.7	-71.8	173.2	0	0	0	112.3	Q117 E119	Q117-L121 WeakPolarHBondContact O-CG 3.06Å; Q117-L121 PolarHBondContact O-N 3.14Å; E119-L121 VanDerWaalsContact C-N 3.32Å; E119-L121 PolarHBondContact O-N 2.75Å
122	V	90.6	Very high	95.6	Very high	58 Å²	58	39.8 Å²	39.8	35%	0.352	20%	0.2	S	C	.	.	H	α-helix	trans	-83.7	-46.6	177.6	178.2	0	0	0	0	111.1	V87 K118 E119 L120 Y150	V87-V122 HydrophobicContact CB-CG1 4.2Å; V87-V122 HydrophobicContact CG1-CG1 3.45Å; V87-V122 VanDerWaalsContact CG1-CG1 3.45Å; V87-V122 HydrophobicContact CG2-CG1 3.61Å; K118-V122 PolarHBondContact O-N 3.31Å; E119-V122 WeakPolarHBondContact O-CB 3.16Å; E119-V122 PolarHBondContact O-N 3.2Å; E119-V122 VanDerWaalsContact O-N 3.09Å; L120-V122 PolarHBondContact O-N 3.33Å; V122-Y150 HydrophobicContact CB-CE1 3.95Å; V122-Y150 HydrophobicContact CG1-CE1 4.02Å; V122-Y150 HydrophobicContact CG1-CE2 4.49Å; V122-Y150 WeakPolarHBondContact CG1-OH 3.29Å
123	F	92.5	Very high	95.4	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.018	20%	0.201	C	C	.	.	S	Bend	trans	-142.8	104.8	179.3	-161.6	-96.6	0	0	0	110.4	E119 L120 V125 Y150 F275 L276 L281 S293 L298	E119-F123 PolarHBondContact O-N 3.1Å; L120-F123 CarbonylContact O-C 3.59Å; F123-V125 HydrophobicContact CD1-CB 3.72Å; F123-V125 HydrophobicContact CD1-CG2 3.65Å; F123-V125 HydrophobicContact CE1-CB 3.63Å; F123-V125 HydrophobicContact CE1-CG1 4.45Å; F123-V125 HydrophobicContact CE1-CG2 3.27Å; F123-V125 HydrophobicContact CZ-CG2 4.1Å; F123-V125 PolarHBondContact O-N 3.36Å; F123-Y150 HydrophobicContact CB-CD1 3.45Å; F123-Y150 VanDerWaalsContact CB-CD1 3.45Å; F123-Y150 HydrophobicContact CB-CD2 4.35Å; F123-Y150 HydrophobicContact CB-CE1 4.02Å; F123-Y150 HydrophobicContact CB-CG 3.63Å; F123-Y150 HydrophobicContact CD1-CG 4.36Å; F123-Y150 HydrophobicContact CG-CD1 4.43Å; F123-Y150 HydrophobicContact CG-CG 4.18Å; F123-F275 HydrophobicContact CE1-CE1 4.39Å; F123-F275 HydrophobicContact CZ-CE1 4.38Å; F123-L276 HydrophobicContact CE1-CD2 3.6Å; F123-L276 HydrophobicContact CE2-CD2 4.16Å; F123-L276 HydrophobicContact CZ-CD2 3.38Å; F123-L281 HydrophobicContact CE2-CD1 4.32Å; F123-L281 HydrophobicContact CZ-CD1 4.05Å; F123-S293 VanDerWaalsContact CE2-OG 3.28Å; F123-S293 WeakPolarHBondContact CE2-OG 3.41Å; F123-L298 HydrophobicContact CE1-CD1 4.4Å; F123-L298 HydrophobicContact CE2-CD1 4.01Å; F123-L298 HydrophobicContact CE2-CD2 4.23Å; F123-L298 HydrophobicContact CZ-CD1 3.91Å; F123-L298 HydrophobicContact CZ-CD2 3.95Å
124	P	95.1	Very high	94.6	Very high	19 Å²	19	40.6 Å²	40.6	12%	0.123	21%	0.212	C	C	.	.			trans	-82.6	60.3	-167.8	34.2	-38.7	0	0	0	112.7	L120 H181 V182 L183 Y295 L298	L120-P124 WeakPolarHBondContact O-CA 3.2Å; L120-P124 WeakPolarHBondContact O-CB 3.33Å; P124-H181 VanDerWaalsContact CB-O 3.32Å; P124-H181 WeakPolarHBondContact CB-O 3.26Å; P124-V182 WeakPolarHBondContact O-CA 3.32Å; P124-L183 PolarHBondContact O-N 3.41Å; P124-Y295 HydrophobicContact CB-CD2 4.35Å; P124-Y295 HydrophobicContact CG-CD2 3.78Å; P124-L298 HydrophobicContact CG-CD1 4.35Å
125	V	96.4	Very high	93.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	131.7	179.7	-178.6	0	0	0	0	110.1	F123 L183 V185 F275 L298	F123-V125 HydrophobicContact CD1-CB 3.72Å; F123-V125 HydrophobicContact CD1-CG2 3.65Å; F123-V125 HydrophobicContact CE1-CB 3.63Å; F123-V125 HydrophobicContact CE1-CG1 4.45Å; F123-V125 HydrophobicContact CE1-CG2 3.27Å; F123-V125 HydrophobicContact CZ-CG2 4.1Å; F123-V125 PolarHBondContact O-N 3.36Å; V125-L183 CarbonylContact C-O 3.31Å; V125-L183 WeakPolarHBondContact CA-O 3.48Å; V125-L183 HydrophobicContact CG2-CB 4.24Å; V125-L183 HydrophobicContact CG2-CD1 4.46Å; V125-V185 HydrophobicContact CG1-CB 4.41Å; V125-V185 HydrophobicContact CG1-CG1 3.73Å; V125-V185 HydrophobicContact CG1-CG2 3.74Å; V125-F275 HydrophobicContact CG1-CD1 4.06Å; V125-F275 HydrophobicContact CG1-CE1 4.2Å; V125-F275 HydrophobicContact CG2-CD1 4.4Å; V125-F275 HydrophobicContact CG2-CE1 3.82Å; V125-F275 HydrophobicContact CG2-CZ 4.39Å; V125-L298 HydrophobicContact CG2-CD1 3.99Å
126	L	98.2	Very high	91.7	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	123.7	172.9	-71.9	174.9	0	0	0	110.5	M116 L120 L128 A148 T149 V176 V182 L183 K184 V185	M116-L126 HydrophobicContact CE-CD2 4.33Å; M116-L126 HydrophobicContact SD-CD2 4.3Å; L120-L126 HydrophobicContact CD1-CD1 4.26Å; L120-L126 HydrophobicContact CD1-CD2 4.3Å; L120-L126 HydrophobicContact CD1-CG 4.37Å; L120-L126 HydrophobicContact CD2-CD1 4.47Å; L120-L126 HydrophobicContact CD2-CD2 3.74Å; L120-L126 HydrophobicContact CD2-CG 3.74Å; L120-L126 HydrophobicContact CG-CD2 4.42Å; L126-L128 HydrophobicContact CB-CD1 4.43Å; L126-A148 CarbonylContact C-O 3.51Å; L126-A148 VanDerWaalsContact CA-O 3.28Å; L126-A148 WeakPolarHBondContact CA-O 3.21Å; L126-T149 HydrophobicContact CD2-CG2 3.99Å; L126-V176 HydrophobicContact CD1-CG2 3.87Å; L126-V182 HydrophobicContact CB-CG1 4.43Å; L126-V182 HydrophobicContact CD1-CG1 3.89Å; L126-V182 HydrophobicContact CG-CG1 3.87Å; L126-L183 PolarHBondContact N-O 2.87Å; L126-K184 CarbonylContact O-C 3.45Å; L126-K184 WeakPolarHBondContact O-CA 3.5Å; L126-V185 PolarHBondContact O-N 3.39Å
127	G	98.3	Very high	89.9	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	133.5	162	0	0	0	0	0	109.7	M147 A148 V185 V272	G127-M147 CarbonylContact O-C 3.51Å; G127-M147 VanDerWaalsContact O-CA 3.31Å; G127-M147 WeakPolarHBondContact O-CA 3.34Å; G127-A148 PolarHBondContact N-O 3.26Å; G127-A148 PolarHBondContact O-N 3.48Å; G127-V185 CarbonylContact C-O 3.54Å; G127-V185 WeakPolarHBondContact CA-O 3.38Å; G127-V272 VanDerWaalsContact CA-CG2 3.46Å
128	L	97.3	Very high	88.3	Confident	8 Å²	8	52.4 Å²	52.4	4%	0.042	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	136.9	-174.4	-92.4	151.2	0	0	0	112.4	L126 L145 Q146 M147 K184 V185 L204	L126-L128 HydrophobicContact CB-CD1 4.43Å; L128-L145 HydrophobicContact CD2-CD1 3.43Å; L128-L145 VanDerWaalsContact CD2-CD1 3.43Å; L128-L145 HydrophobicContact CD2-CG 4.23Å; L128-Q146 WeakPolarHBondContact CA-O 3.46Å; L128-Q146 WeakPolarHBondContact CD2-O 3.4Å; L128-M147 HydrophobicContact CD2-CG 3.79Å; L128-M147 HydrophobicContact CG-CG 4.39Å; L128-K184 HydrophobicContact CD1-CB 3.37Å; L128-K184 HydrophobicContact CD1-CG 3.13Å; L128-V185 PolarHBondContact N-O 3.39Å; L128-L204 HydrophobicContact CD1-CD1 4.16Å; L128-L204 HydrophobicContact CD1-CD2 4.5Å
129	D	97.6	Very high	87.3	Confident	26 Å²	26	50.9 Å²	50.9	14%	0.139	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	171.6	168.2	-156.9	2.4	0	0	0	110.4	L145 Q146 D267	D129-L145 WeakPolarHBondContact O-CD1 3.48Å; D129-Q146 HydrophobicContact CB-CB 4.49Å; D129-Q146 PolarHBondContact N-O 3.39Å; D129-Q146 PolarHBondContact O-N 2.92Å; D129-Q146 PolarHBondContact O-OE1 3.38Å; D129-D267 HydrophobicContact CB-CB 4.4Å; D129-D267 VanDerWaalsContact OD2-CB 3.29Å; D129-D267 WeakPolarHBondContact OD2-CB 3.32Å
130	C	96.7	Very high	86.9	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.014	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	143	178.3	-74.9	0	0	0	0	112.1	W132 V142 L144 L145 D192	C130-W132 HydrophobicContact CB-CE3 4.38Å; C130-W132 HydrophobicContact CB-CZ3 4.15Å; C130-W132 WeakPolarHBondContact O-CZ3 3.28Å; C130-V142 HydrophobicContact CB-CG1 3.86Å; C130-V142 HydrophobicContact CB-CG2 4.31Å; C130-L144 WeakPolarHBondContact CA-O 3.25Å; C130-L145 VanDerWaalsContact SG-CD1 3.56Å; C130-D192 HydrophobicContact CB-CB 4.3Å
131	E	95.5	Very high	86.7	Confident	11 Å²	11	53.3 Å²	53.3	5%	0.051	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	153.1	171.1	-61.1	-61.6	158.7	0	0	112.6	S143 L144 W251 Y263	E131-S143 PolarHBondContact O-N 2.82Å; E131-L144 HydrophobicContact CB-CB 4.03Å; E131-L144 PolarHBondContact N-O 3.23Å; E131-L144 PolarHBondContact O-N 3.4Å; E131-W251 HydrophobicContact CB-CB 4.28Å; E131-W251 HydrophobicContact CB-CD2 3.51Å; E131-W251 HydrophobicContact CB-CE3 3.95Å; E131-W251 HydrophobicContact CB-CG 3.66Å; E131-W251 HydrophobicContact CB-CZ2 4.3Å; E131-W251 HydrophobicContact CB-CZ3 4.49Å; E131-W251 HydrophobicContact CG-CD2 3.83Å; E131-W251 HydrophobicContact CG-CE3 4.03Å; E131-W251 HydrophobicContact CG-CG 4.45Å; E131-W251 HydrophobicContact CG-CH2 3.93Å; E131-W251 HydrophobicContact CG-CZ2 3.71Å; E131-W251 HydrophobicContact CG-CZ3 4.07Å; E131-W251 PolarHBondContact OE2-NE1 3Å; E131-Y263 WeakPolarHBondContact OE1-CE1 3.19Å
132	W	93.9	Very high	86.8	Confident	57 Å²	57	46.4 Å²	46.4	22%	0.216	22%	0.222	C	C	.	.			trans	-154.8	153.7	178.6	57.6	81.7	0	0	0	112.1	C130	C130-W132 HydrophobicContact CB-CE3 4.38Å; C130-W132 HydrophobicContact CB-CZ3 4.15Å; C130-W132 WeakPolarHBondContact O-CZ3 3.28Å
133	V	91.4	Very high	87	Confident	16 Å²	16	43.6 Å²	43.6	10%	0.097	21%	0.206	C	C	.	.			trans	-78.7	145.6	171.5	174.4	0	0	0	0	111.4	M135 S140 W251 E252	V133-M135 HydrophobicContact CG1-CG 4.07Å; V133-S140 PolarHBondContact O-N 3.35Å; V133-W251 HydrophobicContact CG2-CB 4.13Å; V133-E252 HydrophobicContact CB-CG 4.18Å; V133-E252 HydrophobicContact CG2-CB 3.95Å; V133-E252 HydrophobicContact CG2-CG 3.61Å
134	S	80.8	Confident	87.3	Confident	51 Å²	51	43.4 Å²	43.4	36%	0.357	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	106.7	179.7	-79.4	0	0	0	0	110.5	R138 R326	S134-R138 CarbonylContact C-O 3.52Å; S134-R138 WeakPolarHBondContact CA-O 3.1Å; S134-R326 PolarHBondContact OG-NH1 3.13Å; S134-R326 PolarHBondContact OG-NH2 3.24Å
135	M	72.3	Confident	87.4	Confident	118 Å²	118	42.5 Å²	42.5	58%	0.581	20%	0.199	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	125.7	177.9	-69.5	-167.2	-79.9	0	0	111.5	V133 G137 R138	V133-M135 HydrophobicContact CG1-CG 4.07Å; M135-G137 PolarHBondContact O-N 2.83Å; M135-R138 PolarHBondContact N-O 2.93Å; M135-R138 WeakPolarHBondContact O-CA 3.4Å; M135-R138 PolarHBondContact O-N 2.88Å; M135-R138 VanDerWaalsContact O-O 3.05Å
136	K	59.1	Low	87.5	Confident	199 Å²	199	42.5 Å²	42.5	87%	0.865	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.8	52.1	174.3	-59.5	-177.4	178.3	-178.3	0	113.6	R138	K136-R138 PolarHBondContact O-N 3.14Å
137	G	58.7	Low	87.5	Confident	20 Å²	20	42.5 Å²	42.5	21%	0.206	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	2.8	-178.4	0	0	0	0	0	116	M135 E324 R326	M135-G137 PolarHBondContact O-N 2.83Å; G137-E324 WeakPolarHBondContact CA-OE2 3.33Å; G137-E324 PolarHBondContact N-OE2 2.82Å; G137-R326 WeakPolarHBondContact O-CD 3.45Å; G137-R326 VanDerWaalsContact O-CG 3.27Å; G137-R326 WeakPolarHBondContact O-CG 3.43Å; G137-R326 PolarHBondContact O-NE 3.48Å
138	R	62	Low	87.5	Confident	170 Å²	170	42.5 Å²	42.5	64%	0.642	20%	0.199	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	130.9	172.9	-63.3	-176	-179.7	173.3	3.4	110.6	S134 M135 K136 R326	S134-R138 CarbonylContact C-O 3.52Å; S134-R138 WeakPolarHBondContact CA-O 3.1Å; M135-R138 PolarHBondContact N-O 2.93Å; M135-R138 WeakPolarHBondContact O-CA 3.4Å; M135-R138 PolarHBondContact O-N 2.88Å; M135-R138 VanDerWaalsContact O-O 3.05Å; K136-R138 PolarHBondContact O-N 3.14Å; R138-R326 VanDerWaalsContact N-NH2 3.1Å; R138-R326 PolarHBondContact O-NH2 2.62Å; R138-R326 VanDerWaalsContact O-NH2 3.08Å
139	R	74.9	Confident	87.5	Confident	117 Å²	117	42.1 Å²	42.1	44%	0.442	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	141.2	173.3	52.9	179.9	172	-176.6	-2.6	109.8
140	S	85.8	Confident	87.4	Confident	28 Å²	28	42.4 Å²	42.4	20%	0.196	20%	0.196	C	C	.	.			trans	-74.3	175.2	162.9	-62.9	0	0	0	0	110.5	V133	V133-S140 PolarHBondContact O-N 3.35Å
141	E	91.5	Very high	87.3	Confident	69 Å²	69	43.7 Å²	43.7	32%	0.322	21%	0.205	S	C	.	.	S	Bend	trans	-62.4	160.9	166.2	-63.7	166.3	172.1	0	0	110.3	S143 R163 D199 Y200	E141-S143 PolarHBondContact O-N 2.74Å; E141-R163 VanDerWaalsContact OE2-CD 3.31Å; E141-R163 WeakPolarHBondContact OE2-CD 3.21Å; E141-R163 VanDerWaalsContact OE2-CG 3.27Å; E141-R163 WeakPolarHBondContact OE2-CG 3.49Å; E141-R163 IonicContact OE2-CZ 3.76Å; E141-R163 IonicContact OE2-NE 2.73Å; E141-R163 PolarHBondContact OE2-NE 3.09Å; E141-R163 IonicContact OE2-NH2 3.2Å; E141-D199 HydrophobicContact CB-CB 3.97Å; E141-D199 HydrophobicContact CG-CB 4.03Å; E141-Y200 HydrophobicContact CB-CE2 4.41Å
142	V	94.6	Very high	87.3	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.006	20%	0.202	C	C	.	.			trans	-52.9	126.5	176	177.9	0	0	0	0	110	C130 L144 M159 R195 L196 D199 Y200	C130-V142 HydrophobicContact CB-CG1 3.86Å; C130-V142 HydrophobicContact CB-CG2 4.31Å; V142-L144 WeakPolarHBondContact CG1-O 3.19Å; V142-M159 HydrophobicContact CG1-CG 4.07Å; V142-M159 VanDerWaalsContact O-CB 3.28Å; V142-M159 WeakPolarHBondContact O-CB 3.13Å; V142-R195 HydrophobicContact CG2-CB 4Å; V142-L196 HydrophobicContact CB-CD2 4.42Å; V142-L196 HydrophobicContact CG1-CD2 4.28Å; V142-L196 HydrophobicContact CG2-CD2 4.37Å; V142-D199 PolarHBondContact N-OD2 3.48Å; V142-Y200 HydrophobicContact CB-CE2 3.99Å; V142-Y200 WeakPolarHBondContact O-CE2 3.18Å; V142-Y200 PolarHBondContact O-OH 2.99Å
143	S	95.5	Very high	87.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.195	C	C	.	.			trans	-94.4	-34.5	-178.9	-55.6	0	0	0	0	111.5	E131 E141 M159 L160 E252	E131-S143 PolarHBondContact O-N 2.82Å; E141-S143 PolarHBondContact O-N 2.74Å; S143-M159 PolarHBondContact O-N 3.25Å; S143-L160 WeakPolarHBondContact O-CD1 3.4Å; S143-E252 WeakPolarHBondContact OG-CG 3.35Å
144	L	97	Very high	87.9	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	137	-178.6	-159.2	70.3	0	0	0	109.6	C130 E131 V142 Q146 L156 V157 R158 W251 L256 A264	C130-L144 WeakPolarHBondContact CA-O 3.25Å; E131-L144 HydrophobicContact CB-CB 4.03Å; E131-L144 PolarHBondContact N-O 3.23Å; E131-L144 PolarHBondContact O-N 3.4Å; V142-L144 WeakPolarHBondContact CG1-O 3.19Å; L144-Q146 HydrophobicContact CD2-CG 4.35Å; L144-Q146 PolarHBondContact O-OE1 2.81Å; L144-L156 HydrophobicContact CD1-CB 4.11Å; L144-L156 HydrophobicContact CD2-CB 4.39Å; L144-L156 HydrophobicContact CD2-CD2 4.4Å; L144-L156 HydrophobicContact CG-CB 4.42Å; L144-V157 WeakPolarHBondContact CA-O 3.3Å; L144-R158 HydrophobicContact CD1-CG 4.19Å; L144-W251 HydrophobicContact CD2-CE3 4.24Å; L144-W251 HydrophobicContact CD2-CZ3 4.18Å; L144-L256 HydrophobicContact CD1-CD1 3.94Å; L144-L256 HydrophobicContact CD2-CD1 3.96Å; L144-A264 HydrophobicContact CD2-CB 3.73Å
145	L	97.8	Very high	88.7	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	127.3	168.5	173.2	67.8	0	0	0	108.7	L128 D129 C130 M147 V157 M159 F173 L177 L196	L128-L145 HydrophobicContact CD2-CD1 3.43Å; L128-L145 VanDerWaalsContact CD2-CD1 3.43Å; L128-L145 HydrophobicContact CD2-CG 4.23Å; D129-L145 WeakPolarHBondContact O-CD1 3.48Å; C130-L145 VanDerWaalsContact SG-CD1 3.56Å; L145-M147 HydrophobicContact CD2-CG 4.47Å; L145-M147 HydrophobicContact CD2-SD 4.21Å; L145-M147 HydrophobicContact CG-CG 4.27Å; L145-V157 HydrophobicContact CB-CB 4.34Å; L145-V157 PolarHBondContact N-O 2.94Å; L145-V157 PolarHBondContact O-N 3.46Å; L145-M159 HydrophobicContact CB-CG 3.98Å; L145-M159 HydrophobicContact CB-SD 3.68Å; L145-M159 HydrophobicContact CD2-SD 4.29Å; L145-F173 HydrophobicContact CD2-CE2 3.74Å; L145-F173 HydrophobicContact CD2-CZ 3.54Å; L145-L177 HydrophobicContact CD2-CD1 4.44Å; L145-L177 HydrophobicContact CD2-CD2 4.38Å; L145-L196 HydrophobicContact CD1-CD1 3.81Å; L145-L196 HydrophobicContact CD1-CD2 4.28Å; L145-L196 HydrophobicContact CD2-CD1 4.46Å
146	Q	98.2	Very high	89.9	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	130.9	-179.5	-57.2	97.9	-67.5	0	0	110.2	L128 D129 L144 V155 L156 A264 A268	L128-Q146 WeakPolarHBondContact CA-O 3.46Å; L128-Q146 WeakPolarHBondContact CD2-O 3.4Å; D129-Q146 HydrophobicContact CB-CB 4.49Å; D129-Q146 PolarHBondContact N-O 3.39Å; D129-Q146 PolarHBondContact O-N 2.92Å; D129-Q146 PolarHBondContact O-OE1 3.38Å; L144-Q146 HydrophobicContact CD2-CG 4.35Å; L144-Q146 PolarHBondContact O-OE1 2.81Å; Q146-V155 WeakPolarHBondContact CA-O 3.38Å; Q146-L156 HydrophobicContact CB-CD2 4.06Å; Q146-L156 HydrophobicContact CG-CD2 3.46Å; Q146-L156 VanDerWaalsContact CG-CD2 3.46Å; Q146-A264 HydrophobicContact CG-CB 3.9Å; Q146-A264 WeakPolarHBondContact CG-O 3.46Å; Q146-A268 HydrophobicContact CB-CB 3.79Å
147	M	98.4	Very high	91.7	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	111.3	178.5	-65.4	-177.2	-58.9	0	0	110.2	W109 M116 G127 L128 L145 C154 V155 V157 F173 L177	W109-M147 HydrophobicContact CH2-CE 3.45Å; W109-M147 VanDerWaalsContact CH2-CE 3.45Å; W109-M147 HydrophobicContact CZ3-CE 3.31Å; M116-M147 HydrophobicContact CE-CB 4.05Å; M116-M147 HydrophobicContact SD-CE 4.49Å; G127-M147 CarbonylContact O-C 3.51Å; G127-M147 VanDerWaalsContact O-CA 3.31Å; G127-M147 WeakPolarHBondContact O-CA 3.34Å; L128-M147 HydrophobicContact CD2-CG 3.79Å; L128-M147 HydrophobicContact CG-CG 4.39Å; L145-M147 HydrophobicContact CD2-CG 4.47Å; L145-M147 HydrophobicContact CD2-SD 4.21Å; L145-M147 HydrophobicContact CG-CG 4.27Å; M147-C154 CarbonylContact O-C 3.54Å; M147-C154 WeakPolarHBondContact O-CA 3.37Å; M147-V155 HydrophobicContact CE-CG1 4.49Å; M147-V155 PolarHBondContact N-O 3.15Å; M147-V155 PolarHBondContact O-N 3.39Å; M147-V157 HydrophobicContact CE-CG2 3.57Å; M147-F173 HydrophobicContact CE-CD2 4.14Å; M147-F173 HydrophobicContact CE-CE2 3.85Å; M147-F173 HydrophobicContact SD-CE2 4.19Å; M147-L177 HydrophobicContact SD-CD2 4.04Å
148	A	98.6	Very high	93.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	138.2	-179.9	0	0	0	0	0	112.1	L126 G127 L153 C154 A268 Q269 V272	L126-A148 CarbonylContact C-O 3.51Å; L126-A148 VanDerWaalsContact CA-O 3.28Å; L126-A148 WeakPolarHBondContact CA-O 3.21Å; G127-A148 PolarHBondContact N-O 3.26Å; G127-A148 PolarHBondContact O-N 3.48Å; A148-L153 CarbonylContact C-O 3.49Å; A148-L153 VanDerWaalsContact CA-O 3.23Å; A148-L153 WeakPolarHBondContact CA-O 3.36Å; A148-C154 HydrophobicContact CB-CB 4.19Å; A148-A268 VanDerWaalsContact CB-C 3.49Å; A148-A268 HydrophobicContact CB-CB 3.71Å; A148-Q269 HydrophobicContact CB-CG 4.08Å; A148-V272 HydrophobicContact CB-CG2 4.17Å; A148-V272 WeakPolarHBondContact O-CG2 3.47Å
149	T	97.8	Very high	94.9	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.068	C	C	.	.			trans	-98.3	177	174.2	67.1	0	0	0	0	111.3	M116 E119 L126 S151 G152 L153	M116-T149 HydrophobicContact CE-CG2 4.05Å; M116-T149 HydrophobicContact CG-CG2 4.06Å; E119-T149 HydrophobicContact CB-CG2 4.17Å; E119-T149 WeakPolarHBondContact OE2-CB 3.25Å; E119-T149 VanDerWaalsContact OE2-CG2 3.24Å; E119-T149 WeakPolarHBondContact OE2-CG2 3.39Å; E119-T149 PolarHBondContact OE2-OG1 3.49Å; L126-T149 HydrophobicContact CD2-CG2 3.99Å; T149-S151 PolarHBondContact O-N 2.77Å; T149-S151 PolarHBondContact OG1-OG 3.21Å; T149-G152 PolarHBondContact O-N 3.01Å; T149-L153 PolarHBondContact N-O 3.07Å; T149-L153 PolarHBondContact OG1-O 3.47Å
150	Y	95.1	Very high	95.6	Very high	32 Å²	32	11 Å²	11	13%	0.125	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-21.8	179.4	84	-81.4	0	0	0	114.6	V87 P90 E119 V122 F123 G152	V87-Y150 HydrophobicContact CG1-CE2 4.04Å; P90-Y150 WeakPolarHBondContact CD-O 3.42Å; P90-Y150 WeakPolarHBondContact CG-O 3.47Å; E119-Y150 HydrophobicContact CB-CD1 4.41Å; E119-Y150 HydrophobicContact CB-CE1 4Å; E119-Y150 HydrophobicContact CG-CE1 4.41Å; E119-Y150 WeakPolarHBondContact O-CE1 3.36Å; V122-Y150 HydrophobicContact CB-CE1 3.95Å; V122-Y150 HydrophobicContact CG1-CE1 4.02Å; V122-Y150 HydrophobicContact CG1-CE2 4.49Å; V122-Y150 WeakPolarHBondContact CG1-OH 3.29Å; F123-Y150 HydrophobicContact CB-CD1 3.45Å; F123-Y150 VanDerWaalsContact CB-CD1 3.45Å; F123-Y150 HydrophobicContact CB-CD2 4.35Å; F123-Y150 HydrophobicContact CB-CE1 4.02Å; F123-Y150 HydrophobicContact CB-CG 3.63Å; F123-Y150 HydrophobicContact CD1-CG 4.36Å; F123-Y150 HydrophobicContact CG-CD1 4.43Å; F123-Y150 HydrophobicContact CG-CG 4.18Å; Y150-G152 VanDerWaalsContact C-N 3.29Å
151	S	95.1	Very high	95.4	Very high	28 Å²	28	11.9 Å²	11.9	20%	0.196	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-17.8	-179.5	70.6	0	0	0	0	112.7	E119 T149 L153	E119-S151 WeakPolarHBondContact OE1-CB 3.47Å; E119-S151 PolarHBondContact OE1-OG 3.37Å; E119-S151 PolarHBondContact OE2-OG 3.31Å; T149-S151 PolarHBondContact O-N 2.77Å; T149-S151 PolarHBondContact OG1-OG 3.21Å; S151-L153 PolarHBondContact OG-N 3.37Å; S151-L153 VanDerWaalsContact OG-N 3.17Å
152	G	95.8	Very high	95	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.048	C	C	.	.	S	Bend	trans	100.2	-9.2	-167.8	0	0	0	0	0	113.7	V98 T149 Y150 C154 Q269	V98-G152 WeakPolarHBondContact CB-O 3.42Å; T149-G152 PolarHBondContact O-N 3.01Å; Y150-G152 VanDerWaalsContact C-N 3.29Å; G152-C154 PolarHBondContact O-N 3.37Å; G152-C154 VanDerWaalsContact O-N 3.11Å; G152-Q269 PolarHBondContact O-NE2 3.2Å
153	L	97.7	Very high	94.4	Very high	10 Å²	10	12.3 Å²	12.3	5%	0.052	6%	0.06	C	C	.	.			trans	-55.2	121.5	171.3	173.9	65.6	0	0	0	109	V101 L115 E119 A148 T149 S151 V155	V101-L153 HydrophobicContact CG2-CD1 4Å; L115-L153 HydrophobicContact CD2-CD1 4.45Å; L115-L153 HydrophobicContact CD2-CD2 3.82Å; L115-L153 HydrophobicContact CG-CD2 3.94Å; E119-L153 WeakPolarHBondContact OE2-CB 3.28Å; E119-L153 WeakPolarHBondContact OE2-CD2 3.48Å; A148-L153 CarbonylContact C-O 3.49Å; A148-L153 VanDerWaalsContact CA-O 3.23Å; A148-L153 WeakPolarHBondContact CA-O 3.36Å; T149-L153 PolarHBondContact N-O 3.07Å; T149-L153 PolarHBondContact OG1-O 3.47Å; S151-L153 PolarHBondContact OG-N 3.37Å; S151-L153 VanDerWaalsContact OG-N 3.17Å; L153-V155 HydrophobicContact CG-CG2 4.5Å
154	C	98.4	Very high	93.2	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	125.6	176.4	-172	0	0	0	0	110	P100 V101 M147 A148 G152 A265 Q269	P100-C154 CarbonylContact C-O 3.5Å; P100-C154 WeakPolarHBondContact CA-O 3.39Å; P100-C154 HydrophobicContact CB-CB 4.32Å; V101-C154 PolarHBondContact N-O 2.7Å; M147-C154 CarbonylContact O-C 3.54Å; M147-C154 WeakPolarHBondContact O-CA 3.37Å; A148-C154 HydrophobicContact CB-CB 4.19Å; G152-C154 PolarHBondContact O-N 3.37Å; G152-C154 VanDerWaalsContact O-N 3.11Å; C154-A265 HydrophobicContact CB-CB 4.1Å; C154-Q269 HydrophobicContact CB-CG 3.97Å
155	V	98.1	Very high	91.7	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.7	178.5	-178.1	0	0	0	0	108.8	V101 V103 W109 M112 M116 Q146 M147 L153 V157	V101-V155 CarbonylContact O-C 3.46Å; V101-V155 WeakPolarHBondContact O-CA 3.33Å; V103-V155 HydrophobicContact CB-CG1 4.29Å; V103-V155 HydrophobicContact CG2-CG1 3.64Å; W109-V155 HydrophobicContact CZ3-CG1 4.26Å; M112-V155 HydrophobicContact CE-CB 4.25Å; M112-V155 HydrophobicContact CE-CG1 3.71Å; M112-V155 HydrophobicContact CE-CG2 3.63Å; M112-V155 HydrophobicContact CG-CG2 4.07Å; M112-V155 HydrophobicContact SD-CG1 4.49Å; M112-V155 HydrophobicContact SD-CG2 3.38Å; M112-V155 WeakPolarHBondContact SD-CG2 3.45Å; M116-V155 HydrophobicContact CE-CB 3.92Å; M116-V155 HydrophobicContact CE-CG2 3.29Å; Q146-V155 WeakPolarHBondContact CA-O 3.38Å; M147-V155 HydrophobicContact CE-CG1 4.49Å; M147-V155 PolarHBondContact N-O 3.15Å; M147-V155 PolarHBondContact O-N 3.39Å; L153-V155 HydrophobicContact CG-CG2 4.5Å; V155-V157 HydrophobicContact CG1-CG2 3.82Å
156	L	97.9	Very high	90.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	95.9	176.9	-53.3	-179.1	0	0	0	108.3	P100 V101 T102 V103 L144 Q146 R158 T261 A264 A265	P100-L156 HydrophobicContact CB-CD1 3.88Å; P100-L156 HydrophobicContact CB-CG 4Å; P100-L156 HydrophobicContact CG-CD1 4.19Å; V101-L156 PolarHBondContact O-N 2.92Å; T102-L156 WeakPolarHBondContact CA-O 3.23Å; V103-L156 PolarHBondContact N-O 3.14Å; L144-L156 HydrophobicContact CD1-CB 4.11Å; L144-L156 HydrophobicContact CD2-CB 4.39Å; L144-L156 HydrophobicContact CD2-CD2 4.4Å; L144-L156 HydrophobicContact CG-CB 4.42Å; Q146-L156 HydrophobicContact CB-CD2 4.06Å; Q146-L156 HydrophobicContact CG-CD2 3.46Å; Q146-L156 VanDerWaalsContact CG-CD2 3.46Å; L156-R158 PolarHBondContact O-N 2.64Å; L156-T261 HydrophobicContact CD1-CG2 3.96Å; L156-A264 HydrophobicContact CD2-CB 4.13Å; L156-A265 HydrophobicContact CD2-CB 4.35Å
157	V	96.6	Very high	89.5	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.012	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	115.4	-179.5	-175.1	0	0	0	0	109.1	V103 W109 L144 L145 M147 V155 M159 F162 F173	V103-V157 HydrophobicContact CB-CG2 4.42Å; V103-V157 HydrophobicContact CG1-CG1 4.49Å; W109-V157 HydrophobicContact CE3-CG2 4.25Å; W109-V157 HydrophobicContact CZ3-CG2 4.01Å; L144-V157 WeakPolarHBondContact CA-O 3.3Å; L145-V157 HydrophobicContact CB-CB 4.34Å; L145-V157 PolarHBondContact N-O 2.94Å; L145-V157 PolarHBondContact O-N 3.46Å; M147-V157 HydrophobicContact CE-CG2 3.57Å; V155-V157 HydrophobicContact CG1-CG2 3.82Å; V157-M159 HydrophobicContact CB-SD 4.31Å; V157-M159 HydrophobicContact CG1-SD 3.88Å; V157-M159 PolarHBondContact O-N 3.2Å; V157-M159 VanDerWaalsContact O-N 3.12Å; V157-F162 HydrophobicContact CG1-CE2 4.15Å; V157-F173 HydrophobicContact CG1-CE2 4.26Å; V157-F173 HydrophobicContact CG1-CZ 4.34Å; V157-F173 HydrophobicContact CG2-CE2 4.12Å
158	R	95.2	Very high	88.8	Confident	18 Å²	18	38.4 Å²	38.4	7%	0.068	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	97.6	177.4	-66.5	-82	-66.9	176.7	-1.6	108.9	T102 V103 L144 L156 L160 T161 W251 A253	T102-R158 HydrophobicContact CG2-CG 3.67Å; V103-R158 WeakPolarHBondContact O-CB 3.46Å; V103-R158 PolarHBondContact O-N 3.46Å; L144-R158 HydrophobicContact CD1-CG 4.19Å; L156-R158 PolarHBondContact O-N 2.64Å; R158-L160 PolarHBondContact O-N 3.24Å; R158-T161 PolarHBondContact O-OG1 3.25Å; R158-T161 VanDerWaalsContact O-OG1 3.08Å; R158-W251 PolarHBondContact NH1-O 2.7Å; R158-W251 VanDerWaalsContact NH1-O 3.15Å; R158-A253 PolarHBondContact NH1-O 3.5Å; R158-A253 PolarHBondContact NH2-O 3.11Å
159	M	94	Very high	88.4	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-68.9	-20.9	-173	-60.3	-58	-65.8	0	0	113.1	V142 S143 L145 V157 T161 F162 F169 F173 L196 Y200 L202	V142-M159 HydrophobicContact CG1-CG 4.07Å; V142-M159 VanDerWaalsContact O-CB 3.28Å; V142-M159 WeakPolarHBondContact O-CB 3.13Å; S143-M159 PolarHBondContact O-N 3.25Å; L145-M159 HydrophobicContact CB-CG 3.98Å; L145-M159 HydrophobicContact CB-SD 3.68Å; L145-M159 HydrophobicContact CD2-SD 4.29Å; V157-M159 HydrophobicContact CB-SD 4.31Å; V157-M159 HydrophobicContact CG1-SD 3.88Å; V157-M159 PolarHBondContact O-N 3.2Å; V157-M159 VanDerWaalsContact O-N 3.12Å; M159-T161 PolarHBondContact O-N 2.82Å; M159-F162 PolarHBondContact O-N 2.78Å; M159-F162 VanDerWaalsContact O-N 3.14Å; M159-F169 HydrophobicContact CE-CE1 3.71Å; M159-F169 HydrophobicContact CE-CZ 3.84Å; M159-F173 HydrophobicContact CE-CZ 4.44Å; M159-F173 HydrophobicContact SD-CZ 4.3Å; M159-L196 HydrophobicContact CE-CD2 4.21Å; M159-Y200 HydrophobicContact CB-CE1 4.47Å; M159-Y200 HydrophobicContact CB-CE2 4Å; M159-Y200 HydrophobicContact CE-CD1 4.44Å; M159-Y200 HydrophobicContact CE-CD2 3.78Å; M159-Y200 HydrophobicContact CE-CE2 3.98Å; M159-Y200 HydrophobicContact CE-CG 4.04Å; M159-Y200 PolarHBondContact O-OH 3.23Å; M159-L202 HydrophobicContact CE-CD1 3.72Å
160	L	88.1	Confident	88.2	Confident	44 Å²	44	40.5 Å²	40.5	23%	0.23	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-56.2	-34	-179.6	-76.3	96.4	0	0	0	113.4	S143 R158 F162 R163 E252	S143-L160 WeakPolarHBondContact O-CD1 3.4Å; R158-L160 PolarHBondContact O-N 3.24Å; L160-F162 PolarHBondContact O-N 2.82Å; L160-R163 VanDerWaalsContact O-CB 3.28Å; L160-R163 WeakPolarHBondContact O-CB 3.41Å; L160-R163 PolarHBondContact O-N 3Å; L160-E252 HydrophobicContact CD1-CB 4.46Å; L160-E252 HydrophobicContact CD1-CG 4.14Å; L160-E252 HydrophobicContact CD2-CB 3.75Å; L160-E252 HydrophobicContact CD2-CG 3.77Å; L160-E252 HydrophobicContact CG-CG 4.29Å
161	T	82.8	Confident	88.1	Confident	45 Å²	45	45.4 Å²	45.4	28%	0.276	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-71.6	-16.3	-176.2	54.5	0	0	0	0	113.2	S104 R158 M159	S104-T161 VanDerWaalsContact O-CB 3.28Å; S104-T161 WeakPolarHBondContact O-CB 3.36Å; S104-T161 WeakPolarHBondContact O-CG2 3.13Å; S104-T161 PolarHBondContact O-OG1 3.35Å; R158-T161 PolarHBondContact O-OG1 3.25Å; R158-T161 VanDerWaalsContact O-OG1 3.08Å; M159-T161 PolarHBondContact O-N 2.82Å
162	F	82.1	Confident	88.2	Confident	9 Å²	9	44.9 Å²	44.9	4%	0.039	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-99.8	-3	176	-53.5	-77.2	0	0	0	113.2	V157 M159 L160 Q167 F169	V157-F162 HydrophobicContact CG1-CE2 4.15Å; M159-F162 PolarHBondContact O-N 2.78Å; M159-F162 VanDerWaalsContact O-N 3.14Å; L160-F162 PolarHBondContact O-N 2.82Å; F162-Q167 HydrophobicContact CD1-CB 3.96Å; F162-Q167 HydrophobicContact CE1-CB 4.23Å; F162-F169 HydrophobicContact CB-CD1 4.07Å; F162-F169 HydrophobicContact CB-CE1 3.38Å; F162-F169 HydrophobicContact CB-CE2 3.92Å; F162-F169 HydrophobicContact CB-CZ 3.28Å; F162-F169 AromaticContact CD1-CD1 3.68Å; F162-F169 HydrophobicContact CD1-CD1 3.68Å; F162-F169 AromaticContact CD1-CE1 3.84Å; F162-F169 HydrophobicContact CD1-CE1 3.84Å; F162-F169 HydrophobicContact CD1-CG 4.21Å; F162-F169 HydrophobicContact CD1-CZ 4.45Å; F162-F169 AromaticContact CD2-CD1 3.93Å; F162-F169 HydrophobicContact CD2-CD1 3.93Å; F162-F169 AromaticContact CD2-CE1 3.41Å; F162-F169 HydrophobicContact CD2-CE1 3.41Å; F162-F169 VanDerWaalsContact CD2-CE1 3.41Å; F162-F169 HydrophobicContact CD2-CZ 4.21Å; F162-F169 HydrophobicContact CE1-CD1 4.07Å; F162-F169 HydrophobicContact CE1-CE1 4.49Å; F162-F169 HydrophobicContact CE2-CD1 4.29Å; F162-F169 HydrophobicContact CE2-CE1 4.13Å; F162-F169 AromaticContact CG-CD1 3.6Å; F162-F169 HydrophobicContact CG-CD1 3.6Å; F162-F169 AromaticContact CG-CE1 3.23Å; F162-F169 HydrophobicContact CG-CE1 3.23Å; F162-F169 HydrophobicContact CG-CE2 4.5Å; F162-F169 HydrophobicContact CG-CG 4.39Å; F162-F169 AromaticContact CG-CZ 3.75Å; F162-F169 HydrophobicContact CG-CZ 3.75Å; F162-F169 HydrophobicContact CZ-CD1 4.36Å
163	R	83.2	Confident	88.2	Confident	70 Å²	70	45 Å²	45	26%	0.264	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-64.1	139.6	-179.3	-177.2	176.7	-76.1	169.2	3.6	110.7	E141 L160 G165 Q166 Y200 E252	E141-R163 VanDerWaalsContact OE2-CD 3.31Å; E141-R163 WeakPolarHBondContact OE2-CD 3.21Å; E141-R163 VanDerWaalsContact OE2-CG 3.27Å; E141-R163 WeakPolarHBondContact OE2-CG 3.49Å; E141-R163 IonicContact OE2-CZ 3.76Å; E141-R163 IonicContact OE2-NE 2.73Å; E141-R163 PolarHBondContact OE2-NE 3.09Å; E141-R163 IonicContact OE2-NH2 3.2Å; L160-R163 VanDerWaalsContact O-CB 3.28Å; L160-R163 WeakPolarHBondContact O-CB 3.41Å; L160-R163 PolarHBondContact O-N 3Å; R163-G165 PolarHBondContact O-N 2.89Å; R163-G165 VanDerWaalsContact O-N 3.12Å; R163-Q166 WeakPolarHBondContact O-CG 3.48Å; R163-Q166 PolarHBondContact O-N 2.7Å; R163-Y200 HydrophobicContact CB-CE1 4.45Å; R163-E252 IonicContact CZ-OE1 2.99Å; R163-E252 VanDerWaalsContact CZ-OE1 3.3Å; R163-E252 IonicContact NH1-OE1 3.86Å; R163-E252 PolarHBondContact NH1-OE1 3.06Å; R163-E252 IonicContact NH2-OE1 3.86Å; R163-E252 PolarHBondContact NH2-OE1 2.78Å
164	G	70.1	Confident	88.1	Confident	82 Å²	82	45.8 Å²	45.8	85%	0.845	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	64.7	14.6	175.2	0	0	0	0	0	115.3
165	G	65.9	Low	88.1	Confident	65 Å²	65	51.7 Å²	51.7	67%	0.67	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	76.4	19.3	179.4	0	0	0	0	0	114.7	R163 Q167	R163-G165 PolarHBondContact O-N 2.89Å; R163-G165 VanDerWaalsContact O-N 3.12Å; G165-Q167 VanDerWaalsContact C-N 3.27Å; G165-Q167 PolarHBondContact O-N 3.17Å
166	Q	70.3	Confident	88	Confident	165 Å²	165	52 Å²	52	77%	0.771	29%	0.29	S	S	*	.	S	Bend	trans	-59.4	-38.6	175.9	-69	-73.5	-48.4	0	0	112.1	R163	R163-Q166 WeakPolarHBondContact O-CG 3.48Å; R163-Q166 PolarHBondContact O-N 2.7Å
167	Q	78.8	Confident	88	Confident	73 Å²	73	52 Å²	52	34%	0.341	29%	0.291	S	S	.	.	S	Bend	trans	-134.4	150.1	171.8	-64.9	-171.2	1.5	0	0	109.8	F162 G165	F162-Q167 HydrophobicContact CD1-CB 3.96Å; F162-Q167 HydrophobicContact CE1-CB 4.23Å; G165-Q167 VanDerWaalsContact C-N 3.27Å; G165-Q167 PolarHBondContact O-N 3.17Å
168	Q	84	Confident	88	Confident	164 Å²	164	57.4 Å²	57.4	77%	0.766	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-82.4	146.3	171.1	-65.8	-173.6	9.4	0	0	109.9
169	F	89.9	Confident	88	Confident	38 Å²	38	59.2 Å²	59.2	17%	0.167	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-67.7	135	171.1	-70.7	-72.5	0	0	0	110.2	M159 F162 L171 F173 V174 Y200 L202	M159-F169 HydrophobicContact CE-CE1 3.71Å; M159-F169 HydrophobicContact CE-CZ 3.84Å; F162-F169 HydrophobicContact CB-CD1 4.07Å; F162-F169 HydrophobicContact CB-CE1 3.38Å; F162-F169 HydrophobicContact CB-CE2 3.92Å; F162-F169 HydrophobicContact CB-CZ 3.28Å; F162-F169 AromaticContact CD1-CD1 3.68Å; F162-F169 HydrophobicContact CD1-CD1 3.68Å; F162-F169 AromaticContact CD1-CE1 3.84Å; F162-F169 HydrophobicContact CD1-CE1 3.84Å; F162-F169 HydrophobicContact CD1-CG 4.21Å; F162-F169 HydrophobicContact CD1-CZ 4.45Å; F162-F169 AromaticContact CD2-CD1 3.93Å; F162-F169 HydrophobicContact CD2-CD1 3.93Å; F162-F169 AromaticContact CD2-CE1 3.41Å; F162-F169 HydrophobicContact CD2-CE1 3.41Å; F162-F169 VanDerWaalsContact CD2-CE1 3.41Å; F162-F169 HydrophobicContact CD2-CZ 4.21Å; F162-F169 HydrophobicContact CE1-CD1 4.07Å; F162-F169 HydrophobicContact CE1-CE1 4.49Å; F162-F169 HydrophobicContact CE2-CD1 4.29Å; F162-F169 HydrophobicContact CE2-CE1 4.13Å; F162-F169 AromaticContact CG-CD1 3.6Å; F162-F169 HydrophobicContact CG-CD1 3.6Å; F162-F169 AromaticContact CG-CE1 3.23Å; F162-F169 HydrophobicContact CG-CE1 3.23Å; F162-F169 HydrophobicContact CG-CE2 4.5Å; F162-F169 HydrophobicContact CG-CG 4.39Å; F162-F169 AromaticContact CG-CZ 3.75Å; F162-F169 HydrophobicContact CG-CZ 3.75Å; F162-F169 HydrophobicContact CZ-CD1 4.36Å; F169-L171 PolarHBondContact O-N 2.71Å; F169-F173 HydrophobicContact CB-CD1 4.09Å; F169-F173 AromaticContact CD1-CD1 3.58Å; F169-F173 HydrophobicContact CD1-CD1 3.58Å; F169-F173 AromaticContact CD1-CE1 3.41Å; F169-F173 HydrophobicContact CD1-CE1 3.41Å; F169-F173 VanDerWaalsContact CD1-CE1 3.41Å; F169-F173 HydrophobicContact CE1-CD1 4.36Å; F169-F173 AromaticContact CE1-CE1 3.73Å; F169-F173 HydrophobicContact CE1-CE1 3.73Å; F169-F173 HydrophobicContact CG-CD1 4.11Å; F169-F173 HydrophobicContact CG-CE1 4.21Å; F169-V174 HydrophobicContact CB-CG2 3.63Å; F169-Y200 HydrophobicContact CE2-CD1 4.12Å; F169-Y200 HydrophobicContact CE2-CG 4.37Å; F169-Y200 AromaticContact CZ-CD1 3.66Å; F169-Y200 HydrophobicContact CZ-CD1 3.66Å; F169-Y200 HydrophobicContact CZ-CE1 4.46Å; F169-Y200 AromaticContact CZ-CG 3.93Å; F169-Y200 HydrophobicContact CZ-CG 3.93Å; F169-L202 HydrophobicContact CD1-CD1 4.41Å; F169-L202 HydrophobicContact CD2-CD2 3.92Å; F169-L202 HydrophobicContact CD2-CG 4.39Å; F169-L202 HydrophobicContact CE1-CD1 3.94Å; F169-L202 HydrophobicContact CE2-CD1 4.1Å; F169-L202 HydrophobicContact CE2-CD2 4.19Å; F169-L202 HydrophobicContact CE2-CG 4.15Å; F169-L202 HydrophobicContact CG-CD2 4.1Å; F169-L202 HydrophobicContact CZ-CD1 3.77Å; F169-L202 HydrophobicContact CZ-CG 4.33Å
170	P	93.1	Very high	88	Confident	6 Å²	6	62.8 Å²	62.8	4%	0.039	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-56.3	139.4	171.7	-23.1	33.3	0	0	0	110.8	Q106 W109 S172 F173 V174	Q106-P170 HydrophobicContact CB-CG 4.25Å; Q106-P170 HydrophobicContact CG-CG 4.01Å; W109-P170 HydrophobicContact CB-CG 3.99Å; W109-P170 VanDerWaalsContact CD1-CG 3.47Å; W109-P170 HydrophobicContact CG-CB 4.17Å; W109-P170 HydrophobicContact CG-CG 3.82Å; P170-S172 VanDerWaalsContact C-N 3.28Å; P170-S172 PolarHBondContact O-N 3.36Å; P170-F173 HydrophobicContact CB-CB 4.29Å; P170-F173 WeakPolarHBondContact O-CB 3.47Å; P170-F173 PolarHBondContact O-N 3.34Å; P170-V174 PolarHBondContact O-N 3.3Å
171	L	93.8	Very high	88.3	Confident	134 Å²	134	66.1 Å²	66.1	70%	0.702	36%	0.359	S	S	*	.	H	α-helix	trans	-56.8	-43.3	-177.9	-71.5	173.3	0	0	0	112	F169 F173 V174 E175	F169-L171 PolarHBondContact O-N 2.71Å; L171-F173 VanDerWaalsContact C-N 3.25Å; L171-F173 PolarHBondContact O-N 3.14Å; L171-V174 PolarHBondContact O-N 2.9Å; L171-V174 VanDerWaalsContact O-N 3.1Å; L171-E175 WeakPolarHBondContact O-CB 3.45Å; L171-E175 VanDerWaalsContact O-CG 3.29Å; L171-E175 WeakPolarHBondContact O-CG 3.36Å; L171-E175 PolarHBondContact O-N 3.02Å
172	S	96.6	Very high	88.9	Confident	17 Å²	17	64.3 Å²	64.3	12%	0.119	35%	0.348	C	S	.	.	H	α-helix	trans	-61.1	-32.7	178.8	56.2	0	0	0	0	113.5	W109 P170 V176	W109-S172 PolarHBondContact NE1-OG 2.99Å; P170-S172 VanDerWaalsContact C-N 3.28Å; P170-S172 PolarHBondContact O-N 3.36Å; S172-V176 WeakPolarHBondContact O-CG1 3.37Å; S172-V176 PolarHBondContact O-N 2.71Å
173	F	96.4	Very high	89.6	Confident	3 Å²	3	63.9 Å²	63.9	1%	0.013	35%	0.346	C	S	.	.	H	α-helix	trans	-67	-46.2	173.5	176	-106.2	0	0	0	111.6	W109 L145 M147 V157 M159 F169 P170 L171 E175 V176 L177 L202	W109-F173 HydrophobicContact CD2-CB 4.17Å; W109-F173 HydrophobicContact CD2-CD2 4.34Å; W109-F173 HydrophobicContact CE3-CD2 4.16Å; W109-F173 HydrophobicContact CH2-CB 4.39Å; W109-F173 AromaticContact CH2-CD2 3.62Å; W109-F173 HydrophobicContact CH2-CD2 3.62Å; W109-F173 HydrophobicContact CH2-CE2 4.48Å; W109-F173 HydrophobicContact CH2-CG 4.5Å; W109-F173 HydrophobicContact CZ2-CB 3.66Å; W109-F173 AromaticContact CZ2-CD2 3.78Å; W109-F173 HydrophobicContact CZ2-CD2 3.78Å; W109-F173 HydrophobicContact CZ2-CG 4.22Å; W109-F173 AromaticContact CZ3-CD2 3.82Å; W109-F173 HydrophobicContact CZ3-CD2 3.82Å; W109-F173 HydrophobicContact CZ3-CE2 4.43Å; L145-F173 HydrophobicContact CD2-CE2 3.74Å; L145-F173 HydrophobicContact CD2-CZ 3.54Å; M147-F173 HydrophobicContact CE-CD2 4.14Å; M147-F173 HydrophobicContact CE-CE2 3.85Å; M147-F173 HydrophobicContact SD-CE2 4.19Å; V157-F173 HydrophobicContact CG1-CE2 4.26Å; V157-F173 HydrophobicContact CG1-CZ 4.34Å; V157-F173 HydrophobicContact CG2-CE2 4.12Å; M159-F173 HydrophobicContact CE-CZ 4.44Å; M159-F173 HydrophobicContact SD-CZ 4.3Å; F169-F173 HydrophobicContact CB-CD1 4.09Å; F169-F173 AromaticContact CD1-CD1 3.58Å; F169-F173 HydrophobicContact CD1-CD1 3.58Å; F169-F173 AromaticContact CD1-CE1 3.41Å; F169-F173 HydrophobicContact CD1-CE1 3.41Å; F169-F173 VanDerWaalsContact CD1-CE1 3.41Å; F169-F173 HydrophobicContact CE1-CD1 4.36Å; F169-F173 AromaticContact CE1-CE1 3.73Å; F169-F173 HydrophobicContact CE1-CE1 3.73Å; F169-F173 HydrophobicContact CG-CD1 4.11Å; F169-F173 HydrophobicContact CG-CE1 4.21Å; P170-F173 HydrophobicContact CB-CB 4.29Å; P170-F173 WeakPolarHBondContact O-CB 3.47Å; P170-F173 PolarHBondContact O-N 3.34Å; L171-F173 VanDerWaalsContact C-N 3.25Å; L171-F173 PolarHBondContact O-N 3.14Å; F173-E175 VanDerWaalsContact C-N 3.33Å; F173-E175 PolarHBondContact O-N 3.44Å; F173-V176 WeakPolarHBondContact O-CG1 3.48Å; F173-L177 HydrophobicContact CD1-CD1 4.31Å; F173-L177 HydrophobicContact CE1-CD1 3.85Å; F173-L177 HydrophobicContact CE2-CD1 4.14Å; F173-L177 HydrophobicContact CZ-CD1 3.76Å; F173-L177 WeakPolarHBondContact O-CG 3.46Å; F173-L177 PolarHBondContact O-N 2.82Å; F173-L202 HydrophobicContact CD1-CD2 4.46Å; F173-L202 HydrophobicContact CE1-CD1 3.62Å; F173-L202 HydrophobicContact CE1-CD2 4.17Å; F173-L202 HydrophobicContact CZ-CD1 4.21Å
174	V	96	Very high	90.4	Very high	26 Å²	26	60.6 Å²	60.6	16%	0.158	33%	0.334	C	S	.	.	H	α-helix	trans	-65.7	-40	178.3	-178.8	0	0	0	0	111.1	F169 P170 L171 R178 L202	F169-V174 HydrophobicContact CB-CG2 3.63Å; P170-V174 PolarHBondContact O-N 3.3Å; L171-V174 PolarHBondContact O-N 2.9Å; L171-V174 VanDerWaalsContact O-N 3.1Å; V174-R178 PolarHBondContact O-N 3.27Å; V174-L202 HydrophobicContact CG2-CD2 3.88Å
175	E	96.5	Very high	91.7	Very high	124 Å²	124	56.7 Å²	56.7	58%	0.579	29%	0.293	S	S	*	.	H	α-helix	trans	-65.2	-47.9	-179.6	-74.7	174.9	163.6	0	0	111.7	L171 F173 L177 R178 D179	L171-E175 WeakPolarHBondContact O-CB 3.45Å; L171-E175 VanDerWaalsContact O-CG 3.29Å; L171-E175 WeakPolarHBondContact O-CG 3.36Å; L171-E175 PolarHBondContact O-N 3.02Å; F173-E175 VanDerWaalsContact C-N 3.33Å; F173-E175 PolarHBondContact O-N 3.44Å; E175-L177 VanDerWaalsContact C-N 3.29Å; E175-L177 PolarHBondContact O-N 2.93Å; E175-R178 CarbonylContact O-C 3.58Å; E175-R178 PolarHBondContact O-N 3.48Å; E175-D179 WeakPolarHBondContact O-CB 3.19Å; E175-D179 PolarHBondContact O-N 3.4Å
