A0A087Y6G8_POEFO Loading...

Lengsin

May act as a component of the cytoskeleton or as a chaperone for the reorganization of intermediate filament proteins during terminal differentiation in the lens. Does not seem to have enzymatic activity.

AlphaFold DB , UniProt , Accession A0A087Y6G8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 681 aa.

Structure Viewer

Loading PAE data...

(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	27.4	Very low	31.8	Very low	230 Å²	230	153.8 Å²	153.8	100%	1.133	78%	0.784	S	S	*	*				0	132.5	0	-76.7	156.5	131.5	0	0	106.9
2	N	31.7	Very low	31.6	Very low	130 Å²	130	151 Å²	151	70%	0.695	79%	0.788	S	S	*	*			trans	25.8	137.7	142.6	-55.1	64.9	0	0	0	119.3
3	D	35	Very low	31.7	Very low	131 Å²	131	158.5 Å²	158.5	70%	0.701	80%	0.8	S	S	*	*			cis	-167.8	171.2	-0.8	-104.6	-18.5	0	0	0	110.9
4	S	36.6	Very low	31.5	Very low	92 Å²	92	155.2 Å²	155.2	64%	0.643	80%	0.799	S	S	*	*			trans	66.5	141.5	151	-70.4	0	0	0	0	122.7
5	E	35.3	Very low	31.5	Very low	181 Å²	181	158.5 Å²	158.5	85%	0.846	81%	0.805	S	S	*	*			trans	63.1	147.4	143.8	-70.2	166.7	-139.3	0	0	120.2
6	D	37.4	Very low	31.7	Very low	142 Å²	142	159 Å²	159	76%	0.759	81%	0.81	S	S	*	*			cis	-163.6	-168.6	-29.3	-159.4	-10.5	0	0	0	107.4
7	F	29	Very low	31.7	Very low	171 Å²	171	159.2 Å²	159.2	75%	0.75	81%	0.807	S	S	*	*			trans	105.3	106.2	162.7	-78.3	-97.7	0	0	0	120.4
8	K	30.6	Very low	31.8	Very low	152 Å²	152	157.1 Å²	157.1	66%	0.661	80%	0.803	S	S	*	*				59	127	127.1	-77.9	-168.5	167.2	-118.7	0	123
9	E	29.3	Very low	31.7	Very low	149 Å²	149	157.7 Å²	157.7	70%	0.696	81%	0.809	S	S	*	*				42.4	109.9	129.3	-58.2	177.3	99	0	0	119.8
10	S	26.6	Very low	31.6	Very low	119 Å²	119	152.8 Å²	152.8	83%	0.832	80%	0.798	S	S	*	*				173.8	177.7	100.2	52.1	0	0	0	0	113.5
11	H	30.8	Very low	31.5	Very low	195 Å²	195	151.4 Å²	151.4	90%	0.903	80%	0.797	S	S	*	*			trans	-44.4	138.1	-169.5	-58.3	-64.7	0	0	0	118.3
12	S	29.6	Very low	31.5	Very low	120 Å²	120	148.7 Å²	148.7	84%	0.839	78%	0.779	S	S	*	*			trans	-115.7	101.2	158.5	51.1	0	0	0	0	112.1
13	R	32.5	Very low	31.4	Very low	249 Å²	249	150.3 Å²	150.3	94%	0.94	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-89.7	120.4	147.3	-86.9	178.8	167.6	169.2	-3.4	106.5
14	S	29.9	Very low	31.1	Very low	112 Å²	112	149.1 Å²	149.1	78%	0.783	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-103.3	116.6	162.3	50	0	0	0	0	110.4
15	K	31.7	Very low	30.8	Very low	205 Å²	205	152.9 Å²	152.9	89%	0.891	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-97.3	132.5	136.7	-76.8	-177.9	173.7	-177.4	0	104.9
16	D	33.7	Very low	30.4	Very low	166 Å²	166	148 Å²	148	89%	0.888	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-101.1	153.9	157.3	-113.3	-47.7	0	0	0	109.7
17	Q	31.8	Very low	30	Very low	162 Å²	162	151.2 Å²	151.2	76%	0.757	80%	0.803	S	S	*	*			trans	-132	140.6	-155.1	-150.1	-179.7	-17.3	0	0	111.8
18	T	33	Very low	30.2	Very low	121 Å²	121	151.8 Å²	151.8	74%	0.742	81%	0.808	S	S	*	*			trans	28	129.3	154.1	52.4	0	0	0	0	119.9
19	D	30.9	Very low	30.2	Very low	170 Å²	170	151.7 Å²	151.7	91%	0.909	81%	0.81	S	S	*	*				-131.8	161.1	120.5	-151	-14.1	0	0	0	109.8
20	G	29.3	Very low	30.3	Very low	58 Å²	58	153.3 Å²	153.3	60%	0.598	82%	0.815	S	S	*	*			trans	176.6	159.9	-179	0	0	0	0	0	114
21	T	28.9	Very low	30.3	Very low	124 Å²	124	151.3 Å²	151.3	76%	0.761	81%	0.813	S	S	*	*			trans	-164.8	133.4	177.5	-94.9	0	0	0	0	114.4
22	K	28	Very low	30.1	Very low	174 Å²	174	148.4 Å²	148.4	76%	0.757	81%	0.808	S	S	*	*			trans	63.8	113.2	155.1	-74.8	168.5	-168.8	170.1	0	123.2
23	M	29	Very low	30.1	Very low	164 Å²	164	152.1 Å²	152.1	81%	0.808	81%	0.809	S	S	*	*				78.8	111.1	117.7	-72.5	-179.8	166.2	0	0	123.2
24	S	29.6	Very low	29.9	Very low	105 Å²	105	146.5 Å²	146.5	73%	0.734	80%	0.802	S	S	*	*				108.2	148.8	110.6	74.9	0	0	0	0	121.5
25	L	30.8	Very low	29.8	Very low	171 Å²	171	146.9 Å²	146.9	90%	0.895	80%	0.8	S	S	*	*			trans	62.9	97.7	161.6	-69.2	162.5	0	0	0	118.6
26	G	26.7	Very low	29.6	Very low	78 Å²	78	147 Å²	147	80%	0.804	80%	0.801	S	S	*	*			trans	-86	-163.4	-178.6	0	0	0	0	0	117.4
27	K	29.6	Very low	29.2	Very low	211 Å²	211	148.2 Å²	148.2	92%	0.917	80%	0.798	S	S	*	*			trans	-162.9	165.5	166.1	-115.3	168.5	-176.6	176.2	0	110.7
28	E	31.6	Very low	28.9	Very low	183 Å²	183	150.4 Å²	150.4	86%	0.855	81%	0.806	S	S	*	*			trans	-92	178.5	-172.5	-61.3	163.2	110.6	0	0	113.5
29	E	30.9	Very low	28.6	Very low	150 Å²	150	151.5 Å²	151.5	70%	0.701	81%	0.806	S	S	*	*			trans	60.8	103.8	154.8	-85.6	-160.9	-174.1	0	0	120
30	K	30.8	Very low	28.7	Very low	183 Å²	183	149 Å²	149	80%	0.796	80%	0.798	S	S	*	*				-179.8	151.1	91.5	-99.9	147	-174.9	109.6	0	113
31	G	27.4	Very low	28.5	Very low	77 Å²	77	153.6 Å²	153.6	79%	0.794	81%	0.808	S	S	*	*			trans	-94.1	162.6	175.9	0	0	0	0	0	113.5
32	V	27.1	Very low	28.5	Very low	133 Å²	133	156.3 Å²	156.3	81%	0.806	82%	0.815	S	S	*	*			trans	-129.2	120.6	176.7	178	0	0	0	0	110.1	V34	V32-V34 HydrophobicContact CG1-CG2 4.31Å
33	K	28.8	Very low	28.5	Very low	198 Å²	198	151.1 Å²	151.1	86%	0.861	81%	0.811	S	S	*	*			trans	-84.6	133	162.1	-80.6	-177.9	174	178.2	0	108.8
34	V	29.1	Very low	28.4	Very low	131 Å²	131	153.1 Å²	153.1	79%	0.794	82%	0.818	S	S	*	*			trans	-104.2	113.6	167.8	-179.7	0	0	0	0	108.9	V32	V32-V34 HydrophobicContact CG1-CG2 4.31Å
35	T	26.6	Very low	28.3	Very low	121 Å²	121	153.2 Å²	153.2	74%	0.742	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-103.1	132.4	171.8	45.8	0	0	0	0	109.9
36	K	27.5	Very low	28	Very low	207 Å²	207	151.4 Å²	151.4	90%	0.9	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-95.9	125.1	165.4	-75.8	-173.8	175.5	-178.5	0	109
37	K	27	Very low	28.1	Very low	192 Å²	192	159.6 Å²	159.6	84%	0.835	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-96.7	143.5	165.8	-76.9	-174.9	173.7	-177.3	0	109.6
38	F	25	Very low	27.9	Very low	208 Å²	208	153.4 Å²	153.4	91%	0.912	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-97.6	156.4	158.8	-102.9	-97.8	0	0	0	109.8
39	I	26.7	Very low	27.6	Very low	144 Å²	144	148.6 Å²	148.6	74%	0.738	82%	0.821	S	S	*	*			trans	-137.3	128.9	178.8	-61.6	171.2	0	0	0	108.9
40	P	32.2	Very low	27.5	Very low	117 Å²	117	148.8 Å²	148.8	76%	0.76	83%	0.827	S	S	*	*			trans	-122.5	148.9	163.3	37.2	-26	0	0	0	113.4
41	L	25.3	Very low	28	Very low	154 Å²	154	145.9 Å²	145.9	81%	0.806	83%	0.827	S	S	*	*			trans	-134.8	126.3	163.2	-109.8	87.2	0	0	0	107.1
42	M	29.6	Very low	28.2	Very low	181 Å²	181	146.8 Å²	146.8	89%	0.892	82%	0.821	S	S	*	*				64.2	128.2	91.7	-74.1	-72.1	-175.6	0	0	114.5
43	G	27.4	Very low	29.1	Very low	66 Å²	66	145.5 Å²	145.5	68%	0.68	82%	0.815	S	S	*	*			cis	-144.6	-155	-0.7	0	0	0	0	0	110.7
44	Q	27.3	Very low	28.9	Very low	206 Å²	206	143.8 Å²	143.8	96%	0.963	82%	0.816	S	S	*	*			cis	-144.5	177.8	9.1	-79.1	-174.1	-12.7	0	0	111.5
45	S	26.4	Very low	28.9	Very low	107 Å²	107	145.1 Å²	145.1	75%	0.748	81%	0.813	S	S	*	*			trans	-90.3	159.8	-168.2	68.5	0	0	0	0	116.9
46	C	25.6	Very low	28.8	Very low	133 Å²	133	145.5 Å²	145.5	90%	0.899	82%	0.819	S	S	*	*			trans	-140.1	161.7	133.9	-99.1	0	0	0	0	111.8
47	R	28.1	Very low	28.7	Very low	250 Å²	250	142.1 Å²	142.1	94%	0.943	81%	0.811	S	S	*	*			trans	-86.2	156.8	-175.1	-54.9	171.2	-178.2	179.3	-1.5	110.4
48	G	25.8	Very low	28.7	Very low	80 Å²	80	139.7 Å²	139.7	83%	0.825	81%	0.812	S	S	*	*			cis	136.8	144.6	-0.7	0	0	0	0	0	111.6
49	G	24.8	Very low	28.7	Very low	82 Å²	82	135.2 Å²	135.2	85%	0.845	81%	0.806	S	S	*	*			trans	152.7	103.6	174.5	0	0	0	0	0	114.5
50	D	29.3	Very low	28.7	Very low	155 Å²	155	133.3 Å²	133.3	83%	0.829	81%	0.806	S	S	*	*			trans	-143.5	153.6	168.1	-117	-18.1	0	0	0	107
51	P	41.4	Very low	28.4	Very low	121 Å²	121	136.5 Å²	136.5	79%	0.786	81%	0.811	S	S	*	*				-143.1	121.9	111.3	34.4	-18.6	0	0	0	115.5
52	S	30.9	Very low	28.4	Very low	96 Å²	96	137 Å²	137	67%	0.671	81%	0.811	S	S	*	*			trans	-19.9	176.6	132.2	55.1	0	0	0	0	119.4
53	P	46.2	Very low	28.9	Very low	106 Å²	106	133.8 Å²	133.8	69%	0.688	80%	0.803	S	S	*	*			cis	-132.9	-170.2	-33	34.3	-16.4	0	0	0	112.1
54	D	25.6	Very low	28.9	Very low	163 Å²	163	136.2 Å²	136.2	87%	0.872	81%	0.81	S	S	*	*			trans	-138.9	161.3	147.6	-141	-25.4	0	0	0	111.7
55	Q	28.7	Very low	29	Very low	158 Å²	158	130.8 Å²	130.8	74%	0.738	80%	0.8	S	S	*	*			trans	-123.6	153.7	-165.2	-60.8	-178.7	1.3	0	0	114.2
56	C	23.4	Very low	29.5	Very low	130 Å²	130	131.7 Å²	131.7	88%	0.878	80%	0.804	S	S	*	*			trans	-148	148.2	148.3	-162.6	0	0	0	0	111.4
57	L	26.6	Very low	29.4	Very low	136 Å²	136	133.5 Å²	133.5	71%	0.712	80%	0.803	S	S	*	*			trans	-118	-178.1	-174.9	-78.1	162.4	0	0	0	111.5
58	T	26.8	Very low	29.2	Very low	140 Å²	140	129 Å²	129	86%	0.859	80%	0.797	S	S	*	*			trans	69	144.6	174.5	43.3	0	0	0	0	116.9
59	S	25.2	Very low	29.1	Very low	114 Å²	114	131.7 Å²	131.7	80%	0.797	80%	0.797	S	S	*	*			cis	-149.7	164.5	-2.8	43.6	0	0	0	0	113.9
60	S	26.2	Very low	28.8	Very low	104 Å²	104	132.9 Å²	132.9	73%	0.727	79%	0.793	S	S	*	*			trans	-61.5	146.3	166.9	156.8	0	0	0	0	113.9
61	E	25.2	Very low	28.6	Very low	185 Å²	185	130 Å²	130	86%	0.864	79%	0.791	S	S	*	*				-167.3	148	116.1	-108.9	175	-158.9	0	0	115.5
62	M	26.4	Very low	27.7	Very low	165 Å²	165	129.8 Å²	129.8	81%	0.813	79%	0.792	S	S	*	*			trans	-160.8	142.6	171.3	-90.9	-69.8	-81.1	0	0	104.7
63	P	39.3	Very low	27.3	Very low	112 Å²	112	128.3 Å²	128.3	73%	0.727	79%	0.792	S	S	*	*				-155.6	178.1	63.2	42.4	-22.9	0	0	0	116.7
64	S	28.1	Very low	26.9	Very low	117 Å²	117	128.6 Å²	128.6	82%	0.818	79%	0.794	S	S	*	*				169.1	171.9	121.6	50.7	0	0	0	0	111.6
65	A	29.3	Very low	27	Very low	93 Å²	93	128.8 Å²	128.8	77%	0.769	79%	0.789	S	S	*	*			trans	-127.4	-178.4	-164.6	0	0	0	0	0	111.8
66	P	36.8	Very low	26.9	Very low	126 Å²	126	127.1 Å²	127.1	82%	0.818	79%	0.786	S	S	*	*			trans	-88.9	167.1	-143	36.7	-40.4	0	0	0	116
67	L	24	Very low	27.1	Very low	170 Å²	170	129.1 Å²	129.1	89%	0.89	78%	0.782	S	S	*	*			trans	-108.2	147.3	165.9	-91	165.9	0	0	0	111.9
68	L	22.4	Very low	27	Very low	156 Å²	156	128.6 Å²	128.6	82%	0.817	78%	0.78	S	S	*	*			trans	-136.7	127.2	-176.1	-174.9	164.5	0	0	0	107.6
69	V	23.6	Very low	27	Very low	136 Å²	136	127.6 Å²	127.6	82%	0.824	77%	0.769	S	S	*	*			trans	-135.1	147.7	-178.9	-177.7	0	0	0	0	109.4
70	S	20.4	Very low	27	Very low	107 Å²	107	132.6 Å²	132.6	75%	0.748	77%	0.77	S	S	*	*			trans	-153.2	162.8	-174.8	-171.7	0	0	0	0	111.5
71	A	24.3	Very low	26.9	Very low	96 Å²	96	135.2 Å²	135.2	79%	0.793	78%	0.775	S	S	*	*			trans	68	155.8	-177.9	0	0	0	0	0	115
72	S	23.2	Very low	27	Very low	116 Å²	116	134.6 Å²	134.6	81%	0.811	77%	0.772	S	S	*	*			cis	-151.8	175.1	2.5	48.7	0	0	0	0	111.8
73	G	22.4	Very low	26.8	Very low	65 Å²	65	135.6 Å²	135.6	67%	0.67	78%	0.775	S	S	*	*			trans	-74.7	-162.4	169.9	0	0	0	0	0	114.3
74	P	37.8	Very low	26.2	Very low	111 Å²	111	141.4 Å²	141.4	72%	0.721	78%	0.782	S	S	*	*			cis	-147.5	-175.5	45.3	44	-24.3	0	0	0	117.6
75	Q	26.1	Very low	26.7	Very low	167 Å²	167	141.2 Å²	141.2	78%	0.78	78%	0.778	S	S	*	*			trans	31	153.1	137.4	-65.1	-177.9	-83.5	0	0	122.6
76	D	26.7	Very low	26.4	Very low	123 Å²	123	144.2 Å²	144.2	66%	0.658	78%	0.777	S	S	*	*			cis	-164.7	174.8	-8.1	-116.4	-39	0	0	0	110.6
77	E	27.4	Very low	25.8	Very low	173 Å²	173	147.4 Å²	147.4	81%	0.808	77%	0.772	S	S	*	*			trans	66.9	148.1	157.3	-89.3	178.6	-162.5	0	0	119.8
78	D	25.7	Very low	25.8	Very low	125 Å²	125	147.5 Å²	147.5	67%	0.668	77%	0.768	S	S	*	*			cis	-158.4	173.7	-7.2	-155.8	0.5	0	0	0	113.7
79	L	26.3	Very low	25.9	Very low	119 Å²	119	146.2 Å²	146.2	62%	0.623	76%	0.762	S	S	*	*			trans	66.1	94.4	156.1	-59.1	-175.7	0	0	0	124
80	R	24.9	Very low	25.9	Very low	218 Å²	218	151 Å²	151	82%	0.823	77%	0.765	S	S	*	*				72	135	111.8	-74.9	-172.2	-173.1	-173.2	0.3	125.1
81	L	24.9	Very low	26	Very low	160 Å²	160	153.6 Å²	153.6	84%	0.838	77%	0.768	S	S	*	*			trans	84	128.7	144.9	-101.3	78.5	0	0	0	121.3
82	E	26.2	Very low	26.2	Very low	171 Å²	171	156.6 Å²	156.6	80%	0.799	76%	0.763	S	S	*	*			trans	-85.8	157.4	159.3	-54.7	-171.6	130.7	0	0	110.4
83	E	23.8	Very low	26.3	Very low	186 Å²	186	156.8 Å²	156.8	87%	0.869	76%	0.755	S	S	*	*				179.8	154.5	103.6	-95.4	-170.7	157.1	0	0	112.8
84	R	26.1	Very low	26.5	Very low	234 Å²	234	161.3 Å²	161.3	88%	0.883	76%	0.759	S	S	*	*			trans	-112.8	154.5	159.1	-84.1	-179.5	170.9	-173.3	-2	105.3
85	P	37.6	Very low	25.9	Very low	113 Å²	113	160 Å²	160	73%	0.734	75%	0.752	S	S	*	*				-162.8	176.8	54.1	44.5	-22.6	0	0	0	120.2
86	Q	24.2	Very low	25.9	Very low	157 Å²	157	158 Å²	158	73%	0.734	76%	0.757	S	S	*	*			trans	61.9	143.8	138.1	-86.6	-170.8	37.9	0	0	125.4
87	R	23.5	Very low	25.9	Very low	192 Å²	192	160.8 Å²	160.8	73%	0.725	77%	0.766	S	S	*	*			trans	77	118.3	144	-78.8	172.8	-178.9	-94.3	2.5	121.3
88	E	25.3	Very low	25.8	Very low	172 Å²	172	159.5 Å²	159.5	80%	0.804	77%	0.77	S	S	*	*				-174.2	122.8	120.9	-97.3	168.2	-158.8	0	0	105.3
89	D	24.4	Very low	25.7	Very low	129 Å²	129	163.2 Å²	163.2	69%	0.69	78%	0.78	S	S	*	*			cis	84.5	80.7	29.6	-148.8	5	0	0	0	113.4
90	W	23.6	Very low	25.6	Very low	236 Å²	236	164.1 Å²	164.1	89%	0.894	79%	0.79	S	S	*	*			trans	-137.4	143.9	179.1	-85.2	68.9	0	0	0	111
91	M	22.6	Very low	25.5	Very low	162 Å²	162	158.8 Å²	158.8	80%	0.798	79%	0.787	S	S	*	*			trans	-151.9	163.1	-172.5	-109.4	-78.6	-78	0	0	110.5
92	K	27.3	Very low	25.6	Very low	159 Å²	159	161.1 Å²	161.1	69%	0.691	79%	0.79	S	S	*	*			trans	73.3	155.2	176.2	-62.2	-174	137.3	-68	0	115.7
93	D	25.7	Very low	25.5	Very low	121 Å²	121	155.8 Å²	155.8	65%	0.647	78%	0.781	S	S	*	*			cis	-161.7	156	-9.1	-101.7	-3.9	0	0	0	105.7
94	E	26.5	Very low	25.7	Very low	160 Å²	160	151 Å²	151	75%	0.748	78%	0.781	S	S	*	*			cis	-163.1	162.5	-20.4	-151.8	-82.2	101.4	0	0	107.9
95	S	25.7	Very low	26	Very low	84 Å²	84	147.9 Å²	147.9	59%	0.587	78%	0.781	S	S	*	*			trans	75.3	125.1	158.3	79.6	0	0	0	0	122.3
96	S	26.1	Very low	25.6	Very low	125 Å²	125	145.9 Å²	145.9	87%	0.874	78%	0.782	S	S	*	*				-150.3	150.7	116.9	59.9	0	0	0	0	109.3
97	Q	26.6	Very low	26.2	Very low	181 Å²	181	144.2 Å²	144.2	85%	0.846	78%	0.782	S	S	*	*			trans	-107.2	139.9	-162.4	-63.4	179.6	-1.4	0	0	114
98	T	24.5	Very low	27	Very low	146 Å²	146	141.3 Å²	141.3	90%	0.896	78%	0.776	S	S	*	*			trans	-148.5	116.4	140.6	-35.5	0	0	0	0	109.8
99	K	23.8	Very low	27.9	Very low	203 Å²	203	141.1 Å²	141.1	88%	0.883	78%	0.775	S	S	*	*			trans	-103.4	134	175.4	-88.4	-177.2	174.6	176.2	0	110.4
100	V	23.6	Very low	28.9	Very low	137 Å²	137	141.1 Å²	141.1	83%	0.83	77%	0.771	S	S	*	*			trans	-128.5	133.3	151.7	-179.7	0	0	0	0	107
101	S	24.2	Very low	30.6	Very low	107 Å²	107	133.3 Å²	133.3	75%	0.748	75%	0.75	S	S	*	*			trans	-108.5	134.8	-171.7	54.6	0	0	0	0	112.2
102	F	26	Very low	31.8	Very low	209 Å²	209	130.3 Å²	130.3	92%	0.917	74%	0.735	S	S	*	*			trans	-105.4	114.6	156.2	-90.6	-90.8	0	0	0	109.2
103	G	25.4	Very low	32.8	Very low	59 Å²	59	127.4 Å²	127.4	61%	0.608	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-81.9	149.5	167.3	0	0	0	0	0	110.4
104	G	27.9	Very low	33.9	Very low	84 Å²	84	126.9 Å²	126.9	87%	0.866	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-68.8	140.3	177.5	0	0	0	0	0	112.3
105	L	30.8	Very low	34.8	Very low	169 Å²	169	124.4 Å²	124.4	89%	0.885	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-94.5	126.1	165.5	-88.3	73.6	0	0	0	109.4
106	G	29.3	Very low	36.1	Very low	72 Å²	72	125 Å²	125	74%	0.742	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-72.1	153.8	167.4	0	0	0	0	0	111.7	H108	G106-H108 PolarHBondContact O-N 2.91Å
107	V	37.6	Very low	37.1	Very low	122 Å²	122	121.9 Å²	121.9	74%	0.739	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-63.5	124.1	176.5	178.9	0	0	0	0	109.7	Q109	V107-Q109 PolarHBondContact O-N 3.37Å
108	H	39.7	Very low	38.3	Very low	130 Å²	130	118.8 Å²	118.8	60%	0.602	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-67.4	119.7	-178.7	-148.6	-100	0	0	0	110.1	G106 Q110 T111	G106-H108 PolarHBondContact O-N 2.91Å; H108-Q110 PolarHBondContact O-N 3.21Å; H108-Q110 VanDerWaalsContact O-N 3.09Å; H108-T111 PolarHBondContact O-N 3.31Å; H108-T111 PolarHBondContact O-OG1 3.07Å
109	Q	44.9	Very low	39.2	Very low	168 Å²	168	118.7 Å²	118.7	79%	0.785	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-21.6	-167.9	-161.4	168.6	8.5	0	0	113.5	V107	V107-Q109 PolarHBondContact O-N 3.37Å
110	Q	45.8	Very low	40.2	Very low	129 Å²	129	117.1 Å²	117.1	60%	0.603	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-43.7	-177.7	-163.2	165.2	-3.3	0	0	113	H108 M112 E113 E114	H108-Q110 PolarHBondContact O-N 3.21Å; H108-Q110 VanDerWaalsContact O-N 3.09Å; Q110-M112 PolarHBondContact O-N 3.48Å; Q110-M112 VanDerWaalsContact O-N 3.15Å; Q110-E113 PolarHBondContact O-N 3.04Å; Q110-E113 VanDerWaalsContact O-N 3.13Å; Q110-E114 PolarHBondContact O-N 3.39Å
111	T	58.2	Low	40.9	Very low	73 Å²	73	116.2 Å²	116.2	45%	0.448	64%	0.639	S	S	.	*	H	α-helix	trans	-63.3	-23.3	179.2	-7.8	0	0	0	0	112.7	H108 L115	H108-T111 PolarHBondContact O-N 3.31Å; H108-T111 PolarHBondContact O-OG1 3.07Å; T111-L115 PolarHBondContact O-N 3.43Å
112	M	48.2	Very low	41.2	Very low	99 Å²	99	115.9 Å²	115.9	49%	0.488	64%	0.637	S	S	.	*	H	α-helix	trans	-88.3	-11.6	-179	-166.5	156.4	52.8	0	0	113.5	Q110 K116	Q110-M112 PolarHBondContact O-N 3.48Å; Q110-M112 VanDerWaalsContact O-N 3.15Å; M112-K116 WeakPolarHBondContact O-CD 3.49Å; M112-K116 VanDerWaalsContact O-CE 3.24Å; M112-K116 WeakPolarHBondContact O-CE 3.46Å; M112-K116 VanDerWaalsContact O-CG 3.29Å; M112-K116 WeakPolarHBondContact O-CG 3.37Å
113	E	47.6	Very low	41.5	Very low	97 Å²	97	114.6 Å²	114.6	45%	0.453	63%	0.634	S	S	.	*	H	α-helix	trans	-87.1	-35.6	163	-77.2	-57.1	127.4	0	0	111.7	Q110 L115 K116 S117 R120	Q110-E113 PolarHBondContact O-N 3.04Å; Q110-E113 VanDerWaalsContact O-N 3.13Å; E113-L115 VanDerWaalsContact C-N 3.35Å; E113-L115 PolarHBondContact O-N 3.09Å; E113-K116 CarbonylContact O-C 3.59Å; E113-K116 WeakPolarHBondContact O-CA 3.5Å; E113-K116 WeakPolarHBondContact O-CB 3.4Å; E113-K116 PolarHBondContact O-N 3.31Å; E113-K116 WeakPolarHBondContact OE1-CD 3.43Å; E113-K116 IonicContact OE1-NZ 3.62Å; E113-K116 PolarHBondContact OE1-NZ 3.19Å; E113-S117 PolarHBondContact O-N 3Å; E113-R120 IonicContact OE2-NH2 2.75Å
114	E	50.1	Low	41.7	Very low	110 Å²	110	119.8 Å²	119.8	51%	0.514	65%	0.646	S	S	.	*	H	α-helix	trans	-57.8	-45.8	175.4	-68.4	174.8	153.5	0	0	111.7	Q110 K116 S117 I118	Q110-E114 PolarHBondContact O-N 3.39Å; E114-K116 VanDerWaalsContact C-N 3.28Å; E114-K116 PolarHBondContact O-N 3.13Å; E114-S117 WeakPolarHBondContact O-CB 3.45Å; E114-S117 PolarHBondContact O-N 2.92Å; E114-I118 WeakPolarHBondContact O-CG1 3.24Å; E114-I118 PolarHBondContact O-N 3.32Å; E114-I118 VanDerWaalsContact O-N 3.07Å