176	V	97.4	Very high	93.2	Very high	6 Å²	6	53.6 Å²	53.6	4%	0.036	26%	0.262	C	S	.	.	H	α-helix	trans	-62.7	-36	-178.3	72.8	0	0	0	0	112.6	W109 W113 L120 L126 S172 F173 R178 D179 K184	W109-V176 HydrophobicContact CZ2-CG1 4.47Å; W113-V176 HydrophobicContact CH2-CB 3.56Å; W113-V176 HydrophobicContact CH2-CG1 4.1Å; W113-V176 HydrophobicContact CH2-CG2 3.71Å; W113-V176 HydrophobicContact CZ3-CB 3.86Å; W113-V176 HydrophobicContact CZ3-CG1 3.88Å; W113-V176 HydrophobicContact CZ3-CG2 3.97Å; L120-V176 HydrophobicContact CD1-CG2 3.67Å; L126-V176 HydrophobicContact CD1-CG2 3.87Å; S172-V176 WeakPolarHBondContact O-CG1 3.37Å; S172-V176 PolarHBondContact O-N 2.71Å; F173-V176 WeakPolarHBondContact O-CG1 3.48Å; V176-R178 VanDerWaalsContact C-N 3.3Å; V176-R178 PolarHBondContact O-N 2.87Å; V176-D179 PolarHBondContact O-N 3.23Å; V176-K184 WeakPolarHBondContact O-CE 3.37Å; V176-K184 PolarHBondContact O-NZ 2.66Å
177	L	97.3	Very high	94.4	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-66.5	-32	176.1	-63.9	177	0	0	0	112.3	L145 M147 F173 E175 K184 L202 L204 A205	L145-L177 HydrophobicContact CD2-CD1 4.44Å; L145-L177 HydrophobicContact CD2-CD2 4.38Å; M147-L177 HydrophobicContact SD-CD2 4.04Å; F173-L177 HydrophobicContact CD1-CD1 4.31Å; F173-L177 HydrophobicContact CE1-CD1 3.85Å; F173-L177 HydrophobicContact CE2-CD1 4.14Å; F173-L177 HydrophobicContact CZ-CD1 3.76Å; F173-L177 WeakPolarHBondContact O-CG 3.46Å; F173-L177 PolarHBondContact O-N 2.82Å; E175-L177 VanDerWaalsContact C-N 3.29Å; E175-L177 PolarHBondContact O-N 2.93Å; L177-K184 VanDerWaalsContact O-CE 3.26Å; L177-K184 WeakPolarHBondContact O-CE 3.38Å; L177-K184 PolarHBondContact O-NZ 3.38Å; L177-L202 HydrophobicContact CD1-CB 4.42Å; L177-L202 HydrophobicContact CD1-CD1 4.24Å; L177-L204 HydrophobicContact CB-CD1 3.98Å; L177-L204 HydrophobicContact CD2-CD1 3.73Å; L177-L204 HydrophobicContact CG-CD1 4.4Å; L177-A205 PolarHBondContact O-N 2.97Å
178	R	96.4	Very high	95.1	Very high	116 Å²	116	44.4 Å²	44.4	44%	0.438	22%	0.224	S	C	.	.	H	α-helix	trans	-91.9	-14	179.4	-70.5	179.5	172	160.2	1.2	114.1	V174 E175 V176 P180 G201 S203	V174-R178 PolarHBondContact O-N 3.27Å; E175-R178 CarbonylContact O-C 3.58Å; E175-R178 PolarHBondContact O-N 3.48Å; V176-R178 VanDerWaalsContact C-N 3.3Å; V176-R178 PolarHBondContact O-N 2.87Å; R178-P180 WeakPolarHBondContact O-CD 3.44Å; R178-G201 PolarHBondContact NH2-O 3.23Å; R178-S203 WeakPolarHBondContact CG-O 3.49Å; R178-S203 VanDerWaalsContact NE-CB 3.33Å; R178-S203 PolarHBondContact NE-OG 2.85Å; R178-S203 PolarHBondContact NH2-OG 3.01Å
179	D	95.5	Very high	95.5	Very high	55 Å²	55	36.6 Å²	36.6	29%	0.294	19%	0.188	S	C	.	.			trans	-61.6	116.8	-171.4	-171.6	-12	0	0	0	111.2	E175 V176 H181 V182 K184 T206	E175-D179 WeakPolarHBondContact O-CB 3.19Å; E175-D179 PolarHBondContact O-N 3.4Å; V176-D179 PolarHBondContact O-N 3.23Å; D179-H181 PolarHBondContact O-N 2.91Å; D179-H181 VanDerWaalsContact O-N 3.15Å; D179-H181 WeakPolarHBondContact OD1-CB 3.24Å; D179-H181 IonicContact OD1-CG 2.71Å; D179-H181 PolarHBondContact OD1-N 3.47Å; D179-H181 IonicContact OD1-ND1 2.71Å; D179-H181 PolarHBondContact OD1-ND1 2.9Å; D179-V182 HydrophobicContact CB-CB 4.46Å; D179-V182 HydrophobicContact CB-CG2 4.23Å; D179-V182 PolarHBondContact O-N 3.07Å; D179-K184 PolarHBondContact O-NZ 3.37Å; D179-T206 PolarHBondContact O-OG1 3.06Å; D179-T206 VanDerWaalsContact O-OG1 3.11Å
180	P	93.5	Very high	95.7	Very high	76 Å²	76	37.9 Å²	37.9	49%	0.494	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	0.2	178.1	32.8	-37.6	0	0	0	113.6	R178 T206 Y295	R178-P180 WeakPolarHBondContact O-CD 3.44Å; P180-T206 HydrophobicContact CB-CG2 4.32Å; P180-Y295 VanDerWaalsContact O-CZ 3.29Å; P180-Y295 PolarHBondContact O-OH 3.33Å
181	H	94.5	Very high	95.6	Very high	114 Å²	114	40.8 Å²	40.8	53%	0.528	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	4.9	176.7	-56.3	97.4	0	0	0	114	P124 D179 Y295	P124-H181 VanDerWaalsContact CB-O 3.32Å; P124-H181 WeakPolarHBondContact CB-O 3.26Å; D179-H181 PolarHBondContact O-N 2.91Å; D179-H181 VanDerWaalsContact O-N 3.15Å; D179-H181 WeakPolarHBondContact OD1-CB 3.24Å; D179-H181 IonicContact OD1-CG 2.71Å; D179-H181 PolarHBondContact OD1-N 3.47Å; D179-H181 IonicContact OD1-ND1 2.71Å; D179-H181 PolarHBondContact OD1-ND1 2.9Å; H181-Y295 VanDerWaalsContact C-CE2 3.4Å; H181-Y295 VanDerWaalsContact CA-CZ 3.43Å; H181-Y295 HydrophobicContact CB-CD1 4.47Å; H181-Y295 HydrophobicContact CB-CE1 4.26Å; H181-Y295 AromaticContact CD2-CD1 3.89Å; H181-Y295 AromaticContact CD2-CE1 3.73Å; H181-Y295 WeakPolarHBondContact O-CD2 3.37Å; H181-Y295 WeakPolarHBondContact O-CE2 3.41Å
182	V	96.2	Very high	95.6	Very high	7 Å²	7	35 Å²	35	4%	0.042	18%	0.177	C	C	.	.	S	Bend	trans	-119.9	122.3	173.5	178.4	0	0	0	0	108.5	L120 P124 L126 D179 K184 T206	L120-V182 HydrophobicContact CD2-CG1 3.99Å; P124-V182 WeakPolarHBondContact O-CA 3.32Å; L126-V182 HydrophobicContact CB-CG1 4.43Å; L126-V182 HydrophobicContact CD1-CG1 3.89Å; L126-V182 HydrophobicContact CG-CG1 3.87Å; D179-V182 HydrophobicContact CB-CB 4.46Å; D179-V182 HydrophobicContact CB-CG2 4.23Å; D179-V182 PolarHBondContact O-N 3.07Å; V182-K184 HydrophobicContact CG1-CD 4.37Å; V182-K184 WeakPolarHBondContact O-CD 3.39Å; V182-K184 PolarHBondContact O-NZ 3.3Å; V182-T206 WeakPolarHBondContact O-CB 3.19Å; V182-T206 PolarHBondContact O-OG1 2.98Å
183	L	97.3	Very high	95.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	138.9	176.1	-64.4	176.9	0	0	0	110.9	P124 V125 L126 V185 V208 F275 Y295 L298 V299	P124-L183 PolarHBondContact O-N 3.41Å; V125-L183 CarbonylContact C-O 3.31Å; V125-L183 WeakPolarHBondContact CA-O 3.48Å; V125-L183 HydrophobicContact CG2-CB 4.24Å; V125-L183 HydrophobicContact CG2-CD1 4.46Å; L126-L183 PolarHBondContact N-O 2.87Å; L183-V185 HydrophobicContact CB-CG1 4.38Å; L183-V208 HydrophobicContact CD2-CG2 4.02Å; L183-F275 HydrophobicContact CD1-CE2 4.43Å; L183-F275 HydrophobicContact CD1-CZ 3.85Å; L183-Y295 HydrophobicContact CD2-CE2 4.38Å; L183-Y295 HydrophobicContact CG-CE2 4.12Å; L183-L298 HydrophobicContact CD1-CB 4.05Å; L183-V299 HydrophobicContact CD2-CG2 4.41Å
184	K	98.3	Very high	95.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	99.7	-180	-76.2	72.3	159.8	-173	0	109.5	L126 L128 V176 L177 D179 V182 L204 A205 T206 T207 V208	L126-K184 CarbonylContact O-C 3.45Å; L126-K184 WeakPolarHBondContact O-CA 3.5Å; L128-K184 HydrophobicContact CD1-CB 3.37Å; L128-K184 HydrophobicContact CD1-CG 3.13Å; V176-K184 WeakPolarHBondContact O-CE 3.37Å; V176-K184 PolarHBondContact O-NZ 2.66Å; L177-K184 VanDerWaalsContact O-CE 3.26Å; L177-K184 WeakPolarHBondContact O-CE 3.38Å; L177-K184 PolarHBondContact O-NZ 3.38Å; D179-K184 PolarHBondContact O-NZ 3.37Å; V182-K184 HydrophobicContact CG1-CD 4.37Å; V182-K184 WeakPolarHBondContact O-CD 3.39Å; V182-K184 PolarHBondContact O-NZ 3.3Å; K184-L204 HydrophobicContact CG-CD1 3.96Å; K184-L204 HydrophobicContact CG-CG 4.46Å; K184-A205 VanDerWaalsContact CD-O 3.3Å; K184-A205 WeakPolarHBondContact CD-O 3.48Å; K184-T206 PolarHBondContact N-O 3.35Å; K184-T206 PolarHBondContact NZ-OG1 3.17Å; K184-T207 HydrophobicContact CB-CG2 4.04Å; K184-T207 CarbonylContact O-C 3.49Å; K184-T207 WeakPolarHBondContact O-CA 3.12Å; K184-V208 PolarHBondContact O-N 3.14Å
185	V	98.1	Very high	95.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	142.7	-169.1	-56.1	0	0	0	0	111.4	V125 L126 G127 L128 L183 V208 L210 V272 F275	V125-V185 HydrophobicContact CG1-CB 4.41Å; V125-V185 HydrophobicContact CG1-CG1 3.73Å; V125-V185 HydrophobicContact CG1-CG2 3.74Å; L126-V185 PolarHBondContact O-N 3.39Å; G127-V185 CarbonylContact C-O 3.54Å; G127-V185 WeakPolarHBondContact CA-O 3.38Å; L128-V185 PolarHBondContact N-O 3.39Å; L183-V185 HydrophobicContact CB-CG1 4.38Å; V185-V208 WeakPolarHBondContact CA-O 3.5Å; V185-V208 HydrophobicContact CG1-CB 4.21Å; V185-L210 HydrophobicContact CB-CD2 4.13Å; V185-V272 HydrophobicContact CG2-CG2 4.38Å; V185-F275 HydrophobicContact CB-CB 4.41Å; V185-F275 HydrophobicContact CB-CD2 4.21Å; V185-F275 HydrophobicContact CB-CG 4.44Å; V185-F275 HydrophobicContact CG1-CB 4.38Å; V185-F275 HydrophobicContact CG1-CD2 3.46Å; V185-F275 VanDerWaalsContact CG1-CD2 3.46Å; V185-F275 HydrophobicContact CG1-CE2 3.73Å; V185-F275 HydrophobicContact CG1-CG 3.89Å; V185-F275 HydrophobicContact CG1-CZ 4.38Å; V185-F275 HydrophobicContact CG2-CB 4.12Å; V185-F275 HydrophobicContact CG2-CG 4.42Å
186	G	97.4	Very high	95.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.7	176.2	177	0	0	0	0	0	112.2	V208 D209 L210	G186-V208 PolarHBondContact N-O 3.47Å; G186-D209 WeakPolarHBondContact O-CA 3.36Å; G186-L210 PolarHBondContact O-N 3.38Å
187	V	95.8	Very high	94.9	Very high	33 Å²	33	37 Å²	37	20%	0.2	19%	0.185	C	C	.	.	S	Bend	trans	-98	110.5	170.5	172.6	0	0	0	0	108	L210 R211 L228 L231	V187-L210 HydrophobicContact CG2-CB 4.08Å; V187-L210 HydrophobicContact CG2-CD1 4.37Å; V187-R211 HydrophobicContact CG1-CG 4.12Å; V187-R211 HydrophobicContact CG2-CG 4.26Å; V187-L228 HydrophobicContact CB-CB 4.12Å; V187-L228 HydrophobicContact CB-CD1 4.21Å; V187-L228 HydrophobicContact CG2-CB 4Å; V187-L228 HydrophobicContact CG2-CD1 3.62Å; V187-L228 HydrophobicContact CG2-CG 4.44Å; V187-L231 HydrophobicContact CG2-CD1 4.16Å
188	G	92.9	Very high	94.7	Very high	13 Å²	13	42.8 Å²	42.8	13%	0.134	21%	0.206	C	C	.	.	S	Bend	trans	86.8	2.3	-176.4	0	0	0	0	0	115.2	Y190 D191 D192 D209	G188-Y190 PolarHBondContact O-N 3.48Å; G188-D191 WeakPolarHBondContact O-CA 3.25Å; G188-D191 PolarHBondContact O-N 2.89Å; G188-D192 PolarHBondContact O-N 3.46Å; G188-D209 PolarHBondContact N-OD2 2.88Å
189	C	93.6	Very high	94.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-56.2	-26.5	-176.6	61.2	0	0	0	0	114.6	D192 G193	C189-D192 PolarHBondContact O-N 3.09Å; C189-G193 PolarHBondContact O-N 2.92Å
190	Y	92.8	Very high	94.2	Very high	65 Å²	65	37.3 Å²	37.3	26%	0.255	18%	0.184	S	C	.	.	H	α-helix	trans	-63.8	-39.7	172.1	-176.9	-98.6	0	0	0	112.4	G188 K194 T207 D307 P309	G188-Y190 PolarHBondContact O-N 3.48Å; Y190-K194 HydrophobicContact CE1-CD 4.41Å; Y190-K194 PolarHBondContact O-N 3.12Å; Y190-T207 WeakPolarHBondContact CD2-OG1 3.2Å; Y190-D307 HydrophobicContact CE2-CB 4.29Å; Y190-D307 VanDerWaalsContact CE2-O 3.31Å; Y190-D307 WeakPolarHBondContact CE2-O 3.15Å; Y190-P309 HydrophobicContact CD1-CB 3.61Å; Y190-P309 HydrophobicContact CD1-CG 4.42Å; Y190-P309 HydrophobicContact CE1-CB 3.57Å; Y190-P309 HydrophobicContact CE1-CG 3.94Å; Y190-P309 HydrophobicContact CG-CB 4.45Å
191	D	90.9	Very high	94.1	Very high	66 Å²	66	35.8 Å²	35.8	35%	0.353	18%	0.183	S	C	.	.	H	α-helix	trans	-75.1	-29.6	176.9	-74.1	-46.3	0	0	0	111.6	G188 K194 R195	G188-D191 WeakPolarHBondContact O-CA 3.25Å; G188-D191 PolarHBondContact O-N 2.89Å; D191-K194 WeakPolarHBondContact O-CB 3.3Å; D191-K194 PolarHBondContact O-N 3.35Å; D191-K194 IonicContact OD1-NZ 3.91Å; D191-K194 PolarHBondContact OD1-NZ 3.3Å; D191-R195 WeakPolarHBondContact O-CG 3.44Å; D191-R195 PolarHBondContact O-N 2.79Å
192	D	94.1	Very high	94	Very high	14 Å²	14	30.7 Å²	30.7	8%	0.075	16%	0.159	C	C	.	.	H	α-helix	trans	-67.7	-40.6	171.3	-57.3	-40.8	0	0	0	111.7	C130 G188 C189 K194 R195 L196	C130-D192 HydrophobicContact CB-CB 4.3Å; G188-D192 PolarHBondContact O-N 3.46Å; C189-D192 PolarHBondContact O-N 3.09Å; D192-K194 VanDerWaalsContact C-N 3.3Å; D192-K194 PolarHBondContact O-N 2.79Å; D192-R195 WeakPolarHBondContact O-CA 3.29Å; D192-R195 WeakPolarHBondContact O-CB 3.33Å; D192-R195 PolarHBondContact O-N 2.73Å; D192-R195 IonicContact OD1-NE 3.43Å; D192-L196 WeakPolarHBondContact O-CG 3.34Å; D192-L196 PolarHBondContact O-N 3.47Å
193	G	94.1	Very high	93.9	Very high	6 Å²	6	32.5 Å²	32.5	6%	0.062	17%	0.172	C	C	.	.	H	α-helix	trans	-54.2	-43.4	170	0	0	0	0	0	113.2	C189 R195 L196 T197 L204	C189-G193 PolarHBondContact O-N 2.92Å; G193-R195 VanDerWaalsContact C-N 3.28Å; G193-R195 PolarHBondContact O-N 3.47Å; G193-L196 PolarHBondContact O-N 3.44Å; G193-T197 PolarHBondContact O-N 2.78Å; G193-T197 PolarHBondContact O-OG1 3.04Å; G193-T197 VanDerWaalsContact O-OG1 3.11Å; G193-L204 VanDerWaalsContact CA-CD2 3.47Å
194	K	93.1	Very high	93.7	Very high	100 Å²	100	33.8 Å²	33.8	44%	0.435	18%	0.179	S	C	.	.	H	α-helix	trans	-63.4	-33.9	174.3	-68.1	179.6	-164.4	144.5	0	112.8	Y190 D191 D192 R198	Y190-K194 HydrophobicContact CE1-CD 4.41Å; Y190-K194 PolarHBondContact O-N 3.12Å; D191-K194 WeakPolarHBondContact O-CB 3.3Å; D191-K194 PolarHBondContact O-N 3.35Å; D191-K194 IonicContact OD1-NZ 3.91Å; D191-K194 PolarHBondContact OD1-NZ 3.3Å; D192-K194 VanDerWaalsContact C-N 3.3Å; D192-K194 PolarHBondContact O-N 2.79Å; K194-R198 WeakPolarHBondContact O-CB 3.38Å; K194-R198 PolarHBondContact O-N 3.46Å
195	R	93	Very high	93.4	Very high	48 Å²	48	35.1 Å²	35.1	18%	0.181	19%	0.19	C	C	.	.	H	α-helix	trans	-69.6	-48.2	177.8	-65.9	168.5	-167.7	-134.6	16.2	110.1	V142 D191 D192 G193 T197 R198 D199	V142-R195 HydrophobicContact CG2-CB 4Å; D191-R195 WeakPolarHBondContact O-CG 3.44Å; D191-R195 PolarHBondContact O-N 2.79Å; D192-R195 WeakPolarHBondContact O-CA 3.29Å; D192-R195 WeakPolarHBondContact O-CB 3.33Å; D192-R195 PolarHBondContact O-N 2.73Å; D192-R195 IonicContact OD1-NE 3.43Å; G193-R195 VanDerWaalsContact C-N 3.28Å; G193-R195 PolarHBondContact O-N 3.47Å; R195-T197 VanDerWaalsContact C-N 3.26Å; R195-T197 PolarHBondContact O-N 3.44Å; R195-R198 PolarHBondContact O-N 2.98Å; R195-D199 WeakPolarHBondContact O-CB 3.38Å; R195-D199 VanDerWaalsContact O-CG 3.29Å; R195-D199 PolarHBondContact O-N 3.45Å
196	L	94.2	Very high	93.2	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-55.5	-42.2	175.2	-67.4	170.4	0	0	0	111.6	V142 L145 M159 D192 G193 Y200 G201 L202	V142-L196 HydrophobicContact CB-CD2 4.42Å; V142-L196 HydrophobicContact CG1-CD2 4.28Å; V142-L196 HydrophobicContact CG2-CD2 4.37Å; L145-L196 HydrophobicContact CD1-CD1 3.81Å; L145-L196 HydrophobicContact CD1-CD2 4.28Å; L145-L196 HydrophobicContact CD2-CD1 4.46Å; M159-L196 HydrophobicContact CE-CD2 4.21Å; D192-L196 WeakPolarHBondContact O-CG 3.34Å; D192-L196 PolarHBondContact O-N 3.47Å; G193-L196 PolarHBondContact O-N 3.44Å; L196-Y200 WeakPolarHBondContact O-CA 3.34Å; L196-Y200 PolarHBondContact O-N 3.29Å; L196-G201 PolarHBondContact O-N 2.85Å; L196-L202 CarbonylContact C-O 3.5Å; L196-L202 HydrophobicContact CB-CB 4.27Å; L196-L202 PolarHBondContact O-N 2.88Å
197	T	94	Very high	93.2	Very high	62 Å²	62	35.9 Å²	35.9	38%	0.38	19%	0.194	S	C	.	.	H	α-helix	trans	-65.2	-41.3	175.6	-59.3	0	0	0	0	112.5	G193 R195 G201 L202	G193-T197 PolarHBondContact O-N 2.78Å; G193-T197 PolarHBondContact O-OG1 3.04Å; G193-T197 VanDerWaalsContact O-OG1 3.11Å; R195-T197 VanDerWaalsContact C-N 3.26Å; R195-T197 PolarHBondContact O-N 3.44Å; T197-G201 WeakPolarHBondContact O-CA 3.29Å; T197-G201 PolarHBondContact O-N 3.49Å; T197-L202 WeakPolarHBondContact CA-O 3.46Å; T197-L202 WeakPolarHBondContact CB-O 3.43Å; T197-L202 PolarHBondContact N-O 2.83Å; T197-L202 PolarHBondContact OG1-O 3.31Å
198	R	92.3	Very high	93.2	Very high	122 Å²	122	34.3 Å²	34.3	46%	0.46	19%	0.185	S	C	.	.	H	α-helix	trans	-70.4	-43.3	-179.7	179.5	-158.8	64.9	-166.2	-6.5	112.1	K194 R195	K194-R198 WeakPolarHBondContact O-CB 3.38Å; K194-R198 PolarHBondContact O-N 3.46Å; R195-R198 PolarHBondContact O-N 2.98Å
199	D	91.8	Very high	93.4	Very high	27 Å²	27	33.9 Å²	33.9	14%	0.144	18%	0.18	C	C	.	.	H	α-helix	trans	-82.9	-36.9	-171.2	-65	-19.8	0	0	0	111.4	E141 V142 R195	E141-D199 HydrophobicContact CB-CB 3.97Å; E141-D199 HydrophobicContact CG-CB 4.03Å; V142-D199 PolarHBondContact N-OD2 3.48Å; R195-D199 WeakPolarHBondContact O-CB 3.38Å; R195-D199 VanDerWaalsContact O-CG 3.29Å; R195-D199 PolarHBondContact O-N 3.45Å
200	Y	91.5	Very high	93.5	Very high	29 Å²	29	34.1 Å²	34.1	11%	0.114	18%	0.181	C	C	.	.	H	α-helix	trans	-129.5	0.3	-171.1	-63	-77.1	0	0	0	114.4	E141 V142 M159 R163 F169 L196 L202	E141-Y200 HydrophobicContact CB-CE2 4.41Å; V142-Y200 HydrophobicContact CB-CE2 3.99Å; V142-Y200 WeakPolarHBondContact O-CE2 3.18Å; V142-Y200 PolarHBondContact O-OH 2.99Å; M159-Y200 HydrophobicContact CB-CE1 4.47Å; M159-Y200 HydrophobicContact CB-CE2 4Å; M159-Y200 HydrophobicContact CE-CD1 4.44Å; M159-Y200 HydrophobicContact CE-CD2 3.78Å; M159-Y200 HydrophobicContact CE-CE2 3.98Å; M159-Y200 HydrophobicContact CE-CG 4.04Å; M159-Y200 PolarHBondContact O-OH 3.23Å; R163-Y200 HydrophobicContact CB-CE1 4.45Å; F169-Y200 HydrophobicContact CE2-CD1 4.12Å; F169-Y200 HydrophobicContact CE2-CG 4.37Å; F169-Y200 AromaticContact CZ-CD1 3.66Å; F169-Y200 HydrophobicContact CZ-CD1 3.66Å; F169-Y200 HydrophobicContact CZ-CE1 4.46Å; F169-Y200 AromaticContact CZ-CG 3.93Å; F169-Y200 HydrophobicContact CZ-CG 3.93Å; L196-Y200 WeakPolarHBondContact O-CA 3.34Å; L196-Y200 PolarHBondContact O-N 3.29Å; Y200-L202 PolarHBondContact O-N 3.01Å
201	G	90.5	Very high	93.6	Very high	45 Å²	45	33.2 Å²	33.2	46%	0.464	18%	0.177	S	C	.	.			trans	70	6.2	-174.3	0	0	0	0	0	114.3	R178 L196 T197 S203	R178-G201 PolarHBondContact NH2-O 3.23Å; L196-G201 PolarHBondContact O-N 2.85Å; T197-G201 WeakPolarHBondContact O-CA 3.29Å; T197-G201 PolarHBondContact O-N 3.49Å; G201-S203 PolarHBondContact O-N 3.48Å
202	L	93.2	Very high	93.6	Very high	6 Å²	6	31.9 Å²	31.9	3%	0.031	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-76.5	116.9	-179.9	-65.7	171.5	0	0	0	110	M159 F169 F173 V174 L177 L196 T197 Y200	M159-L202 HydrophobicContact CE-CD1 3.72Å; F169-L202 HydrophobicContact CD1-CD1 4.41Å; F169-L202 HydrophobicContact CD2-CD2 3.92Å; F169-L202 HydrophobicContact CD2-CG 4.39Å; F169-L202 HydrophobicContact CE1-CD1 3.94Å; F169-L202 HydrophobicContact CE2-CD1 4.1Å; F169-L202 HydrophobicContact CE2-CD2 4.19Å; F169-L202 HydrophobicContact CE2-CG 4.15Å; F169-L202 HydrophobicContact CG-CD2 4.1Å; F169-L202 HydrophobicContact CZ-CD1 3.77Å; F169-L202 HydrophobicContact CZ-CG 4.33Å; F173-L202 HydrophobicContact CD1-CD2 4.46Å; F173-L202 HydrophobicContact CE1-CD1 3.62Å; F173-L202 HydrophobicContact CE1-CD2 4.17Å; F173-L202 HydrophobicContact CZ-CD1 4.21Å; V174-L202 HydrophobicContact CG2-CD2 3.88Å; L177-L202 HydrophobicContact CD1-CB 4.42Å; L177-L202 HydrophobicContact CD1-CD1 4.24Å; L196-L202 CarbonylContact C-O 3.5Å; L196-L202 HydrophobicContact CB-CB 4.27Å; L196-L202 PolarHBondContact O-N 2.88Å; T197-L202 WeakPolarHBondContact CA-O 3.46Å; T197-L202 WeakPolarHBondContact CB-O 3.43Å; T197-L202 PolarHBondContact N-O 2.83Å; T197-L202 PolarHBondContact OG1-O 3.31Å; Y200-L202 PolarHBondContact O-N 3.01Å
203	S	92.7	Very high	93.4	Very high	46 Å²	46	31.2 Å²	31.2	32%	0.322	17%	0.165	S	C	.	.	P	Polyproline II helix	trans	-87.3	125	177.8	-38.8	0	0	0	0	109.4	R178 G201	R178-S203 WeakPolarHBondContact CG-O 3.49Å; R178-S203 VanDerWaalsContact NE-CB 3.33Å; R178-S203 PolarHBondContact NE-OG 2.85Å; R178-S203 PolarHBondContact NH2-OG 3.01Å; G201-S203 PolarHBondContact O-N 3.48Å
204	L	93.7	Very high	93.1	Very high	27 Å²	27	31.1 Å²	31.1	14%	0.141	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-98.9	129.5	172.7	-163.5	67.2	0	0	0	108.8	L128 L177 K184 G193 T207	L128-L204 HydrophobicContact CD1-CD1 4.16Å; L128-L204 HydrophobicContact CD1-CD2 4.5Å; L177-L204 HydrophobicContact CB-CD1 3.98Å; L177-L204 HydrophobicContact CD2-CD1 3.73Å; L177-L204 HydrophobicContact CG-CD1 4.4Å; K184-L204 HydrophobicContact CG-CD1 3.96Å; K184-L204 HydrophobicContact CG-CG 4.46Å; G193-L204 VanDerWaalsContact CA-CD2 3.47Å; L204-T207 HydrophobicContact CD2-CG2 3.48Å; L204-T207 VanDerWaalsContact CD2-CG2 3.48Å; L204-T207 HydrophobicContact CG-CG2 3.73Å
205	A	92.1	Very high	92.8	Very high	27 Å²	27	31.5 Å²	31.5	22%	0.223	17%	0.17	C	C	.	.			trans	-118.8	168.6	174.2	0	0	0	0	0	110.6	L177 K184 T207	L177-A205 PolarHBondContact O-N 2.97Å; K184-A205 VanDerWaalsContact CD-O 3.3Å; K184-A205 WeakPolarHBondContact CD-O 3.48Å; A205-T207 VanDerWaalsContact C-N 3.28Å; A205-T207 PolarHBondContact O-N 2.95Å
206	T	93.9	Very high	92.3	Very high	13 Å²	13	34.5 Å²	34.5	8%	0.08	18%	0.181	C	C	.	.	S	Bend	trans	57.1	37.6	171.2	47.9	0	0	0	0	114.8	D179 P180 V182 K184 V306 D307	D179-T206 PolarHBondContact O-OG1 3.06Å; D179-T206 VanDerWaalsContact O-OG1 3.11Å; P180-T206 HydrophobicContact CB-CG2 4.32Å; V182-T206 WeakPolarHBondContact O-CB 3.19Å; V182-T206 PolarHBondContact O-OG1 2.98Å; K184-T206 PolarHBondContact N-O 3.35Å; K184-T206 PolarHBondContact NZ-OG1 3.17Å; T206-V306 HydrophobicContact CG2-CG1 4.18Å; T206-D307 PolarHBondContact N-OD1 3.1Å; T206-D307 VanDerWaalsContact N-OD1 3.08Å; T206-D307 PolarHBondContact N-OD2 3.2Å
207	T	97.1	Very high	91.3	Very high	4 Å²	4	38.7 Å²	38.7	3%	0.025	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	141.7	176.1	57.2	0	0	0	0	111.9	K184 Y190 L204 A205 V306 D307	K184-T207 HydrophobicContact CB-CG2 4.04Å; K184-T207 CarbonylContact O-C 3.49Å; K184-T207 WeakPolarHBondContact O-CA 3.12Å; Y190-T207 WeakPolarHBondContact CD2-OG1 3.2Å; L204-T207 HydrophobicContact CD2-CG2 3.48Å; L204-T207 VanDerWaalsContact CD2-CG2 3.48Å; L204-T207 HydrophobicContact CG-CG2 3.73Å; A205-T207 VanDerWaalsContact C-N 3.28Å; A205-T207 PolarHBondContact O-N 2.95Å; T207-V306 CarbonylContact O-C 3.59Å; T207-V306 VanDerWaalsContact O-CA 3.3Å; T207-V306 WeakPolarHBondContact O-CA 3.4Å; T207-D307 PolarHBondContact N-OD1 3.05Å; T207-D307 PolarHBondContact O-N 2.81Å; T207-D307 PolarHBondContact OG1-OD1 3.38Å
208	V	96.5	Very high	89.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	109.2	177.2	179.9	0	0	0	0	109	L183 K184 V185 G186 L210 L213 C302 V306	L183-V208 HydrophobicContact CD2-CG2 4.02Å; K184-V208 PolarHBondContact O-N 3.14Å; V185-V208 WeakPolarHBondContact CA-O 3.5Å; V185-V208 HydrophobicContact CG1-CB 4.21Å; G186-V208 PolarHBondContact N-O 3.47Å; V208-L210 PolarHBondContact O-N 3.17Å; V208-L213 HydrophobicContact CG1-CD1 3.62Å; V208-L213 HydrophobicContact CG1-CG 4.03Å; V208-C302 HydrophobicContact CG1-CB 4.48Å; V208-C302 HydrophobicContact CG2-CB 4.2Å; V208-V306 HydrophobicContact CG2-CG2 4.01Å
209	D	96.7	Very high	87.7	Confident	4 Å²	4	44.4 Å²	44.4	2%	0.021	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	119.8	177.9	-164.4	-62.6	0	0	0	110.7	G186 G188 R211 H212 F310	G186-D209 WeakPolarHBondContact O-CA 3.36Å; G188-D209 PolarHBondContact N-OD2 2.88Å; D209-R211 PolarHBondContact O-N 3.12Å; D209-R211 VanDerWaalsContact O-N 3.11Å; D209-R211 VanDerWaalsContact OD1-CB 3.22Å; D209-R211 WeakPolarHBondContact OD1-CB 3.48Å; D209-R211 VanDerWaalsContact OD1-CG 3.26Å; D209-R211 WeakPolarHBondContact OD1-CG 3.28Å; D209-R211 IonicContact OD1-CZ 2.78Å; D209-R211 PolarHBondContact OD1-N 2.98Å; D209-R211 IonicContact OD1-NE 2.86Å; D209-R211 PolarHBondContact OD1-NE 2.67Å; D209-R211 IonicContact OD1-NH2 2.8Å; D209-R211 IonicContact OD2-CZ 3.56Å; D209-R211 IonicContact OD2-NE 3.38Å; D209-R211 PolarHBondContact OD2-NE 3.42Å; D209-R211 IonicContact OD2-NH2 2.6Å; D209-R211 PolarHBondContact OD2-NH2 3.23Å; D209-H212 WeakPolarHBondContact O-CB 3.47Å; D209-H212 PolarHBondContact O-N 2.88Å; D209-F310 HydrophobicContact CB-CB 4.48Å
210	L	95.6	Very high	85.8	Confident	4 Å²	4	46.9 Å²	46.9	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-60.8	-25.2	-174.6	-66	173.7	0	0	0	113.1	V185 G186 V187 V208 H212 L213 A214 L228 S271 L274 F275	V185-L210 HydrophobicContact CB-CD2 4.13Å; G186-L210 PolarHBondContact O-N 3.38Å; V187-L210 HydrophobicContact CG2-CB 4.08Å; V187-L210 HydrophobicContact CG2-CD1 4.37Å; V208-L210 PolarHBondContact O-N 3.17Å; L210-H212 VanDerWaalsContact C-N 3.26Å; L210-H212 PolarHBondContact O-N 2.87Å; L210-L213 HydrophobicContact CD2-CD1 4.37Å; L210-L213 PolarHBondContact O-N 3.5Å; L210-A214 WeakPolarHBondContact O-CB 3.32Å; L210-A214 PolarHBondContact O-N 3.16Å; L210-L228 HydrophobicContact CD1-CD1 4.36Å; L210-S271 WeakPolarHBondContact CD1-O 3.35Å; L210-L274 HydrophobicContact CD1-CB 4Å; L210-L274 HydrophobicContact CD1-CD1 4.14Å; L210-F275 HydrophobicContact CD2-CB 3.83Å; L210-F275 HydrophobicContact CD2-CD2 4.12Å; L210-F275 HydrophobicContact CD2-CG 4.5Å
211	R	93.9	Very high	84.1	Confident	47 Å²	47	50.6 Å²	50.6	18%	0.177	27%	0.273	C	S	.	.	H	α-helix	trans	-64.8	-34	177.7	-59.6	176.5	-77	-169.2	-8.6	111.7	V187 D209 L215 L226 L231 F310	V187-R211 HydrophobicContact CG1-CG 4.12Å; V187-R211 HydrophobicContact CG2-CG 4.26Å; D209-R211 PolarHBondContact O-N 3.12Å; D209-R211 VanDerWaalsContact O-N 3.11Å; D209-R211 VanDerWaalsContact OD1-CB 3.22Å; D209-R211 WeakPolarHBondContact OD1-CB 3.48Å; D209-R211 VanDerWaalsContact OD1-CG 3.26Å; D209-R211 WeakPolarHBondContact OD1-CG 3.28Å; D209-R211 IonicContact OD1-CZ 2.78Å; D209-R211 PolarHBondContact OD1-N 2.98Å; D209-R211 IonicContact OD1-NE 2.86Å; D209-R211 PolarHBondContact OD1-NE 2.67Å; D209-R211 IonicContact OD1-NH2 2.8Å; D209-R211 IonicContact OD2-CZ 3.56Å; D209-R211 IonicContact OD2-NE 3.38Å; D209-R211 PolarHBondContact OD2-NE 3.42Å; D209-R211 IonicContact OD2-NH2 2.6Å; D209-R211 PolarHBondContact OD2-NH2 3.23Å; R211-L215 WeakPolarHBondContact O-CB 3.42Å; R211-L215 VanDerWaalsContact O-CG 3.29Å; R211-L215 WeakPolarHBondContact O-CG 3.21Å; R211-L215 PolarHBondContact O-N 2.92Å; R211-L226 HydrophobicContact CB-CB 4.35Å; R211-L226 VanDerWaalsContact CD-O 3.24Å; R211-L226 WeakPolarHBondContact CD-O 3.29Å; R211-L226 HydrophobicContact CG-CB 3.97Å; R211-L226 WeakPolarHBondContact CG-O 3.49Å; R211-L231 HydrophobicContact CG-CD1 4.37Å; R211-F310 HydrophobicContact CB-CD2 3.55Å; R211-F310 HydrophobicContact CB-CE1 4.3Å; R211-F310 HydrophobicContact CB-CE2 3.29Å; R211-F310 HydrophobicContact CB-CG 4.2Å; R211-F310 HydrophobicContact CB-CZ 3.7Å; R211-F310 HydrophobicContact CG-CE2 4.48Å
212	H	91.6	Very high	83	Confident	37 Å²	37	50.2 Å²	50.2	17%	0.171	26%	0.262	C	S	.	.	H	α-helix	trans	-67.7	-40.6	174.7	-76.3	-51.4	0	0	0	112.1	D209 L210 R216 L305 F310	D209-H212 WeakPolarHBondContact O-CB 3.47Å; D209-H212 PolarHBondContact O-N 2.88Å; L210-H212 VanDerWaalsContact C-N 3.26Å; L210-H212 PolarHBondContact O-N 2.87Å; H212-R216 WeakPolarHBondContact O-CB 3.38Å; H212-R216 PolarHBondContact O-N 3.13Å; H212-R216 VanDerWaalsContact O-N 3.08Å; H212-L305 HydrophobicContact CB-CB 4.41Å; H212-L305 HydrophobicContact CB-CD1 3.82Å; H212-L305 HydrophobicContact CB-CD2 3.73Å; H212-L305 HydrophobicContact CB-CG 4.18Å; H212-F310 AromaticContact CD2-CD2 3.72Å; H212-F310 AromaticContact CE1-CD2 3.31Å; H212-F310 WeakPolarHBondContact CE1-CD2 3.47Å; H212-F310 AromaticContact CE1-CE2 3.82Å; H212-F310 AromaticContact CG-CD2 3.72Å; H212-F310 AromaticContact ND1-CD2 3.47Å; H212-F310 WeakPolarHBondContact ND1-CD2 3.26Å; H212-F310 AromaticContact ND1-CE2 3.66Å; H212-F310 AromaticContact NE2-CD2 3.48Å; H212-F310 WeakPolarHBondContact NE2-CD2 2.99Å
213	L	89.4	Confident	81.9	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-68.7	-45	177.4	-71.4	174.3	0	0	0	111.1	V208 L210 L215 R216 E217 F275 V278 L279 L305	V208-L213 HydrophobicContact CG1-CD1 3.62Å; V208-L213 HydrophobicContact CG1-CG 4.03Å; L210-L213 HydrophobicContact CD2-CD1 4.37Å; L210-L213 PolarHBondContact O-N 3.5Å; L213-L215 VanDerWaalsContact C-N 3.32Å; L213-L215 PolarHBondContact O-N 3.14Å; L213-R216 PolarHBondContact O-N 3.16Å; L213-E217 PolarHBondContact O-N 3.11Å; L213-F275 HydrophobicContact CD1-CD2 3.53Å; L213-F275 HydrophobicContact CD1-CE2 3.64Å; L213-V278 HydrophobicContact CB-CG1 3.82Å; L213-L279 HydrophobicContact CD2-CD2 4.26Å; L213-L305 HydrophobicContact CD2-CD1 3.56Å; L213-L305 HydrophobicContact CG-CD1 4.03Å
214	A	88.8	Confident	81	Confident	4 Å²	4	56 Å²	56	3%	0.033	30%	0.295	C	S	.	.	H	α-helix	trans	-55.7	-46.9	175.3	0	0	0	0	0	111.1	L210 R216 S218 L231	L210-A214 WeakPolarHBondContact O-CB 3.32Å; L210-A214 PolarHBondContact O-N 3.16Å; A214-R216 VanDerWaalsContact C-N 3.32Å; A214-R216 PolarHBondContact O-N 3.2Å; A214-S218 WeakPolarHBondContact O-CB 3.47Å; A214-S218 PolarHBondContact O-N 3.07Å; A214-L231 HydrophobicContact CB-CD1 4.43Å; A214-L231 HydrophobicContact CB-CD2 3.78Å
215	L	86.4	Confident	80.5	Confident	109 Å²	109	56.4 Å²	56.4	57%	0.571	31%	0.307	S	S	*	.	H	α-helix	trans	-67.5	-27.4	176.9	-73.7	176.4	0	0	0	114.4	R211 L213 L226 F310	R211-L215 WeakPolarHBondContact O-CB 3.42Å; R211-L215 VanDerWaalsContact O-CG 3.29Å; R211-L215 WeakPolarHBondContact O-CG 3.21Å; R211-L215 PolarHBondContact O-N 2.92Å; L213-L215 VanDerWaalsContact C-N 3.32Å; L213-L215 PolarHBondContact O-N 3.14Å; L215-L226 HydrophobicContact CD1-CD1 3.82Å; L215-L226 HydrophobicContact CD2-CD1 4Å; L215-L226 HydrophobicContact CD2-CD2 4.19Å; L215-L226 HydrophobicContact CG-CD1 3.92Å; L215-L226 HydrophobicContact CG-CD2 4.26Å; L215-F310 HydrophobicContact CD1-CE2 3.95Å; L215-F310 HydrophobicContact CD1-CZ 3.9Å
216	R	83.3	Confident	80.4	Confident	111 Å²	111	57.4 Å²	57.4	42%	0.419	31%	0.308	S	S	.	.	H	α-helix	trans	-79.9	-46.6	-179.1	177.5	-178.8	-70.1	-172.1	-8.8	111.9	H212 L213 A214 R301 Q303 L305	H212-R216 WeakPolarHBondContact O-CB 3.38Å; H212-R216 PolarHBondContact O-N 3.13Å; H212-R216 VanDerWaalsContact O-N 3.08Å; L213-R216 PolarHBondContact O-N 3.16Å; A214-R216 VanDerWaalsContact C-N 3.32Å; A214-R216 PolarHBondContact O-N 3.2Å; R216-R301 PolarHBondContact NH1-O 3.42Å; R216-Q303 PolarHBondContact NH1-O 3.17Å; R216-Q303 PolarHBondContact NH2-O 2.88Å; R216-L305 VanDerWaalsContact CZ-CD1 3.4Å; R216-L305 VanDerWaalsContact CZ-CG 3.49Å
217	E	71.7	Confident	80.3	Confident	88 Å²	88	59.3 Å²	59.3	41%	0.411	32%	0.322	S	S	.	.	H	α-helix	trans	-96.9	-14.3	-169.6	-62.1	-59.2	147.1	0	0	112.9	L213 R219 V278	L213-E217 PolarHBondContact O-N 3.11Å; E217-R219 PolarHBondContact O-N 3.34Å; E217-V278 HydrophobicContact CB-CG1 3.77Å; E217-V278 HydrophobicContact CG-CG1 3.99Å
218	S	59.3	Low	80.1	Confident	53 Å²	53	59.9 Å²	59.9	37%	0.371	32%	0.324	S	S	.	.			trans	-66.2	96.7	179.3	169.6	0	0	0	0	111.5	A214 S220	A214-S218 WeakPolarHBondContact O-CB 3.47Å; A214-S218 PolarHBondContact O-N 3.07Å; S218-S220 PolarHBondContact OG-N 2.86Å; S218-S220 PolarHBondContact OG-O 3.38Å
219	R	51.8	Low	80	Confident	251 Å²	251	65 Å²	65	95%	0.947	35%	0.347	S	S	*	.			trans	-81.3	-1.7	148.2	-64.6	-177.1	175.4	-177.6	-0.7	111.6	E217	E217-R219 PolarHBondContact O-N 3.34Å
220	S	52.9	Low	79.8	Confident	79 Å²	79	65.3 Å²	65.3	55%	0.552	35%	0.349	S	S	*	.	S	Bend	trans	-119.4	118.5	-168.6	-50	0	0	0	0	110.3	S218 V222	S218-S220 PolarHBondContact OG-N 2.86Å; S218-S220 PolarHBondContact OG-O 3.38Å; S220-V222 PolarHBondContact O-N 3.43Å
221	S	54.4	Low	79.7	Confident	108 Å²	108	65.2 Å²	65.2	76%	0.755	35%	0.349	S	S	*	.			trans	-46	91.5	-172.6	-173.6	0	0	0	0	114.9	S223	S221-S223 PolarHBondContact O-N 3.42Å
222	V	68.8	Low	79.7	Confident	37 Å²	37	63 Å²	63	22%	0.224	34%	0.34	C	S	.	.			trans	-74.8	100.1	161.9	-177.9	0	0	0	0	106.5	S220 G225 L226 L231 L235	S220-V222 PolarHBondContact O-N 3.43Å; V222-G225 VanDerWaalsContact CG1-O 3.24Å; V222-G225 WeakPolarHBondContact CG1-O 3.45Å; V222-L226 HydrophobicContact CG1-CD2 4.18Å; V222-L231 HydrophobicContact CG1-CD2 3.92Å; V222-L231 HydrophobicContact CG2-CD2 4.34Å; V222-L235 HydrophobicContact CG2-CD2 4.36Å
223	S	69	Low	79.7	Confident	83 Å²	83	63 Å²	63	58%	0.58	35%	0.347	S	S	*	.			trans	-98.1	-25.1	-174.8	57.9	0	0	0	0	112.7	S221 D234	S221-S223 PolarHBondContact O-N 3.42Å; S223-D234 PolarHBondContact N-OD2 2.78Å
224	N	73.8	Confident	79.8	Confident	89 Å²	89	64.8 Å²	64.8	48%	0.476	36%	0.357	S	S	.	.	S	Bend	trans	-99.7	15.8	-165.8	-60.9	-29.4	0	0	0	113.2	S230 D234	N224-S230 WeakPolarHBondContact O-CB 3.4Å; N224-S230 PolarHBondContact O-OG 2.96Å; N224-D234 PolarHBondContact N-OD2 2.87Å; N224-D234 PolarHBondContact ND2-OD1 3.05Å
225	G	83.7	Confident	79.8	Confident	37 Å²	37	66.1 Å²	66.1	38%	0.381	36%	0.363	S	S	.	.			trans	94.7	-178.1	-179.6	0	0	0	0	0	114.5	V222 S230	V222-G225 VanDerWaalsContact CG1-O 3.24Å; V222-G225 WeakPolarHBondContact CG1-O 3.45Å; G225-S230 VanDerWaalsContact O-CB 3.27Å; G225-S230 WeakPolarHBondContact O-CB 3.01Å
226	L	89	Confident	80.1	Confident	48 Å²	48	62.1 Å²	62.1	25%	0.251	34%	0.342	S	S	.	.	S	Bend	trans	-108.1	18.8	-173.1	-62.1	175.6	0	0	0	113.1	R211 L215 V222 L231 F310	R211-L226 HydrophobicContact CB-CB 4.35Å; R211-L226 VanDerWaalsContact CD-O 3.24Å; R211-L226 WeakPolarHBondContact CD-O 3.29Å; R211-L226 HydrophobicContact CG-CB 3.97Å; R211-L226 WeakPolarHBondContact CG-O 3.49Å; L215-L226 HydrophobicContact CD1-CD1 3.82Å; L215-L226 HydrophobicContact CD2-CD1 4Å; L215-L226 HydrophobicContact CD2-CD2 4.19Å; L215-L226 HydrophobicContact CG-CD1 3.92Å; L215-L226 HydrophobicContact CG-CD2 4.26Å; V222-L226 HydrophobicContact CG1-CD2 4.18Å; L226-L231 HydrophobicContact CD2-CD2 4.22Å; L226-F310 HydrophobicContact CD1-CE1 4.42Å; L226-F310 HydrophobicContact CD1-CZ 3.75Å
227	S	91.7	Very high	80.5	Confident	53 Å²	53	63.7 Å²	63.7	37%	0.371	36%	0.359	S	S	.	.	S	Bend	trans	-71.6	158	172.9	84.4	0	0	0	0	110.5	K229 S230 L231	S227-K229 PolarHBondContact O-N 3.43Å; S227-K229 PolarHBondContact OG-N 2.97Å; S227-S230 PolarHBondContact O-N 3.24Å; S227-S230 WeakPolarHBondContact OG-CB 3.49Å; S227-S230 PolarHBondContact OG-N 3.14Å; S227-S230 PolarHBondContact OG-OG 3.26Å; S227-L231 WeakPolarHBondContact O-CB 3.32Å; S227-L231 WeakPolarHBondContact O-CG 3.14Å; S227-L231 PolarHBondContact O-N 2.8Å
228	L	94.1	Very high	81.5	Confident	15 Å²	15	61 Å²	61	8%	0.079	35%	0.348	C	S	.	.	H	α-helix	trans	-57.8	-39.5	175.5	-168.9	72.1	0	0	0	111.5	V187 L210 A232 L240 D267 I270 L274	V187-L228 HydrophobicContact CB-CB 4.12Å; V187-L228 HydrophobicContact CB-CD1 4.21Å; V187-L228 HydrophobicContact CG2-CB 4Å; V187-L228 HydrophobicContact CG2-CD1 3.62Å; V187-L228 HydrophobicContact CG2-CG 4.44Å; L210-L228 HydrophobicContact CD1-CD1 4.36Å; L228-A232 WeakPolarHBondContact O-CB 3.4Å; L228-A232 PolarHBondContact O-N 3.32Å; L228-L240 HydrophobicContact CD2-CD1 4.17Å; L228-L240 HydrophobicContact CG-CD1 4.09Å; L228-D267 HydrophobicContact CD2-CB 3.87Å; L228-D267 WeakPolarHBondContact CD2-OD1 3.34Å; L228-I270 HydrophobicContact CD1-CG2 4.1Å; L228-I270 HydrophobicContact CG-CG2 4.22Å; L228-L274 HydrophobicContact CD1-CD1 3.67Å
229	K	93.8	Very high	83	Confident	107 Å²	107	63.6 Å²	63.6	47%	0.465	36%	0.364	S	S	.	.	H	α-helix	trans	-60.8	-48.6	175.4	178.6	-176.2	178.6	-174.8	0	111.6	S227 A232 A233 L240 K242	S227-K229 PolarHBondContact O-N 3.43Å; S227-K229 PolarHBondContact OG-N 2.97Å; K229-A232 PolarHBondContact O-N 2.84Å; K229-A233 WeakPolarHBondContact O-CB 3.33Å; K229-A233 PolarHBondContact O-N 2.96Å; K229-L240 HydrophobicContact CB-CB 4.33Å; K229-L240 HydrophobicContact CG-CB 4.28Å; K229-K242 HydrophobicContact CB-CG 4.1Å; K229-K242 HydrophobicContact CD-CB 4.36Å; K229-K242 HydrophobicContact CD-CG 3.99Å; K229-K242 HydrophobicContact CG-CG 4.41Å
230	S	92.4	Very high	84.8	Confident	11 Å²	11	52.1 Å²	52.1	8%	0.077	32%	0.321	C	S	.	.	H	α-helix	trans	-63.7	-46.8	-179.9	-51.7	0	0	0	0	111.2	N224 G225 S227 A232 A233 D234	N224-S230 WeakPolarHBondContact O-CB 3.4Å; N224-S230 PolarHBondContact O-OG 2.96Å; G225-S230 VanDerWaalsContact O-CB 3.27Å; G225-S230 WeakPolarHBondContact O-CB 3.01Å; S227-S230 PolarHBondContact O-N 3.24Å; S227-S230 WeakPolarHBondContact OG-CB 3.49Å; S227-S230 PolarHBondContact OG-N 3.14Å; S227-S230 PolarHBondContact OG-OG 3.26Å; S230-A232 PolarHBondContact O-N 3.2Å; S230-A233 PolarHBondContact O-N 2.91Å; S230-D234 WeakPolarHBondContact O-CB 3.12Å; S230-D234 VanDerWaalsContact O-CG 3.26Å; S230-D234 PolarHBondContact O-N 3.33Å
231	L	93.1	Very high	86.3	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-64.7	-39.8	178.7	-67.9	174	0	0	0	111.9	V187 R211 A214 V222 L226 S227 D234 L235 L274	V187-L231 HydrophobicContact CG2-CD1 4.16Å; R211-L231 HydrophobicContact CG-CD1 4.37Å; A214-L231 HydrophobicContact CB-CD1 4.43Å; A214-L231 HydrophobicContact CB-CD2 3.78Å; V222-L231 HydrophobicContact CG1-CD2 3.92Å; V222-L231 HydrophobicContact CG2-CD2 4.34Å; L226-L231 HydrophobicContact CD2-CD2 4.22Å; S227-L231 WeakPolarHBondContact O-CB 3.32Å; S227-L231 WeakPolarHBondContact O-CG 3.14Å; S227-L231 PolarHBondContact O-N 2.8Å; L231-D234 PolarHBondContact O-N 3.11Å; L231-L235 HydrophobicContact CD2-CD1 4.21Å; L231-L235 VanDerWaalsContact O-CB 3.27Å; L231-L235 WeakPolarHBondContact O-CB 3.35Å; L231-L235 PolarHBondContact O-N 2.8Å; L231-L274 HydrophobicContact CB-CD1 3.87Å; L231-L274 HydrophobicContact CB-CD2 4.08Å; L231-L274 WeakPolarHBondContact O-CD2 3.21Å
232	A	94.3	Very high	87.7	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.7	-42.2	176.2	0	0	0	0	0	112.1	L228 K229 S230 L236 N237 V238 L240 I270	L228-A232 WeakPolarHBondContact O-CB 3.4Å; L228-A232 PolarHBondContact O-N 3.32Å; K229-A232 PolarHBondContact O-N 2.84Å; S230-A232 PolarHBondContact O-N 3.2Å; A232-L236 CarbonylContact O-C 3.43Å; A232-L236 WeakPolarHBondContact O-CA 3.48Å; A232-L236 WeakPolarHBondContact O-CB 3.31Å; A232-L236 PolarHBondContact O-N 3.05Å; A232-N237 PolarHBondContact O-N 3.14Å; A232-N237 VanDerWaalsContact O-N 3.09Å; A232-V238 CarbonylContact C-O 3.5Å; A232-V238 PolarHBondContact O-N 2.82Å; A232-V238 VanDerWaalsContact O-N 3.12Å; A232-L240 HydrophobicContact CB-CD1 3.96Å; A232-L240 HydrophobicContact CB-CG 4.12Å; A232-I270 HydrophobicContact CB-CG2 3.8Å
233	A	92.6	Very high	88.1	Confident	37 Å²	37	50.1 Å²	50.1	31%	0.306	29%	0.294	S	S	.	.	H	α-helix	trans	-64.3	-51.3	174.9	0	0	0	0	0	111.1	K229 S230 N237 V238	K229-A233 WeakPolarHBondContact O-CB 3.33Å; K229-A233 PolarHBondContact O-N 2.96Å; S230-A233 PolarHBondContact O-N 2.91Å; A233-N237 VanDerWaalsContact O-CA 3.29Å; A233-N237 WeakPolarHBondContact O-CA 3.47Å; A233-N237 PolarHBondContact O-N 3.5Å; A233-N237 VanDerWaalsContact O-N 3.14Å; A233-V238 PolarHBondContact N-O 3.06Å
234	D	90.3	Very high	88.4	Confident	39 Å²	39	49.3 Å²	49.3	21%	0.209	28%	0.283	C	S	.	.	H	α-helix	trans	-70.2	-36.9	-172.7	-69.9	3.5	0	0	0	112.9	S223 N224 S230 L231	S223-D234 PolarHBondContact N-OD2 2.78Å; N224-D234 PolarHBondContact N-OD2 2.87Å; N224-D234 PolarHBondContact ND2-OD1 3.05Å; S230-D234 WeakPolarHBondContact O-CB 3.12Å; S230-D234 VanDerWaalsContact O-CG 3.26Å; S230-D234 PolarHBondContact O-N 3.33Å; L231-D234 PolarHBondContact O-N 3.11Å
235	L	90.1	Very high	88.8	Confident	32 Å²	32	53.2 Å²	53.2	17%	0.168	30%	0.298	C	S	.	.	H	α-helix	trans	-106.8	-24.2	-169.9	-57.2	-179.8	0	0	0	114.2	V222 L231 L274 R277 V278	V222-L235 HydrophobicContact CG2-CD2 4.36Å; L231-L235 HydrophobicContact CD2-CD1 4.21Å; L231-L235 VanDerWaalsContact O-CB 3.27Å; L231-L235 WeakPolarHBondContact O-CB 3.35Å; L231-L235 PolarHBondContact O-N 2.8Å; L235-L274 HydrophobicContact CB-CD2 3.94Å; L235-L274 HydrophobicContact CD1-CD2 4.08Å; L235-R277 HydrophobicContact CB-CG 4.5Å; L235-R277 PolarHBondContact O-NE 2.79Å; L235-V278 HydrophobicContact CD1-CG2 3.79Å
236	L	91.5	Very high	88.8	Confident	25 Å²	25	52.4 Å²	52.4	13%	0.131	29%	0.285	C	S	.	.	H	α-helix	trans	-119.5	-7.3	-177.7	-55.9	175.4	0	0	0	113.3	A232 V238 I270 A273 L274 R277	A232-L236 CarbonylContact O-C 3.43Å; A232-L236 WeakPolarHBondContact O-CA 3.48Å; A232-L236 WeakPolarHBondContact O-CB 3.31Å; A232-L236 PolarHBondContact O-N 3.05Å; L236-V238 HydrophobicContact CB-CB 4.46Å; L236-V238 HydrophobicContact CB-CG2 4.11Å; L236-V238 PolarHBondContact O-N 3.37Å; L236-I270 HydrophobicContact CD1-CD1 3.93Å; L236-I270 HydrophobicContact CD1-CG2 4.28Å; L236-A273 HydrophobicContact CD1-CB 3.77Å; L236-L274 HydrophobicContact CD1-CD2 3.76Å; L236-L274 HydrophobicContact CD1-CG 3.74Å; L236-L274 HydrophobicContact CG-CD2 3.83Å; L236-L274 HydrophobicContact CG-CG 4.36Å; L236-R277 HydrophobicContact CD2-CB 3.73Å; L236-R277 HydrophobicContact CD2-CG 3.84Å
237	N	92.1	Very high	88.5	Confident	144 Å²	144	56.3 Å²	56.3	77%	0.77	30%	0.296	S	S	*	.			trans	54.3	33.5	-171.4	-61.2	-51.3	0	0	0	113.1	A232 A233	A232-N237 PolarHBondContact O-N 3.14Å; A232-N237 VanDerWaalsContact O-N 3.09Å; A233-N237 VanDerWaalsContact O-CA 3.29Å; A233-N237 WeakPolarHBondContact O-CA 3.47Å; A233-N237 PolarHBondContact O-N 3.5Å; A233-N237 VanDerWaalsContact O-N 3.14Å
238	V	92.9	Very high	88.1	Confident	30 Å²	30	57.6 Å²	57.6	18%	0.182	31%	0.305	C	S	.	.			trans	-111.2	117.2	178.7	178.8	0	0	0	0	110	L96 A232 A233 L236 I270	L96-V238 HydrophobicContact CD1-CG1 4.03Å; L96-V238 HydrophobicContact CD1-CG2 4.28Å; A232-V238 CarbonylContact C-O 3.5Å; A232-V238 PolarHBondContact O-N 2.82Å; A232-V238 VanDerWaalsContact O-N 3.12Å; A233-V238 PolarHBondContact N-O 3.06Å; L236-V238 HydrophobicContact CB-CB 4.46Å; L236-V238 HydrophobicContact CB-CG2 4.11Å; L236-V238 PolarHBondContact O-N 3.37Å; V238-I270 HydrophobicContact CB-CD1 4.17Å; V238-I270 HydrophobicContact CG1-CD1 4.01Å; V238-I270 HydrophobicContact CG2-CD1 4.46Å
239	P	90.9	Very high	87.9	Confident	109 Å²	109	58 Å²	58	71%	0.708	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-73.7	132	172.1	30	-32.5	0	0	0	110.2
240	L	90	Very high	87.8	Confident	10 Å²	10	57.2 Å²	57.2	5%	0.052	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-103.2	126	169.6	-70.8	-178.4	0	0	0	110.2	L228 K229 A232 K242 R266 I270	L228-L240 HydrophobicContact CD2-CD1 4.17Å; L228-L240 HydrophobicContact CG-CD1 4.09Å; K229-L240 HydrophobicContact CB-CB 4.33Å; K229-L240 HydrophobicContact CG-CB 4.28Å; A232-L240 HydrophobicContact CB-CD1 3.96Å; A232-L240 HydrophobicContact CB-CG 4.12Å; L240-K242 PolarHBondContact O-N 3.37Å; L240-R266 HydrophobicContact CD2-CB 4.31Å; L240-I270 HydrophobicContact CD1-CG1 4.41Å; L240-I270 HydrophobicContact CD1-CG2 4.24Å; L240-I270 HydrophobicContact CD2-CG1 4.11Å
241	D	83.1	Confident	88	Confident	87 Å²	87	56.7 Å²	56.7	47%	0.465	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-68.6	126.8	165.6	-175.7	13	0	0	0	108.3	S243 L246 Y263	D241-S243 VanDerWaalsContact OD1-CB 3.28Å; D241-S243 WeakPolarHBondContact OD1-CB 3.29Å; D241-S243 PolarHBondContact OD1-N 2.88Å; D241-S243 PolarHBondContact OD1-OG 3.5Å; D241-S243 PolarHBondContact OD2-OG 2.77Å; D241-L246 WeakPolarHBondContact OD2-CD1 3.38Å; D241-Y263 WeakPolarHBondContact O-CE2 3.42Å
242	K	83.8	Confident	88	Confident	62 Å²	62	58.5 Å²	58.5	27%	0.27	31%	0.314	S	S	.	.			trans	-127.4	31.2	176.6	-67.9	-61.8	-168	-180	0	110.2	K229 L240 Y263 D267	K229-K242 HydrophobicContact CB-CG 4.1Å; K229-K242 HydrophobicContact CD-CB 4.36Å; K229-K242 HydrophobicContact CD-CG 3.99Å; K229-K242 HydrophobicContact CG-CG 4.41Å; L240-K242 PolarHBondContact O-N 3.37Å; K242-Y263 HydrophobicContact CD-CE2 4.15Å; K242-Y263 WeakPolarHBondContact CD-OH 3.16Å; K242-D267 IonicContact NZ-OD1 3.97Å; K242-D267 PolarHBondContact NZ-OD1 2.83Å; K242-D267 IonicContact NZ-OD2 3.63Å; K242-D267 PolarHBondContact NZ-OD2 3.37Å
243	S	78.3	Confident	87.9	Confident	32 Å²	32	59.6 Å²	59.6	22%	0.224	32%	0.323	C	S	.	.			trans	-48.6	138.1	176.2	59.6	0	0	0	0	111.1	D241 E245 L246 R247	D241-S243 VanDerWaalsContact OD1-CB 3.28Å; D241-S243 WeakPolarHBondContact OD1-CB 3.29Å; D241-S243 PolarHBondContact OD1-N 2.88Å; D241-S243 PolarHBondContact OD1-OG 3.5Å; D241-S243 PolarHBondContact OD2-OG 2.77Å; S243-E245 PolarHBondContact O-N 2.62Å; S243-L246 PolarHBondContact O-N 3Å; S243-L246 WeakPolarHBondContact OG-CG 3.48Å; S243-L246 PolarHBondContact OG-N 2.76Å; S243-R247 WeakPolarHBondContact O-CB 3.47Å; S243-R247 PolarHBondContact O-N 3.3Å
244	L	76	Confident	87.7	Confident	66 Å²	66	64.7 Å²	64.7	35%	0.346	35%	0.346	S	S	.	.	H	α-helix	trans	-62.5	-30.3	175.7	-74.4	-179.3	0	0	0	111.3	C248 A320 P321	L244-C248 WeakPolarHBondContact O-CB 3.27Å; L244-C248 PolarHBondContact O-N 2.81Å; L244-A320 HydrophobicContact CD1-CB 4.23Å; L244-A320 HydrophobicContact CD2-CB 4.36Å; L244-A320 HydrophobicContact CG-CB 4.47Å; L244-P321 HydrophobicContact CD1-CG 4.11Å
245	E	80.3	Confident	87.8	Confident	172 Å²	172	70.7 Å²	70.7	80%	0.804	37%	0.373	S	S	*	.	H	α-helix	trans	-59.5	-50.2	177.3	-66.3	177.3	-175	0	0	111.6	S243 S249	S243-E245 PolarHBondContact O-N 2.62Å; E245-S249 WeakPolarHBondContact O-CA 3.42Å; E245-S249 VanDerWaalsContact O-CB 3.24Å; E245-S249 WeakPolarHBondContact O-CB 3.37Å; E245-S249 PolarHBondContact O-N 3.13Å
246	L	84.4	Confident	88	Confident	20 Å²	20	70.4 Å²	70.4	11%	0.105	37%	0.371	C	S	.	.	H	α-helix	trans	-72.2	-46.2	177.2	-69.2	174.2	0	0	0	111.9	D241 S243 C248 S249 W251 E259 Q260 Y263	D241-L246 WeakPolarHBondContact OD2-CD1 3.38Å; S243-L246 PolarHBondContact O-N 3Å; S243-L246 WeakPolarHBondContact OG-CG 3.48Å; S243-L246 PolarHBondContact OG-N 2.76Å; L246-C248 VanDerWaalsContact C-N 3.27Å; L246-C248 PolarHBondContact O-N 3.05Å; L246-S249 VanDerWaalsContact O-CB 3.25Å; L246-S249 WeakPolarHBondContact O-CB 3.21Å; L246-S249 PolarHBondContact O-N 2.66Å; L246-S249 VanDerWaalsContact O-N 3.1Å; L246-S249 PolarHBondContact O-OG 3.27Å; L246-W251 VanDerWaalsContact O-CZ2 3.32Å; L246-W251 WeakPolarHBondContact O-CZ2 3.49Å; L246-E259 HydrophobicContact CD2-CB 3.8Å; L246-Q260 HydrophobicContact CD2-CG 4.47Å; L246-Y263 HydrophobicContact CB-CD2 3.95Å; L246-Y263 HydrophobicContact CB-CE2 4.19Å; L246-Y263 HydrophobicContact CB-CG 4.31Å; L246-Y263 HydrophobicContact CD1-CD2 3.86Å; L246-Y263 HydrophobicContact CD1-CG 4.39Å
247	R	83.3	Confident	88.2	Confident	129 Å²	129	72.6 Å²	72.6	49%	0.487	39%	0.385	S	S	.	.	H	α-helix	trans	-61	-36.4	-177.6	-168.5	-178.8	71.2	152.5	-0.9	112.7	S243 W251	S243-R247 WeakPolarHBondContact O-CB 3.47Å; S243-R247 PolarHBondContact O-N 3.3Å; R247-W251 PolarHBondContact O-NE1 2.73Å
248	C	83	Confident	88.4	Confident	81 Å²	81	72.3 Å²	72.3	55%	0.547	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	14.5	179	-59.7	0	0	0	0	112.8	L244 L246	L244-C248 WeakPolarHBondContact O-CB 3.27Å; L244-C248 PolarHBondContact O-N 2.81Å; L246-C248 VanDerWaalsContact C-N 3.27Å; L246-C248 PolarHBondContact O-N 3.05Å
249	S	89.6	Confident	88.5	Confident	23 Å²	23	77.2 Å²	77.2	16%	0.161	40%	0.404	C	S	.	.	S	Bend	trans	-65.4	169.7	179.1	67.5	0	0	0	0	112.3	E245 L246 W251 Q260	E245-S249 WeakPolarHBondContact O-CA 3.42Å; E245-S249 VanDerWaalsContact O-CB 3.24Å; E245-S249 WeakPolarHBondContact O-CB 3.37Å; E245-S249 PolarHBondContact O-N 3.13Å; L246-S249 VanDerWaalsContact O-CB 3.25Å; L246-S249 WeakPolarHBondContact O-CB 3.21Å; L246-S249 PolarHBondContact O-N 2.66Å; L246-S249 VanDerWaalsContact O-N 3.1Å; L246-S249 PolarHBondContact O-OG 3.27Å; S249-W251 VanDerWaalsContact C-N 3.35Å; S249-W251 PolarHBondContact O-N 3.45Å; S249-Q260 PolarHBondContact OG-NE2 3.33Å
250	N	92.8	Very high	88.7	Confident	90 Å²	90	72.5 Å²	72.5	48%	0.481	37%	0.373	S	S	.	.			trans	-75.5	85.8	176.1	-173.7	12.3	0	0	0	111.2	E252 A253 Q260	N250-E252 PolarHBondContact O-N 3.41Å; N250-E252 PolarHBondContact OD1-N 3.09Å; N250-E252 VanDerWaalsContact OD1-N 3.16Å; N250-A253 HydrophobicContact CB-CB 4.37Å; N250-A253 VanDerWaalsContact O-CB 3.31Å; N250-A253 WeakPolarHBondContact O-CB 3.41Å; N250-A253 PolarHBondContact O-N 3.13Å; N250-A253 PolarHBondContact OD1-N 2.99Å; N250-Q260 PolarHBondContact O-NE2 3.05Å
251	W	95.1	Very high	89	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-11.4	174.6	-64.9	112.1	0	0	0	114.2	E131 V133 L144 R158 L246 R247 S249 L256 Q260 Y263 A264	E131-W251 HydrophobicContact CB-CB 4.28Å; E131-W251 HydrophobicContact CB-CD2 3.51Å; E131-W251 HydrophobicContact CB-CE3 3.95Å; E131-W251 HydrophobicContact CB-CG 3.66Å; E131-W251 HydrophobicContact CB-CZ2 4.3Å; E131-W251 HydrophobicContact CB-CZ3 4.49Å; E131-W251 HydrophobicContact CG-CD2 3.83Å; E131-W251 HydrophobicContact CG-CE3 4.03Å; E131-W251 HydrophobicContact CG-CG 4.45Å; E131-W251 HydrophobicContact CG-CH2 3.93Å; E131-W251 HydrophobicContact CG-CZ2 3.71Å; E131-W251 HydrophobicContact CG-CZ3 4.07Å; E131-W251 PolarHBondContact OE2-NE1 3Å; V133-W251 HydrophobicContact CG2-CB 4.13Å; L144-W251 HydrophobicContact CD2-CE3 4.24Å; L144-W251 HydrophobicContact CD2-CZ3 4.18Å; R158-W251 PolarHBondContact NH1-O 2.7Å; R158-W251 VanDerWaalsContact NH1-O 3.15Å; L246-W251 VanDerWaalsContact O-CZ2 3.32Å; L246-W251 WeakPolarHBondContact O-CZ2 3.49Å; R247-W251 PolarHBondContact O-NE1 2.73Å; S249-W251 VanDerWaalsContact C-N 3.35Å; S249-W251 PolarHBondContact O-N 3.45Å; W251-L256 HydrophobicContact CE3-CD2 4.22Å; W251-Q260 HydrophobicContact CE3-CB 4.36Å; W251-Q260 HydrophobicContact CH2-CB 3.99Å; W251-Q260 HydrophobicContact CH2-CG 4.23Å; W251-Q260 WeakPolarHBondContact CH2-O 3.28Å; W251-Q260 HydrophobicContact CZ3-CB 3.64Å; W251-Q260 HydrophobicContact CZ3-CG 4.08Å; W251-Q260 WeakPolarHBondContact CZ3-O 3.25Å; W251-Y263 AromaticContact CH2-CD1 3.71Å; W251-Y263 HydrophobicContact CH2-CD1 3.71Å; W251-Y263 HydrophobicContact CH2-CE1 4.4Å; W251-Y263 HydrophobicContact CH2-CG 4.48Å; W251-Y263 AromaticContact CZ2-CD1 3.83Å; W251-Y263 HydrophobicContact CZ2-CD1 3.83Å; W251-Y263 HydrophobicContact CZ2-CE1 4.07Å; W251-A264 HydrophobicContact CH2-CB 4.11Å; W251-A264 HydrophobicContact CZ3-CB 4.04Å
252	E	93.4	Very high	89.6	Confident	40 Å²	40	70.8 Å²	70.8	19%	0.187	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	1.5	175.1	-65.9	-171	153.3	0	0	112.6	V133 S143 L160 R163 N250	V133-E252 HydrophobicContact CB-CG 4.18Å; V133-E252 HydrophobicContact CG2-CB 3.95Å; V133-E252 HydrophobicContact CG2-CG 3.61Å; S143-E252 WeakPolarHBondContact OG-CG 3.35Å; L160-E252 HydrophobicContact CD1-CB 4.46Å; L160-E252 HydrophobicContact CD1-CG 4.14Å; L160-E252 HydrophobicContact CD2-CB 3.75Å; L160-E252 HydrophobicContact CD2-CG 3.77Å; L160-E252 HydrophobicContact CG-CG 4.29Å; R163-E252 IonicContact CZ-OE1 2.99Å; R163-E252 VanDerWaalsContact CZ-OE1 3.3Å; R163-E252 IonicContact NH1-OE1 3.86Å; R163-E252 PolarHBondContact NH1-OE1 3.06Å; R163-E252 IonicContact NH2-OE1 3.86Å; R163-E252 PolarHBondContact NH2-OE1 2.78Å; N250-E252 PolarHBondContact O-N 3.41Å; N250-E252 PolarHBondContact OD1-N 3.09Å; N250-E252 VanDerWaalsContact OD1-N 3.16Å
253	A	92.4	Very high	90.2	Very high	23 Å²	23	68.6 Å²	68.6	19%	0.19	36%	0.356	C	S	.	.			trans	-57.5	140.1	177.2	0	0	0	0	0	111.2	R158 N250 Q255	R158-A253 PolarHBondContact NH1-O 3.5Å; R158-A253 PolarHBondContact NH2-O 3.11Å; N250-A253 HydrophobicContact CB-CB 4.37Å; N250-A253 VanDerWaalsContact O-CB 3.31Å; N250-A253 WeakPolarHBondContact O-CB 3.41Å; N250-A253 PolarHBondContact O-N 3.13Å; N250-A253 PolarHBondContact OD1-N 2.99Å; A253-Q255 PolarHBondContact O-N 3.02Å
254	D	88.8	Confident	91	Very high	145 Å²	145	67.1 Å²	67.1	78%	0.775	35%	0.345	S	S	*	.	S	Bend	trans	-53.6	-38.2	-179.2	-67.1	-28.9	0	0	0	112.3
255	Q	91.6	Very high	92.1	Very high	165 Å²	165	64 Å²	64	77%	0.771	33%	0.329	S	S	*	.	S	Bend	trans	-123.6	124.8	173.4	-63.2	-61.7	-34	0	0	109.1	A253	A253-Q255 PolarHBondContact O-N 3.02Å
256	L	94.6	Very high	92.9	Very high	25 Å²	25	61 Å²	61	13%	0.131	31%	0.31	C	S	.	.			trans	-78.8	141.6	173.3	-63.9	179.8	0	0	0	109.8	L144 W251 Q260 T261	L144-L256 HydrophobicContact CD1-CD1 3.94Å; L144-L256 HydrophobicContact CD2-CD1 3.96Å; W251-L256 HydrophobicContact CE3-CD2 4.22Å; L256-Q260 HydrophobicContact CB-CB 4.28Å; L256-T261 HydrophobicContact CB-CG2 3.71Å; L256-T261 HydrophobicContact CD1-CG2 4.28Å
257	T	95.7	Very high	93.4	Very high	71 Å²	71	60.1 Å²	60.1	44%	0.436	31%	0.306	S	S	.	.			trans	-69.5	162.8	175.8	71.8	0	0	0	0	111.3	E259 Q260 T261	T257-E259 PolarHBondContact O-N 3.42Å; T257-E259 PolarHBondContact OG1-N 3.05Å; T257-Q260 PolarHBondContact O-N 3.17Å; T257-Q260 WeakPolarHBondContact OG1-CG 2.88Å; T257-Q260 PolarHBondContact OG1-N 3.03Å; T257-Q260 VanDerWaalsContact OG1-N 3.15Å; T257-T261 WeakPolarHBondContact O-CG2 3.03Å; T257-T261 PolarHBondContact O-N 3.07Å; T257-T261 PolarHBondContact O-OG1 3.46Å
258	L	95.7	Very high	94.1	Very high	138 Å²	138	54 Å²	54	72%	0.723	28%	0.283	S	S	*	.	H	α-helix	trans	-58.8	-35.5	173.6	-178.3	60.6	0	0	0	111.6	T261 T262	L258-T261 WeakPolarHBondContact CA-OG1 3.41Å; L258-T261 PolarHBondContact O-OG1 2.9Å; L258-T262 WeakPolarHBondContact O-CB 3.38Å; L258-T262 PolarHBondContact O-N 3.44Å; L258-T262 PolarHBondContact O-OG1 3.14Å
259	E	94.7	Very high	94.8	Very high	134 Å²	134	50.3 Å²	50.3	63%	0.626	26%	0.258	S	S	*	.	H	α-helix	trans	-68.2	-45.1	177.8	-63.3	-179.7	168.1	0	0	111.7	L246 T257 T262 Y263	L246-E259 HydrophobicContact CD2-CB 3.8Å; T257-E259 PolarHBondContact O-N 3.42Å; T257-E259 PolarHBondContact OG1-N 3.05Å; E259-T262 PolarHBondContact O-N 3.12Å; E259-Y263 WeakPolarHBondContact O-CB 3.48Å; E259-Y263 PolarHBondContact O-N 3.23Å
260	Q	95.8	Very high	95.2	Very high	10 Å²	10	49.2 Å²	49.2	5%	0.047	25%	0.25	C	C	.	.	H	α-helix	trans	-60.8	-47.9	176.1	-76.6	177.8	-51.3	0	0	111.9	L246 S249 N250 W251 L256 T257 Y263 A264	L246-Q260 HydrophobicContact CD2-CG 4.47Å; S249-Q260 PolarHBondContact OG-NE2 3.33Å; N250-Q260 PolarHBondContact O-NE2 3.05Å; W251-Q260 HydrophobicContact CE3-CB 4.36Å; W251-Q260 HydrophobicContact CH2-CB 3.99Å; W251-Q260 HydrophobicContact CH2-CG 4.23Å; W251-Q260 WeakPolarHBondContact CH2-O 3.28Å; W251-Q260 HydrophobicContact CZ3-CB 3.64Å; W251-Q260 HydrophobicContact CZ3-CG 4.08Å; W251-Q260 WeakPolarHBondContact CZ3-O 3.25Å; L256-Q260 HydrophobicContact CB-CB 4.28Å; T257-Q260 PolarHBondContact O-N 3.17Å; T257-Q260 WeakPolarHBondContact OG1-CG 2.88Å; T257-Q260 PolarHBondContact OG1-N 3.03Å; T257-Q260 VanDerWaalsContact OG1-N 3.15Å; Q260-Y263 PolarHBondContact O-N 3.05Å; Q260-A264 VanDerWaalsContact O-CB 3.3Å; Q260-A264 WeakPolarHBondContact O-CB 3.4Å; Q260-A264 PolarHBondContact O-N 3.12Å
261	T	96.9	Very high	95.5	Very high	18 Å²	18	45 Å²	45	11%	0.11	23%	0.228	C	C	.	.	H	α-helix	trans	-64.5	-41.2	178.9	50	0	0	0	0	111.8	L156 L256 T257 L258 A265	L156-T261 HydrophobicContact CD1-CG2 3.96Å; L256-T261 HydrophobicContact CB-CG2 3.71Å; L256-T261 HydrophobicContact CD1-CG2 4.28Å; T257-T261 WeakPolarHBondContact O-CG2 3.03Å; T257-T261 PolarHBondContact O-N 3.07Å; T257-T261 PolarHBondContact O-OG1 3.46Å; L258-T261 WeakPolarHBondContact CA-OG1 3.41Å; L258-T261 PolarHBondContact O-OG1 2.9Å; T261-A265 WeakPolarHBondContact O-CB 3.35Å; T261-A265 PolarHBondContact O-N 3.31Å
262	T	95.8	Very high	95.6	Very high	43 Å²	43	45 Å²	45	26%	0.264	23%	0.228	S	C	.	.	H	α-helix	trans	-66.1	-44.2	176.2	-59.8	0	0	0	0	111.6	L258 E259 R266	L258-T262 WeakPolarHBondContact O-CB 3.38Å; L258-T262 PolarHBondContact O-N 3.44Å; L258-T262 PolarHBondContact O-OG1 3.14Å; E259-T262 PolarHBondContact O-N 3.12Å; T262-R266 HydrophobicContact CG2-CG 4.36Å; T262-R266 WeakPolarHBondContact O-CB 3.29Å; T262-R266 WeakPolarHBondContact O-CG 3.41Å; T262-R266 PolarHBondContact O-N 3.41Å
263	Y	95.8	Very high	95.7	Very high	16 Å²	16	43.1 Å²	43.1	6%	0.063	22%	0.219	C	C	.	.	H	α-helix	trans	-56.9	-55.7	176.4	175.8	-85	0	0	0	111.1	E131 D241 K242 L246 W251 E259 Q260 A265 R266 D267	E131-Y263 WeakPolarHBondContact OE1-CE1 3.19Å; D241-Y263 WeakPolarHBondContact O-CE2 3.42Å; K242-Y263 HydrophobicContact CD-CE2 4.15Å; K242-Y263 WeakPolarHBondContact CD-OH 3.16Å; L246-Y263 HydrophobicContact CB-CD2 3.95Å; L246-Y263 HydrophobicContact CB-CE2 4.19Å; L246-Y263 HydrophobicContact CB-CG 4.31Å; L246-Y263 HydrophobicContact CD1-CD2 3.86Å; L246-Y263 HydrophobicContact CD1-CG 4.39Å; W251-Y263 AromaticContact CH2-CD1 3.71Å; W251-Y263 HydrophobicContact CH2-CD1 3.71Å; W251-Y263 HydrophobicContact CH2-CE1 4.4Å; W251-Y263 HydrophobicContact CH2-CG 4.48Å; W251-Y263 AromaticContact CZ2-CD1 3.83Å; W251-Y263 HydrophobicContact CZ2-CD1 3.83Å; W251-Y263 HydrophobicContact CZ2-CE1 4.07Å; E259-Y263 WeakPolarHBondContact O-CB 3.48Å; E259-Y263 PolarHBondContact O-N 3.23Å; Q260-Y263 PolarHBondContact O-N 3.05Å; Y263-A265 VanDerWaalsContact C-N 3.33Å; Y263-A265 PolarHBondContact O-N 3.5Å; Y263-R266 PolarHBondContact O-N 2.88Å; Y263-D267 PolarHBondContact O-N 3.1Å
264	A	96.1	Very high	95.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.1	-42.4	-177	0	0	0	0	0	111.7	L144 Q146 L156 W251 Q260	L144-A264 HydrophobicContact CD2-CB 3.73Å; Q146-A264 HydrophobicContact CG-CB 3.9Å; Q146-A264 WeakPolarHBondContact CG-O 3.46Å; L156-A264 HydrophobicContact CD2-CB 4.13Å; W251-A264 HydrophobicContact CH2-CB 4.11Å; W251-A264 HydrophobicContact CZ3-CB 4.04Å; Q260-A264 VanDerWaalsContact O-CB 3.3Å; Q260-A264 WeakPolarHBondContact O-CB 3.4Å; Q260-A264 PolarHBondContact O-N 3.12Å
265	A	97.5	Very high	96.2	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-65.6	-41.6	179.1	0	0	0	0	0	112.6	P100 C154 L156 T261 Y263 D267 A268 Q269	P100-A265 HydrophobicContact CB-CB 3.69Å; P100-A265 HydrophobicContact CG-CB 3.84Å; C154-A265 HydrophobicContact CB-CB 4.1Å; L156-A265 HydrophobicContact CD2-CB 4.35Å; T261-A265 WeakPolarHBondContact O-CB 3.35Å; T261-A265 PolarHBondContact O-N 3.31Å; Y263-A265 VanDerWaalsContact C-N 3.33Å; Y263-A265 PolarHBondContact O-N 3.5Å; A265-D267 VanDerWaalsContact C-N 3.32Å; A265-D267 PolarHBondContact O-N 2.72Å; A265-A268 PolarHBondContact O-N 2.91Å; A265-Q269 WeakPolarHBondContact O-CB 3.49Å; A265-Q269 VanDerWaalsContact O-CG 3.28Å; A265-Q269 WeakPolarHBondContact O-CG 3.2Å; A265-Q269 PolarHBondContact O-N 3.48Å
266	R	97.1	Very high	96.2	Very high	108 Å²	108	27.4 Å²	27.4	41%	0.408	14%	0.137	S	C	.	.	H	α-helix	trans	-61.6	-38.6	-178.5	-79.1	178.4	176.3	-178.5	2.1	112.3	L96 L240 T262 Y263 A268 Q269 I270	L96-R266 HydrophobicContact CD2-CG 4.25Å; L240-R266 HydrophobicContact CD2-CB 4.31Å; T262-R266 HydrophobicContact CG2-CG 4.36Å; T262-R266 WeakPolarHBondContact O-CB 3.29Å; T262-R266 WeakPolarHBondContact O-CG 3.41Å; T262-R266 PolarHBondContact O-N 3.41Å; Y263-R266 PolarHBondContact O-N 2.88Å; R266-A268 PolarHBondContact O-N 2.97Å; R266-Q269 PolarHBondContact O-N 3.28Å; R266-I270 WeakPolarHBondContact O-CB 3.09Å; R266-I270 WeakPolarHBondContact O-CG1 3.27Å; R266-I270 PolarHBondContact O-N 3.1Å
267	D	96.1	Very high	96.1	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.011	15%	0.152	C	C	.	.	H	α-helix	trans	-63.7	-41.1	-179.7	-77	-21.7	0	0	0	112.5	D129 L228 K242 Y263 A265 S271	D129-D267 HydrophobicContact CB-CB 4.4Å; D129-D267 VanDerWaalsContact OD2-CB 3.29Å; D129-D267 WeakPolarHBondContact OD2-CB 3.32Å; L228-D267 HydrophobicContact CD2-CB 3.87Å; L228-D267 WeakPolarHBondContact CD2-OD1 3.34Å; K242-D267 IonicContact NZ-OD1 3.97Å; K242-D267 PolarHBondContact NZ-OD1 2.83Å; K242-D267 IonicContact NZ-OD2 3.63Å; K242-D267 PolarHBondContact NZ-OD2 3.37Å; Y263-D267 PolarHBondContact O-N 3.1Å; A265-D267 VanDerWaalsContact C-N 3.32Å; A265-D267 PolarHBondContact O-N 2.72Å; D267-S271 WeakPolarHBondContact O-CB 3.05Å; D267-S271 PolarHBondContact O-N 2.73Å; D267-S271 VanDerWaalsContact O-N 3.16Å; D267-S271 PolarHBondContact O-OG 2.82Å
268	A	97.8	Very high	95.8	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-71.7	-44.1	174.6	0	0	0	0	0	112.2	Q146 A148 A265 R266 S271 V272	Q146-A268 HydrophobicContact CB-CB 3.79Å; A148-A268 VanDerWaalsContact CB-C 3.49Å; A148-A268 HydrophobicContact CB-CB 3.71Å; A265-A268 PolarHBondContact O-N 2.91Å; R266-A268 PolarHBondContact O-N 2.97Å; A268-S271 WeakPolarHBondContact O-CB 3.28Å; A268-S271 PolarHBondContact O-N 2.8Å; A268-V272 PolarHBondContact O-N 3.41Å
269	Q	98.1	Very high	95.4	Very high	4 Å²	4	23.2 Å²	23.2	2%	0.019	11%	0.105	C	C	.	.	H	α-helix	trans	-62.5	-45	178.7	-72.5	169	-26.6	0	0	112.1	M95 L96 V98 A148 G152 C154 A265 R266 S271 V272 A273	M95-Q269 PolarHBondContact O-NE2 3.1Å; L96-Q269 HydrophobicContact CD2-CB 3.82Å; V98-Q269 PolarHBondContact O-NE2 3.43Å; A148-Q269 HydrophobicContact CB-CG 4.08Å; G152-Q269 PolarHBondContact O-NE2 3.2Å; C154-Q269 HydrophobicContact CB-CG 3.97Å; A265-Q269 WeakPolarHBondContact O-CB 3.49Å; A265-Q269 VanDerWaalsContact O-CG 3.28Å; A265-Q269 WeakPolarHBondContact O-CG 3.2Å; A265-Q269 PolarHBondContact O-N 3.48Å; R266-Q269 PolarHBondContact O-N 3.28Å; Q269-S271 VanDerWaalsContact C-N 3.27Å; Q269-S271 PolarHBondContact O-N 3.26Å; Q269-V272 PolarHBondContact O-N 3.49Å; Q269-A273 PolarHBondContact O-N 2.86Å
270	I	97.8	Very high	95	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.3	-36.7	175.6	-73.9	-69.4	0	0	0	111	L96 L228 A232 L236 V238 L240 R266 V272 A273 L274	L96-I270 HydrophobicContact CD1-CD1 4.01Å; L96-I270 HydrophobicContact CD2-CD1 4.01Å; L96-I270 HydrophobicContact CD2-CG1 4.01Å; L228-I270 HydrophobicContact CD1-CG2 4.1Å; L228-I270 HydrophobicContact CG-CG2 4.22Å; A232-I270 HydrophobicContact CB-CG2 3.8Å; L236-I270 HydrophobicContact CD1-CD1 3.93Å; L236-I270 HydrophobicContact CD1-CG2 4.28Å; V238-I270 HydrophobicContact CB-CD1 4.17Å; V238-I270 HydrophobicContact CG1-CD1 4.01Å; V238-I270 HydrophobicContact CG2-CD1 4.46Å; L240-I270 HydrophobicContact CD1-CG1 4.41Å; L240-I270 HydrophobicContact CD1-CG2 4.24Å; L240-I270 HydrophobicContact CD2-CG1 4.11Å; R266-I270 WeakPolarHBondContact O-CB 3.09Å; R266-I270 WeakPolarHBondContact O-CG1 3.27Å; R266-I270 PolarHBondContact O-N 3.1Å; I270-V272 VanDerWaalsContact C-N 3.27Å; I270-V272 PolarHBondContact O-N 3.34Å; I270-A273 PolarHBondContact O-N 3.39Å; I270-L274 HydrophobicContact CG2-CD1 3.71Å; I270-L274 HydrophobicContact CG2-CG 3.98Å; I270-L274 VanDerWaalsContact O-CB 3.31Å; I270-L274 WeakPolarHBondContact O-CB 3.45Å; I270-L274 WeakPolarHBondContact O-CG 3.35Å; I270-L274 PolarHBondContact O-N 3.39Å
271	S	98	Very high	94.4	Very high	2 Å²	2	19.8 Å²	19.8	1%	0.014	11%	0.105	C	C	.	.	H	α-helix	trans	-59.2	-40.5	176.8	-67.2	0	0	0	0	111.9	L210 D267 A268 Q269 F275	L210-S271 WeakPolarHBondContact CD1-O 3.35Å; D267-S271 WeakPolarHBondContact O-CB 3.05Å; D267-S271 PolarHBondContact O-N 2.73Å; D267-S271 VanDerWaalsContact O-N 3.16Å; D267-S271 PolarHBondContact O-OG 2.82Å; A268-S271 WeakPolarHBondContact O-CB 3.28Å; A268-S271 PolarHBondContact O-N 2.8Å; Q269-S271 VanDerWaalsContact C-N 3.27Å; Q269-S271 PolarHBondContact O-N 3.26Å; S271-F275 WeakPolarHBondContact O-CB 3.36Å; S271-F275 PolarHBondContact O-N 3.21Å
272	V	97.6	Very high	93.2	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-69.8	-44.9	173.6	-173.7	0	0	0	0	111.5	M95 G127 A148 V185 A268 Q269 I270 L274 F275 L276	M95-V272 HydrophobicContact CE-CB 3.79Å; M95-V272 HydrophobicContact CE-CG1 3.76Å; G127-V272 VanDerWaalsContact CA-CG2 3.46Å; A148-V272 HydrophobicContact CB-CG2 4.17Å; A148-V272 WeakPolarHBondContact O-CG2 3.47Å; V185-V272 HydrophobicContact CG2-CG2 4.38Å; A268-V272 PolarHBondContact O-N 3.41Å; Q269-V272 PolarHBondContact O-N 3.49Å; I270-V272 VanDerWaalsContact C-N 3.27Å; I270-V272 PolarHBondContact O-N 3.34Å; V272-L274 VanDerWaalsContact C-N 3.31Å; V272-L274 PolarHBondContact O-N 3.38Å; V272-F275 WeakPolarHBondContact O-CB 3.42Å; V272-F275 PolarHBondContact O-N 2.97Å; V272-F275 VanDerWaalsContact O-N 3.17Å; V272-L276 HydrophobicContact CG1-CD1 3.98Å; V272-L276 HydrophobicContact CG1-CG 4.31Å; V272-L276 VanDerWaalsContact O-CG 3.3Å; V272-L276 WeakPolarHBondContact O-CG 2.93Å; V272-L276 PolarHBondContact O-N 3.28Å
273	A	96.3	Very high	91.3	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.008	12%	0.123	C	C	.	.	H	α-helix	trans	-60.1	-41.8	179.2	0	0	0	0	0	112	C92 M95 L236 Q269 I270 L276 R277	C92-A273 HydrophobicContact CB-CB 4.3Å; M95-A273 HydrophobicContact CE-CB 4.49Å; M95-A273 HydrophobicContact SD-CB 4.06Å; L236-A273 HydrophobicContact CD1-CB 3.77Å; Q269-A273 PolarHBondContact O-N 2.86Å; I270-A273 PolarHBondContact O-N 3.39Å; A273-L276 PolarHBondContact O-N 2.92Å; A273-R277 VanDerWaalsContact O-CB 3.28Å; A273-R277 WeakPolarHBondContact O-CB 3.28Å; A273-R277 PolarHBondContact O-N 3.11Å
274	L	95.4	Very high	89.3	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-62.9	-45.5	174.2	-78.8	173.6	0	0	0	111.5	L210 L228 L231 L235 L236 I270 V272 L276 R277 V278	L210-L274 HydrophobicContact CD1-CB 4Å; L210-L274 HydrophobicContact CD1-CD1 4.14Å; L228-L274 HydrophobicContact CD1-CD1 3.67Å; L231-L274 HydrophobicContact CB-CD1 3.87Å; L231-L274 HydrophobicContact CB-CD2 4.08Å; L231-L274 WeakPolarHBondContact O-CD2 3.21Å; L235-L274 HydrophobicContact CB-CD2 3.94Å; L235-L274 HydrophobicContact CD1-CD2 4.08Å; L236-L274 HydrophobicContact CD1-CD2 3.76Å; L236-L274 HydrophobicContact CD1-CG 3.74Å; L236-L274 HydrophobicContact CG-CD2 3.83Å; L236-L274 HydrophobicContact CG-CG 4.36Å; I270-L274 HydrophobicContact CG2-CD1 3.71Å; I270-L274 HydrophobicContact CG2-CG 3.98Å; I270-L274 VanDerWaalsContact O-CB 3.31Å; I270-L274 WeakPolarHBondContact O-CB 3.45Å; I270-L274 WeakPolarHBondContact O-CG 3.35Å; I270-L274 PolarHBondContact O-N 3.39Å; V272-L274 VanDerWaalsContact C-N 3.31Å; V272-L274 PolarHBondContact O-N 3.38Å; L274-L276 VanDerWaalsContact C-N 3.34Å; L274-L276 PolarHBondContact O-N 3.39Å; L274-R277 PolarHBondContact O-N 2.74Å; L274-V278 WeakPolarHBondContact O-CB 3.38Å; L274-V278 WeakPolarHBondContact O-CG2 3.43Å; L274-V278 PolarHBondContact O-N 2.97Å
275	F	95.4	Very high	86.8	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-55.7	-50.8	175.9	-178.2	-99.8	0	0	0	111.3	F123 V125 L183 V185 L210 L213 S271 V272 R277 V278 L279 L298	F123-F275 HydrophobicContact CE1-CE1 4.39Å; F123-F275 HydrophobicContact CZ-CE1 4.38Å; V125-F275 HydrophobicContact CG1-CD1 4.06Å; V125-F275 HydrophobicContact CG1-CE1 4.2Å; V125-F275 HydrophobicContact CG2-CD1 4.4Å; V125-F275 HydrophobicContact CG2-CE1 3.82Å; V125-F275 HydrophobicContact CG2-CZ 4.39Å; L183-F275 HydrophobicContact CD1-CE2 4.43Å; L183-F275 HydrophobicContact CD1-CZ 3.85Å; V185-F275 HydrophobicContact CB-CB 4.41Å; V185-F275 HydrophobicContact CB-CD2 4.21Å; V185-F275 HydrophobicContact CB-CG 4.44Å; V185-F275 HydrophobicContact CG1-CB 4.38Å; V185-F275 HydrophobicContact CG1-CD2 3.46Å; V185-F275 VanDerWaalsContact CG1-CD2 3.46Å; V185-F275 HydrophobicContact CG1-CE2 3.73Å; V185-F275 HydrophobicContact CG1-CG 3.89Å; V185-F275 HydrophobicContact CG1-CZ 4.38Å; V185-F275 HydrophobicContact CG2-CB 4.12Å; V185-F275 HydrophobicContact CG2-CG 4.42Å; L210-F275 HydrophobicContact CD2-CB 3.83Å; L210-F275 HydrophobicContact CD2-CD2 4.12Å; L210-F275 HydrophobicContact CD2-CG 4.5Å; L213-F275 HydrophobicContact CD1-CD2 3.53Å; L213-F275 HydrophobicContact CD1-CE2 3.64Å; S271-F275 WeakPolarHBondContact O-CB 3.36Å; S271-F275 PolarHBondContact O-N 3.21Å; V272-F275 WeakPolarHBondContact O-CB 3.42Å; V272-F275 PolarHBondContact O-N 2.97Å; V272-F275 VanDerWaalsContact O-N 3.17Å; F275-R277 PolarHBondContact O-N 3.18Å; F275-V278 PolarHBondContact O-N 3.19Å; F275-L279 HydrophobicContact CD1-CD1 4.17Å; F275-L279 HydrophobicContact CD2-CD1 4.39Å; F275-L279 HydrophobicContact CE1-CD1 3.55Å; F275-L279 HydrophobicContact CE2-CD1 3.83Å; F275-L279 HydrophobicContact CZ-CD1 3.37Å; F275-L279 HydrophobicContact CZ-CG 4.46Å; F275-L279 WeakPolarHBondContact O-CG 3.37Å; F275-L279 PolarHBondContact O-N 3.18Å; F275-L279 VanDerWaalsContact O-N 3.12Å; F275-L298 HydrophobicContact CE1-CD2 4.21Å
276	L	92.8	Very high	84.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.6	-43.3	179	-65.2	168.3	0	0	0	111.7	I89 M95 F123 V272 A273 L274 G280 L281 Q282	I89-L276 HydrophobicContact CD1-CD2 4.3Å; I89-L276 HydrophobicContact CG2-CD1 3.72Å; I89-L276 HydrophobicContact CG2-CD2 4.39Å; M95-L276 HydrophobicContact CE-CD1 4.49Å; M95-L276 HydrophobicContact SD-CD1 4.26Å; F123-L276 HydrophobicContact CE1-CD2 3.6Å; F123-L276 HydrophobicContact CE2-CD2 4.16Å; F123-L276 HydrophobicContact CZ-CD2 3.38Å; V272-L276 HydrophobicContact CG1-CD1 3.98Å; V272-L276 HydrophobicContact CG1-CG 4.31Å; V272-L276 VanDerWaalsContact O-CG 3.3Å; V272-L276 WeakPolarHBondContact O-CG 2.93Å; V272-L276 PolarHBondContact O-N 3.28Å; A273-L276 PolarHBondContact O-N 2.92Å; L274-L276 VanDerWaalsContact C-N 3.34Å; L274-L276 PolarHBondContact O-N 3.39Å; L276-G280 PolarHBondContact O-N 3.02Å; L276-L281 HydrophobicContact CB-CB 4.47Å; L276-L281 HydrophobicContact CD2-CB 4.22Å; L276-L281 HydrophobicContact CD2-CD1 4.09Å; L276-L281 WeakPolarHBondContact O-CB 3.28Å; L276-L281 PolarHBondContact O-N 3.34Å; L276-Q282 HydrophobicContact CB-CG 3.88Å
277	R	91.2	Very high	82	Confident	116 Å²	116	40 Å²	40	44%	0.438	24%	0.24	S	C	.	.	H	α-helix	trans	-64.4	-48	179.2	-178.8	62.6	172.3	169.5	0.7	112.4	L235 L236 A273 L274 F275 L279 G280	L235-R277 HydrophobicContact CB-CG 4.5Å; L235-R277 PolarHBondContact O-NE 2.79Å; L236-R277 HydrophobicContact CD2-CB 3.73Å; L236-R277 HydrophobicContact CD2-CG 3.84Å; A273-R277 VanDerWaalsContact O-CB 3.28Å; A273-R277 WeakPolarHBondContact O-CB 3.28Å; A273-R277 PolarHBondContact O-N 3.11Å; L274-R277 PolarHBondContact O-N 2.74Å; F275-R277 PolarHBondContact O-N 3.18Å; R277-L279 VanDerWaalsContact C-N 3.26Å; R277-L279 PolarHBondContact O-N 3.04Å; R277-G280 PolarHBondContact O-N 3.13Å
278	V	89.6	Confident	79.4	Confident	24 Å²	24	44.1 Å²	44.1	15%	0.145	28%	0.275	C	S	.	.	H	α-helix	trans	-64.8	-33	-178.4	173.1	0	0	0	0	111.4	L213 E217 L235 L274 F275 G280	L213-V278 HydrophobicContact CB-CG1 3.82Å; E217-V278 HydrophobicContact CB-CG1 3.77Å; E217-V278 HydrophobicContact CG-CG1 3.99Å; L235-V278 HydrophobicContact CD1-CG2 3.79Å; L274-V278 WeakPolarHBondContact O-CB 3.38Å; L274-V278 WeakPolarHBondContact O-CG2 3.43Å; L274-V278 PolarHBondContact O-N 2.97Å; F275-V278 PolarHBondContact O-N 3.19Å; V278-G280 VanDerWaalsContact C-N 3.26Å; V278-G280 PolarHBondContact O-N 3.32Å
279	L	88.4	Confident	76.8	Confident	6 Å²	6	46.5 Å²	46.5	3%	0.031	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	0.7	174.7	-62	-169.5	0	0	0	113.9	L213 F275 R277 L281 L298 R301	L213-L279 HydrophobicContact CD2-CD2 4.26Å; F275-L279 HydrophobicContact CD1-CD1 4.17Å; F275-L279 HydrophobicContact CD2-CD1 4.39Å; F275-L279 HydrophobicContact CE1-CD1 3.55Å; F275-L279 HydrophobicContact CE2-CD1 3.83Å; F275-L279 HydrophobicContact CZ-CD1 3.37Å; F275-L279 HydrophobicContact CZ-CG 4.46Å; F275-L279 WeakPolarHBondContact O-CG 3.37Å; F275-L279 PolarHBondContact O-N 3.18Å; F275-L279 VanDerWaalsContact O-N 3.12Å; R277-L279 VanDerWaalsContact C-N 3.26Å; R277-L279 PolarHBondContact O-N 3.04Å; L279-L281 VanDerWaalsContact C-N 3.29Å; L279-L281 HydrophobicContact CB-CD1 3.96Å; L279-L281 HydrophobicContact CB-CG 3.9Å; L279-L281 HydrophobicContact CD1-CD1 4.29Å; L279-L281 PolarHBondContact O-N 3.23Å; L279-L298 HydrophobicContact CD1-CD2 4.18Å; L279-R301 HydrophobicContact CD1-CB 4.38Å; L279-R301 HydrophobicContact CD2-CB 3.91Å; L279-R301 PolarHBondContact O-NH1 3.04Å
280	G	85.9	Confident	74.2	Confident	56 Å²	56	51.5 Å²	51.5	58%	0.577	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	70	24.5	-179.4	0	0	0	0	0	113.9	L276 R277 V278	L276-G280 PolarHBondContact O-N 3.02Å; R277-G280 PolarHBondContact O-N 3.13Å; V278-G280 VanDerWaalsContact C-N 3.26Å; V278-G280 PolarHBondContact O-N 3.32Å
281	L	82.9	Confident	71.6	Confident	17 Å²	17	55.5 Å²	55.5	9%	0.089	35%	0.35	C	S	.	.			trans	-90.2	-3.9	-177.9	-57.8	175.6	0	0	0	113	I89 F123 L276 L279 L289 L298	I89-L281 HydrophobicContact CD1-CB 4.01Å; I89-L281 WeakPolarHBondContact CD1-O 3.36Å; F123-L281 HydrophobicContact CE2-CD1 4.32Å; F123-L281 HydrophobicContact CZ-CD1 4.05Å; L276-L281 HydrophobicContact CB-CB 4.47Å; L276-L281 HydrophobicContact CD2-CB 4.22Å; L276-L281 HydrophobicContact CD2-CD1 4.09Å; L276-L281 WeakPolarHBondContact O-CB 3.28Å; L276-L281 PolarHBondContact O-N 3.34Å; L279-L281 VanDerWaalsContact C-N 3.29Å; L279-L281 HydrophobicContact CB-CD1 3.96Å; L279-L281 HydrophobicContact CB-CG 3.9Å; L279-L281 HydrophobicContact CD1-CD1 4.29Å; L279-L281 PolarHBondContact O-N 3.23Å; L281-L289 HydrophobicContact CD2-CD2 4.29Å; L281-L298 HydrophobicContact CD1-CD2 3.95Å
282	Q	70.8	Confident	69.2	Low	29 Å²	29	57.2 Å²	57.2	14%	0.136	37%	0.369	C	S	.	.			trans	-109.9	112.3	171.2	-69.5	-169.6	-9.9	0	0	110.7	I89 P90 L276	I89-Q282 HydrophobicContact CG2-CG 4.03Å; P90-Q282 PolarHBondContact O-NE2 3.01Å; L276-Q282 HydrophobicContact CB-CG 3.88Å
283	T	56.5	Low	67.2	Low	101 Å²	101	57.6 Å²	57.6	62%	0.62	37%	0.371	S	S	*	.			trans	-110.4	133.2	168	31.2	0	0	0	0	110.5	T285	T283-T285 PolarHBondContact O-N 3.34Å
284	E	53.1	Low	66	Low	188 Å²	188	60.8 Å²	60.8	88%	0.879	39%	0.394	S	S	*	.	S	Bend	trans	-73.2	-6.9	178	-63.5	-143.7	158.1	0	0	113.7
285	T	44.3	Very low	65.3	Low	123 Å²	123	63.4 Å²	63.4	76%	0.755	40%	0.403	S	S	*	.	S	Bend	trans	-127.8	95.4	-179.5	50.2	0	0	0	0	111.1	T283	T283-T285 PolarHBondContact O-N 3.34Å
286	G	43.2	Very low	64.6	Low	56 Å²	56	67 Å²	67	58%	0.577	43%	0.429	S	S	*	.			trans	67.2	160.9	158.3	0	0	0	0	0	118.2
287	P	50.8	Low	64.2	Low	114 Å²	114	70.4 Å²	70.4	74%	0.74	45%	0.445	S	S	*	.			trans	-88.2	135.2	-164.3	34.7	-30.9	0	0	0	111.8
288	A	40.7	Very low	64	Low	88 Å²	88	65 Å²	65	73%	0.727	42%	0.424	S	S	*	.			trans	-162.7	75.5	150.8	0	0	0	0	0	110.9
289	L	44.3	Very low	63.7	Low	49 Å²	49	66 Å²	66	26%	0.257	43%	0.431	S	S	.	.			trans	-91.9	102.8	142.1	-85.6	162.5	0	0	0	106.3	I89 L281 S291	I89-L289 HydrophobicContact CD1-CD1 3.63Å; L281-L289 HydrophobicContact CD2-CD2 4.29Å; L289-S291 PolarHBondContact O-N 3.44Å
290	S	42	Very low	63.4	Low	110 Å²	110	69.2 Å²	69.2	77%	0.769	45%	0.454	S	S	*	.	S	Bend	trans	-71.1	109.6	161.9	-60.5	0	0	0	0	106.8
291	S	44.5	Very low	63.4	Low	83 Å²	83	70.8 Å²	70.8	58%	0.58	44%	0.442	S	S	*	.	S	Bend	trans	68.1	129	-170.2	78.5	0	0	0	0	113.7	L289 S293	L289-S291 PolarHBondContact O-N 3.44Å; S291-S293 PolarHBondContact O-N 3.02Å
292	G	47.1	Very low	63.6	Low	39 Å²	39	70 Å²	70	40%	0.402	44%	0.438	S	S	.	.			trans	-49.7	135.4	172.8	0	0	0	0	0	108.9	S294	G292-S294 PolarHBondContact O-N 2.84Å
293	S	56	Low	64.2	Low	8 Å²	8	75.3 Å²	75.3	6%	0.056	46%	0.463	C	S	.	.			trans	-54.3	104.6	-177	59.3	0	0	0	0	107.8	F123 S291 Y295	F123-S293 VanDerWaalsContact CE2-OG 3.28Å; F123-S293 WeakPolarHBondContact CE2-OG 3.41Å; S291-S293 PolarHBondContact O-N 3.02Å; S293-Y295 PolarHBondContact O-N 3.48Å
294	S	70.7	Confident	65.6	Low	68 Å²	68	72.4 Å²	72.4	48%	0.476	45%	0.453	S	S	.	.			trans	-52.4	140	178	169.6	0	0	0	0	106.9	G292 S296 E297 L298	G292-S294 PolarHBondContact O-N 2.84Å; S294-S296 WeakPolarHBondContact CB-OG 3.26Å; S294-S296 PolarHBondContact O-N 2.78Å; S294-S296 PolarHBondContact OG-OG 3.14Å; S294-E297 WeakPolarHBondContact O-CA 3.34Å; S294-E297 WeakPolarHBondContact O-CB 3.38Å; S294-E297 PolarHBondContact O-N 3.07Å; S294-L298 PolarHBondContact O-N 3.14Å
295	Y	80.3	Confident	67.3	Low	56 Å²	56	64.1 Å²	64.1	22%	0.22	41%	0.414	C	S	.	.	H	α-helix	trans	-45.9	-35.6	177.5	177.9	-109.9	0	0	0	111.9	P124 P180 H181 L183 S293 E297 L298 V299	P124-Y295 HydrophobicContact CB-CD2 4.35Å; P124-Y295 HydrophobicContact CG-CD2 3.78Å; P180-Y295 VanDerWaalsContact O-CZ 3.29Å; P180-Y295 PolarHBondContact O-OH 3.33Å; H181-Y295 VanDerWaalsContact C-CE2 3.4Å; H181-Y295 VanDerWaalsContact CA-CZ 3.43Å; H181-Y295 HydrophobicContact CB-CD1 4.47Å; H181-Y295 HydrophobicContact CB-CE1 4.26Å; H181-Y295 AromaticContact CD2-CD1 3.89Å; H181-Y295 AromaticContact CD2-CE1 3.73Å; H181-Y295 WeakPolarHBondContact O-CD2 3.37Å; H181-Y295 WeakPolarHBondContact O-CE2 3.41Å; L183-Y295 HydrophobicContact CD2-CE2 4.38Å; L183-Y295 HydrophobicContact CG-CE2 4.12Å; S293-Y295 PolarHBondContact O-N 3.48Å; Y295-E297 VanDerWaalsContact C-N 3.34Å; Y295-E297 PolarHBondContact O-N 3.36Å; Y295-L298 PolarHBondContact O-N 3.42Å; Y295-V299 HydrophobicContact CD1-CG2 3.98Å; Y295-V299 HydrophobicContact CD2-CG2 4.11Å; Y295-V299 HydrophobicContact CE1-CG2 3.44Å; Y295-V299 VanDerWaalsContact CE1-CG2 3.44Å; Y295-V299 HydrophobicContact CE2-CG2 3.56Å; Y295-V299 HydrophobicContact CG-CG2 4.27Å; Y295-V299 WeakPolarHBondContact O-CB 3.29Å; Y295-V299 VanDerWaalsContact O-CG2 3.29Å; Y295-V299 WeakPolarHBondContact O-CG2 3.43Å; Y295-V299 PolarHBondContact O-N 3.23Å; Y295-V299 WeakPolarHBondContact OH-CG2 3.42Å
296	S	80.9	Confident	69.6	Low	77 Å²	77	60.3 Å²	60.3	54%	0.538	39%	0.391	S	S	.	.	H	α-helix	trans	-56.5	-39.2	173.9	61.4	0	0	0	0	114.5	S294 S300	S294-S296 WeakPolarHBondContact CB-OG 3.26Å; S294-S296 PolarHBondContact O-N 2.78Å; S294-S296 PolarHBondContact OG-OG 3.14Å; S296-S300 VanDerWaalsContact O-CB 3.27Å; S296-S300 WeakPolarHBondContact O-CB 3.29Å; S296-S300 PolarHBondContact O-N 2.61Å
297	E	83.9	Confident	71.8	Confident	71 Å²	71	60.6 Å²	60.6	33%	0.332	38%	0.379	S	S	.	.	H	α-helix	trans	-70.7	-45.7	178.6	-167.6	-172.5	163.2	0	0	111.3	S294 Y295 V299 S300 R301	S294-E297 WeakPolarHBondContact O-CA 3.34Å; S294-E297 WeakPolarHBondContact O-CB 3.38Å; S294-E297 PolarHBondContact O-N 3.07Å; Y295-E297 VanDerWaalsContact C-N 3.34Å; Y295-E297 PolarHBondContact O-N 3.36Å; E297-V299 VanDerWaalsContact C-N 3.33Å; E297-V299 PolarHBondContact O-N 3.38Å; E297-S300 WeakPolarHBondContact O-CB 3.21Å; E297-S300 PolarHBondContact O-N 2.87Å; E297-R301 WeakPolarHBondContact O-CG 3.47Å; E297-R301 PolarHBondContact O-N 3.34Å; E297-R301 IonicContact OE1-CZ 2.83Å; E297-R301 IonicContact OE1-NE 3.73Å; E297-R301 PolarHBondContact OE1-NE 3.36Å; E297-R301 IonicContact OE1-NH2 3.71Å; E297-R301 PolarHBondContact OE1-NH2 3.47Å
298	L	87.1	Confident	73.5	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	35%	0.353	C	S	.	.	H	α-helix	trans	-59.7	-45.7	176.9	-65.7	178	0	0	0	111.1	F123 P124 V125 L183 F275 L279 L281 S294 Y295 S300 R301 C302	F123-L298 HydrophobicContact CE1-CD1 4.4Å; F123-L298 HydrophobicContact CE2-CD1 4.01Å; F123-L298 HydrophobicContact CE2-CD2 4.23Å; F123-L298 HydrophobicContact CZ-CD1 3.91Å; F123-L298 HydrophobicContact CZ-CD2 3.95Å; P124-L298 HydrophobicContact CG-CD1 4.35Å; V125-L298 HydrophobicContact CG2-CD1 3.99Å; L183-L298 HydrophobicContact CD1-CB 4.05Å; F275-L298 HydrophobicContact CE1-CD2 4.21Å; L279-L298 HydrophobicContact CD1-CD2 4.18Å; L281-L298 HydrophobicContact CD1-CD2 3.95Å; S294-L298 PolarHBondContact O-N 3.14Å; Y295-L298 PolarHBondContact O-N 3.42Å; L298-S300 VanDerWaalsContact C-N 3.34Å; L298-S300 PolarHBondContact O-N 3.02Å; L298-R301 PolarHBondContact O-N 2.79Å; L298-C302 PolarHBondContact O-N 3.06Å; L298-C302 VanDerWaalsContact O-N 3.1Å; L298-C302 PolarHBondContact O-SG 3.15Å
299	V	83.4	Confident	75.7	Confident	47 Å²	47	54.3 Å²	54.3	29%	0.285	33%	0.33	S	S	.	.	H	α-helix	trans	-63.8	-39.6	175.8	172.9	0	0	0	0	111.7	L183 Y295 E297 R301 C302 Q303	L183-V299 HydrophobicContact CD2-CG2 4.41Å; Y295-V299 HydrophobicContact CD1-CG2 3.98Å; Y295-V299 HydrophobicContact CD2-CG2 4.11Å; Y295-V299 HydrophobicContact CE1-CG2 3.44Å; Y295-V299 VanDerWaalsContact CE1-CG2 3.44Å; Y295-V299 HydrophobicContact CE2-CG2 3.56Å; Y295-V299 HydrophobicContact CG-CG2 4.27Å; Y295-V299 WeakPolarHBondContact O-CB 3.29Å; Y295-V299 VanDerWaalsContact O-CG2 3.29Å; Y295-V299 WeakPolarHBondContact O-CG2 3.43Å; Y295-V299 PolarHBondContact O-N 3.23Å; Y295-V299 WeakPolarHBondContact OH-CG2 3.42Å; E297-V299 VanDerWaalsContact C-N 3.33Å; E297-V299 PolarHBondContact O-N 3.38Å; V299-R301 VanDerWaalsContact C-N 3.32Å; V299-R301 PolarHBondContact O-N 2.79Å; V299-C302 CarbonylContact O-C 3.52Å; V299-C302 VanDerWaalsContact O-C 3.31Å; V299-C302 WeakPolarHBondContact O-CA 3.45Å; V299-C302 PolarHBondContact O-N 3.29Å; V299-C302 VanDerWaalsContact O-N 3.08Å; V299-Q303 PolarHBondContact O-N 3.26Å
300	S	83.6	Confident	77.6	Confident	73 Å²	73	53.5 Å²	53.5	51%	0.51	33%	0.325	S	S	.	.	H	α-helix	trans	-59.2	-43.5	176.5	-174.1	0	0	0	0	111.4	S296 E297 L298 C302 Q303	S296-S300 VanDerWaalsContact O-CB 3.27Å; S296-S300 WeakPolarHBondContact O-CB 3.29Å; S296-S300 PolarHBondContact O-N 2.61Å; E297-S300 WeakPolarHBondContact O-CB 3.21Å; E297-S300 PolarHBondContact O-N 2.87Å; L298-S300 VanDerWaalsContact C-N 3.34Å; L298-S300 PolarHBondContact O-N 3.02Å; S300-C302 VanDerWaalsContact C-N 3.26Å; S300-C302 PolarHBondContact O-N 3.16Å; S300-Q303 VanDerWaalsContact O-CB 3.24Å; S300-Q303 WeakPolarHBondContact O-CB 3.44Å; S300-Q303 PolarHBondContact O-N 2.87Å
301	R	84.6	Confident	79.2	Confident	89 Å²	89	58.7 Å²	58.7	34%	0.336	33%	0.327	S	S	.	.	H	α-helix	trans	-65.3	-31.9	175.4	-66.2	178.1	-175.9	-121.8	9.6	112.2	R216 L279 E297 L298 V299 Q303	R216-R301 PolarHBondContact NH1-O 3.42Å; L279-R301 HydrophobicContact CD1-CB 4.38Å; L279-R301 HydrophobicContact CD2-CB 3.91Å; L279-R301 PolarHBondContact O-NH1 3.04Å; E297-R301 WeakPolarHBondContact O-CG 3.47Å; E297-R301 PolarHBondContact O-N 3.34Å; E297-R301 IonicContact OE1-CZ 2.83Å; E297-R301 IonicContact OE1-NE 3.73Å; E297-R301 PolarHBondContact OE1-NE 3.36Å; E297-R301 IonicContact OE1-NH2 3.71Å; E297-R301 PolarHBondContact OE1-NH2 3.47Å; L298-R301 PolarHBondContact O-N 2.79Å; V299-R301 VanDerWaalsContact C-N 3.32Å; V299-R301 PolarHBondContact O-N 2.79Å; R301-Q303 VanDerWaalsContact C-N 3.33Å; R301-Q303 PolarHBondContact O-N 3.33Å