115	L	45.1	Very low	41.9	Very low	109 Å²	109	124.5 Å²	124.5	57%	0.571	65%	0.651	S	S	*	*	H	α-helix	trans	-60.5	-32.7	172.9	-78.5	165.5	0	0	0	113.3	T111 E113 S117 L119	T111-L115 PolarHBondContact O-N 3.43Å; E113-L115 VanDerWaalsContact C-N 3.35Å; E113-L115 PolarHBondContact O-N 3.09Å; L115-S117 VanDerWaalsContact C-N 3.34Å; L115-L119 WeakPolarHBondContact O-CG 3.42Å; L115-L119 PolarHBondContact O-N 3.41Å
116	K	52.8	Low	41.7	Very low	96 Å²	96	121.9 Å²	121.9	42%	0.417	65%	0.647	S	S	.	*	H	α-helix	trans	-79.3	-14	174	-65.1	173.6	-159.5	166	0	113.3	M112 E113 E114 R120	M112-K116 WeakPolarHBondContact O-CD 3.49Å; M112-K116 VanDerWaalsContact O-CE 3.24Å; M112-K116 WeakPolarHBondContact O-CE 3.46Å; M112-K116 VanDerWaalsContact O-CG 3.29Å; M112-K116 WeakPolarHBondContact O-CG 3.37Å; E113-K116 CarbonylContact O-C 3.59Å; E113-K116 WeakPolarHBondContact O-CA 3.5Å; E113-K116 WeakPolarHBondContact O-CB 3.4Å; E113-K116 PolarHBondContact O-N 3.31Å; E113-K116 WeakPolarHBondContact OE1-CD 3.43Å; E113-K116 IonicContact OE1-NZ 3.62Å; E113-K116 PolarHBondContact OE1-NZ 3.19Å; E114-K116 VanDerWaalsContact C-N 3.28Å; E114-K116 PolarHBondContact O-N 3.13Å; K116-R120 PolarHBondContact O-NE 3.15Å; K116-R120 PolarHBondContact O-NH2 3.32Å
117	S	48.1	Very low	41.6	Very low	60 Å²	60	125.6 Å²	125.6	42%	0.42	65%	0.654	S	S	.	*	H	α-helix	trans	-80.1	-48.9	170.5	-156.4	0	0	0	0	109.9	E113 E114 L115 L119 R120 D121	E113-S117 PolarHBondContact O-N 3Å; E114-S117 WeakPolarHBondContact O-CB 3.45Å; E114-S117 PolarHBondContact O-N 2.92Å; L115-S117 VanDerWaalsContact C-N 3.34Å; S117-L119 PolarHBondContact O-N 2.86Å; S117-R120 WeakPolarHBondContact O-CB 3.29Å; S117-R120 PolarHBondContact O-N 3.43Å; S117-D121 PolarHBondContact O-N 2.81Å
118	I	50.2	Low	41.2	Very low	116 Å²	116	129.3 Å²	129.3	60%	0.595	66%	0.655	S	S	*	*	H	α-helix	trans	-57.8	-36.7	179.4	-64.8	165.7	0	0	0	111.7	E114 R120	E114-I118 WeakPolarHBondContact O-CG1 3.24Å; E114-I118 PolarHBondContact O-N 3.32Å; E114-I118 VanDerWaalsContact O-N 3.07Å; I118-R120 VanDerWaalsContact C-N 3.3Å; I118-R120 PolarHBondContact O-N 2.99Å
119	L	43.3	Very low	40.5	Very low	144 Å²	144	126.7 Å²	126.7	75%	0.754	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-7.1	175.4	-72.1	170.7	0	0	0	115	L115 S117	L115-L119 WeakPolarHBondContact O-CG 3.42Å; L115-L119 PolarHBondContact O-N 3.41Å; S117-L119 PolarHBondContact O-N 2.86Å
120	R	45.8	Very low	39.8	Very low	170 Å²	170	126.2 Å²	126.2	64%	0.642	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-28.7	177	-87.3	-177.6	-88.4	-165.3	-1.7	113.8	E113 K116 S117 I118 S122	E113-R120 IonicContact OE2-NH2 2.75Å; K116-R120 PolarHBondContact O-NE 3.15Å; K116-R120 PolarHBondContact O-NH2 3.32Å; S117-R120 WeakPolarHBondContact O-CB 3.29Å; S117-R120 PolarHBondContact O-N 3.43Å; I118-R120 VanDerWaalsContact C-N 3.3Å; I118-R120 PolarHBondContact O-N 2.99Å; R120-S122 PolarHBondContact O-N 2.66Å
121	D	38.1	Very low	38.9	Very low	118 Å²	118	129.4 Å²	129.4	63%	0.631	67%	0.669	S	S	*	*	S	Bend	trans	-88.5	2.7	-174	-62.4	-35.9	0	0	0	114.7	S117 H123	S117-D121 PolarHBondContact O-N 2.81Å; D121-H123 VanDerWaalsContact C-N 3.33Å; D121-H123 PolarHBondContact O-N 3.24Å
122	S	31.6	Very low	37.6	Very low	100 Å²	100	133.5 Å²	133.5	70%	0.699	68%	0.683	S	S	*	*			trans	-75.6	75.9	178.3	-69.8	0	0	0	0	113.1	R120 L124	R120-S122 PolarHBondContact O-N 2.66Å; S122-L124 PolarHBondContact O-N 3.31Å
123	H	30.2	Very low	36.5	Very low	182 Å²	182	138.4 Å²	138.4	84%	0.843	71%	0.705	S	S	*	*			trans	-65.8	96	172	-87.1	-95.4	0	0	0	112.8	D121	D121-H123 VanDerWaalsContact C-N 3.33Å; D121-H123 PolarHBondContact O-N 3.24Å
124	L	31.4	Very low	35.8	Very low	167 Å²	167	143.5 Å²	143.5	87%	0.874	73%	0.726	S	S	*	*			trans	-172.6	86.6	144.6	-107.5	171.2	0	0	0	112.3	S122	S122-L124 PolarHBondContact O-N 3.31Å
125	L	30.4	Very low	35.2	Very low	183 Å²	183	144 Å²	144	96%	0.958	74%	0.738	S	S	*	*			trans	177.6	89	147.7	-101.2	166	0	0	0	109.3
126	S	26.9	Very low	34.3	Very low	115 Å²	115	142.7 Å²	142.7	80%	0.804	75%	0.751	S	S	*	*			trans	-133.8	102.3	176.1	-175.6	0	0	0	0	111.6
127	V	28.2	Very low	33	Very low	149 Å²	149	143.5 Å²	143.5	90%	0.903	77%	0.769	S	S	*	*			trans	-141.2	115.8	141.3	-179.1	0	0	0	0	106.6
128	R	29.2	Very low	32.8	Very low	201 Å²	201	145.4 Å²	145.4	76%	0.758	78%	0.78	S	S	*	*			trans	-131.7	102.6	171.7	-174.6	-178.7	-175.6	-173.9	3.4	109.6
129	G	25.6	Very low	31.6	Very low	74 Å²	74	149.4 Å²	149.4	76%	0.763	79%	0.793	S	S	*	*			trans	-75.1	142.6	154.7	0	0	0	0	0	109.2
130	R	29	Very low	30.8	Very low	159 Å²	159	148.5 Å²	148.5	60%	0.6	79%	0.794	S	S	*	*			trans	-142.2	130.6	178.7	176.8	-128.5	-76	-108.9	2.4	108.3
131	E	27.1	Very low	29.9	Very low	196 Å²	196	151.3 Å²	151.3	92%	0.916	81%	0.806	S	S	*	*			trans	-155	165	144.3	-117.5	153.9	-143.2	0	0	109.7
132	E	30.8	Very low	29.3	Very low	158 Å²	158	153.7 Å²	153.7	74%	0.738	82%	0.818	S	S	*	*			trans	-125.6	143.1	-167.7	-63.1	170.3	109.6	0	0	109
133	E	24.8	Very low	29.2	Very low	203 Å²	203	157.4 Å²	157.4	95%	0.949	82%	0.824	S	S	*	*			trans	-170	-177.6	132	-109.6	-179.4	-170.6	0	0	112.8
134	K	33.8	Very low	28.9	Very low	204 Å²	204	152.3 Å²	152.3	89%	0.887	82%	0.821	S	S	*	*			trans	-106.8	169.9	-158.8	-98.8	-171.3	176.4	179	0	114.6
135	P	37.7	Very low	28.8	Very low	120 Å²	120	149.9 Å²	149.9	78%	0.779	82%	0.817	S	S	*	*			trans	-96.1	159	-147.4	37	-38.8	0	0	0	116.7
136	G	24.6	Very low	28.7	Very low	81 Å²	81	146.7 Å²	146.7	84%	0.835	81%	0.81	S	S	*	*			trans	-117.4	155.3	158.3	0	0	0	0	0	111.4
137	S	27	Very low	28.9	Very low	114 Å²	114	146.6 Å²	146.6	80%	0.797	81%	0.81	S	S	*	*			trans	-151.8	163.9	-170.3	177.4	0	0	0	0	109.4
138	P	42.8	Very low	28.8	Very low	100 Å²	100	143.4 Å²	143.4	65%	0.649	81%	0.807	S	S	*	*			cis	-115.9	-162.5	-41.9	37.7	-23.8	0	0	0	109.4
139	F	24.9	Very low	28.6	Very low	200 Å²	200	137.6 Å²	137.6	88%	0.877	81%	0.81	S	S	*	*			trans	-164	155.4	131.7	-108.7	-65.7	0	0	0	113.3
140	T	27.4	Very low	28.9	Very low	125 Å²	125	141.5 Å²	141.5	77%	0.767	82%	0.819	S	S	*	*			trans	-96	149.4	-170.8	-18.5	0	0	0	0	112.7
141	Y	25.9	Very low	28.8	Very low	229 Å²	229	137.5 Å²	137.5	90%	0.898	83%	0.827	S	S	*	*			trans	-78.2	147.7	166.1	-90.5	-94	0	0	0	111.9
142	L	26.4	Very low	29	Very low	168 Å²	168	138.3 Å²	138.3	88%	0.88	82%	0.821	S	S	*	*			trans	-137.1	159.9	176.3	-111.9	171.9	0	0	0	111.3
143	H	28.6	Very low	29	Very low	177 Å²	177	137.3 Å²	137.3	82%	0.819	82%	0.817	S	S	*	*			trans	-67.8	151.9	-175.6	-91.2	-93.9	0	0	0	114.3
144	G	24.3	Very low	29.2	Very low	76 Å²	76	137.8 Å²	137.8	78%	0.784	82%	0.816	S	S	*	*			trans	-142.3	129	158.5	0	0	0	0	0	110
145	S	29.9	Very low	29.1	Very low	115 Å²	115	140 Å²	140	80%	0.804	82%	0.819	S	S	*	*			trans	-126.1	140.2	-176.8	-59.8	0	0	0	0	110.3
146	S	26.8	Very low	28.6	Very low	116 Å²	116	137.8 Å²	137.8	81%	0.811	82%	0.817	S	S	*	*			trans	-147.7	144.3	170.1	-173.5	0	0	0	0	112.5
147	S	31.1	Very low	28.9	Very low	114 Å²	114	141.4 Å²	141.4	80%	0.797	82%	0.817	S	S	*	*			trans	-58.6	168.4	165.9	45.4	0	0	0	0	113.2
148	G	27.4	Very low	29.1	Very low	82 Å²	82	143.5 Å²	143.5	85%	0.845	82%	0.82	S	S	*	*			cis	146.1	143.1	-2.8	0	0	0	0	0	111.7
149	G	25.5	Very low	28.5	Very low	79 Å²	79	146 Å²	146	81%	0.814	83%	0.828	S	S	*	*			trans	-177.3	158.8	-177	0	0	0	0	0	114
150	V	30.9	Very low	28.8	Very low	156 Å²	156	143.5 Å²	143.5	95%	0.945	82%	0.824	S	S	*	*			trans	-126.6	142.4	-169.1	178	0	0	0	0	111.4
151	G	26.9	Very low	29.6	Very low	75 Å²	75	142.3 Å²	142.3	77%	0.773	82%	0.818	S	S	*	*			trans	-157.3	156.6	175.1	0	0	0	0	0	111.6
152	R	30.6	Very low	29.7	Very low	212 Å²	212	139.8 Å²	139.8	80%	0.8	81%	0.814	S	S	*	*			trans	-147.4	142.1	-159.6	-170	174.1	177.1	-175.6	-5.1	114.1
153	E	31.5	Very low	29.8	Very low	138 Å²	138	143.3 Å²	143.3	65%	0.645	82%	0.816	S	S	*	*			trans	35.3	127.4	158	-66.6	165.2	-146.6	0	0	121.3
154	K	29.2	Very low	29.8	Very low	212 Å²	212	140.8 Å²	140.8	92%	0.922	81%	0.813	S	S	*	*				-172.7	166	112.4	-104.9	171.4	-176.5	-179	0	114.6
155	R	31.5	Very low	29.9	Very low	252 Å²	252	146.6 Å²	146.6	95%	0.951	82%	0.817	S	S	*	*			trans	-91.4	160.6	172.2	-63	-179.8	176.2	-170.1	-1.8	111.7
156	G	26.9	Very low	29.8	Very low	73 Å²	73	146.7 Å²	146.7	75%	0.753	82%	0.817	S	S	*	*			trans	179.7	139.5	162	0	0	0	0	0	110.5
157	D	30.8	Very low	29.8	Very low	156 Å²	156	146.5 Å²	146.5	83%	0.834	81%	0.812	S	S	*	*			trans	-99.5	173.5	-177.2	-68.7	-67.6	0	0	0	113
158	D	31.7	Very low	29.6	Very low	159 Å²	159	150.8 Å²	150.8	85%	0.85	82%	0.816	S	S	*	*			trans	81.4	154.2	155.6	-72.8	-31.4	0	0	0	123.7
159	D	30.5	Very low	29.6	Very low	153 Å²	153	156.7 Å²	156.7	82%	0.818	82%	0.819	S	S	*	*			trans	60.9	100	169.2	-78.9	-17.1	0	0	0	122.4
160	N	32	Very low	29.9	Very low	147 Å²	147	158.9 Å²	158.9	79%	0.786	82%	0.819	S	S	*	*			trans	-78.3	131.9	151.3	167.3	32.5	0	0	0	109.9	H162	N160-H162 PolarHBondContact OD1-N 3.32Å
161	P	42.2	Very low	29.7	Very low	100 Å²	100	160.6 Å²	160.6	65%	0.649	82%	0.816	S	S	*	*				-141.9	138.8	119.9	34.7	-21.3	0	0	0	115.6
162	H	28.9	Very low	29.8	Very low	176 Å²	176	162.5 Å²	162.5	82%	0.815	82%	0.818	S	S	*	*			trans	51	106.2	152.7	-61.3	-58.9	0	0	0	119.5	N160	N160-H162 PolarHBondContact OD1-N 3.32Å
163	R	28.9	Very low	29.8	Very low	241 Å²	241	160.2 Å²	160.2	91%	0.909	82%	0.821	S	S	*	*				-147.7	132.5	125.6	-122.6	174.7	-171.1	-167.5	1.6	114
164	T	28.8	Very low	29.8	Very low	124 Å²	124	157.5 Å²	157.5	76%	0.761	82%	0.822	S	S	*	*			trans	-83.9	146	174.9	42.9	0	0	0	0	111.4
165	F	26.7	Very low	30	Very low	198 Å²	198	151.7 Å²	151.7	87%	0.868	81%	0.809	S	S	*	*			trans	-142.6	125.4	141.8	-97.9	-75.2	0	0	0	109.6
166	S	26.2	Very low	30	Very low	117 Å²	117	150.5 Å²	150.5	82%	0.818	80%	0.804	S	S	*	*			trans	-149.6	132.8	172	-177.9	0	0	0	0	107.7
167	T	27.9	Very low	30.1	Very low	112 Å²	112	158.9 Å²	158.9	69%	0.687	81%	0.813	S	S	*	*			trans	-141.4	110.7	-176.2	32.2	0	0	0	0	109.7
168	F	26.1	Very low	30	Very low	204 Å²	204	155.4 Å²	155.4	90%	0.895	82%	0.815	S	S	*	*				165.2	109.4	122.9	-98.2	-72.5	0	0	0	111.8
169	K	27.1	Very low	29.8	Very low	207 Å²	207	151.9 Å²	151.9	90%	0.9	82%	0.815	S	S	*	*			trans	-165.2	153.7	138.4	-108.2	172.2	-177.6	179.3	0	110.1
170	P	33.1	Very low	29.8	Very low	125 Å²	125	150 Å²	150	81%	0.812	81%	0.814	S	S	*	*			trans	-88.2	167	-166.8	35.7	-36	0	0	0	114.1
171	Q	26.6	Very low	29.7	Very low	192 Å²	192	147.6 Å²	147.6	90%	0.897	81%	0.809	S	S	*	*			trans	-90.8	164.2	179.5	-63.1	177.1	-76.2	0	0	113.5
172	S	29	Very low	29.3	Very low	114 Å²	114	153.5 Å²	153.5	80%	0.797	82%	0.818	S	S	*	*			trans	-149.7	124.5	165.3	60.6	0	0	0	0	111.5
173	D	29.8	Very low	29.2	Very low	164 Å²	164	151.8 Å²	151.8	88%	0.877	81%	0.81	S	S	*	*			trans	-162.8	156.5	174.5	-98.6	-42.6	0	0	0	106.3
174	A	32.1	Very low	29.1	Very low	81 Å²	81	144.8 Å²	144.8	67%	0.669	80%	0.798	S	S	*	*			cis	-161.5	-177.1	-21.7	0	0	0	0	0	105.2
175	S	32.7	Very low	29.1	Very low	91 Å²	91	145.2 Å²	145.2	64%	0.636	80%	0.801	S	S	*	*			cis	175.7	143.6	33.1	-151.7	0	0	0	0	112.6
176	R	32.6	Very low	29.9	Very low	227 Å²	227	141 Å²	141	86%	0.857	79%	0.794	S	S	*	*			trans	74	145.9	141.3	-73.8	168.2	179.2	-170.1	-1	125.9
177	R	29.4	Very low	30	Very low	248 Å²	248	142.5 Å²	142.5	94%	0.936	79%	0.791	S	S	*	*			trans	69.9	138.1	167.6	-57.8	179.6	-177.3	-166.1	0.4	116.7
178	G	27.3	Very low	30	Very low	84 Å²	84	144.9 Å²	144.9	87%	0.866	79%	0.794	S	S	*	*			cis	105.2	129.3	-15.7	0	0	0	0	0	116.9
179	G	27.9	Very low	30	Very low	84 Å²	84	142.2 Å²	142.2	87%	0.866	79%	0.789	S	S	*	*			cis	144.7	125.9	-12.1	0	0	0	0	0	115.2
180	S	30	Very low	30.8	Very low	114 Å²	114	137.3 Å²	137.3	80%	0.797	78%	0.778	S	S	*	*			trans	-166.4	143.2	177.7	-177.1	0	0	0	0	116.7
181	S	30.5	Very low	31.3	Very low	96 Å²	96	136.8 Å²	136.8	67%	0.671	77%	0.774	S	S	*	*			trans	65.9	120.1	144.1	58.4	0	0	0	0	125.6
182	R	33.4	Very low	31.5	Very low	225 Å²	225	133.4 Å²	133.4	85%	0.849	77%	0.767	S	S	*	*			trans	71.1	141.9	130.4	-80.6	-167.8	167.5	-180	-3.1	119.9
183	E	26.7	Very low	31.5	Very low	139 Å²	139	134.5 Å²	134.5	65%	0.65	77%	0.768	S	S	*	*			cis	-155.7	169.1	6.8	-80.5	-118.6	166.5	0	0	108.4
184	S	28.2	Very low	31.3	Very low	94 Å²	94	133.8 Å²	133.8	66%	0.657	76%	0.764	S	S	*	*			cis	-167.6	-173.7	-13.2	-97.8	0	0	0	0	111.8
185	T	28.6	Very low	31	Very low	133 Å²	133	134.1 Å²	134.1	82%	0.816	77%	0.768	S	S	*	*			trans	-96.8	-175.9	-175.6	16.6	0	0	0	0	113.9
186	P	43.2	Very low	30.7	Very low	111 Å²	111	135 Å²	135	72%	0.721	77%	0.774	S	S	*	*			cis	-120.4	-151	15.9	20.9	7.5	0	0	0	113.7
187	I	27.7	Very low	30.4	Very low	148 Å²	148	129.7 Å²	129.7	76%	0.759	77%	0.771	S	S	*	*			cis	-149.8	151.3	21.2	-54.5	168.1	0	0	0	113.3
188	H	27.9	Very low	30.3	Very low	161 Å²	161	122.3 Å²	122.3	75%	0.745	76%	0.758	S	S	*	*			trans	-32.8	161.2	155.9	-72.8	-80.3	0	0	0	118.9
189	L	27.3	Very low	30.2	Very low	149 Å²	149	125.2 Å²	125.2	78%	0.78	75%	0.752	S	S	*	*			cis	-161.8	-152.9	-12.4	-122	-176.4	0	0	0	111.1
190	P	43	Very low	30.1	Very low	104 Å²	104	132.4 Å²	132.4	68%	0.675	75%	0.753	S	S	*	*			trans	-107.3	-155.2	-156.2	49.7	-35.4	0	0	0	112.2
191	P	44.4	Very low	29.9	Very low	113 Å²	113	133.1 Å²	133.1	73%	0.734	76%	0.758	S	S	*	*			cis	-140.7	-168.7	2	41.5	-19.1	0	0	0	118.3
192	T	29.7	Very low	29.8	Very low	121 Å²	121	133.5 Å²	133.5	74%	0.742	77%	0.767	S	S	*	*			trans	-35.1	150.8	166.1	53.7	0	0	0	0	118.9
193	V	29.5	Very low	29.4	Very low	137 Å²	137	127.4 Å²	127.4	83%	0.83	77%	0.765	S	S	*	*				-178.1	162.6	116.3	147	0	0	0	0	110.4
194	D	25.4	Very low	29.5	Very low	149 Å²	149	130.7 Å²	130.7	80%	0.797	78%	0.777	S	S	*	*			trans	-74.8	171	-168.6	-55.6	-91.5	0	0	0	118.3
195	A	26.2	Very low	29.5	Very low	89 Å²	89	132.9 Å²	132.9	74%	0.736	79%	0.786	S	S	*	*				111.7	120.4	129.5	0	0	0	0	0	121.3
196	S	26.3	Very low	29.3	Very low	110 Å²	110	134.3 Å²	134.3	77%	0.769	79%	0.789	S	S	*	*			trans	94.9	145.3	135.5	82.5	0	0	0	0	121.7
197	S	26.5	Very low	28.5	Very low	115 Å²	115	140.8 Å²	140.8	80%	0.804	80%	0.799	S	S	*	*			trans	72.1	154.5	170.5	90.9	0	0	0	0	115.9
198	S	27	Very low	28.5	Very low	93 Å²	93	142.4 Å²	142.4	65%	0.65	80%	0.804	S	S	*	*			cis	-155.6	144	2.6	66.9	0	0	0	0	114.5
199	I	25.9	Very low	28.6	Very low	145 Å²	145	140.3 Å²	140.3	74%	0.744	80%	0.804	S	S	*	*			trans	60.2	117.6	131.6	-64.1	171.8	0	0	0	121.2
200	R	25.5	Very low	28.5	Very low	235 Å²	235	137 Å²	137	89%	0.887	81%	0.806	S	S	*	*			trans	39.5	127.9	143	-58.6	174.8	-177.5	175.1	-0.1	121
201	S	25.5	Very low	27.8	Very low	129 Å²	129	138.3 Å²	138.3	90%	0.902	81%	0.812	S	S	*	*				-166	171.4	100.6	50	0	0	0	0	111
202	A	28.3	Very low	27.1	Very low	104 Å²	104	141.1 Å²	141.1	86%	0.86	81%	0.808	S	S	*	*			trans	-111.6	139.4	-165.9	0	0	0	0	0	113.7
203	A	24.6	Very low	27.2	Very low	97 Å²	97	140 Å²	140	80%	0.802	80%	0.796	S	S	*	*			trans	-146.8	151.5	163.9	0	0	0	0	0	111.5
204	K	29.4	Very low	27.4	Very low	208 Å²	208	141.7 Å²	141.7	90%	0.904	79%	0.789	S	S	*	*			trans	-56.1	140.9	-174.7	-55.8	162.1	-178.2	174.1	0	113.1
205	T	26.8	Very low	27.6	Very low	139 Å²	139	136.6 Å²	136.6	85%	0.853	77%	0.768	S	S	*	*			trans	-133.2	153	159.2	50.6	0	0	0	0	110.9
206	N	25.7	Very low	28.1	Very low	164 Å²	164	138.9 Å²	138.9	88%	0.877	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-72.3	145.9	-175.2	-72.5	-30.3	0	0	0	112.3	Q208	N206-Q208 PolarHBondContact O-N 3.45Å
207	R	25.4	Very low	28.2	Very low	247 Å²	247	137.7 Å²	137.7	93%	0.932	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-63.5	120.3	161.8	-77.7	178.9	168.6	171	-5	109.3
208	Q	27.8	Very low	28.4	Very low	182 Å²	182	136.5 Å²	136.5	85%	0.85	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-82.7	142.2	151.7	-72.9	-170.5	-18.2	0	0	109	N206 G210	N206-Q208 PolarHBondContact O-N 3.45Å; Q208-G210 PolarHBondContact O-N 3.34Å
209	P	29.6	Very low	28.7	Very low	117 Å²	117	136.8 Å²	136.8	76%	0.76	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-73.6	120.6	168.9	30.1	-31.5	0	0	0	109.4	V211	P209-V211 PolarHBondContact O-N 3.39Å
210	G	25.1	Very low	28.9	Very low	80 Å²	80	138.2 Å²	138.2	83%	0.825	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-69.7	119.4	175.9	0	0	0	0	0	111.3	Q208	Q208-G210 PolarHBondContact O-N 3.34Å
211	V	30	Very low	29	Very low	130 Å²	130	131.7 Å²	131.7	79%	0.788	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-77.3	122.1	176.6	179.8	0	0	0	0	109.4	P209	P209-V211 PolarHBondContact O-N 3.39Å
212	R	28.6	Very low	29.1	Very low	172 Å²	172	138.2 Å²	138.2	65%	0.649	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-76.2	132	168.5	-81.1	-174.2	170.5	179.8	-5.9	109.9	Y214	R212-Y214 HydrophobicContact CB-CE2 4.21Å; R212-Y214 PolarHBondContact O-N 3.42Å
213	I	33.1	Very low	29	Very low	99 Å²	99	136.4 Å²	136.4	51%	0.508	74%	0.737	S	S	.	*			trans	-81.5	106.4	170.8	-58.1	174.3	0	0	0	107.7	A215	I213-A215 PolarHBondContact O-N 2.93Å
214	Y	33.8	Very low	29.2	Very low	172 Å²	172	141.4 Å²	141.4	68%	0.675	74%	0.743	S	S	*	*			trans	-82	94.5	177.1	-75.2	-74.6	0	0	0	111.1	R212 H216	R212-Y214 HydrophobicContact CB-CE2 4.21Å; R212-Y214 PolarHBondContact O-N 3.42Å; Y214-H216 PolarHBondContact O-N 3.3Å
215	A	29.6	Very low	29.6	Very low	42 Å²	42	138.6 Å²	138.6	35%	0.347	74%	0.744	S	S	.	*			trans	-79.2	111.5	167.3	0	0	0	0	0	110.1	I213 S217 S239	I213-A215 PolarHBondContact O-N 2.93Å; A215-S217 PolarHBondContact O-N 2.98Å; A215-S217 VanDerWaalsContact O-N 3.08Å; A215-S239 VanDerWaalsContact CB-OG 3.27Å; A215-S239 WeakPolarHBondContact CB-OG 3.45Å
216	H	34.9	Very low	29.9	Very low	136 Å²	136	135.1 Å²	135.1	63%	0.63	74%	0.736	S	S	*	*			trans	-73.7	100.1	-178.9	-77.1	-54.7	0	0	0	112.6	Y214	Y214-H216 PolarHBondContact O-N 3.3Å
217	S	28.3	Very low	30.6	Very low	86 Å²	86	135.3 Å²	135.3	60%	0.601	74%	0.737	S	S	*	*			trans	-95.3	107.2	155	53.7	0	0	0	0	109	A215 S219	A215-S217 PolarHBondContact O-N 2.98Å; A215-S217 VanDerWaalsContact O-N 3.08Å; S217-S219 PolarHBondContact O-N 3.17Å
218	S	32.4	Very low	31.4	Very low	89 Å²	89	125.3 Å²	125.3	62%	0.622	71%	0.705	S	S	*	*			trans	-84	71.7	-173	57.6	0	0	0	0	112.7
219	S	32.9	Very low	32.3	Very low	99 Å²	99	121.4 Å²	121.4	69%	0.692	69%	0.69	S	S	*	*			trans	-154.8	106.3	161.3	-172	0	0	0	0	112	S217	S217-S219 PolarHBondContact O-N 3.17Å