302	C	87.5	Confident	79.3	Confident	0 Å²	0	57 Å²	57	0%	0	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	6.6	176.7	-58.8	0	0	0	0	114.2	V208 L298 V299 S300 G304 L305 V306	V208-C302 HydrophobicContact CG1-CB 4.48Å; V208-C302 HydrophobicContact CG2-CB 4.2Å; L298-C302 PolarHBondContact O-N 3.06Å; L298-C302 VanDerWaalsContact O-N 3.1Å; L298-C302 PolarHBondContact O-SG 3.15Å; V299-C302 CarbonylContact O-C 3.52Å; V299-C302 VanDerWaalsContact O-C 3.31Å; V299-C302 WeakPolarHBondContact O-CA 3.45Å; V299-C302 PolarHBondContact O-N 3.29Å; V299-C302 VanDerWaalsContact O-N 3.08Å; S300-C302 VanDerWaalsContact C-N 3.26Å; S300-C302 PolarHBondContact O-N 3.16Å; C302-G304 PolarHBondContact O-N 3.39Å; C302-L305 WeakPolarHBondContact O-CB 3.2Å; C302-L305 PolarHBondContact O-N 3.23Å; C302-V306 HydrophobicContact CB-CG2 4Å
303	Q	83.8	Confident	78.8	Confident	141 Å²	141	65.7 Å²	65.7	66%	0.659	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	128.3	-171.3	-170.9	178.9	14.3	0	0	111.6	R216 V299 S300 R301 L305	R216-Q303 PolarHBondContact NH1-O 3.17Å; R216-Q303 PolarHBondContact NH2-O 2.88Å; V299-Q303 PolarHBondContact O-N 3.26Å; S300-Q303 VanDerWaalsContact O-CB 3.24Å; S300-Q303 WeakPolarHBondContact O-CB 3.44Å; S300-Q303 PolarHBondContact O-N 2.87Å; R301-Q303 VanDerWaalsContact C-N 3.33Å; R301-Q303 PolarHBondContact O-N 3.33Å; Q303-L305 VanDerWaalsContact C-N 3.26Å; Q303-L305 PolarHBondContact O-N 3.46Å
304	G	84.8	Confident	77.7	Confident	39 Å²	39	76.3 Å²	76.3	40%	0.402	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.4	5.1	-179.8	0	0	0	0	0	115.8	C302 V308 K355	C302-G304 PolarHBondContact O-N 3.39Å; G304-V308 WeakPolarHBondContact O-CG2 3.48Å; G304-K355 PolarHBondContact O-NZ 2.82Å; G304-K355 VanDerWaalsContact O-NZ 3.13Å
305	L	89.9	Confident	75.8	Confident	14 Å²	14	81.2 Å²	81.2	7%	0.073	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-19.2	175.6	-54	-177.3	0	0	0	113.7	H212 L213 R216 C302 Q303 D307 V308	H212-L305 HydrophobicContact CB-CB 4.41Å; H212-L305 HydrophobicContact CB-CD1 3.82Å; H212-L305 HydrophobicContact CB-CD2 3.73Å; H212-L305 HydrophobicContact CB-CG 4.18Å; L213-L305 HydrophobicContact CD2-CD1 3.56Å; L213-L305 HydrophobicContact CG-CD1 4.03Å; R216-L305 VanDerWaalsContact CZ-CD1 3.4Å; R216-L305 VanDerWaalsContact CZ-CG 3.49Å; C302-L305 WeakPolarHBondContact O-CB 3.2Å; C302-L305 PolarHBondContact O-N 3.23Å; Q303-L305 VanDerWaalsContact C-N 3.26Å; Q303-L305 PolarHBondContact O-N 3.46Å; L305-D307 PolarHBondContact O-N 3.27Å; L305-V308 WeakPolarHBondContact O-CB 3.12Å; L305-V308 PolarHBondContact O-N 3.08Å
306	V	91.5	Very high	73.4	Confident	44 Å²	44	81.7 Å²	81.7	27%	0.267	43%	0.426	S	S	.	.	B	Isolated β-bridge	trans	-63.8	130.7	178.3	-174.4	0	0	0	0	110.9	T206 T207 V208 C302 V308	T206-V306 HydrophobicContact CG2-CG1 4.18Å; T207-V306 CarbonylContact O-C 3.59Å; T207-V306 VanDerWaalsContact O-CA 3.3Å; T207-V306 WeakPolarHBondContact O-CA 3.4Å; V208-V306 HydrophobicContact CG2-CG2 4.01Å; C302-V306 HydrophobicContact CB-CG2 4Å; V306-V308 PolarHBondContact O-N 3.19Å
307	D	90.2	Very high	71.1	Confident	61 Å²	61	85.4 Å²	85.4	33%	0.326	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	31.3	-177.7	-62.5	-40.7	0	0	0	114	Y190 T206 T207 L305	Y190-D307 HydrophobicContact CE2-CB 4.29Å; Y190-D307 VanDerWaalsContact CE2-O 3.31Å; Y190-D307 WeakPolarHBondContact CE2-O 3.15Å; T206-D307 PolarHBondContact N-OD1 3.1Å; T206-D307 VanDerWaalsContact N-OD1 3.08Å; T206-D307 PolarHBondContact N-OD2 3.2Å; T207-D307 PolarHBondContact N-OD1 3.05Å; T207-D307 PolarHBondContact O-N 2.81Å; T207-D307 PolarHBondContact OG1-OD1 3.38Å; L305-D307 PolarHBondContact O-N 3.27Å
308	V	86.9	Confident	68.5	Low	31 Å²	31	89.1 Å²	89.1	19%	0.188	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-99	121	176.5	-179	0	0	0	0	110	G304 L305 V306 F310	G304-V308 WeakPolarHBondContact O-CG2 3.48Å; L305-V308 WeakPolarHBondContact O-CB 3.12Å; L305-V308 PolarHBondContact O-N 3.08Å; V306-V308 PolarHBondContact O-N 3.19Å; V308-F310 PolarHBondContact O-N 3.05Å
309	P	87.6	Confident	66	Low	39 Å²	39	92.7 Å²	92.7	25%	0.253	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-65.8	129.2	171.2	23.5	-30	0	0	0	110.4	Y190 R311	Y190-P309 HydrophobicContact CD1-CB 3.61Å; Y190-P309 HydrophobicContact CD1-CG 4.42Å; Y190-P309 HydrophobicContact CE1-CB 3.57Å; Y190-P309 HydrophobicContact CE1-CG 3.94Å; Y190-P309 HydrophobicContact CG-CB 4.45Å; P309-R311 PolarHBondContact O-N 3.08Å
310	F	82.8	Confident	63.2	Low	33 Å²	33	93.6 Å²	93.6	15%	0.145	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-70.5	126.3	170.6	-163.7	-89.3	0	0	0	110.1	D209 R211 H212 L215 L226 V308	D209-F310 HydrophobicContact CB-CB 4.48Å; R211-F310 HydrophobicContact CB-CD2 3.55Å; R211-F310 HydrophobicContact CB-CE1 4.3Å; R211-F310 HydrophobicContact CB-CE2 3.29Å; R211-F310 HydrophobicContact CB-CG 4.2Å; R211-F310 HydrophobicContact CB-CZ 3.7Å; R211-F310 HydrophobicContact CG-CE2 4.48Å; H212-F310 AromaticContact CD2-CD2 3.72Å; H212-F310 AromaticContact CE1-CD2 3.31Å; H212-F310 WeakPolarHBondContact CE1-CD2 3.47Å; H212-F310 AromaticContact CE1-CE2 3.82Å; H212-F310 AromaticContact CG-CD2 3.72Å; H212-F310 AromaticContact ND1-CD2 3.47Å; H212-F310 WeakPolarHBondContact ND1-CD2 3.26Å; H212-F310 AromaticContact ND1-CE2 3.66Å; H212-F310 AromaticContact NE2-CD2 3.48Å; H212-F310 WeakPolarHBondContact NE2-CD2 2.99Å; L215-F310 HydrophobicContact CD1-CE2 3.95Å; L215-F310 HydrophobicContact CD1-CZ 3.9Å; L226-F310 HydrophobicContact CD1-CE1 4.42Å; L226-F310 HydrophobicContact CD1-CZ 3.75Å; V308-F310 PolarHBondContact O-N 3.05Å
311	R	76.7	Confident	60.8	Low	218 Å²	218	95.1 Å²	95.1	82%	0.823	52%	0.519	S	S	*	.			trans	-122	95.4	173.8	-66.2	-174.6	-171.9	-98.2	3.1	108.5	P309 R313	P309-R311 PolarHBondContact O-N 3.08Å; R311-R313 PolarHBondContact O-N 3.3Å
312	G	45.8	Very low	58.3	Low	47 Å²	47	95.5 Å²	95.5	49%	0.485	53%	0.525	S	S	.	.			trans	-65	128.6	174.5	0	0	0	0	0	111.4
313	R	36.4	Very low	55.6	Low	223 Å²	223	98.8 Å²	98.8	84%	0.842	56%	0.559	S	S	*	*	S	Bend	trans	-86.3	135.7	140.4	-77.4	-173.8	-125.7	-130.9	1.3	104.3	R311	R311-R313 PolarHBondContact O-N 3.3Å
314	W	33.6	Very low	53	Low	230 Å²	230	98.2 Å²	98.2	87%	0.871	56%	0.556	S	S	*	*			trans	77.6	84.6	-166.1	-66.7	-88.5	0	0	0	114.4
315	D	30.6	Very low	50.2	Low	171 Å²	171	103.9 Å²	103.9	91%	0.914	57%	0.565	S	S	*	*			trans	-110.8	88.4	139	-88.2	-32.2	0	0	0	105.5
316	G	28.8	Very low	47.3	Very low	67 Å²	67	107.9 Å²	107.9	69%	0.691	58%	0.579	S	S	*	*			trans	-100.2	116.2	160.6	0	0	0	0	0	107.1
317	D	33.1	Very low	44.4	Very low	155 Å²	155	114 Å²	114	83%	0.829	60%	0.598	S	S	*	*			trans	39.1	105.6	148	-149.1	32.9	0	0	0	118.8
318	D	30.4	Very low	41.3	Very low	149 Å²	149	123 Å²	123	80%	0.797	63%	0.627	S	S	*	*			trans	-135.9	124.3	145.3	-107.1	-22.4	0	0	0	107.5
319	G	33.1	Very low	38.3	Very low	75 Å²	75	126.2 Å²	126.2	77%	0.773	65%	0.647	S	S	*	*			trans	-72.1	134.4	-158.9	0	0	0	0	0	116.6
320	A	26.4	Very low	35.6	Very low	66 Å²	66	134.9 Å²	134.9	55%	0.545	68%	0.675	S	S	.	*			trans	-148.1	147.6	149.1	0	0	0	0	0	107.9	L244	L244-A320 HydrophobicContact CD1-CB 4.23Å; L244-A320 HydrophobicContact CD2-CB 4.36Å; L244-A320 HydrophobicContact CG-CB 4.47Å
321	P	32	Very low	33.1	Very low	106 Å²	106	141.8 Å²	141.8	69%	0.688	70%	0.704	S	S	*	*			trans	-64.6	150.9	-161.9	26.1	-35	0	0	0	113.5	L244	L244-P321 HydrophobicContact CD1-CG 4.11Å
322	E	32.2	Very low	30.8	Very low	96 Å²	96	136.5 Å²	136.5	45%	0.449	70%	0.699	S	S	.	*			trans	-48.2	132.8	-177	-66.4	174.6	125.9	0	0	114.2	R515	E322-R515 WeakPolarHBondContact OE1-CG 3.47Å; E322-R515 WeakPolarHBondContact OE2-CG 3.44Å; E322-R515 IonicContact OE2-NE 2.62Å
323	G	31.5	Very low	29.9	Very low	69 Å²	69	139.1 Å²	139.1	71%	0.711	72%	0.715	S	S	*	*			trans	166.9	115.5	164.2	0	0	0	0	0	112.5
324	E	28.4	Very low	29.4	Very low	130 Å²	130	137.2 Å²	137.2	61%	0.607	72%	0.718	S	S	*	*			trans	73.1	82.4	163.3	-59.4	-174.5	146.7	0	0	117.9	G137 R326	G137-E324 WeakPolarHBondContact CA-OE2 3.33Å; G137-E324 PolarHBondContact N-OE2 2.82Å; E324-R326 PolarHBondContact O-N 3.43Å
325	R	27	Very low	29.2	Very low	158 Å²	158	133.3 Å²	133.3	60%	0.596	71%	0.714	S	S	*	*			trans	-53.3	100.8	144.8	-76.3	177.6	167.8	-179.6	2.6	109.5	R327 E509	R325-R327 PolarHBondContact O-N 2.97Å; R325-E509 IonicContact CZ-OE1 3.22Å; R325-E509 IonicContact CZ-OE2 3.64Å; R325-E509 IonicContact NE-OE2 3.74Å; R325-E509 IonicContact NH1-OE1 2.67Å; R325-E509 PolarHBondContact NH1-OE1 3.34Å; R325-E509 IonicContact NH1-OE2 3.6Å; R325-E509 PolarHBondContact NH1-OE2 2.92Å; R325-E509 IonicContact NH2-OE1 2.73Å; R325-E509 PolarHBondContact NH2-OE1 3.38Å; R325-E509 IonicContact NH2-OE2 3.7Å; R325-E509 PolarHBondContact NH2-OE2 3.11Å
326	R	29.2	Very low	28.9	Very low	97 Å²	97	132.8 Å²	132.8	37%	0.366	71%	0.712	S	S	.	*			trans	-72.6	101.5	175.3	-76.1	-175.4	171.6	-171.5	-19.7	111.3	S134 G137 R138 E324 R328	S134-R326 PolarHBondContact OG-NH1 3.13Å; S134-R326 PolarHBondContact OG-NH2 3.24Å; G137-R326 WeakPolarHBondContact O-CD 3.45Å; G137-R326 VanDerWaalsContact O-CG 3.27Å; G137-R326 WeakPolarHBondContact O-CG 3.43Å; G137-R326 PolarHBondContact O-NE 3.48Å; R138-R326 VanDerWaalsContact N-NH2 3.1Å; R138-R326 PolarHBondContact O-NH2 2.62Å; R138-R326 VanDerWaalsContact O-NH2 3.08Å; E324-R326 PolarHBondContact O-N 3.43Å; R326-R328 PolarHBondContact O-N 2.97Å
327	R	30.3	Very low	28.7	Very low	174 Å²	174	134.9 Å²	134.9	66%	0.657	72%	0.716	S	S	*	*			trans	-30.1	123.4	149.3	-78	172.2	171.3	-177.6	-10.2	111	R325 T329 E502	R325-R327 PolarHBondContact O-N 2.97Å; R327-T329 VanDerWaalsContact C-N 3.32Å; R327-T329 PolarHBondContact O-N 3.34Å; R327-E502 WeakPolarHBondContact CD-OE1 3.39Å; R327-E502 HydrophobicContact CG-CG 4.36Å; R327-E502 WeakPolarHBondContact CG-OE1 3.48Å; R327-E502 IonicContact CZ-OE1 3.36Å; R327-E502 IonicContact CZ-OE2 3.35Å; R327-E502 IonicContact NE-OE1 2.84Å; R327-E502 PolarHBondContact NE-OE1 2.89Å; R327-E502 IonicContact NE-OE2 2.94Å; R327-E502 PolarHBondContact NE-OE2 3.19Å; R327-E502 IonicContact NH2-OE2 2.69Å; R327-E502 PolarHBondContact NH2-OE2 3.24Å
328	R	25.2	Very low	28.7	Very low	249 Å²	249	132.8 Å²	132.8	94%	0.94	71%	0.711	S	S	*	*			trans	-69.5	89.7	165.5	-83.1	-179.3	172.5	174.5	-1.2	109.1	R326 R330	R326-R328 PolarHBondContact O-N 2.97Å; R328-R330 PolarHBondContact O-N 2.88Å
329	T	24.3	Very low	28.4	Very low	98 Å²	98	134.8 Å²	134.8	60%	0.601	72%	0.715	S	S	*	*			trans	-78.6	106.8	165	-19.9	0	0	0	0	108.1	R327	R327-T329 VanDerWaalsContact C-N 3.32Å; R327-T329 PolarHBondContact O-N 3.34Å
330	R	29.8	Very low	28.7	Very low	222 Å²	222	137.6 Å²	137.6	84%	0.838	72%	0.723	S	S	*	*			trans	-86.6	119	158.1	-110.2	177.2	163.7	169.5	-6.1	106.2	R328	R328-R330 PolarHBondContact O-N 2.88Å
331	K	30.9	Very low	28.7	Very low	177 Å²	177	137.3 Å²	137.3	77%	0.77	73%	0.726	S	S	*	*			trans	-104.8	160.9	168.6	-102.3	-158.9	175.4	-173.2	0	110.1
332	P	28.8	Very low	28.9	Very low	108 Å²	108	139.9 Å²	139.9	70%	0.701	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-94.5	155.7	-134.3	36.6	-35.3	0	0	0	113	M334	P332-M334 PolarHBondContact O-N 3.32Å
333	A	26.3	Very low	28.9	Very low	101 Å²	101	144.3 Å²	144.3	84%	0.835	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-72.7	121.8	163.8	0	0	0	0	0	108.4
334	M	25.6	Very low	29.2	Very low	183 Å²	183	148.7 Å²	148.7	90%	0.901	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-67.6	143.4	166.8	-79.3	178.8	84	0	0	109.9	P332	P332-M334 PolarHBondContact O-N 3.32Å
335	N	29.5	Very low	30	Very low	148 Å²	148	146.2 Å²	146.2	79%	0.791	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-46.3	134.7	170.9	-71.9	-22.9	0	0	0	111.9
336	N	23.3	Very low	30.9	Very low	161 Å²	161	144 Å²	144	86%	0.861	76%	0.757	S	S	*	*				-154.9	106.4	128.4	-83.9	-27	0	0	0	106.9
337	S	26	Very low	32.1	Very low	111 Å²	111	140.9 Å²	140.9	78%	0.776	75%	0.747	S	S	*	*			trans	-69.4	143	153.9	-57.2	0	0	0	0	107
338	P	33.1	Very low	33.4	Very low	111 Å²	111	133.2 Å²	133.2	72%	0.721	72%	0.72	S	S	*	*				-138.4	154.6	74.3	23.5	-1.2	0	0	0	116
339	E	24.5	Very low	34.9	Very low	191 Å²	191	124.9 Å²	124.9	89%	0.893	69%	0.688	S	S	*	*			trans	76.9	135.7	143.6	-71.8	178.8	171.1	0	0	122.8
340	S	38.2	Very low	36.2	Very low	134 Å²	134	127.8 Å²	127.8	94%	0.937	69%	0.693	S	S	*	*			trans	-46.9	124.8	-178.9	-170.1	0	0	0	0	114.2
341	G	26.8	Very low	37.3	Very low	59 Å²	59	120.5 Å²	120.5	61%	0.608	67%	0.67	S	S	*	*			trans	176.3	117.4	167.1	0	0	0	0	0	111.7	Q343	G341-Q343 PolarHBondContact O-N 3.03Å
342	D	36	Very low	38	Very low	161 Å²	161	119.5 Å²	119.5	86%	0.861	67%	0.674	S	S	*	*			trans	-45.7	96.7	176	-82.5	-41.9	0	0	0	113	Q344	D342-Q344 PolarHBondContact O-N 3.1Å; D342-Q344 VanDerWaalsContact O-N 3.08Å
343	Q	33.1	Very low	38.7	Very low	189 Å²	189	125.8 Å²	125.8	88%	0.883	68%	0.683	S	S	*	*			trans	-77.5	94.2	166.8	-73.3	-172	7.2	0	0	109.2	G341 V345	G341-Q343 PolarHBondContact O-N 3.03Å; Q343-V345 PolarHBondContact O-N 3.27Å
344	Q	37.7	Very low	39.8	Very low	161 Å²	161	128.6 Å²	128.6	75%	0.752	67%	0.672	S	S	*	*			trans	-65.1	112.5	173.8	-72.7	-178.4	6	0	0	110.4	D342 P346	D342-Q344 PolarHBondContact O-N 3.1Å; D342-Q344 VanDerWaalsContact O-N 3.08Å; Q344-P346 WeakPolarHBondContact O-CD 3.47Å
345	V	43.9	Very low	40.8	Very low	77 Å²	77	126.2 Å²	126.2	47%	0.467	66%	0.657	S	S	.	*	P	Polyproline II helix	trans	-64.1	125.2	167.3	178	0	0	0	0	108.3	Q343 D347	Q343-V345 PolarHBondContact O-N 3.27Å; V345-D347 PolarHBondContact O-N 3.35Å
346	P	46.4	Very low	42	Very low	113 Å²	113	124.1 Å²	124.1	73%	0.734	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-57.5	132.1	-179.7	-25.7	34.1	0	0	0	112	Q344 P348	Q344-P346 WeakPolarHBondContact O-CD 3.47Å; P346-P348 WeakPolarHBondContact O-CD 3.41Å; P346-P348 VanDerWaalsContact O-N 3.15Å
347	D	54	Low	43.4	Very low	30 Å²	30	118.9 Å²	118.9	16%	0.16	62%	0.623	C	S	.	*	P	Polyproline II helix	trans	-53.7	117.5	-178.5	-176.3	-16.9	0	0	0	110.7	V345 R349 K350	V345-D347 PolarHBondContact O-N 3.35Å; D347-R349 VanDerWaalsContact CG-NE 3.34Å; D347-R349 PolarHBondContact O-N 3.29Å; D347-R349 WeakPolarHBondContact OD1-CB 3.1Å; D347-R349 VanDerWaalsContact OD1-CG 3.29Å; D347-R349 WeakPolarHBondContact OD1-CG 3.28Å; D347-R349 IonicContact OD1-CZ 2.84Å; D347-R349 PolarHBondContact OD1-N 3.03Å; D347-R349 IonicContact OD1-NE 2.78Å; D347-R349 PolarHBondContact OD1-NE 3.35Å; D347-R349 IonicContact OD1-NH2 3.64Å; D347-R349 IonicContact OD2-CZ 3.14Å; D347-R349 IonicContact OD2-NE 2.73Å; D347-R349 PolarHBondContact OD2-NE 3.06Å; D347-R349 IonicContact OD2-NH2 3.37Å; D347-R349 PolarHBondContact OD2-NH2 3.15Å; D347-K350 HydrophobicContact CB-CB 4.3Å; D347-K350 HydrophobicContact CB-CD 3.97Å; D347-K350 HydrophobicContact CB-CG 3.9Å; D347-K350 PolarHBondContact O-N 2.89Å
348	P	57.1	Low	44.8	Very low	13 Å²	13	114.1 Å²	114.1	8%	0.084	59%	0.591	C	S	.	*	T	Hydrogen-bonded Turn	trans	-56.9	-21.2	-179.7	-24.2	32.7	0	0	0	113.7	P346 L357 A479 V482 H483	P346-P348 WeakPolarHBondContact O-CD 3.41Å; P346-P348 VanDerWaalsContact O-N 3.15Å; P348-L357 HydrophobicContact CB-CD1 3.95Å; P348-A479 HydrophobicContact CB-CB 4.29Å; P348-A479 HydrophobicContact CG-CB 4.31Å; P348-V482 HydrophobicContact CG-CB 4.47Å; P348-V482 HydrophobicContact CG-CG1 4.26Å; P348-H483 WeakPolarHBondContact CD-NE2 3.35Å
349	R	56.9	Low	45.9	Very low	74 Å²	74	114.8 Å²	114.8	28%	0.279	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.6	-23.6	177.5	-56.5	171	-68.5	-177.7	-1.7	113.3	D347 N351 L357 C476 A479	D347-R349 VanDerWaalsContact CG-NE 3.34Å; D347-R349 PolarHBondContact O-N 3.29Å; D347-R349 WeakPolarHBondContact OD1-CB 3.1Å; D347-R349 VanDerWaalsContact OD1-CG 3.29Å; D347-R349 WeakPolarHBondContact OD1-CG 3.28Å; D347-R349 IonicContact OD1-CZ 2.84Å; D347-R349 PolarHBondContact OD1-N 3.03Å; D347-R349 IonicContact OD1-NE 2.78Å; D347-R349 PolarHBondContact OD1-NE 3.35Å; D347-R349 IonicContact OD1-NH2 3.64Å; D347-R349 IonicContact OD2-CZ 3.14Å; D347-R349 IonicContact OD2-NE 2.73Å; D347-R349 PolarHBondContact OD2-NE 3.06Å; D347-R349 IonicContact OD2-NH2 3.37Å; D347-R349 PolarHBondContact OD2-NH2 3.15Å; R349-N351 VanDerWaalsContact C-N 3.29Å; R349-L357 HydrophobicContact CG-CD1 4.18Å; R349-C476 PolarHBondContact NH1-SG 2.8Å; R349-A479 HydrophobicContact CG-CB 3.78Å
350	K	51.4	Low	47.2	Very low	160 Å²	160	109.4 Å²	109.4	70%	0.696	59%	0.589	S	S	*	*	S	Bend	trans	-85.1	-3.6	-178.8	-67.4	-175.8	-176.4	179.3	0	113	D347 N352	D347-K350 HydrophobicContact CB-CB 4.3Å; D347-K350 HydrophobicContact CB-CD 3.97Å; D347-K350 HydrophobicContact CB-CG 3.9Å; D347-K350 PolarHBondContact O-N 2.89Å; K350-N352 PolarHBondContact O-N 2.54Å
351	N	54	Low	48.2	Very low	68 Å²	68	107.7 Å²	107.7	36%	0.364	56%	0.563	S	S	.	*			trans	-88.1	89.1	179.5	-164	-12.5	0	0	0	110.8	R349 R353 R354	R349-N351 VanDerWaalsContact C-N 3.29Å; N351-R353 PolarHBondContact O-N 3.08Å; N351-R353 PolarHBondContact OD1-N 2.89Å; N351-R354 PolarHBondContact O-N 3.43Å
352	N	46	Very low	49.6	Very low	157 Å²	157	110.4 Å²	110.4	84%	0.84	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	-7.2	-179.8	-69.9	-8.3	0	0	0	114.3	K350	K350-N352 PolarHBondContact O-N 2.54Å
353	R	42.7	Very low	50.7	Low	240 Å²	240	104 Å²	104	91%	0.906	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	0.1	177.7	-61.6	-172.3	179.9	-178.6	0.5	114.2	N351	N351-R353 PolarHBondContact O-N 3.08Å; N351-R353 PolarHBondContact OD1-N 2.89Å
354	R	49.4	Very low	51.9	Low	159 Å²	159	103.4 Å²	103.4	60%	0.6	53%	0.531	S	S	*	.	S	Bend	trans	-107.5	152.5	178.5	-68.3	-176.9	176.5	177.4	0.3	111.9	N351	N351-R354 PolarHBondContact O-N 3.43Å
355	K	46.9	Very low	52.9	Low	134 Å²	134	106.3 Å²	106.3	58%	0.583	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-53.5	148.7	171.2	-69	-178.3	-178.4	177.2	0	110.1	G304 L357	G304-K355 PolarHBondContact O-NZ 2.82Å; G304-K355 VanDerWaalsContact O-NZ 3.13Å; K355-L357 PolarHBondContact O-N 3.43Å; K355-L357 VanDerWaalsContact O-N 3.16Å
356	P	53.7	Low	54.1	Low	103 Å²	103	105.7 Å²	105.7	67%	0.669	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-52.3	125.3	177.6	-21.9	30.2	0	0	0	110.4	G358 V359	P356-G358 PolarHBondContact O-N 3.42Å; P356-V359 HydrophobicContact CB-CG2 4.11Å; P356-V359 VanDerWaalsContact O-CG2 3.26Å; P356-V359 WeakPolarHBondContact O-CG2 3.35Å
357	L	53.4	Low	55.6	Low	52 Å²	52	103.5 Å²	103.5	27%	0.272	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	131.8	175.4	-70.5	173.7	0	0	0	108.9	P348 R349 K355 S475 A478 A479	P348-L357 HydrophobicContact CB-CD1 3.95Å; R349-L357 HydrophobicContact CG-CD1 4.18Å; K355-L357 PolarHBondContact O-N 3.43Å; K355-L357 VanDerWaalsContact O-N 3.16Å; L357-S475 VanDerWaalsContact O-CA 3.28Å; L357-S475 WeakPolarHBondContact O-CA 3.31Å; L357-S475 WeakPolarHBondContact O-CB 3.36Å; L357-A478 HydrophobicContact CB-CB 3.97Å; L357-A478 HydrophobicContact CD2-CB 4.32Å; L357-A479 HydrophobicContact CD1-CB 4.17Å
358	G	55.3	Low	57	Low	11 Å²	11	102.7 Å²	102.7	11%	0.113	52%	0.522	C	S	.	.	T	Hydrogen-bonded Turn	trans	108	3.1	172.2	0	0	0	0	0	117	P356 G360 Y361	P356-G358 PolarHBondContact O-N 3.42Å; G358-G360 PolarHBondContact O-N 3.03Å; G358-Y361 PolarHBondContact O-N 3.39Å
359	V	55.5	Low	58.6	Low	124 Å²	124	103.6 Å²	103.6	75%	0.752	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-15.7	-175.8	178.3	0	0	0	0	114.2	P356	P356-V359 HydrophobicContact CB-CG2 4.11Å; P356-V359 VanDerWaalsContact O-CG2 3.26Å; P356-V359 WeakPolarHBondContact O-CG2 3.35Å
360	G	53.4	Low	60.1	Low	79 Å²	79	103.2 Å²	103.2	81%	0.814	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-0.8	175.2	0	0	0	0	0	115.7	G358	G358-G360 PolarHBondContact O-N 3.03Å
361	Y	58	Low	62.1	Low	98 Å²	98	97.6 Å²	97.6	38%	0.384	51%	0.505	S	S	.	.			trans	-98.7	121.1	-179.4	-69.3	-87.1	0	0	0	110.2	G358 A363 I444 T474 H477 A478 N481	G358-Y361 PolarHBondContact O-N 3.39Å; Y361-A363 PolarHBondContact O-N 3.06Å; Y361-I444 HydrophobicContact CD1-CD1 3.57Å; Y361-I444 HydrophobicContact CE1-CD1 3.95Å; Y361-I444 HydrophobicContact CG-CD1 4.14Å; Y361-T474 HydrophobicContact CG-CG2 4.45Å; Y361-H477 AromaticContact CE1-CE1 3.62Å; Y361-H477 AromaticContact CE1-ND1 3.62Å; Y361-H477 AromaticContact CZ-CE1 3.72Å; Y361-H477 AromaticContact CZ-ND1 3.45Å; Y361-H477 PolarHBondContact OH-CE1 3.18Å; Y361-H477 PolarHBondContact OH-ND1 3.36Å; Y361-A478 HydrophobicContact CE2-CB 4.48Å; Y361-N481 PolarHBondContact OH-ND2 2.87Å
362	S	56.1	Low	64	Low	115 Å²	115	94.5 Å²	94.5	80%	0.804	49%	0.489	S	S	*	.			trans	-79	114.5	170.7	-172.8	0	0	0	0	109.4
363	A	59.4	Low	66.3	Low	27 Å²	27	89.4 Å²	89.4	22%	0.223	46%	0.459	C	S	.	.			trans	-78.3	137	174.1	0	0	0	0	0	110.8	Y361 S442	Y361-A363 PolarHBondContact O-N 3.06Å; A363-S442 VanDerWaalsContact CB-OG 3.29Å; A363-S442 WeakPolarHBondContact CB-OG 3.35Å
364	R	59.1	Low	68.7	Low	176 Å²	176	78.2 Å²	78.2	66%	0.664	42%	0.417	S	S	*	.			trans	-77	146.2	176	-67.7	-167.5	-175.9	-144.2	0.2	110.4
365	K	58.2	Low	70.9	Confident	222 Å²	222	71.3 Å²	71.3	97%	0.965	39%	0.393	S	S	*	.	S	Bend	trans	-84	-14.4	176.8	-64.8	-177	179	-179.2	0	113.4
366	S	69.1	Low	73.2	Confident	64 Å²	64	65 Å²	65	45%	0.448	37%	0.365	S	S	.	.	S	Bend	trans	-100.1	151.7	-179.5	64.3	0	0	0	0	111.5
367	P	77.9	Confident	75.2	Confident	67 Å²	67	62.1 Å²	62.1	44%	0.435	35%	0.346	S	S	.	.			trans	-56.6	152.8	171.1	24.3	-32.8	0	0	0	111.7
368	L	84.3	Confident	77.1	Confident	13 Å²	13	64.6 Å²	64.6	7%	0.068	36%	0.36	C	S	.	.	S	Bend	trans	-108.4	-15.7	178	-72.3	179.4	0	0	0	113.7	N432 Y443 R445 L471	L368-N432 PolarHBondContact N-OD1 2.73Å; L368-Y443 HydrophobicContact CB-CE2 4.1Å; L368-Y443 HydrophobicContact CD1-CD2 3.78Å; L368-Y443 HydrophobicContact CD1-CE2 3.9Å; L368-Y443 HydrophobicContact CG-CD2 4.32Å; L368-Y443 HydrophobicContact CG-CE2 3.92Å; L368-R445 HydrophobicContact CD1-CG 4.03Å; L368-R445 PolarHBondContact O-NH2 3.3Å; L368-L471 HydrophobicContact CB-CD1 4.21Å; L368-L471 HydrophobicContact CB-CD2 4.03Å; L368-L471 HydrophobicContact CD1-CD2 3.61Å; L368-L471 HydrophobicContact CG-CD2 4.49Å
369	Y	89.1	Confident	78.7	Confident	32 Å²	32	65.6 Å²	65.6	13%	0.125	37%	0.37	C	S	.	.			trans	-112.2	109	164.4	-61.5	-52.6	0	0	0	108.4	N371 K430 E431 N432 I469 L471	Y369-N371 VanDerWaalsContact C-N 3.33Å; Y369-K430 HydrophobicContact CD1-CB 4.36Å; Y369-K430 HydrophobicContact CD1-CD 4.42Å; Y369-K430 HydrophobicContact CD2-CB 3.52Å; Y369-K430 HydrophobicContact CE1-CD 4.09Å; Y369-K430 HydrophobicContact CE2-CB 3.75Å; Y369-K430 HydrophobicContact CE2-CD 4.39Å; Y369-K430 HydrophobicContact CG-CB 3.86Å; Y369-E431 WeakPolarHBondContact CD2-O 3.33Å; Y369-N432 PolarHBondContact N-OD1 2.81Å; Y369-N432 PolarHBondContact O-ND2 2.82Å; Y369-I469 PolarHBondContact OH-O 3.34Å; Y369-I469 VanDerWaalsContact OH-O 3.05Å; Y369-L471 HydrophobicContact CD2-CD1 3.55Å; Y369-L471 HydrophobicContact CD2-CG 4.24Å; Y369-L471 HydrophobicContact CE2-CD1 3.31Å; Y369-L471 HydrophobicContact CE2-CD2 4.42Å; Y369-L471 HydrophobicContact CE2-CG 3.5Å; Y369-L471 VanDerWaalsContact CE2-CG 3.5Å; Y369-L471 HydrophobicContact CG-CD1 4.47Å
370	D	89.8	Confident	80.5	Confident	67 Å²	67	62.3 Å²	62.3	36%	0.358	35%	0.347	S	S	.	.			trans	-83.3	-16.3	174.6	-62.3	-43	0	0	0	112.1	C372 K387	D370-C372 VanDerWaalsContact C-N 3.29Å; D370-C372 PolarHBondContact O-N 2.83Å; D370-K387 HydrophobicContact CB-CB 3.91Å; D370-K387 WeakPolarHBondContact OD2-CB 3.26Å; D370-K387 PolarHBondContact OD2-N 2.9Å
371	N	92.2	Very high	82.4	Confident	41 Å²	41	60.9 Å²	60.9	22%	0.219	32%	0.323	C	S	.	.			trans	54.2	38.4	178.8	-61.5	-48.7	0	0	0	114	Y369 F373 A429 K430	Y369-N371 VanDerWaalsContact C-N 3.33Å; N371-F373 WeakPolarHBondContact O-CD2 3.39Å; N371-F373 WeakPolarHBondContact O-CE2 3.48Å; N371-A429 HydrophobicContact CB-CB 4.16Å; N371-K430 PolarHBondContact ND2-O 2.95Å; N371-K430 PolarHBondContact OD1-N 3.12Å
372	C	93.8	Very high	84	Confident	3 Å²	3	57 Å²	57	2%	0.02	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	132.9	171.6	-58.6	0	0	0	0	110.3	D370 T384 C385 K387 A390 F407	D370-C372 VanDerWaalsContact C-N 3.29Å; D370-C372 PolarHBondContact O-N 2.83Å; C372-T384 CarbonylContact O-C 3.6Å; C372-T384 VanDerWaalsContact O-CA 3.26Å; C372-T384 WeakPolarHBondContact O-CA 3.43Å; C372-C385 WeakPolarHBondContact CB-O 3.44Å; C372-C385 PolarHBondContact N-O 3.31Å; C372-C385 PolarHBondContact O-N 3.05Å; C372-C385 PolarHBondContact O-SG 3Å; C372-K387 VanDerWaalsContact SG-CA 3.58Å; C372-A390 HydrophobicContact CB-CB 3.91Å; C372-F407 CarbonylContact C-O 3.59Å; C372-F407 VanDerWaalsContact CA-O 3.29Å; C372-F407 WeakPolarHBondContact CA-O 3.11Å; C372-F407 HydrophobicContact CB-CB 4.34Å; C372-F407 HydrophobicContact CB-CD1 3.94Å
373	F	94.6	Very high	85.6	Confident	51 Å²	51	53 Å²	53	22%	0.224	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	139.4	-177.1	-65.1	-95.9	0	0	0	111.7	N371 T384 P406 F407 I408 V409 A429	N371-F373 WeakPolarHBondContact O-CD2 3.39Å; N371-F373 WeakPolarHBondContact O-CE2 3.48Å; F373-T384 HydrophobicContact CD1-CG2 3.96Å; F373-T384 HydrophobicContact CE1-CG2 3.65Å; F373-T384 HydrophobicContact CZ-CG2 4.07Å; F373-P406 HydrophobicContact CD2-CB 4.22Å; F373-P406 HydrophobicContact CE2-CB 4.18Å; F373-F407 PolarHBondContact N-O 3.11Å; F373-I408 HydrophobicContact CB-CG1 4.14Å; F373-I408 HydrophobicContact CB-CG2 4.39Å; F373-I408 WeakPolarHBondContact O-CA 3.28Å; F373-V409 PolarHBondContact O-N 2.81Å; F373-A429 HydrophobicContact CZ-CB 4.42Å
374	L	94.6	Very high	87.2	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	130.7	169.7	-64.4	179.2	0	0	0	109.7	L382 C383 C385 Y393 V409 L411	L374-L382 HydrophobicContact CB-CB 4.4Å; L374-L382 WeakPolarHBondContact O-CA 3.46Å; L374-L382 VanDerWaalsContact O-CB 3.29Å; L374-L382 WeakPolarHBondContact O-CB 3.27Å; L374-L382 PolarHBondContact O-N 3.01Å; L374-C383 PolarHBondContact N-O 2.58Å; L374-C383 PolarHBondContact O-N 3.49Å; L374-C385 HydrophobicContact CD1-CB 4.32Å; L374-Y393 HydrophobicContact CD1-CD2 4.45Å; L374-Y393 HydrophobicContact CD1-CE2 3.79Å; L374-Y393 HydrophobicContact CD2-CD2 4.04Å; L374-Y393 HydrophobicContact CD2-CE2 4.2Å; L374-V409 WeakPolarHBondContact CA-O 3.47Å; L374-V409 HydrophobicContact CD2-CB 3.97Å; L374-V409 HydrophobicContact CD2-CG1 4.37Å; L374-L411 HydrophobicContact CD2-CD2 4.4Å
375	N	95.1	Very high	88.7	Confident	15 Å²	15	45.2 Å²	45.2	8%	0.08	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	149.3	175.3	-68.6	1.3	0	0	0	110.6	Q380 Q402 I408 V409 R410 L411	N375-Q380 CarbonylContact C-O 3.54Å; N375-Q380 WeakPolarHBondContact CA-O 3.26Å; N375-Q402 PolarHBondContact ND2-OE1 3.43Å; N375-Q402 VanDerWaalsContact ND2-OE1 3.14Å; N375-I408 WeakPolarHBondContact ND2-CG2 3.37Å; N375-V409 PolarHBondContact N-O 3.32Å; N375-R410 HydrophobicContact CB-CG 4.45Å; N375-L411 PolarHBondContact O-N 3.08Å
376	A	94.9	Very high	90.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.219	C	C	.	.			trans	-72.4	167.3	170.1	0	0	0	0	0	111.6	D378 G379 Q380 L382 R410 P415	A376-D378 WeakPolarHBondContact CB-OD1 3.34Å; A376-D378 PolarHBondContact O-N 3.14Å; A376-D378 VanDerWaalsContact O-N 3.14Å; A376-G379 PolarHBondContact O-N 3.28Å; A376-Q380 HydrophobicContact CB-CB 4.31Å; A376-Q380 PolarHBondContact N-O 3.08Å; A376-L382 HydrophobicContact CB-CD1 4.16Å; A376-L382 HydrophobicContact CB-CD2 3.95Å; A376-L382 HydrophobicContact CB-CG 4.18Å; A376-R410 WeakPolarHBondContact O-CG 3.31Å; A376-P415 HydrophobicContact CB-CG 4.41Å
377	P	94.8	Very high	91.3	Very high	43 Å²	43	39.3 Å²	39.3	28%	0.279	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-31.7	-179.6	-26.3	33.3	0	0	0	114.2	G379 R410 L411 F413	P377-G379 VanDerWaalsContact C-N 3.3Å; P377-R410 PolarHBondContact O-NH1 3.21Å; P377-L411 WeakPolarHBondContact CA-O 3.39Å; P377-L411 WeakPolarHBondContact CG-O 3.3Å; P377-F413 WeakPolarHBondContact CD-O 3.46Å; P377-F413 WeakPolarHBondContact CG-O 3.05Å
378	D	93.3	Very high	92	Very high	105 Å²	105	44.6 Å²	44.6	56%	0.561	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	0.4	177.4	60	7.6	0	0	0	114.3	A376 Q380 R418	A376-D378 WeakPolarHBondContact CB-OD1 3.34Å; A376-D378 PolarHBondContact O-N 3.14Å; A376-D378 VanDerWaalsContact O-N 3.14Å; D378-Q380 WeakPolarHBondContact OD1-CB 3.5Å; D378-Q380 PolarHBondContact OD1-N 3.22Å; D378-R418 IonicContact OD1-NH1 2.74Å; D378-R418 PolarHBondContact OD1-NH1 3.43Å; D378-R418 IonicContact OD1-NH2 2.62Å; D378-R418 IonicContact OD2-CZ 3.28Å; D378-R418 IonicContact OD2-NH1 2.82Å; D378-R418 PolarHBondContact OD2-NH1 3.25Å; D378-R418 IonicContact OD2-NH2 2.93Å; D378-R418 PolarHBondContact OD2-NH2 3.41Å; D378-R418 VanDerWaalsContact OD2-NH2 3.17Å
379	G	90.8	Very high	92.4	Very high	32 Å²	32	48.9 Å²	48.9	33%	0.33	25%	0.254	S	S	.	.	S	Bend	trans	88.8	-0.3	-179.6	0	0	0	0	0	115	A376 P377 P381	A376-G379 PolarHBondContact O-N 3.28Å; P377-G379 VanDerWaalsContact C-N 3.3Å; G379-P381 WeakPolarHBondContact O-CD 3.29Å
380	Q	92.4	Very high	92.6	Very high	54 Å²	54	47.4 Å²	47.4	25%	0.252	25%	0.248	S	C	.	.			trans	-65.6	128.5	177	-172.7	-176.1	7.4	0	0	111	N375 A376 D378	N375-Q380 CarbonylContact C-O 3.54Å; N375-Q380 WeakPolarHBondContact CA-O 3.26Å; A376-Q380 HydrophobicContact CB-CB 4.31Å; A376-Q380 PolarHBondContact N-O 3.08Å; D378-Q380 WeakPolarHBondContact OD1-CB 3.5Å; D378-Q380 PolarHBondContact OD1-N 3.22Å
381	P	92.4	Very high	92.8	Very high	50 Å²	50	47.4 Å²	47.4	33%	0.325	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	136	173.1	-23.8	35	0	0	0	112	G379 P419 L427	G379-P381 WeakPolarHBondContact O-CD 3.29Å; P381-P419 WeakPolarHBondContact O-CG 3.49Å; P381-L427 HydrophobicContact CB-CD2 3.74Å
382	L	91.6	Very high	93	Very high	16 Å²	16	51.5 Å²	51.5	8%	0.084	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-57.7	-178.7	-59.1	174.5	0	0	0	112.3	L374 A376 L411 P415 R418 P419 L427	L374-L382 HydrophobicContact CB-CB 4.4Å; L374-L382 WeakPolarHBondContact O-CA 3.46Å; L374-L382 VanDerWaalsContact O-CB 3.29Å; L374-L382 WeakPolarHBondContact O-CB 3.27Å; L374-L382 PolarHBondContact O-N 3.01Å; A376-L382 HydrophobicContact CB-CD1 4.16Å; A376-L382 HydrophobicContact CB-CD2 3.95Å; A376-L382 HydrophobicContact CB-CG 4.18Å; L382-L411 HydrophobicContact CD1-CD1 3.68Å; L382-L411 HydrophobicContact CD1-CG 4.39Å; L382-P415 HydrophobicContact CD1-CB 4.05Å; L382-P415 HydrophobicContact CD1-CG 3.86Å; L382-P415 HydrophobicContact CD2-CG 3.9Å; L382-R418 HydrophobicContact CD2-CG 4.14Å; L382-P419 WeakPolarHBondContact O-CG 3.23Å; L382-L427 VanDerWaalsContact C-CD2 3.42Å; L382-L427 WeakPolarHBondContact O-CD2 3.34Å
383	C	91.1	Very high	93.1	Very high	31 Å²	31	52.9 Å²	52.9	21%	0.209	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.4	165.1	179.9	61.7	0	0	0	0	113.1	L374 Y426	L374-C383 PolarHBondContact N-O 2.58Å; L374-C383 PolarHBondContact O-N 3.49Å; C383-Y426 CarbonylContact C-O 3.45Å; C383-Y426 VanDerWaalsContact CA-O 3.24Å; C383-Y426 WeakPolarHBondContact CA-O 3.2Å
384	T	92.1	Very high	93.2	Very high	25 Å²	25	52.5 Å²	52.5	15%	0.153	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	143.3	163.3	61.8	0	0	0	0	111	C372 F373 Y426	C372-T384 CarbonylContact O-C 3.6Å; C372-T384 VanDerWaalsContact O-CA 3.26Å; C372-T384 WeakPolarHBondContact O-CA 3.43Å; F373-T384 HydrophobicContact CD1-CG2 3.96Å; F373-T384 HydrophobicContact CE1-CG2 3.65Å; F373-T384 HydrophobicContact CZ-CG2 4.07Å; T384-Y426 PolarHBondContact N-O 2.93Å; T384-Y426 PolarHBondContact OG1-O 2.64Å
385	C	91	Very high	93.2	Very high	14 Å²	14	58.9 Å²	58.9	10%	0.095	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	169.6	179.1	72.4	0	0	0	0	113.3	C372 L374 K389	C372-C385 WeakPolarHBondContact CB-O 3.44Å; C372-C385 PolarHBondContact N-O 3.31Å; C372-C385 PolarHBondContact O-N 3.05Å; C372-C385 PolarHBondContact O-SG 3Å; L374-C385 HydrophobicContact CD1-CB 4.32Å; C385-K389 HydrophobicContact CB-CB 4.47Å; C385-K389 HydrophobicContact CB-CD 4.14Å
386	D	91.1	Very high	93.3	Very high	60 Å²	60	64.4 Å²	64.4	32%	0.321	32%	0.322	S	S	.	.			trans	-69.8	145.3	173.6	-69	-0.6	0	0	0	110.2	K388 K389 A390 R445	D386-K388 PolarHBondContact O-N 3.39Å; D386-K388 VanDerWaalsContact O-N 3.17Å; D386-K389 WeakPolarHBondContact O-CA 3.45Å; D386-K389 WeakPolarHBondContact O-CB 3.37Å; D386-K389 PolarHBondContact O-N 3.34Å; D386-A390 PolarHBondContact O-N 2.76Å; D386-A390 VanDerWaalsContact O-N 3.15Å; D386-R445 IonicContact OD1-NH2 3.3Å; D386-R445 IonicContact OD2-CZ 3.94Å; D386-R445 IonicContact OD2-NH2 2.7Å; D386-R445 PolarHBondContact OD2-NH2 3.37Å
387	K	91.2	Very high	93.3	Very high	102 Å²	102	67 Å²	67	44%	0.443	35%	0.349	S	S	.	.	H	α-helix	trans	-58.2	-36.6	-176.4	-172.4	168.3	-174.1	168.8	0	112.2	D370 C372 K389 A390 L391	D370-K387 HydrophobicContact CB-CB 3.91Å; D370-K387 WeakPolarHBondContact OD2-CB 3.26Å; D370-K387 PolarHBondContact OD2-N 2.9Å; C372-K387 VanDerWaalsContact SG-CA 3.58Å; K387-K389 VanDerWaalsContact C-N 3.26Å; K387-K389 PolarHBondContact O-N 3.3Å; K387-A390 PolarHBondContact O-N 2.88Å; K387-L391 HydrophobicContact CG-CD1 4.11Å; K387-L391 HydrophobicContact CG-CG 4.34Å; K387-L391 WeakPolarHBondContact O-CB 3.48Å; K387-L391 VanDerWaalsContact O-CG 3.29Å; K387-L391 WeakPolarHBondContact O-CG 3.47Å; K387-L391 PolarHBondContact O-N 2.72Å
388	K	92.3	Very high	93.4	Very high	179 Å²	179	67.6 Å²	67.6	78%	0.778	35%	0.349	S	S	*	.	H	α-helix	trans	-59.7	-36	175	-172.2	177	-179.6	179.1	0	112.5	D386 W392	D386-K388 PolarHBondContact O-N 3.39Å; D386-K388 VanDerWaalsContact O-N 3.17Å; K388-W392 WeakPolarHBondContact O-CB 3.2Å; K388-W392 PolarHBondContact O-N 3.27Å; K388-W392 VanDerWaalsContact O-N 3.09Å
389	K	91.9	Very high	93.5	Very high	103 Å²	103	63 Å²	63	45%	0.448	33%	0.327	S	S	.	.	H	α-helix	trans	-74.1	-42.5	177.5	-175.6	177.3	178.5	-175.6	0	110.9	C385 D386 K387 W392 Y393	C385-K389 HydrophobicContact CB-CB 4.47Å; C385-K389 HydrophobicContact CB-CD 4.14Å; D386-K389 WeakPolarHBondContact O-CA 3.45Å; D386-K389 WeakPolarHBondContact O-CB 3.37Å; D386-K389 PolarHBondContact O-N 3.34Å; K387-K389 VanDerWaalsContact C-N 3.26Å; K387-K389 PolarHBondContact O-N 3.3Å; K389-W392 WeakPolarHBondContact O-CB 3.35Å; K389-W392 PolarHBondContact O-N 3.37Å; K389-Y393 HydrophobicContact CD-CE2 4.47Å; K389-Y393 WeakPolarHBondContact CE-OH 3.49Å; K389-Y393 HydrophobicContact CG-CE2 3.91Å; K389-Y393 WeakPolarHBondContact O-CD2 3.35Å; K389-Y393 PolarHBondContact O-N 3.16Å
390	A	93.7	Very high	93.8	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-59	-47.7	175	0	0	0	0	0	111.4	C372 D386 K387 W392 Y393 L394 F407 V409	C372-A390 HydrophobicContact CB-CB 3.91Å; D386-A390 PolarHBondContact O-N 2.76Å; D386-A390 VanDerWaalsContact O-N 3.15Å; K387-A390 PolarHBondContact O-N 2.88Å; A390-W392 VanDerWaalsContact C-N 3.31Å; A390-W392 PolarHBondContact O-N 3.27Å; A390-Y393 PolarHBondContact O-N 3.42Å; A390-L394 PolarHBondContact O-N 3.03Å; A390-F407 HydrophobicContact CB-CD1 4.06Å; A390-F407 HydrophobicContact CB-CE1 3.77Å; A390-V409 HydrophobicContact CB-CG2 3.96Å
391	L	94.9	Very high	94	Very high	67 Å²	67	66.9 Å²	66.9	35%	0.351	34%	0.338	S	S	.	.	H	α-helix	trans	-59.8	-38.6	175.3	-70.8	171.7	0	0	0	112.5	K387 Y393 L394 D395 F407	K387-L391 HydrophobicContact CG-CD1 4.11Å; K387-L391 HydrophobicContact CG-CG 4.34Å; K387-L391 WeakPolarHBondContact O-CB 3.48Å; K387-L391 VanDerWaalsContact O-CG 3.29Å; K387-L391 WeakPolarHBondContact O-CG 3.47Å; K387-L391 PolarHBondContact O-N 2.72Å; L391-Y393 VanDerWaalsContact C-N 3.27Å; L391-Y393 PolarHBondContact O-N 3Å; L391-L394 HydrophobicContact CD2-CD1 4.29Å; L391-L394 WeakPolarHBondContact O-CB 3.49Å; L391-L394 PolarHBondContact O-N 3.41Å; L391-L394 VanDerWaalsContact O-N 3.08Å; L391-D395 PolarHBondContact O-N 2.94Å; L391-F407 HydrophobicContact CD2-CZ 4.13Å
392	W	95.8	Very high	94.1	Very high	128 Å²	128	69.7 Å²	69.7	49%	0.485	35%	0.347	S	S	.	.	H	α-helix	trans	-58.3	-36.6	177.2	179	91.6	0	0	0	113	K388 K389 A390 K396 I398	K388-W392 WeakPolarHBondContact O-CB 3.2Å; K388-W392 PolarHBondContact O-N 3.27Å; K388-W392 VanDerWaalsContact O-N 3.09Å; K389-W392 WeakPolarHBondContact O-CB 3.35Å; K389-W392 PolarHBondContact O-N 3.37Å; A390-W392 VanDerWaalsContact C-N 3.31Å; A390-W392 PolarHBondContact O-N 3.27Å; W392-K396 HydrophobicContact CD2-CG 4.04Å; W392-K396 HydrophobicContact CE3-CG 4.48Å; W392-K396 HydrophobicContact CG-CG 4.49Å; W392-K396 HydrophobicContact CH2-CG 4.34Å; W392-K396 HydrophobicContact CZ2-CG 3.88Å; W392-K396 VanDerWaalsContact O-CB 3.29Å; W392-K396 WeakPolarHBondContact O-CB 3.35Å; W392-K396 WeakPolarHBondContact O-CG 3.36Å; W392-K396 PolarHBondContact O-N 3.18Å; W392-I398 HydrophobicContact CH2-CD1 3.94Å; W392-I398 HydrophobicContact CZ3-CD1 3.69Å
393	Y	95.8	Very high	94.3	Very high	32 Å²	32	70.6 Å²	70.6	13%	0.125	36%	0.355	C	S	.	.	H	α-helix	trans	-67.6	-38.8	175.8	-71.7	-74.7	0	0	0	112.2	L374 K389 A390 L391 G397 I398 G399 L411 F413	L374-Y393 HydrophobicContact CD1-CD2 4.45Å; L374-Y393 HydrophobicContact CD1-CE2 3.79Å; L374-Y393 HydrophobicContact CD2-CD2 4.04Å; L374-Y393 HydrophobicContact CD2-CE2 4.2Å; K389-Y393 HydrophobicContact CD-CE2 4.47Å; K389-Y393 WeakPolarHBondContact CE-OH 3.49Å; K389-Y393 HydrophobicContact CG-CE2 3.91Å; K389-Y393 WeakPolarHBondContact O-CD2 3.35Å; K389-Y393 PolarHBondContact O-N 3.16Å; A390-Y393 PolarHBondContact O-N 3.42Å; L391-Y393 VanDerWaalsContact C-N 3.27Å; L391-Y393 PolarHBondContact O-N 3Å; Y393-G397 PolarHBondContact O-N 2.83Å; Y393-I398 HydrophobicContact CD1-CD1 3.83Å; Y393-I398 HydrophobicContact CD1-CG1 3.99Å; Y393-I398 HydrophobicContact CE1-CD1 4.33Å; Y393-I398 PolarHBondContact O-N 3.34Å; Y393-I398 VanDerWaalsContact O-N 3.08Å; Y393-G399 PolarHBondContact O-N 3.07Å; Y393-L411 HydrophobicContact CD1-CD2 3.52Å; Y393-L411 HydrophobicContact CD2-CD2 4.08Å; Y393-L411 HydrophobicContact CE1-CD2 3.75Å; Y393-L411 HydrophobicContact CE2-CD2 4.28Å; Y393-L411 HydrophobicContact CG-CD2 3.71Å; Y393-F413 HydrophobicContact CD1-CE1 4.19Å; Y393-F413 HydrophobicContact CE1-CE1 4.05Å; Y393-F413 AromaticContact CE1-CZ 3.98Å; Y393-F413 HydrophobicContact CE1-CZ 3.98Å
394	L	95.6	Very high	94.3	Very high	43 Å²	43	76.4 Å²	76.4	23%	0.225	38%	0.379	C	S	.	.	H	α-helix	trans	-65.2	-50	175.3	-59	178.6	0	0	0	110.9	A390 L391 K396 G397 G399 L401 F407 V409	A390-L394 PolarHBondContact O-N 3.03Å; L391-L394 HydrophobicContact CD2-CD1 4.29Å; L391-L394 WeakPolarHBondContact O-CB 3.49Å; L391-L394 PolarHBondContact O-N 3.41Å; L391-L394 VanDerWaalsContact O-N 3.08Å; L394-K396 PolarHBondContact O-N 3.46Å; L394-G397 PolarHBondContact O-N 3.3Å; L394-G399 WeakPolarHBondContact CD2-O 3.39Å; L394-L401 HydrophobicContact CD1-CB 4.27Å; L394-L401 HydrophobicContact CD1-CD1 4.42Å; L394-L401 HydrophobicContact CD2-CB 4.09Å; L394-L401 VanDerWaalsContact CD2-N 3.34Å; L394-F407 HydrophobicContact CD1-CZ 4.2Å; L394-V409 HydrophobicContact CD1-CG2 4.09Å; L394-V409 HydrophobicContact CD2-CG1 3.8Å; L394-V409 HydrophobicContact CD2-CG2 4.03Å; L394-V409 HydrophobicContact CG-CG1 4.28Å; L394-V409 HydrophobicContact CG-CG2 4.05Å
395	D	96.3	Very high	94.1	Very high	137 Å²	137	82.4 Å²	82.4	73%	0.733	41%	0.41	S	S	*	.	H	α-helix	trans	-61.3	-31.3	-179.6	-70.3	-8.4	0	0	0	112.3	L391 G397	L391-D395 PolarHBondContact O-N 2.94Å; D395-G397 VanDerWaalsContact C-N 3.3Å
396	K	96.2	Very high	94.1	Very high	131 Å²	131	84.9 Å²	84.9	57%	0.57	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-4	176.2	-71.8	-64.4	-178.3	-172.4	0	113.8	W392 L394 I398	W392-K396 HydrophobicContact CD2-CG 4.04Å; W392-K396 HydrophobicContact CE3-CG 4.48Å; W392-K396 HydrophobicContact CG-CG 4.49Å; W392-K396 HydrophobicContact CH2-CG 4.34Å; W392-K396 HydrophobicContact CZ2-CG 3.88Å; W392-K396 VanDerWaalsContact O-CB 3.29Å; W392-K396 WeakPolarHBondContact O-CB 3.35Å; W392-K396 WeakPolarHBondContact O-CG 3.36Å; W392-K396 PolarHBondContact O-N 3.18Å; L394-K396 PolarHBondContact O-N 3.46Å; K396-I398 HydrophobicContact CB-CD1 4.03Å; K396-I398 HydrophobicContact CB-CG1 3.72Å; K396-I398 PolarHBondContact O-N 3.25Å
397	G	95.5	Very high	94.3	Very high	54 Å²	54	83.5 Å²	83.5	56%	0.557	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	21.3	-178.3	0	0	0	0	0	113.7	Y393 L394 D395	Y393-G397 PolarHBondContact O-N 2.83Å; L394-G397 PolarHBondContact O-N 3.3Å; D395-G397 VanDerWaalsContact C-N 3.3Å
398	I	96.3	Very high	94.5	Very high	57 Å²	57	80.1 Å²	80.1	29%	0.292	40%	0.403	S	S	.	.	S	Bend	trans	-113.7	9	180	57.3	170.8	0	0	0	112.1	W392 Y393 K396 L412 F413	W392-I398 HydrophobicContact CH2-CD1 3.94Å; W392-I398 HydrophobicContact CZ3-CD1 3.69Å; Y393-I398 HydrophobicContact CD1-CD1 3.83Å; Y393-I398 HydrophobicContact CD1-CG1 3.99Å; Y393-I398 HydrophobicContact CE1-CD1 4.33Å; Y393-I398 PolarHBondContact O-N 3.34Å; Y393-I398 VanDerWaalsContact O-N 3.08Å; K396-I398 HydrophobicContact CB-CD1 4.03Å; K396-I398 HydrophobicContact CB-CG1 3.72Å; K396-I398 PolarHBondContact O-N 3.25Å; I398-L412 PolarHBondContact O-N 2.99Å; I398-F413 HydrophobicContact CB-CD1 4.13Å; I398-F413 HydrophobicContact CB-CE1 4.24Å; I398-F413 HydrophobicContact CD1-CE1 4.02Å; I398-F413 HydrophobicContact CG1-CE1 4.38Å
399	G	96.1	Very high	94.7	Very high	9 Å²	9	71.6 Å²	71.6	9%	0.093	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	156	169.7	0	0	0	0	0	110.6	Y393 L394 R410	Y393-G399 PolarHBondContact O-N 3.07Å; L394-G399 WeakPolarHBondContact CD2-O 3.39Å; G399-R410 CarbonylContact C-O 3.49Å; G399-R410 WeakPolarHBondContact CA-O 3.5Å
400	E	96.6	Very high	94.9	Very high	98 Å²	98	69.7 Å²	69.7	46%	0.458	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	138.6	178	-176.7	-179.6	-155.2	0	0	109.7	Q402 V409 R410 L412	E400-Q402 PolarHBondContact O-N 3.09Å; E400-V409 CarbonylContact O-C 3.56Å; E400-V409 WeakPolarHBondContact O-CA 3.29Å; E400-R410 PolarHBondContact N-O 3.45Å; E400-R410 PolarHBondContact O-N 3.17Å; E400-R410 IonicContact OE2-CZ 3.81Å; E400-R410 IonicContact OE2-NE 3.38Å; E400-R410 IonicContact OE2-NH2 3.19Å; E400-R410 PolarHBondContact OE2-NH2 3.2Å; E400-L412 HydrophobicContact CB-CD2 4.26Å
401	L	96.8	Very high	95.1	Very high	68 Å²	68	70 Å²	70	36%	0.356	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	118.1	176.8	-178.2	66.5	0	0	0	109	L394 S403 E404 F407 V409	L394-L401 HydrophobicContact CD1-CB 4.27Å; L394-L401 HydrophobicContact CD1-CD1 4.42Å; L394-L401 HydrophobicContact CD2-CB 4.09Å; L394-L401 VanDerWaalsContact CD2-N 3.34Å; L401-S403 WeakPolarHBondContact CD1-O 3.38Å; L401-E404 HydrophobicContact CD2-CG 3.9Å; L401-F407 HydrophobicContact CD1-CD2 4.28Å; L401-F407 HydrophobicContact CD1-CE1 4.18Å; L401-F407 HydrophobicContact CD1-CE2 3.78Å; L401-F407 HydrophobicContact CD1-CZ 3.73Å; L401-V409 HydrophobicContact CD1-CG2 4.46Å
402	Q	95.3	Very high	95.1	Very high	110 Å²	110	71.1 Å²	71.1	51%	0.514	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-35.6	179.7	-172.5	177.1	15.5	0	0	112	N375 E400 I408	N375-Q402 PolarHBondContact ND2-OE1 3.43Å; N375-Q402 VanDerWaalsContact ND2-OE1 3.14Å; E400-Q402 PolarHBondContact O-N 3.09Å; Q402-I408 HydrophobicContact CB-CB 4.32Å; Q402-I408 HydrophobicContact CB-CG2 4.16Å; Q402-I408 PolarHBondContact N-O 3.09Å
403	S	94.6	Very high	95	Very high	35 Å²	35	68.9 Å²	68.9	25%	0.245	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	143	-179	172.7	0	0	0	0	110	L401 D405 P406 F407 I408	L401-S403 WeakPolarHBondContact CD1-O 3.38Å; S403-D405 PolarHBondContact OG-N 3.09Å; S403-D405 PolarHBondContact OG-O 3.04Å; S403-P406 CarbonylContact C-O 3.59Å; S403-P406 VanDerWaalsContact CB-O 3.27Å; S403-P406 WeakPolarHBondContact CB-O 3.45Å; S403-P406 PolarHBondContact OG-O 3.19Å; S403-F407 CarbonylContact O-C 3.49Å; S403-F407 WeakPolarHBondContact O-CA 3.09Å; S403-I408 PolarHBondContact N-O 3.11Å; S403-I408 PolarHBondContact O-N 3.23Å
404	E	91.3	Very high	94.9	Very high	153 Å²	153	72.8 Å²	72.8	72%	0.715	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-31.2	175	-70.8	-171.5	173.8	0	0	113	L401 P406 F407	L401-E404 HydrophobicContact CD2-CG 3.9Å; E404-P406 CarbonylContact C-O 3.51Å; E404-F407 WeakPolarHBondContact O-CA 3.21Å; E404-F407 PolarHBondContact O-N 2.84Å
405	D	88.6	Confident	94.6	Very high	151 Å²	151	71.6 Å²	71.6	81%	0.807	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.3	107.3	176.8	-169.6	18.7	0	0	0	111.8	S403	S403-D405 PolarHBondContact OG-N 3.09Å; S403-D405 PolarHBondContact OG-O 3.04Å
406	P	90.6	Very high	93.9	Very high	65 Å²	65	71.5 Å²	71.5	42%	0.422	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	cis	-62.6	154.9	-5.7	28.4	-35	0	0	0	111.2	F373 S403 E404 I408	F373-P406 HydrophobicContact CD2-CB 4.22Å; F373-P406 HydrophobicContact CE2-CB 4.18Å; S403-P406 CarbonylContact C-O 3.59Å; S403-P406 VanDerWaalsContact CB-O 3.27Å; S403-P406 WeakPolarHBondContact CB-O 3.45Å; S403-P406 PolarHBondContact OG-O 3.19Å; E404-P406 CarbonylContact C-O 3.51Å; P406-I408 HydrophobicContact CG-CD1 4.11Å; P406-I408 HydrophobicContact CG-CG1 4.2Å; P406-I408 WeakPolarHBondContact O-CG1 3.32Å; P406-I408 PolarHBondContact O-N 3.33Å
407	F	94.3	Very high	93.1	Very high	32 Å²	32	67.1 Å²	67.1	14%	0.14	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	106	-178.7	-163	-89.6	0	0	0	110.3	C372 F373 A390 L391 L394 L401 S403 E404 V409	C372-F407 CarbonylContact C-O 3.59Å; C372-F407 VanDerWaalsContact CA-O 3.29Å; C372-F407 WeakPolarHBondContact CA-O 3.11Å; C372-F407 HydrophobicContact CB-CB 4.34Å; C372-F407 HydrophobicContact CB-CD1 3.94Å; F373-F407 PolarHBondContact N-O 3.11Å; A390-F407 HydrophobicContact CB-CD1 4.06Å; A390-F407 HydrophobicContact CB-CE1 3.77Å; L391-F407 HydrophobicContact CD2-CZ 4.13Å; L394-F407 HydrophobicContact CD1-CZ 4.2Å; L401-F407 HydrophobicContact CD1-CD2 4.28Å; L401-F407 HydrophobicContact CD1-CE1 4.18Å; L401-F407 HydrophobicContact CD1-CE2 3.78Å; L401-F407 HydrophobicContact CD1-CZ 3.73Å; S403-F407 CarbonylContact O-C 3.49Å; S403-F407 WeakPolarHBondContact O-CA 3.09Å; E404-F407 WeakPolarHBondContact O-CA 3.21Å; E404-F407 PolarHBondContact O-N 2.84Å; F407-V409 HydrophobicContact CD1-CG2 4.26Å; F407-V409 HydrophobicContact CE1-CG2 3.73Å
408	I	95.8	Very high	92.7	Very high	31 Å²	31	67.4 Å²	67.4	16%	0.159	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.8	-175.4	-52.5	-178.2	0	0	0	109.9	F373 N375 Q402 S403 P406	F373-I408 HydrophobicContact CB-CG1 4.14Å; F373-I408 HydrophobicContact CB-CG2 4.39Å; F373-I408 WeakPolarHBondContact O-CA 3.28Å; N375-I408 WeakPolarHBondContact ND2-CG2 3.37Å; Q402-I408 HydrophobicContact CB-CB 4.32Å; Q402-I408 HydrophobicContact CB-CG2 4.16Å; Q402-I408 PolarHBondContact N-O 3.09Å; S403-I408 PolarHBondContact N-O 3.11Å; S403-I408 PolarHBondContact O-N 3.23Å; P406-I408 HydrophobicContact CG-CD1 4.11Å; P406-I408 HydrophobicContact CG-CG1 4.2Å; P406-I408 WeakPolarHBondContact O-CG1 3.32Å; P406-I408 PolarHBondContact O-N 3.33Å
409	V	97.1	Very high	92.1	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	124.2	172.5	176	0	0	0	0	109.7	F373 L374 N375 A390 L394 E400 L401 F407	F373-V409 PolarHBondContact O-N 2.81Å; L374-V409 WeakPolarHBondContact CA-O 3.47Å; L374-V409 HydrophobicContact CD2-CB 3.97Å; L374-V409 HydrophobicContact CD2-CG1 4.37Å; N375-V409 PolarHBondContact N-O 3.32Å; A390-V409 HydrophobicContact CB-CG2 3.96Å; L394-V409 HydrophobicContact CD1-CG2 4.09Å; L394-V409 HydrophobicContact CD2-CG1 3.8Å; L394-V409 HydrophobicContact CD2-CG2 4.03Å; L394-V409 HydrophobicContact CG-CG1 4.28Å; L394-V409 HydrophobicContact CG-CG2 4.05Å; E400-V409 CarbonylContact O-C 3.56Å; E400-V409 WeakPolarHBondContact O-CA 3.29Å; L401-V409 HydrophobicContact CD1-CG2 4.46Å; F407-V409 HydrophobicContact CD1-CG2 4.26Å; F407-V409 HydrophobicContact CE1-CG2 3.73Å
410	R	96.8	Very high	91.2	Very high	63 Å²	63	69.5 Å²	69.5	24%	0.238	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	124.8	174.7	-171.7	175.2	66.6	98.1	1.9	109.4	N375 A376 P377 G399 E400	N375-R410 HydrophobicContact CB-CG 4.45Å; A376-R410 WeakPolarHBondContact O-CG 3.31Å; P377-R410 PolarHBondContact O-NH1 3.21Å; G399-R410 CarbonylContact C-O 3.49Å; G399-R410 WeakPolarHBondContact CA-O 3.5Å; E400-R410 PolarHBondContact N-O 3.45Å; E400-R410 PolarHBondContact O-N 3.17Å; E400-R410 IonicContact OE2-CZ 3.81Å; E400-R410 IonicContact OE2-NE 3.38Å; E400-R410 IonicContact OE2-NH2 3.19Å; E400-R410 PolarHBondContact OE2-NH2 3.2Å
411	L	96.6	Very high	90.4	Very high	5 Å²	5	67.6 Å²	67.6	3%	0.026	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	144.8	176	-58	-176.6	0	0	0	110.2	L374 N375 P377 L382 Y393 F413 P415	L374-L411 HydrophobicContact CD2-CD2 4.4Å; N375-L411 PolarHBondContact O-N 3.08Å; P377-L411 WeakPolarHBondContact CA-O 3.39Å; P377-L411 WeakPolarHBondContact CG-O 3.3Å; L382-L411 HydrophobicContact CD1-CD1 3.68Å; L382-L411 HydrophobicContact CD1-CG 4.39Å; Y393-L411 HydrophobicContact CD1-CD2 3.52Å; Y393-L411 HydrophobicContact CD2-CD2 4.08Å; Y393-L411 HydrophobicContact CE1-CD2 3.75Å; Y393-L411 HydrophobicContact CE2-CD2 4.28Å; Y393-L411 HydrophobicContact CG-CD2 3.71Å; L411-F413 HydrophobicContact CB-CD1 4.41Å; L411-F413 HydrophobicContact CB-CE1 4.28Å; L411-F413 HydrophobicContact CD1-CE1 4.36Å; L411-F413 HydrophobicContact CD1-CZ 4.11Å; L411-F413 HydrophobicContact CD2-CE1 4.22Å; L411-P415 HydrophobicContact CD1-CB 4.49Å
412	L	95.4	Very high	89.4	Confident	91 Å²	91	71.4 Å²	71.4	48%	0.476	38%	0.383	S	S	.	.	S	Bend	trans	-96.9	7.1	177.9	-60.2	179.2	0	0	0	113	I398 E400	I398-L412 PolarHBondContact O-N 2.99Å; E400-L412 HydrophobicContact CB-CD2 4.26Å
413	F	94.3	Very high	88.6	Confident	82 Å²	82	73.7 Å²	73.7	36%	0.36	39%	0.394	S	S	.	.	S	Bend	trans	-136.5	160.9	179.6	68	-85.3	0	0	0	110.5	P377 Y393 I398 L411 P415	P377-F413 WeakPolarHBondContact CD-O 3.46Å; P377-F413 WeakPolarHBondContact CG-O 3.05Å; Y393-F413 HydrophobicContact CD1-CE1 4.19Å; Y393-F413 HydrophobicContact CE1-CE1 4.05Å; Y393-F413 AromaticContact CE1-CZ 3.98Å; Y393-F413 HydrophobicContact CE1-CZ 3.98Å; I398-F413 HydrophobicContact CB-CD1 4.13Å; I398-F413 HydrophobicContact CB-CE1 4.24Å; I398-F413 HydrophobicContact CD1-CE1 4.02Å; I398-F413 HydrophobicContact CG1-CE1 4.38Å; L411-F413 HydrophobicContact CB-CD1 4.41Å; L411-F413 HydrophobicContact CB-CE1 4.28Å; L411-F413 HydrophobicContact CD1-CE1 4.36Å; L411-F413 HydrophobicContact CD1-CZ 4.11Å; L411-F413 HydrophobicContact CD2-CE1 4.22Å; F413-P415 WeakPolarHBondContact O-CD 3.47Å
414	E	93.1	Very high	88.2	Confident	113 Å²	113	73.3 Å²	73.3	53%	0.528	39%	0.388	S	S	.	.			trans	-73.1	119.5	179.6	-173.9	57.2	-150.8	0	0	110.9	R418	E414-R418 IonicContact OE1-CZ 2.66Å; E414-R418 IonicContact OE1-NE 3.98Å; E414-R418 PolarHBondContact OE1-NE 2.79Å; E414-R418 IonicContact OE1-NH2 3.14Å; E414-R418 PolarHBondContact OE1-NH2 3.26Å; E414-R418 IonicContact OE2-CZ 3.45Å; E414-R418 IonicContact OE2-NH2 2.94Å; E414-R418 PolarHBondContact OE2-NH2 3.01Å
415	P	89.4	Confident	88.1	Confident	18 Å²	18	66.1 Å²	66.1	12%	0.117	36%	0.355	C	S	.	.			trans	-70.2	147.7	-180	30.2	-36.5	0	0	0	111.4	A376 L382 L411 F413 G417 R418	A376-P415 HydrophobicContact CB-CG 4.41Å; L382-P415 HydrophobicContact CD1-CB 4.05Å; L382-P415 HydrophobicContact CD1-CG 3.86Å; L382-P415 HydrophobicContact CD2-CG 3.9Å; L411-P415 HydrophobicContact CD1-CB 4.49Å; F413-P415 WeakPolarHBondContact O-CD 3.47Å; P415-G417 PolarHBondContact O-N 2.81Å; P415-R418 HydrophobicContact CG-CG 4.15Å
416	S	81	Confident	88.2	Confident	135 Å²	135	60 Å²	60	94%	0.944	32%	0.32	S	S	*	.	S	Bend	trans	-66.1	-10.4	179.2	-44.3	0	0	0	0	114.4
417	G	80.3	Confident	88.1	Confident	40 Å²	40	58.1 Å²	58.1	41%	0.412	31%	0.307	S	S	.	.			trans	-158.3	141.6	178.1	0	0	0	0	0	111.9	P415	P415-G417 PolarHBondContact O-N 2.81Å
418	R	85.9	Confident	87.9	Confident	60 Å²	60	58.4 Å²	58.4	23%	0.226	31%	0.312	C	S	.	.			trans	-118.4	155.2	176.4	-67.1	175.4	173.6	-117.3	9.3	110.3	D378 L382 E414 P415	D378-R418 IonicContact OD1-NH1 2.74Å; D378-R418 PolarHBondContact OD1-NH1 3.43Å; D378-R418 IonicContact OD1-NH2 2.62Å; D378-R418 IonicContact OD2-CZ 3.28Å; D378-R418 IonicContact OD2-NH1 2.82Å; D378-R418 PolarHBondContact OD2-NH1 3.25Å; D378-R418 IonicContact OD2-NH2 2.93Å; D378-R418 PolarHBondContact OD2-NH2 3.41Å; D378-R418 VanDerWaalsContact OD2-NH2 3.17Å; L382-R418 HydrophobicContact CD2-CG 4.14Å; E414-R418 IonicContact OE1-CZ 2.66Å; E414-R418 IonicContact OE1-NE 3.98Å; E414-R418 PolarHBondContact OE1-NE 2.79Å; E414-R418 IonicContact OE1-NH2 3.14Å; E414-R418 PolarHBondContact OE1-NH2 3.26Å; E414-R418 IonicContact OE2-CZ 3.45Å; E414-R418 IonicContact OE2-NH2 2.94Å; E414-R418 PolarHBondContact OE2-NH2 3.01Å; P415-R418 HydrophobicContact CG-CG 4.15Å
419	P	84.1	Confident	87.6	Confident	19 Å²	19	59.4 Å²	59.4	12%	0.123	32%	0.324	C	S	.	.			trans	-63.1	140.3	171	-19.3	32.3	0	0	0	111	P381 L382 S421 D424 L427	P381-P419 WeakPolarHBondContact O-CG 3.49Å; L382-P419 WeakPolarHBondContact O-CG 3.23Å; P419-S421 VanDerWaalsContact C-N 3.31Å; P419-D424 HydrophobicContact CB-CB 4.21Å; P419-L427 HydrophobicContact CB-CD1 4.27Å; P419-L427 HydrophobicContact CG-CD1 4.28Å; P419-L427 HydrophobicContact CG-CD2 4.12Å; P419-L427 HydrophobicContact CG-CG 4.34Å
420	D	77.4	Confident	87.4	Confident	90 Å²	90	60 Å²	60	48%	0.481	33%	0.327	S	S	.	.	S	Bend	trans	-82.1	-15.6	178.9	-62.1	0.4	0	0	0	111.9	K625 R628	D420-K625 WeakPolarHBondContact OD1-CE 3.44Å; D420-K625 IonicContact OD1-NZ 2.83Å; D420-K625 PolarHBondContact OD1-NZ 2.98Å; D420-K625 WeakPolarHBondContact OD2-CD 3.4Å; D420-K625 WeakPolarHBondContact OD2-CE 3.28Å; D420-K625 IonicContact OD2-NZ 3.21Å; D420-K625 PolarHBondContact OD2-NZ 2.96Å; D420-R628 IonicContact OD2-CZ 3.48Å; D420-R628 IonicContact OD2-NH2 3.23Å; D420-R628 PolarHBondContact OD2-NH2 3.44Å
421	S	80.5	Confident	87.1	Confident	59 Å²	59	63.7 Å²	63.7	41%	0.413	35%	0.347	S	S	.	.	S	Bend	trans	-141	150.3	-171.8	167	0	0	0	0	109.8	P419 Q423	P419-S421 VanDerWaalsContact C-N 3.31Å; S421-Q423 PolarHBondContact O-N 3.17Å; S421-Q423 PolarHBondContact OG-N 3.44Å; S421-Q423 PolarHBondContact OG-O 2.94Å; S421-Q423 VanDerWaalsContact OG-O 3.06Å
422	Q	75.8	Confident	86.9	Confident	148 Å²	148	65.3 Å²	65.3	69%	0.692	36%	0.355	S	S	*	.	S	Bend	trans	-70.2	-20.2	170.3	-64.2	-66.3	-14.1	0	0	112.3
423	Q	78.8	Confident	86.8	Confident	158 Å²	158	62 Å²	62	74%	0.738	34%	0.338	S	S	*	.	S	Bend	trans	-106.8	88.9	172.1	-69.5	180	2.6	0	0	108.8	S421	S421-Q423 PolarHBondContact O-N 3.17Å; S421-Q423 PolarHBondContact OG-N 3.44Å; S421-Q423 PolarHBondContact OG-O 2.94Å; S421-Q423 VanDerWaalsContact OG-O 3.06Å
424	D	85.8	Confident	86.8	Confident	26 Å²	26	58.1 Å²	58.1	14%	0.139	32%	0.321	C	S	.	.			trans	-127.4	142.8	-178.9	-174.9	-73.7	0	0	0	110.7	P419 Y426 L427 T428	P419-D424 HydrophobicContact CB-CB 4.21Å; D424-Y426 PolarHBondContact O-N 2.9Å; D424-Y426 WeakPolarHBondContact OD1-CB 3.3Å; D424-Y426 WeakPolarHBondContact OD1-CD2 3.37Å; D424-Y426 PolarHBondContact OD1-N 3.26Å; D424-L427 HydrophobicContact CB-CD1 3.96Å; D424-L427 HydrophobicContact CB-CG 4.04Å; D424-L427 WeakPolarHBondContact O-CB 3.46Å; D424-L427 PolarHBondContact O-N 3.47Å; D424-L427 VanDerWaalsContact O-N 3.07Å; D424-T428 PolarHBondContact O-OG1 3.47Å
425	Y	89.3	Confident	86.9	Confident	3 Å²	3	53 Å²	53	1%	0.012	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-55.7	-36.2	-179.1	174.6	-93.4	0	0	0	112.9	L427 T428 K430 S466 H467 P614 P615 W617	Y425-L427 VanDerWaalsContact C-N 3.3Å; Y425-L427 PolarHBondContact O-N 2.93Å; Y425-T428 PolarHBondContact O-N 3.32Å; Y425-K430 VanDerWaalsContact CE1-CE 3.49Å; Y425-K430 PolarHBondContact O-NZ 2.82Å; Y425-K430 WeakPolarHBondContact OH-CE 3.48Å; Y425-S466 PolarHBondContact OH-O 2.85Å; Y425-H467 HydrophobicContact CD1-CB 4.39Å; Y425-H467 AromaticContact CD1-ND1 3.74Å; Y425-H467 AromaticContact CD2-ND1 3.86Å; Y425-H467 HydrophobicContact CE1-CB 4.12Å; Y425-H467 AromaticContact CE1-ND1 3.86Å; Y425-H467 AromaticContact CE2-ND1 3.95Å; Y425-H467 AromaticContact CG-ND1 3.74Å; Y425-H467 AromaticContact CZ-ND1 3.95Å; Y425-P614 HydrophobicContact CE2-CB 3.91Å; Y425-P614 HydrophobicContact CE2-CG 4.4Å; Y425-P615 WeakPolarHBondContact CD2-O 3.2Å; Y425-W617 HydrophobicContact CD2-CB 4.47Å; Y425-W617 HydrophobicContact CE2-CB 4.02Å; Y425-W617 AromaticContact CE2-CD1 3.88Å; Y425-W617 HydrophobicContact CE2-CG 4.39Å
426	Y	89.6	Confident	87.3	Confident	21 Å²	21	52.3 Å²	52.3	8%	0.082	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-75.6	-20.1	-178.4	-57.9	-71.2	0	0	0	112.6	C383 T384 D424 T428 H464 S466 H621 N622	C383-Y426 CarbonylContact C-O 3.45Å; C383-Y426 VanDerWaalsContact CA-O 3.24Å; C383-Y426 WeakPolarHBondContact CA-O 3.2Å; T384-Y426 PolarHBondContact N-O 2.93Å; T384-Y426 PolarHBondContact OG1-O 2.64Å; D424-Y426 PolarHBondContact O-N 2.9Å; D424-Y426 WeakPolarHBondContact OD1-CB 3.3Å; D424-Y426 WeakPolarHBondContact OD1-CD2 3.37Å; D424-Y426 PolarHBondContact OD1-N 3.26Å; Y426-T428 VanDerWaalsContact C-N 3.35Å; Y426-H464 HydrophobicContact CE1-CB 3.99Å; Y426-H464 WeakPolarHBondContact CE1-O 3.44Å; Y426-H464 HydrophobicContact CE2-CB 4.23Å; Y426-H464 VanDerWaalsContact OH-CB 3.28Å; Y426-H464 WeakPolarHBondContact OH-CB 3.14Å; Y426-H464 PolarHBondContact OH-O 2.89Å; Y426-S466 WeakPolarHBondContact CD1-OG 3.27Å; Y426-S466 WeakPolarHBondContact CE1-OG 3.5Å; Y426-H621 AromaticContact CE2-CE1 3.96Å; Y426-H621 AromaticContact CE2-NE2 3.4Å; Y426-H621 WeakPolarHBondContact CE2-NE2 3.37Å; Y426-H621 AromaticContact CZ-NE2 3.5Å; Y426-H621 PolarHBondContact OH-NE2 2.95Å; Y426-H621 VanDerWaalsContact OH-NE2 3.15Å; Y426-N622 PolarHBondContact OH-ND2 2.96Å
427	L	89.8	Confident	87.9	Confident	27 Å²	27	48.3 Å²	48.3	14%	0.141	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-82.1	-16	175.6	-60.9	178.9	0	0	0	112.9	P381 L382 P419 D424 Y425	P381-L427 HydrophobicContact CB-CD2 3.74Å; L382-L427 VanDerWaalsContact C-CD2 3.42Å; L382-L427 WeakPolarHBondContact O-CD2 3.34Å; P419-L427 HydrophobicContact CB-CD1 4.27Å; P419-L427 HydrophobicContact CG-CD1 4.28Å; P419-L427 HydrophobicContact CG-CD2 4.12Å; P419-L427 HydrophobicContact CG-CG 4.34Å; D424-L427 HydrophobicContact CB-CD1 3.96Å; D424-L427 HydrophobicContact CB-CG 4.04Å; D424-L427 WeakPolarHBondContact O-CB 3.46Å; D424-L427 PolarHBondContact O-N 3.47Å; D424-L427 VanDerWaalsContact O-N 3.07Å; Y425-L427 VanDerWaalsContact C-N 3.3Å; Y425-L427 PolarHBondContact O-N 2.93Å
428	T	88.8	Confident	88.5	Confident	38 Å²	38	47.4 Å²	47.4	23%	0.233	26%	0.256	C	S	.	.	S	Bend	trans	-85.6	125.9	-174.4	-54.4	0	0	0	0	111.1	D424 Y425 Y426 K430 P615	D424-T428 PolarHBondContact O-OG1 3.47Å; Y425-T428 PolarHBondContact O-N 3.32Å; Y426-T428 VanDerWaalsContact C-N 3.35Å; T428-K430 PolarHBondContact O-NZ 2.96Å; T428-P615 HydrophobicContact CG2-CB 4.4Å; T428-P615 HydrophobicContact CG2-CG 4.26Å
429	A	89.9	Confident	88.7	Confident	52 Å²	52	49.5 Å²	49.5	43%	0.43	27%	0.266	S	S	.	.			trans	-63.8	139.5	170.5	0	0	0	0	0	110.9	N371 F373	N371-A429 HydrophobicContact CB-CB 4.16Å; F373-A429 HydrophobicContact CZ-CB 4.42Å
430	K	92.3	Very high	88.7	Confident	13 Å²	13	51.9 Å²	51.9	6%	0.057	29%	0.287	C	S	.	.			trans	-114.6	141.3	-171.6	-66.1	167.2	-173.9	62.8	0	111	Y369 N371 Y425 T428 P614	Y369-K430 HydrophobicContact CD1-CB 4.36Å; Y369-K430 HydrophobicContact CD1-CD 4.42Å; Y369-K430 HydrophobicContact CD2-CB 3.52Å; Y369-K430 HydrophobicContact CE1-CD 4.09Å; Y369-K430 HydrophobicContact CE2-CB 3.75Å; Y369-K430 HydrophobicContact CE2-CD 4.39Å; Y369-K430 HydrophobicContact CG-CB 3.86Å; N371-K430 PolarHBondContact ND2-O 2.95Å; N371-K430 PolarHBondContact OD1-N 3.12Å; Y425-K430 VanDerWaalsContact CE1-CE 3.49Å; Y425-K430 PolarHBondContact O-NZ 2.82Å; Y425-K430 WeakPolarHBondContact OH-CE 3.48Å; T428-K430 PolarHBondContact O-NZ 2.96Å; K430-P614 HydrophobicContact CG-CB 4.33Å
431	E	91.9	Very high	88.5	Confident	140 Å²	140	52.5 Å²	52.5	65%	0.654	29%	0.291	S	S	*	.			trans	-79.6	141.5	178.1	-62.5	-173.3	128.1	0	0	111.4	Y369 L433	Y369-E431 WeakPolarHBondContact CD2-O 3.33Å; E431-L433 VanDerWaalsContact C-N 3.27Å; E431-L433 HydrophobicContact CB-CD2 3.87Å; E431-L433 HydrophobicContact CB-CG 3.81Å; E431-L433 PolarHBondContact O-N 2.77Å; E431-L433 WeakPolarHBondContact OE2-CD2 3.42Å
432	N	92.1	Very high	88.3	Confident	38 Å²	38	52.4 Å²	52.4	20%	0.203	29%	0.29	C	S	.	.	S	Bend	trans	-85.1	68.4	178.2	-84.6	-71.7	0	0	0	110.8	L368 Y369 Y443	L368-N432 PolarHBondContact N-OD1 2.73Å; Y369-N432 PolarHBondContact N-OD1 2.81Å; Y369-N432 PolarHBondContact O-ND2 2.82Å; N432-Y443 HydrophobicContact CB-CE1 4.28Å; N432-Y443 HydrophobicContact CB-CE2 4.41Å; N432-Y443 WeakPolarHBondContact CB-OH 3.43Å; N432-Y443 WeakPolarHBondContact O-CE1 3.31Å
433	L	92.6	Very high	88.7	Confident	22 Å²	22	46.4 Å²	46.4	12%	0.115	26%	0.261	C	S	.	.	S	Bend	trans	-142.1	163.4	-179.2	55.3	73.4	0	0	0	111.9	E431 V435 K439 A440 L471 H612	E431-L433 VanDerWaalsContact C-N 3.27Å; E431-L433 HydrophobicContact CB-CD2 3.87Å; E431-L433 HydrophobicContact CB-CG 3.81Å; E431-L433 PolarHBondContact O-N 2.77Å; E431-L433 WeakPolarHBondContact OE2-CD2 3.42Å; L433-V435 PolarHBondContact O-N 3.48Å; L433-K439 CarbonylContact C-O 3.4Å; L433-K439 WeakPolarHBondContact CA-O 3.27Å; L433-A440 HydrophobicContact CB-CB 4.5Å; L433-L471 VanDerWaalsContact O-CB 3.26Å; L433-L471 WeakPolarHBondContact O-CB 3.19Å; L433-H612 HydrophobicContact CD1-CB 3.46Å; L433-H612 VanDerWaalsContact CD1-CB 3.46Å
434	C	94.1	Very high	89.2	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.233	C	C	.	.			trans	-67.6	115.9	169.9	177.8	0	0	0	0	110.1	V436 C437 G438 K439 L471 C473	C434-V436 PolarHBondContact O-N 3.23Å; C434-V436 PolarHBondContact SG-N 2.69Å; C434-C437 PolarHBondContact O-N 3.17Å; C434-C437 PolarHBondContact SG-SG 2.77Å; C434-G438 WeakPolarHBondContact O-CA 3.47Å; C434-G438 PolarHBondContact O-N 3.3Å; C434-K439 HydrophobicContact CB-CB 4.28Å; C434-K439 PolarHBondContact N-O 2.92Å; C434-L471 CarbonylContact C-O 3.55Å; C434-L471 WeakPolarHBondContact CA-O 3.19Å; C434-C473 HydrophobicContact CB-CB 3.98Å; C434-C473 PolarHBondContact SG-N 3.25Å
435	V	96.7	Very high	89.4	Confident	5 Å²	5	44 Å²	44	3%	0.03	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-19.6	179.7	-55.9	0	0	0	0	113.3	L433 L470 L471 L472 F604 P610 R611 H612 L613	L433-V435 PolarHBondContact O-N 3.48Å; V435-L470 HydrophobicContact CG1-CB 4.17Å; V435-L470 HydrophobicContact CG1-CD2 4.42Å; V435-L470 HydrophobicContact CG2-CB 4.14Å; V435-L470 HydrophobicContact CG2-CD1 4.18Å; V435-L471 PolarHBondContact N-O 3.21Å; V435-L472 HydrophobicContact CG2-CD1 4.04Å; V435-F604 HydrophobicContact CG2-CE1 4.28Å; V435-F604 HydrophobicContact CG2-CZ 3.85Å; V435-P610 HydrophobicContact CG2-CB 4.41Å; V435-P610 VanDerWaalsContact O-CB 3.3Å; V435-P610 WeakPolarHBondContact O-CB 3.39Å; V435-R611 PolarHBondContact O-N 2.7Å; V435-R611 VanDerWaalsContact O-N 3.1Å; V435-H612 WeakPolarHBondContact CA-O 3.36Å; V435-H612 WeakPolarHBondContact CB-O 3.38Å; V435-H612 CarbonylContact O-C 3.52Å; V435-H612 WeakPolarHBondContact O-CA 3.31Å; V435-H612 PolarHBondContact O-N 3.19Å; V435-L613 HydrophobicContact CB-CD2 4.36Å; V435-L613 HydrophobicContact CG2-CD2 4.45Å
436	V	96.3	Very high	89.6	Confident	4 Å²	4	44.5 Å²	44.5	2%	0.024	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-53	-178.8	-171.6	0	0	0	0	112.7	C434 L472 C476 F604 M608 P610 R611	C434-V436 PolarHBondContact O-N 3.23Å; C434-V436 PolarHBondContact SG-N 2.69Å; V436-L472 HydrophobicContact CG2-CG 4.29Å; V436-C476 HydrophobicContact CB-CB 4.28Å; V436-C476 HydrophobicContact CG2-CB 4.38Å; V436-F604 HydrophobicContact CG2-CE2 4.33Å; V436-F604 HydrophobicContact CG2-CZ 3.95Å; V436-M608 HydrophobicContact CG1-CB 4.4Å; V436-M608 HydrophobicContact CG1-CE 4.29Å; V436-M608 WeakPolarHBondContact CG1-O 3.49Å; V436-M608 HydrophobicContact CG2-CB 4.09Å; V436-M608 HydrophobicContact CG2-CE 4.12Å; V436-P610 HydrophobicContact CG2-CB 4.26Å; V436-R611 PolarHBondContact O-N 3.18Å
437	C	93.8	Very high	89.9	Confident	51 Å²	51	46.9 Å²	46.9	35%	0.345	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-0.2	-170.1	66.8	0	0	0	0	114.7	C434 K439 C476	C434-C437 PolarHBondContact O-N 3.17Å; C434-C437 PolarHBondContact SG-SG 2.77Å; C437-K439 PolarHBondContact O-N 3.22Å; C437-C476 VanDerWaalsContact SG-SG 3.67Å
438	G	93.1	Very high	90.2	Very high	22 Å²	22	45.7 Å²	45.7	23%	0.227	26%	0.255	C	S	.	.			trans	78.1	-2	177.4	0	0	0	0	0	115.3	C434 A440 H612	C434-G438 WeakPolarHBondContact O-CA 3.47Å; C434-G438 PolarHBondContact O-N 3.3Å; G438-A440 PolarHBondContact O-N 2.93Å; G438-A440 VanDerWaalsContact O-N 3.14Å; G438-H612 VanDerWaalsContact CA-CD2 3.42Å; G438-H612 WeakPolarHBondContact CA-CD2 3.18Å; G438-H612 WeakPolarHBondContact CA-NE2 3.41Å; G438-H612 PolarHBondContact N-CD2 2.96Å; G438-H612 VanDerWaalsContact N-CD2 3.34Å
439	K	89.8	Confident	90.5	Very high	103 Å²	103	44 Å²	44	45%	0.448	25%	0.245	S	C	.	.			trans	-58	119.3	176.9	-75.7	-172.4	-179.7	-171.2	0	111.4	L433 C434 C437 C473	L433-K439 CarbonylContact C-O 3.4Å; L433-K439 WeakPolarHBondContact CA-O 3.27Å; C434-K439 HydrophobicContact CB-CB 4.28Å; C434-K439 PolarHBondContact N-O 2.92Å; C437-K439 PolarHBondContact O-N 3.22Å; K439-C473 HydrophobicContact CB-CB 4.24Å; K439-C473 HydrophobicContact CD-CB 4.32Å
440	A	84.6	Confident	90.6	Very high	69 Å²	69	42 Å²	42	57%	0.57	23%	0.228	S	C	*	.			trans	-92.4	-2.8	176.6	0	0	0	0	0	112.5	L433 G438 Y443	L433-A440 HydrophobicContact CB-CB 4.5Å; G438-A440 PolarHBondContact O-N 2.93Å; G438-A440 VanDerWaalsContact O-N 3.14Å; A440-Y443 WeakPolarHBondContact O-CE1 2.96Å
441	D	72.4	Confident	90.4	Very high	104 Å²	104	47.2 Å²	47.2	56%	0.556	25%	0.252	S	S	*	.	S	Bend	trans	-104.2	130.2	172.5	61.4	-39	0	0	0	109.6
442	S	76.3	Confident	90.2	Very high	57 Å²	57	43.3 Å²	43.3	40%	0.399	23%	0.234	S	C	.	.	S	Bend	trans	65.2	60.9	168.1	-58.4	0	0	0	0	117.1	A363 C473 T474	A363-S442 VanDerWaalsContact CB-OG 3.29Å; A363-S442 WeakPolarHBondContact CB-OG 3.35Å; S442-C473 WeakPolarHBondContact O-CA 3.28Å; S442-T474 PolarHBondContact O-N 2.8Å
443	Y	85.2	Confident	90.2	Very high	22 Å²	22	41.5 Å²	41.5	9%	0.086	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	156.9	174.2	50.4	-100.9	0	0	0	113.6	L368 N432 A440 L471 L472	L368-Y443 HydrophobicContact CB-CE2 4.1Å; L368-Y443 HydrophobicContact CD1-CD2 3.78Å; L368-Y443 HydrophobicContact CD1-CE2 3.9Å; L368-Y443 HydrophobicContact CG-CD2 4.32Å; L368-Y443 HydrophobicContact CG-CE2 3.92Å; N432-Y443 HydrophobicContact CB-CE1 4.28Å; N432-Y443 HydrophobicContact CB-CE2 4.41Å; N432-Y443 WeakPolarHBondContact CB-OH 3.43Å; N432-Y443 WeakPolarHBondContact O-CE1 3.31Å; A440-Y443 WeakPolarHBondContact O-CE1 2.96Å; Y443-L471 HydrophobicContact CD2-CB 4.33Å; Y443-L471 HydrophobicContact CD2-CD1 3.71Å; Y443-L471 HydrophobicContact CD2-CD2 4.26Å; Y443-L471 HydrophobicContact CD2-CG 4.31Å; Y443-L471 HydrophobicContact CE2-CD1 3.87Å; Y443-L471 HydrophobicContact CG-CB 4.49Å; Y443-L471 HydrophobicContact CG-CD1 4.41Å; Y443-L472 CarbonylContact C-O 3.41Å; Y443-L472 VanDerWaalsContact CA-O 3.28Å; Y443-L472 WeakPolarHBondContact CA-O 3.43Å
444	I	88.1	Confident	90.1	Very high	26 Å²	26	41.7 Å²	41.7	13%	0.133	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	155.7	-179.7	57.8	173	0	0	0	110.4	Y361 L471 L472 H477	Y361-I444 HydrophobicContact CD1-CD1 3.57Å; Y361-I444 HydrophobicContact CE1-CD1 3.95Å; Y361-I444 HydrophobicContact CG-CD1 4.14Å; I444-L471 WeakPolarHBondContact O-CA 3.43Å; I444-L472 WeakPolarHBondContact CG1-O 2.95Å; I444-L472 PolarHBondContact N-O 2.75Å; I444-L472 PolarHBondContact O-N 3.4Å; I444-H477 HydrophobicContact CD1-CB 3.76Å; I444-H477 HydrophobicContact CG1-CB 4.05Å
445	R	91.2	Very high	89.9	Confident	106 Å²	106	48.6 Å²	48.6	40%	0.4	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	129.7	177.3	-61.9	-173.2	-179.7	127.1	-9.9	110.6	L368 D386 I469 L470 L471	L368-R445 HydrophobicContact CD1-CG 4.03Å; L368-R445 PolarHBondContact O-NH2 3.3Å; D386-R445 IonicContact OD1-NH2 3.3Å; D386-R445 IonicContact OD2-CZ 3.94Å; D386-R445 IonicContact OD2-NH2 2.7Å; D386-R445 PolarHBondContact OD2-NH2 3.37Å; R445-I469 HydrophobicContact CB-CG2 3.88Å; R445-I469 HydrophobicContact CG-CG2 4.13Å; R445-L470 CarbonylContact C-O 3.56Å; R445-L471 HydrophobicContact CG-CD2 3.79Å
446	K	93.1	Very high	89.6	Confident	14 Å²	14	49 Å²	49	6%	0.061	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	126.6	174.2	176.7	61.6	-177.5	175.8	0	109.2	I448 I469 L470 L472 S480 N481 D484	K446-I448 HydrophobicContact CG-CD1 4.05Å; K446-I448 PolarHBondContact O-N 3.13Å; K446-I469 WeakPolarHBondContact O-CA 3.43Å; K446-L470 PolarHBondContact N-O 3.26Å; K446-L470 PolarHBondContact O-N 3.02Å; K446-L472 HydrophobicContact CB-CD1 3.48Å; K446-L472 VanDerWaalsContact CB-CD1 3.48Å; K446-L472 HydrophobicContact CB-CD2 4.06Å; K446-L472 HydrophobicContact CB-CG 4.24Å; K446-L472 HydrophobicContact CG-CD1 4.04Å; K446-L472 HydrophobicContact CG-CD2 3.96Å; K446-S480 VanDerWaalsContact CE-OG 3.29Å; K446-S480 WeakPolarHBondContact CE-OG 3.38Å; K446-N481 PolarHBondContact NZ-OD1 3.23Å; K446-D484 WeakPolarHBondContact CE-OD2 3.12Å; K446-D484 IonicContact NZ-OD2 3.43Å; K446-D484 PolarHBondContact NZ-OD2 3.03Å
447	N	95	Very high	89.4	Confident	71 Å²	71	48.8 Å²	48.8	38%	0.38	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	114.3	166.5	-60.2	-58.4	0	0	0	108.7	D468 I469	N447-D468 CarbonylContact C-O 3.5Å; N447-D468 WeakPolarHBondContact CA-O 3.25Å; N447-I469 WeakPolarHBondContact OD1-CG1 3.43Å
448	I	96.4	Very high	89.2	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.01	24%	0.235	C	C	.	.	S	Bend	trans	-68.7	-44	178	-59.4	-50.9	0	0	0	110.6	K446 P450 D468 L470 R601 F604 W617	K446-I448 HydrophobicContact CG-CD1 4.05Å; K446-I448 PolarHBondContact O-N 3.13Å; I448-P450 WeakPolarHBondContact O-CD 3.48Å; I448-D468 HydrophobicContact CB-CB 4.41Å; I448-D468 PolarHBondContact N-O 3.42Å; I448-L470 HydrophobicContact CD1-CB 4.34Å; I448-L470 HydrophobicContact CD1-CD1 3.99Å; I448-L470 HydrophobicContact CD1-CG 4.32Å; I448-L470 HydrophobicContact CG1-CB 4.44Å; I448-L470 HydrophobicContact CG1-CD1 3.86Å; I448-L470 HydrophobicContact CG1-CG 4Å; I448-R601 HydrophobicContact CG2-CG 4.11Å; I448-F604 HydrophobicContact CD1-CB 4.3Å; I448-F604 HydrophobicContact CD1-CD1 3.82Å; I448-F604 HydrophobicContact CD1-CD2 3.56Å; I448-F604 HydrophobicContact CD1-CE1 3.96Å; I448-F604 HydrophobicContact CD1-CE2 3.71Å; I448-F604 HydrophobicContact CD1-CG 3.61Å; I448-F604 HydrophobicContact CD1-CZ 3.91Å; I448-F604 HydrophobicContact CG2-CB 3.83Å; I448-F604 HydrophobicContact CG2-CG 4.26Å; I448-W617 HydrophobicContact CG2-CZ2 4.27Å
449	V	95	Very high	88.8	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.024	25%	0.246	C	C	.	.	S	Bend	trans	-90.2	111.4	163.2	-176.1	0	0	0	0	107.4	H451 R454 D468 E597 W600	V449-H451 PolarHBondContact O-N 3.23Å; V449-R454 HydrophobicContact CG1-CB 4.47Å; V449-D468 HydrophobicContact CB-CB 4.48Å; V449-D468 HydrophobicContact CG2-CB 4.33Å; V449-E597 HydrophobicContact CG2-CG 4.08Å; V449-W600 HydrophobicContact CG2-CB 4.07Å
450	P	93	Very high	88.5	Confident	9 Å²	9	48 Å²	48	6%	0.058	24%	0.242	C	C	.	.			trans	-60.3	142.3	-174.3	-25.2	34.5	0	0	0	112.8	I448 E452 Y453 R454 W600	I448-P450 WeakPolarHBondContact O-CD 3.48Å; P450-E452 HydrophobicContact CB-CG 4.15Å; P450-E452 PolarHBondContact O-N 2.73Å; P450-E452 VanDerWaalsContact O-N 3.09Å; P450-Y453 HydrophobicContact CB-CD2 3.87Å; P450-Y453 HydrophobicContact CB-CE2 4.08Å; P450-Y453 HydrophobicContact CG-CD2 4.07Å; P450-Y453 HydrophobicContact CG-CE2 4.06Å; P450-Y453 PolarHBondContact O-N 3.4Å; P450-R454 PolarHBondContact O-N 2.91Å; P450-R454 VanDerWaalsContact O-N 3.13Å; P450-W600 HydrophobicContact CG-CD2 3.95Å; P450-W600 HydrophobicContact CG-CE3 3.83Å; P450-W600 HydrophobicContact CG-CH2 3.68Å; P450-W600 HydrophobicContact CG-CZ2 3.77Å; P450-W600 HydrophobicContact CG-CZ3 3.7Å
451	H	88.7	Confident	88.6	Confident	123 Å²	123	44.8 Å²	44.8	57%	0.569	22%	0.215	S	C	*	.	H	α-helix	trans	-57.3	-28.6	-178.9	-179.4	-96.2	0	0	0	113	V449 Y453 R454 R455	V449-H451 PolarHBondContact O-N 3.23Å; H451-Y453 PolarHBondContact O-N 2.85Å; H451-R454 PolarHBondContact O-N 2.85Å; H451-R455 WeakPolarHBondContact O-CB 3.15Å; H451-R455 VanDerWaalsContact O-CG 3.26Å; H451-R455 WeakPolarHBondContact O-CG 3.42Å; H451-R455 PolarHBondContact O-N 3.06Å
452	E	86.3	Confident	89.2	Confident	58 Å²	58	42.1 Å²	42.1	27%	0.271	20%	0.199	S	C	.	.	H	α-helix	trans	-59.3	-27.8	176.5	78.5	-164.5	114	0	0	113.5	P450 H456 K488 H577 G578	P450-E452 HydrophobicContact CB-CG 4.15Å; P450-E452 PolarHBondContact O-N 2.73Å; P450-E452 VanDerWaalsContact O-N 3.09Å; E452-H456 PolarHBondContact O-CD2 2.62Å; E452-K488 WeakPolarHBondContact OE1-CE 3.32Å; E452-K488 IonicContact OE1-NZ 3.17Å; E452-K488 PolarHBondContact OE1-NZ 2.96Å; E452-H577 IonicContact OE2-CD2 2.89Å; E452-G578 WeakPolarHBondContact O-CA 3.44Å
453	Y	92.4	Very high	89.1	Confident	0 Å²	0	44 Å²	44	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-94.9	-49.3	174.2	-53.3	-77.5	0	0	0	110.4	P450 H451 R455 H456 F457 K488 L491 H577 V581 V582 W600	P450-Y453 HydrophobicContact CB-CD2 3.87Å; P450-Y453 HydrophobicContact CB-CE2 4.08Å; P450-Y453 HydrophobicContact CG-CD2 4.07Å; P450-Y453 HydrophobicContact CG-CE2 4.06Å; P450-Y453 PolarHBondContact O-N 3.4Å; H451-Y453 PolarHBondContact O-N 2.85Å; Y453-R455 PolarHBondContact O-N 3.08Å; Y453-R455 VanDerWaalsContact O-N 3.12Å; Y453-H456 PolarHBondContact O-N 3.28Å; Y453-F457 WeakPolarHBondContact O-CD1 3.39Å; Y453-K488 WeakPolarHBondContact OH-CG 3.48Å; Y453-L491 HydrophobicContact CE1-CD1 4.36Å; Y453-H577 AromaticContact CE1-CD2 3.86Å; Y453-H577 AromaticContact CE1-NE2 3.59Å; Y453-H577 AromaticContact CZ-CD2 3.9Å; Y453-H577 AromaticContact CZ-NE2 3.53Å; Y453-H577 PolarHBondContact OH-CD2 3.5Å; Y453-H577 PolarHBondContact OH-NE2 3.42Å; Y453-V581 HydrophobicContact CD1-CB 4.14Å; Y453-V581 HydrophobicContact CD1-CG1 4.14Å; Y453-V581 HydrophobicContact CE1-CB 3.87Å; Y453-V581 HydrophobicContact CE1-CG1 3.93Å; Y453-V581 HydrophobicContact CE1-CG2 4.08Å; Y453-V582 HydrophobicContact CD1-CG2 4.28Å; Y453-W600 HydrophobicContact CD2-CZ2 4.15Å; Y453-W600 AromaticContact CD2-NE1 3.64Å; Y453-W600 AromaticContact CE2-CE2 3.67Å; Y453-W600 HydrophobicContact CE2-CH2 4.41Å; Y453-W600 AromaticContact CE2-CZ2 3.36Å; Y453-W600 HydrophobicContact CE2-CZ2 3.36Å; Y453-W600 AromaticContact CE2-NE1 3.62Å; Y453-W600 AromaticContact CZ-CZ2 3.96Å
454	R	91.5	Very high	88.4	Confident	25 Å²	25	48.6 Å²	48.6	9%	0.094	23%	0.226	C	C	.	.	H	α-helix	trans	-55.5	-35.7	-174.9	-164.9	65.6	146.1	171.7	-7	112.8	V449 P450 H451 H456 F457 M461 K462 D468 E597	V449-R454 HydrophobicContact CG1-CB 4.47Å; P450-R454 PolarHBondContact O-N 2.91Å; P450-R454 VanDerWaalsContact O-N 3.13Å; H451-R454 PolarHBondContact O-N 2.85Å; R454-H456 PolarHBondContact O-N 3.04Å; R454-H456 VanDerWaalsContact O-N 3.12Å; R454-F457 WeakPolarHBondContact O-CB 3.49Å; R454-F457 PolarHBondContact O-N 2.86Å; R454-F457 VanDerWaalsContact O-N 3.1Å; R454-M461 PolarHBondContact NH1-O 3.4Å; R454-K462 WeakPolarHBondContact O-CE 3.24Å; R454-D468 IonicContact CZ-OD2 2.89Å; R454-D468 IonicContact NE-OD2 3.82Å; R454-D468 IonicContact NH2-OD2 2.62Å; R454-D468 PolarHBondContact NH2-OD2 3.09Å; R454-E597 IonicContact CZ-OE2 2.88Å; R454-E597 IonicContact NH1-OE2 2.72Å; R454-E597 PolarHBondContact NH1-OE2 2.97Å; R454-E597 IonicContact NH2-OE2 3.66Å
455	R	89.3	Confident	88	Confident	145 Å²	145	50.8 Å²	50.8	55%	0.547	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-23.7	177	70.6	177.3	-68.6	179.6	-0.1	114.1	H451 Y453 K462	H451-R455 WeakPolarHBondContact O-CB 3.15Å; H451-R455 VanDerWaalsContact O-CG 3.26Å; H451-R455 WeakPolarHBondContact O-CG 3.42Å; H451-R455 PolarHBondContact O-N 3.06Å; Y453-R455 PolarHBondContact O-N 3.08Å; Y453-R455 VanDerWaalsContact O-N 3.12Å; R455-K462 VanDerWaalsContact C-CE 3.48Å; R455-K462 WeakPolarHBondContact O-CE 3.42Å; R455-K462 PolarHBondContact O-NZ 3.3Å
456	H	91.1	Very high	87.8	Confident	13 Å²	13	48.1 Å²	48.1	6%	0.06	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-6.3	-179.1	-61.4	-60.3	0	0	0	113	E452 Y453 R454 L579 V582 L638	E452-H456 PolarHBondContact O-CD2 2.62Å; Y453-H456 PolarHBondContact O-N 3.28Å; R454-H456 PolarHBondContact O-N 3.04Å; R454-H456 VanDerWaalsContact O-N 3.12Å; H456-L579 HydrophobicContact CB-CD1 4.19Å; H456-L579 PolarHBondContact CD2-N 2.84Å; H456-L579 VanDerWaalsContact CD2-N 3.31Å; H456-V582 HydrophobicContact CB-CB 4.02Å; H456-V582 HydrophobicContact CB-CG1 3.9Å; H456-V582 HydrophobicContact CB-CG2 4.17Å; H456-L638 WeakPolarHBondContact O-CD2 3.11Å
457	F	90.8	Very high	87.7	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.233	C	C	.	.	S	Bend	trans	-63.4	158.1	177.2	-81	35.2	0	0	0	111	Y453 R454 M461 K462 V582 L596 E597	Y453-F457 WeakPolarHBondContact O-CD1 3.39Å; R454-F457 WeakPolarHBondContact O-CB 3.49Å; R454-F457 PolarHBondContact O-N 2.86Å; R454-F457 VanDerWaalsContact O-N 3.1Å; F457-M461 HydrophobicContact CB-CB 4.38Å; F457-M461 HydrophobicContact CD2-CB 3.98Å; F457-M461 HydrophobicContact CD2-CE 4.04Å; F457-M461 HydrophobicContact CD2-SD 4.16Å; F457-M461 HydrophobicContact CE2-CE 4.01Å; F457-K462 HydrophobicContact CB-CG 4.23Å; F457-K462 WeakPolarHBondContact O-CD 3.5Å; F457-K462 WeakPolarHBondContact O-CE 3.41Å; F457-K462 PolarHBondContact O-NZ 2.97Å; F457-V582 HydrophobicContact CD1-CG1 4.11Å; F457-V582 HydrophobicContact CD1-CG2 4Å; F457-V582 HydrophobicContact CE1-CG1 4.45Å; F457-V582 HydrophobicContact CE1-CG2 3.78Å; F457-L596 HydrophobicContact CE1-CD2 4.05Å; F457-L596 HydrophobicContact CZ-CD2 4.23Å; F457-E597 HydrophobicContact CE2-CB 4.47Å
458	P	89.4	Confident	87.6	Confident	6 Å²	6	44.3 Å²	44.3	4%	0.039	22%	0.216	C	C	.	.			trans	-59.8	151.4	169.6	27.2	-34.8	0	0	0	110.6	E460 M461 K462 L593 I636	P458-E460 VanDerWaalsContact CB-OE2 3.3Å; P458-E460 WeakPolarHBondContact CB-OE2 3.43Å; P458-E460 PolarHBondContact O-N 2.89Å; P458-M461 HydrophobicContact CG-CB 4.3Å; P458-M461 HydrophobicContact CG-CG 4.03Å; P458-M461 HydrophobicContact CG-SD 3.99Å; P458-M461 PolarHBondContact O-N 2.96Å; P458-K462 PolarHBondContact O-N 2.84Å; P458-L593 HydrophobicContact CG-CD1 3.76Å; P458-I636 HydrophobicContact CB-CG2 4.3Å; P458-I636 HydrophobicContact CG-CG2 4.25Å
459	T	85.9	Confident	87.5	Confident	75 Å²	75	45.6 Å²	45.6	46%	0.46	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-55.7	-37.4	-176.3	-54.6	0	0	0	0	111.3	M461 K462	T459-M461 PolarHBondContact O-N 3.23Å; T459-M461 VanDerWaalsContact O-N 3.1Å; T459-K462 PolarHBondContact O-N 3.27Å
460	E	83.9	Confident	87.5	Confident	79 Å²	79	45.4 Å²	45.4	37%	0.369	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-54.5	-29.7	177.4	-63.8	74.6	-166.7	0	0	113.2	P458 F626 F630	P458-E460 VanDerWaalsContact CB-OE2 3.3Å; P458-E460 WeakPolarHBondContact CB-OE2 3.43Å; P458-E460 PolarHBondContact O-N 2.89Å; E460-F626 WeakPolarHBondContact O-CE1 3.43Å; E460-F630 HydrophobicContact CB-CD2 4.46Å; E460-F630 HydrophobicContact CB-CE1 4.35Å; E460-F630 HydrophobicContact CB-CE2 3.77Å; E460-F630 HydrophobicContact CB-CZ 3.7Å; E460-F630 HydrophobicContact CG-CD1 4.26Å; E460-F630 HydrophobicContact CG-CE1 3.58Å; E460-F630 HydrophobicContact CG-CE2 3.94Å; E460-F630 HydrophobicContact CG-CZ 3.39Å
461	M	85.9	Confident	87.6	Confident	1 Å²	1	45 Å²	45	1%	0.005	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-104.6	-1.8	179.7	-63.7	-177	75.7	0	0	113.6	R454 F457 P458 T459 L590 L593 M594 F626	R454-M461 PolarHBondContact NH1-O 3.4Å; F457-M461 HydrophobicContact CB-CB 4.38Å; F457-M461 HydrophobicContact CD2-CB 3.98Å; F457-M461 HydrophobicContact CD2-CE 4.04Å; F457-M461 HydrophobicContact CD2-SD 4.16Å; F457-M461 HydrophobicContact CE2-CE 4.01Å; P458-M461 HydrophobicContact CG-CB 4.3Å; P458-M461 HydrophobicContact CG-CG 4.03Å; P458-M461 HydrophobicContact CG-SD 3.99Å; P458-M461 PolarHBondContact O-N 2.96Å; T459-M461 PolarHBondContact O-N 3.23Å; T459-M461 VanDerWaalsContact O-N 3.1Å; M461-L590 HydrophobicContact CG-CD1 4.27Å; M461-L590 HydrophobicContact SD-CD1 3.57Å; M461-L590 VanDerWaalsContact SD-CD1 3.57Å; M461-L593 HydrophobicContact CE-CB 4.24Å; M461-L593 HydrophobicContact SD-CB 3.97Å; M461-L593 HydrophobicContact SD-CD1 3.99Å; M461-M594 HydrophobicContact CE-CG 4.38Å; M461-F626 HydrophobicContact CB-CZ 4.41Å; M461-F626 HydrophobicContact CE-CD2 4.42Å; M461-F626 HydrophobicContact CE-CE2 4.25Å; M461-F626 HydrophobicContact CG-CD2 4.39Å; M461-F626 HydrophobicContact CG-CE1 4.46Å; M461-F626 HydrophobicContact CG-CE2 4.11Å; M461-F626 HydrophobicContact CG-CZ 4.15Å