220	R	29.2	Very low	32.9	Very low	176 Å²	176	122.1 Å²	122.1	66%	0.664	69%	0.687	S	S	*	*			trans	-158.6	118.9	154.6	-114.5	173.1	-178	141.8	1.1	108.3	S228 N232	R220-S228 PolarHBondContact NH2-OG 3.28Å; R220-N232 PolarHBondContact NH1-OD1 2.74Å; R220-N232 PolarHBondContact NH2-OD1 3.41Å; R220-N232 VanDerWaalsContact NH2-OD1 3.12Å
221	A	28.1	Very low	33.9	Very low	97 Å²	97	123.8 Å²	123.8	80%	0.802	68%	0.677	S	S	*	*			trans	-72.5	159.7	171.4	0	0	0	0	0	110.3	G223	A221-G223 PolarHBondContact O-N 3.43Å
222	W	26.8	Very low	34.9	Very low	266 Å²	266	119.8 Å²	119.8	100%	1.008	65%	0.651	S	S	*	*	S	Bend	trans	-81.6	108.3	173.9	-72.5	63.2	0	0	0	109.4
223	G	26.8	Very low	35.8	Very low	66 Å²	66	116.7 Å²	116.7	68%	0.68	64%	0.643	S	S	*	*			trans	172.5	117.3	176.5	0	0	0	0	0	114.1	A221	A221-G223 PolarHBondContact O-N 3.43Å
224	E	28.9	Very low	36.6	Very low	202 Å²	202	114.8 Å²	114.8	94%	0.944	64%	0.642	S	S	*	*			trans	65.2	153.2	160.5	-53.8	-165.7	153.9	0	0	119.1
225	T	37	Very low	37.7	Very low	150 Å²	150	110.1 Å²	110.1	92%	0.92	63%	0.631	S	S	*	*			trans	-110	113.3	-168.8	49.3	0	0	0	0	111.6
226	G	33.3	Very low	39.1	Very low	66 Å²	66	112 Å²	112	68%	0.68	63%	0.633	S	S	*	*			trans	-147.6	132	175.4	0	0	0	0	0	111.7	S228	G226-S228 PolarHBondContact O-N 3.16Å
227	D	40.1	Very low	40.2	Very low	167 Å²	167	112.6 Å²	112.6	89%	0.893	63%	0.633	S	S	*	*			trans	-36.5	118.4	-178.8	-158.2	0.4	0	0	0	115.1
228	S	43.8	Very low	41.9	Very low	37 Å²	37	111 Å²	111	26%	0.259	62%	0.623	S	S	.	*			trans	-147.9	20.4	179.8	70	0	0	0	0	115.4	R220 G226 N230 D231 N232	R220-S228 PolarHBondContact NH2-OG 3.28Å; G226-S228 PolarHBondContact O-N 3.16Å; S228-N230 PolarHBondContact O-N 2.92Å; S228-N230 VanDerWaalsContact O-N 3.09Å; S228-D231 PolarHBondContact O-N 3.31Å; S228-N232 VanDerWaalsContact O-CG 3.3Å; S228-N232 PolarHBondContact O-N 3.09Å; S228-N232 PolarHBondContact O-ND2 3.49Å; S228-N232 VanDerWaalsContact O-ND2 3.12Å; S228-N232 PolarHBondContact OG-ND2 3.09Å
229	D	46.1	Very low	43.7	Very low	101 Å²	101	108.2 Å²	108.2	54%	0.54	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72	-7.7	-168.1	-153.2	56.8	0	0	0	114.6	K233	D229-K233 WeakPolarHBondContact O-CG 3.31Å; D229-K233 PolarHBondContact O-NZ 2.67Å; D229-K233 IonicContact OD2-NZ 3.71Å; D229-K233 PolarHBondContact OD2-NZ 2.87Å
230	N	41.2	Very low	45.8	Very low	132 Å²	132	105 Å²	105	71%	0.706	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-45.4	176.3	-152.2	33.2	0	0	0	112.3	S228 N232 K233 A234	S228-N230 PolarHBondContact O-N 2.92Å; S228-N230 VanDerWaalsContact O-N 3.09Å; N230-N232 VanDerWaalsContact C-N 3.33Å; N230-N232 PolarHBondContact O-N 3.48Å; N230-K233 PolarHBondContact O-N 2.9Å; N230-K233 VanDerWaalsContact O-N 3.15Å; N230-A234 PolarHBondContact O-N 2.71Å
231	D	47.8	Very low	48.5	Very low	114 Å²	114	101.2 Å²	101.2	61%	0.61	57%	0.57	S	S	*	*	H	α-helix	trans	-64.2	-38.4	178.7	-69.1	-25.9	0	0	0	112	S228 K233 A234 V235	S228-D231 PolarHBondContact O-N 3.31Å; D231-K233 PolarHBondContact O-N 3.14Å; D231-A234 PolarHBondContact O-N 3.4Å; D231-A234 VanDerWaalsContact O-N 3.13Å; D231-V235 WeakPolarHBondContact O-CG2 3.48Å; D231-V235 PolarHBondContact O-N 2.99Å
232	N	50.3	Low	51.3	Low	46 Å²	46	105.5 Å²	105.5	25%	0.246	57%	0.566	C	S	.	*	H	α-helix	trans	-54.7	-42.7	174.4	-66.4	-29.1	0	0	0	111.2	R220 S228 N230 V235 E236	R220-N232 PolarHBondContact NH1-OD1 2.74Å; R220-N232 PolarHBondContact NH2-OD1 3.41Å; R220-N232 VanDerWaalsContact NH2-OD1 3.12Å; S228-N232 VanDerWaalsContact O-CG 3.3Å; S228-N232 PolarHBondContact O-N 3.09Å; S228-N232 PolarHBondContact O-ND2 3.49Å; S228-N232 VanDerWaalsContact O-ND2 3.12Å; S228-N232 PolarHBondContact OG-ND2 3.09Å; N230-N232 VanDerWaalsContact C-N 3.33Å; N230-N232 PolarHBondContact O-N 3.48Å; N232-V235 PolarHBondContact O-N 3Å; N232-E236 WeakPolarHBondContact O-CB 3.41Å; N232-E236 WeakPolarHBondContact O-CG 3.36Å; N232-E236 PolarHBondContact O-N 3.18Å
233	K	47.6	Very low	54.3	Low	108 Å²	108	95.7 Å²	95.7	47%	0.47	53%	0.53	S	S	.	.	H	α-helix	trans	-69	-36.2	179.1	-64.6	-178.4	-174.6	101	0	112.4	D229 N230 D231 F237	D229-K233 WeakPolarHBondContact O-CG 3.31Å; D229-K233 PolarHBondContact O-NZ 2.67Å; D229-K233 IonicContact OD2-NZ 3.71Å; D229-K233 PolarHBondContact OD2-NZ 2.87Å; N230-K233 PolarHBondContact O-N 2.9Å; N230-K233 VanDerWaalsContact O-N 3.15Å; D231-K233 PolarHBondContact O-N 3.14Å; K233-F237 VanDerWaalsContact O-CB 3.26Å; K233-F237 WeakPolarHBondContact O-CB 3.27Å; K233-F237 PolarHBondContact O-N 3.5Å
234	A	49.9	Very low	57.4	Low	59 Å²	59	97.2 Å²	97.2	49%	0.488	52%	0.518	S	S	.	.	H	α-helix	trans	-66.3	-39.9	175.5	0	0	0	0	0	111.9	N230 D231 S238	N230-A234 PolarHBondContact O-N 2.71Å; D231-A234 PolarHBondContact O-N 3.4Å; D231-A234 VanDerWaalsContact O-N 3.13Å; A234-S238 VanDerWaalsContact O-CB 3.26Å; A234-S238 WeakPolarHBondContact O-CB 3.45Å; A234-S238 PolarHBondContact O-N 3.49Å
235	V	57.4	Low	60.4	Low	73 Å²	73	90.5 Å²	90.5	44%	0.442	49%	0.494	S	S	.	.	H	α-helix	trans	-70.2	-43.3	175.9	176.2	0	0	0	0	111.6	D231 N232 S239	D231-V235 WeakPolarHBondContact O-CG2 3.48Å; D231-V235 PolarHBondContact O-N 2.99Å; N232-V235 PolarHBondContact O-N 3Å; V235-S239 VanDerWaalsContact O-CB 3.28Å; V235-S239 WeakPolarHBondContact O-CB 3.35Å; V235-S239 PolarHBondContact O-N 3.45Å; V235-S239 PolarHBondContact O-OG 2.79Å
236	E	57.4	Low	63.2	Low	83 Å²	83	84.6 Å²	84.6	39%	0.388	46%	0.46	S	S	.	.	H	α-helix	trans	-59.4	-44.6	172.4	-77.4	-177.3	170.2	0	0	111.3	N232 S239 N240	N232-E236 WeakPolarHBondContact O-CB 3.41Å; N232-E236 WeakPolarHBondContact O-CG 3.36Å; N232-E236 PolarHBondContact O-N 3.18Å; E236-S239 WeakPolarHBondContact CA-OG 3.49Å; E236-S239 PolarHBondContact O-OG 2.66Å; E236-S239 VanDerWaalsContact O-OG 3.05Å; E236-N240 WeakPolarHBondContact O-CB 3.48Å; E236-N240 PolarHBondContact O-N 2.78Å; E236-N240 PolarHBondContact O-ND2 3.09Å
237	F	59.3	Low	66.1	Low	147 Å²	147	81.5 Å²	81.5	65%	0.645	43%	0.428	S	S	*	.	H	α-helix	trans	-66	-47.8	179.4	-170.3	-104.7	0	0	0	112.2	K233 S239 N240 L241	K233-F237 VanDerWaalsContact O-CB 3.26Å; K233-F237 WeakPolarHBondContact O-CB 3.27Å; K233-F237 PolarHBondContact O-N 3.5Å; F237-S239 PolarHBondContact O-N 3.43Å; F237-N240 PolarHBondContact O-N 3.22Å; F237-L241 HydrophobicContact CD1-CD1 3.85Å; F237-L241 HydrophobicContact CD2-CD1 4.17Å; F237-L241 HydrophobicContact CE1-CD1 3.6Å; F237-L241 HydrophobicContact CE1-CD2 4.43Å; F237-L241 HydrophobicContact CE2-CD1 3.94Å; F237-L241 HydrophobicContact CG-CD1 4.13Å; F237-L241 HydrophobicContact CZ-CD1 3.65Å; F237-L241 WeakPolarHBondContact O-CD1 3.23Å; F237-L241 PolarHBondContact O-N 2.65Å
238	S	64	Low	68.8	Low	54 Å²	54	77.4 Å²	77.4	38%	0.378	40%	0.404	S	S	.	.	H	α-helix	trans	-61.1	-42.4	178.7	-176.2	0	0	0	0	112.5	A234 L241 R242	A234-S238 VanDerWaalsContact O-CB 3.26Å; A234-S238 WeakPolarHBondContact O-CB 3.45Å; A234-S238 PolarHBondContact O-N 3.49Å; S238-L241 PolarHBondContact O-N 3.09Å; S238-R242 WeakPolarHBondContact O-CG 3.39Å; S238-R242 PolarHBondContact O-N 2.98Å; S238-R242 VanDerWaalsContact O-N 3.13Å
239	S	69	Low	71.3	Confident	30 Å²	30	81.4 Å²	81.4	21%	0.21	42%	0.418	C	S	.	.	H	α-helix	trans	-69.8	-39.1	179.3	56.5	0	0	0	0	112.5	A215 V235 E236 F237 R242 F243	A215-S239 VanDerWaalsContact CB-OG 3.27Å; A215-S239 WeakPolarHBondContact CB-OG 3.45Å; V235-S239 VanDerWaalsContact O-CB 3.28Å; V235-S239 WeakPolarHBondContact O-CB 3.35Å; V235-S239 PolarHBondContact O-N 3.45Å; V235-S239 PolarHBondContact O-OG 2.79Å; E236-S239 WeakPolarHBondContact CA-OG 3.49Å; E236-S239 PolarHBondContact O-OG 2.66Å; E236-S239 VanDerWaalsContact O-OG 3.05Å; F237-S239 PolarHBondContact O-N 3.43Å; S239-R242 PolarHBondContact O-N 3.29Å; S239-F243 PolarHBondContact O-N 3.44Å
240	N	78.6	Confident	73.7	Confident	31 Å²	31	77 Å²	77	17%	0.166	40%	0.395	C	S	.	.	H	α-helix	trans	-60.5	-45.7	170.6	-83.6	-77.3	0	0	0	112.2	E236 F237 R242 F243 F244	E236-N240 WeakPolarHBondContact O-CB 3.48Å; E236-N240 PolarHBondContact O-N 2.78Å; E236-N240 PolarHBondContact O-ND2 3.09Å; F237-N240 PolarHBondContact O-N 3.22Å; N240-R242 VanDerWaalsContact C-N 3.31Å; N240-R242 PolarHBondContact O-N 2.79Å; N240-F243 WeakPolarHBondContact O-CB 3.45Å; N240-F243 PolarHBondContact O-N 3.04Å; N240-F243 VanDerWaalsContact O-N 3.16Å; N240-F244 HydrophobicContact CB-CE2 4.32Å; N240-F244 WeakPolarHBondContact O-CD2 3.24Å; N240-F244 PolarHBondContact O-N 3.12Å
241	L	84.6	Confident	76.3	Confident	96 Å²	96	73.7 Å²	73.7	50%	0.503	37%	0.374	S	S	.	.	H	α-helix	trans	-59.3	-40.5	176.7	-94.7	80	0	0	0	112.4	F237 S238 F244 S245	F237-L241 HydrophobicContact CD1-CD1 3.85Å; F237-L241 HydrophobicContact CD2-CD1 4.17Å; F237-L241 HydrophobicContact CE1-CD1 3.6Å; F237-L241 HydrophobicContact CE1-CD2 4.43Å; F237-L241 HydrophobicContact CE2-CD1 3.94Å; F237-L241 HydrophobicContact CG-CD1 4.13Å; F237-L241 HydrophobicContact CZ-CD1 3.65Å; F237-L241 WeakPolarHBondContact O-CD1 3.23Å; F237-L241 PolarHBondContact O-N 2.65Å; S238-L241 PolarHBondContact O-N 3.09Å; L241-F244 PolarHBondContact O-N 2.77Å; L241-S245 WeakPolarHBondContact O-CB 3.4Å; L241-S245 PolarHBondContact O-N 2.89Å
242	R	87.6	Confident	78.7	Confident	187 Å²	187	73.9 Å²	73.9	71%	0.706	37%	0.371	S	S	*	.	H	α-helix	trans	-61.9	-43.6	174.9	-70.3	176.8	-173.7	-163.9	0.4	111.8	S238 S239 N240 S245 A246	S238-R242 WeakPolarHBondContact O-CG 3.39Å; S238-R242 PolarHBondContact O-N 2.98Å; S238-R242 VanDerWaalsContact O-N 3.13Å; S239-R242 PolarHBondContact O-N 3.29Å; N240-R242 VanDerWaalsContact C-N 3.31Å; N240-R242 PolarHBondContact O-N 2.79Å; R242-S245 PolarHBondContact O-N 3.38Å; R242-A246 WeakPolarHBondContact O-CB 3.46Å; R242-A246 PolarHBondContact O-N 2.83Å
243	F	90.1	Very high	80.8	Confident	61 Å²	61	74.5 Å²	74.5	27%	0.268	37%	0.373	S	S	.	.	H	α-helix	trans	-61.1	-49.5	177	177.8	-90.6	0	0	0	112	S239 N240 S245 A246 M247 A287 I288 L327	S239-F243 PolarHBondContact O-N 3.44Å; N240-F243 WeakPolarHBondContact O-CB 3.45Å; N240-F243 PolarHBondContact O-N 3.04Å; N240-F243 VanDerWaalsContact O-N 3.16Å; F243-S245 VanDerWaalsContact C-N 3.35Å; F243-S245 PolarHBondContact O-N 2.98Å; F243-A246 PolarHBondContact O-N 2.76Å; F243-M247 HydrophobicContact CD1-CE 4.33Å; F243-M247 HydrophobicContact CE1-CE 3.82Å; F243-M247 HydrophobicContact CE1-SD 4.01Å; F243-M247 HydrophobicContact CZ-SD 4.35Å; F243-M247 VanDerWaalsContact O-CB 3.3Å; F243-M247 WeakPolarHBondContact O-CB 3.11Å; F243-M247 PolarHBondContact O-N 3.47Å; F243-A287 WeakPolarHBondContact CZ-O 3.41Å; F243-I288 HydrophobicContact CE1-CG1 4.12Å; F243-I288 HydrophobicContact CZ-CG1 4.17Å; F243-L327 HydrophobicContact CD2-CD1 3.73Å; F243-L327 HydrophobicContact CD2-CG 4.49Å; F243-L327 HydrophobicContact CE2-CD1 3.57Å; F243-L327 HydrophobicContact CE2-CG 4.21Å; F243-L327 HydrophobicContact CG-CD1 4.45Å; F243-L327 HydrophobicContact CZ-CD1 4.16Å
244	F	90.8	Very high	83.2	Confident	97 Å²	97	70.3 Å²	70.3	43%	0.425	36%	0.355	S	S	.	.	H	α-helix	trans	-62	-41.5	177.2	-72.2	-65.4	0	0	0	112.1	N240 L241 M247 E248	N240-F244 HydrophobicContact CB-CE2 4.32Å; N240-F244 WeakPolarHBondContact O-CD2 3.24Å; N240-F244 PolarHBondContact O-N 3.12Å; L241-F244 PolarHBondContact O-N 2.77Å; F244-M247 HydrophobicContact CD1-CE 3.53Å; F244-M247 HydrophobicContact CE1-CE 3.92Å; F244-M247 PolarHBondContact O-N 2.88Å; F244-E248 PolarHBondContact O-N 2.85Å
245	S	93.4	Very high	85.4	Confident	62 Å²	62	71.3 Å²	71.3	43%	0.434	36%	0.363	S	S	.	.	H	α-helix	trans	-62.2	-47.6	177	-174.7	0	0	0	0	112.5	L241 R242 F243 M247 E248 Q249	L241-S245 WeakPolarHBondContact O-CB 3.4Å; L241-S245 PolarHBondContact O-N 2.89Å; R242-S245 PolarHBondContact O-N 3.38Å; F243-S245 VanDerWaalsContact C-N 3.35Å; F243-S245 PolarHBondContact O-N 2.98Å; S245-M247 PolarHBondContact O-N 2.81Å; S245-E248 PolarHBondContact O-N 3.08Å; S245-Q249 VanDerWaalsContact O-CG 3.28Å; S245-Q249 WeakPolarHBondContact O-CG 3.49Å; S245-Q249 PolarHBondContact O-N 3.05Å
246	A	94.3	Very high	87.3	Confident	25 Å²	25	77.2 Å²	77.2	21%	0.207	38%	0.378	C	S	.	.	H	α-helix	trans	-63.2	-41.2	177	0	0	0	0	0	111.8	R242 F243 E248 Q249 I250 L327	R242-A246 WeakPolarHBondContact O-CB 3.46Å; R242-A246 PolarHBondContact O-N 2.83Å; F243-A246 PolarHBondContact O-N 2.76Å; A246-E248 PolarHBondContact O-N 3.05Å; A246-Q249 PolarHBondContact O-N 3.2Å; A246-I250 WeakPolarHBondContact O-CD1 3.45Å; A246-I250 VanDerWaalsContact O-CG1 3.25Å; A246-I250 WeakPolarHBondContact O-CG1 3.43Å; A246-I250 PolarHBondContact O-N 2.89Å; A246-L327 HydrophobicContact CB-CB 4.26Å; A246-L327 HydrophobicContact CB-CD1 4.31Å
247	M	95.4	Very high	89.1	Confident	1 Å²	1	77.3 Å²	77.3	1%	0.005	38%	0.378	C	S	.	.	H	α-helix	trans	-63.7	-41	178.7	-179.2	169.9	55.4	0	0	112.8	F243 F244 S245 I250 K251 H284 A287 I288 L327	F243-M247 HydrophobicContact CD1-CE 4.33Å; F243-M247 HydrophobicContact CE1-CE 3.82Å; F243-M247 HydrophobicContact CE1-SD 4.01Å; F243-M247 HydrophobicContact CZ-SD 4.35Å; F243-M247 VanDerWaalsContact O-CB 3.3Å; F243-M247 WeakPolarHBondContact O-CB 3.11Å; F243-M247 PolarHBondContact O-N 3.47Å; F244-M247 HydrophobicContact CD1-CE 3.53Å; F244-M247 HydrophobicContact CE1-CE 3.92Å; F244-M247 PolarHBondContact O-N 2.88Å; S245-M247 PolarHBondContact O-N 2.81Å; M247-I250 PolarHBondContact O-N 2.77Å; M247-K251 WeakPolarHBondContact O-CG 3.45Å; M247-K251 PolarHBondContact O-N 3.01Å; M247-H284 PolarHBondContact SD-ND1 2.7Å; M247-A287 HydrophobicContact SD-CB 4.27Å; M247-I288 HydrophobicContact SD-CG1 4.43Å; M247-L327 HydrophobicContact CB-CD1 4.05Å
248	E	95.4	Very high	90.9	Very high	82 Å²	82	75.3 Å²	75.3	38%	0.383	37%	0.374	S	S	.	.	H	α-helix	trans	-71.6	-35.2	175.1	-64.8	-48.6	129.8	0	0	112.6	F244 S245 A246 K251 Q252	F244-E248 PolarHBondContact O-N 2.85Å; S245-E248 PolarHBondContact O-N 3.08Å; A246-E248 PolarHBondContact O-N 3.05Å; E248-K251 PolarHBondContact O-N 2.89Å; E248-K251 WeakPolarHBondContact OE1-CD 3.21Å; E248-K251 WeakPolarHBondContact OE1-CE 3.17Å; E248-K251 IonicContact OE1-NZ 2.66Å; E248-K251 PolarHBondContact OE1-NZ 3.34Å; E248-K251 VanDerWaalsContact OE2-CD 3.24Å; E248-K251 WeakPolarHBondContact OE2-CD 3.17Å; E248-K251 IonicContact OE2-NZ 2.66Å; E248-Q252 VanDerWaalsContact O-CG 3.32Å; E248-Q252 WeakPolarHBondContact O-CG 3.35Å; E248-Q252 PolarHBondContact O-N 2.71Å
249	Q	96.4	Very high	92.5	Very high	120 Å²	120	73 Å²	73	56%	0.561	36%	0.357	S	S	*	.	H	α-helix	trans	-60.4	-44.9	171.4	-73.5	168.3	-4.2	0	0	111.5	S245 A246 Q252 Q253	S245-Q249 VanDerWaalsContact O-CG 3.28Å; S245-Q249 WeakPolarHBondContact O-CG 3.49Å; S245-Q249 PolarHBondContact O-N 3.05Å; A246-Q249 PolarHBondContact O-N 3.2Å; Q249-Q252 PolarHBondContact O-N 3.16Å; Q249-Q253 PolarHBondContact O-N 3.44Å
250	I	97.1	Very high	93.9	Very high	10 Å²	10	74.8 Å²	74.8	5%	0.051	37%	0.365	C	S	.	.	H	α-helix	trans	-65.8	-40	177.5	-67	162	0	0	0	111.3	A246 M247 Q252 Q253 I254 F283 L327 F330	A246-I250 WeakPolarHBondContact O-CD1 3.45Å; A246-I250 VanDerWaalsContact O-CG1 3.25Å; A246-I250 WeakPolarHBondContact O-CG1 3.43Å; A246-I250 PolarHBondContact O-N 2.89Å; M247-I250 PolarHBondContact O-N 2.77Å; I250-Q252 VanDerWaalsContact C-N 3.33Å; I250-Q252 PolarHBondContact O-N 3.41Å; I250-Q253 PolarHBondContact O-N 3.35Å; I250-I254 HydrophobicContact CG2-CD1 3.75Å; I250-I254 HydrophobicContact CG2-CG1 4.35Å; I250-I254 VanDerWaalsContact O-CB 3.31Å; I250-I254 WeakPolarHBondContact O-CB 3.35Å; I250-I254 VanDerWaalsContact O-CG1 3.31Å; I250-I254 WeakPolarHBondContact O-CG1 3.47Å; I250-I254 PolarHBondContact O-N 3.43Å; I250-F283 HydrophobicContact CB-CE1 4.31Å; I250-F283 HydrophobicContact CB-CZ 4.42Å; I250-F283 HydrophobicContact CG2-CE1 3.57Å; I250-F283 HydrophobicContact CG2-CE2 4.47Å; I250-F283 HydrophobicContact CG2-CZ 3.53Å; I250-L327 HydrophobicContact CD1-CB 3.8Å; I250-L327 HydrophobicContact CD1-CD1 4.48Å; I250-L327 HydrophobicContact CD1-CD2 4Å; I250-L327 HydrophobicContact CD1-CG 4.3Å; I250-F330 HydrophobicContact CB-CD1 4.44Å; I250-F330 HydrophobicContact CB-CG 4.46Å; I250-F330 HydrophobicContact CD1-CB 3.68Å; I250-F330 HydrophobicContact CD1-CG 4.08Å; I250-F330 HydrophobicContact CG1-CB 3.91Å; I250-F330 HydrophobicContact CG1-CD1 4Å; I250-F330 HydrophobicContact CG1-CG 3.91Å; I250-F330 HydrophobicContact CG2-CD1 3.82Å; I250-F330 HydrophobicContact CG2-CD2 3.68Å; I250-F330 HydrophobicContact CG2-CE1 3.9Å; I250-F330 HydrophobicContact CG2-CE2 3.75Å; I250-F330 HydrophobicContact CG2-CG 3.71Å; I250-F330 HydrophobicContact CG2-CZ 3.86Å
251	K	96.4	Very high	94.8	Very high	61 Å²	61	77.5 Å²	77.5	27%	0.265	38%	0.375	S	S	.	.	H	α-helix	trans	-59.4	-41.7	172.4	-76.1	167.4	175.3	179.3	0	112.3	M247 E248 A255 H284	M247-K251 WeakPolarHBondContact O-CG 3.45Å; M247-K251 PolarHBondContact O-N 3.01Å; E248-K251 PolarHBondContact O-N 2.89Å; E248-K251 WeakPolarHBondContact OE1-CD 3.21Å; E248-K251 WeakPolarHBondContact OE1-CE 3.17Å; E248-K251 IonicContact OE1-NZ 2.66Å; E248-K251 PolarHBondContact OE1-NZ 3.34Å; E248-K251 VanDerWaalsContact OE2-CD 3.24Å; E248-K251 WeakPolarHBondContact OE2-CD 3.17Å; E248-K251 IonicContact OE2-NZ 2.66Å; K251-A255 PolarHBondContact O-N 3.34Å; K251-H284 PolarHBondContact NZ-ND1 3.48Å
252	Q	96.8	Very high	95.5	Very high	119 Å²	119	73 Å²	73	56%	0.556	35%	0.351	S	S	*	.	H	α-helix	trans	-66.6	-38.6	175.9	-70.2	173.2	25.5	0	0	112.1	E248 Q249 I250 A255 R256	E248-Q252 VanDerWaalsContact O-CG 3.32Å; E248-Q252 WeakPolarHBondContact O-CG 3.35Å; E248-Q252 PolarHBondContact O-N 2.71Å; Q249-Q252 PolarHBondContact O-N 3.16Å; I250-Q252 VanDerWaalsContact C-N 3.33Å; I250-Q252 PolarHBondContact O-N 3.41Å; Q252-A255 PolarHBondContact O-N 3.23Å; Q252-R256 WeakPolarHBondContact O-CB 3.28Å; Q252-R256 PolarHBondContact O-N 3.2Å
253	Q	96.3	Very high	95.9	Very high	59 Å²	59	65.8 Å²	65.8	28%	0.276	32%	0.324	S	S	.	.	H	α-helix	trans	-65	-47.5	174.7	-168.8	175	8.7	0	0	111.5	Q249 I250 A255 R256 E257 F330 V332	Q249-Q253 PolarHBondContact O-N 3.44Å; I250-Q253 PolarHBondContact O-N 3.35Å; Q253-A255 VanDerWaalsContact C-N 3.28Å; Q253-A255 PolarHBondContact O-N 3.13Å; Q253-R256 PolarHBondContact O-N 3.32Å; Q253-R256 VanDerWaalsContact O-N 3.13Å; Q253-E257 HydrophobicContact CG-CG 4.46Å; Q253-E257 WeakPolarHBondContact CG-OE1 3.48Å; Q253-E257 PolarHBondContact NE2-OE1 2.79Å; Q253-E257 PolarHBondContact O-N 3.12Å; Q253-F330 HydrophobicContact CG-CE1 4.46Å; Q253-V332 HydrophobicContact CG-CG2 4.47Å