462	K	84.4	Confident	87.8	Confident	49 Å²	49	39.1 Å²	39.1	21%	0.213	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-25.1	-179.7	-78.7	168.6	163	156.6	0	112.7	R454 R455 F457 P458 T459	R454-K462 WeakPolarHBondContact O-CE 3.24Å; R455-K462 VanDerWaalsContact C-CE 3.48Å; R455-K462 WeakPolarHBondContact O-CE 3.42Å; R455-K462 PolarHBondContact O-NZ 3.3Å; F457-K462 HydrophobicContact CB-CG 4.23Å; F457-K462 WeakPolarHBondContact O-CD 3.5Å; F457-K462 WeakPolarHBondContact O-CE 3.41Å; F457-K462 PolarHBondContact O-NZ 2.97Å; P458-K462 PolarHBondContact O-N 2.84Å; T459-K462 PolarHBondContact O-N 3.27Å
463	D	74.4	Confident	87.9	Confident	95 Å²	95	36.5 Å²	36.5	51%	0.508	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	154.6	179.2	-66.2	-26.6	0	0	0	111.6	N465	D463-N465 VanDerWaalsContact C-N 3.26Å; D463-N465 PolarHBondContact O-N 2.87Å
464	H	70.2	Confident	87.7	Confident	119 Å²	119	37.8 Å²	37.8	55%	0.551	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	34.5	177	-50.5	-79.1	0	0	0	114.7	Y426 S466	Y426-H464 HydrophobicContact CE1-CB 3.99Å; Y426-H464 WeakPolarHBondContact CE1-O 3.44Å; Y426-H464 HydrophobicContact CE2-CB 4.23Å; Y426-H464 VanDerWaalsContact OH-CB 3.28Å; Y426-H464 WeakPolarHBondContact OH-CB 3.14Å; Y426-H464 PolarHBondContact OH-O 2.89Å; H464-S466 PolarHBondContact O-N 2.74Å
465	N	79.6	Confident	87.4	Confident	72 Å²	72	37.9 Å²	37.9	39%	0.385	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-65.6	-2.9	-178.4	67	27.6	0	0	0	115.9	D463 H467 D468 I469	D463-N465 VanDerWaalsContact C-N 3.26Å; D463-N465 PolarHBondContact O-N 2.87Å; N465-H467 PolarHBondContact O-N 3.47Å; N465-H467 VanDerWaalsContact O-N 3.12Å; N465-D468 PolarHBondContact O-N 2.88Å; N465-I469 WeakPolarHBondContact O-CG1 3.41Å; N465-I469 VanDerWaalsContact OD1-CD1 3.31Å; N465-I469 WeakPolarHBondContact OD1-CD1 3.33Å
466	S	86.9	Confident	87.6	Confident	50 Å²	50	31 Å²	31	35%	0.35	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-65.5	-14.8	-178.7	59.8	0	0	0	0	113.7	Y425 Y426 H464 D468 I469	Y425-S466 PolarHBondContact OH-O 2.85Å; Y426-S466 WeakPolarHBondContact CD1-OG 3.27Å; Y426-S466 WeakPolarHBondContact CE1-OG 3.5Å; H464-S466 PolarHBondContact O-N 2.74Å; S466-D468 VanDerWaalsContact C-N 3.3Å; S466-I469 PolarHBondContact O-N 3.19Å
467	H	91.6	Very high	87.6	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-61.6	-38.3	166.8	-170	82.6	0	0	0	112.4	Y425 N465 I469 R601 W617 S618 H621	Y425-H467 HydrophobicContact CD1-CB 4.39Å; Y425-H467 AromaticContact CD1-ND1 3.74Å; Y425-H467 AromaticContact CD2-ND1 3.86Å; Y425-H467 HydrophobicContact CE1-CB 4.12Å; Y425-H467 AromaticContact CE1-ND1 3.86Å; Y425-H467 AromaticContact CE2-ND1 3.95Å; Y425-H467 AromaticContact CG-ND1 3.74Å; Y425-H467 AromaticContact CZ-ND1 3.95Å; N465-H467 PolarHBondContact O-N 3.47Å; N465-H467 VanDerWaalsContact O-N 3.12Å; H467-I469 VanDerWaalsContact C-N 3.3Å; H467-I469 PolarHBondContact O-N 2.49Å; H467-R601 PolarHBondContact CD2-NH2 3.39Å; H467-W617 AromaticContact CD2-NE1 3.74Å; H467-W617 AromaticContact CE1-CD1 3.6Å; H467-W617 AromaticContact CE1-CG 3.9Å; H467-W617 AromaticContact CE1-NE1 3.96Å; H467-W617 AromaticContact ND1-CD1 3.89Å; H467-W617 AromaticContact NE2-CD1 3.71Å; H467-W617 AromaticContact NE2-CE2 3.87Å; H467-W617 AromaticContact NE2-NE1 3.59Å; H467-W617 PolarHBondContact O-NE1 3.18Å; H467-S618 PolarHBondContact CE1-N 3.46Å; H467-S618 VanDerWaalsContact CE1-N 3.31Å; H467-S618 PolarHBondContact NE2-N 3.21Å; H467-S618 PolarHBondContact NE2-O 3.41Å; H467-H621 AromaticContact CD2-CD2 3.83Å; H467-H621 AromaticContact CD2-CG 3.85Å; H467-H621 WeakPolarHBondContact CE1-CB 3.38Å; H467-H621 AromaticContact CE1-CD2 3.82Å; H467-H621 AromaticContact CE1-CG 3.31Å; H467-H621 AromaticContact CE1-ND1 3.71Å; H467-H621 AromaticContact CG-CD2 3.35Å; H467-H621 AromaticContact CG-CG 3.65Å; H467-H621 AromaticContact ND1-CD2 3.4Å; H467-H621 PolarHBondContact ND1-CD2 3.15Å; H467-H621 AromaticContact ND1-CE1 3.94Å; H467-H621 AromaticContact ND1-CG 3.36Å; H467-H621 AromaticContact ND1-ND1 3.71Å; H467-H621 AromaticContact ND1-NE2 3.79Å; H467-H621 WeakPolarHBondContact NE2-CB 3.29Å; H467-H621 AromaticContact NE2-CG 3.64Å
468	D	93.8	Very high	87.3	Confident	4 Å²	4	32 Å²	32	2%	0.021	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-90.9	9.5	179.8	-61	-47.6	0	0	0	112.8	N447 I448 V449 R454 N465 S466 R601	N447-D468 CarbonylContact C-O 3.5Å; N447-D468 WeakPolarHBondContact CA-O 3.25Å; I448-D468 HydrophobicContact CB-CB 4.41Å; I448-D468 PolarHBondContact N-O 3.42Å; V449-D468 HydrophobicContact CB-CB 4.48Å; V449-D468 HydrophobicContact CG2-CB 4.33Å; R454-D468 IonicContact CZ-OD2 2.89Å; R454-D468 IonicContact NE-OD2 3.82Å; R454-D468 IonicContact NH2-OD2 2.62Å; R454-D468 PolarHBondContact NH2-OD2 3.09Å; N465-D468 PolarHBondContact O-N 2.88Å; S466-D468 VanDerWaalsContact C-N 3.3Å; D468-R601 IonicContact OD1-CZ 2.74Å; D468-R601 VanDerWaalsContact OD1-CZ 3.28Å; D468-R601 IonicContact OD1-NE 2.69Å; D468-R601 PolarHBondContact OD1-NE 3.1Å; D468-R601 IonicContact OD1-NH2 3.49Å; D468-R601 PolarHBondContact OD1-NH2 3.42Å; D468-R601 IonicContact OD2-NH2 3.83Å; D468-R601 PolarHBondContact OD2-NH2 2.93Å; D468-R601 VanDerWaalsContact OD2-NH2 3.14Å
469	I	93.5	Very high	87.3	Confident	30 Å²	30	31.8 Å²	31.8	15%	0.154	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	101	179.9	-57.7	176.3	0	0	0	109.3	Y369 R445 K446 N447 N465 S466 H467	Y369-I469 PolarHBondContact OH-O 3.34Å; Y369-I469 VanDerWaalsContact OH-O 3.05Å; R445-I469 HydrophobicContact CB-CG2 3.88Å; R445-I469 HydrophobicContact CG-CG2 4.13Å; K446-I469 WeakPolarHBondContact O-CA 3.43Å; N447-I469 WeakPolarHBondContact OD1-CG1 3.43Å; N465-I469 WeakPolarHBondContact O-CG1 3.41Å; N465-I469 VanDerWaalsContact OD1-CD1 3.31Å; N465-I469 WeakPolarHBondContact OD1-CD1 3.33Å; S466-I469 PolarHBondContact O-N 3.19Å; H467-I469 VanDerWaalsContact C-N 3.3Å; H467-I469 PolarHBondContact O-N 2.49Å
470	L	95	Very high	87.6	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	158.5	-179	-61.8	-177.4	0	0	0	111.9	V435 R445 K446 I448 L472 F604 L613 P614 W617	V435-L470 HydrophobicContact CG1-CB 4.17Å; V435-L470 HydrophobicContact CG1-CD2 4.42Å; V435-L470 HydrophobicContact CG2-CB 4.14Å; V435-L470 HydrophobicContact CG2-CD1 4.18Å; R445-L470 CarbonylContact C-O 3.56Å; K446-L470 PolarHBondContact N-O 3.26Å; K446-L470 PolarHBondContact O-N 3.02Å; I448-L470 HydrophobicContact CD1-CB 4.34Å; I448-L470 HydrophobicContact CD1-CD1 3.99Å; I448-L470 HydrophobicContact CD1-CG 4.32Å; I448-L470 HydrophobicContact CG1-CB 4.44Å; I448-L470 HydrophobicContact CG1-CD1 3.86Å; I448-L470 HydrophobicContact CG1-CG 4Å; L470-L472 HydrophobicContact CB-CD1 4.15Å; L470-F604 HydrophobicContact CD1-CD1 4.41Å; L470-F604 HydrophobicContact CD1-CE1 3.75Å; L470-F604 HydrophobicContact CD1-CZ 4.28Å; L470-L613 HydrophobicContact CD1-CD2 3.54Å; L470-P614 HydrophobicContact CD2-CG 4.06Å; L470-W617 HydrophobicContact CD1-CZ2 4.38Å
471	L	94.1	Very high	87.7	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	126.5	178	-62.7	-173.5	0	0	0	111.4	L368 Y369 L433 C434 V435 Y443 I444 R445	L368-L471 HydrophobicContact CB-CD1 4.21Å; L368-L471 HydrophobicContact CB-CD2 4.03Å; L368-L471 HydrophobicContact CD1-CD2 3.61Å; L368-L471 HydrophobicContact CG-CD2 4.49Å; Y369-L471 HydrophobicContact CD2-CD1 3.55Å; Y369-L471 HydrophobicContact CD2-CG 4.24Å; Y369-L471 HydrophobicContact CE2-CD1 3.31Å; Y369-L471 HydrophobicContact CE2-CD2 4.42Å; Y369-L471 HydrophobicContact CE2-CG 3.5Å; Y369-L471 VanDerWaalsContact CE2-CG 3.5Å; Y369-L471 HydrophobicContact CG-CD1 4.47Å; L433-L471 VanDerWaalsContact O-CB 3.26Å; L433-L471 WeakPolarHBondContact O-CB 3.19Å; C434-L471 CarbonylContact C-O 3.55Å; C434-L471 WeakPolarHBondContact CA-O 3.19Å; V435-L471 PolarHBondContact N-O 3.21Å; Y443-L471 HydrophobicContact CD2-CB 4.33Å; Y443-L471 HydrophobicContact CD2-CD1 3.71Å; Y443-L471 HydrophobicContact CD2-CD2 4.26Å; Y443-L471 HydrophobicContact CD2-CG 4.31Å; Y443-L471 HydrophobicContact CE2-CD1 3.87Å; Y443-L471 HydrophobicContact CG-CB 4.49Å; Y443-L471 HydrophobicContact CG-CD1 4.41Å; I444-L471 WeakPolarHBondContact O-CA 3.43Å; R445-L471 HydrophobicContact CG-CD2 3.79Å
472	L	93.4	Very high	87.5	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	139.7	176.3	-76.7	66	0	0	0	109.7	V435 V436 Y443 I444 K446 L470 C476 H477 F604	V435-L472 HydrophobicContact CG2-CD1 4.04Å; V436-L472 HydrophobicContact CG2-CG 4.29Å; Y443-L472 CarbonylContact C-O 3.41Å; Y443-L472 VanDerWaalsContact CA-O 3.28Å; Y443-L472 WeakPolarHBondContact CA-O 3.43Å; I444-L472 WeakPolarHBondContact CG1-O 2.95Å; I444-L472 PolarHBondContact N-O 2.75Å; I444-L472 PolarHBondContact O-N 3.4Å; K446-L472 HydrophobicContact CB-CD1 3.48Å; K446-L472 VanDerWaalsContact CB-CD1 3.48Å; K446-L472 HydrophobicContact CB-CD2 4.06Å; K446-L472 HydrophobicContact CB-CG 4.24Å; K446-L472 HydrophobicContact CG-CD1 4.04Å; K446-L472 HydrophobicContact CG-CD2 3.96Å; L470-L472 HydrophobicContact CB-CD1 4.15Å; L472-C476 HydrophobicContact CB-CB 4.29Å; L472-C476 HydrophobicContact CD2-CB 4.43Å; L472-C476 HydrophobicContact CG-CB 4.45Å; L472-H477 HydrophobicContact CB-CB 4Å; L472-H477 HydrophobicContact CD2-CB 4.36Å; L472-F604 HydrophobicContact CD1-CE2 4.42Å; L472-F604 HydrophobicContact CD1-CZ 4.32Å; L472-F604 HydrophobicContact CD2-CE2 4.14Å
473	C	89.8	Confident	87.7	Confident	3 Å²	3	28.1 Å²	28.1	2%	0.02	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	158.4	166.7	73.5	0	0	0	0	110.3	C434 K439 S442 S475 C476 H477	C434-C473 HydrophobicContact CB-CB 3.98Å; C434-C473 PolarHBondContact SG-N 3.25Å; K439-C473 HydrophobicContact CB-CB 4.24Å; K439-C473 HydrophobicContact CD-CB 4.32Å; S442-C473 WeakPolarHBondContact O-CA 3.28Å; C473-S475 PolarHBondContact O-N 2.9Å; C473-S475 VanDerWaalsContact O-N 3.14Å; C473-S475 PolarHBondContact SG-OG 2.83Å; C473-C476 PolarHBondContact O-N 2.93Å; C473-C476 PolarHBondContact SG-SG 3.44Å; C473-H477 WeakPolarHBondContact O-CB 3.39Å; C473-H477 PolarHBondContact O-N 3.33Å
474	T	87.3	Confident	88.5	Confident	26 Å²	26	23.8 Å²	23.8	16%	0.16	13%	0.134	C	C	.	.	H	α-helix	trans	-53.8	-38.7	-174.6	59.5	0	0	0	0	113.3	Y361 S442 A478	Y361-T474 HydrophobicContact CG-CG2 4.45Å; S442-T474 PolarHBondContact O-N 2.8Å; T474-A478 WeakPolarHBondContact O-CB 3.24Å; T474-A478 PolarHBondContact O-N 2.94Å
475	S	86.2	Confident	89.1	Confident	27 Å²	27	19.9 Å²	19.9	19%	0.189	13%	0.125	C	C	.	.	H	α-helix	trans	-67.3	-46.3	176	62.1	0	0	0	0	113.6	L357 C473 H477 A478 A479	L357-S475 VanDerWaalsContact O-CA 3.28Å; L357-S475 WeakPolarHBondContact O-CA 3.31Å; L357-S475 WeakPolarHBondContact O-CB 3.36Å; C473-S475 PolarHBondContact O-N 2.9Å; C473-S475 VanDerWaalsContact O-N 3.14Å; C473-S475 PolarHBondContact SG-OG 2.83Å; S475-H477 VanDerWaalsContact C-N 3.34Å; S475-A478 PolarHBondContact O-N 3.49Å; S475-A479 WeakPolarHBondContact O-CB 3.46Å; S475-A479 PolarHBondContact O-N 3.47Å
476	C	92.3	Very high	89.4	Confident	1 Å²	1	21.8 Å²	21.8	1%	0.007	13%	0.13	C	C	.	.	H	α-helix	trans	-67.4	-36.7	176.9	-67.6	0	0	0	0	111.6	R349 V436 C437 L472 C473 A479 S480 M608	R349-C476 PolarHBondContact NH1-SG 2.8Å; V436-C476 HydrophobicContact CB-CB 4.28Å; V436-C476 HydrophobicContact CG2-CB 4.38Å; C437-C476 VanDerWaalsContact SG-SG 3.67Å; L472-C476 HydrophobicContact CB-CB 4.29Å; L472-C476 HydrophobicContact CD2-CB 4.43Å; L472-C476 HydrophobicContact CG-CB 4.45Å; C473-C476 PolarHBondContact O-N 2.93Å; C473-C476 PolarHBondContact SG-SG 3.44Å; C476-A479 PolarHBondContact O-N 2.96Å; C476-S480 WeakPolarHBondContact O-CB 3.34Å; C476-S480 PolarHBondContact O-N 2.81Å; C476-M608 HydrophobicContact CB-CE 4.05Å; C476-M608 WeakPolarHBondContact O-CE 3.31Å
477	H	91.9	Very high	89.6	Confident	20 Å²	20	19.6 Å²	19.6	9%	0.093	12%	0.115	C	C	.	.	H	α-helix	trans	-64	-45.8	175.9	179.7	-90.5	0	0	0	111.7	Y361 I444 L472 C473 S475 S480 N481	Y361-H477 AromaticContact CE1-CE1 3.62Å; Y361-H477 AromaticContact CE1-ND1 3.62Å; Y361-H477 AromaticContact CZ-CE1 3.72Å; Y361-H477 AromaticContact CZ-ND1 3.45Å; Y361-H477 PolarHBondContact OH-CE1 3.18Å; Y361-H477 PolarHBondContact OH-ND1 3.36Å; I444-H477 HydrophobicContact CD1-CB 3.76Å; I444-H477 HydrophobicContact CG1-CB 4.05Å; L472-H477 HydrophobicContact CB-CB 4Å; L472-H477 HydrophobicContact CD2-CB 4.36Å; C473-H477 WeakPolarHBondContact O-CB 3.39Å; C473-H477 PolarHBondContact O-N 3.33Å; S475-H477 VanDerWaalsContact C-N 3.34Å; H477-S480 PolarHBondContact O-N 2.84Å; H477-N481 PolarHBondContact CE1-ND2 2.8Å; H477-N481 PolarHBondContact ND1-ND2 2.78Å; H477-N481 PolarHBondContact O-N 2.78Å
478	A	84.9	Confident	89.4	Confident	15 Å²	15	21.8 Å²	21.8	12%	0.124	12%	0.124	C	C	.	.	H	α-helix	trans	-62.8	-41.9	175.8	0	0	0	0	0	112.1	L357 Y361 T474 S475 N481 V482	L357-A478 HydrophobicContact CB-CB 3.97Å; L357-A478 HydrophobicContact CD2-CB 4.32Å; Y361-A478 HydrophobicContact CE2-CB 4.48Å; T474-A478 WeakPolarHBondContact O-CB 3.24Å; T474-A478 PolarHBondContact O-N 2.94Å; S475-A478 PolarHBondContact O-N 3.49Å; A478-N481 PolarHBondContact O-N 3.02Å; A478-V482 PolarHBondContact O-N 3.1Å
479	A	87.9	Confident	88.9	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.1	-46.8	174.3	0	0	0	0	0	112.1	P348 R349 L357 S475 C476 N481 V482 H483 M608	P348-A479 HydrophobicContact CB-CB 4.29Å; P348-A479 HydrophobicContact CG-CB 4.31Å; R349-A479 HydrophobicContact CG-CB 3.78Å; L357-A479 HydrophobicContact CD1-CB 4.17Å; S475-A479 WeakPolarHBondContact O-CB 3.46Å; S475-A479 PolarHBondContact O-N 3.47Å; C476-A479 PolarHBondContact O-N 2.96Å; A479-N481 VanDerWaalsContact C-N 3.3Å; A479-N481 PolarHBondContact O-N 2.81Å; A479-V482 WeakPolarHBondContact O-CB 3.47Å; A479-V482 PolarHBondContact O-N 2.89Å; A479-H483 PolarHBondContact O-CD2 3.39Å; A479-H483 PolarHBondContact O-N 2.97Å; A479-H483 VanDerWaalsContact O-N 3.11Å; A479-M608 HydrophobicContact CB-CE 4.26Å
480	S	92.7	Very high	88.7	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-57.4	-41.5	175.1	170.8	0	0	0	0	111.8	K446 C476 H477 V482 H483 D484 M608	K446-S480 VanDerWaalsContact CE-OG 3.29Å; K446-S480 WeakPolarHBondContact CE-OG 3.38Å; C476-S480 WeakPolarHBondContact O-CB 3.34Å; C476-S480 PolarHBondContact O-N 2.81Å; H477-S480 PolarHBondContact O-N 2.84Å; S480-V482 VanDerWaalsContact C-N 3.27Å; S480-V482 PolarHBondContact O-N 3.32Å; S480-H483 PolarHBondContact O-N 3.5Å; S480-H483 VanDerWaalsContact O-N 3.16Å; S480-D484 WeakPolarHBondContact O-CB 3.44Å; S480-D484 VanDerWaalsContact O-CG 3.23Å; S480-D484 PolarHBondContact O-N 3.08Å; S480-D484 VanDerWaalsContact O-OD1 3.04Å; S480-M608 VanDerWaalsContact CA-SD 3.56Å
481	N	86.6	Confident	88.5	Confident	58 Å²	58	28.3 Å²	28.3	31%	0.31	15%	0.154	S	C	.	.	H	α-helix	trans	-64.2	-31	177.2	-72.7	-16.9	0	0	0	113.6	Y361 K446 H477 A478 A479 G485	Y361-N481 PolarHBondContact OH-ND2 2.87Å; K446-N481 PolarHBondContact NZ-OD1 3.23Å; H477-N481 PolarHBondContact CE1-ND2 2.8Å; H477-N481 PolarHBondContact ND1-ND2 2.78Å; H477-N481 PolarHBondContact O-N 2.78Å; A478-N481 PolarHBondContact O-N 3.02Å; A479-N481 VanDerWaalsContact C-N 3.3Å; A479-N481 PolarHBondContact O-N 2.81Å; N481-G485 PolarHBondContact O-N 3.37Å; N481-G485 VanDerWaalsContact O-N 3.14Å
482	V	81.8	Confident	88.1	Confident	64 Å²	64	28.4 Å²	28.4	39%	0.388	16%	0.155	S	C	.	.	H	α-helix	trans	-67	-47.3	173.2	170.8	0	0	0	0	109.7	P348 A478 A479 S480 G485 F486	P348-V482 HydrophobicContact CG-CB 4.47Å; P348-V482 HydrophobicContact CG-CG1 4.26Å; A478-V482 PolarHBondContact O-N 3.1Å; A479-V482 WeakPolarHBondContact O-CB 3.47Å; A479-V482 PolarHBondContact O-N 2.89Å; S480-V482 VanDerWaalsContact C-N 3.27Å; S480-V482 PolarHBondContact O-N 3.32Å; V482-G485 PolarHBondContact O-N 3.18Å; V482-F486 HydrophobicContact CG1-CE2 3.8Å; V482-F486 WeakPolarHBondContact O-CD2 3.15Å
483	H	88.3	Confident	87.8	Confident	5 Å²	5	34 Å²	34	2%	0.023	19%	0.185	C	C	.	.	H	α-helix	trans	-60.5	-47	176.1	-67	-58.8	0	0	0	112.6	P348 A479 S480 G485 F486 L487 H603 T607	P348-H483 WeakPolarHBondContact CD-NE2 3.35Å; A479-H483 PolarHBondContact O-CD2 3.39Å; A479-H483 PolarHBondContact O-N 2.97Å; A479-H483 VanDerWaalsContact O-N 3.11Å; S480-H483 PolarHBondContact O-N 3.5Å; S480-H483 VanDerWaalsContact O-N 3.16Å; H483-G485 PolarHBondContact O-N 2.87Å; H483-F486 WeakPolarHBondContact O-CB 3.31Å; H483-F486 PolarHBondContact O-N 2.91Å; H483-L487 PolarHBondContact O-N 2.97Å; H483-H603 PolarHBondContact O-CE1 3.47Å; H483-H603 PolarHBondContact O-NE2 3.4Å; H483-T607 HydrophobicContact CB-CG2 4.15Å
484	D	90.6	Very high	87.9	Confident	5 Å²	5	38.8 Å²	38.8	3%	0.027	21%	0.207	C	C	.	.	H	α-helix	trans	-55.5	-37.8	175.6	-71.3	9.2	0	0	0	111.7	K446 S480 F486 L487 K488 W600 H603	K446-D484 WeakPolarHBondContact CE-OD2 3.12Å; K446-D484 IonicContact NZ-OD2 3.43Å; K446-D484 PolarHBondContact NZ-OD2 3.03Å; S480-D484 WeakPolarHBondContact O-CB 3.44Å; S480-D484 VanDerWaalsContact O-CG 3.23Å; S480-D484 PolarHBondContact O-N 3.08Å; S480-D484 VanDerWaalsContact O-OD1 3.04Å; D484-F486 PolarHBondContact O-N 3.38Å; D484-L487 PolarHBondContact O-N 2.87Å; D484-K488 VanDerWaalsContact O-CB 3.28Å; D484-K488 WeakPolarHBondContact O-CB 3.43Å; D484-K488 WeakPolarHBondContact O-CG 3.38Å; D484-K488 PolarHBondContact O-N 3.44Å; D484-W600 HydrophobicContact CB-CH2 4.06Å; D484-W600 HydrophobicContact CB-CZ3 3.86Å; D484-H603 PolarHBondContact N-NE2 3.41Å; D484-H603 IonicContact OD1-CD2 3.86Å; D484-H603 IonicContact OD1-NE2 2.7Å
485	G	83.4	Confident	87.9	Confident	36 Å²	36	39.8 Å²	39.8	37%	0.371	21%	0.209	S	C	.	.	H	α-helix	trans	-58.1	-35.4	176.9	0	0	0	0	0	113	N481 V482 H483 Q489	N481-G485 PolarHBondContact O-N 3.37Å; N481-G485 VanDerWaalsContact O-N 3.14Å; V482-G485 PolarHBondContact O-N 3.18Å; H483-G485 PolarHBondContact O-N 2.87Å; G485-Q489 PolarHBondContact O-N 3.36Å; G485-Q489 VanDerWaalsContact O-N 3.11Å
486	F	85.9	Confident	87.7	Confident	113 Å²	113	41.4 Å²	41.4	50%	0.496	22%	0.224	S	C	.	.	H	α-helix	trans	-71.4	-46.2	175.5	-64.9	-77.6	0	0	0	111.8	V482 H483 D484 K488 Q489 Q490	V482-F486 HydrophobicContact CG1-CE2 3.8Å; V482-F486 WeakPolarHBondContact O-CD2 3.15Å; H483-F486 WeakPolarHBondContact O-CB 3.31Å; H483-F486 PolarHBondContact O-N 2.91Å; D484-F486 PolarHBondContact O-N 3.38Å; F486-K488 VanDerWaalsContact C-N 3.31Å; F486-K488 PolarHBondContact O-N 2.78Å; F486-Q489 PolarHBondContact O-N 3.34Å; F486-Q489 VanDerWaalsContact O-N 3.14Å; F486-Q490 WeakPolarHBondContact O-CG 3.31Å; F486-Q490 PolarHBondContact O-N 3.38Å
487	L	91.3	Very high	87.2	Confident	4 Å²	4	41.4 Å²	41.4	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-62.8	-40.4	177	176.9	57.7	0	0	0	111.5	H483 D484 Q489 Q490 L491 R599 W600 H603	H483-L487 PolarHBondContact O-N 2.97Å; D484-L487 PolarHBondContact O-N 2.87Å; L487-Q489 VanDerWaalsContact C-N 3.3Å; L487-Q489 PolarHBondContact O-N 3Å; L487-Q490 WeakPolarHBondContact O-CB 3.48Å; L487-Q490 PolarHBondContact O-N 3.17Å; L487-Q490 VanDerWaalsContact O-N 3.17Å; L487-L491 HydrophobicContact CD1-CD1 4.41Å; L487-L491 HydrophobicContact CD1-CG 4.21Å; L487-L491 HydrophobicContact CG-CD1 4.18Å; L487-L491 HydrophobicContact CG-CG 4.45Å; L487-L491 WeakPolarHBondContact O-CG 3.47Å; L487-L491 PolarHBondContact O-N 3.15Å; L487-R599 HydrophobicContact CD1-CG 4.31Å; L487-W600 HydrophobicContact CB-CH2 4.16Å; L487-W600 HydrophobicContact CB-CZ3 4.46Å; L487-W600 HydrophobicContact CD2-CD2 3.74Å; L487-W600 HydrophobicContact CD2-CE3 3.69Å; L487-W600 HydrophobicContact CD2-CG 4.37Å; L487-W600 HydrophobicContact CD2-CH2 3.89Å; L487-W600 HydrophobicContact CD2-CZ2 3.96Å; L487-W600 HydrophobicContact CD2-CZ3 3.77Å; L487-W600 HydrophobicContact CG-CH2 4.07Å; L487-W600 HydrophobicContact CG-CZ2 4.09Å; L487-W600 HydrophobicContact CG-CZ3 4.4Å; L487-H603 HydrophobicContact CD2-CB 3.62Å
488	K	86.9	Confident	86.1	Confident	47 Å²	47	43.2 Å²	43.2	20%	0.204	24%	0.238	C	C	.	.	H	α-helix	trans	-55.3	-44.5	172.2	-81.3	-175.7	-157.1	-162.6	0	112.6	E452 Y453 D484 F486 L491 A492 W600	E452-K488 WeakPolarHBondContact OE1-CE 3.32Å; E452-K488 IonicContact OE1-NZ 3.17Å; E452-K488 PolarHBondContact OE1-NZ 2.96Å; Y453-K488 WeakPolarHBondContact OH-CG 3.48Å; D484-K488 VanDerWaalsContact O-CB 3.28Å; D484-K488 WeakPolarHBondContact O-CB 3.43Å; D484-K488 WeakPolarHBondContact O-CG 3.38Å; D484-K488 PolarHBondContact O-N 3.44Å; F486-K488 VanDerWaalsContact C-N 3.31Å; F486-K488 PolarHBondContact O-N 2.78Å; K488-L491 PolarHBondContact O-N 2.83Å; K488-A492 VanDerWaalsContact O-CB 3.32Å; K488-A492 WeakPolarHBondContact O-CB 3.28Å; K488-A492 PolarHBondContact O-N 2.97Å; K488-W600 HydrophobicContact CG-CH2 3.86Å; K488-W600 HydrophobicContact CG-CZ2 4.04Å
489	Q	83.3	Confident	85.1	Confident	68 Å²	68	46.4 Å²	46.4	32%	0.318	25%	0.25	S	C	.	.	H	α-helix	trans	-67.9	-36.7	177.7	-172.9	62.9	70.6	0	0	112	G485 F486 L487 A492 N493	G485-Q489 PolarHBondContact O-N 3.36Å; G485-Q489 VanDerWaalsContact O-N 3.11Å; F486-Q489 PolarHBondContact O-N 3.34Å; F486-Q489 VanDerWaalsContact O-N 3.14Å; L487-Q489 VanDerWaalsContact C-N 3.3Å; L487-Q489 PolarHBondContact O-N 3Å; Q489-A492 WeakPolarHBondContact O-CB 3.36Å; Q489-A492 PolarHBondContact O-N 3.35Å; Q489-N493 PolarHBondContact NE2-OD1 2.94Å; Q489-N493 VanDerWaalsContact O-CG 3.23Å; Q489-N493 PolarHBondContact O-N 2.69Å; Q489-N493 PolarHBondContact O-ND2 3.16Å; Q489-N493 PolarHBondContact O-OD1 3.28Å
490	Q	89.9	Confident	83.5	Confident	102 Å²	102	49.8 Å²	49.8	48%	0.477	29%	0.285	S	S	.	.	H	α-helix	trans	-62.3	-50.5	173.1	-70.9	177.3	-28.3	0	0	111.2	F486 L487 A492 N493 E494	F486-Q490 WeakPolarHBondContact O-CG 3.31Å; F486-Q490 PolarHBondContact O-N 3.38Å; L487-Q490 WeakPolarHBondContact O-CB 3.48Å; L487-Q490 PolarHBondContact O-N 3.17Å; L487-Q490 VanDerWaalsContact O-N 3.17Å; Q490-A492 VanDerWaalsContact C-N 3.25Å; Q490-A492 PolarHBondContact O-N 3.31Å; Q490-N493 PolarHBondContact O-N 3.2Å; Q490-N493 VanDerWaalsContact O-N 3.07Å; Q490-E494 WeakPolarHBondContact O-CG 3.34Å; Q490-E494 PolarHBondContact O-N 3.26Å
491	L	90.9	Very high	81.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-59.1	-37	175.5	-67.2	171.3	0	0	0	112	Y453 L487 K488 N493 F495 V581 L596 R599 W600	Y453-L491 HydrophobicContact CE1-CD1 4.36Å; L487-L491 HydrophobicContact CD1-CD1 4.41Å; L487-L491 HydrophobicContact CD1-CG 4.21Å; L487-L491 HydrophobicContact CG-CD1 4.18Å; L487-L491 HydrophobicContact CG-CG 4.45Å; L487-L491 WeakPolarHBondContact O-CG 3.47Å; L487-L491 PolarHBondContact O-N 3.15Å; K488-L491 PolarHBondContact O-N 2.83Å; L491-N493 VanDerWaalsContact C-N 3.34Å; L491-F495 HydrophobicContact CB-CD2 4.5Å; L491-F495 HydrophobicContact CD2-CD2 4.19Å; L491-F495 HydrophobicContact CD2-CE2 3.74Å; L491-F495 WeakPolarHBondContact O-CD2 3.19Å; L491-F495 PolarHBondContact O-N 3.4Å; L491-F495 VanDerWaalsContact O-N 3.09Å; L491-V581 HydrophobicContact CB-CG1 4.43Å; L491-V581 HydrophobicContact CB-CG2 4.25Å; L491-V581 HydrophobicContact CD1-CG1 4.45Å; L491-V581 HydrophobicContact CD2-CG1 4.27Å; L491-L596 HydrophobicContact CD1-CD1 4.19Å; L491-L596 HydrophobicContact CD2-CD1 4.2Å; L491-R599 VanDerWaalsContact CD2-NH1 3.32Å; L491-W600 HydrophobicContact CD1-CZ2 3.94Å
492	A	85.8	Confident	79.7	Confident	3 Å²	3	52.2 Å²	52.2	3%	0.025	30%	0.298	C	S	.	.	H	α-helix	trans	-62.3	-40.8	175.5	0	0	0	0	0	112.2	K488 Q489 Q490 A496 A497 Q499	K488-A492 VanDerWaalsContact O-CB 3.32Å; K488-A492 WeakPolarHBondContact O-CB 3.28Å; K488-A492 PolarHBondContact O-N 2.97Å; Q489-A492 WeakPolarHBondContact O-CB 3.36Å; Q489-A492 PolarHBondContact O-N 3.35Å; Q490-A492 VanDerWaalsContact C-N 3.25Å; Q490-A492 PolarHBondContact O-N 3.31Å; A492-A496 CarbonylContact O-C 3.58Å; A492-A496 WeakPolarHBondContact O-CA 3.46Å; A492-A496 PolarHBondContact O-N 3.45Å; A492-A497 WeakPolarHBondContact CA-O 3.28Å; A492-A497 WeakPolarHBondContact CB-O 3.34Å; A492-A497 PolarHBondContact O-N 2.88Å; A492-Q499 HydrophobicContact CB-CG 4.41Å
493	N	86.3	Confident	78.1	Confident	117 Å²	117	55.3 Å²	55.3	63%	0.626	31%	0.308	S	S	*	.	H	α-helix	trans	-72.7	-45.8	178.4	-64	-12.1	0	0	0	111.3	Q489 Q490 L491 F495 A496	Q489-N493 PolarHBondContact NE2-OD1 2.94Å; Q489-N493 VanDerWaalsContact O-CG 3.23Å; Q489-N493 PolarHBondContact O-N 2.69Å; Q489-N493 PolarHBondContact O-ND2 3.16Å; Q489-N493 PolarHBondContact O-OD1 3.28Å; Q490-N493 PolarHBondContact O-N 3.2Å; Q490-N493 VanDerWaalsContact O-N 3.07Å; L491-N493 VanDerWaalsContact C-N 3.34Å; N493-F495 PolarHBondContact O-N 3.37Å; N493-A496 PolarHBondContact O-N 3.42Å
494	E	91.1	Very high	76.3	Confident	103 Å²	103	56.3 Å²	56.3	48%	0.481	32%	0.32	S	S	.	.	H	α-helix	trans	-63.1	-40.6	-177.1	-73.4	169.8	-150.3	0	0	113.2	Q490 R599	Q490-E494 WeakPolarHBondContact O-CG 3.34Å; Q490-E494 PolarHBondContact O-N 3.26Å; E494-R599 IonicContact OE1-CZ 3.3Å; E494-R599 IonicContact OE1-NH1 2.76Å; E494-R599 PolarHBondContact OE1-NH1 3.43Å; E494-R599 IonicContact OE1-NH2 3.87Å; E494-R599 PolarHBondContact OE1-NH2 3.47Å; E494-R599 IonicContact OE2-CZ 3.88Å; E494-R599 IonicContact OE2-NH1 3.56Å; E494-R599 PolarHBondContact OE2-NH1 3.4Å; E494-R599 IonicContact OE2-NH2 2.82Å; E494-R599 PolarHBondContact OE2-NH2 3.2Å
495	F	88.1	Confident	74.7	Confident	48 Å²	48	59 Å²	59	21%	0.211	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	15.6	-175.7	-59.9	-66.2	0	0	0	113.3	L491 N493 A497 K580 V581 A584 H585	L491-F495 HydrophobicContact CB-CD2 4.5Å; L491-F495 HydrophobicContact CD2-CD2 4.19Å; L491-F495 HydrophobicContact CD2-CE2 3.74Å; L491-F495 WeakPolarHBondContact O-CD2 3.19Å; L491-F495 PolarHBondContact O-N 3.4Å; L491-F495 VanDerWaalsContact O-N 3.09Å; N493-F495 PolarHBondContact O-N 3.37Å; F495-A497 PolarHBondContact O-N 3.46Å; F495-A497 VanDerWaalsContact O-N 3.13Å; F495-K580 WeakPolarHBondContact O-CE 3.2Å; F495-V581 HydrophobicContact CB-CG2 4.33Å; F495-V581 HydrophobicContact CD2-CB 4.44Å; F495-V581 HydrophobicContact CD2-CG1 3.92Å; F495-V581 HydrophobicContact CD2-CG2 4.2Å; F495-V581 HydrophobicContact CE2-CG1 4.23Å; F495-A584 HydrophobicContact CB-CB 4.28Å; F495-A584 HydrophobicContact CD1-CB 3.3Å; F495-A584 HydrophobicContact CE1-CB 3.81Å; F495-A584 HydrophobicContact CG-CB 3.94Å; F495-H585 AromaticContact CE2-CD2 3.69Å; F495-H585 AromaticContact CE2-NE2 3.33Å; F495-H585 VanDerWaalsContact CE2-NE2 3.33Å; F495-H585 WeakPolarHBondContact CE2-NE2 3.17Å; F495-H585 AromaticContact CZ-CD2 3.51Å; F495-H585 AromaticContact CZ-NE2 3.2Å; F495-H585 WeakPolarHBondContact CZ-NE2 3.28Å
496	A	82.8	Confident	73.8	Confident	60 Å²	60	65.5 Å²	65.5	50%	0.496	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.1	42.1	-175.1	0	0	0	0	0	112.2	A492 N493 P498 K580	A492-A496 CarbonylContact O-C 3.58Å; A492-A496 WeakPolarHBondContact O-CA 3.46Å; A492-A496 PolarHBondContact O-N 3.45Å; N493-A496 PolarHBondContact O-N 3.42Å; A496-P498 WeakPolarHBondContact O-CD 3.23Å; A496-K580 WeakPolarHBondContact O-CE 3.21Å; A496-K580 PolarHBondContact O-NZ 3.39Å
497	A	81.4	Confident	72.9	Confident	2 Å²	2	63.2 Å²	63.2	2%	0.017	35%	0.345	C	S	.	.			trans	-109.2	70.1	-177.3	0	0	0	0	0	110.5	A492 F495 H577 K580 V581	A492-A497 WeakPolarHBondContact CA-O 3.28Å; A492-A497 WeakPolarHBondContact CB-O 3.34Å; A492-A497 PolarHBondContact O-N 2.88Å; F495-A497 PolarHBondContact O-N 3.46Å; F495-A497 VanDerWaalsContact O-N 3.13Å; A497-H577 PolarHBondContact O-CE1 3.2Å; A497-H577 PolarHBondContact O-ND1 3.39Å; A497-K580 HydrophobicContact CB-CB 3.9Å; A497-K580 HydrophobicContact CB-CD 3.89Å; A497-K580 HydrophobicContact CB-CG 3.97Å; A497-V581 HydrophobicContact CB-CG2 3.91Å
498	P	68.4	Low	72	Confident	58 Å²	58	65.4 Å²	65.4	38%	0.377	36%	0.356	S	S	.	.			trans	-60.7	143.2	-174.2	23.8	-33.9	0	0	0	112.8	A496 C501	A496-P498 WeakPolarHBondContact O-CD 3.23Å; P498-C501 HydrophobicContact CB-CB 4.25Å; P498-C501 HydrophobicContact CG-CB 4.4Å; P498-C501 WeakPolarHBondContact CG-SG 3.36Å
499	Q	63.4	Low	71.5	Confident	81 Å²	81	65.5 Å²	65.5	38%	0.379	36%	0.357	S	S	.	.	S	Bend	trans	-100.1	125.8	174.7	-62.6	-171.4	2.1	0	0	109.6	A492 H577	A492-Q499 HydrophobicContact CB-CG 4.41Å; Q499-H577 HydrophobicContact CG-CB 4.28Å; Q499-H577 PolarHBondContact NE2-CD2 2.94Å; Q499-H577 PolarHBondContact NE2-CE1 2.95Å; Q499-H577 PolarHBondContact NE2-NE2 2.94Å
500	G	54.9	Low	71.4	Confident	71 Å²	71	63.9 Å²	63.9	73%	0.732	35%	0.351	S	S	*	.	S	Bend	trans	74.5	19.9	175.7	0	0	0	0	0	115.8
501	C	49.9	Very low	70.9	Confident	35 Å²	35	62.4 Å²	62.4	24%	0.236	35%	0.352	C	S	.	.	S	Bend	trans	-83	165.5	161.7	67.1	0	0	0	0	110.3	P498 E503 G504 V505	P498-C501 HydrophobicContact CB-CB 4.25Å; P498-C501 HydrophobicContact CG-CB 4.4Å; P498-C501 WeakPolarHBondContact CG-SG 3.36Å; C501-E503 VanDerWaalsContact C-N 3.26Å; C501-E503 PolarHBondContact O-N 3.36Å; C501-G504 CarbonylContact O-C 3.47Å; C501-G504 VanDerWaalsContact O-CA 3.27Å; C501-G504 WeakPolarHBondContact O-CA 3.38Å; C501-G504 PolarHBondContact O-N 3.34Å; C501-G504 PolarHBondContact SG-N 2.85Å; C501-V505 WeakPolarHBondContact O-CG2 3.44Å; C501-V505 PolarHBondContact O-N 2.85Å
502	E	48.8	Very low	70.5	Confident	75 Å²	75	66.2 Å²	66.2	35%	0.35	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-59.4	-34.5	179.3	-73	-179	-167.4	0	0	113.2	R327 G504 V505 L508 N571	R327-E502 WeakPolarHBondContact CD-OE1 3.39Å; R327-E502 HydrophobicContact CG-CG 4.36Å; R327-E502 WeakPolarHBondContact CG-OE1 3.48Å; R327-E502 IonicContact CZ-OE1 3.36Å; R327-E502 IonicContact CZ-OE2 3.35Å; R327-E502 IonicContact NE-OE1 2.84Å; R327-E502 PolarHBondContact NE-OE1 2.89Å; R327-E502 IonicContact NE-OE2 2.94Å; R327-E502 PolarHBondContact NE-OE2 3.19Å; R327-E502 IonicContact NH2-OE2 2.69Å; R327-E502 PolarHBondContact NH2-OE2 3.24Å; E502-G504 PolarHBondContact O-N 3.34Å; E502-V505 PolarHBondContact O-N 3.3Å; E502-L508 HydrophobicContact CB-CD2 4.07Å; E502-L508 HydrophobicContact CG-CD2 4.37Å; E502-N571 PolarHBondContact O-ND2 3.01Å
503	E	48.3	Very low	70.7	Confident	129 Å²	129	70 Å²	70	60%	0.603	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-64	-21.1	171.4	-59.9	139.8	-175.8	0	0	112.6	C501 Y574	C501-E503 VanDerWaalsContact C-N 3.26Å; C501-E503 PolarHBondContact O-N 3.36Å; E503-Y574 WeakPolarHBondContact O-CA 3.35Å; E503-Y574 WeakPolarHBondContact O-CD2 3.36Å
504	G	50.1	Low	70.9	Confident	26 Å²	26	69 Å²	69	27%	0.268	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-97.4	9.7	175.5	0	0	0	0	0	113.8	C501 E502 Y574	C501-G504 CarbonylContact O-C 3.47Å; C501-G504 VanDerWaalsContact O-CA 3.27Å; C501-G504 WeakPolarHBondContact O-CA 3.38Å; C501-G504 PolarHBondContact O-N 3.34Å; C501-G504 PolarHBondContact SG-N 2.85Å; E502-G504 PolarHBondContact O-N 3.34Å; G504-Y574 VanDerWaalsContact C-CD2 3.5Å; G504-Y574 VanDerWaalsContact C-CE2 3.42Å; G504-Y574 VanDerWaalsContact O-CE2 3.23Å; G504-Y574 WeakPolarHBondContact O-CE2 3.5Å
505	V	58.5	Low	70.8	Confident	62 Å²	62	69.1 Å²	69.1	38%	0.376	37%	0.369	S	S	.	.			trans	-107.9	120.3	173	-170.3	0	0	0	0	109.3	C501 E502 V507 N571	C501-V505 WeakPolarHBondContact O-CG2 3.44Å; C501-V505 PolarHBondContact O-N 2.85Å; E502-V505 PolarHBondContact O-N 3.3Å; V505-V507 WeakPolarHBondContact CG1-O 3.45Å; V505-V507 PolarHBondContact O-N 2.57Å; V505-N571 VanDerWaalsContact O-CB 3.25Å; V505-N571 WeakPolarHBondContact O-CB 3.3Å; V505-N571 PolarHBondContact O-ND2 3.15Å
506	R	63.4	Low	70.9	Confident	172 Å²	172	67 Å²	67	65%	0.649	36%	0.36	S	S	*	.	S	Bend	trans	-62	-29.5	-178.9	-173.3	177.8	-179	-170.4	0.6	113.4	L570 N571 Y574	R506-L570 HydrophobicContact CG-CD2 4.43Å; R506-N571 PolarHBondContact O-N 2.92Å; R506-Y574 HydrophobicContact CB-CD1 3.87Å; R506-Y574 HydrophobicContact CB-CD2 4.42Å; R506-Y574 HydrophobicContact CB-CE1 3.82Å; R506-Y574 HydrophobicContact CB-CE2 4.41Å; R506-Y574 HydrophobicContact CB-CG 4.16Å; R506-Y574 HydrophobicContact CG-CD1 3.93Å; R506-Y574 HydrophobicContact CG-CE1 4.04Å
507	V	68.1	Low	71.4	Confident	65 Å²	65	67 Å²	67	39%	0.394	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	117.2	-176.2	-178.6	0	0	0	0	108.6	V505 R568 I569 L570	V505-V507 WeakPolarHBondContact CG1-O 3.45Å; V505-V507 PolarHBondContact O-N 2.57Å; V507-R568 HydrophobicContact CG1-CB 3.66Å; V507-R568 HydrophobicContact CG1-CG 4.22Å; V507-I569 CarbonylContact C-O 3.43Å; V507-I569 WeakPolarHBondContact CA-O 3.36Å; V507-L570 HydrophobicContact CG2-CD2 4.31Å
508	L	71.6	Confident	71.9	Confident	50 Å²	50	70 Å²	70	26%	0.262	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	150.3	173.3	-67.4	168.1	0	0	0	109.4	E502 R568 I569 N571	E502-L508 HydrophobicContact CB-CD2 4.07Å; E502-L508 HydrophobicContact CG-CD2 4.37Å; L508-R568 CarbonylContact O-C 3.4Å; L508-R568 WeakPolarHBondContact O-CA 3.42Å; L508-I569 HydrophobicContact CB-CG1 4.33Å; L508-I569 PolarHBondContact N-O 3.16Å; L508-I569 PolarHBondContact O-N 3.17Å; L508-N571 HydrophobicContact CD1-CB 3.74Å; L508-N571 HydrophobicContact CG-CB 3.89Å
509	E	76.1	Confident	73	Confident	48 Å²	48	67.3 Å²	67.3	22%	0.224	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	119	165.8	-168.9	177.8	-80.8	0	0	107.7	R325 S511 R514 T567	R325-E509 IonicContact CZ-OE1 3.22Å; R325-E509 IonicContact CZ-OE2 3.64Å; R325-E509 IonicContact NE-OE2 3.74Å; R325-E509 IonicContact NH1-OE1 2.67Å; R325-E509 PolarHBondContact NH1-OE1 3.34Å; R325-E509 IonicContact NH1-OE2 3.6Å; R325-E509 PolarHBondContact NH1-OE2 2.92Å; R325-E509 IonicContact NH2-OE1 2.73Å; R325-E509 PolarHBondContact NH2-OE1 3.38Å; R325-E509 IonicContact NH2-OE2 3.7Å; R325-E509 PolarHBondContact NH2-OE2 3.11Å; E509-S511 PolarHBondContact O-N 2.84Å; E509-R514 WeakPolarHBondContact OE2-CD 3.44Å; E509-R514 IonicContact OE2-CZ 3.45Å; E509-R514 IonicContact OE2-NE 2.79Å; E509-R514 IonicContact OE2-NH1 2.88Å; E509-R514 PolarHBondContact OE2-NH1 2.96Å; E509-T567 CarbonylContact C-O 3.39Å; E509-T567 VanDerWaalsContact CA-O 3.28Å; E509-T567 WeakPolarHBondContact CA-O 3.48Å
510	D	81.3	Confident	74.3	Confident	35 Å²	35	63.5 Å²	63.5	19%	0.187	33%	0.333	C	S	.	.			trans	-71.3	114.4	171.6	-175.6	-44.5	0	0	0	108.2	D512 R513 R514 T567 I569	D510-D512 VanDerWaalsContact C-N 3.3Å; D510-D512 PolarHBondContact O-N 3.25Å; D510-D512 PolarHBondContact OD1-N 3.39Å; D510-R513 HydrophobicContact CB-CB 3.96Å; D510-R513 HydrophobicContact CB-CG 4.03Å; D510-R513 VanDerWaalsContact CG-CG 3.49Å; D510-R513 PolarHBondContact OD1-N 2.93Å; D510-R513 WeakPolarHBondContact OD2-CD 3.48Å; D510-R513 IonicContact OD2-NE 3.75Å; D510-R513 PolarHBondContact OD2-NE 3.29Å; D510-R514 WeakPolarHBondContact O-CB 3.32Å; D510-R514 PolarHBondContact O-N 2.79Å; D510-R514 VanDerWaalsContact O-N 3.11Å; D510-T567 PolarHBondContact N-O 2.83Å; D510-I569 HydrophobicContact CB-CD1 3.98Å; D510-I569 HydrophobicContact CB-CG1 4.21Å; D510-I569 HydrophobicContact CB-CG2 4.41Å
511	S	79.8	Confident	76.1	Confident	71 Å²	71	66 Å²	66	50%	0.497	32%	0.32	S	S	.	.	H	α-helix	trans	-63.8	-38.3	-177.8	47.6	0	0	0	0	111.6	E509 R514 R515	E509-S511 PolarHBondContact O-N 2.84Å; S511-R514 PolarHBondContact O-N 3.48Å; S511-R515 WeakPolarHBondContact O-CG 3.29Å; S511-R515 PolarHBondContact O-N 3.25Å
512	D	83.3	Confident	78	Confident	79 Å²	79	65.7 Å²	65.7	42%	0.422	32%	0.321	S	S	.	.	H	α-helix	trans	-74.9	-44.8	-173.3	-61	-29.8	0	0	0	110	D510 R514 R515 V516 Y545	D510-D512 VanDerWaalsContact C-N 3.3Å; D510-D512 PolarHBondContact O-N 3.25Å; D510-D512 PolarHBondContact OD1-N 3.39Å; D512-R514 PolarHBondContact O-N 3.2Å; D512-R515 PolarHBondContact O-N 3Å; D512-V516 WeakPolarHBondContact O-CB 3.29Å; D512-V516 WeakPolarHBondContact O-CG2 3.26Å; D512-V516 PolarHBondContact O-N 3.3Å; D512-Y545 HydrophobicContact CB-CD2 4.21Å; D512-Y545 HydrophobicContact CB-CE2 4.06Å
513	R	88.8	Confident	80	Confident	82 Å²	82	63 Å²	63	31%	0.309	31%	0.308	S	S	.	.	H	α-helix	trans	-56.2	-37.6	170.2	-70.6	179.8	-170.7	-144.3	-6.6	112.1	D510 R517 Y545 K566 T567	D510-R513 HydrophobicContact CB-CB 3.96Å; D510-R513 HydrophobicContact CB-CG 4.03Å; D510-R513 VanDerWaalsContact CG-CG 3.49Å; D510-R513 PolarHBondContact OD1-N 2.93Å; D510-R513 WeakPolarHBondContact OD2-CD 3.48Å; D510-R513 IonicContact OD2-NE 3.75Å; D510-R513 PolarHBondContact OD2-NE 3.29Å; R513-R517 WeakPolarHBondContact O-CB 3.2Å; R513-R517 PolarHBondContact O-N 3.21Å; R513-Y545 HydrophobicContact CG-CE2 4.23Å; R513-Y545 WeakPolarHBondContact CG-OH 3.22Å; R513-Y545 PolarHBondContact NE-OH 3.36Å; R513-K566 WeakPolarHBondContact CD-O 3.47Å; R513-K566 PolarHBondContact NH1-O 3.34Å; R513-T567 HydrophobicContact CB-CG2 4.1Å
514	R	89.8	Confident	81.9	Confident	96 Å²	96	59.8 Å²	59.8	36%	0.362	30%	0.295	S	S	.	.	H	α-helix	trans	-68.6	-46.4	179.6	174.3	174.6	168.6	-167.8	-5.4	112	E509 D510 S511 D512 V516 R517 S518 T567	E509-R514 WeakPolarHBondContact OE2-CD 3.44Å; E509-R514 IonicContact OE2-CZ 3.45Å; E509-R514 IonicContact OE2-NE 2.79Å; E509-R514 IonicContact OE2-NH1 2.88Å; E509-R514 PolarHBondContact OE2-NH1 2.96Å; D510-R514 WeakPolarHBondContact O-CB 3.32Å; D510-R514 PolarHBondContact O-N 2.79Å; D510-R514 VanDerWaalsContact O-N 3.11Å; S511-R514 PolarHBondContact O-N 3.48Å; D512-R514 PolarHBondContact O-N 3.2Å; R514-V516 VanDerWaalsContact C-N 3.35Å; R514-R517 PolarHBondContact O-N 3.07Å; R514-S518 WeakPolarHBondContact O-CB 3.24Å; R514-S518 PolarHBondContact O-N 2.96Å; R514-T567 VanDerWaalsContact CA-CG2 3.45Å; R514-T567 HydrophobicContact CB-CG2 3.91Å
515	R	89.3	Confident	83.6	Confident	107 Å²	107	63 Å²	63	40%	0.404	31%	0.313	S	S	.	.	H	α-helix	trans	-59.9	-47.9	178	-69	173.8	70.5	-160.5	-0.9	110.6	E322 S511 D512 S518 A519 L541	E322-R515 WeakPolarHBondContact OE1-CG 3.47Å; E322-R515 WeakPolarHBondContact OE2-CG 3.44Å; E322-R515 IonicContact OE2-NE 2.62Å; S511-R515 WeakPolarHBondContact O-CG 3.29Å; S511-R515 PolarHBondContact O-N 3.25Å; D512-R515 PolarHBondContact O-N 3Å; R515-S518 PolarHBondContact O-N 3.01Å; R515-A519 WeakPolarHBondContact O-CB 3Å; R515-A519 PolarHBondContact O-N 2.95Å; R515-L541 HydrophobicContact CB-CD1 4.48Å; R515-L541 HydrophobicContact CB-CD2 4.22Å
516	V	91.7	Very high	84.5	Confident	3 Å²	3	61 Å²	61	2%	0.018	30%	0.304	C	S	.	.	H	α-helix	trans	-63.9	-44.7	-179.5	174.1	0	0	0	0	111.2	D512 R514 S518 A519 A520 L541 I542 Y545 A562 L565	D512-V516 WeakPolarHBondContact O-CB 3.29Å; D512-V516 WeakPolarHBondContact O-CG2 3.26Å; D512-V516 PolarHBondContact O-N 3.3Å; R514-V516 VanDerWaalsContact C-N 3.35Å; V516-S518 VanDerWaalsContact C-N 3.32Å; V516-S518 PolarHBondContact O-N 3.38Å; V516-A519 PolarHBondContact O-N 3.46Å; V516-A520 WeakPolarHBondContact O-CB 3.42Å; V516-A520 PolarHBondContact O-N 3.27Å; V516-L541 HydrophobicContact CB-CD2 4.37Å; V516-L541 HydrophobicContact CG2-CD2 3.83Å; V516-L541 HydrophobicContact CG2-CG 4.41Å; V516-I542 HydrophobicContact CG1-CG1 4.27Å; V516-Y545 HydrophobicContact CB-CD1 4.28Å; V516-Y545 HydrophobicContact CB-CG 4.22Å; V516-Y545 HydrophobicContact CG1-CD1 3.82Å; V516-Y545 HydrophobicContact CG1-CE1 4.49Å; V516-Y545 HydrophobicContact CG1-CG 4.14Å; V516-Y545 VanDerWaalsContact CG2-CB 3.43Å; V516-Y545 HydrophobicContact CG2-CD1 3.96Å; V516-Y545 HydrophobicContact CG2-CD2 3.72Å; V516-Y545 HydrophobicContact CG2-CG 3.41Å; V516-Y545 VanDerWaalsContact CG2-CG 3.41Å; V516-A562 HydrophobicContact CG1-CB 3.99Å; V516-L565 HydrophobicContact CB-CD1 4.06Å; V516-L565 HydrophobicContact CG1-CD1 3.57Å
517	R	92.4	Very high	84.7	Confident	61 Å²	61	61 Å²	61	23%	0.23	31%	0.308	C	S	.	.	H	α-helix	trans	-60.2	-42	174.3	-172.4	-179.6	66.5	-177.8	-2.2	112.7	R513 R514 R521 A562 A563 L565 T567	R513-R517 WeakPolarHBondContact O-CB 3.2Å; R513-R517 PolarHBondContact O-N 3.21Å; R514-R517 PolarHBondContact O-N 3.07Å; R517-R521 WeakPolarHBondContact O-CB 3.24Å; R517-R521 VanDerWaalsContact O-CG 3.25Å; R517-R521 WeakPolarHBondContact O-CG 3.25Å; R517-R521 PolarHBondContact O-N 2.98Å; R517-R521 VanDerWaalsContact O-N 3.11Å; R517-A562 VanDerWaalsContact CA-O 3.31Å; R517-A562 WeakPolarHBondContact CA-O 3.39Å; R517-A563 WeakPolarHBondContact CG-O 3.38Å; R517-L565 HydrophobicContact CB-CB 4.47Å; R517-L565 WeakPolarHBondContact CD-O 3.38Å; R517-T567 HydrophobicContact CB-CG2 4.29Å; R517-T567 VanDerWaalsContact CZ-OG1 3.25Å; R517-T567 PolarHBondContact NH1-OG1 3.38Å; R517-T567 PolarHBondContact NH2-OG1 3.07Å; R517-T567 VanDerWaalsContact NH2-OG1 3.16Å
518	S	91.6	Very high	84.6	Confident	63 Å²	63	65.5 Å²	65.5	44%	0.441	33%	0.33	S	S	.	.	H	α-helix	trans	-66.3	-42.8	178.2	-163.7	0	0	0	0	111.2	R514 R515 V516 R521 A522	R514-S518 WeakPolarHBondContact O-CB 3.24Å; R514-S518 PolarHBondContact O-N 2.96Å; R515-S518 PolarHBondContact O-N 3.01Å; V516-S518 VanDerWaalsContact C-N 3.32Å; V516-S518 PolarHBondContact O-N 3.38Å; S518-R521 PolarHBondContact O-N 3.32Å; S518-A522 WeakPolarHBondContact O-CB 3.21Å; S518-A522 PolarHBondContact O-N 3.38Å
519	A	91.1	Very high	84.8	Confident	3 Å²	3	66.7 Å²	66.7	3%	0.025	35%	0.354	C	S	.	.	H	α-helix	trans	-61.2	-48.1	177	0	0	0	0	0	112	R515 V516 R521 A522 L523 L538 L541 I542	R515-A519 WeakPolarHBondContact O-CB 3Å; R515-A519 PolarHBondContact O-N 2.95Å; V516-A519 PolarHBondContact O-N 3.46Å; A519-R521 PolarHBondContact O-N 3.16Å; A519-A522 WeakPolarHBondContact O-CB 3.39Å; A519-A522 PolarHBondContact O-N 3.03Å; A519-L523 WeakPolarHBondContact O-CG 3.17Å; A519-L523 PolarHBondContact O-N 3.38Å; A519-L538 HydrophobicContact CB-CB 4.12Å; A519-L538 HydrophobicContact CB-CD2 3.66Å; A519-L538 HydrophobicContact CB-CG 4.37Å; A519-L541 HydrophobicContact CB-CD2 3.64Å; A519-I542 HydrophobicContact CB-CD1 4.04Å; A519-I542 HydrophobicContact CB-CG1 4.02Å
520	A	92.2	Very high	85.1	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-63.2	-42.9	179.9	0	0	0	0	0	112	V516 A522 L523 L524 I542 L559 A562 A563	V516-A520 WeakPolarHBondContact O-CB 3.42Å; V516-A520 PolarHBondContact O-N 3.27Å; A520-A522 VanDerWaalsContact C-N 3.34Å; A520-A522 PolarHBondContact O-N 3.11Å; A520-L523 PolarHBondContact O-N 3.03Å; A520-L524 WeakPolarHBondContact O-CG 3.08Å; A520-L524 PolarHBondContact O-N 2.79Å; A520-I542 HydrophobicContact CB-CD1 3.86Å; A520-L559 HydrophobicContact CB-CD2 4.37Å; A520-L559 WeakPolarHBondContact CB-O 3.4Å; A520-A562 HydrophobicContact CB-CB 3.54Å; A520-A563 HydrophobicContact CB-CB 4.03Å
521	R	92.4	Very high	85.5	Confident	123 Å²	123	68.7 Å²	68.7	46%	0.464	37%	0.371	S	S	.	.	H	α-helix	trans	-64	-38.4	174.9	-72.4	174.2	-178.7	-158.6	-7.5	112.6	R517 S518 A519 L524 S525 A563	R517-R521 WeakPolarHBondContact O-CB 3.24Å; R517-R521 VanDerWaalsContact O-CG 3.25Å; R517-R521 WeakPolarHBondContact O-CG 3.25Å; R517-R521 PolarHBondContact O-N 2.98Å; R517-R521 VanDerWaalsContact O-N 3.11Å; S518-R521 PolarHBondContact O-N 3.32Å; A519-R521 PolarHBondContact O-N 3.16Å; R521-L524 PolarHBondContact O-N 3.19Å; R521-S525 VanDerWaalsContact O-CB 3.27Å; R521-S525 WeakPolarHBondContact O-CB 3.18Å; R521-S525 PolarHBondContact O-N 3.07Å; R521-S525 PolarHBondContact O-OG 3.08Å; R521-A563 HydrophobicContact CG-CB 3.75Å; R521-A563 PolarHBondContact NE-O 2.87Å; R521-A563 PolarHBondContact NH2-O 2.6Å; R521-A563 VanDerWaalsContact NH2-O 3.1Å
522	A	89.8	Confident	85.8	Confident	30 Å²	30	72.7 Å²	72.7	25%	0.248	38%	0.382	C	S	.	.	H	α-helix	trans	-63.3	-42.8	175.6	0	0	0	0	0	111	S518 A519 A520 S525 A526 L538	S518-A522 WeakPolarHBondContact O-CB 3.21Å; S518-A522 PolarHBondContact O-N 3.38Å; A519-A522 WeakPolarHBondContact O-CB 3.39Å; A519-A522 PolarHBondContact O-N 3.03Å; A520-A522 VanDerWaalsContact C-N 3.34Å; A520-A522 PolarHBondContact O-N 3.11Å; A522-S525 PolarHBondContact O-N 2.94Å; A522-S525 PolarHBondContact O-OG 2.83Å; A522-A526 WeakPolarHBondContact O-CB 3.45Å; A522-A526 PolarHBondContact O-N 3.31Å; A522-L538 HydrophobicContact CB-CD1 3.85Å
523	L	89.5	Confident	86	Confident	17 Å²	17	75.8 Å²	75.8	9%	0.089	39%	0.394	C	S	.	.	H	α-helix	trans	-67.3	-35.7	176.4	-68.5	174.3	0	0	0	113.4	A519 A520 L530 R535 L538 Q539 I542 L559	A519-L523 WeakPolarHBondContact O-CG 3.17Å; A519-L523 PolarHBondContact O-N 3.38Å; A520-L523 PolarHBondContact O-N 3.03Å; L523-L530 HydrophobicContact CD2-CD2 4.44Å; L523-R535 HydrophobicContact CD2-CB 4.43Å; L523-R535 HydrophobicContact CD2-CG 3.65Å; L523-L538 HydrophobicContact CD1-CB 4.01Å; L523-L538 HydrophobicContact CD2-CB 4.17Å; L523-L538 HydrophobicContact CD2-CD1 4.32Å; L523-L538 HydrophobicContact CG-CB 4.05Å; L523-L538 HydrophobicContact CG-CD1 4.31Å; L523-Q539 HydrophobicContact CD1-CG 3.82Å; L523-Q539 HydrophobicContact CD2-CG 4.43Å; L523-I542 HydrophobicContact CD1-CD1 3.63Å; L523-L559 HydrophobicContact CB-CD1 4.33Å; L523-L559 HydrophobicContact CB-CD2 4.12Å; L523-L559 HydrophobicContact CD1-CD2 3.74Å
524	L	89.1	Confident	85.7	Confident	62 Å²	62	77.3 Å²	77.3	33%	0.325	40%	0.4	S	S	.	.	H	α-helix	trans	-74.9	-32.8	177.5	-71.6	169.4	0	0	0	113.3	A520 R521 L559 A563	A520-L524 WeakPolarHBondContact O-CG 3.08Å; A520-L524 PolarHBondContact O-N 2.79Å; R521-L524 PolarHBondContact O-N 3.19Å; L524-L559 HydrophobicContact CD1-CB 4.25Å; L524-L559 HydrophobicContact CD2-CB 3.83Å; L524-L559 HydrophobicContact CD2-CD1 4.26Å; L524-L559 HydrophobicContact CG-CB 3.99Å; L524-A563 HydrophobicContact CD1-CB 3.78Å
525	S	86.3	Confident	85.6	Confident	93 Å²	93	75.7 Å²	75.7	65%	0.65	39%	0.393	S	S	*	.	H	α-helix	trans	-91.9	-33.2	-175.4	59	0	0	0	0	113.4	R521 A522 K527	R521-S525 VanDerWaalsContact O-CB 3.27Å; R521-S525 WeakPolarHBondContact O-CB 3.18Å; R521-S525 PolarHBondContact O-N 3.07Å; R521-S525 PolarHBondContact O-OG 3.08Å; A522-S525 PolarHBondContact O-N 2.94Å; A522-S525 PolarHBondContact O-OG 2.83Å; S525-K527 PolarHBondContact O-N 3.05Å
526	A	77.8	Confident	85.5	Confident	21 Å²	21	74.7 Å²	74.7	17%	0.174	40%	0.396	C	S	.	.			trans	-90.6	102.6	177.5	0	0	0	0	0	109.7	A522 L530	A522-A526 WeakPolarHBondContact O-CB 3.45Å; A522-A526 PolarHBondContact O-N 3.31Å; A526-L530 HydrophobicContact CB-CB 4.03Å; A526-L530 HydrophobicContact CB-CD1 3.28Å; A526-L530 HydrophobicContact CB-CG 4.2Å
527	K	66.6	Low	85.5	Confident	173 Å²	173	78.8 Å²	78.8	75%	0.752	42%	0.415	S	S	*	.	S	Bend	trans	-63.1	-107.5	171.2	-61.1	179.9	178.3	-177.4	0	110.4	S525 R535	S525-K527 PolarHBondContact O-N 3.05Å; K527-R535 PolarHBondContact O-NH2 2.97Å
528	D	66.8	Low	85.3	Confident	159 Å²	159	76.5 Å²	76.5	85%	0.85	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	1.2	-179.5	-52.4	-47.7	0	0	0	113.7	L530	D528-L530 VanDerWaalsContact C-N 3.34Å; D528-L530 PolarHBondContact O-N 2.72Å
529	G	75.8	Confident	85.2	Confident	74 Å²	74	75.7 Å²	75.7	76%	0.763	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-0.5	-175.2	0	0	0	0	0	115.7
530	L	82.8	Confident	85.1	Confident	37 Å²	37	80.1 Å²	80.1	19%	0.194	42%	0.42	C	S	.	.	S	Bend	trans	-100.1	126.5	-179	-134.4	89.5	0	0	0	110.6	L523 A526 D528 R534 R535 L538	L523-L530 HydrophobicContact CD2-CD2 4.44Å; A526-L530 HydrophobicContact CB-CB 4.03Å; A526-L530 HydrophobicContact CB-CD1 3.28Å; A526-L530 HydrophobicContact CB-CG 4.2Å; D528-L530 VanDerWaalsContact C-N 3.34Å; D528-L530 PolarHBondContact O-N 2.72Å; L530-R534 HydrophobicContact CD2-CB 4.4Å; L530-R534 HydrophobicContact CD2-CG 4.04Å; L530-R534 HydrophobicContact CG-CG 4.48Å; L530-R535 HydrophobicContact CD2-CB 4.47Å; L530-L538 HydrophobicContact CD2-CD1 3.74Å
531	P	89.4	Confident	85	Confident	89 Å²	89	82.1 Å²	82.1	58%	0.578	43%	0.43	S	S	*	.			trans	-55.5	141	173.5	-25.4	34.3	0	0	0	112.1	Q533 R534 R535	P531-Q533 PolarHBondContact O-N 3.06Å; P531-R534 HydrophobicContact CB-CB 4.38Å; P531-R534 WeakPolarHBondContact O-CB 3.36Å; P531-R534 PolarHBondContact O-N 3.28Å; P531-R535 PolarHBondContact O-N 2.8Å
532	E	85.3	Confident	84.9	Confident	154 Å²	154	76.3 Å²	76.3	72%	0.72	41%	0.408	S	S	*	.	H	α-helix	trans	-56.5	-47.4	-175.1	-167	170.6	-165.2	0	0	112.2	R534 R535 D536	E532-R534 VanDerWaalsContact C-N 3.26Å; E532-R534 PolarHBondContact O-N 2.9Å; E532-R535 WeakPolarHBondContact O-CA 3.3Å; E532-R535 VanDerWaalsContact O-CB 3.29Å; E532-R535 WeakPolarHBondContact O-CB 3.46Å; E532-R535 PolarHBondContact O-N 2.79Å; E532-D536 PolarHBondContact O-N 3.1Å
533	Q	86.9	Confident	84.9	Confident	145 Å²	145	78.2 Å²	78.2	68%	0.678	41%	0.409	S	S	*	.	H	α-helix	trans	-54.2	-41.5	174.3	-173.9	-179.5	12	0	0	112.8	P531 E537	P531-Q533 PolarHBondContact O-N 3.06Å; Q533-E537 WeakPolarHBondContact O-CG 3.34Å; Q533-E537 PolarHBondContact O-N 3.04Å
534	R	84.2	Confident	84.9	Confident	113 Å²	113	83 Å²	83	43%	0.426	44%	0.435	S	S	.	.	H	α-helix	trans	-73.1	-33	179.2	-175.4	55.4	176.5	171.5	2.1	111.5	L530 P531 E532 E537 L538	L530-R534 HydrophobicContact CD2-CB 4.4Å; L530-R534 HydrophobicContact CD2-CG 4.04Å; L530-R534 HydrophobicContact CG-CG 4.48Å; P531-R534 HydrophobicContact CB-CB 4.38Å; P531-R534 WeakPolarHBondContact O-CB 3.36Å; P531-R534 PolarHBondContact O-N 3.28Å; E532-R534 VanDerWaalsContact C-N 3.26Å; E532-R534 PolarHBondContact O-N 2.9Å; R534-E537 VanDerWaalsContact CD-OE2 3.29Å; R534-E537 WeakPolarHBondContact CD-OE2 3.28Å; R534-E537 IonicContact CZ-OE2 3.74Å; R534-E537 IonicContact NE-OE2 3.96Å; R534-E537 IonicContact NH1-OE2 2.74Å; R534-E537 PolarHBondContact NH1-OE2 2.97Å; R534-L538 HydrophobicContact CG-CD1 4.46Å; R534-L538 VanDerWaalsContact O-CG 3.24Å; R534-L538 WeakPolarHBondContact O-CG 3.49Å; R534-L538 PolarHBondContact O-N 2.78Å
535	R	86.4	Confident	84.9	Confident	62 Å²	62	83.8 Å²	83.8	23%	0.234	43%	0.434	C	S	.	.	H	α-helix	trans	-63	-45.7	175.2	-169.8	-178.2	-60.8	-83.2	-2	110.4	L523 K527 L530 P531 E532 L538 Q539	L523-R535 HydrophobicContact CD2-CB 4.43Å; L523-R535 HydrophobicContact CD2-CG 3.65Å; K527-R535 PolarHBondContact O-NH2 2.97Å; L530-R535 HydrophobicContact CD2-CB 4.47Å; P531-R535 PolarHBondContact O-N 2.8Å; E532-R535 WeakPolarHBondContact O-CA 3.3Å; E532-R535 VanDerWaalsContact O-CB 3.29Å; E532-R535 WeakPolarHBondContact O-CB 3.46Å; E532-R535 PolarHBondContact O-N 2.79Å; R535-L538 PolarHBondContact O-N 3.27Å; R535-Q539 WeakPolarHBondContact O-CG 3.43Å; R535-Q539 PolarHBondContact O-N 2.91Å
536	D	87.4	Confident	84.8	Confident	86 Å²	86	81.6 Å²	81.6	46%	0.46	41%	0.414	S	S	.	.	H	α-helix	trans	-63.8	-42.9	179.8	-63.6	-21.9	0	0	0	112.1	E532 L538 Q539 L540	E532-D536 PolarHBondContact O-N 3.1Å; D536-L538 VanDerWaalsContact C-N 3.34Å; D536-L538 PolarHBondContact O-N 3.11Å; D536-Q539 PolarHBondContact O-N 3.49Å; D536-L540 WeakPolarHBondContact O-CB 3.37Å; D536-L540 PolarHBondContact O-N 3.22Å
537	E	90.9	Very high	85.1	Confident	90 Å²	90	87.6 Å²	87.6	42%	0.421	44%	0.443	S	S	.	.	H	α-helix	trans	-57.4	-45	174.4	-75.1	173.3	-173.3	0	0	112.6	Q533 R534 L541	Q533-E537 WeakPolarHBondContact O-CG 3.34Å; Q533-E537 PolarHBondContact O-N 3.04Å; R534-E537 VanDerWaalsContact CD-OE2 3.29Å; R534-E537 WeakPolarHBondContact CD-OE2 3.28Å; R534-E537 IonicContact CZ-OE2 3.74Å; R534-E537 IonicContact NE-OE2 3.96Å; R534-E537 IonicContact NH1-OE2 2.74Å; R534-E537 PolarHBondContact NH1-OE2 2.97Å; E537-L541 WeakPolarHBondContact O-CB 3.2Å; E537-L541 PolarHBondContact O-N 3.26Å; E537-L541 VanDerWaalsContact O-N 3.12Å
538	L	90.1	Very high	85.9	Confident	13 Å²	13	80.9 Å²	80.9	7%	0.068	41%	0.414	C	S	.	.	H	α-helix	trans	-70.9	-38.5	-179.4	-65.7	179.9	0	0	0	111.6	A519 A522 L523 L530 R534 R535 D536 L541 I542	A519-L538 HydrophobicContact CB-CB 4.12Å; A519-L538 HydrophobicContact CB-CD2 3.66Å; A519-L538 HydrophobicContact CB-CG 4.37Å; A522-L538 HydrophobicContact CB-CD1 3.85Å; L523-L538 HydrophobicContact CD1-CB 4.01Å; L523-L538 HydrophobicContact CD2-CB 4.17Å; L523-L538 HydrophobicContact CD2-CD1 4.32Å; L523-L538 HydrophobicContact CG-CB 4.05Å; L523-L538 HydrophobicContact CG-CD1 4.31Å; L530-L538 HydrophobicContact CD2-CD1 3.74Å; R534-L538 HydrophobicContact CG-CD1 4.46Å; R534-L538 VanDerWaalsContact O-CG 3.24Å; R534-L538 WeakPolarHBondContact O-CG 3.49Å; R534-L538 PolarHBondContact O-N 2.78Å; R535-L538 PolarHBondContact O-N 3.27Å; D536-L538 VanDerWaalsContact C-N 3.34Å; D536-L538 PolarHBondContact O-N 3.11Å; L538-L541 PolarHBondContact O-N 3.39Å; L538-I542 WeakPolarHBondContact O-CD1 3.19Å; L538-I542 VanDerWaalsContact O-CG1 3.31Å; L538-I542 WeakPolarHBondContact O-CG1 3.19Å; L538-I542 PolarHBondContact O-N 2.81Å
539	Q	89.1	Confident	86.5	Confident	46 Å²	46	78.5 Å²	78.5	22%	0.215	40%	0.402	C	S	.	.	H	α-helix	trans	-64.3	-45.3	175.3	-72.9	-178	6.9	0	0	111.3	L523 R535 D536 L541 I542 R543 L554	L523-Q539 HydrophobicContact CD1-CG 3.82Å; L523-Q539 HydrophobicContact CD2-CG 4.43Å; R535-Q539 WeakPolarHBondContact O-CG 3.43Å; R535-Q539 PolarHBondContact O-N 2.91Å; D536-Q539 PolarHBondContact O-N 3.49Å; Q539-L541 VanDerWaalsContact C-N 3.33Å; Q539-L541 PolarHBondContact O-N 3.46Å; Q539-I542 PolarHBondContact O-N 3.2Å; Q539-R543 WeakPolarHBondContact O-CG 3.35Å; Q539-R543 PolarHBondContact O-N 3.3Å; Q539-L554 HydrophobicContact CG-CD2 4.26Å
540	L	88.9	Confident	86.2	Confident	96 Å²	96	84.4 Å²	84.4	50%	0.503	41%	0.409	S	S	.	.	H	α-helix	trans	-60.7	-41.8	177.9	-175.7	64.1	0	0	0	111.9	D536 I542 R543 N544	D536-L540 WeakPolarHBondContact O-CB 3.37Å; D536-L540 PolarHBondContact O-N 3.22Å; L540-I542 VanDerWaalsContact C-N 3.32Å; L540-I542 PolarHBondContact O-N 3.43Å; L540-R543 PolarHBondContact O-N 3.44Å; L540-N544 WeakPolarHBondContact O-CB 3.31Å; L540-N544 PolarHBondContact O-N 3.33Å; L540-N544 PolarHBondContact O-ND2 3.48Å
541	L	90.3	Very high	85.4	Confident	42 Å²	42	91.7 Å²	91.7	22%	0.22	44%	0.443	C	S	.	.	H	α-helix	trans	-61.2	-39.6	176.5	-177.7	119.6	0	0	0	112.4	R515 V516 A519 E537 L538 Q539 Y545	R515-L541 HydrophobicContact CB-CD1 4.48Å; R515-L541 HydrophobicContact CB-CD2 4.22Å; V516-L541 HydrophobicContact CB-CD2 4.37Å; V516-L541 HydrophobicContact CG2-CD2 3.83Å; V516-L541 HydrophobicContact CG2-CG 4.41Å; A519-L541 HydrophobicContact CB-CD2 3.64Å; E537-L541 WeakPolarHBondContact O-CB 3.2Å; E537-L541 PolarHBondContact O-N 3.26Å; E537-L541 VanDerWaalsContact O-N 3.12Å; L538-L541 PolarHBondContact O-N 3.39Å; Q539-L541 VanDerWaalsContact C-N 3.33Å; Q539-L541 PolarHBondContact O-N 3.46Å; L541-Y545 PolarHBondContact O-N 3Å
542	I	89.8	Confident	84.7	Confident	0 Å²	0	92 Å²	92	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-72	-44.2	178.2	-62.8	164.7	0	0	0	110.7	V516 A519 A520 L523 L538 Q539 L540 N544 Y545 M546 L554 L559 A562	V516-I542 HydrophobicContact CG1-CG1 4.27Å; A519-I542 HydrophobicContact CB-CD1 4.04Å; A519-I542 HydrophobicContact CB-CG1 4.02Å; A520-I542 HydrophobicContact CB-CD1 3.86Å; L523-I542 HydrophobicContact CD1-CD1 3.63Å; L538-I542 WeakPolarHBondContact O-CD1 3.19Å; L538-I542 VanDerWaalsContact O-CG1 3.31Å; L538-I542 WeakPolarHBondContact O-CG1 3.19Å; L538-I542 PolarHBondContact O-N 2.81Å; Q539-I542 PolarHBondContact O-N 3.2Å; L540-I542 VanDerWaalsContact C-N 3.32Å; L540-I542 PolarHBondContact O-N 3.43Å; I542-N544 VanDerWaalsContact C-N 3.34Å; I542-N544 PolarHBondContact O-N 3.23Å; I542-Y545 PolarHBondContact O-N 2.97Å; I542-M546 HydrophobicContact CG2-CG 4.11Å; I542-M546 WeakPolarHBondContact O-CB 3.19Å; I542-M546 WeakPolarHBondContact O-CG 3.19Å; I542-M546 PolarHBondContact O-N 3.22Å; I542-L554 HydrophobicContact CD1-CD2 4.44Å; I542-L554 HydrophobicContact CG2-CD1 4.3Å; I542-L554 HydrophobicContact CG2-CD2 4.32Å; I542-L559 HydrophobicContact CD1-CD2 3.63Å; I542-A562 HydrophobicContact CG2-CB 4.08Å
543	R	89.4	Confident	84.3	Confident	71 Å²	71	92.5 Å²	92.5	27%	0.268	44%	0.439	S	S	.	.	H	α-helix	trans	-56.4	-48	176.7	-71.9	-173.9	-176.4	126.9	5.3	111.8	Q539 L540 Y545 M546 D547 M548 L554	Q539-R543 WeakPolarHBondContact O-CG 3.35Å; Q539-R543 PolarHBondContact O-N 3.3Å; L540-R543 PolarHBondContact O-N 3.44Å; R543-Y545 VanDerWaalsContact C-N 3.28Å; R543-Y545 PolarHBondContact O-N 3.21Å; R543-M546 PolarHBondContact O-N 3.31Å; R543-D547 PolarHBondContact O-N 2.85Å; R543-D547 VanDerWaalsContact O-N 3.07Å; R543-M548 HydrophobicContact CB-CB 4.31Å; R543-M548 HydrophobicContact CG-CB 4.39Å; R543-M548 PolarHBondContact O-N 3.3Å; R543-L554 HydrophobicContact CB-CD1 4.42Å; R543-L554 HydrophobicContact CG-CD1 3.25Å
544	N	88.8	Confident	84.1	Confident	118 Å²	118	86.9 Å²	86.9	63%	0.631	41%	0.413	S	S	*	.	H	α-helix	trans	-63.5	-33.5	-179.6	-70.2	-12.4	0	0	0	112.8	L540 I542	L540-N544 WeakPolarHBondContact O-CB 3.31Å; L540-N544 PolarHBondContact O-N 3.33Å; L540-N544 PolarHBondContact O-ND2 3.48Å; I542-N544 VanDerWaalsContact C-N 3.34Å; I542-N544 PolarHBondContact O-N 3.23Å
545	Y	89.1	Confident	84.2	Confident	78 Å²	78	84.2 Å²	84.2	31%	0.306	41%	0.409	S	S	.	.	H	α-helix	trans	-80.4	-34.9	179.7	-178.4	-89.3	0	0	0	112.9	D512 R513 V516 L541 I542 R543 D547 L565	D512-Y545 HydrophobicContact CB-CD2 4.21Å; D512-Y545 HydrophobicContact CB-CE2 4.06Å; R513-Y545 HydrophobicContact CG-CE2 4.23Å; R513-Y545 WeakPolarHBondContact CG-OH 3.22Å; R513-Y545 PolarHBondContact NE-OH 3.36Å; V516-Y545 HydrophobicContact CB-CD1 4.28Å; V516-Y545 HydrophobicContact CB-CG 4.22Å; V516-Y545 HydrophobicContact CG1-CD1 3.82Å; V516-Y545 HydrophobicContact CG1-CE1 4.49Å; V516-Y545 HydrophobicContact CG1-CG 4.14Å; V516-Y545 VanDerWaalsContact CG2-CB 3.43Å; V516-Y545 HydrophobicContact CG2-CD1 3.96Å; V516-Y545 HydrophobicContact CG2-CD2 3.72Å; V516-Y545 HydrophobicContact CG2-CG 3.41Å; V516-Y545 VanDerWaalsContact CG2-CG 3.41Å; L541-Y545 PolarHBondContact O-N 3Å; I542-Y545 PolarHBondContact O-N 2.97Å; R543-Y545 VanDerWaalsContact C-N 3.28Å; R543-Y545 PolarHBondContact O-N 3.21Å; Y545-D547 VanDerWaalsContact C-N 3.26Å; Y545-L565 HydrophobicContact CD1-CD1 4.14Å; Y545-L565 HydrophobicContact CE1-CD1 3.61Å; Y545-L565 HydrophobicContact CE1-CD2 4.31Å
546	M	85.5	Confident	84.2	Confident	47 Å²	47	86.8 Å²	86.8	23%	0.232	43%	0.428	C	S	.	.	H	α-helix	trans	-86.5	3.2	179.3	-59.2	-66	-89.5	0	0	112.7	I542 R543 M548 V558 E561	I542-M546 HydrophobicContact CG2-CG 4.11Å; I542-M546 WeakPolarHBondContact O-CB 3.19Å; I542-M546 WeakPolarHBondContact O-CG 3.19Å; I542-M546 PolarHBondContact O-N 3.22Å; R543-M546 PolarHBondContact O-N 3.31Å; M546-M548 VanDerWaalsContact C-N 3.3Å; M546-M548 HydrophobicContact CB-CG 3.94Å; M546-M548 HydrophobicContact CB-SD 4.25Å; M546-M548 PolarHBondContact O-N 3.47Å; M546-V558 HydrophobicContact CE-CG1 4.22Å; M546-E561 HydrophobicContact CE-CB 4.32Å; M546-E561 HydrophobicContact CE-CG 3.94Å
547	D	84.5	Confident	84.1	Confident	146 Å²	146	89.2 Å²	89.2	78%	0.781	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	44.1	-178.6	-156.1	29.8	0	0	0	112.7	R543 Y545	R543-D547 PolarHBondContact O-N 2.85Å; R543-D547 VanDerWaalsContact O-N 3.07Å; Y545-D547 VanDerWaalsContact C-N 3.26Å
548	M	83.6	Confident	84	Confident	32 Å²	32	86.3 Å²	86.3	16%	0.158	43%	0.425	C	S	.	.			trans	-86.7	137.6	-179.7	-64.6	179.9	72.6	0	0	111.4	R543 M546 Q552 E553 L554 V558	R543-M548 HydrophobicContact CB-CB 4.31Å; R543-M548 HydrophobicContact CG-CB 4.39Å; R543-M548 PolarHBondContact O-N 3.3Å; M546-M548 VanDerWaalsContact C-N 3.3Å; M546-M548 HydrophobicContact CB-CG 3.94Å; M546-M548 HydrophobicContact CB-SD 4.25Å; M546-M548 PolarHBondContact O-N 3.47Å; M548-Q552 VanDerWaalsContact CA-OE1 3.3Å; M548-Q552 HydrophobicContact CB-CB 4.44Å; M548-Q552 HydrophobicContact CE-CB 3.79Å; M548-E553 WeakPolarHBondContact CE-O 3.47Å; M548-L554 HydrophobicContact CE-CD1 4.35Å; M548-L554 HydrophobicContact SD-CD1 3.82Å; M548-V558 HydrophobicContact SD-CG1 3.83Å
549	N	79	Confident	83.9	Confident	109 Å²	109	86.3 Å²	86.3	58%	0.583	43%	0.425	S	S	*	.			trans	-72.7	157.1	175	-66.1	-28.8	0	0	0	111.5	E551 Q552	N549-E551 PolarHBondContact O-N 3.01Å; N549-E551 VanDerWaalsContact O-N 3.08Å; N549-Q552 HydrophobicContact CB-CG 4.39Å; N549-Q552 PolarHBondContact O-N 3.45Å
550	E	67.9	Low	84.1	Confident	198 Å²	198	88.5 Å²	88.5	93%	0.925	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-24.4	-179.7	-67.9	-174.3	167.5	0	0	113.7
551	E	66.7	Low	84.1	Confident	191 Å²	191	89.8 Å²	89.8	89%	0.893	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-9.7	178.3	-60.6	-178.6	175.5	0	0	113.8	N549	N549-E551 PolarHBondContact O-N 3.01Å; N549-E551 VanDerWaalsContact O-N 3.08Å
552	Q	75.1	Confident	84.1	Confident	95 Å²	95	87.8 Å²	87.8	44%	0.444	43%	0.428	S	S	.	.	S	Bend	trans	-87.3	120.2	-179.4	-72.7	177.3	-34.4	0	0	111.3	M548 N549	M548-Q552 VanDerWaalsContact CA-OE1 3.3Å; M548-Q552 HydrophobicContact CB-CB 4.44Å; M548-Q552 HydrophobicContact CE-CB 3.79Å; N549-Q552 HydrophobicContact CB-CG 4.39Å; N549-Q552 PolarHBondContact O-N 3.45Å
553	E	76.3	Confident	84.1	Confident	164 Å²	164	87.9 Å²	87.9	77%	0.766	43%	0.429	S	S	*	.			trans	-69.3	139.6	176.2	-69.8	-170.6	168.5	0	0	111.8	M548 T555	M548-E553 WeakPolarHBondContact CE-O 3.47Å; E553-T555 PolarHBondContact O-N 2.87Å; E553-T555 VanDerWaalsContact O-N 3.1Å
554	L	82.3	Confident	84.2	Confident	28 Å²	28	89.2 Å²	89.2	15%	0.147	44%	0.441	C	S	.	.			trans	-82	89.6	178.4	-143.7	104	0	0	0	109	Q539 I542 R543 M548 L559	Q539-L554 HydrophobicContact CG-CD2 4.26Å; I542-L554 HydrophobicContact CD1-CD2 4.44Å; I542-L554 HydrophobicContact CG2-CD1 4.3Å; I542-L554 HydrophobicContact CG2-CD2 4.32Å; R543-L554 HydrophobicContact CB-CD1 4.42Å; R543-L554 HydrophobicContact CG-CD1 3.25Å; M548-L554 HydrophobicContact CE-CD1 4.35Å; M548-L554 HydrophobicContact SD-CD1 3.82Å; L554-L559 HydrophobicContact CD2-CD1 4.43Å; L554-L559 HydrophobicContact CD2-CD2 3.4Å; L554-L559 HydrophobicContact CD2-CG 3.84Å
555	T	87.9	Confident	84.3	Confident	56 Å²	56	85 Å²	85	34%	0.344	42%	0.419	S	S	.	.			trans	-75.8	162.4	-177.3	77.5	0	0	0	0	112.4	E553 E557 V558 L559	E553-T555 PolarHBondContact O-N 2.87Å; E553-T555 VanDerWaalsContact O-N 3.1Å; T555-E557 WeakPolarHBondContact CB-OE2 3.19Å; T555-E557 PolarHBondContact O-N 3.4Å; T555-E557 PolarHBondContact OG1-N 2.98Å; T555-E557 PolarHBondContact OG1-OE2 3.38Å; T555-V558 PolarHBondContact O-N 2.79Å; T555-L559 PolarHBondContact O-N 2.94Å; T555-L559 VanDerWaalsContact O-N 3.08Å
556	N	84.8	Confident	84.2	Confident	117 Å²	117	89.3 Å²	89.3	63%	0.626	44%	0.439	S	S	*	.	H	α-helix	trans	-62	-28.8	176.2	-80.4	-44.3	0	0	0	112.4	L559 Q560	N556-L559 PolarHBondContact O-N 3.17Å; N556-Q560 WeakPolarHBondContact O-CB 3.16Å; N556-Q560 PolarHBondContact O-N 3.29Å
557	E	87	Confident	84.1	Confident	137 Å²	137	87.4 Å²	87.4	64%	0.64	43%	0.43	S	S	*	.	H	α-helix	trans	-65.7	-44.1	175	-60.5	78.2	-160.5	0	0	111.6	T555 L559 Q560 E561	T555-E557 WeakPolarHBondContact CB-OE2 3.19Å; T555-E557 PolarHBondContact O-N 3.4Å; T555-E557 PolarHBondContact OG1-N 2.98Å; T555-E557 PolarHBondContact OG1-OE2 3.38Å; E557-L559 VanDerWaalsContact C-N 3.34Å; E557-L559 PolarHBondContact O-N 3.45Å; E557-Q560 PolarHBondContact O-N 2.89Å; E557-E561 PolarHBondContact O-N 3.45Å
558	V	87.8	Confident	84	Confident	28 Å²	28	89.2 Å²	89.2	17%	0.17	43%	0.426	C	S	.	.	H	α-helix	trans	-65.7	-38.8	177.5	178.3	0	0	0	0	111.1	M546 M548 T555 Q560 E561 A562	M546-V558 HydrophobicContact CE-CG1 4.22Å; M548-V558 HydrophobicContact SD-CG1 3.83Å; T555-V558 PolarHBondContact O-N 2.79Å; V558-Q560 VanDerWaalsContact C-N 3.34Å; V558-E561 PolarHBondContact O-N 3.2Å; V558-A562 WeakPolarHBondContact O-CB 3.47Å; V558-A562 PolarHBondContact O-N 3.42Å
559	L	89.3	Confident	83.9	Confident	14 Å²	14	90.4 Å²	90.4	7%	0.073	43%	0.432	C	S	.	.	H	α-helix	trans	-62.3	-41.4	173	-74.8	175.8	0	0	0	111.9	A520 L523 L524 I542 L554 T555 N556 E557 A562 A563	A520-L559 HydrophobicContact CB-CD2 4.37Å; A520-L559 WeakPolarHBondContact CB-O 3.4Å; L523-L559 HydrophobicContact CB-CD1 4.33Å; L523-L559 HydrophobicContact CB-CD2 4.12Å; L523-L559 HydrophobicContact CD1-CD2 3.74Å; L524-L559 HydrophobicContact CD1-CB 4.25Å; L524-L559 HydrophobicContact CD2-CB 3.83Å; L524-L559 HydrophobicContact CD2-CD1 4.26Å; L524-L559 HydrophobicContact CG-CB 3.99Å; I542-L559 HydrophobicContact CD1-CD2 3.63Å; L554-L559 HydrophobicContact CD2-CD1 4.43Å; L554-L559 HydrophobicContact CD2-CD2 3.4Å; L554-L559 HydrophobicContact CD2-CG 3.84Å; T555-L559 PolarHBondContact O-N 2.94Å; T555-L559 VanDerWaalsContact O-N 3.08Å; N556-L559 PolarHBondContact O-N 3.17Å; E557-L559 VanDerWaalsContact C-N 3.34Å; E557-L559 PolarHBondContact O-N 3.45Å; L559-A562 PolarHBondContact O-N 3.12Å; L559-A563 VanDerWaalsContact O-CB 3.28Å; L559-A563 WeakPolarHBondContact O-CB 3.44Å; L559-A563 PolarHBondContact O-N 2.85Å
560	Q	91.5	Very high	83.7	Confident	91 Å²	91	91.1 Å²	91.1	43%	0.425	44%	0.435	S	S	.	.	H	α-helix	trans	-66.7	-41.7	177.6	-170.9	58.1	52	0	0	111.4	N556 E557 V558 A562 A563 D564	N556-Q560 WeakPolarHBondContact O-CB 3.16Å; N556-Q560 PolarHBondContact O-N 3.29Å; E557-Q560 PolarHBondContact O-N 2.89Å; V558-Q560 VanDerWaalsContact C-N 3.34Å; Q560-A562 PolarHBondContact O-N 3.48Å; Q560-A563 PolarHBondContact O-N 3.38Å; Q560-D564 PolarHBondContact NE2-OD2 3.41Å; Q560-D564 PolarHBondContact O-N 2.7Å; Q560-D564 VanDerWaalsContact O-N 3.13Å
561	E	90.4	Very high	84	Confident	123 Å²	123	82.9 Å²	82.9	58%	0.575	40%	0.398	S	S	*	.	H	α-helix	trans	-58.6	-46.9	173.8	-174.3	179.7	179.5	0	0	111.8	M546 E557 V558 A563 D564 L565	M546-E561 HydrophobicContact CE-CB 4.32Å; M546-E561 HydrophobicContact CE-CG 3.94Å; E557-E561 PolarHBondContact O-N 3.45Å; V558-E561 PolarHBondContact O-N 3.2Å; E561-A563 VanDerWaalsContact C-N 3.33Å; E561-A563 PolarHBondContact O-N 3.49Å; E561-D564 PolarHBondContact O-N 2.94Å; E561-L565 PolarHBondContact O-N 3.4Å
562	A	90.1	Very high	84.3	Confident	0 Å²	0	83.1 Å²	83.1	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-62.9	-37.3	175.5	0	0	0	0	0	112.4	V516 R517 A520 I542 V558 L559 Q560 D564 L565	V516-A562 HydrophobicContact CG1-CB 3.99Å; R517-A562 VanDerWaalsContact CA-O 3.31Å; R517-A562 WeakPolarHBondContact CA-O 3.39Å; A520-A562 HydrophobicContact CB-CB 3.54Å; I542-A562 HydrophobicContact CG2-CB 4.08Å; V558-A562 WeakPolarHBondContact O-CB 3.47Å; V558-A562 PolarHBondContact O-N 3.42Å; L559-A562 PolarHBondContact O-N 3.12Å; Q560-A562 PolarHBondContact O-N 3.48Å; A562-D564 PolarHBondContact O-N 2.81Å; A562-L565 WeakPolarHBondContact O-CG 3.33Å; A562-L565 PolarHBondContact O-N 3.25Å
563	A	90.3	Very high	84	Confident	2 Å²	2	81.9 Å²	81.9	2%	0.017	41%	0.405	C	S	.	.	H	α-helix	trans	-69.7	-17.8	177.9	0	0	0	0	0	114.3	R517 A520 R521 L524 L559 Q560 E561	R517-A563 WeakPolarHBondContact CG-O 3.38Å; A520-A563 HydrophobicContact CB-CB 4.03Å; R521-A563 HydrophobicContact CG-CB 3.75Å; R521-A563 PolarHBondContact NE-O 2.87Å; R521-A563 PolarHBondContact NH2-O 2.6Å; R521-A563 VanDerWaalsContact NH2-O 3.1Å; L524-A563 HydrophobicContact CD1-CB 3.78Å; L559-A563 VanDerWaalsContact O-CB 3.28Å; L559-A563 WeakPolarHBondContact O-CB 3.44Å; L559-A563 PolarHBondContact O-N 2.85Å; Q560-A563 PolarHBondContact O-N 3.38Å; E561-A563 VanDerWaalsContact C-N 3.33Å; E561-A563 PolarHBondContact O-N 3.49Å
564	D	91.5	Very high	83.8	Confident	100 Å²	100	77.7 Å²	77.7	54%	0.535	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	3.7	180	-70.4	-32.7	0	0	0	113.8	Q560 E561 A562 K566	Q560-D564 PolarHBondContact NE2-OD2 3.41Å; Q560-D564 PolarHBondContact O-N 2.7Å; Q560-D564 VanDerWaalsContact O-N 3.13Å; E561-D564 PolarHBondContact O-N 2.94Å; A562-D564 PolarHBondContact O-N 2.81Å; D564-K566 PolarHBondContact O-N 3.02Å
565	L	90.4	Very high	83.5	Confident	30 Å²	30	79.1 Å²	79.1	16%	0.157	39%	0.392	C	S	.	.			trans	-53	129.8	176.9	-75.9	172.5	0	0	0	112.9	V516 R517 Y545 E561 A562 T567	V516-L565 HydrophobicContact CB-CD1 4.06Å; V516-L565 HydrophobicContact CG1-CD1 3.57Å; R517-L565 HydrophobicContact CB-CB 4.47Å; R517-L565 WeakPolarHBondContact CD-O 3.38Å; Y545-L565 HydrophobicContact CD1-CD1 4.14Å; Y545-L565 HydrophobicContact CE1-CD1 3.61Å; Y545-L565 HydrophobicContact CE1-CD2 4.31Å; E561-L565 PolarHBondContact O-N 3.4Å; A562-L565 WeakPolarHBondContact O-CG 3.33Å; A562-L565 PolarHBondContact O-N 3.25Å; L565-T567 PolarHBondContact O-N 2.82Å; L565-T567 VanDerWaalsContact O-N 3.12Å
566	K	86.2	Confident	83.1	Confident	168 Å²	168	78 Å²	78	73%	0.73	39%	0.386	S	S	*	.			trans	-74.3	103.1	171.9	-72.6	-179.6	-176.4	169.9	0	109.9	R513 D564	R513-K566 WeakPolarHBondContact CD-O 3.47Å; R513-K566 PolarHBondContact NH1-O 3.34Å; D564-K566 PolarHBondContact O-N 3.02Å
567	T	84.1	Confident	83.1	Confident	7 Å²	7	73.5 Å²	73.5	4%	0.043	36%	0.361	C	S	.	.			trans	-79.2	-17.6	-179.4	52	0	0	0	0	114.5	E509 D510 R513 R514 R517 L565	E509-T567 CarbonylContact C-O 3.39Å; E509-T567 VanDerWaalsContact CA-O 3.28Å; E509-T567 WeakPolarHBondContact CA-O 3.48Å; D510-T567 PolarHBondContact N-O 2.83Å; R513-T567 HydrophobicContact CB-CG2 4.1Å; R514-T567 VanDerWaalsContact CA-CG2 3.45Å; R514-T567 HydrophobicContact CB-CG2 3.91Å; R517-T567 HydrophobicContact CB-CG2 4.29Å; R517-T567 VanDerWaalsContact CZ-OG1 3.25Å; R517-T567 PolarHBondContact NH1-OG1 3.38Å; R517-T567 PolarHBondContact NH2-OG1 3.07Å; R517-T567 VanDerWaalsContact NH2-OG1 3.16Å; L565-T567 PolarHBondContact O-N 2.82Å; L565-T567 VanDerWaalsContact O-N 3.12Å
568	R	82.5	Confident	83.2	Confident	184 Å²	184	67.1 Å²	67.1	69%	0.694	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	110.4	177.9	-73.3	-175.5	-177.2	171.7	1.7	109.3	V507 L508	V507-R568 HydrophobicContact CG1-CB 3.66Å; V507-R568 HydrophobicContact CG1-CG 4.22Å; L508-R568 CarbonylContact O-C 3.4Å; L508-R568 WeakPolarHBondContact O-CA 3.42Å
569	I	80.3	Confident	83.3	Confident	57 Å²	57	66.6 Å²	66.6	29%	0.292	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	150	-178	59.3	171	0	0	0	110.6	V507 L508 D510	V507-I569 CarbonylContact C-O 3.43Å; V507-I569 WeakPolarHBondContact CA-O 3.36Å; L508-I569 HydrophobicContact CB-CG1 4.33Å; L508-I569 PolarHBondContact N-O 3.16Å; L508-I569 PolarHBondContact O-N 3.17Å; D510-I569 HydrophobicContact CB-CD1 3.98Å; D510-I569 HydrophobicContact CB-CG1 4.21Å; D510-I569 HydrophobicContact CB-CG2 4.41Å
570	L	74.6	Confident	83.3	Confident	123 Å²	123	70 Å²	70	64%	0.644	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	133.8	174.8	-73	167.9	0	0	0	109.1	R506 V507 E572	R506-L570 HydrophobicContact CG-CD2 4.43Å; V507-L570 HydrophobicContact CG2-CD2 4.31Å; L570-E572 PolarHBondContact O-N 2.73Å
571	N	75.3	Confident	83.4	Confident	25 Å²	25	65.7 Å²	65.7	13%	0.134	32%	0.322	C	S	.	.			trans	-80.2	105.3	172.4	-176.8	-1	0	0	0	109.1	E502 V505 R506 L508 A573 Y574	E502-N571 PolarHBondContact O-ND2 3.01Å; V505-N571 VanDerWaalsContact O-CB 3.25Å; V505-N571 WeakPolarHBondContact O-CB 3.3Å; V505-N571 PolarHBondContact O-ND2 3.15Å; R506-N571 PolarHBondContact O-N 2.92Å; L508-N571 HydrophobicContact CD1-CB 3.74Å; L508-N571 HydrophobicContact CG-CB 3.89Å; N571-A573 PolarHBondContact O-N 3.31Å; N571-A573 WeakPolarHBondContact OD1-CB 2.87Å; N571-A573 PolarHBondContact OD1-N 3.46Å; N571-Y574 WeakPolarHBondContact O-CB 3.44Å; N571-Y574 PolarHBondContact O-N 3.18Å; N571-Y574 VanDerWaalsContact O-N 3.09Å
572	E	73.8	Confident	83.5	Confident	197 Å²	197	59.8 Å²	59.8	92%	0.921	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-26.6	179	-61.9	-173.8	167.7	0	0	112.5	L570 Y574	L570-E572 PolarHBondContact O-N 2.73Å; E572-Y574 VanDerWaalsContact C-N 3.27Å; E572-Y574 PolarHBondContact O-N 2.89Å
573	A	67.8	Low	83.6	Confident	69 Å²	69	65.5 Å²	65.5	57%	0.57	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	1.9	175.8	0	0	0	0	0	113.5	N571 V575	N571-A573 PolarHBondContact O-N 3.31Å; N571-A573 WeakPolarHBondContact OD1-CB 2.87Å; N571-A573 PolarHBondContact OD1-N 3.46Å; A573-V575 PolarHBondContact O-N 2.9Å
574	Y	73	Confident	83.7	Confident	76 Å²	76	66.5 Å²	66.5	30%	0.298	32%	0.324	S	S	.	.			trans	-68.7	114.9	-176.9	172.2	-108.2	0	0	0	112.3	E503 G504 R506 N571 E572 P576	E503-Y574 WeakPolarHBondContact O-CA 3.35Å; E503-Y574 WeakPolarHBondContact O-CD2 3.36Å; G504-Y574 VanDerWaalsContact C-CD2 3.5Å; G504-Y574 VanDerWaalsContact C-CE2 3.42Å; G504-Y574 VanDerWaalsContact O-CE2 3.23Å; G504-Y574 WeakPolarHBondContact O-CE2 3.5Å; R506-Y574 HydrophobicContact CB-CD1 3.87Å; R506-Y574 HydrophobicContact CB-CD2 4.42Å; R506-Y574 HydrophobicContact CB-CE1 3.82Å; R506-Y574 HydrophobicContact CB-CE2 4.41Å; R506-Y574 HydrophobicContact CB-CG 4.16Å; R506-Y574 HydrophobicContact CG-CD1 3.93Å; R506-Y574 HydrophobicContact CG-CE1 4.04Å; N571-Y574 WeakPolarHBondContact O-CB 3.44Å; N571-Y574 PolarHBondContact O-N 3.18Å; N571-Y574 VanDerWaalsContact O-N 3.09Å; E572-Y574 VanDerWaalsContact C-N 3.27Å; E572-Y574 PolarHBondContact O-N 2.89Å; Y574-P576 HydrophobicContact CE1-CG 3.7Å
575	V	75.1	Confident	83.8	Confident	57 Å²	57	61.9 Å²	61.9	35%	0.345	30%	0.299	S	S	.	.			trans	-116.4	118.9	169.2	-175.7	0	0	0	0	108.9	A573 H577 L579 K580	A573-V575 PolarHBondContact O-N 2.9Å; V575-H577 PolarHBondContact O-N 3.4Å; V575-L579 HydrophobicContact CG1-CD2 4.36Å; V575-K580 HydrophobicContact CG1-CB 4.17Å
576	P	79.8	Confident	83.8	Confident	32 Å²	32	61 Å²	61	21%	0.208	30%	0.297	C	S	.	.			trans	-55.8	136.9	176.1	-23	30.2	0	0	0	112.1	Y574 G578 L579 K580	Y574-P576 HydrophobicContact CE1-CG 3.7Å; P576-G578 VanDerWaalsContact C-N 3.33Å; P576-G578 PolarHBondContact O-N 3.33Å; P576-L579 HydrophobicContact CB-CB 4.05Å; P576-L579 HydrophobicContact CG-CB 4.34Å; P576-L579 WeakPolarHBondContact O-CB 3.48Å; P576-L579 PolarHBondContact O-N 2.76Å; P576-K580 PolarHBondContact O-N 3.21Å
577	H	85.2	Confident	84	Confident	23 Å²	23	61.1 Å²	61.1	11%	0.106	30%	0.3	C	S	.	.	H	α-helix	trans	-48.1	-53.1	176.6	166.8	76.7	0	0	0	112.4	E452 Y453 A497 Q499 V575 L579 K580 V581	E452-H577 IonicContact OE2-CD2 2.89Å; Y453-H577 AromaticContact CE1-CD2 3.86Å; Y453-H577 AromaticContact CE1-NE2 3.59Å; Y453-H577 AromaticContact CZ-CD2 3.9Å; Y453-H577 AromaticContact CZ-NE2 3.53Å; Y453-H577 PolarHBondContact OH-CD2 3.5Å; Y453-H577 PolarHBondContact OH-NE2 3.42Å; A497-H577 PolarHBondContact O-CE1 3.2Å; A497-H577 PolarHBondContact O-ND1 3.39Å; Q499-H577 HydrophobicContact CG-CB 4.28Å; Q499-H577 PolarHBondContact NE2-CD2 2.94Å; Q499-H577 PolarHBondContact NE2-CE1 2.95Å; Q499-H577 PolarHBondContact NE2-NE2 2.94Å; V575-H577 PolarHBondContact O-N 3.4Å; H577-L579 VanDerWaalsContact C-N 3.29Å; H577-L579 PolarHBondContact O-N 2.95Å; H577-K580 PolarHBondContact O-N 2.94Å; H577-K580 VanDerWaalsContact O-N 3.14Å; H577-V581 PolarHBondContact O-N 2.98Å
578	G	88.4	Confident	84.1	Confident	3 Å²	3	67.9 Å²	67.9	3%	0.031	33%	0.325	C	S	.	.	H	α-helix	trans	-59.7	-38.4	-179.2	0	0	0	0	0	112.9	E452 P576 V582	E452-G578 WeakPolarHBondContact O-CA 3.44Å; P576-G578 VanDerWaalsContact C-N 3.33Å; P576-G578 PolarHBondContact O-N 3.33Å; G578-V582 WeakPolarHBondContact O-CB 3.38Å; G578-V582 WeakPolarHBondContact O-CG2 3.42Å; G578-V582 PolarHBondContact O-N 3.39Å
579	L	89.1	Confident	84.4	Confident	18 Å²	18	59.9 Å²	59.9	9%	0.094	30%	0.3	C	S	.	.	H	α-helix	trans	-64.4	-43	176.3	-179.5	57.3	0	0	0	111.5	H456 V575 P576 H577 V582 R583	H456-L579 HydrophobicContact CB-CD1 4.19Å; H456-L579 PolarHBondContact CD2-N 2.84Å; H456-L579 VanDerWaalsContact CD2-N 3.31Å; V575-L579 HydrophobicContact CG1-CD2 4.36Å; P576-L579 HydrophobicContact CB-CB 4.05Å; P576-L579 HydrophobicContact CG-CB 4.34Å; P576-L579 WeakPolarHBondContact O-CB 3.48Å; P576-L579 PolarHBondContact O-N 2.76Å; H577-L579 VanDerWaalsContact C-N 3.29Å; H577-L579 PolarHBondContact O-N 2.95Å; L579-V582 PolarHBondContact O-N 3.19Å; L579-R583 HydrophobicContact CD1-CG 4.11Å; L579-R583 HydrophobicContact CG-CG 4.43Å; L579-R583 VanDerWaalsContact O-CB 3.28Å; L579-R583 WeakPolarHBondContact O-CB 3.16Å; L579-R583 VanDerWaalsContact O-CG 3.25Å; L579-R583 WeakPolarHBondContact O-CG 3.44Å; L579-R583 PolarHBondContact O-N 3.3Å
580	K	89.8	Confident	84.9	Confident	85 Å²	85	57.3 Å²	57.3	37%	0.37	29%	0.286	S	S	.	.	H	α-helix	trans	-65.2	-44	-179.7	-169.5	166.3	-179.7	175.9	0	112	F495 A496 A497 V575 P576 H577 R583 A584	F495-K580 WeakPolarHBondContact O-CE 3.2Å; A496-K580 WeakPolarHBondContact O-CE 3.21Å; A496-K580 PolarHBondContact O-NZ 3.39Å; A497-K580 HydrophobicContact CB-CB 3.9Å; A497-K580 HydrophobicContact CB-CD 3.89Å; A497-K580 HydrophobicContact CB-CG 3.97Å; V575-K580 HydrophobicContact CG1-CB 4.17Å; P576-K580 PolarHBondContact O-N 3.21Å; H577-K580 PolarHBondContact O-N 2.94Å; H577-K580 VanDerWaalsContact O-N 3.14Å; K580-R583 PolarHBondContact O-N 3.45Å; K580-A584 PolarHBondContact O-N 3.22Å
581	V	92.7	Very high	85.6	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.5	-46.4	175.9	175.2	0	0	0	0	111.1	Y453 L491 F495 A497 H577 R583 A584 H585 L596	Y453-V581 HydrophobicContact CD1-CB 4.14Å; Y453-V581 HydrophobicContact CD1-CG1 4.14Å; Y453-V581 HydrophobicContact CE1-CB 3.87Å; Y453-V581 HydrophobicContact CE1-CG1 3.93Å; Y453-V581 HydrophobicContact CE1-CG2 4.08Å; L491-V581 HydrophobicContact CB-CG1 4.43Å; L491-V581 HydrophobicContact CB-CG2 4.25Å; L491-V581 HydrophobicContact CD1-CG1 4.45Å; L491-V581 HydrophobicContact CD2-CG1 4.27Å; F495-V581 HydrophobicContact CB-CG2 4.33Å; F495-V581 HydrophobicContact CD2-CB 4.44Å; F495-V581 HydrophobicContact CD2-CG1 3.92Å; F495-V581 HydrophobicContact CD2-CG2 4.2Å; F495-V581 HydrophobicContact CE2-CG1 4.23Å; A497-V581 HydrophobicContact CB-CG2 3.91Å; H577-V581 PolarHBondContact O-N 2.98Å; V581-R583 PolarHBondContact O-N 3.16Å; V581-A584 PolarHBondContact O-N 2.97Å; V581-H585 PolarHBondContact O-CD2 3.36Å; V581-H585 PolarHBondContact O-N 3.12Å; V581-L596 HydrophobicContact CG1-CD1 4.14Å; V581-L596 HydrophobicContact CG1-CD2 4.15Å
582	V	93.4	Very high	86.5	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.5	-40.5	178.9	172.7	0	0	0	0	111.4	Y453 H456 F457 G578 L579 A584 H585 A586 L593 L596 L638	Y453-V582 HydrophobicContact CD1-CG2 4.28Å; H456-V582 HydrophobicContact CB-CB 4.02Å; H456-V582 HydrophobicContact CB-CG1 3.9Å; H456-V582 HydrophobicContact CB-CG2 4.17Å; F457-V582 HydrophobicContact CD1-CG1 4.11Å; F457-V582 HydrophobicContact CD1-CG2 4Å; F457-V582 HydrophobicContact CE1-CG1 4.45Å; F457-V582 HydrophobicContact CE1-CG2 3.78Å; G578-V582 WeakPolarHBondContact O-CB 3.38Å; G578-V582 WeakPolarHBondContact O-CG2 3.42Å; G578-V582 PolarHBondContact O-N 3.39Å; L579-V582 PolarHBondContact O-N 3.19Å; V582-A584 PolarHBondContact O-N 3.34Å; V582-H585 PolarHBondContact O-N 3.31Å; V582-A586 VanDerWaalsContact O-CB 3.25Å; V582-A586 WeakPolarHBondContact O-CB 3.41Å; V582-A586 PolarHBondContact O-N 3.25Å; V582-L593 HydrophobicContact CG1-CD2 3.83Å; V582-L596 HydrophobicContact CG2-CD2 3.93Å; V582-L638 HydrophobicContact CG1-CD1 4.45Å; V582-L638 HydrophobicContact CG1-CD2 3.76Å
583	R	92.2	Very high	87.4	Confident	120 Å²	120	47 Å²	47	45%	0.453	23%	0.229	S	C	.	.	H	α-helix	trans	-56.7	-47.9	172.9	-81.6	174.7	176.8	173.7	-0.3	112.1	L579 K580 V581 H585 A586 Q587 L638	L579-R583 HydrophobicContact CD1-CG 4.11Å; L579-R583 HydrophobicContact CG-CG 4.43Å; L579-R583 VanDerWaalsContact O-CB 3.28Å; L579-R583 WeakPolarHBondContact O-CB 3.16Å; L579-R583 VanDerWaalsContact O-CG 3.25Å; L579-R583 WeakPolarHBondContact O-CG 3.44Å; L579-R583 PolarHBondContact O-N 3.3Å; K580-R583 PolarHBondContact O-N 3.45Å; V581-R583 PolarHBondContact O-N 3.16Å; R583-H585 VanDerWaalsContact C-N 3.34Å; R583-H585 PolarHBondContact O-N 3.07Å; R583-A586 PolarHBondContact O-N 3.32Å; R583-Q587 PolarHBondContact O-N 2.98Å; R583-L638 HydrophobicContact CB-CD1 4.05Å; R583-L638 HydrophobicContact CG-CD1 3.36Å
584	A	92.4	Very high	88.6	Confident	22 Å²	22	44 Å²	44	18%	0.182	20%	0.204	C	C	.	.	H	α-helix	trans	-63	-40.6	179.3	0	0	0	0	0	112.2	F495 K580 V581 V582	F495-A584 HydrophobicContact CB-CB 4.28Å; F495-A584 HydrophobicContact CD1-CB 3.3Å; F495-A584 HydrophobicContact CE1-CB 3.81Å; F495-A584 HydrophobicContact CG-CB 3.94Å; K580-A584 PolarHBondContact O-N 3.22Å; V581-A584 PolarHBondContact O-N 2.97Å; V582-A584 PolarHBondContact O-N 3.34Å
585	H	93.1	Very high	89.6	Confident	3 Å²	3	43.3 Å²	43.3	1%	0.014	20%	0.203	C	C	.	.	H	α-helix	trans	-68	-39.6	174.2	-86.4	-93	0	0	0	112.7	F495 V581 V582 R583 Q587 R588 G592 L593 L596	F495-H585 AromaticContact CE2-CD2 3.69Å; F495-H585 AromaticContact CE2-NE2 3.33Å; F495-H585 VanDerWaalsContact CE2-NE2 3.33Å; F495-H585 WeakPolarHBondContact CE2-NE2 3.17Å; F495-H585 AromaticContact CZ-CD2 3.51Å; F495-H585 AromaticContact CZ-NE2 3.2Å; F495-H585 WeakPolarHBondContact CZ-NE2 3.28Å; V581-H585 PolarHBondContact O-CD2 3.36Å; V581-H585 PolarHBondContact O-N 3.12Å; V582-H585 PolarHBondContact O-N 3.31Å; R583-H585 VanDerWaalsContact C-N 3.34Å; R583-H585 PolarHBondContact O-N 3.07Å; H585-Q587 PolarHBondContact O-N 3.38Å; H585-R588 PolarHBondContact CE1-NH2 2.88Å; H585-R588 PolarHBondContact ND1-NH2 3.05Å; H585-R588 PolarHBondContact O-N 3.45Å; H585-R588 VanDerWaalsContact O-N 3.11Å; H585-G592 PolarHBondContact ND1-O 3.32Å; H585-G592 WeakPolarHBondContact O-CA 3.33Å; H585-L593 HydrophobicContact CB-CD2 4.03Å; H585-L596 HydrophobicContact CB-CB 4.48Å