254	I	96.8	Very high	96.3	Very high	19 Å²	19	62.9 Å²	62.9	10%	0.097	31%	0.312	C	S	.	.	H	α-helix	trans	-50.6	-46.7	173.2	-82.3	165.4	0	0	0	112	I250 N258 I259 V262 V280 F283 F330	I250-I254 HydrophobicContact CG2-CD1 3.75Å; I250-I254 HydrophobicContact CG2-CG1 4.35Å; I250-I254 VanDerWaalsContact O-CB 3.31Å; I250-I254 WeakPolarHBondContact O-CB 3.35Å; I250-I254 VanDerWaalsContact O-CG1 3.31Å; I250-I254 WeakPolarHBondContact O-CG1 3.47Å; I250-I254 PolarHBondContact O-N 3.43Å; I254-N258 PolarHBondContact O-N 3.15Å; I254-N258 VanDerWaalsContact O-N 3.12Å; I254-I259 HydrophobicContact CB-CB 4.39Å; I254-I259 HydrophobicContact CG1-CB 4.18Å; I254-I259 HydrophobicContact CG1-CD1 4.12Å; I254-I259 HydrophobicContact CG1-CG2 4.38Å; I254-I259 HydrophobicContact CG2-CB 4.38Å; I254-I259 PolarHBondContact O-N 2.89Å; I254-V262 HydrophobicContact CD1-CG2 4.39Å; I254-V280 HydrophobicContact CB-CG2 4.43Å; I254-V280 HydrophobicContact CD1-CG2 3.8Å; I254-V280 HydrophobicContact CG1-CG2 4.16Å; I254-V280 HydrophobicContact CG2-CG2 3.45Å; I254-V280 VanDerWaalsContact CG2-CG2 3.45Å; I254-F283 HydrophobicContact CD1-CD1 3.8Å; I254-F283 HydrophobicContact CD1-CE1 4.09Å; I254-F283 HydrophobicContact CD1-CG 4.11Å; I254-F330 HydrophobicContact CD1-CE2 4.46Å; I254-F330 HydrophobicContact CD1-CZ 4.3Å; I254-F330 HydrophobicContact CG1-CZ 3.94Å
255	A	96.5	Very high	96.6	Very high	80 Å²	80	58.4 Å²	58.4	66%	0.661	29%	0.292	S	S	*	.	H	α-helix	trans	-70.7	-38.3	179.6	0	0	0	0	0	112.5	K251 Q252 Q253	K251-A255 PolarHBondContact O-N 3.34Å; Q252-A255 PolarHBondContact O-N 3.23Å; Q253-A255 VanDerWaalsContact C-N 3.28Å; Q253-A255 PolarHBondContact O-N 3.13Å
256	R	97.2	Very high	96.8	Very high	198 Å²	198	55.4 Å²	55.4	75%	0.747	27%	0.271	S	S	*	.	H	α-helix	trans	-67.5	-42.3	178.7	-175.7	-172.4	-59.9	169.8	2.7	112.6	Q252 Q253	Q252-R256 WeakPolarHBondContact O-CB 3.28Å; Q252-R256 PolarHBondContact O-N 3.2Å; Q253-R256 PolarHBondContact O-N 3.32Å; Q253-R256 VanDerWaalsContact O-N 3.13Å
257	E	95.8	Very high	96.7	Very high	85 Å²	85	54.5 Å²	54.5	40%	0.397	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	10	-175.4	-62.8	-176.4	-125.7	0	0	112.6	Q253 I259 V332	Q253-E257 HydrophobicContact CG-CG 4.46Å; Q253-E257 WeakPolarHBondContact CG-OE1 3.48Å; Q253-E257 PolarHBondContact NE2-OE1 2.79Å; Q253-E257 PolarHBondContact O-N 3.12Å; E257-I259 VanDerWaalsContact C-N 3.34Å; E257-I259 HydrophobicContact CB-CD1 4.23Å; E257-I259 HydrophobicContact CB-CG1 4.03Å; E257-I259 PolarHBondContact O-N 3.4Å; E257-V332 WeakPolarHBondContact OE2-CG2 3.42Å
258	N	96.3	Very high	96.5	Very high	104 Å²	104	54.5 Å²	54.5	56%	0.556	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	45.6	173.4	-167.2	19.9	0	0	0	113.2	I254 Q338	I254-N258 PolarHBondContact O-N 3.15Å; I254-N258 VanDerWaalsContact O-N 3.12Å; N258-Q338 PolarHBondContact ND2-NE2 3.34Å; N258-Q338 VanDerWaalsContact ND2-NE2 3.12Å; N258-Q338 WeakPolarHBondContact O-CB 3.22Å; N258-Q338 WeakPolarHBondContact O-CG 3.23Å; N258-Q338 PolarHBondContact O-NE2 3.12Å
259	I	97.8	Very high	96	Very high	5 Å²	5	50.9 Å²	50.9	3%	0.026	25%	0.246	C	C	.	.			trans	-82.2	120.5	-174.2	-58	-177.8	0	0	0	110.2	I254 E257 F261 V262 V280 F330 V332 Q338	I254-I259 HydrophobicContact CB-CB 4.39Å; I254-I259 HydrophobicContact CG1-CB 4.18Å; I254-I259 HydrophobicContact CG1-CD1 4.12Å; I254-I259 HydrophobicContact CG1-CG2 4.38Å; I254-I259 HydrophobicContact CG2-CB 4.38Å; I254-I259 PolarHBondContact O-N 2.89Å; E257-I259 VanDerWaalsContact C-N 3.34Å; E257-I259 HydrophobicContact CB-CD1 4.23Å; E257-I259 HydrophobicContact CB-CG1 4.03Å; E257-I259 PolarHBondContact O-N 3.4Å; I259-F261 WeakPolarHBondContact CG2-O 3.1Å; I259-V262 HydrophobicContact CG2-CG2 4.39Å; I259-V280 WeakPolarHBondContact O-CG1 3.28Å; I259-F330 HydrophobicContact CD1-CE1 4.39Å; I259-F330 HydrophobicContact CD1-CZ 3.97Å; I259-V332 HydrophobicContact CD1-CB 4.28Å; I259-V332 HydrophobicContact CD1-CG1 3.84Å; I259-V332 HydrophobicContact CD1-CG2 3.49Å; I259-V332 VanDerWaalsContact CD1-CG2 3.49Å; I259-V332 HydrophobicContact CG1-CG1 4.31Å; I259-Q338 CarbonylContact C-O 3.54Å; I259-Q338 WeakPolarHBondContact CA-O 3.45Å; I259-Q338 WeakPolarHBondContact CG2-O 3.47Å
260	N	97.8	Very high	95.5	Very high	69 Å²	69	48 Å²	48	37%	0.369	23%	0.232	S	C	.	.			trans	-97.1	-21.7	178.9	-86.2	-43.9	0	0	0	113.6	V280 Q338	N260-V280 WeakPolarHBondContact O-CB 3.22Å; N260-V280 PolarHBondContact O-N 2.98Å; N260-Q338 HydrophobicContact CB-CB 4.15Å; N260-Q338 PolarHBondContact N-O 2.76Å; N260-Q338 VanDerWaalsContact ND2-CD 3.29Å; N260-Q338 PolarHBondContact ND2-NE2 3Å; N260-Q338 PolarHBondContact ND2-OE1 2.9Å
261	F	98.1	Very high	95	Very high	88 Å²	88	47.5 Å²	47.5	39%	0.386	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	149.1	-176.7	-60.9	-78.7	0	0	0	112.1	I259 T277 V278 P279 Q338 T339 G340	I259-F261 WeakPolarHBondContact CG2-O 3.1Å; F261-T277 HydrophobicContact CB-CG2 3.77Å; F261-T277 HydrophobicContact CD1-CG2 4.02Å; F261-T277 HydrophobicContact CG-CG2 4.15Å; F261-V278 WeakPolarHBondContact CA-O 3.46Å; F261-P279 HydrophobicContact CD1-CB 4.46Å; F261-P279 HydrophobicContact CD1-CG 4.43Å; F261-P279 HydrophobicContact CE1-CB 4.42Å; F261-P279 HydrophobicContact CE1-CG 4.27Å; F261-Q338 PolarHBondContact N-O 3.28Å; F261-Q338 VanDerWaalsContact N-O 3.16Å; F261-T339 HydrophobicContact CB-CG2 4.26Å; F261-T339 CarbonylContact O-C 3.51Å; F261-T339 WeakPolarHBondContact O-CA 3.26Å; F261-G340 PolarHBondContact O-N 3.45Å
262	V	98.4	Very high	94.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	125.7	171.1	-178.3	0	0	0	0	109.4	I254 I259 F264 V278 V280 F283 F330 G340 V342	I254-V262 HydrophobicContact CD1-CG2 4.39Å; I259-V262 HydrophobicContact CG2-CG2 4.39Å; V262-F264 HydrophobicContact CB-CE2 4.07Å; V262-F264 HydrophobicContact CG1-CD2 4.18Å; V262-F264 HydrophobicContact CG1-CE2 3.87Å; V262-V278 PolarHBondContact N-O 3.33Å; V262-V278 PolarHBondContact O-N 2.97Å; V262-V280 HydrophobicContact CG2-CG2 4.35Å; V262-F283 HydrophobicContact CB-CD2 4.19Å; V262-F283 HydrophobicContact CG1-CD2 4.11Å; V262-F283 HydrophobicContact CG1-CE2 4.19Å; V262-F283 HydrophobicContact CG2-CD2 3.94Å; V262-F283 HydrophobicContact CG2-CG 4.48Å; V262-F330 HydrophobicContact CG1-CE2 4.11Å; V262-F330 HydrophobicContact CG2-CE2 4.17Å; V262-G340 CarbonylContact C-O 3.59Å; V262-G340 WeakPolarHBondContact CA-O 3.48Å; V262-V342 HydrophobicContact CG1-CG1 4.21Å
263	R	98	Very high	94.3	Very high	37 Å²	37	42.7 Å²	42.7	14%	0.14	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	120.7	170.4	-58	-172.6	-169.5	177.9	2.4	109.7	E265 L333 T339 G340 R341 V342 E465	R263-E265 HydrophobicContact CB-CG 3.92Å; R263-E265 WeakPolarHBondContact CD-OE1 3.22Å; R263-E265 IonicContact NH1-OE1 2.68Å; R263-L333 HydrophobicContact CG-CD1 4.36Å; R263-T339 HydrophobicContact CG-CG2 3.89Å; R263-G340 PolarHBondContact N-O 2.97Å; R263-R341 CarbonylContact O-C 3.53Å; R263-R341 WeakPolarHBondContact O-CA 3.31Å; R263-V342 PolarHBondContact O-N 3.39Å; R263-E465 IonicContact CZ-OE1 3.8Å; R263-E465 IonicContact CZ-OE2 2.79Å; R263-E465 IonicContact NH1-OE1 3.28Å; R263-E465 PolarHBondContact NH1-OE1 3.02Å; R263-E465 IonicContact NH1-OE2 2.83Å; R263-E465 PolarHBondContact NH1-OE2 3.04Å; R263-E465 IonicContact NH2-OE1 2.92Å; R263-E465 PolarHBondContact NH2-OE1 3.05Å; R263-E465 IonicContact NH2-OE2 3.34Å; R263-E465 PolarHBondContact NH2-OE2 2.77Å
264	F	98.3	Very high	94.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	109	168.8	-72.5	-113	0	0	0	106.7	V262 S275 K276 V278 F283 K286 V291 P325 V342	V262-F264 HydrophobicContact CB-CE2 4.07Å; V262-F264 HydrophobicContact CG1-CD2 4.18Å; V262-F264 HydrophobicContact CG1-CE2 3.87Å; F264-S275 CarbonylContact O-C 3.51Å; F264-S275 WeakPolarHBondContact O-CA 3.26Å; F264-S275 WeakPolarHBondContact O-CB 3.49Å; F264-K276 PolarHBondContact N-O 2.69Å; F264-K276 PolarHBondContact O-N 3.03Å; F264-V278 HydrophobicContact CD2-CB 4.02Å; F264-V278 HydrophobicContact CD2-CG2 3.59Å; F264-V278 HydrophobicContact CE2-CB 3.78Å; F264-V278 HydrophobicContact CE2-CG1 4.33Å; F264-V278 HydrophobicContact CE2-CG2 3.73Å; F264-V278 HydrophobicContact CG-CG2 4.48Å; F264-F283 HydrophobicContact CE2-CD2 4.19Å; F264-F283 AromaticContact CZ-CD2 3.85Å; F264-F283 HydrophobicContact CZ-CD2 3.85Å; F264-F283 HydrophobicContact CZ-CE2 4.13Å; F264-K286 HydrophobicContact CE1-CB 3.91Å; F264-K286 HydrophobicContact CE2-CB 4.32Å; F264-K286 HydrophobicContact CZ-CB 3.62Å; F264-V291 HydrophobicContact CB-CG2 4.08Å; F264-V291 HydrophobicContact CD1-CB 4.43Å; F264-V291 HydrophobicContact CD1-CG2 3.48Å; F264-V291 VanDerWaalsContact CD1-CG2 3.48Å; F264-V291 HydrophobicContact CD2-CG2 3.99Å; F264-V291 HydrophobicContact CE1-CG2 3.8Å; F264-V291 HydrophobicContact CE2-CG2 4.32Å; F264-V291 HydrophobicContact CG-CB 4.49Å; F264-V291 HydrophobicContact CG-CG2 3.58Å; F264-V291 HydrophobicContact CZ-CG2 4.23Å; F264-P325 HydrophobicContact CD1-CB 4.12Å; F264-P325 HydrophobicContact CD1-CG 4.37Å; F264-P325 HydrophobicContact CE1-CB 3.99Å; F264-P325 HydrophobicContact CE1-CG 3.88Å; F264-V342 HydrophobicContact CD1-CG1 3.95Å; F264-V342 HydrophobicContact CD2-CG1 4.48Å; F264-V342 HydrophobicContact CE1-CG1 4.19Å; F264-V342 HydrophobicContact CG-CG1 4.11Å
265	E	97.3	Very high	94	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.009	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.7	-170.4	-52.8	-156.2	166.2	0	0	112.2	R263 S273 R341 V342 I343 C344	R263-E265 HydrophobicContact CB-CG 3.92Å; R263-E265 WeakPolarHBondContact CD-OE1 3.22Å; R263-E265 IonicContact NH1-OE1 2.68Å; E265-S273 VanDerWaalsContact CD-OG 3.3Å; E265-S273 PolarHBondContact OE2-OG 3.44Å; E265-R341 VanDerWaalsContact CD-NE 3.33Å; E265-R341 HydrophobicContact CG-CG 4.03Å; E265-R341 IonicContact OE1-NE 2.75Å; E265-R341 WeakPolarHBondContact OE2-CD 3.33Å; E265-R341 IonicContact OE2-CZ 3.93Å; E265-R341 IonicContact OE2-NE 3.13Å; E265-R341 PolarHBondContact OE2-NE 3.13Å; E265-R341 IonicContact OE2-NH2 2.7Å; E265-V342 PolarHBondContact N-O 3.5Å; E265-I343 CarbonylContact O-C 3.55Å; E265-I343 WeakPolarHBondContact O-CA 3.35Å; E265-C344 PolarHBondContact O-N 3.37Å
266	A	95.9	Very high	94	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	162.1	168.4	0	0	0	0	0	110.1	R274 L298 L323	A266-R274 PolarHBondContact N-O 3.4Å; A266-R274 PolarHBondContact O-N 3.36Å; A266-L298 HydrophobicContact CB-CD1 4.28Å; A266-L298 HydrophobicContact CB-CD2 3.95Å; A266-L323 HydrophobicContact CB-CD2 3.85Å
267	T	93.7	Very high	94	Very high	6 Å²	6	39.3 Å²	39.3	4%	0.037	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	137.6	175.2	-166.5	0	0	0	0	110.4	G271 P358 R359 Y591	T267-G271 WeakPolarHBondContact OG1-CA 3.39Å; T267-P358 HydrophobicContact CG2-CB 3.88Å; T267-P358 HydrophobicContact CG2-CG 3.96Å; T267-R359 HydrophobicContact CG2-CB 4.45Å; T267-Y591 HydrophobicContact CG2-CD2 3.7Å; T267-Y591 HydrophobicContact CG2-CE2 3.73Å
268	D	89.6	Confident	94.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.184	C	C	.	.			trans	-82.2	177.5	161.9	71.6	15.9	0	0	0	111.6	H270 G271 V272 R274 L298 N589	D268-H270 VanDerWaalsContact C-N 3.25Å; D268-H270 PolarHBondContact O-N 3.34Å; D268-H270 WeakPolarHBondContact OD1-CA 3.46Å; D268-H270 WeakPolarHBondContact OD1-CB 3.41Å; D268-H270 IonicContact OD1-CD2 3.18Å; D268-H270 PolarHBondContact OD1-N 3.49Å; D268-H270 IonicContact OD2-CD2 3.86Å; D268-G271 PolarHBondContact O-N 3.42Å; D268-G271 PolarHBondContact OD1-N 3.16Å; D268-V272 PolarHBondContact N-O 3.49Å; D268-V272 PolarHBondContact OD1-N 3.05Å; D268-V272 WeakPolarHBondContact OD2-CB 3.29Å; D268-R274 HydrophobicContact CB-CG 3.92Å; D268-R274 IonicContact OD2-CZ 2.76Å; D268-R274 IonicContact OD2-NE 2.77Å; D268-R274 PolarHBondContact OD2-NE 3.03Å; D268-R274 IonicContact OD2-NH2 3.75Å; D268-R274 PolarHBondContact OD2-NH2 3.4Å; D268-L298 WeakPolarHBondContact CA-O 3.47Å; D268-L298 WeakPolarHBondContact CB-O 3.36Å; D268-N589 PolarHBondContact O-ND2 2.95Å
269	L	85.5	Confident	94.1	Very high	6 Å²	6	32.5 Å²	32.5	3%	0.031	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-29.8	179.9	-62.3	170.4	0	0	0	113.5	G271 L298 T356 P358 N589 F652 Y655 M659	L269-G271 PolarHBondContact O-N 3.4Å; L269-L298 PolarHBondContact N-O 2.81Å; L269-T356 WeakPolarHBondContact CD2-O 3.37Å; L269-P358 HydrophobicContact CD2-CG 4.32Å; L269-N589 PolarHBondContact O-ND2 2.82Å; L269-F652 HydrophobicContact CD2-CD2 3.85Å; L269-F652 HydrophobicContact CD2-CE2 3.69Å; L269-Y655 HydrophobicContact CD1-CD1 3.3Å; L269-Y655 HydrophobicContact CD1-CE1 3.57Å; L269-Y655 HydrophobicContact CD1-CG 4.39Å; L269-M659 HydrophobicContact CB-CE 4.38Å; L269-M659 HydrophobicContact CB-SD 3.87Å; L269-M659 HydrophobicContact CD1-SD 3.92Å
270	H	85.4	Confident	94.1	Very high	59 Å²	59	34 Å²	34	27%	0.273	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-2.6	176.2	-44.4	-91.1	0	0	0	113	D268 V272 M659 E663	D268-H270 VanDerWaalsContact C-N 3.25Å; D268-H270 PolarHBondContact O-N 3.34Å; D268-H270 WeakPolarHBondContact OD1-CA 3.46Å; D268-H270 WeakPolarHBondContact OD1-CB 3.41Å; D268-H270 IonicContact OD1-CD2 3.18Å; D268-H270 PolarHBondContact OD1-N 3.49Å; D268-H270 IonicContact OD2-CD2 3.86Å; H270-V272 HydrophobicContact CB-CG2 4.25Å; H270-M659 PolarHBondContact CE1-SD 3.26Å; H270-E663 IonicContact CE1-OE1 3.68Å; H270-E663 PolarHBondContact CE1-OE1 2.98Å; H270-E663 VanDerWaalsContact CE1-OE1 3.31Å; H270-E663 IonicContact ND1-OE1 3.54Å
271	G	87.3	Confident	94.1	Very high	1 Å²	1	40 Å²	40	1%	0.01	20%	0.195	C	C	.	.	S	Bend	trans	79.8	17.7	-177.7	0	0	0	0	0	113.9	T267 D268 L269 R460 N589	T267-G271 WeakPolarHBondContact OG1-CA 3.39Å; D268-G271 PolarHBondContact O-N 3.42Å; D268-G271 PolarHBondContact OD1-N 3.16Å; L269-G271 PolarHBondContact O-N 3.4Å; G271-R460 PolarHBondContact O-NH1 2.93Å; G271-N589 VanDerWaalsContact CA-CG 3.45Å; G271-N589 WeakPolarHBondContact CA-ND2 3.3Å; G271-N589 PolarHBondContact N-ND2 3.21Å; G271-N589 VanDerWaalsContact N-ND2 3.2Å
272	V	87.9	Confident	94.1	Very high	57 Å²	57	39.7 Å²	39.7	35%	0.345	19%	0.194	S	C	.	.			trans	-86.9	141.9	176.8	-178.3	0	0	0	0	109.3	D268 H270	D268-V272 PolarHBondContact N-O 3.49Å; D268-V272 PolarHBondContact OD1-N 3.05Å; D268-V272 WeakPolarHBondContact OD2-CB 3.29Å; H270-V272 HydrophobicContact CB-CG2 4.25Å
273	S	90.1	Very high	94	Very high	21 Å²	21	39.9 Å²	39.9	15%	0.147	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	129.5	174.9	-174.2	0	0	0	0	111	E265	E265-S273 VanDerWaalsContact CD-OG 3.3Å; E265-S273 PolarHBondContact OE2-OG 3.44Å
274	R	93.3	Very high	93.9	Very high	82 Å²	82	42.2 Å²	42.2	31%	0.309	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	122.8	177.5	-58.3	-66.7	175.2	175.6	-3	107.4	A266 D268 Y297 L298	A266-R274 PolarHBondContact N-O 3.4Å; A266-R274 PolarHBondContact O-N 3.36Å; D268-R274 HydrophobicContact CB-CG 3.92Å; D268-R274 IonicContact OD2-CZ 2.76Å; D268-R274 IonicContact OD2-NE 2.77Å; D268-R274 PolarHBondContact OD2-NE 3.03Å; D268-R274 IonicContact OD2-NH2 3.75Å; D268-R274 PolarHBondContact OD2-NH2 3.4Å; R274-Y297 WeakPolarHBondContact CD-O 3.46Å; R274-Y297 WeakPolarHBondContact CG-O 3.12Å; R274-L298 HydrophobicContact CB-CD2 3.69Å; R274-L298 HydrophobicContact CG-CD2 4.06Å
275	S	94	Very high	93.8	Very high	51 Å²	51	46 Å²	46	36%	0.357	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	156	-166.1	66.4	0	0	0	0	114.8	F264	F264-S275 CarbonylContact O-C 3.51Å; F264-S275 WeakPolarHBondContact O-CA 3.26Å; F264-S275 WeakPolarHBondContact O-CB 3.49Å
276	K	96.1	Very high	93.8	Very high	72 Å²	72	48.1 Å²	48.1	31%	0.313	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	124.6	165.4	-88.1	178.6	176.4	-176.2	0	109.6	F264 V291 P292 M293	F264-K276 PolarHBondContact N-O 2.69Å; F264-K276 PolarHBondContact O-N 3.03Å; K276-V291 HydrophobicContact CB-CG1 3.89Å; K276-V291 HydrophobicContact CD-CG1 3.82Å; K276-V291 HydrophobicContact CG-CG1 4.47Å; K276-P292 VanDerWaalsContact CD-O 3.31Å; K276-P292 WeakPolarHBondContact CD-O 3.25Å; K276-P292 WeakPolarHBondContact CE-O 3.31Å; K276-P292 PolarHBondContact NZ-O 2.99Å; K276-M293 HydrophobicContact CB-CE 4.36Å; K276-M293 HydrophobicContact CD-CE 4.15Å; K276-M293 HydrophobicContact CD-SD 3.88Å; K276-M293 VanDerWaalsContact CE-SD 3.52Å; K276-M293 HydrophobicContact CG-CE 3.76Å; K276-M293 HydrophobicContact CG-SD 4.04Å
277	T	96.8	Very high	93.8	Very high	80 Å²	80	48.3 Å²	48.3	49%	0.491	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	119.9	177.1	-53.6	0	0	0	0	109.9	F261	F261-T277 HydrophobicContact CB-CG2 3.77Å; F261-T277 HydrophobicContact CD1-CG2 4.02Å; F261-T277 HydrophobicContact CG-CG2 4.15Å
278	V	97.8	Very high	93.8	Very high	12 Å²	12	51.1 Å²	51.1	7%	0.073	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	127.2	-176.4	177.6	0	0	0	0	109.5	F261 V262 F264 V280 F282 K286 V291	F261-V278 WeakPolarHBondContact CA-O 3.46Å; V262-V278 PolarHBondContact N-O 3.33Å; V262-V278 PolarHBondContact O-N 2.97Å; F264-V278 HydrophobicContact CD2-CB 4.02Å; F264-V278 HydrophobicContact CD2-CG2 3.59Å; F264-V278 HydrophobicContact CE2-CB 3.78Å; F264-V278 HydrophobicContact CE2-CG1 4.33Å; F264-V278 HydrophobicContact CE2-CG2 3.73Å; F264-V278 HydrophobicContact CG-CG2 4.48Å; V278-V280 PolarHBondContact O-N 3.36Å; V278-F282 HydrophobicContact CG1-CB 3.81Å; V278-K286 HydrophobicContact CG1-CG 3.96Å; V278-K286 HydrophobicContact CG2-CG 4.46Å; V278-V291 HydrophobicContact CG2-CG2 3.94Å
279	P	98.2	Very high	94	Very high	34 Å²	34	58.6 Å²	58.6	22%	0.221	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	133.4	171.1	-22.3	32.9	0	0	0	111.3	F261 R281 F282	F261-P279 HydrophobicContact CD1-CB 4.46Å; F261-P279 HydrophobicContact CD1-CG 4.43Å; F261-P279 HydrophobicContact CE1-CB 4.42Å; F261-P279 HydrophobicContact CE1-CG 4.27Å; P279-R281 HydrophobicContact CB-CG 4.37Å; P279-R281 PolarHBondContact O-N 3.43Å; P279-F282 HydrophobicContact CB-CD2 4.16Å; P279-F282 HydrophobicContact CB-CE2 4.45Å; P279-F282 HydrophobicContact CG-CD2 4.35Å; P279-F282 HydrophobicContact CG-CE2 4.48Å; P279-F282 PolarHBondContact O-N 3.5Å
280	V	97.2	Very high	94.5	Very high	37 Å²	37	58.4 Å²	58.4	22%	0.224	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-58.9	-26.4	-163.4	78	0	0	0	0	115.1	I254 I259 N260 V262 V278 F282 F283	I254-V280 HydrophobicContact CB-CG2 4.43Å; I254-V280 HydrophobicContact CD1-CG2 3.8Å; I254-V280 HydrophobicContact CG1-CG2 4.16Å; I254-V280 HydrophobicContact CG2-CG2 3.45Å; I254-V280 VanDerWaalsContact CG2-CG2 3.45Å; I259-V280 WeakPolarHBondContact O-CG1 3.28Å; N260-V280 WeakPolarHBondContact O-CB 3.22Å; N260-V280 PolarHBondContact O-N 2.98Å; V262-V280 HydrophobicContact CG2-CG2 4.35Å; V278-V280 PolarHBondContact O-N 3.36Å; V280-F282 PolarHBondContact O-N 3.24Å; V280-F282 VanDerWaalsContact O-N 3.09Å; V280-F283 HydrophobicContact CG2-CB 4.27Å; V280-F283 WeakPolarHBondContact O-CB 3.42Å; V280-F283 PolarHBondContact O-N 3.08Å
281	R	97.1	Very high	95	Very high	194 Å²	194	56 Å²	56	73%	0.732	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-56	-22.5	172.6	63.1	-179.2	175.1	-91.7	1.1	114.4	P279	P279-R281 HydrophobicContact CB-CG 4.37Å; P279-R281 PolarHBondContact O-N 3.43Å
282	F	97.6	Very high	95.4	Very high	83 Å²	83	58.4 Å²	58.4	36%	0.364	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-100.1	-2	175.3	-55.2	-67.3	0	0	0	113.2	V278 P279 V280 H284 E285 K286	V278-F282 HydrophobicContact CG1-CB 3.81Å; P279-F282 HydrophobicContact CB-CD2 4.16Å; P279-F282 HydrophobicContact CB-CE2 4.45Å; P279-F282 HydrophobicContact CG-CD2 4.35Å; P279-F282 HydrophobicContact CG-CE2 4.48Å; P279-F282 PolarHBondContact O-N 3.5Å; V280-F282 PolarHBondContact O-N 3.24Å; V280-F282 VanDerWaalsContact O-N 3.09Å; F282-H284 VanDerWaalsContact C-N 3.32Å; F282-H284 PolarHBondContact O-N 3.45Å; F282-E285 WeakPolarHBondContact O-CB 3.33Å; F282-E285 PolarHBondContact O-N 3.49Å; F282-E285 VanDerWaalsContact O-N 3.16Å; F282-K286 HydrophobicContact CB-CG 4.42Å; F282-K286 WeakPolarHBondContact O-CG 3.26Å; F282-K286 PolarHBondContact O-N 3.24Å
283	F	96.8	Very high	95.5	Very high	4 Å²	4	55.8 Å²	55.8	2%	0.018	27%	0.267	C	S	.	.	H	α-helix	trans	-56.2	-44	-174.8	173.8	-103.7	0	0	0	112.4	I250 I254 V262 F264 V280 E285 K286 A287 L327	I250-F283 HydrophobicContact CB-CE1 4.31Å; I250-F283 HydrophobicContact CB-CZ 4.42Å; I250-F283 HydrophobicContact CG2-CE1 3.57Å; I250-F283 HydrophobicContact CG2-CE2 4.47Å; I250-F283 HydrophobicContact CG2-CZ 3.53Å; I254-F283 HydrophobicContact CD1-CD1 3.8Å; I254-F283 HydrophobicContact CD1-CE1 4.09Å; I254-F283 HydrophobicContact CD1-CG 4.11Å; V262-F283 HydrophobicContact CB-CD2 4.19Å; V262-F283 HydrophobicContact CG1-CD2 4.11Å; V262-F283 HydrophobicContact CG1-CE2 4.19Å; V262-F283 HydrophobicContact CG2-CD2 3.94Å; V262-F283 HydrophobicContact CG2-CG 4.48Å; F264-F283 HydrophobicContact CE2-CD2 4.19Å; F264-F283 AromaticContact CZ-CD2 3.85Å; F264-F283 HydrophobicContact CZ-CD2 3.85Å; F264-F283 HydrophobicContact CZ-CE2 4.13Å; V280-F283 HydrophobicContact CG2-CB 4.27Å; V280-F283 WeakPolarHBondContact O-CB 3.42Å; V280-F283 PolarHBondContact O-N 3.08Å; F283-E285 PolarHBondContact O-N 2.92Å; F283-K286 CarbonylContact O-C 3.45Å; F283-K286 PolarHBondContact O-N 3.31Å; F283-A287 HydrophobicContact CE1-CB 4.48Å; F283-A287 HydrophobicContact CZ-CB 4.36Å; F283-A287 WeakPolarHBondContact O-CB 3.49Å; F283-A287 PolarHBondContact O-N 3.46Å; F283-L327 HydrophobicContact CZ-CD2 4.21Å
284	H	95.9	Very high	95.4	Very high	86 Å²	86	56.5 Å²	56.5	40%	0.398	27%	0.271	S	S	.	.	H	α-helix	trans	-61.7	-40.9	179.3	179.2	51	0	0	0	113	M247 K251 F282 I288	M247-H284 PolarHBondContact SD-ND1 2.7Å; K251-H284 PolarHBondContact NZ-ND1 3.48Å; F282-H284 VanDerWaalsContact C-N 3.32Å; F282-H284 PolarHBondContact O-N 3.45Å; H284-I288 WeakPolarHBondContact O-CG1 3.3Å; H284-I288 PolarHBondContact O-N 3Å
285	E	96.4	Very high	95.1	Very high	79 Å²	79	53.8 Å²	53.8	37%	0.369	26%	0.261	S	S	.	.	H	α-helix	trans	-65.1	-48.5	175.4	-175.7	-158.4	133.1	0	0	110.7	F282 F283 A287 I288 Y289	F282-E285 WeakPolarHBondContact O-CB 3.33Å; F282-E285 PolarHBondContact O-N 3.49Å; F282-E285 VanDerWaalsContact O-N 3.16Å; F283-E285 PolarHBondContact O-N 2.92Å; E285-A287 VanDerWaalsContact C-N 3.3Å; E285-A287 PolarHBondContact O-N 2.83Å; E285-I288 PolarHBondContact O-N 3.06Å; E285-I288 VanDerWaalsContact O-N 3.17Å; E285-Y289 HydrophobicContact CG-CD2 3.92Å; E285-Y289 HydrophobicContact CG-CE2 4.41Å; E285-Y289 VanDerWaalsContact O-CD2 3.31Å; E285-Y289 WeakPolarHBondContact O-CD2 3.32Å; E285-Y289 PolarHBondContact O-N 3.2Å
286	K	96.8	Very high	94.4	Very high	47 Å²	47	53.7 Å²	53.7	20%	0.204	26%	0.261	C	S	.	.	H	α-helix	trans	-73.8	-19	-178.4	-58.5	-45.3	-179.6	-167.1	0	113.6	F264 V278 F282 F283 G290 V291	F264-K286 HydrophobicContact CE1-CB 3.91Å; F264-K286 HydrophobicContact CE2-CB 4.32Å; F264-K286 HydrophobicContact CZ-CB 3.62Å; V278-K286 HydrophobicContact CG1-CG 3.96Å; V278-K286 HydrophobicContact CG2-CG 4.46Å; F282-K286 HydrophobicContact CB-CG 4.42Å; F282-K286 WeakPolarHBondContact O-CG 3.26Å; F282-K286 PolarHBondContact O-N 3.24Å; F283-K286 CarbonylContact O-C 3.45Å; F283-K286 PolarHBondContact O-N 3.31Å; K286-G290 WeakPolarHBondContact CD-O 3.28Å; K286-G290 CarbonylContact O-C 3.45Å; K286-G290 WeakPolarHBondContact O-CA 3.27Å; K286-G290 PolarHBondContact O-N 2.86Å; K286-G290 VanDerWaalsContact O-N 3.09Å; K286-V291 HydrophobicContact CB-CG2 3.73Å; K286-V291 HydrophobicContact CD-CG2 4.27Å; K286-V291 HydrophobicContact CG-CG2 3.98Å
287	A	95.5	Very high	93.8	Very high	3 Å²	3	56.2 Å²	56.2	3%	0.025	27%	0.269	C	S	.	.	H	α-helix	trans	-69.9	-32.9	168.8	0	0	0	0	0	112.5	F243 M247 F283 E285 L327	F243-A287 WeakPolarHBondContact CZ-O 3.41Å; M247-A287 HydrophobicContact SD-CB 4.27Å; F283-A287 HydrophobicContact CE1-CB 4.48Å; F283-A287 HydrophobicContact CZ-CB 4.36Å; F283-A287 WeakPolarHBondContact O-CB 3.49Å; F283-A287 PolarHBondContact O-N 3.46Å; E285-A287 VanDerWaalsContact C-N 3.3Å; E285-A287 PolarHBondContact O-N 2.83Å; A287-L327 HydrophobicContact CB-CD2 4.45Å
288	I	94.1	Very high	93.2	Very high	65 Å²	65	52.7 Å²	52.7	33%	0.333	25%	0.247	S	C	.	.	H	α-helix	trans	-90.4	-45.9	-177.7	-65.5	169.2	0	0	0	111.5	F243 M247 H284 E285	F243-I288 HydrophobicContact CE1-CG1 4.12Å; F243-I288 HydrophobicContact CZ-CG1 4.17Å; M247-I288 HydrophobicContact SD-CG1 4.43Å; H284-I288 WeakPolarHBondContact O-CG1 3.3Å; H284-I288 PolarHBondContact O-N 3Å; E285-I288 PolarHBondContact O-N 3.06Å; E285-I288 VanDerWaalsContact O-N 3.17Å
289	Y	94.3	Very high	92.2	Very high	157 Å²	157	52.3 Å²	52.3	62%	0.616	25%	0.245	S	C	*	.	H	α-helix	trans	-102.1	-1.9	-172.9	-56	-68.4	0	0	0	114.2	E285	E285-Y289 HydrophobicContact CG-CD2 3.92Å; E285-Y289 HydrophobicContact CG-CE2 4.41Å; E285-Y289 VanDerWaalsContact O-CD2 3.31Å; E285-Y289 WeakPolarHBondContact O-CD2 3.32Å; E285-Y289 PolarHBondContact O-N 3.2Å
290	G	95.4	Very high	90.7	Very high	3 Å²	3	53 Å²	53	3%	0.031	25%	0.246	C	C	.	.			trans	71.9	-177.8	-174.4	0	0	0	0	0	114.2	K286 L323	K286-G290 WeakPolarHBondContact CD-O 3.28Å; K286-G290 CarbonylContact O-C 3.45Å; K286-G290 WeakPolarHBondContact O-CA 3.27Å; K286-G290 PolarHBondContact O-N 2.86Å; K286-G290 VanDerWaalsContact O-N 3.09Å; G290-L323 CarbonylContact C-O 3.6Å; G290-L323 WeakPolarHBondContact CA-O 3.48Å
291	V	96.9	Very high	88.9	Confident	8 Å²	8	53.2 Å²	53.2	5%	0.048	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	121.1	176.1	-179.7	0	0	0	0	110.1	F264 K276 V278 K286 L323	F264-V291 HydrophobicContact CB-CG2 4.08Å; F264-V291 HydrophobicContact CD1-CB 4.43Å; F264-V291 HydrophobicContact CD1-CG2 3.48Å; F264-V291 VanDerWaalsContact CD1-CG2 3.48Å; F264-V291 HydrophobicContact CD2-CG2 3.99Å; F264-V291 HydrophobicContact CE1-CG2 3.8Å; F264-V291 HydrophobicContact CE2-CG2 4.32Å; F264-V291 HydrophobicContact CG-CB 4.49Å; F264-V291 HydrophobicContact CG-CG2 3.58Å; F264-V291 HydrophobicContact CZ-CG2 4.23Å; K276-V291 HydrophobicContact CB-CG1 3.89Å; K276-V291 HydrophobicContact CD-CG1 3.82Å; K276-V291 HydrophobicContact CG-CG1 4.47Å; V278-V291 HydrophobicContact CG2-CG2 3.94Å; K286-V291 HydrophobicContact CB-CG2 3.73Å; K286-V291 HydrophobicContact CD-CG2 4.27Å; K286-V291 HydrophobicContact CG-CG2 3.98Å; V291-L323 HydrophobicContact CB-CB 4.36Å; V291-L323 PolarHBondContact N-O 3.03Å; V291-L323 WeakPolarHBondContact O-CB 3.36Å; V291-L323 PolarHBondContact O-N 3.39Å
292	P	94.8	Very high	86.7	Confident	51 Å²	51	50 Å²	50	33%	0.331	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	139.8	176	27.5	-34	0	0	0	111.4	K276 V321 L322	K276-P292 VanDerWaalsContact CD-O 3.31Å; K276-P292 WeakPolarHBondContact CD-O 3.25Å; K276-P292 WeakPolarHBondContact CE-O 3.31Å; K276-P292 PolarHBondContact NZ-O 2.99Å; P292-V321 CarbonylContact C-O 3.48Å; P292-V321 WeakPolarHBondContact CA-O 3.45Å; P292-L322 HydrophobicContact CB-CD2 4.12Å
293	M	91	Very high	84.2	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	135.7	-176.5	-178.7	71.6	99	0	0	109.2	K276 R295 Y297 D320 V321 L323	K276-M293 HydrophobicContact CB-CE 4.36Å; K276-M293 HydrophobicContact CD-CE 4.15Å; K276-M293 HydrophobicContact CD-SD 3.88Å; K276-M293 VanDerWaalsContact CE-SD 3.52Å; K276-M293 HydrophobicContact CG-CE 3.76Å; K276-M293 HydrophobicContact CG-SD 4.04Å; M293-R295 PolarHBondContact O-N 3.31Å; M293-Y297 HydrophobicContact SD-CD2 3.54Å; M293-Y297 VanDerWaalsContact SD-CD2 3.54Å; M293-Y297 HydrophobicContact SD-CE2 4.25Å; M293-Y297 HydrophobicContact SD-CG 4.29Å; M293-D320 CarbonylContact O-C 3.58Å; M293-D320 WeakPolarHBondContact O-CA 3.42Å; M293-V321 HydrophobicContact CB-CG2 4.33Å; M293-V321 PolarHBondContact N-O 2.87Å; M293-V321 VanDerWaalsContact O-CG2 3.26Å; M293-V321 WeakPolarHBondContact O-CG2 3.33Å; M293-V321 PolarHBondContact O-N 3.13Å; M293-L323 HydrophobicContact CB-CD1 4.2Å; M293-L323 HydrophobicContact CB-CD2 4.27Å; M293-L323 HydrophobicContact CB-CG 3.98Å; M293-L323 HydrophobicContact CE-CD1 3.91Å; M293-L323 HydrophobicContact CG-CD1 4.46Å
294	P	88.1	Confident	81.5	Confident	36 Å²	36	52.8 Å²	52.8	23%	0.234	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	132.1	175.8	-25.4	35.3	0	0	0	111.4	S296 Y297 D320	P294-S296 PolarHBondContact O-N 2.95Å; P294-Y297 HydrophobicContact CB-CD1 3.99Å; P294-Y297 HydrophobicContact CB-CE1 4.16Å; P294-Y297 HydrophobicContact CB-CG 4.37Å; P294-Y297 HydrophobicContact CG-CD1 4.35Å; P294-Y297 HydrophobicContact CG-CE1 4.15Å; P294-Y297 HydrophobicContact CG-CE2 4.43Å; P294-Y297 WeakPolarHBondContact O-CB 3.31Å; P294-Y297 PolarHBondContact O-N 3.33Å; P294-D320 WeakPolarHBondContact CA-OD1 3.17Å; P294-D320 VanDerWaalsContact N-OD1 3.11Å
295	R	85.6	Confident	79	Confident	26 Å²	26	58.2 Å²	58.2	10%	0.098	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-53.7	-40.6	-178.4	-174.6	174.8	176.1	-162.3	-9.1	112.1	M293 Y297 L298 E299 A315 S319 V321	M293-R295 PolarHBondContact O-N 3.31Å; R295-Y297 PolarHBondContact O-N 3.12Å; R295-L298 PolarHBondContact O-N 2.88Å; R295-E299 WeakPolarHBondContact CG-OE2 3.45Å; R295-E299 IonicContact CZ-OE1 2.89Å; R295-E299 IonicContact CZ-OE2 3.05Å; R295-E299 IonicContact NE-OE1 3.43Å; R295-E299 PolarHBondContact NE-OE1 3.12Å; R295-E299 IonicContact NE-OE2 3.17Å; R295-E299 PolarHBondContact NE-OE2 2.95Å; R295-E299 IonicContact NH2-OE1 2.65Å; R295-E299 PolarHBondContact NH2-OE1 3.15Å; R295-E299 IonicContact NH2-OE2 3.63Å; R295-E299 PolarHBondContact NH2-OE2 3.01Å; R295-E299 PolarHBondContact O-N 2.83Å; R295-E299 VanDerWaalsContact O-N 3.07Å; R295-A315 PolarHBondContact NH1-O 2.73Å; R295-S319 VanDerWaalsContact CB-O 3.23Å; R295-S319 WeakPolarHBondContact CB-O 3.45Å; R295-S319 PolarHBondContact N-O 3.14Å; R295-V321 HydrophobicContact CB-CG1 4.05Å; R295-V321 HydrophobicContact CG-CG1 4.06Å
296	S	80.6	Confident	76.4	Confident	49 Å²	49	57 Å²	57	34%	0.343	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-60.3	-12.3	177.5	57.8	0	0	0	0	115.9	P294 E299 L300	P294-S296 PolarHBondContact O-N 2.95Å; S296-E299 WeakPolarHBondContact CA-O 3.2Å; S296-L300 VanDerWaalsContact O-CD2 3.24Å; S296-L300 WeakPolarHBondContact O-CD2 3.49Å; S296-L300 WeakPolarHBondContact O-CG 3.2Å
297	Y	83.3	Confident	73.8	Confident	125 Å²	125	60.5 Å²	60.5	49%	0.49	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-81.3	-21.7	175	-75.1	20.4	0	0	0	112.5	R274 M293 P294 R295	R274-Y297 WeakPolarHBondContact CD-O 3.46Å; R274-Y297 WeakPolarHBondContact CG-O 3.12Å; M293-Y297 HydrophobicContact SD-CD2 3.54Å; M293-Y297 VanDerWaalsContact SD-CD2 3.54Å; M293-Y297 HydrophobicContact SD-CE2 4.25Å; M293-Y297 HydrophobicContact SD-CG 4.29Å; P294-Y297 HydrophobicContact CB-CD1 3.99Å; P294-Y297 HydrophobicContact CB-CE1 4.16Å; P294-Y297 HydrophobicContact CB-CG 4.37Å; P294-Y297 HydrophobicContact CG-CD1 4.35Å; P294-Y297 HydrophobicContact CG-CE1 4.15Å; P294-Y297 HydrophobicContact CG-CE2 4.43Å; P294-Y297 WeakPolarHBondContact O-CB 3.31Å; P294-Y297 PolarHBondContact O-N 3.33Å; R295-Y297 PolarHBondContact O-N 3.12Å
298	L	83	Confident	71.3	Confident	6 Å²	6	68.9 Å²	68.9	3%	0.031	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-30.1	174.6	-52.4	-176.3	0	0	0	111.7	A266 D268 L269 R274 R295 V321 L323 P346 L354	A266-L298 HydrophobicContact CB-CD1 4.28Å; A266-L298 HydrophobicContact CB-CD2 3.95Å; D268-L298 WeakPolarHBondContact CA-O 3.47Å; D268-L298 WeakPolarHBondContact CB-O 3.36Å; L269-L298 PolarHBondContact N-O 2.81Å; R274-L298 HydrophobicContact CB-CD2 3.69Å; R274-L298 HydrophobicContact CG-CD2 4.06Å; R295-L298 PolarHBondContact O-N 2.88Å; L298-V321 HydrophobicContact CD1-CG2 4.13Å; L298-L323 HydrophobicContact CD1-CD2 4.11Å; L298-P346 HydrophobicContact CD1-CB 3.66Å; L298-P346 HydrophobicContact CD1-CG 3.88Å; L298-L354 HydrophobicContact CD1-CD2 4.34Å
299	E	77.4	Confident	69.1	Low	3 Å²	3	67.7 Å²	67.7	1%	0.014	35%	0.35	C	S	.	.	S	Bend	trans	-112	84.4	179.5	-69.6	-178.4	-178.5	0	0	109.6	R295 S296 T301 F317 T356 Y655	R295-E299 WeakPolarHBondContact CG-OE2 3.45Å; R295-E299 IonicContact CZ-OE1 2.89Å; R295-E299 IonicContact CZ-OE2 3.05Å; R295-E299 IonicContact NE-OE1 3.43Å; R295-E299 PolarHBondContact NE-OE1 3.12Å; R295-E299 IonicContact NE-OE2 3.17Å; R295-E299 PolarHBondContact NE-OE2 2.95Å; R295-E299 IonicContact NH2-OE1 2.65Å; R295-E299 PolarHBondContact NH2-OE1 3.15Å; R295-E299 IonicContact NH2-OE2 3.63Å; R295-E299 PolarHBondContact NH2-OE2 3.01Å; R295-E299 PolarHBondContact O-N 2.83Å; R295-E299 VanDerWaalsContact O-N 3.07Å; S296-E299 WeakPolarHBondContact CA-O 3.2Å; E299-T301 PolarHBondContact O-N 2.84Å; E299-T301 VanDerWaalsContact O-N 3.13Å; E299-F317 WeakPolarHBondContact OE2-CE1 3.38Å; E299-T356 WeakPolarHBondContact OE1-CB 3.48Å; E299-T356 WeakPolarHBondContact OE1-CG2 3.24Å; E299-T356 PolarHBondContact OE1-OG1 3.29Å; E299-Y655 HydrophobicContact CB-CE1 3.9Å; E299-Y655 HydrophobicContact CB-CE2 4.32Å; E299-Y655 WeakPolarHBondContact CB-OH 3.39Å; E299-Y655 HydrophobicContact CG-CE1 4.45Å; E299-Y655 PolarHBondContact O-OH 3.42Å
300	L	67	Low	66.6	Low	50 Å²	50	63.3 Å²	63.3	26%	0.262	34%	0.337	S	S	.	.			trans	-88.1	61.4	-172	-76.5	160.6	0	0	0	113.2	S296	S296-L300 VanDerWaalsContact O-CD2 3.24Å; S296-L300 WeakPolarHBondContact O-CD2 3.49Å; S296-L300 WeakPolarHBondContact O-CG 3.2Å
301	T	59	Low	64	Low	41 Å²	41	71.7 Å²	71.7	25%	0.252	38%	0.375	S	S	.	.			trans	-80.3	120.9	162.5	-68.5	0	0	0	0	109.9	E299 Y655	E299-T301 PolarHBondContact O-N 2.84Å; E299-T301 VanDerWaalsContact O-N 3.13Å; T301-Y655 WeakPolarHBondContact CB-OH 3.17Å; T301-Y655 PolarHBondContact N-OH 3.31Å; T301-Y655 VanDerWaalsContact N-OH 3.14Å; T301-Y655 WeakPolarHBondContact OG1-CE1 3.22Å; T301-Y655 PolarHBondContact OG1-OH 3.02Å
302	L	51.4	Low	61.2	Low	126 Å²	126	76.7 Å²	76.7	66%	0.66	42%	0.417	S	S	*	.			trans	-91	-2.8	-178.3	-68.4	169	0	0	0	113.6	P304 F662	L302-P304 VanDerWaalsContact O-CD 3.29Å; L302-P304 WeakPolarHBondContact O-CD 3.4Å; L302-F662 HydrophobicContact CB-CD1 4.07Å; L302-F662 HydrophobicContact CB-CE1 3.43Å; L302-F662 VanDerWaalsContact CB-CE1 3.43Å; L302-F662 HydrophobicContact CB-CE2 4.45Å; L302-F662 HydrophobicContact CB-CZ 3.64Å; L302-F662 HydrophobicContact CD1-CE1 3.98Å; L302-F662 HydrophobicContact CG-CE1 4.31Å
303	S	44.5	Very low	58.8	Low	29 Å²	29	81.9 Å²	81.9	20%	0.203	44%	0.442	C	S	.	.			trans	-75.1	119.5	177.3	173.1	0	0	0	0	112.1	K305 S306	S303-K305 PolarHBondContact O-N 3.16Å; S303-K305 PolarHBondContact OG-N 2.82Å; S303-K305 VanDerWaalsContact OG-N 3.16Å; S303-S306 WeakPolarHBondContact CB-OG 3.37Å; S303-S306 PolarHBondContact OG-N 2.82Å; S303-S306 PolarHBondContact OG-OG 3.39Å
304	P	39.8	Very low	56.7	Low	116 Å²	116	84.4 Å²	84.4	75%	0.753	46%	0.458	S	S	*	.	S	Bend	trans	-81.9	-1.1	168.5	-7.7	27.4	0	0	0	112.9	L302	L302-P304 VanDerWaalsContact O-CD 3.29Å; L302-P304 WeakPolarHBondContact O-CD 3.4Å
305	K	44.3	Very low	54.5	Low	200 Å²	200	85.6 Å²	85.6	87%	0.87	47%	0.471	S	S	*	.	S	Bend	trans	-104.7	-11.6	-167.9	-68.3	-179.1	178	175.4	0	114.1	S303	S303-K305 PolarHBondContact O-N 3.16Å; S303-K305 PolarHBondContact OG-N 2.82Å; S303-K305 VanDerWaalsContact OG-N 3.16Å
306	S	42	Very low	53	Low	54 Å²	54	87.5 Å²	87.5	38%	0.378	49%	0.488	S	S	.	.			trans	-123.2	67.9	-175.2	55.9	0	0	0	0	111	S303 E308	S303-S306 WeakPolarHBondContact CB-OG 3.37Å; S303-S306 PolarHBondContact OG-N 2.82Å; S303-S306 PolarHBondContact OG-OG 3.39Å; S306-E308 PolarHBondContact O-N 3.15Å
307	N	42.8	Very low	51.7	Low	121 Å²	121	87 Å²	87	65%	0.647	48%	0.48	S	S	*	.			trans	-73.8	-5.9	179.4	-102.1	-12.8	0	0	0	114.2
308	E	43.3	Very low	50.6	Low	178 Å²	178	86.2 Å²	86.2	83%	0.832	49%	0.493	S	S	*	.			trans	-124.3	67.4	-168.1	-64	-174.3	179.7	0	0	112.1	S306	S306-E308 PolarHBondContact O-N 3.15Å
309	V	47	Very low	50.2	Low	41 Å²	41	87.2 Å²	87.2	25%	0.248	50%	0.5	C	S	.	.	S	Bend	trans	-111.2	64.3	157.6	-173.2	0	0	0	0	108.2	Q654	V309-Q654 HydrophobicContact CG1-CB 3.76Å
310	D	41.3	Very low	50.7	Low	64 Å²	64	90.4 Å²	90.4	34%	0.342	52%	0.517	S	S	.	.	S	Bend	trans	177.1	141.3	159.7	-101.8	-33.1	0	0	0	108.2	A312 T314	D310-A312 PolarHBondContact O-N 2.94Å; D310-T314 HydrophobicContact CB-CG2 3.47Å; D310-T314 VanDerWaalsContact CB-CG2 3.47Å; D310-T314 VanDerWaalsContact CB-OG1 3.22Å; D310-T314 WeakPolarHBondContact CB-OG1 3.35Å; D310-T314 PolarHBondContact O-OG1 2.87Å; D310-T314 VanDerWaalsContact O-OG1 3.08Å
311	H	40.5	Very low	51.9	Low	180 Å²	180	88.1 Å²	88.1	83%	0.833	51%	0.505	S	S	*	.			trans	-75.9	124	-175	-63.9	-31.9	0	0	0	114.3	N313	H311-N313 PolarHBondContact O-N 3.01Å
312	A	39.5	Very low	53.7	Low	113 Å²	113	88.2 Å²	88.2	93%	0.934	50%	0.504	S	S	*	.	S	Bend	trans	55.4	-4	148.5	0	0	0	0	0	120.6	D310	D310-A312 PolarHBondContact O-N 2.94Å