586	A	91.4	Very high	90.6	Very high	13 Å²	13	40.6 Å²	40.6	11%	0.107	19%	0.186	C	C	.	.	H	α-helix	trans	-64.6	-21.2	179.8	0	0	0	0	0	113.9	V582 R583 R588 G589 L593 I636 L638	V582-A586 VanDerWaalsContact O-CB 3.25Å; V582-A586 WeakPolarHBondContact O-CB 3.41Å; V582-A586 PolarHBondContact O-N 3.25Å; R583-A586 PolarHBondContact O-N 3.32Å; A586-R588 PolarHBondContact O-N 3.41Å; A586-G589 WeakPolarHBondContact O-CA 3.4Å; A586-G589 PolarHBondContact O-N 3.12Å; A586-L593 HydrophobicContact CB-CD2 4.2Å; A586-L593 HydrophobicContact CB-CG 4.48Å; A586-I636 HydrophobicContact CB-CB 4.19Å; A586-I636 HydrophobicContact CB-CD1 3.85Å; A586-I636 HydrophobicContact CB-CG2 3.99Å; A586-L638 HydrophobicContact CB-CD1 3.81Å; A586-L638 HydrophobicContact CB-CD2 4.19Å; A586-L638 HydrophobicContact CB-CG 4.28Å
587	Q	89.4	Confident	91.3	Very high	169 Å²	169	39.1 Å²	39.1	79%	0.79	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.6	172.4	-71.9	174	-11.9	0	0	112.6	R583 H585 G589	R583-Q587 PolarHBondContact O-N 2.98Å; H585-Q587 PolarHBondContact O-N 3.38Å; Q587-G589 PolarHBondContact O-N 3.18Å
588	R	87.9	Confident	91.9	Very high	150 Å²	150	41.1 Å²	41.1	57%	0.566	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.7	21.9	174.2	-60.8	-178.1	-67.1	173.9	-2	112.4	H585 A586 G592	H585-R588 PolarHBondContact CE1-NH2 2.88Å; H585-R588 PolarHBondContact ND1-NH2 3.05Å; H585-R588 PolarHBondContact O-N 3.45Å; H585-R588 VanDerWaalsContact O-N 3.11Å; A586-R588 PolarHBondContact O-N 3.41Å; R588-G592 PolarHBondContact O-N 2.84Å
589	G	88.5	Confident	92.3	Very high	16 Å²	16	43.8 Å²	43.8	17%	0.165	19%	0.192	C	C	.	.	H	α-helix	trans	61.6	-155.4	-178.2	0	0	0	0	0	113.2	A586 Q587 R591 G592 L593 I636	A586-G589 WeakPolarHBondContact O-CA 3.4Å; A586-G589 PolarHBondContact O-N 3.12Å; Q587-G589 PolarHBondContact O-N 3.18Å; G589-R591 VanDerWaalsContact C-N 3.31Å; G589-R591 PolarHBondContact O-N 3.09Å; G589-G592 PolarHBondContact O-N 3.44Å; G589-G592 VanDerWaalsContact O-N 3.1Å; G589-L593 PolarHBondContact O-N 3.47Å; G589-I636 VanDerWaalsContact O-CD1 3.25Å; G589-I636 WeakPolarHBondContact O-CD1 3.27Å
590	L	89.6	Confident	92.7	Very high	2 Å²	2	43 Å²	43	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-60.8	-38	-174.9	-178.7	60.3	0	0	0	112.5	M461 G592 L593 M594 F626 L627 F630	M461-L590 HydrophobicContact CG-CD1 4.27Å; M461-L590 HydrophobicContact SD-CD1 3.57Å; M461-L590 VanDerWaalsContact SD-CD1 3.57Å; L590-G592 VanDerWaalsContact C-N 3.28Å; L590-G592 PolarHBondContact O-N 3.03Å; L590-L593 PolarHBondContact O-N 3Å; L590-M594 HydrophobicContact CD1-CE 3.9Å; L590-M594 HydrophobicContact CD2-CE 3.73Å; L590-M594 HydrophobicContact CG-CE 3.48Å; L590-M594 VanDerWaalsContact CG-CE 3.48Å; L590-M594 HydrophobicContact CG-SD 4.28Å; L590-M594 WeakPolarHBondContact O-CG 3.47Å; L590-M594 PolarHBondContact O-N 3.22Å; L590-F626 HydrophobicContact CD2-CB 4.02Å; L590-L627 HydrophobicContact CD2-CD2 4.26Å; L590-F630 HydrophobicContact CD2-CB 4.38Å
591	R	90.8	Very high	93.1	Very high	126 Å²	126	39 Å²	39	48%	0.475	17%	0.171	S	C	.	.	H	α-helix	trans	-60.7	-36.9	176	-70.4	-175.7	174.7	-79.8	2.6	112.2	G589 M594 E595 L627 E632	G589-R591 VanDerWaalsContact C-N 3.31Å; G589-R591 PolarHBondContact O-N 3.09Å; R591-M594 PolarHBondContact O-N 2.91Å; R591-E595 PolarHBondContact O-N 3.49Å; R591-L627 HydrophobicContact CG-CD2 4.21Å; R591-E632 IonicContact CZ-OE1 3.02Å; R591-E632 IonicContact CZ-OE2 3.83Å; R591-E632 IonicContact NE-OE1 3.35Å; R591-E632 IonicContact NE-OE2 3.98Å; R591-E632 PolarHBondContact NE-OE2 3.48Å; R591-E632 IonicContact NH2-OE1 3.8Å; R591-E632 PolarHBondContact NH2-OE1 2.69Å; R591-E632 IonicContact NH2-OE2 2.61Å; R591-E632 PolarHBondContact NH2-OE2 3.29Å
592	G	92.4	Very high	93.3	Very high	2 Å²	2	44.5 Å²	44.5	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-62.6	-42.5	176	0	0	0	0	0	112.9	H585 R588 G589 L590 E595 L596	H585-G592 PolarHBondContact ND1-O 3.32Å; H585-G592 WeakPolarHBondContact O-CA 3.33Å; R588-G592 PolarHBondContact O-N 2.84Å; G589-G592 PolarHBondContact O-N 3.44Å; G589-G592 VanDerWaalsContact O-N 3.1Å; L590-G592 VanDerWaalsContact C-N 3.28Å; L590-G592 PolarHBondContact O-N 3.03Å; G592-E595 PolarHBondContact O-N 3.45Å; G592-L596 PolarHBondContact O-N 2.87Å
593	L	92.9	Very high	93.5	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-70.8	-38.9	176.9	-66	-176.8	0	0	0	112.8	P458 M461 V582 H585 A586 G589 L590 E595 L596 E597 I636	P458-L593 HydrophobicContact CG-CD1 3.76Å; M461-L593 HydrophobicContact CE-CB 4.24Å; M461-L593 HydrophobicContact SD-CB 3.97Å; M461-L593 HydrophobicContact SD-CD1 3.99Å; V582-L593 HydrophobicContact CG1-CD2 3.83Å; H585-L593 HydrophobicContact CB-CD2 4.03Å; A586-L593 HydrophobicContact CB-CD2 4.2Å; A586-L593 HydrophobicContact CB-CG 4.48Å; G589-L593 PolarHBondContact O-N 3.47Å; L590-L593 PolarHBondContact O-N 3Å; L593-E595 PolarHBondContact O-N 2.88Å; L593-L596 WeakPolarHBondContact O-CB 3.27Å; L593-L596 PolarHBondContact O-N 2.57Å; L593-L596 VanDerWaalsContact O-N 3.13Å; L593-E597 PolarHBondContact O-N 2.67Å; L593-I636 HydrophobicContact CD1-CD1 3.48Å; L593-I636 VanDerWaalsContact CD1-CD1 3.48Å; L593-I636 HydrophobicContact CD1-CG1 4.32Å; L593-I636 HydrophobicContact CD1-CG2 4.17Å; L593-I636 HydrophobicContact CG-CD1 3.82Å
594	M	93.7	Very high	93.8	Very high	8 Å²	8	40.1 Å²	40.1	4%	0.039	18%	0.176	C	C	.	.	H	α-helix	trans	-58.4	-37.9	171.8	-70.4	169.5	176.9	0	0	111.7	M461 L590 R591 E597 R598 H623 F626 L627	M461-M594 HydrophobicContact CE-CG 4.38Å; L590-M594 HydrophobicContact CD1-CE 3.9Å; L590-M594 HydrophobicContact CD2-CE 3.73Å; L590-M594 HydrophobicContact CG-CE 3.48Å; L590-M594 VanDerWaalsContact CG-CE 3.48Å; L590-M594 HydrophobicContact CG-SD 4.28Å; L590-M594 WeakPolarHBondContact O-CG 3.47Å; L590-M594 PolarHBondContact O-N 3.22Å; R591-M594 PolarHBondContact O-N 2.91Å; M594-E597 PolarHBondContact O-N 2.74Å; M594-R598 WeakPolarHBondContact O-CB 3.32Å; M594-R598 PolarHBondContact O-N 3.18Å; M594-H623 HydrophobicContact CE-CB 4.3Å; M594-H623 VanDerWaalsContact CE-O 3.24Å; M594-H623 WeakPolarHBondContact CE-O 3.32Å; M594-H623 HydrophobicContact CG-CB 4.42Å; M594-H623 PolarHBondContact O-CE1 3.08Å; M594-H623 HydrophobicContact SD-CB 4.05Å; M594-F626 HydrophobicContact CE-CB 3.41Å; M594-F626 VanDerWaalsContact CE-CB 3.41Å; M594-F626 HydrophobicContact CE-CD2 3.99Å; M594-F626 HydrophobicContact CE-CG 4.19Å; M594-L627 HydrophobicContact CE-CD2 4.12Å; M594-L627 HydrophobicContact CE-CG 3.91Å; M594-L627 HydrophobicContact SD-CD2 4.18Å; M594-L627 HydrophobicContact SD-CG 4.14Å
595	E	94.9	Very high	94	Very high	60 Å²	60	41.7 Å²	41.7	28%	0.28	18%	0.181	S	C	.	.	H	α-helix	trans	-65.9	-38.4	176	-171.6	55.2	-138.4	0	0	111.9	R591 G592 L593 R598 R599	R591-E595 PolarHBondContact O-N 3.49Å; G592-E595 PolarHBondContact O-N 3.45Å; L593-E595 PolarHBondContact O-N 2.88Å; E595-R598 VanDerWaalsContact OE2-CD 3.3Å; E595-R598 WeakPolarHBondContact OE2-CD 3.38Å; E595-R598 IonicContact OE2-CZ 2.89Å; E595-R598 IonicContact OE2-NE 3.8Å; E595-R598 IonicContact OE2-NH1 2.7Å; E595-R598 PolarHBondContact OE2-NH1 3.49Å; E595-R599 VanDerWaalsContact O-CB 3.25Å; E595-R599 WeakPolarHBondContact O-CB 3.21Å; E595-R599 PolarHBondContact O-N 3.2Å
596	L	95.4	Very high	94.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64	-44.3	174.5	-178.6	58.7	0	0	0	111.7	F457 L491 V581 V582 H585 G592 L593 R599 W600	F457-L596 HydrophobicContact CE1-CD2 4.05Å; F457-L596 HydrophobicContact CZ-CD2 4.23Å; L491-L596 HydrophobicContact CD1-CD1 4.19Å; L491-L596 HydrophobicContact CD2-CD1 4.2Å; V581-L596 HydrophobicContact CG1-CD1 4.14Å; V581-L596 HydrophobicContact CG1-CD2 4.15Å; V582-L596 HydrophobicContact CG2-CD2 3.93Å; H585-L596 HydrophobicContact CB-CB 4.48Å; G592-L596 PolarHBondContact O-N 2.87Å; L593-L596 WeakPolarHBondContact O-CB 3.27Å; L593-L596 PolarHBondContact O-N 2.57Å; L593-L596 VanDerWaalsContact O-N 3.13Å; L596-R599 PolarHBondContact O-N 3.28Å; L596-W600 PolarHBondContact O-N 2.9Å; L596-W600 VanDerWaalsContact O-N 3.14Å
597	E	95.1	Very high	94.3	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.009	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-49.3	175.9	179.2	164.7	135.1	0	0	111.5	V449 R454 F457 L593 M594 R599 W600 R601 H623	V449-E597 HydrophobicContact CG2-CG 4.08Å; R454-E597 IonicContact CZ-OE2 2.88Å; R454-E597 IonicContact NH1-OE2 2.72Å; R454-E597 PolarHBondContact NH1-OE2 2.97Å; R454-E597 IonicContact NH2-OE2 3.66Å; F457-E597 HydrophobicContact CE2-CB 4.47Å; L593-E597 PolarHBondContact O-N 2.67Å; M594-E597 PolarHBondContact O-N 2.74Å; E597-R599 VanDerWaalsContact C-N 3.32Å; E597-R599 PolarHBondContact O-N 2.86Å; E597-W600 PolarHBondContact O-N 3.03Å; E597-R601 VanDerWaalsContact CD-NH2 3.26Å; E597-R601 VanDerWaalsContact CG-CZ 3.43Å; E597-R601 WeakPolarHBondContact O-CG 3.27Å; E597-R601 PolarHBondContact O-N 3.11Å; E597-R601 IonicContact OE1-CZ 3.04Å; E597-R601 IonicContact OE1-NE 3.46Å; E597-R601 IonicContact OE1-NH1 3.51Å; E597-R601 PolarHBondContact OE1-NH1 3Å; E597-R601 IonicContact OE1-NH2 2.76Å; E597-R601 PolarHBondContact OE1-NH2 2.96Å; E597-H623 IonicContact OE1-CD2 3.69Å; E597-H623 IonicContact OE1-NE2 3.49Å; E597-H623 PolarHBondContact OE1-NE2 3.49Å
598	R	96.8	Very high	94.6	Very high	65 Å²	65	39.3 Å²	39.3	25%	0.245	18%	0.177	C	C	.	.	H	α-helix	trans	-56.3	-44.3	174.3	171.6	-175.2	-73.4	171.6	-1.8	112	M594 E595 R601 R602 V619 D620	M594-R598 WeakPolarHBondContact O-CB 3.32Å; M594-R598 PolarHBondContact O-N 3.18Å; E595-R598 VanDerWaalsContact OE2-CD 3.3Å; E595-R598 WeakPolarHBondContact OE2-CD 3.38Å; E595-R598 IonicContact OE2-CZ 2.89Å; E595-R598 IonicContact OE2-NE 3.8Å; E595-R598 IonicContact OE2-NH1 2.7Å; E595-R598 PolarHBondContact OE2-NH1 3.49Å; R598-R601 PolarHBondContact O-N 3.48Å; R598-R602 VanDerWaalsContact CD-CZ 3.44Å; R598-R602 HydrophobicContact CG-CG 4.35Å; R598-R602 WeakPolarHBondContact O-CB 3.49Å; R598-R602 WeakPolarHBondContact O-CG 3.37Å; R598-R602 PolarHBondContact O-N 3.12Å; R598-V619 HydrophobicContact CB-CG1 4.02Å; R598-V619 HydrophobicContact CG-CG1 3.54Å; R598-D620 IonicContact CZ-OD1 3.66Å; R598-D620 IonicContact NE-OD1 3.87Å; R598-D620 PolarHBondContact NE-OD1 3.42Å; R598-D620 IonicContact NH2-OD1 3.77Å; R598-D620 PolarHBondContact NH2-OD1 2.99Å
599	R	97.3	Very high	95	Very high	58 Å²	58	37.9 Å²	37.9	22%	0.219	18%	0.177	C	C	.	.	H	α-helix	trans	-62.6	-44	-179.6	-170.9	172.7	175.9	-175.5	-2.1	111.7	L487 L491 E494 E595 L596 E597 H603	L487-R599 HydrophobicContact CD1-CG 4.31Å; L491-R599 VanDerWaalsContact CD2-NH1 3.32Å; E494-R599 IonicContact OE1-CZ 3.3Å; E494-R599 IonicContact OE1-NH1 2.76Å; E494-R599 PolarHBondContact OE1-NH1 3.43Å; E494-R599 IonicContact OE1-NH2 3.87Å; E494-R599 PolarHBondContact OE1-NH2 3.47Å; E494-R599 IonicContact OE2-CZ 3.88Å; E494-R599 IonicContact OE2-NH1 3.56Å; E494-R599 PolarHBondContact OE2-NH1 3.4Å; E494-R599 IonicContact OE2-NH2 2.82Å; E494-R599 PolarHBondContact OE2-NH2 3.2Å; E595-R599 VanDerWaalsContact O-CB 3.25Å; E595-R599 WeakPolarHBondContact O-CB 3.21Å; E595-R599 PolarHBondContact O-N 3.2Å; L596-R599 PolarHBondContact O-N 3.28Å; E597-R599 VanDerWaalsContact C-N 3.32Å; E597-R599 PolarHBondContact O-N 2.86Å; R599-H603 WeakPolarHBondContact O-CB 3.24Å; R599-H603 PolarHBondContact O-N 3.43Å
600	W	97.6	Very high	95.4	Very high	1 Å²	1	38.3 Å²	38.3	0%	0.004	18%	0.177	C	C	.	.	H	α-helix	trans	-63.3	-44.6	173.9	-86	107.9	0	0	0	112.7	V449 P450 Y453 D484 L487 K488 L491 L596 E597 H603 F604	V449-W600 HydrophobicContact CG2-CB 4.07Å; P450-W600 HydrophobicContact CG-CD2 3.95Å; P450-W600 HydrophobicContact CG-CE3 3.83Å; P450-W600 HydrophobicContact CG-CH2 3.68Å; P450-W600 HydrophobicContact CG-CZ2 3.77Å; P450-W600 HydrophobicContact CG-CZ3 3.7Å; Y453-W600 HydrophobicContact CD2-CZ2 4.15Å; Y453-W600 AromaticContact CD2-NE1 3.64Å; Y453-W600 AromaticContact CE2-CE2 3.67Å; Y453-W600 HydrophobicContact CE2-CH2 4.41Å; Y453-W600 AromaticContact CE2-CZ2 3.36Å; Y453-W600 HydrophobicContact CE2-CZ2 3.36Å; Y453-W600 AromaticContact CE2-NE1 3.62Å; Y453-W600 AromaticContact CZ-CZ2 3.96Å; D484-W600 HydrophobicContact CB-CH2 4.06Å; D484-W600 HydrophobicContact CB-CZ3 3.86Å; L487-W600 HydrophobicContact CB-CH2 4.16Å; L487-W600 HydrophobicContact CB-CZ3 4.46Å; L487-W600 HydrophobicContact CD2-CD2 3.74Å; L487-W600 HydrophobicContact CD2-CE3 3.69Å; L487-W600 HydrophobicContact CD2-CG 4.37Å; L487-W600 HydrophobicContact CD2-CH2 3.89Å; L487-W600 HydrophobicContact CD2-CZ2 3.96Å; L487-W600 HydrophobicContact CD2-CZ3 3.77Å; L487-W600 HydrophobicContact CG-CH2 4.07Å; L487-W600 HydrophobicContact CG-CZ2 4.09Å; L487-W600 HydrophobicContact CG-CZ3 4.4Å; K488-W600 HydrophobicContact CG-CH2 3.86Å; K488-W600 HydrophobicContact CG-CZ2 4.04Å; L491-W600 HydrophobicContact CD1-CZ2 3.94Å; L596-W600 PolarHBondContact O-N 2.9Å; L596-W600 VanDerWaalsContact O-N 3.14Å; E597-W600 PolarHBondContact O-N 3.03Å; W600-H603 WeakPolarHBondContact O-CB 3.28Å; W600-H603 PolarHBondContact O-N 2.94Å; W600-F604 PolarHBondContact O-N 3.34Å
601	R	97.6	Very high	95.7	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-63.7	-45.4	177.6	-72.5	175.8	177.3	160	5.1	112.6	I448 H467 D468 E597 R598 F604 L605 W617 V619 H621	I448-R601 HydrophobicContact CG2-CG 4.11Å; H467-R601 PolarHBondContact CD2-NH2 3.39Å; D468-R601 IonicContact OD1-CZ 2.74Å; D468-R601 VanDerWaalsContact OD1-CZ 3.28Å; D468-R601 IonicContact OD1-NE 2.69Å; D468-R601 PolarHBondContact OD1-NE 3.1Å; D468-R601 IonicContact OD1-NH2 3.49Å; D468-R601 PolarHBondContact OD1-NH2 3.42Å; D468-R601 IonicContact OD2-NH2 3.83Å; D468-R601 PolarHBondContact OD2-NH2 2.93Å; D468-R601 VanDerWaalsContact OD2-NH2 3.14Å; E597-R601 VanDerWaalsContact CD-NH2 3.26Å; E597-R601 VanDerWaalsContact CG-CZ 3.43Å; E597-R601 WeakPolarHBondContact O-CG 3.27Å; E597-R601 PolarHBondContact O-N 3.11Å; E597-R601 IonicContact OE1-CZ 3.04Å; E597-R601 IonicContact OE1-NE 3.46Å; E597-R601 IonicContact OE1-NH1 3.51Å; E597-R601 PolarHBondContact OE1-NH1 3Å; E597-R601 IonicContact OE1-NH2 2.76Å; E597-R601 PolarHBondContact OE1-NH2 2.96Å; R598-R601 PolarHBondContact O-N 3.48Å; R601-F604 PolarHBondContact O-N 3.22Å; R601-L605 PolarHBondContact O-N 3.13Å; R601-L605 VanDerWaalsContact O-N 3.14Å; R601-W617 HydrophobicContact CB-CH2 3.79Å; R601-W617 HydrophobicContact CB-CZ2 4.33Å; R601-W617 HydrophobicContact CG-CH2 3.97Å; R601-W617 HydrophobicContact CG-CZ2 3.99Å; R601-V619 HydrophobicContact CB-CB 4.43Å; R601-V619 HydrophobicContact CB-CG1 4.18Å; R601-V619 HydrophobicContact CB-CG2 4.29Å; R601-V619 WeakPolarHBondContact CD-O 3.45Å; R601-V619 PolarHBondContact NH1-O 3.27Å; R601-H621 PolarHBondContact NH1-O 3.42Å
602	R	97.8	Very high	96	Very high	116 Å²	116	46 Å²	46	44%	0.438	21%	0.209	S	C	.	.	H	α-helix	trans	-63.9	-41	175	-74.4	-179.4	179.4	162.6	0.3	111.8	R598 F604 L605 T606 V619	R598-R602 VanDerWaalsContact CD-CZ 3.44Å; R598-R602 HydrophobicContact CG-CG 4.35Å; R598-R602 WeakPolarHBondContact O-CB 3.49Å; R598-R602 WeakPolarHBondContact O-CG 3.37Å; R598-R602 PolarHBondContact O-N 3.12Å; R602-F604 VanDerWaalsContact C-N 3.29Å; R602-F604 PolarHBondContact O-N 3.19Å; R602-L605 PolarHBondContact O-N 3.43Å; R602-T606 WeakPolarHBondContact O-CB 3.1Å; R602-T606 WeakPolarHBondContact O-CG2 3.29Å; R602-T606 PolarHBondContact O-N 3.18Å; R602-T606 PolarHBondContact O-OG1 3.05Å; R602-V619 HydrophobicContact CG-CG1 3.73Å; R602-V619 HydrophobicContact CG-CG2 4.04Å
603	H	97.5	Very high	96.1	Very high	25 Å²	25	48.3 Å²	48.3	12%	0.116	22%	0.221	C	C	.	.	H	α-helix	trans	-57.5	-44.3	175.6	176.7	74	0	0	0	111.6	H483 D484 L487 R599 W600 T606 T607	H483-H603 PolarHBondContact O-CE1 3.47Å; H483-H603 PolarHBondContact O-NE2 3.4Å; D484-H603 PolarHBondContact N-NE2 3.41Å; D484-H603 IonicContact OD1-CD2 3.86Å; D484-H603 IonicContact OD1-NE2 2.7Å; L487-H603 HydrophobicContact CD2-CB 3.62Å; R599-H603 WeakPolarHBondContact O-CB 3.24Å; R599-H603 PolarHBondContact O-N 3.43Å; W600-H603 WeakPolarHBondContact O-CB 3.28Å; W600-H603 PolarHBondContact O-N 2.94Å; H603-T606 WeakPolarHBondContact CA-OG1 3.4Å; H603-T606 PolarHBondContact O-OG1 3.4Å; H603-T607 WeakPolarHBondContact O-CB 3.42Å; H603-T607 WeakPolarHBondContact O-CG2 3.34Å; H603-T607 PolarHBondContact O-N 3.27Å; H603-T607 PolarHBondContact O-OG1 3.29Å
604	F	97.8	Very high	96.1	Very high	3 Å²	3	49.2 Å²	49.2	1%	0.013	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-47.5	175.4	178.2	-106.3	0	0	0	112.5	V435 V436 I448 L470 L472 W600 R601 R602 T606 M608 P610 L613	V435-F604 HydrophobicContact CG2-CE1 4.28Å; V435-F604 HydrophobicContact CG2-CZ 3.85Å; V436-F604 HydrophobicContact CG2-CE2 4.33Å; V436-F604 HydrophobicContact CG2-CZ 3.95Å; I448-F604 HydrophobicContact CD1-CB 4.3Å; I448-F604 HydrophobicContact CD1-CD1 3.82Å; I448-F604 HydrophobicContact CD1-CD2 3.56Å; I448-F604 HydrophobicContact CD1-CE1 3.96Å; I448-F604 HydrophobicContact CD1-CE2 3.71Å; I448-F604 HydrophobicContact CD1-CG 3.61Å; I448-F604 HydrophobicContact CD1-CZ 3.91Å; I448-F604 HydrophobicContact CG2-CB 3.83Å; I448-F604 HydrophobicContact CG2-CG 4.26Å; L470-F604 HydrophobicContact CD1-CD1 4.41Å; L470-F604 HydrophobicContact CD1-CE1 3.75Å; L470-F604 HydrophobicContact CD1-CZ 4.28Å; L472-F604 HydrophobicContact CD1-CE2 4.42Å; L472-F604 HydrophobicContact CD1-CZ 4.32Å; L472-F604 HydrophobicContact CD2-CE2 4.14Å; W600-F604 PolarHBondContact O-N 3.34Å; R601-F604 PolarHBondContact O-N 3.22Å; R602-F604 VanDerWaalsContact C-N 3.29Å; R602-F604 PolarHBondContact O-N 3.19Å; F604-T606 PolarHBondContact O-N 2.9Å; F604-M608 HydrophobicContact CD2-CB 4.05Å; F604-M608 HydrophobicContact CD2-CG 3.65Å; F604-M608 HydrophobicContact CE2-CB 3.85Å; F604-M608 HydrophobicContact CE2-CG 3.65Å; F604-M608 HydrophobicContact CZ-CB 4.32Å; F604-M608 VanDerWaalsContact O-CB 3.23Å; F604-M608 WeakPolarHBondContact O-CB 3.48Å; F604-M608 PolarHBondContact O-N 3.14Å; F604-P610 HydrophobicContact CD1-CG 4.47Å; F604-P610 HydrophobicContact CE1-CB 4.2Å; F604-P610 HydrophobicContact CE1-CG 3.93Å; F604-P610 HydrophobicContact CZ-CB 4.49Å; F604-L613 HydrophobicContact CE1-CD2 4.28Å
605	L	97.4	Very high	96	Very high	54 Å²	54	52.8 Å²	52.8	28%	0.283	25%	0.25	S	S	.	.	H	α-helix	trans	-59.1	-48.4	178.6	-69.4	-175.9	0	0	0	112.5	R601 R602 Q609 P610 L613 W617 V619	R601-L605 PolarHBondContact O-N 3.13Å; R601-L605 VanDerWaalsContact O-N 3.14Å; R602-L605 PolarHBondContact O-N 3.43Å; L605-Q609 WeakPolarHBondContact O-CA 3.27Å; L605-Q609 PolarHBondContact O-N 3.38Å; L605-P610 HydrophobicContact CD2-CG 3.81Å; L605-L613 HydrophobicContact CD2-CD1 3.51Å; L605-W617 HydrophobicContact CD1-CZ3 3.98Å; L605-W617 HydrophobicContact CD2-CE3 4.34Å; L605-W617 HydrophobicContact CD2-CH2 4.33Å; L605-W617 HydrophobicContact CD2-CZ3 3.66Å; L605-W617 HydrophobicContact CG-CH2 4.31Å; L605-W617 HydrophobicContact CG-CZ3 3.84Å; L605-V619 HydrophobicContact CD1-CG2 3.59Å
606	T	96.3	Very high	95.9	Very high	96 Å²	96	54.1 Å²	54.1	59%	0.589	26%	0.259	S	S	*	.	H	α-helix	trans	-68.2	-44.1	-175.4	49.1	0	0	0	0	112.1	R602 H603 F604	R602-T606 WeakPolarHBondContact O-CB 3.1Å; R602-T606 WeakPolarHBondContact O-CG2 3.29Å; R602-T606 PolarHBondContact O-N 3.18Å; R602-T606 PolarHBondContact O-OG1 3.05Å; H603-T606 WeakPolarHBondContact CA-OG1 3.4Å; H603-T606 PolarHBondContact O-OG1 3.4Å; F604-T606 PolarHBondContact O-N 2.9Å
607	T	94.4	Very high	95.8	Very high	39 Å²	39	55.2 Å²	55.2	24%	0.239	26%	0.263	C	S	.	.	H	α-helix	trans	-83.5	-34.4	-175.6	59.6	0	0	0	0	113.7	H483 H603	H483-T607 HydrophobicContact CB-CG2 4.15Å; H603-T607 WeakPolarHBondContact O-CB 3.42Å; H603-T607 WeakPolarHBondContact O-CG2 3.34Å; H603-T607 PolarHBondContact O-N 3.27Å; H603-T607 PolarHBondContact O-OG1 3.29Å
608	M	95.1	Very high	95.8	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-98.1	-21.7	-174.9	-60.9	-58.7	-60	0	0	113.5	V436 C476 A479 S480 F604	V436-M608 HydrophobicContact CG1-CB 4.4Å; V436-M608 HydrophobicContact CG1-CE 4.29Å; V436-M608 WeakPolarHBondContact CG1-O 3.49Å; V436-M608 HydrophobicContact CG2-CB 4.09Å; V436-M608 HydrophobicContact CG2-CE 4.12Å; C476-M608 HydrophobicContact CB-CE 4.05Å; C476-M608 WeakPolarHBondContact O-CE 3.31Å; A479-M608 HydrophobicContact CB-CE 4.26Å; S480-M608 VanDerWaalsContact CA-SD 3.56Å; F604-M608 HydrophobicContact CD2-CB 4.05Å; F604-M608 HydrophobicContact CD2-CG 3.65Å; F604-M608 HydrophobicContact CE2-CB 3.85Å; F604-M608 HydrophobicContact CE2-CG 3.65Å; F604-M608 HydrophobicContact CZ-CB 4.32Å; F604-M608 VanDerWaalsContact O-CB 3.23Å; F604-M608 WeakPolarHBondContact O-CB 3.48Å; F604-M608 PolarHBondContact O-N 3.14Å
609	Q	96.3	Very high	95.8	Very high	120 Å²	120	55.4 Å²	55.4	56%	0.561	27%	0.273	S	S	*	.			trans	46	61.8	-178.7	-62	-178.1	-10.7	0	0	112.8	L605	L605-Q609 WeakPolarHBondContact O-CA 3.27Å; L605-Q609 PolarHBondContact O-N 3.38Å
610	P	96.8	Very high	95.6	Very high	24 Å²	24	55.7 Å²	55.7	16%	0.156	28%	0.279	C	S	.	.			trans	-69.8	139.5	-172.4	31.4	-37.3	0	0	0	112.7	V435 V436 F604 L605 L613	V435-P610 HydrophobicContact CG2-CB 4.41Å; V435-P610 VanDerWaalsContact O-CB 3.3Å; V435-P610 WeakPolarHBondContact O-CB 3.39Å; V436-P610 HydrophobicContact CG2-CB 4.26Å; F604-P610 HydrophobicContact CD1-CG 4.47Å; F604-P610 HydrophobicContact CE1-CB 4.2Å; F604-P610 HydrophobicContact CE1-CG 3.93Å; F604-P610 HydrophobicContact CZ-CB 4.49Å; L605-P610 HydrophobicContact CD2-CG 3.81Å; P610-L613 HydrophobicContact CB-CD1 4.33Å; P610-L613 HydrophobicContact CB-CD2 4.28Å; P610-L613 HydrophobicContact CB-CG 3.89Å; P610-L613 HydrophobicContact CG-CD1 3.56Å; P610-L613 HydrophobicContact CG-CD2 4.11Å; P610-L613 HydrophobicContact CG-CG 3.67Å
611	R	96.2	Very high	95.2	Very high	211 Å²	211	56.5 Å²	56.5	80%	0.796	28%	0.283	S	S	*	.	S	Bend	trans	-104	-14.5	-176.4	-61.9	-179.7	-178	-174.9	-2.8	114.3	V435 V436	V435-R611 PolarHBondContact O-N 2.7Å; V435-R611 VanDerWaalsContact O-N 3.1Å; V436-R611 PolarHBondContact O-N 3.18Å
612	H	96.2	Very high	94.8	Very high	79 Å²	79	58 Å²	58	37%	0.366	29%	0.291	S	S	.	.	S	Bend	trans	-131.8	44.8	-173.6	-54.6	-92.7	0	0	0	110.5	L433 V435 G438	L433-H612 HydrophobicContact CD1-CB 3.46Å; L433-H612 VanDerWaalsContact CD1-CB 3.46Å; V435-H612 WeakPolarHBondContact CA-O 3.36Å; V435-H612 WeakPolarHBondContact CB-O 3.38Å; V435-H612 CarbonylContact O-C 3.52Å; V435-H612 WeakPolarHBondContact O-CA 3.31Å; V435-H612 PolarHBondContact O-N 3.19Å; G438-H612 VanDerWaalsContact CA-CD2 3.42Å; G438-H612 WeakPolarHBondContact CA-CD2 3.18Å; G438-H612 WeakPolarHBondContact CA-NE2 3.41Å; G438-H612 PolarHBondContact N-CD2 2.96Å; G438-H612 VanDerWaalsContact N-CD2 3.34Å
613	L	95.4	Very high	94.5	Very high	51 Å²	51	52.9 Å²	52.9	27%	0.267	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-64.9	142.6	172.6	-81.8	172.6	0	0	0	110.1	V435 L470 F604 L605 P610 W617	V435-L613 HydrophobicContact CB-CD2 4.36Å; V435-L613 HydrophobicContact CG2-CD2 4.45Å; L470-L613 HydrophobicContact CD1-CD2 3.54Å; F604-L613 HydrophobicContact CE1-CD2 4.28Å; L605-L613 HydrophobicContact CD2-CD1 3.51Å; P610-L613 HydrophobicContact CB-CD1 4.33Å; P610-L613 HydrophobicContact CB-CD2 4.28Å; P610-L613 HydrophobicContact CB-CG 3.89Å; P610-L613 HydrophobicContact CG-CD1 3.56Å; P610-L613 HydrophobicContact CG-CD2 4.11Å; P610-L613 HydrophobicContact CG-CG 3.67Å; L613-W617 HydrophobicContact CD1-CE3 3.94Å; L613-W617 HydrophobicContact CD1-CZ3 4.43Å; L613-W617 HydrophobicContact CD2-CD2 4.14Å; L613-W617 HydrophobicContact CD2-CE3 4.3Å; L613-W617 HydrophobicContact CD2-CG 4.28Å
614	P	93.8	Very high	94	Very high	19 Å²	19	56.3 Å²	56.3	12%	0.123	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-58.3	145.6	172.2	-19.8	30.5	0	0	0	110.8	Y425 K430 L470 W617	Y425-P614 HydrophobicContact CE2-CB 3.91Å; Y425-P614 HydrophobicContact CE2-CG 4.4Å; K430-P614 HydrophobicContact CG-CB 4.33Å; L470-P614 HydrophobicContact CD2-CG 4.06Å; P614-W617 VanDerWaalsContact O-CB 3.28Å; P614-W617 WeakPolarHBondContact O-CB 3.25Å; P614-W617 PolarHBondContact O-N 3.2Å
615	P	91	Very high	93.5	Very high	83 Å²	83	59.1 Å²	59.1	54%	0.539	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	146.8	174.1	-23.8	33.1	0	0	0	111.3	Y425 T428 W617	Y425-P615 WeakPolarHBondContact CD2-O 3.2Å; T428-P615 HydrophobicContact CG2-CB 4.4Å; T428-P615 HydrophobicContact CG2-CG 4.26Å; P615-W617 PolarHBondContact O-N 2.99Å; P615-W617 VanDerWaalsContact O-N 3.1Å
616	L	91.7	Very high	93	Very high	87 Å²	87	57.6 Å²	57.6	46%	0.455	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	4.5	-179.9	-48.2	173.6	0	0	0	115	S618	L616-S618 PolarHBondContact O-N 2.89Å
617	W	94.8	Very high	92.6	Very high	24 Å²	24	54.9 Å²	54.9	9%	0.091	28%	0.284	C	S	.	.			trans	-64.8	125.8	167.9	-165.7	90.4	0	0	0	109.8	Y425 I448 H467 L470 R601 L605 L613 P614 P615 V619	Y425-W617 HydrophobicContact CD2-CB 4.47Å; Y425-W617 HydrophobicContact CE2-CB 4.02Å; Y425-W617 AromaticContact CE2-CD1 3.88Å; Y425-W617 HydrophobicContact CE2-CG 4.39Å; I448-W617 HydrophobicContact CG2-CZ2 4.27Å; H467-W617 AromaticContact CD2-NE1 3.74Å; H467-W617 AromaticContact CE1-CD1 3.6Å; H467-W617 AromaticContact CE1-CG 3.9Å; H467-W617 AromaticContact CE1-NE1 3.96Å; H467-W617 AromaticContact ND1-CD1 3.89Å; H467-W617 AromaticContact NE2-CD1 3.71Å; H467-W617 AromaticContact NE2-CE2 3.87Å; H467-W617 AromaticContact NE2-NE1 3.59Å; H467-W617 PolarHBondContact O-NE1 3.18Å; L470-W617 HydrophobicContact CD1-CZ2 4.38Å; R601-W617 HydrophobicContact CB-CH2 3.79Å; R601-W617 HydrophobicContact CB-CZ2 4.33Å; R601-W617 HydrophobicContact CG-CH2 3.97Å; R601-W617 HydrophobicContact CG-CZ2 3.99Å; L605-W617 HydrophobicContact CD1-CZ3 3.98Å; L605-W617 HydrophobicContact CD2-CE3 4.34Å; L605-W617 HydrophobicContact CD2-CH2 4.33Å; L605-W617 HydrophobicContact CD2-CZ3 3.66Å; L605-W617 HydrophobicContact CG-CH2 4.31Å; L605-W617 HydrophobicContact CG-CZ3 3.84Å; L613-W617 HydrophobicContact CD1-CE3 3.94Å; L613-W617 HydrophobicContact CD1-CZ3 4.43Å; L613-W617 HydrophobicContact CD2-CD2 4.14Å; L613-W617 HydrophobicContact CD2-CE3 4.3Å; L613-W617 HydrophobicContact CD2-CG 4.28Å; P614-W617 VanDerWaalsContact O-CB 3.28Å; P614-W617 WeakPolarHBondContact O-CB 3.25Å; P614-W617 PolarHBondContact O-N 3.2Å; P615-W617 PolarHBondContact O-N 2.99Å; P615-W617 VanDerWaalsContact O-N 3.1Å; W617-V619 HydrophobicContact CZ3-CG2 4.43Å
618	S	94.4	Very high	92.3	Very high	49 Å²	49	61.5 Å²	61.5	34%	0.343	31%	0.305	S	S	.	.			trans	-144.6	154.1	-174.8	58.7	0	0	0	0	112	H467 L616 D620 H621	H467-S618 PolarHBondContact CE1-N 3.46Å; H467-S618 VanDerWaalsContact CE1-N 3.31Å; H467-S618 PolarHBondContact NE2-N 3.21Å; H467-S618 PolarHBondContact NE2-O 3.41Å; L616-S618 PolarHBondContact O-N 2.89Å; S618-D620 VanDerWaalsContact C-N 3.31Å; S618-D620 PolarHBondContact O-N 3.33Å; S618-H621 PolarHBondContact OG-N 2.94Å
619	V	96	Very high	91.8	Very high	21 Å²	21	68.3 Å²	68.3	13%	0.127	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-37.8	178.9	173.2	0	0	0	0	111.4	R598 R601 R602 L605 W617	R598-V619 HydrophobicContact CB-CG1 4.02Å; R598-V619 HydrophobicContact CG-CG1 3.54Å; R601-V619 HydrophobicContact CB-CB 4.43Å; R601-V619 HydrophobicContact CB-CG1 4.18Å; R601-V619 HydrophobicContact CB-CG2 4.29Å; R601-V619 WeakPolarHBondContact CD-O 3.45Å; R601-V619 PolarHBondContact NH1-O 3.27Å; R602-V619 HydrophobicContact CG-CG1 3.73Å; R602-V619 HydrophobicContact CG-CG2 4.04Å; L605-V619 HydrophobicContact CD1-CG2 3.59Å; W617-V619 HydrophobicContact CZ3-CG2 4.43Å
620	D	93.6	Very high	91.2	Very high	64 Å²	64	65.3 Å²	65.3	34%	0.342	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	22.6	-173.7	-64.7	-67.4	0	0	0	113.4	R598 S618 N622 H623	R598-D620 IonicContact CZ-OD1 3.66Å; R598-D620 IonicContact NE-OD1 3.87Å; R598-D620 PolarHBondContact NE-OD1 3.42Å; R598-D620 IonicContact NH2-OD1 3.77Å; R598-D620 PolarHBondContact NH2-OD1 2.99Å; S618-D620 VanDerWaalsContact C-N 3.31Å; S618-D620 PolarHBondContact O-N 3.33Å; D620-N622 PolarHBondContact O-N 2.93Å; D620-H623 WeakPolarHBondContact CA-ND1 3.36Å; D620-H623 HydrophobicContact CB-CB 4.43Å; D620-H623 WeakPolarHBondContact O-CB 3.5Å; D620-H623 PolarHBondContact O-N 3.27Å; D620-H623 VanDerWaalsContact O-N 3.07Å; D620-H623 IonicContact OD1-CE1 2.68Å; D620-H623 IonicContact OD1-ND1 3.59Å; D620-H623 PolarHBondContact OD1-ND1 3.46Å
621	H	90.4	Very high	90.5	Very high	18 Å²	18	65.7 Å²	65.7	8%	0.083	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	135.1	-179.8	-174.9	73.7	0	0	0	111.9	Y426 H467 R601 S618 H623	Y426-H621 AromaticContact CE2-CE1 3.96Å; Y426-H621 AromaticContact CE2-NE2 3.4Å; Y426-H621 WeakPolarHBondContact CE2-NE2 3.37Å; Y426-H621 AromaticContact CZ-NE2 3.5Å; Y426-H621 PolarHBondContact OH-NE2 2.95Å; Y426-H621 VanDerWaalsContact OH-NE2 3.15Å; H467-H621 AromaticContact CD2-CD2 3.83Å; H467-H621 AromaticContact CD2-CG 3.85Å; H467-H621 WeakPolarHBondContact CE1-CB 3.38Å; H467-H621 AromaticContact CE1-CD2 3.82Å; H467-H621 AromaticContact CE1-CG 3.31Å; H467-H621 AromaticContact CE1-ND1 3.71Å; H467-H621 AromaticContact CG-CD2 3.35Å; H467-H621 AromaticContact CG-CG 3.65Å; H467-H621 AromaticContact ND1-CD2 3.4Å; H467-H621 PolarHBondContact ND1-CD2 3.15Å; H467-H621 AromaticContact ND1-CE1 3.94Å; H467-H621 AromaticContact ND1-CG 3.36Å; H467-H621 AromaticContact ND1-ND1 3.71Å; H467-H621 AromaticContact ND1-NE2 3.79Å; H467-H621 WeakPolarHBondContact NE2-CB 3.29Å; H467-H621 AromaticContact NE2-CG 3.64Å; R601-H621 PolarHBondContact NH1-O 3.42Å; S618-H621 PolarHBondContact OG-N 2.94Å; H621-H623 PolarHBondContact O-CD2 3.49Å; H621-H623 PolarHBondContact O-N 2.9Å
622	N	87.9	Confident	89.4	Confident	35 Å²	35	60.6 Å²	60.6	19%	0.187	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	-2.7	-173.9	-67.3	-32.5	0	0	0	116.9	Y426 D620 S624 K625 F626	Y426-N622 PolarHBondContact OH-ND2 2.96Å; D620-N622 PolarHBondContact O-N 2.93Å; N622-S624 PolarHBondContact O-N 3.4Å; N622-K625 WeakPolarHBondContact O-CB 3.24Å; N622-K625 PolarHBondContact O-N 3.43Å; N622-K625 VanDerWaalsContact O-N 3.14Å; N622-F626 HydrophobicContact CB-CD2 4.08Å; N622-F626 HydrophobicContact CB-CE2 3.61Å; N622-F626 HydrophobicContact CB-CZ 3.86Å; N622-F626 WeakPolarHBondContact O-CD2 3.49Å; N622-F626 WeakPolarHBondContact O-CG 3.48Å; N622-F626 PolarHBondContact O-N 3.2Å
623	H	90.8	Very high	88	Confident	7 Å²	7	64.4 Å²	64.4	3%	0.032	34%	0.336	C	S	.	.	H	α-helix	trans	-60.7	-49.2	-176.5	-69.7	-178.4	0	0	0	112.3	M594 E597 D620 H621 K625 F626 L627	M594-H623 HydrophobicContact CE-CB 4.3Å; M594-H623 VanDerWaalsContact CE-O 3.24Å; M594-H623 WeakPolarHBondContact CE-O 3.32Å; M594-H623 HydrophobicContact CG-CB 4.42Å; M594-H623 PolarHBondContact O-CE1 3.08Å; M594-H623 HydrophobicContact SD-CB 4.05Å; E597-H623 IonicContact OE1-CD2 3.69Å; E597-H623 IonicContact OE1-NE2 3.49Å; E597-H623 PolarHBondContact OE1-NE2 3.49Å; D620-H623 WeakPolarHBondContact CA-ND1 3.36Å; D620-H623 HydrophobicContact CB-CB 4.43Å; D620-H623 WeakPolarHBondContact O-CB 3.5Å; D620-H623 PolarHBondContact O-N 3.27Å; D620-H623 VanDerWaalsContact O-N 3.07Å; D620-H623 IonicContact OD1-CE1 2.68Å; D620-H623 IonicContact OD1-ND1 3.59Å; D620-H623 PolarHBondContact OD1-ND1 3.46Å; H621-H623 PolarHBondContact O-CD2 3.49Å; H621-H623 PolarHBondContact O-N 2.9Å; H623-K625 VanDerWaalsContact C-N 3.29Å; H623-K625 PolarHBondContact O-N 2.96Å; H623-F626 PolarHBondContact O-N 3.08Å; H623-L627 WeakPolarHBondContact O-CG 3.44Å; H623-L627 PolarHBondContact O-N 2.98Å
624	S	88.6	Confident	86.8	Confident	98 Å²	98	63.8 Å²	63.8	69%	0.685	33%	0.332	S	S	*	.	H	α-helix	trans	-63.8	-34.9	176.6	-50.5	0	0	0	0	112.6	N622 L627 R628	N622-S624 PolarHBondContact O-N 3.4Å; S624-L627 PolarHBondContact O-N 3.21Å; S624-R628 WeakPolarHBondContact O-CB 3.45Å; S624-R628 PolarHBondContact O-N 3.49Å
625	K	86.4	Confident	85.5	Confident	61 Å²	61	67.9 Å²	67.9	27%	0.265	36%	0.359	S	S	.	.	H	α-helix	trans	-65	-43.8	177.7	-175.6	171.8	-175.1	157.2	0	110.9	D420 N622 H623 K629	D420-K625 WeakPolarHBondContact OD1-CE 3.44Å; D420-K625 IonicContact OD1-NZ 2.83Å; D420-K625 PolarHBondContact OD1-NZ 2.98Å; D420-K625 WeakPolarHBondContact OD2-CD 3.4Å; D420-K625 WeakPolarHBondContact OD2-CE 3.28Å; D420-K625 IonicContact OD2-NZ 3.21Å; D420-K625 PolarHBondContact OD2-NZ 2.96Å; N622-K625 WeakPolarHBondContact O-CB 3.24Å; N622-K625 PolarHBondContact O-N 3.43Å; N622-K625 VanDerWaalsContact O-N 3.14Å; H623-K625 VanDerWaalsContact C-N 3.29Å; H623-K625 PolarHBondContact O-N 2.96Å; K625-K629 VanDerWaalsContact O-CB 3.27Å; K625-K629 WeakPolarHBondContact O-CB 3.35Å; K625-K629 PolarHBondContact O-N 2.93Å
626	F	87.3	Confident	84.9	Confident	22 Å²	22	65.4 Å²	65.4	10%	0.096	34%	0.341	C	S	.	.	H	α-helix	trans	-64.7	-45	176.3	-65.1	-44.8	0	0	0	111.8	E460 M461 L590 M594 N622 H623 R628 K629 F630	E460-F626 WeakPolarHBondContact O-CE1 3.43Å; M461-F626 HydrophobicContact CB-CZ 4.41Å; M461-F626 HydrophobicContact CE-CD2 4.42Å; M461-F626 HydrophobicContact CE-CE2 4.25Å; M461-F626 HydrophobicContact CG-CD2 4.39Å; M461-F626 HydrophobicContact CG-CE1 4.46Å; M461-F626 HydrophobicContact CG-CE2 4.11Å; M461-F626 HydrophobicContact CG-CZ 4.15Å; L590-F626 HydrophobicContact CD2-CB 4.02Å; M594-F626 HydrophobicContact CE-CB 3.41Å; M594-F626 VanDerWaalsContact CE-CB 3.41Å; M594-F626 HydrophobicContact CE-CD2 3.99Å; M594-F626 HydrophobicContact CE-CG 4.19Å; N622-F626 HydrophobicContact CB-CD2 4.08Å; N622-F626 HydrophobicContact CB-CE2 3.61Å; N622-F626 HydrophobicContact CB-CZ 3.86Å; N622-F626 WeakPolarHBondContact O-CD2 3.49Å; N622-F626 WeakPolarHBondContact O-CG 3.48Å; N622-F626 PolarHBondContact O-N 3.2Å; H623-F626 PolarHBondContact O-N 3.08Å; F626-R628 PolarHBondContact O-N 2.66Å; F626-K629 PolarHBondContact O-N 3.38Å; F626-F630 HydrophobicContact CB-CD2 4.43Å; F626-F630 HydrophobicContact CD1-CD2 4.26Å; F626-F630 HydrophobicContact CD1-CE2 4.01Å; F626-F630 WeakPolarHBondContact O-CB 3.29Å; F626-F630 PolarHBondContact O-N 3.1Å
627	L	88.6	Confident	84.1	Confident	40 Å²	40	69.8 Å²	69.8	21%	0.209	36%	0.356	C	S	.	.	H	α-helix	trans	-60.2	-44.7	177.2	-69.3	174.7	0	0	0	112	L590 R591 M594 H623 S624 K629 G631	L590-L627 HydrophobicContact CD2-CD2 4.26Å; R591-L627 HydrophobicContact CG-CD2 4.21Å; M594-L627 HydrophobicContact CE-CD2 4.12Å; M594-L627 HydrophobicContact CE-CG 3.91Å; M594-L627 HydrophobicContact SD-CD2 4.18Å; M594-L627 HydrophobicContact SD-CG 4.14Å; H623-L627 WeakPolarHBondContact O-CG 3.44Å; H623-L627 PolarHBondContact O-N 2.98Å; S624-L627 PolarHBondContact O-N 3.21Å; L627-K629 PolarHBondContact O-N 2.92Å; L627-G631 VanDerWaalsContact O-CA 3.27Å; L627-G631 WeakPolarHBondContact O-CA 3.46Å; L627-G631 PolarHBondContact O-N 3.5Å
628	R	87.5	Confident	83.1	Confident	178 Å²	178	70.7 Å²	70.7	67%	0.672	36%	0.363	S	S	*	.	H	α-helix	trans	-65.1	-38.7	177.4	-178.7	-177.5	57.3	-178	-6	112.6	D420 S624 F626	D420-R628 IonicContact OD2-CZ 3.48Å; D420-R628 IonicContact OD2-NH2 3.23Å; D420-R628 PolarHBondContact OD2-NH2 3.44Å; S624-R628 WeakPolarHBondContact O-CB 3.45Å; S624-R628 PolarHBondContact O-N 3.49Å; F626-R628 PolarHBondContact O-N 2.66Å
629	K	85.2	Confident	81.3	Confident	143 Å²	143	75.6 Å²	75.6	62%	0.622	39%	0.385	S	S	*	.	H	α-helix	trans	-80.4	-36.3	-174.5	-174	172.6	178.3	179.7	0	113	K625 F626 L627	K625-K629 VanDerWaalsContact O-CB 3.27Å; K625-K629 WeakPolarHBondContact O-CB 3.35Å; K625-K629 PolarHBondContact O-N 2.93Å; F626-K629 PolarHBondContact O-N 3.38Å; L627-K629 PolarHBondContact O-N 2.92Å
630	F	83.6	Confident	80.6	Confident	58 Å²	58	78.3 Å²	78.3	25%	0.254	40%	0.398	S	S	.	.	H	α-helix	trans	-118	-8.5	-169.4	-60.5	-67.3	0	0	0	114.3	E460 L590 F626 L634	E460-F630 HydrophobicContact CB-CD2 4.46Å; E460-F630 HydrophobicContact CB-CE1 4.35Å; E460-F630 HydrophobicContact CB-CE2 3.77Å; E460-F630 HydrophobicContact CB-CZ 3.7Å; E460-F630 HydrophobicContact CG-CD1 4.26Å; E460-F630 HydrophobicContact CG-CE1 3.58Å; E460-F630 HydrophobicContact CG-CE2 3.94Å; E460-F630 HydrophobicContact CG-CZ 3.39Å; L590-F630 HydrophobicContact CD2-CB 4.38Å; F626-F630 HydrophobicContact CB-CD2 4.43Å; F626-F630 HydrophobicContact CD1-CD2 4.26Å; F626-F630 HydrophobicContact CD1-CE2 4.01Å; F626-F630 WeakPolarHBondContact O-CB 3.29Å; F626-F630 PolarHBondContact O-N 3.1Å; F630-L634 HydrophobicContact CB-CB 4.33Å; F630-L634 HydrophobicContact CB-CD1 4.15Å; F630-L634 HydrophobicContact CB-CD2 3.89Å; F630-L634 HydrophobicContact CB-CG 4.33Å; F630-L634 HydrophobicContact CD1-CD1 4.42Å; F630-L634 HydrophobicContact CD1-CD2 4.45Å; F630-L634 HydrophobicContact CG-CD2 4.18Å
631	G	80.6	Confident	79.9	Confident	31 Å²	31	79.1 Å²	79.1	32%	0.32	40%	0.401	S	S	.	.			trans	76.6	177.2	-177.3	0	0	0	0	0	113.6	L627	L627-G631 VanDerWaalsContact O-CA 3.27Å; L627-G631 WeakPolarHBondContact O-CA 3.46Å; L627-G631 PolarHBondContact O-N 3.5Å
632	E	72.9	Confident	79.3	Confident	105 Å²	105	82.4 Å²	82.4	49%	0.491	42%	0.419	S	S	.	.	S	Bend	trans	-80.1	-31.1	-178.9	-56.9	-151.9	-179.6	0	0	112.8	R591	R591-E632 IonicContact CZ-OE1 3.02Å; R591-E632 IonicContact CZ-OE2 3.83Å; R591-E632 IonicContact NE-OE1 3.35Å; R591-E632 IonicContact NE-OE2 3.98Å; R591-E632 PolarHBondContact NE-OE2 3.48Å; R591-E632 IonicContact NH2-OE1 3.8Å; R591-E632 PolarHBondContact NH2-OE1 2.69Å; R591-E632 IonicContact NH2-OE2 2.61Å; R591-E632 PolarHBondContact NH2-OE2 3.29Å
633	D	67.8	Low	78.8	Confident	158 Å²	158	85.2 Å²	85.2	85%	0.845	43%	0.432	S	S	*	.			trans	-98.9	20.9	-171.2	-57.3	-48.4	0	0	0	113.8	P635	D633-P635 VanDerWaalsContact O-CD 3.22Å; D633-P635 WeakPolarHBondContact O-CD 3.16Å; D633-P635 VanDerWaalsContact O-N 3.07Å
634	L	68.9	Low	78.1	Confident	38 Å²	38	90.1 Å²	90.1	20%	0.199	46%	0.457	C	S	.	.			trans	-55.8	117.8	-179.5	-176.3	74.9	0	0	0	110.1	F630 I636	F630-L634 HydrophobicContact CB-CB 4.33Å; F630-L634 HydrophobicContact CB-CD1 4.15Å; F630-L634 HydrophobicContact CB-CD2 3.89Å; F630-L634 HydrophobicContact CB-CG 4.33Å; F630-L634 HydrophobicContact CD1-CD1 4.42Å; F630-L634 HydrophobicContact CD1-CD2 4.45Å; F630-L634 HydrophobicContact CG-CD2 4.18Å; L634-I636 PolarHBondContact O-N 2.78Å; L634-I636 VanDerWaalsContact O-N 3.09Å
635	P	67.7	Low	77.4	Confident	106 Å²	106	89.6 Å²	89.6	69%	0.688	44%	0.442	S	S	*	.			trans	-69.8	110.5	178.1	26.3	-32.4	0	0	0	109.6	D633 K637	D633-P635 VanDerWaalsContact O-CD 3.22Å; D633-P635 WeakPolarHBondContact O-CD 3.16Å; D633-P635 VanDerWaalsContact O-N 3.07Å; P635-K637 PolarHBondContact O-N 3.44Å
636	I	77.9	Confident	76.8	Confident	31 Å²	31	91.6 Å²	91.6	16%	0.159	46%	0.455	C	S	.	.			trans	-77.6	107.3	-178.5	-60.5	167.6	0	0	0	109.4	P458 A586 G589 L593 L634 L638	P458-I636 HydrophobicContact CB-CG2 4.3Å; P458-I636 HydrophobicContact CG-CG2 4.25Å; A586-I636 HydrophobicContact CB-CB 4.19Å; A586-I636 HydrophobicContact CB-CD1 3.85Å; A586-I636 HydrophobicContact CB-CG2 3.99Å; G589-I636 VanDerWaalsContact O-CD1 3.25Å; G589-I636 WeakPolarHBondContact O-CD1 3.27Å; L593-I636 HydrophobicContact CD1-CD1 3.48Å; L593-I636 VanDerWaalsContact CD1-CD1 3.48Å; L593-I636 HydrophobicContact CD1-CG1 4.32Å; L593-I636 HydrophobicContact CD1-CG2 4.17Å; L593-I636 HydrophobicContact CG-CD1 3.82Å; L634-I636 PolarHBondContact O-N 2.78Å; L634-I636 VanDerWaalsContact O-N 3.09Å; I636-L638 HydrophobicContact CG2-CD2 3.44Å; I636-L638 VanDerWaalsContact CG2-CD2 3.44Å; I636-L638 HydrophobicContact CG2-CG 3.84Å
637	K	74.6	Confident	75.9	Confident	178 Å²	178	97 Å²	97	77%	0.774	48%	0.482	S	S	*	.			trans	-85.8	110.5	164.8	-66	-177.1	-177.9	178.4	0	108.6	P635	P635-K637 PolarHBondContact O-N 3.44Å
638	L	74.9	Confident	74.9	Confident	43 Å²	43	101.8 Å²	101.8	23%	0.225	51%	0.505	C	S	.	.			trans	-86.5	129.9	177	-61.7	172.8	0	0	0	109.5	H456 V582 R583 A586 I636	H456-L638 WeakPolarHBondContact O-CD2 3.11Å; V582-L638 HydrophobicContact CG1-CD1 4.45Å; V582-L638 HydrophobicContact CG1-CD2 3.76Å; R583-L638 HydrophobicContact CB-CD1 4.05Å; R583-L638 HydrophobicContact CG-CD1 3.36Å; A586-L638 HydrophobicContact CB-CD1 3.81Å; A586-L638 HydrophobicContact CB-CD2 4.19Å; A586-L638 HydrophobicContact CB-CG 4.28Å; I636-L638 HydrophobicContact CG2-CD2 3.44Å; I636-L638 VanDerWaalsContact CG2-CD2 3.44Å; I636-L638 HydrophobicContact CG2-CG 3.84Å
639	N	57.1	Low	73.7	Confident	152 Å²	152	94.8 Å²	94.8	81%	0.813	49%	0.49	S	S	*	.			trans	-81.5	0	175.5	-67.4	-10.3	0	0	0	112.8

Retrieved 639 of 639 residues in 191.1 ms (Link to these results)

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