313	N	43.9	Very low	55.9	Low	159 Å²	159	82.2 Å²	82.2	85%	0.85	47%	0.473	S	S	*	.	S	Bend	trans	-145.1	21.8	-175.9	-160	21.6	0	0	0	112.2	H311	H311-N313 PolarHBondContact O-N 3.01Å
314	T	45.9	Very low	58.4	Low	55 Å²	55	84 Å²	84	34%	0.337	48%	0.479	S	S	.	.			trans	-82.3	124.5	-164.5	-39	0	0	0	0	111.8	D310 S316	D310-T314 HydrophobicContact CB-CG2 3.47Å; D310-T314 VanDerWaalsContact CB-CG2 3.47Å; D310-T314 VanDerWaalsContact CB-OG1 3.22Å; D310-T314 WeakPolarHBondContact CB-OG1 3.35Å; D310-T314 PolarHBondContact O-OG1 2.87Å; D310-T314 VanDerWaalsContact O-OG1 3.08Å; T314-S316 PolarHBondContact O-N 2.93Å; T314-S316 VanDerWaalsContact O-N 3.14Å
315	A	43.6	Very low	61.1	Low	62 Å²	62	79 Å²	79	51%	0.512	45%	0.447	S	S	.	.			trans	-65	113.6	165.5	0	0	0	0	0	109.3	R295	R295-A315 PolarHBondContact NH1-O 2.73Å
316	S	52.3	Low	63.7	Low	66 Å²	66	71 Å²	71	46%	0.462	41%	0.413	S	S	.	.			trans	-40.4	143.4	179.3	173.8	0	0	0	0	113	T314 S318 S319	T314-S316 PolarHBondContact O-N 2.93Å; T314-S316 VanDerWaalsContact O-N 3.14Å; S316-S318 WeakPolarHBondContact CB-OG 3.34Å; S316-S318 PolarHBondContact O-N 2.57Å; S316-S318 PolarHBondContact OG-N 3.07Å; S316-S318 PolarHBondContact OG-OG 3.06Å; S316-S319 VanDerWaalsContact O-CB 3.27Å; S316-S319 WeakPolarHBondContact O-CB 3.15Å; S316-S319 PolarHBondContact O-N 3.06Å; S316-S319 PolarHBondContact O-OG 3Å
317	F	53.8	Low	66.3	Low	39 Å²	39	69.2 Å²	69.2	17%	0.171	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-11.3	173.1	-65	-73.7	0	0	0	113.8	E299 S319 Y655	E299-F317 WeakPolarHBondContact OE2-CE1 3.38Å; F317-S319 PolarHBondContact O-N 2.92Å; F317-Y655 HydrophobicContact CD1-CE2 4.35Å; F317-Y655 HydrophobicContact CE1-CD2 4.28Å; F317-Y655 AromaticContact CE1-CE2 3.52Å; F317-Y655 HydrophobicContact CE1-CE2 3.52Å; F317-Y655 HydrophobicContact CZ-CD2 4.42Å; F317-Y655 AromaticContact CZ-CE2 3.84Å; F317-Y655 HydrophobicContact CZ-CE2 3.84Å
318	S	60.1	Low	68.8	Low	108 Å²	108	67.5 Å²	67.5	76%	0.755	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	4.1	167.4	70.7	0	0	0	0	114.8	S316	S316-S318 WeakPolarHBondContact CB-OG 3.34Å; S316-S318 PolarHBondContact O-N 2.57Å; S316-S318 PolarHBondContact OG-N 3.07Å; S316-S318 PolarHBondContact OG-OG 3.06Å
319	S	75.7	Confident	71.4	Confident	27 Å²	27	59.5 Å²	59.5	19%	0.189	36%	0.361	C	S	.	.	S	Bend	trans	-84.7	150.5	176.6	55.9	0	0	0	0	112.6	R295 S316 F317	R295-S319 VanDerWaalsContact CB-O 3.23Å; R295-S319 WeakPolarHBondContact CB-O 3.45Å; R295-S319 PolarHBondContact N-O 3.14Å; S316-S319 VanDerWaalsContact O-CB 3.27Å; S316-S319 WeakPolarHBondContact O-CB 3.15Å; S316-S319 PolarHBondContact O-N 3.06Å; S316-S319 PolarHBondContact O-OG 3Å; F317-S319 PolarHBondContact O-N 2.92Å
320	D	87.2	Confident	73.8	Confident	69 Å²	69	57.9 Å²	57.9	37%	0.369	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	154.9	167.5	-87.4	-29.6	0	0	0	111.2	M293 P294 I349	M293-D320 CarbonylContact O-C 3.58Å; M293-D320 WeakPolarHBondContact O-CA 3.42Å; P294-D320 WeakPolarHBondContact CA-OD1 3.17Å; P294-D320 VanDerWaalsContact N-OD1 3.11Å; D320-I349 HydrophobicContact CB-CG2 4.34Å; D320-I349 WeakPolarHBondContact O-CG2 3.32Å
321	V	92.3	Very high	76.4	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.012	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	151.7	161.3	-69.1	0	0	0	0	109.3	P292 M293 R295 L298 C347 L354	P292-V321 CarbonylContact C-O 3.48Å; P292-V321 WeakPolarHBondContact CA-O 3.45Å; M293-V321 HydrophobicContact CB-CG2 4.33Å; M293-V321 PolarHBondContact N-O 2.87Å; M293-V321 VanDerWaalsContact O-CG2 3.26Å; M293-V321 WeakPolarHBondContact O-CG2 3.33Å; M293-V321 PolarHBondContact O-N 3.13Å; R295-V321 HydrophobicContact CB-CG1 4.05Å; R295-V321 HydrophobicContact CG-CG1 4.06Å; L298-V321 HydrophobicContact CD1-CG2 4.13Å; V321-C347 CarbonylContact C-O 3.57Å; V321-C347 VanDerWaalsContact CA-O 3.23Å; V321-C347 WeakPolarHBondContact CA-O 3.38Å; V321-C347 WeakPolarHBondContact CB-O 3.45Å; V321-L354 HydrophobicContact CG1-CD1 4.2Å; V321-L354 HydrophobicContact CG1-CD2 4.29Å
322	L	95.8	Very high	79.1	Confident	44 Å²	44	51.8 Å²	51.8	23%	0.23	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	120.6	174.2	-61.4	176.1	0	0	0	109.4	P292 I324 P346 C347	P292-L322 HydrophobicContact CB-CD2 4.12Å; L322-I324 HydrophobicContact CB-CD1 3.86Å; L322-I324 PolarHBondContact O-N 2.95Å; L322-P346 WeakPolarHBondContact O-CA 3.39Å; L322-C347 PolarHBondContact N-O 2.78Å; L322-C347 PolarHBondContact O-N 2.84Å
323	L	97.6	Very high	81.8	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	108.5	169.9	-57.2	-170.6	0	0	0	108.9	A266 G290 V291 M293 L298 C344 P346	A266-L323 HydrophobicContact CB-CD2 3.85Å; G290-L323 CarbonylContact C-O 3.6Å; G290-L323 WeakPolarHBondContact CA-O 3.48Å; V291-L323 HydrophobicContact CB-CB 4.36Å; V291-L323 PolarHBondContact N-O 3.03Å; V291-L323 WeakPolarHBondContact O-CB 3.36Å; V291-L323 PolarHBondContact O-N 3.39Å; M293-L323 HydrophobicContact CB-CD1 4.2Å; M293-L323 HydrophobicContact CB-CD2 4.27Å; M293-L323 HydrophobicContact CB-CG 3.98Å; M293-L323 HydrophobicContact CE-CD1 3.91Å; M293-L323 HydrophobicContact CG-CD1 4.46Å; L298-L323 HydrophobicContact CD1-CD2 4.11Å; L323-C344 HydrophobicContact CB-CB 3.76Å; L323-P346 HydrophobicContact CD2-CB 4Å
324	I	97.4	Very high	84.1	Confident	65 Å²	65	41.9 Å²	41.9	33%	0.333	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	117.2	179.7	-49.9	-53.5	0	0	0	108.8	L322 C344 D345 C347	L322-I324 HydrophobicContact CB-CD1 3.86Å; L322-I324 PolarHBondContact O-N 2.95Å; I324-C344 CarbonylContact O-C 3.43Å; I324-C344 WeakPolarHBondContact O-CA 3.35Å; I324-D345 WeakPolarHBondContact CB-O 3.47Å; I324-D345 PolarHBondContact N-O 3.2Å; I324-D345 PolarHBondContact O-N 2.97Å; I324-C347 HydrophobicContact CG1-CB 4.15Å
325	P	97.6	Very high	86.3	Confident	11 Å²	11	40.2 Å²	40.2	7%	0.071	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	131	-171.2	30.6	-36.1	0	0	0	113.3	F264 L327 V342	F264-P325 HydrophobicContact CD1-CB 4.12Å; F264-P325 HydrophobicContact CD1-CG 4.37Å; F264-P325 HydrophobicContact CE1-CB 3.99Å; F264-P325 HydrophobicContact CE1-CG 3.88Å; P325-L327 HydrophobicContact CB-CD2 4.31Å; P325-L327 HydrophobicContact CG-CD2 4.28Å; P325-L327 PolarHBondContact O-N 3.25Å; P325-V342 HydrophobicContact CB-CB 4.44Å; P325-V342 HydrophobicContact CB-CG1 3.75Å; P325-V342 HydrophobicContact CB-CG2 3.79Å
326	D	97.1	Very high	88.6	Confident	32 Å²	32	38.2 Å²	38.2	17%	0.171	22%	0.223	C	C	.	.			trans	-82.6	89.3	170.2	-170	-25	0	0	0	108.9	S328 T329 V342 I343 R359 K363	D326-S328 PolarHBondContact O-N 2.79Å; D326-S328 PolarHBondContact OD1-OG 2.83Å; D326-T329 HydrophobicContact CB-CG2 4.08Å; D326-T329 WeakPolarHBondContact O-CB 3.16Å; D326-T329 PolarHBondContact O-N 2.92Å; D326-T329 PolarHBondContact O-OG1 2.92Å; D326-V342 WeakPolarHBondContact O-CG2 3.4Å; D326-I343 WeakPolarHBondContact CB-O 3.09Å; D326-I343 PolarHBondContact N-O 3.23Å; D326-R359 IonicContact OD2-CZ 3.43Å; D326-R359 IonicContact OD2-NH1 2.72Å; D326-R359 PolarHBondContact OD2-NH1 2.86Å; D326-R359 IonicContact OD2-NH2 3.34Å; D326-R359 PolarHBondContact OD2-NH2 3.13Å; D326-K363 IonicContact OD2-NZ 2.71Å; D326-K363 PolarHBondContact OD2-NZ 3.44Å
327	L	96.8	Very high	90.5	Very high	17 Å²	17	43.2 Å²	43.2	9%	0.089	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-55.1	-23.5	-172.4	-62.9	-172.5	0	0	0	114.2	F243 A246 M247 I250 F283 A287 P325 T329 F330	F243-L327 HydrophobicContact CD2-CD1 3.73Å; F243-L327 HydrophobicContact CD2-CG 4.49Å; F243-L327 HydrophobicContact CE2-CD1 3.57Å; F243-L327 HydrophobicContact CE2-CG 4.21Å; F243-L327 HydrophobicContact CG-CD1 4.45Å; F243-L327 HydrophobicContact CZ-CD1 4.16Å; A246-L327 HydrophobicContact CB-CB 4.26Å; A246-L327 HydrophobicContact CB-CD1 4.31Å; M247-L327 HydrophobicContact CB-CD1 4.05Å; I250-L327 HydrophobicContact CD1-CB 3.8Å; I250-L327 HydrophobicContact CD1-CD1 4.48Å; I250-L327 HydrophobicContact CD1-CD2 4Å; I250-L327 HydrophobicContact CD1-CG 4.3Å; F283-L327 HydrophobicContact CZ-CD2 4.21Å; A287-L327 HydrophobicContact CB-CD2 4.45Å; P325-L327 HydrophobicContact CB-CD2 4.31Å; P325-L327 HydrophobicContact CG-CD2 4.28Å; P325-L327 PolarHBondContact O-N 3.25Å; L327-T329 PolarHBondContact O-N 2.99Å; L327-F330 PolarHBondContact O-N 2.71Å
328	S	95.7	Very high	92.5	Very high	85 Å²	85	45.1 Å²	45.1	59%	0.594	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-62.2	-25.3	174.7	73.9	0	0	0	0	113.5	D326 R331	D326-S328 PolarHBondContact O-N 2.79Å; D326-S328 PolarHBondContact OD1-OG 2.83Å; S328-R331 PolarHBondContact O-NH1 3.28Å
329	T	97.4	Very high	94.3	Very high	11 Å²	11	40.7 Å²	40.7	7%	0.067	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-90.6	5	-178.8	70.9	0	0	0	0	113.6	D326 L327 R331 I343	D326-T329 HydrophobicContact CB-CG2 4.08Å; D326-T329 WeakPolarHBondContact O-CB 3.16Å; D326-T329 PolarHBondContact O-N 2.92Å; D326-T329 PolarHBondContact O-OG1 2.92Å; L327-T329 PolarHBondContact O-N 2.99Å; T329-R331 PolarHBondContact O-N 2.67Å; T329-I343 HydrophobicContact CG2-CB 4.11Å; T329-I343 HydrophobicContact CG2-CD1 4.16Å; T329-I343 HydrophobicContact CG2-CG1 4.34Å; T329-I343 WeakPolarHBondContact OG1-CB 3.24Å; T329-I343 PolarHBondContact OG1-N 2.83Å
330	F	97.8	Very high	95.4	Very high	7 Å²	7	39.4 Å²	39.4	3%	0.031	21%	0.208	C	C	.	.			trans	-62.5	126.6	177.4	-176.5	-91.2	0	0	0	111	I250 Q253 I254 I259 V262 L327 V332 R341 V342	I250-F330 HydrophobicContact CB-CD1 4.44Å; I250-F330 HydrophobicContact CB-CG 4.46Å; I250-F330 HydrophobicContact CD1-CB 3.68Å; I250-F330 HydrophobicContact CD1-CG 4.08Å; I250-F330 HydrophobicContact CG1-CB 3.91Å; I250-F330 HydrophobicContact CG1-CD1 4Å; I250-F330 HydrophobicContact CG1-CG 3.91Å; I250-F330 HydrophobicContact CG2-CD1 3.82Å; I250-F330 HydrophobicContact CG2-CD2 3.68Å; I250-F330 HydrophobicContact CG2-CE1 3.9Å; I250-F330 HydrophobicContact CG2-CE2 3.75Å; I250-F330 HydrophobicContact CG2-CG 3.71Å; I250-F330 HydrophobicContact CG2-CZ 3.86Å; Q253-F330 HydrophobicContact CG-CE1 4.46Å; I254-F330 HydrophobicContact CD1-CE2 4.46Å; I254-F330 HydrophobicContact CD1-CZ 4.3Å; I254-F330 HydrophobicContact CG1-CZ 3.94Å; I259-F330 HydrophobicContact CD1-CE1 4.39Å; I259-F330 HydrophobicContact CD1-CZ 3.97Å; V262-F330 HydrophobicContact CG1-CE2 4.11Å; V262-F330 HydrophobicContact CG2-CE2 4.17Å; L327-F330 PolarHBondContact O-N 2.71Å; F330-V332 HydrophobicContact CE1-CG2 4.11Å; F330-R341 VanDerWaalsContact CA-O 3.29Å; F330-R341 WeakPolarHBondContact CA-O 3.47Å; F330-V342 HydrophobicContact CD2-CB 4.39Å
331	R	97.3	Very high	95.9	Very high	89 Å²	89	36.4 Å²	36.4	34%	0.336	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	159.3	178	-61.2	-67	-178.1	-79.5	-4.7	110	S328 T329 G340 R341 M424	S328-R331 PolarHBondContact O-NH1 3.28Å; T329-R331 PolarHBondContact O-N 2.67Å; R331-G340 CarbonylContact O-C 3.56Å; R331-G340 WeakPolarHBondContact O-CA 3.34Å; R331-R341 PolarHBondContact N-O 2.88Å; R331-R341 PolarHBondContact O-N 2.99Å; R331-M424 HydrophobicContact CB-CE 3.68Å; R331-M424 HydrophobicContact CB-SD 3.69Å; R331-M424 HydrophobicContact CG-CE 4.32Å
332	V	97	Very high	96.1	Very high	27 Å²	27	36.3 Å²	36.3	16%	0.164	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	127.3	178.4	-170.4	0	0	0	0	108.4	Q253 E257 I259 F330 P334 M424	Q253-V332 HydrophobicContact CG-CG2 4.47Å; E257-V332 WeakPolarHBondContact OE2-CG2 3.42Å; I259-V332 HydrophobicContact CD1-CB 4.28Å; I259-V332 HydrophobicContact CD1-CG1 3.84Å; I259-V332 HydrophobicContact CD1-CG2 3.49Å; I259-V332 VanDerWaalsContact CD1-CG2 3.49Å; I259-V332 HydrophobicContact CG1-CG1 4.31Å; F330-V332 HydrophobicContact CE1-CG2 4.11Å; V332-P334 WeakPolarHBondContact O-CD 3.03Å; V332-M424 VanDerWaalsContact O-SD 3.33Å
333	L	95.3	Very high	96.3	Very high	5 Å²	5	34.4 Å²	34.4	3%	0.026	18%	0.181	C	C	.	.			trans	-79.1	107.8	-171.2	-69	167.6	0	0	0	110.8	R263 W335 A336 T339 R341 M424	R263-L333 HydrophobicContact CG-CD1 4.36Å; L333-W335 HydrophobicContact CD2-CH2 4.17Å; L333-W335 HydrophobicContact CD2-CZ2 3.6Å; L333-W335 PolarHBondContact O-N 2.89Å; L333-W335 VanDerWaalsContact O-N 3.12Å; L333-A336 HydrophobicContact CB-CB 3.97Å; L333-A336 HydrophobicContact CD1-CB 4.28Å; L333-A336 PolarHBondContact O-N 2.97Å; L333-A336 VanDerWaalsContact O-N 3.13Å; L333-A336 VanDerWaalsContact O-O 3.13Å; L333-T339 WeakPolarHBondContact CB-O 3.33Å; L333-T339 HydrophobicContact CD1-CG2 3.87Å; L333-T339 PolarHBondContact N-O 2.78Å; L333-R341 HydrophobicContact CD1-CB 4.26Å; L333-R341 HydrophobicContact CD2-CB 4.13Å; L333-R341 HydrophobicContact CG-CB 4.07Å; L333-M424 HydrophobicContact CD2-CE 3.68Å; L333-M424 HydrophobicContact CD2-SD 3.81Å; L333-M424 HydrophobicContact CG-SD 4.46Å
334	P	93.4	Very high	96.3	Very high	58 Å²	58	34.5 Å²	34.5	38%	0.377	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-24.7	-171.7	-22.7	36	0	0	0	113.6	V332 C423 M424	V332-P334 WeakPolarHBondContact O-CD 3.03Å; P334-C423 HydrophobicContact CG-CB 3.73Å; P334-M424 HydrophobicContact CG-CG 4.4Å
335	W	90.7	Very high	96.3	Very high	21 Å²	21	33 Å²	33	8%	0.08	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-12.4	-179.7	56.5	85.4	0	0	0	114.5	L333 M421 M424 G462 E465 M466 K469	L333-W335 HydrophobicContact CD2-CH2 4.17Å; L333-W335 HydrophobicContact CD2-CZ2 3.6Å; L333-W335 PolarHBondContact O-N 2.89Å; L333-W335 VanDerWaalsContact O-N 3.12Å; W335-M421 HydrophobicContact CE3-CE 4.18Å; W335-M421 HydrophobicContact CH2-CE 3.64Å; W335-M421 HydrophobicContact CH2-SD 4.13Å; W335-M421 HydrophobicContact CZ3-CE 3.39Å; W335-M421 HydrophobicContact CZ3-SD 4.12Å; W335-M424 HydrophobicContact CH2-CG 3.73Å; W335-M424 HydrophobicContact CZ3-CG 3.75Å; W335-G462 VanDerWaalsContact CZ2-CA 3.46Å; W335-E465 PolarHBondContact NE1-OE2 3.3Å; W335-M466 HydrophobicContact CB-CG 3.92Å; W335-M466 HydrophobicContact CD2-CG 3.7Å; W335-M466 HydrophobicContact CD2-SD 4.19Å; W335-M466 HydrophobicContact CE3-CG 3.65Å; W335-M466 HydrophobicContact CE3-SD 3.49Å; W335-M466 HydrophobicContact CG-CG 3.84Å; W335-M466 HydrophobicContact CZ3-CG 4.38Å; W335-M466 HydrophobicContact CZ3-SD 3.96Å; W335-K469 HydrophobicContact CB-CD 4.48Å; W335-K469 PolarHBondContact O-NZ 3.32Å
336	A	92.2	Very high	96.2	Very high	20 Å²	20	32.7 Å²	32.7	17%	0.165	17%	0.173	C	C	.	.	S	Bend	trans	-120.6	120.3	-173.9	0	0	0	0	0	112.1	L333 Q338 T339	L333-A336 HydrophobicContact CB-CB 3.97Å; L333-A336 HydrophobicContact CD1-CB 4.28Å; L333-A336 PolarHBondContact O-N 2.97Å; L333-A336 VanDerWaalsContact O-N 3.13Å; L333-A336 VanDerWaalsContact O-O 3.13Å; A336-Q338 PolarHBondContact O-N 3.13Å; A336-T339 PolarHBondContact O-N 2.75Å
337	E	92.7	Very high	96	Very high	170 Å²	170	31.6 Å²	31.6	79%	0.794	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	130.4	-172.5	-63.7	-179.5	-178.4	0	0	112.9	T339	E337-T339 PolarHBondContact O-N 2.92Å; E337-T339 PolarHBondContact O-OG1 2.97Å
338	Q	96.4	Very high	95.7	Very high	79 Å²	79	32.6 Å²	32.6	37%	0.369	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	32.8	172.3	-56.4	-175.2	-52.3	0	0	114.4	N258 I259 N260 F261 A336	N258-Q338 PolarHBondContact ND2-NE2 3.34Å; N258-Q338 VanDerWaalsContact ND2-NE2 3.12Å; N258-Q338 WeakPolarHBondContact O-CB 3.22Å; N258-Q338 WeakPolarHBondContact O-CG 3.23Å; N258-Q338 PolarHBondContact O-NE2 3.12Å; I259-Q338 CarbonylContact C-O 3.54Å; I259-Q338 WeakPolarHBondContact CA-O 3.45Å; I259-Q338 WeakPolarHBondContact CG2-O 3.47Å; N260-Q338 HydrophobicContact CB-CB 4.15Å; N260-Q338 PolarHBondContact N-O 2.76Å; N260-Q338 VanDerWaalsContact ND2-CD 3.29Å; N260-Q338 PolarHBondContact ND2-NE2 3Å; N260-Q338 PolarHBondContact ND2-OE1 2.9Å; F261-Q338 PolarHBondContact N-O 3.28Å; F261-Q338 VanDerWaalsContact N-O 3.16Å; A336-Q338 PolarHBondContact O-N 3.13Å
339	T	97.8	Very high	95.2	Very high	16 Å²	16	34.1 Å²	34.1	10%	0.098	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	121	-171.1	-57.1	0	0	0	0	112.3	F261 R263 L333 A336 E337	F261-T339 HydrophobicContact CB-CG2 4.26Å; F261-T339 CarbonylContact O-C 3.51Å; F261-T339 WeakPolarHBondContact O-CA 3.26Å; R263-T339 HydrophobicContact CG-CG2 3.89Å; L333-T339 WeakPolarHBondContact CB-O 3.33Å; L333-T339 HydrophobicContact CD1-CG2 3.87Å; L333-T339 PolarHBondContact N-O 2.78Å; A336-T339 PolarHBondContact O-N 2.75Å; E337-T339 PolarHBondContact O-N 2.92Å; E337-T339 PolarHBondContact O-OG1 2.97Å
340	G	97.4	Very high	94.7	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	167.6	167.4	0	0	0	0	0	112.8	F261 V262 R263 R331	F261-G340 PolarHBondContact O-N 3.45Å; V262-G340 CarbonylContact C-O 3.59Å; V262-G340 WeakPolarHBondContact CA-O 3.48Å; R263-G340 PolarHBondContact N-O 2.97Å; R331-G340 CarbonylContact O-C 3.56Å; R331-G340 WeakPolarHBondContact O-CA 3.34Å
341	R	97.4	Very high	94.1	Very high	6 Å²	6	40.8 Å²	40.8	2%	0.023	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	145.2	175.2	169.9	174.3	176.1	-103.6	16.4	109.7	R263 E265 F330 R331 L333 M424 F457 T458	R263-R341 CarbonylContact O-C 3.53Å; R263-R341 WeakPolarHBondContact O-CA 3.31Å; E265-R341 VanDerWaalsContact CD-NE 3.33Å; E265-R341 HydrophobicContact CG-CG 4.03Å; E265-R341 IonicContact OE1-NE 2.75Å; E265-R341 WeakPolarHBondContact OE2-CD 3.33Å; E265-R341 IonicContact OE2-CZ 3.93Å; E265-R341 IonicContact OE2-NE 3.13Å; E265-R341 PolarHBondContact OE2-NE 3.13Å; E265-R341 IonicContact OE2-NH2 2.7Å; F330-R341 VanDerWaalsContact CA-O 3.29Å; F330-R341 WeakPolarHBondContact CA-O 3.47Å; R331-R341 PolarHBondContact N-O 2.88Å; R331-R341 PolarHBondContact O-N 2.99Å; L333-R341 HydrophobicContact CD1-CB 4.26Å; L333-R341 HydrophobicContact CD2-CB 4.13Å; L333-R341 HydrophobicContact CG-CB 4.07Å; R341-M424 HydrophobicContact CB-CE 4.49Å; R341-F457 VanDerWaalsContact NH2-CD1 3.33Å; R341-T458 VanDerWaalsContact CZ-OG1 3.29Å; R341-T458 PolarHBondContact NH1-OG1 3.48Å; R341-T458 PolarHBondContact NH2-OG1 3.42Å
342	V	98.3	Very high	93.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	134.1	166	66.4	0	0	0	0	109.9	V262 R263 F264 E265 P325 D326 F330	V262-V342 HydrophobicContact CG1-CG1 4.21Å; R263-V342 PolarHBondContact O-N 3.39Å; F264-V342 HydrophobicContact CD1-CG1 3.95Å; F264-V342 HydrophobicContact CD2-CG1 4.48Å; F264-V342 HydrophobicContact CE1-CG1 4.19Å; F264-V342 HydrophobicContact CG-CG1 4.11Å; E265-V342 PolarHBondContact N-O 3.5Å; P325-V342 HydrophobicContact CB-CB 4.44Å; P325-V342 HydrophobicContact CB-CG1 3.75Å; P325-V342 HydrophobicContact CB-CG2 3.79Å; D326-V342 WeakPolarHBondContact O-CG2 3.4Å; F330-V342 HydrophobicContact CD2-CB 4.39Å
343	I	98.4	Very high	93.5	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.015	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	141	174.6	-53.1	176.8	0	0	0	108.2	E265 D326 T329 D454 F457	E265-I343 CarbonylContact O-C 3.55Å; E265-I343 WeakPolarHBondContact O-CA 3.35Å; D326-I343 WeakPolarHBondContact CB-O 3.09Å; D326-I343 PolarHBondContact N-O 3.23Å; T329-I343 HydrophobicContact CG2-CB 4.11Å; T329-I343 HydrophobicContact CG2-CD1 4.16Å; T329-I343 HydrophobicContact CG2-CG1 4.34Å; T329-I343 WeakPolarHBondContact OG1-CB 3.24Å; T329-I343 PolarHBondContact OG1-N 2.83Å; I343-D454 HydrophobicContact CD1-CB 3.79Å; I343-F457 HydrophobicContact CD1-CD1 4.27Å; I343-F457 HydrophobicContact CG2-CE1 4.49Å
344	C	98.3	Very high	93.3	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.014	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	138.7	-173.2	-56.8	0	0	0	0	111.6	E265 L323 I324	E265-C344 PolarHBondContact O-N 3.37Å; L323-C344 HydrophobicContact CB-CB 3.76Å; I324-C344 CarbonylContact O-C 3.43Å; I324-C344 WeakPolarHBondContact O-CA 3.35Å
345	D	97.4	Very high	93.2	Very high	34 Å²	34	46.8 Å²	46.8	18%	0.182	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	119.9	169.2	-64.2	-32	0	0	0	108.5	I324 R359 K363	I324-D345 WeakPolarHBondContact CB-O 3.47Å; I324-D345 PolarHBondContact N-O 3.2Å; I324-D345 PolarHBondContact O-N 2.97Å; D345-R359 VanDerWaalsContact CG-NH1 3.31Å; D345-R359 WeakPolarHBondContact OD1-CD 3.41Å; D345-R359 IonicContact OD1-CZ 3.69Å; D345-R359 IonicContact OD1-NE 3.62Å; D345-R359 IonicContact OD1-NH1 2.65Å; D345-R359 PolarHBondContact OD1-NH1 3.01Å; D345-R359 IonicContact OD2-NH1 3.65Å; D345-R359 PolarHBondContact OD2-NH1 3.25Å; D345-K363 IonicContact OD1-NZ 3.05Å; D345-K363 IonicContact OD2-NZ 2.71Å; D345-K363 PolarHBondContact OD2-NZ 2.95Å
346	P	94.9	Very high	93.1	Very high	5 Å²	5	46 Å²	46	3%	0.032	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	139.4	-177.4	29.8	-34.4	0	0	0	112.4	L298 L322 L323 L354 S357	L298-P346 HydrophobicContact CD1-CB 3.66Å; L298-P346 HydrophobicContact CD1-CG 3.88Å; L322-P346 WeakPolarHBondContact O-CA 3.39Å; L323-P346 HydrophobicContact CD2-CB 4Å; P346-L354 HydrophobicContact CB-CB 4.2Å; P346-L354 HydrophobicContact CB-CD2 3.96Å; P346-L354 HydrophobicContact CG-CB 4.12Å; P346-L354 HydrophobicContact CG-CD2 3.9Å; P346-L354 WeakPolarHBondContact O-CB 3.44Å; P346-L354 PolarHBondContact O-N 3.37Å; P346-S357 WeakPolarHBondContact CD-OG 3.35Å; P346-S357 WeakPolarHBondContact CG-OG 3.29Å
347	C	93.4	Very high	93.3	Very high	8 Å²	8	45.3 Å²	45.3	5%	0.054	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	157.4	175.8	-64.2	0	0	0	0	110.9	V321 L322 I324 S352	V321-C347 CarbonylContact C-O 3.57Å; V321-C347 VanDerWaalsContact CA-O 3.23Å; V321-C347 WeakPolarHBondContact CA-O 3.38Å; V321-C347 WeakPolarHBondContact CB-O 3.45Å; L322-C347 PolarHBondContact N-O 2.78Å; L322-C347 PolarHBondContact O-N 2.84Å; I324-C347 HydrophobicContact CG1-CB 4.15Å; C347-S352 CarbonylContact C-O 3.56Å; C347-S352 VanDerWaalsContact CA-O 3.28Å; C347-S352 WeakPolarHBondContact CA-O 3.47Å; C347-S352 WeakPolarHBondContact CB-O 3.39Å
348	T	89.7	Confident	93.4	Very high	39 Å²	39	37.3 Å²	37.3	24%	0.239	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	163.7	169.8	62.6	0	0	0	0	111.4	T350 G351 S352	T348-T350 PolarHBondContact O-N 2.77Å; T348-T350 VanDerWaalsContact O-N 3.09Å; T348-T350 PolarHBondContact OG1-N 2.72Å; T348-T350 PolarHBondContact OG1-OG1 2.78Å; T348-G351 PolarHBondContact O-N 3.48Å; T348-G351 PolarHBondContact OG1-N 2.91Å; T348-S352 PolarHBondContact N-O 3.28Å; T348-S352 WeakPolarHBondContact OG1-CB 3.35Å; T348-S352 PolarHBondContact OG1-N 3.12Å; T348-S352 PolarHBondContact OG1-O 2.83Å
349	I	87	Confident	93.5	Very high	116 Å²	116	33.7 Å²	33.7	60%	0.595	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-17.4	167.2	55.2	171.5	0	0	0	114	D320 G351	D320-I349 HydrophobicContact CB-CG2 4.34Å; D320-I349 WeakPolarHBondContact O-CG2 3.32Å; I349-G351 VanDerWaalsContact C-N 3.3Å
350	T	85.8	Confident	93.5	Very high	112 Å²	112	34.2 Å²	34.2	69%	0.687	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.3	5.8	173	56.1	0	0	0	0	113.4	T348 S352	T348-T350 PolarHBondContact O-N 2.77Å; T348-T350 VanDerWaalsContact O-N 3.09Å; T348-T350 PolarHBondContact OG1-N 2.72Å; T348-T350 PolarHBondContact OG1-OG1 2.78Å; T350-S352 VanDerWaalsContact C-N 3.29Å; T350-S352 PolarHBondContact O-N 3.21Å
351	G	85.8	Confident	93.6	Very high	47 Å²	47	34.2 Å²	34.2	49%	0.485	19%	0.193	S	C	.	.	S	Bend	trans	74.3	13.5	179.7	0	0	0	0	0	114.7	T348 I349	T348-G351 PolarHBondContact O-N 3.48Å; T348-G351 PolarHBondContact OG1-N 2.91Å; I349-G351 VanDerWaalsContact C-N 3.3Å
352	S	89.5	Confident	93.6	Very high	63 Å²	63	34 Å²	34	44%	0.441	19%	0.192	S	C	.	.			trans	-88.1	135.4	175.8	-60.2	0	0	0	0	110.4	C347 T348 T350 L354	C347-S352 CarbonylContact C-O 3.56Å; C347-S352 VanDerWaalsContact CA-O 3.28Å; C347-S352 WeakPolarHBondContact CA-O 3.47Å; C347-S352 WeakPolarHBondContact CB-O 3.39Å; T348-S352 PolarHBondContact N-O 3.28Å; T348-S352 WeakPolarHBondContact OG1-CB 3.35Å; T348-S352 PolarHBondContact OG1-N 3.12Å; T348-S352 PolarHBondContact OG1-O 2.83Å; T350-S352 VanDerWaalsContact C-N 3.29Å; T350-S352 PolarHBondContact O-N 3.21Å; S352-L354 PolarHBondContact O-N 3.4Å
353	P	92.1	Very high	93.6	Very high	48 Å²	48	36.3 Å²	36.3	31%	0.312	20%	0.202	S	C	.	.	B	Isolated β-bridge	trans	-56.5	135.9	176.4	-27.6	36	0	0	0	112.7	R355 L360	P353-R355 PolarHBondContact O-N 3.42Å; P353-R355 VanDerWaalsContact O-N 3.15Å; P353-L360 HydrophobicContact CB-CD1 4.11Å; P353-L360 HydrophobicContact CB-CD2 3.55Å
354	L	90.4	Very high	93.6	Very high	7 Å²	7	40.9 Å²	40.9	4%	0.037	22%	0.223	C	C	.	.			trans	-72.4	107.1	-179	-177	69.7	0	0	0	109.8	L298 V321 P346 S352 T356 S357 L360	L298-L354 HydrophobicContact CD1-CD2 4.34Å; V321-L354 HydrophobicContact CG1-CD1 4.2Å; V321-L354 HydrophobicContact CG1-CD2 4.29Å; P346-L354 HydrophobicContact CB-CB 4.2Å; P346-L354 HydrophobicContact CB-CD2 3.96Å; P346-L354 HydrophobicContact CG-CB 4.12Å; P346-L354 HydrophobicContact CG-CD2 3.9Å; P346-L354 WeakPolarHBondContact O-CB 3.44Å; P346-L354 PolarHBondContact O-N 3.37Å; S352-L354 PolarHBondContact O-N 3.4Å; L354-T356 WeakPolarHBondContact CG-OG1 3.48Å; L354-T356 PolarHBondContact O-N 3.01Å; L354-T356 VanDerWaalsContact O-N 3.15Å; L354-S357 WeakPolarHBondContact O-CB 3.44Å; L354-S357 PolarHBondContact O-N 2.95Å; L354-L360 WeakPolarHBondContact O-CD2 3.28Å
355	R	90.8	Very high	93.6	Very high	186 Å²	186	40.8 Å²	40.8	70%	0.702	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.3	-171.3	-66.1	-176.3	178.3	-175.1	-1.2	115.1	P353 S357 P651	P353-R355 PolarHBondContact O-N 3.42Å; P353-R355 VanDerWaalsContact O-N 3.15Å; R355-S357 VanDerWaalsContact C-N 3.28Å; R355-P651 HydrophobicContact CB-CB 4.38Å; R355-P651 HydrophobicContact CB-CG 4.42Å
356	T	90.5	Very high	93.6	Very high	6 Å²	6	40.1 Å²	40.1	4%	0.037	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-8.1	174.4	51.9	0	0	0	0	113.2	L269 E299 L354 P358 P651	L269-T356 WeakPolarHBondContact CD2-O 3.37Å; E299-T356 WeakPolarHBondContact OE1-CB 3.48Å; E299-T356 WeakPolarHBondContact OE1-CG2 3.24Å; E299-T356 PolarHBondContact OE1-OG1 3.29Å; L354-T356 WeakPolarHBondContact CG-OG1 3.48Å; L354-T356 PolarHBondContact O-N 3.01Å; L354-T356 VanDerWaalsContact O-N 3.15Å; T356-P358 VanDerWaalsContact O-CD 3.24Å; T356-P358 WeakPolarHBondContact O-CD 3.42Å; T356-P651 HydrophobicContact CG2-CB 4.5Å
357	S	94.5	Very high	93.7	Very high	4 Å²	4	41 Å²	41	3%	0.028	23%	0.228	C	C	.	.			trans	-69.9	118.2	-173.3	-176.5	0	0	0	0	112.5	P346 L354 R355 R359 L360 I361	P346-S357 WeakPolarHBondContact CD-OG 3.35Å; P346-S357 WeakPolarHBondContact CG-OG 3.29Å; L354-S357 WeakPolarHBondContact O-CB 3.44Å; L354-S357 PolarHBondContact O-N 2.95Å; R355-S357 VanDerWaalsContact C-N 3.28Å; S357-R359 VanDerWaalsContact C-N 3.3Å; S357-R359 PolarHBondContact O-N 3.05Å; S357-L360 WeakPolarHBondContact O-CB 3.3Å; S357-L360 PolarHBondContact O-N 3.03Å; S357-L360 VanDerWaalsContact O-N 3.13Å; S357-I361 WeakPolarHBondContact O-CG1 3.34Å; S357-I361 PolarHBondContact O-N 2.96Å; S357-I361 VanDerWaalsContact O-N 3.13Å
358	P	96.8	Very high	93.9	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.013	24%	0.241	C	C	.	.	H	α-helix	trans	-55.3	-41.7	179.3	-29.6	38	0	0	0	113.9	T267 L269 T356 I361 A362 N589 Y591 I592	T267-P358 HydrophobicContact CG2-CB 3.88Å; T267-P358 HydrophobicContact CG2-CG 3.96Å; L269-P358 HydrophobicContact CD2-CG 4.32Å; T356-P358 VanDerWaalsContact O-CD 3.24Å; T356-P358 WeakPolarHBondContact O-CD 3.42Å; P358-I361 PolarHBondContact O-N 3.25Å; P358-A362 WeakPolarHBondContact O-CB 3.43Å; P358-A362 PolarHBondContact O-N 3.33Å; P358-N589 VanDerWaalsContact CG-ND2 3.28Å; P358-N589 WeakPolarHBondContact CG-ND2 3.42Å; P358-Y591 HydrophobicContact CB-CD2 4.33Å; P358-Y591 HydrophobicContact CB-CG 4.39Å; P358-Y591 WeakPolarHBondContact O-CB 3.21Å; P358-I592 HydrophobicContact CB-CD1 3.58Å; P358-I592 HydrophobicContact CB-CG1 3.93Å; P358-I592 HydrophobicContact CG-CD1 4.07Å; P358-I592 HydrophobicContact CG-CG1 4.31Å
359	R	98.1	Very high	94.2	Very high	3 Å²	3	42.1 Å²	42.1	1%	0.011	23%	0.23	C	C	.	.	H	α-helix	trans	-68	-35.8	-179.4	-170.2	170.3	-171.6	-101.9	0.3	112.3	T267 D326 D345 S357 K363 I450 D454 Y591	T267-R359 HydrophobicContact CG2-CB 4.45Å; D326-R359 IonicContact OD2-CZ 3.43Å; D326-R359 IonicContact OD2-NH1 2.72Å; D326-R359 PolarHBondContact OD2-NH1 2.86Å; D326-R359 IonicContact OD2-NH2 3.34Å; D326-R359 PolarHBondContact OD2-NH2 3.13Å; D345-R359 VanDerWaalsContact CG-NH1 3.31Å; D345-R359 WeakPolarHBondContact OD1-CD 3.41Å; D345-R359 IonicContact OD1-CZ 3.69Å; D345-R359 IonicContact OD1-NE 3.62Å; D345-R359 IonicContact OD1-NH1 2.65Å; D345-R359 PolarHBondContact OD1-NH1 3.01Å; D345-R359 IonicContact OD2-NH1 3.65Å; D345-R359 PolarHBondContact OD2-NH1 3.25Å; S357-R359 VanDerWaalsContact C-N 3.3Å; S357-R359 PolarHBondContact O-N 3.05Å; R359-K363 WeakPolarHBondContact O-CB 3.49Å; R359-K363 WeakPolarHBondContact O-CG 3.4Å; R359-K363 PolarHBondContact O-N 2.89Å; R359-I450 HydrophobicContact CG-CD1 4.29Å; R359-I450 HydrophobicContact CG-CG1 4.44Å; R359-D454 IonicContact CZ-OD1 3.16Å; R359-D454 IonicContact CZ-OD2 3.76Å; R359-D454 IonicContact NE-OD1 3.57Å; R359-D454 PolarHBondContact NE-OD1 3.44Å; R359-D454 IonicContact NE-OD2 2.72Å; R359-D454 IonicContact NH2-OD1 3.57Å; R359-D454 PolarHBondContact NH2-OD1 2.86Å; R359-D454 IonicContact NH2-OD2 3.46Å; R359-D454 PolarHBondContact NH2-OD2 3.15Å; R359-Y591 HydrophobicContact CB-CD1 3.96Å; R359-Y591 HydrophobicContact CB-CE1 4.02Å; R359-Y591 HydrophobicContact CB-CG 4.23Å; R359-Y591 HydrophobicContact CG-CD1 3.94Å; R359-Y591 HydrophobicContact CG-CE1 3.68Å
360	L	97.5	Very high	94.6	Very high	27 Å²	27	42.5 Å²	42.5	14%	0.141	23%	0.23	C	C	.	.	H	α-helix	trans	-64.6	-48	174.1	179.4	66.4	0	0	0	111.4	P353 L354 S357 A362 K363 Q364	P353-L360 HydrophobicContact CB-CD1 4.11Å; P353-L360 HydrophobicContact CB-CD2 3.55Å; L354-L360 WeakPolarHBondContact O-CD2 3.28Å; S357-L360 WeakPolarHBondContact O-CB 3.3Å; S357-L360 PolarHBondContact O-N 3.03Å; S357-L360 VanDerWaalsContact O-N 3.13Å; L360-A362 VanDerWaalsContact C-N 3.34Å; L360-A362 PolarHBondContact O-N 3.47Å; L360-K363 PolarHBondContact O-N 3.37Å; L360-Q364 HydrophobicContact CD1-CG 4.39Å; L360-Q364 HydrophobicContact CG-CG 4.49Å; L360-Q364 WeakPolarHBondContact O-CG 3.22Å; L360-Q364 PolarHBondContact O-N 2.94Å
361	I	98.2	Very high	95.1	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-61.7	-44.2	-178.8	-61.1	160.1	0	0	0	110.1	S357 P358 Q364 L365 A595 L648 F652	S357-I361 WeakPolarHBondContact O-CG1 3.34Å; S357-I361 PolarHBondContact O-N 2.96Å; S357-I361 VanDerWaalsContact O-N 3.13Å; P358-I361 PolarHBondContact O-N 3.25Å; I361-Q364 PolarHBondContact O-N 3.48Å; I361-L365 HydrophobicContact CG2-CD1 4.02Å; I361-L365 PolarHBondContact O-N 3.38Å; I361-A595 HydrophobicContact CG2-CB 4.1Å; I361-L648 HydrophobicContact CG2-CB 4.36Å; I361-L648 HydrophobicContact CG2-CD2 3.72Å; I361-F652 HydrophobicContact CD1-CB 3.62Å; I361-F652 HydrophobicContact CD1-CD1 4.22Å; I361-F652 HydrophobicContact CD1-CD2 3.61Å; I361-F652 HydrophobicContact CD1-CE2 4.39Å; I361-F652 HydrophobicContact CD1-CG 3.52Å
362	A	98.6	Very high	95.5	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.4	-49.4	173.2	0	0	0	0	0	112.3	P358 L360 Q364 L365 L366 I450 A595	P358-A362 WeakPolarHBondContact O-CB 3.43Å; P358-A362 PolarHBondContact O-N 3.33Å; L360-A362 VanDerWaalsContact C-N 3.34Å; L360-A362 PolarHBondContact O-N 3.47Å; A362-Q364 VanDerWaalsContact C-N 3.3Å; A362-Q364 PolarHBondContact O-N 3.31Å; A362-L365 PolarHBondContact O-N 3.06Å; A362-L366 WeakPolarHBondContact O-CB 3.34Å; A362-L366 WeakPolarHBondContact O-CD1 3.48Å; A362-L366 VanDerWaalsContact O-CG 3.22Å; A362-L366 WeakPolarHBondContact O-CG 3.46Å; A362-L366 PolarHBondContact O-N 3.41Å; A362-I450 HydrophobicContact CB-CD1 3.64Å; A362-A595 HydrophobicContact CB-CB 4.34Å
363	K	98.3	Very high	95.8	Very high	50 Å²	50	41.7 Å²	41.7	22%	0.217	22%	0.22	C	C	.	.	H	α-helix	trans	-57.7	-40	175.7	-78	-178.2	172.8	-170.4	0	112.4	D326 D345 R359 L360 G367 I450	D326-K363 IonicContact OD2-NZ 2.71Å; D326-K363 PolarHBondContact OD2-NZ 3.44Å; D345-K363 IonicContact OD1-NZ 3.05Å; D345-K363 IonicContact OD2-NZ 2.71Å; D345-K363 PolarHBondContact OD2-NZ 2.95Å; R359-K363 WeakPolarHBondContact O-CB 3.49Å; R359-K363 WeakPolarHBondContact O-CG 3.4Å; R359-K363 PolarHBondContact O-N 2.89Å; L360-K363 PolarHBondContact O-N 3.37Å; K363-G367 PolarHBondContact O-N 3.37Å; K363-I450 HydrophobicContact CG-CB 4.32Å; K363-I450 HydrophobicContact CG-CD1 3.96Å; K363-I450 HydrophobicContact CG-CG1 3.86Å
364	Q	97.9	Very high	96	Very high	98 Å²	98	41.1 Å²	41.1	46%	0.458	21%	0.213	S	C	.	.	H	α-helix	trans	-66.9	-45.4	179.4	-75.2	175	-7.2	0	0	112.6	L360 I361 A362 G367 Q368	L360-Q364 HydrophobicContact CD1-CG 4.39Å; L360-Q364 HydrophobicContact CG-CG 4.49Å; L360-Q364 WeakPolarHBondContact O-CG 3.22Å; L360-Q364 PolarHBondContact O-N 2.94Å; I361-Q364 PolarHBondContact O-N 3.48Å; A362-Q364 VanDerWaalsContact C-N 3.3Å; A362-Q364 PolarHBondContact O-N 3.31Å; Q364-G367 PolarHBondContact O-N 2.7Å; Q364-Q368 PolarHBondContact O-N 2.77Å
365	L	98.3	Very high	96.3	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-71.2	-35.6	179.9	-73.2	164	0	0	0	112.5	I361 A362 G367 Q368 L369 A595 T598 A599 A647 L648	I361-L365 HydrophobicContact CG2-CD1 4.02Å; I361-L365 PolarHBondContact O-N 3.38Å; A362-L365 PolarHBondContact O-N 3.06Å; L365-G367 VanDerWaalsContact C-N 3.33Å; L365-Q368 PolarHBondContact O-N 2.92Å; L365-L369 WeakPolarHBondContact O-CB 3.41Å; L365-L369 PolarHBondContact O-N 3.26Å; L365-A595 HydrophobicContact CD1-CB 3.83Å; L365-T598 HydrophobicContact CB-CG2 4.08Å; L365-A599 HydrophobicContact CD1-CB 4.31Å; L365-A599 HydrophobicContact CD2-CB 4.43Å; L365-A647 HydrophobicContact CD2-CB 4.08Å; L365-L648 HydrophobicContact CD1-CD2 4.08Å
366	L	98.1	Very high	96.6	Very high	20 Å²	20	33 Å²	33	11%	0.105	19%	0.185	C	C	.	.	H	α-helix	trans	-64.3	-36.8	169.3	-68.6	169.3	0	0	0	112	A362 L369 Q370 L376 I450 L594	A362-L366 WeakPolarHBondContact O-CB 3.34Å; A362-L366 WeakPolarHBondContact O-CD1 3.48Å; A362-L366 VanDerWaalsContact O-CG 3.22Å; A362-L366 WeakPolarHBondContact O-CG 3.46Å; A362-L366 PolarHBondContact O-N 3.41Å; L366-L369 WeakPolarHBondContact O-CB 3.5Å; L366-L369 PolarHBondContact O-N 3.07Å; L366-Q370 WeakPolarHBondContact O-CB 3.06Å; L366-Q370 PolarHBondContact O-N 3.46Å; L366-L376 HydrophobicContact CD2-CB 4Å; L366-L376 HydrophobicContact CD2-CD2 4.04Å; L366-I450 HydrophobicContact CD1-CB 4.05Å; L366-I450 HydrophobicContact CD1-CD1 4.29Å; L366-L594 HydrophobicContact CD1-CD2 3.99Å
367	G	97.1	Very high	97	Very high	22 Å²	22	34.3 Å²	34.3	23%	0.227	19%	0.191	C	C	.	.	H	α-helix	trans	-63.9	-41.2	172.4	0	0	0	0	0	113	K363 Q364 L365 Q370 S371	K363-G367 PolarHBondContact O-N 3.37Å; Q364-G367 PolarHBondContact O-N 2.7Å; L365-G367 VanDerWaalsContact C-N 3.33Å; G367-Q370 PolarHBondContact O-N 2.95Å; G367-S371 WeakPolarHBondContact O-CB 3.49Å; G367-S371 PolarHBondContact O-N 3.48Å
368	Q	96.4	Very high	97.1	Very high	70 Å²	70	34.1 Å²	34.1	33%	0.327	19%	0.19	S	C	.	.	H	α-helix	trans	-61.1	-44.4	171.5	-70.3	-174.3	41.5	0	0	111.5	Q364 L365 Q370 S371 L372 L602	Q364-Q368 PolarHBondContact O-N 2.77Å; L365-Q368 PolarHBondContact O-N 2.92Å; Q368-Q370 PolarHBondContact O-N 3.15Å; Q368-S371 PolarHBondContact O-N 3Å; Q368-S371 PolarHBondContact O-OG 3.12Å; Q368-L372 PolarHBondContact O-N 3.03Å; Q368-L602 HydrophobicContact CB-CD2 4.26Å
369	L	96.3	Very high	97.2	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-59.6	-45.9	178.3	-169.6	67	0	0	0	111.4	L365 L366 S371 L372 F374 L376 L492 W518 T598 L602	L365-L369 WeakPolarHBondContact O-CB 3.41Å; L365-L369 PolarHBondContact O-N 3.26Å; L366-L369 WeakPolarHBondContact O-CB 3.5Å; L366-L369 PolarHBondContact O-N 3.07Å; L369-S371 PolarHBondContact O-N 3.17Å; L369-L372 PolarHBondContact O-N 3.49Å; L369-F374 CarbonylContact C-O 3.4Å; L369-F374 HydrophobicContact CD1-CB 3.85Å; L369-F374 HydrophobicContact CD1-CD2 4.12Å; L369-F374 HydrophobicContact CD1-CG 4.41Å; L369-F374 HydrophobicContact CG-CB 3.86Å; L369-F374 PolarHBondContact O-N 3.01Å; L369-L376 HydrophobicContact CD2-CB 3.69Å; L369-L492 HydrophobicContact CD1-CD1 4.07Å; L369-L492 HydrophobicContact CD2-CD1 4.04Å; L369-L492 HydrophobicContact CG-CD1 4.4Å; L369-W518 HydrophobicContact CD1-CH2 4.38Å; L369-W518 HydrophobicContact CD1-CZ3 3.93Å; L369-W518 HydrophobicContact CD2-CH2 4.5Å; L369-T598 HydrophobicContact CB-CG2 4.24Å; L369-T598 HydrophobicContact CD2-CG2 4.11Å; L369-L602 HydrophobicContact CD1-CD1 3.91Å; L369-L602 HydrophobicContact CD1-CD2 4.45Å
370	Q	96	Very high	97.2	Very high	125 Å²	125	34.5 Å²	34.5	58%	0.584	19%	0.192	S	C	*	.	H	α-helix	trans	-64.1	-38.7	176.2	-166	174	38.6	0	0	112.7	L366 G367 Q368 L372 G373 F374	L366-Q370 WeakPolarHBondContact O-CB 3.06Å; L366-Q370 PolarHBondContact O-N 3.46Å; G367-Q370 PolarHBondContact O-N 2.95Å; Q368-Q370 PolarHBondContact O-N 3.15Å; Q370-L372 PolarHBondContact O-N 2.74Å; Q370-G373 PolarHBondContact O-N 2.74Å; Q370-F374 VanDerWaalsContact CA-O 3.22Å; Q370-F374 WeakPolarHBondContact CA-O 3.43Å; Q370-F374 PolarHBondContact N-O 3.43Å
371	S	95.6	Very high	97.1	Very high	84 Å²	84	33.9 Å²	33.9	59%	0.587	19%	0.19	S	C	*	.	H	α-helix	trans	-64.1	-21	176.7	77.4	0	0	0	0	113.6	G367 Q368 L369	G367-S371 WeakPolarHBondContact O-CB 3.49Å; G367-S371 PolarHBondContact O-N 3.48Å; Q368-S371 PolarHBondContact O-N 3Å; Q368-S371 PolarHBondContact O-OG 3.12Å; L369-S371 PolarHBondContact O-N 3.17Å
372	L	94.6	Very high	97.1	Very high	84 Å²	84	34 Å²	34	44%	0.44	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	12	176.7	-69.8	165.8	0	0	0	113.1	Q368 L369 Q370 F374 L602	Q368-L372 PolarHBondContact O-N 3.03Å; L369-L372 PolarHBondContact O-N 3.49Å; Q370-L372 PolarHBondContact O-N 2.74Å; L372-F374 HydrophobicContact CB-CD2 3.99Å; L372-F374 HydrophobicContact CB-CE2 4.17Å; L372-L602 HydrophobicContact CD1-CD1 3.79Å; L372-L602 HydrophobicContact CD1-CD2 4.23Å; L372-L602 HydrophobicContact CD1-CG 4.38Å
373	G	95.4	Very high	96.8	Very high	37 Å²	37	35.7 Å²	35.7	38%	0.381	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.4	12.3	174.1	0	0	0	0	0	115.1	Q370 A495	Q370-G373 PolarHBondContact O-N 2.74Å; G373-A495 PolarHBondContact O-N 2.63Å
374	F	96.8	Very high	96.4	Very high	35 Å²	35	33.3 Å²	33.3	15%	0.154	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	150.8	-174.4	-55	-58.3	0	0	0	113.2	L369 Q370 L372 L492 W493 L501 I514 I605	L369-F374 CarbonylContact C-O 3.4Å; L369-F374 HydrophobicContact CD1-CB 3.85Å; L369-F374 HydrophobicContact CD1-CD2 4.12Å; L369-F374 HydrophobicContact CD1-CG 4.41Å; L369-F374 HydrophobicContact CG-CB 3.86Å; L369-F374 PolarHBondContact O-N 3.01Å; Q370-F374 VanDerWaalsContact CA-O 3.22Å; Q370-F374 WeakPolarHBondContact CA-O 3.43Å; Q370-F374 PolarHBondContact N-O 3.43Å; L372-F374 HydrophobicContact CB-CD2 3.99Å; L372-F374 HydrophobicContact CB-CE2 4.17Å; F374-L492 HydrophobicContact CB-CD1 3.93Å; F374-L492 HydrophobicContact CB-CD2 4.4Å; F374-L492 HydrophobicContact CB-CG 4.22Å; F374-L492 HydrophobicContact CD1-CD2 3.92Å; F374-L492 HydrophobicContact CD1-CG 4.34Å; F374-L492 HydrophobicContact CE1-CD2 4.31Å; F374-L492 HydrophobicContact CG-CD1 4.47Å; F374-L492 HydrophobicContact CG-CD2 4.08Å; F374-L492 HydrophobicContact CG-CG 4.41Å; F374-W493 CarbonylContact C-O 3.57Å; F374-W493 WeakPolarHBondContact CA-O 3.32Å; F374-L501 HydrophobicContact CD1-CD1 3.5Å; F374-L501 HydrophobicContact CE1-CD1 3.8Å; F374-I514 HydrophobicContact CE1-CD1 4.43Å; F374-I514 HydrophobicContact CE1-CG1 4.36Å; F374-I514 HydrophobicContact CZ-CD1 4Å; F374-I514 HydrophobicContact CZ-CG1 4.39Å; F374-I605 HydrophobicContact CE2-CD1 4.2Å; F374-I605 HydrophobicContact CE2-CG2 4.36Å; F374-I605 HydrophobicContact CZ-CD1 4.43Å
375	S	96.9	Very high	95.9	Very high	22 Å²	22	29 Å²	29	15%	0.154	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	139	170.7	-167.2	0	0	0	0	110.1	F448 W493 D494	S375-F448 VanDerWaalsContact OG-CD1 3.29Å; S375-F448 WeakPolarHBondContact OG-CD1 3.36Å; S375-W493 PolarHBondContact N-O 2.63Å; S375-W493 PolarHBondContact O-N 3.28Å; S375-D494 VanDerWaalsContact CB-O 3.24Å; S375-D494 WeakPolarHBondContact CB-O 3.28Å
376	L	97.8	Very high	95.1	Very high	2 Å²	2	29 Å²	29	1%	0.01	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	126.8	176.2	-169	65.7	0	0	0	109.7	L366 L369 F448 G449 H490 W518 L594	L366-L376 HydrophobicContact CD2-CB 4Å; L366-L376 HydrophobicContact CD2-CD2 4.04Å; L369-L376 HydrophobicContact CD2-CB 3.69Å; L376-F448 WeakPolarHBondContact O-CA 3.46Å; L376-G449 PolarHBondContact O-N 2.92Å; L376-H490 HydrophobicContact CD1-CB 4.16Å; L376-W518 HydrophobicContact CD1-CH2 4.14Å; L376-W518 HydrophobicContact CD1-CZ2 4Å; L376-L594 HydrophobicContact CD2-CD1 3.61Å; L376-L594 HydrophobicContact CD2-CG 4.28Å
377	H	97.5	Very high	94.1	Very high	32 Å²	32	28.8 Å²	28.8	15%	0.148	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	118.4	174.8	-175	-123	0	0	0	108.8	P446 E447 F448 H490 S491 W493	H377-P446 VanDerWaalsContact CE1-CB 3.47Å; H377-P446 WeakPolarHBondContact CE1-CB 3.22Å; H377-E447 WeakPolarHBondContact CA-O 3.5Å; H377-F448 HydrophobicContact CB-CD1 3.83Å; H377-F448 HydrophobicContact CB-CE1 3.61Å; H377-F448 HydrophobicContact CB-CZ 4.12Å; H377-F448 AromaticContact CD2-CD2 3.71Å; H377-F448 AromaticContact CD2-CE1 3.96Å; H377-F448 AromaticContact CD2-CE2 3.61Å; H377-F448 AromaticContact CD2-CG 3.92Å; H377-F448 AromaticContact CD2-CZ 3.75Å; H377-H490 CarbonylContact O-C 3.47Å; H377-H490 WeakPolarHBondContact O-CA 3.3Å; H377-S491 PolarHBondContact N-O 3.11Å; H377-S491 PolarHBondContact O-N 2.9Å; H377-S491 PolarHBondContact O-OG 2.78Å; H377-W493 VanDerWaalsContact CB-CD1 3.46Å; H377-W493 HydrophobicContact CB-CG 4.38Å; H377-W493 AromaticContact CG-NE1 3.93Å; H377-W493 AromaticContact ND1-NE1 3.79Å
378	S	97.7	Very high	92.9	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.007	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	151.1	-166.6	55	0	0	0	0	114.3	P446 E447 A452 S489	S378-P446 WeakPolarHBondContact O-CA 3.48Å; S378-E447 PolarHBondContact N-O 2.82Å; S378-E447 PolarHBondContact O-N 3.41Å; S378-A452 WeakPolarHBondContact O-CB 3.44Å; S378-A452 WeakPolarHBondContact OG-CB 3.45Å; S378-S489 CarbonylContact C-O 3.52Å; S378-S489 WeakPolarHBondContact CA-O 3.36Å; S378-S489 WeakPolarHBondContact CB-O 3.04Å
379	S	97.1	Very high	91.3	Very high	9 Å²	9	27 Å²	27	6%	0.063	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	157.2	170.4	47.6	0	0	0	0	111.2	L444 S489	S379-L444 WeakPolarHBondContact CB-O 3.35Å; S379-S489 PolarHBondContact N-O 2.72Å; S379-S489 PolarHBondContact O-N 2.98Å
380	F	98.1	Very high	89.2	Confident	3 Å²	3	29.6 Å²	29.6	1%	0.013	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	134.8	166.5	-72.3	-95.5	0	0	0	110.2	Y382 L444 A452 A453 A456 V487 L488 P590 V593	F380-Y382 HydrophobicContact CB-CD2 4.25Å; F380-Y382 HydrophobicContact CB-CE2 3.74Å; F380-Y382 HydrophobicContact CD1-CE1 4.49Å; F380-Y382 HydrophobicContact CD1-CE2 4.42Å; F380-Y382 AromaticContact CD1-CZ 3.91Å; F380-Y382 WeakPolarHBondContact CD1-OH 3.5Å; F380-Y382 HydrophobicContact CG-CE2 4.29Å; F380-L444 HydrophobicContact CB-CD1 4.43Å; F380-L444 WeakPolarHBondContact O-CB 3.41Å; F380-L444 PolarHBondContact O-N 3.37Å; F380-A452 WeakPolarHBondContact CD2-O 3.39Å; F380-A453 HydrophobicContact CE2-CB 4.36Å; F380-A456 HydrophobicContact CB-CB 4.07Å; F380-A456 HydrophobicContact CD1-CB 4.43Å; F380-A456 HydrophobicContact CD2-CB 3.47Å; F380-A456 VanDerWaalsContact CD2-CB 3.47Å; F380-A456 HydrophobicContact CE2-CB 3.96Å; F380-A456 HydrophobicContact CG-CB 3.74Å; F380-V487 WeakPolarHBondContact CA-O 3.35Å; F380-L488 HydrophobicContact CD1-CD1 4.29Å; F380-L488 HydrophobicContact CD2-CD1 4.15Å; F380-L488 HydrophobicContact CE1-CB 4.49Å; F380-L488 HydrophobicContact CE1-CD1 3.93Å; F380-L488 HydrophobicContact CE2-CD1 3.78Å; F380-L488 HydrophobicContact CG-CD1 4.4Å; F380-L488 HydrophobicContact CZ-CD1 3.66Å; F380-P590 HydrophobicContact CE1-CB 3.89Å; F380-P590 HydrophobicContact CE2-CB 4.1Å; F380-P590 HydrophobicContact CZ-CB 3.64Å; F380-P590 WeakPolarHBondContact CZ-O 3.49Å; F380-V593 HydrophobicContact CE1-CB 4.01Å; F380-V593 HydrophobicContact CE1-CG1 3.97Å; F380-V593 HydrophobicContact CZ-CB 4.41Å
381	T	97.4	Very high	86.9	Confident	15 Å²	15	31 Å²	31	9%	0.092	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	123.8	166.1	-59.1	0	0	0	0	108.2	E441 I442 N443 G486 V487	T381-E441 HydrophobicContact CG2-CG 3.6Å; T381-I442 WeakPolarHBondContact CA-O 3.33Å; T381-N443 WeakPolarHBondContact CB-OD1 3.12Å; T381-N443 WeakPolarHBondContact CG2-OD1 3.49Å; T381-N443 PolarHBondContact OG1-OD1 3.03Å; T381-G486 CarbonylContact O-C 3.54Å; T381-G486 WeakPolarHBondContact O-CA 3.35Å; T381-V487 PolarHBondContact N-O 3.5Å; T381-V487 PolarHBondContact O-N 2.85Å
382	Y	96.4	Very high	84.4	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.008	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	126.6	-179.8	-72.9	-61.5	0	0	0	111.3	F380 I442 A456 F459 R460 F476 A586	F380-Y382 HydrophobicContact CB-CD2 4.25Å; F380-Y382 HydrophobicContact CB-CE2 3.74Å; F380-Y382 HydrophobicContact CD1-CE1 4.49Å; F380-Y382 HydrophobicContact CD1-CE2 4.42Å; F380-Y382 AromaticContact CD1-CZ 3.91Å; F380-Y382 WeakPolarHBondContact CD1-OH 3.5Å; F380-Y382 HydrophobicContact CG-CE2 4.29Å; Y382-I442 PolarHBondContact N-O 3.37Å; Y382-I442 PolarHBondContact O-N 2.81Å; Y382-A456 HydrophobicContact CE2-CB 3.9Å; Y382-F459 AromaticContact CD2-CD1 3.83Å; Y382-F459 HydrophobicContact CD2-CD1 3.83Å; Y382-F459 AromaticContact CD2-CE1 3.98Å; Y382-F459 HydrophobicContact CD2-CE1 3.98Å; Y382-F459 HydrophobicContact CE2-CD1 4.41Å; Y382-R460 HydrophobicContact CD2-CG 4.46Å; Y382-R460 HydrophobicContact CE2-CG 3.96Å; Y382-F476 HydrophobicContact CG-CE1 4.21Å; Y382-A586 HydrophobicContact CD1-CB 3.74Å; Y382-A586 HydrophobicContact CE1-CB 4.4Å
383	E	93.5	Very high	82	Confident	36 Å²	36	38.3 Å²	38.3	17%	0.168	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	139.5	155.3	-64.7	176.2	150.6	0	0	109.1	A434 Q439 M440 N484 A485 A586	E383-A434 HydrophobicContact CG-CB 4.41Å; E383-Q439 HydrophobicContact CB-CG 4.45Å; E383-Q439 PolarHBondContact OE2-NE2 3.35Å; E383-M440 CarbonylContact C-O 3.6Å; E383-M440 VanDerWaalsContact CA-O 3.28Å; E383-M440 WeakPolarHBondContact CA-O 3.24Å; E383-N484 HydrophobicContact CB-CB 4.21Å; E383-N484 WeakPolarHBondContact O-CB 3.44Å; E383-N484 PolarHBondContact O-OD1 3.24Å; E383-A485 HydrophobicContact CG-CB 4.14Å; E383-A485 PolarHBondContact N-O 2.96Å; E383-A485 VanDerWaalsContact OE2-CB 3.23Å; E383-A485 WeakPolarHBondContact OE2-CB 3.48Å; E383-A485 PolarHBondContact OE2-N 2.84Å; E383-A586 VanDerWaalsContact O-CB 3.3Å; E383-A586 WeakPolarHBondContact O-CB 3.49Å
384	C	89.6	Confident	79.6	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	151.3	170.8	75.5	0	0	0	0	111.8	Q439 M440 I442 S475 F476 N484	C384-Q439 CarbonylContact O-C 3.5Å; C384-Q439 WeakPolarHBondContact O-CA 3.4Å; C384-M440 PolarHBondContact N-O 3.07Å; C384-M440 PolarHBondContact O-N 3.29Å; C384-I442 VanDerWaalsContact SG-CD1 3.5Å; C384-S475 CarbonylContact C-O 3.6Å; C384-S475 WeakPolarHBondContact CA-O 3.32Å; C384-S475 WeakPolarHBondContact CB-O 3.38Å; C384-F476 HydrophobicContact CB-CD1 3.38Å; C384-F476 HydrophobicContact CB-CE1 3.46Å; C384-F476 VanDerWaalsContact CB-CE1 3.46Å; C384-F476 HydrophobicContact CB-CG 4.16Å; C384-F476 HydrophobicContact CB-CZ 4.24Å; C384-N484 WeakPolarHBondContact CA-OD1 3.34Å; C384-N484 PolarHBondContact N-OD1 3.49Å
385	C	86.4	Confident	77	Confident	7 Å²	7	44.2 Å²	44.2	5%	0.047	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	121.5	174.2	-47.1	0	0	0	0	109.2	L387 A474 S475 L482 N484	C385-L387 HydrophobicContact CB-CG 4.33Å; C385-A474 CarbonylContact O-C 3.55Å; C385-A474 WeakPolarHBondContact O-CA 3.47Å; C385-S475 PolarHBondContact N-O 3.4Å; C385-S475 PolarHBondContact O-N 3.5Å; C385-L482 WeakPolarHBondContact SG-CD2 3.16Å; C385-N484 PolarHBondContact SG-ND2 3.37Å
386	V	82.2	Confident	74.2	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	124.4	164.2	-178.4	0	0	0	0	107.1	L405 F413 G438 M440 Y472 I473 A474	V386-L405 HydrophobicContact CB-CD1 3.59Å; V386-L405 HydrophobicContact CG1-CD1 3.63Å; V386-L405 VanDerWaalsContact O-CD1 3.23Å; V386-L405 WeakPolarHBondContact O-CD1 3.37Å; V386-F413 HydrophobicContact CG1-CE1 4.12Å; V386-G438 PolarHBondContact N-O 2.87Å; V386-M440 HydrophobicContact CG2-CG 4.33Å; V386-Y472 HydrophobicContact CG1-CD1 4.15Å; V386-Y472 HydrophobicContact CG1-CG 4.09Å; V386-I473 WeakPolarHBondContact CA-O 3.16Å; V386-A474 HydrophobicContact CG2-CB 4.4Å
387	L	77.3	Confident	71.5	Confident	17 Å²	17	56.3 Å²	56.3	9%	0.089	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	140.9	-173.1	-60.3	173.4	0	0	0	109.9	C385 A389 F400 Y472 I473	C385-L387 HydrophobicContact CB-CG 4.33Å; L387-A389 PolarHBondContact O-N 2.95Å; L387-F400 HydrophobicContact CD1-CD1 3.68Å; L387-F400 HydrophobicContact CD1-CE1 3.69Å; L387-F400 HydrophobicContact CD2-CD1 4.06Å; L387-Y472 CarbonylContact O-C 3.52Å; L387-Y472 WeakPolarHBondContact O-CA 3.45Å; L387-Y472 WeakPolarHBondContact O-CB 3.19Å; L387-I473 PolarHBondContact N-O 2.84Å; L387-I473 PolarHBondContact O-N 3.49Å
388	G	71.3	Confident	68.8	Low	22 Å²	22	59.5 Å²	59.5	23%	0.227	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	128.9	171.7	0	0	0	0	0	111	P390	G388-P390 VanDerWaalsContact O-CD 3.24Å; G388-P390 WeakPolarHBondContact O-CD 3.46Å
389	A	63.3	Low	65.9	Low	31 Å²	31	65.2 Å²	65.2	26%	0.256	36%	0.355	S	S	.	.			trans	-89	109.5	178.3	0	0	0	0	0	109.6	L387 D391 S471 I473	L387-A389 PolarHBondContact O-N 2.95Å; A389-D391 PolarHBondContact O-N 3.34Å; A389-S471 WeakPolarHBondContact CA-O 3.36Å; A389-S471 VanDerWaalsContact CB-O 3.24Å; A389-S471 WeakPolarHBondContact CB-O 3.48Å; A389-S471 PolarHBondContact N-O 2.75Å; A389-I473 HydrophobicContact CB-CD1 4.13Å; A389-I473 HydrophobicContact CB-CG1 4Å
390	P	53.3	Low	63.2	Low	56 Å²	56	70.8 Å²	70.8	36%	0.364	38%	0.378	S	S	.	.			trans	-64.2	136.5	172.9	25.2	-33	0	0	0	110.7	G388 R392 I393	G388-P390 VanDerWaalsContact O-CD 3.24Å; G388-P390 WeakPolarHBondContact O-CD 3.46Å; P390-R392 PolarHBondContact O-N 3.22Å; P390-I393 HydrophobicContact CB-CD1 3.89Å; P390-I393 HydrophobicContact CB-CG1 4.14Å; P390-I393 HydrophobicContact CG-CD1 3.34Å; P390-I393 HydrophobicContact CG-CG1 3.74Å
391	D	46.1	Very low	60.5	Low	155 Å²	155	73.3 Å²	73.3	83%	0.829	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	107.9	177.5	-101.8	-42.6	0	0	0	110.6	A389	A389-D391 PolarHBondContact O-N 3.34Å
392	R	44.8	Very low	57.8	Low	243 Å²	243	75.7 Å²	75.7	92%	0.917	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	83.5	-177.9	-50	173.7	177.1	-172	-1.5	115	P390	P390-R392 PolarHBondContact O-N 3.22Å
393	I	43.1	Very low	55.3	Low	78 Å²	78	79.4 Å²	79.4	40%	0.4	44%	0.439	S	S	.	.			trans	-121.3	140.1	150.6	-49	-176.9	0	0	0	110.6	P390 T397 L399	P390-I393 HydrophobicContact CB-CD1 3.89Å; P390-I393 HydrophobicContact CB-CG1 4.14Å; P390-I393 HydrophobicContact CG-CD1 3.34Å; P390-I393 HydrophobicContact CG-CG1 3.74Å; I393-T397 VanDerWaalsContact CG2-O 3.31Å; I393-T397 WeakPolarHBondContact CG2-O 3.39Å; I393-L399 HydrophobicContact CD1-CD1 4.33Å
394	G	44.9	Very low	53.1	Low	51 Å²	51	82.2 Å²	82.2	53%	0.526	46%	0.459	S	S	.	.			trans	-71.3	172.3	173.9	0	0	0	0	0	112.9	K396	G394-K396 PolarHBondContact O-N 3Å
395	P	43.1	Very low	51.2	Low	145 Å²	145	82.5 Å²	82.5	94%	0.942	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	18.3	-166.8	30.1	-37.9	0	0	0	116.2
396	K	38.2	Very low	49.6	Very low	199 Å²	199	87.8 Å²	87.8	87%	0.865	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.5	3.4	-176.2	-69.8	-161.9	172.4	-165.3	0	115.5	G394	G394-K396 PolarHBondContact O-N 3Å
397	T	40.2	Very low	48.3	Very low	80 Å²	80	90.1 Å²	90.1	49%	0.491	50%	0.504	S	S	.	.			trans	-148.8	69.8	-179	-32.5	0	0	0	0	113.3	I393 L399	I393-T397 VanDerWaalsContact CG2-O 3.31Å; I393-T397 WeakPolarHBondContact CG2-O 3.39Å; T397-L399 VanDerWaalsContact C-N 3.33Å; T397-L399 HydrophobicContact CG2-CD1 3.73Å; T397-L399 PolarHBondContact O-N 3.46Å
398	L	40.8	Very low	47.4	Very low	98 Å²	98	96.5 Å²	96.5	51%	0.513	54%	0.538	S	S	.	.			trans	-71.1	92.3	162.5	-65.4	176	0	0	0	108.7	F400 I473	L398-F400 WeakPolarHBondContact O-CD2 3.28Å; L398-F400 WeakPolarHBondContact O-CE2 3.2Å; L398-I473 HydrophobicContact CD2-CD1 3.74Å
399	L	37.9	Very low	47	Very low	121 Å²	121	102.5 Å²	102.5	63%	0.634	56%	0.56	S	S	*	*			trans	-65.9	134.6	157.7	-80.5	96.5	0	0	0	107.6	I393 T397 P401	I393-L399 HydrophobicContact CD1-CD1 4.33Å; T397-L399 VanDerWaalsContact C-N 3.33Å; T397-L399 HydrophobicContact CG2-CD1 3.73Å; T397-L399 PolarHBondContact O-N 3.46Å; L399-P401 WeakPolarHBondContact O-CD 3.41Å
400	F	40.5	Very low	47.4	Very low	126 Å²	126	101.6 Å²	101.6	55%	0.553	55%	0.551	S	S	*	*			trans	-93.4	102.8	-177.5	-67.4	-100	0	0	0	110.8	L387 L398 A402	L387-F400 HydrophobicContact CD1-CD1 3.68Å; L387-F400 HydrophobicContact CD1-CE1 3.69Å; L387-F400 HydrophobicContact CD2-CD1 4.06Å; L398-F400 WeakPolarHBondContact O-CD2 3.28Å; L398-F400 WeakPolarHBondContact O-CE2 3.2Å; F400-A402 PolarHBondContact O-N 3.04Å
401	P	40	Very low	48.7	Very low	57 Å²	57	103 Å²	103	37%	0.37	56%	0.555	S	S	.	*			trans	-69.3	88.7	157.8	30.2	-33.1	0	0	0	108.2	L399 T403	L399-P401 WeakPolarHBondContact O-CD 3.41Å; P401-T403 PolarHBondContact O-N 3.41Å
402	A	40.3	Very low	50.6	Low	65 Å²	65	99.2 Å²	99.2	54%	0.537	54%	0.538	S	S	.	.			trans	-75.1	62.5	-178.1	0	0	0	0	0	112	F400 P437	F400-A402 PolarHBondContact O-N 3.04Å; A402-P437 HydrophobicContact CB-CB 3.72Å; A402-P437 HydrophobicContact CB-CG 4.41Å
403	T	44.5	Very low	52.6	Low	79 Å²	79	88 Å²	88	49%	0.485	50%	0.496	S	S	.	.			trans	-96.4	133	178.8	50.2	0	0	0	0	111.6	P401 L405	P401-T403 PolarHBondContact O-N 3.41Å; T403-L405 PolarHBondContact O-N 3.13Å; T403-L405 VanDerWaalsContact O-N 3.12Å
404	T	47	Very low	54.7	Low	96 Å²	96	85.1 Å²	85.1	59%	0.589	48%	0.481	S	S	*	.			trans	-69.9	104.9	175.4	-43.5	0	0	0	0	110.4	L406	T404-L406 PolarHBondContact O-N 2.72Å
405	L	50.8	Low	56.9	Low	5 Å²	5	87.8 Å²	87.8	3%	0.026	48%	0.48	C	S	.	.	S	Bend	trans	-71.5	15.9	-170.2	-65.7	175.1	0	0	0	116.1	V386 T403 S407 D410 F414 M440 Y472	V386-L405 HydrophobicContact CB-CD1 3.59Å; V386-L405 HydrophobicContact CG1-CD1 3.63Å; V386-L405 VanDerWaalsContact O-CD1 3.23Å; V386-L405 WeakPolarHBondContact O-CD1 3.37Å; T403-L405 PolarHBondContact O-N 3.13Å; T403-L405 VanDerWaalsContact O-N 3.12Å; L405-S407 PolarHBondContact O-N 3.04Å; L405-D410 HydrophobicContact CB-CB 4.44Å; L405-D410 HydrophobicContact CD2-CB 4.25Å; L405-F414 HydrophobicContact CB-CE2 4.06Å; L405-F414 HydrophobicContact CB-CZ 4.22Å; L405-F414 HydrophobicContact CD1-CZ 4.35Å; L405-M440 HydrophobicContact CB-CE 4.24Å; L405-Y472 HydrophobicContact CD2-CE1 4.17Å
406	L	53.1	Low	59.3	Low	118 Å²	118	84.6 Å²	84.6	62%	0.618	45%	0.452	S	S	*	.			trans	-94.3	47.8	163.5	-89.7	74.3	0	0	0	110.2	T404 M440	T404-L406 PolarHBondContact O-N 2.72Å; L406-M440 HydrophobicContact CD1-CE 4.03Å; L406-M440 HydrophobicContact CD1-SD 4.09Å
407	S	54.1	Low	61.9	Low	50 Å²	50	75.1 Å²	75.1	35%	0.35	41%	0.411	S	S	.	.	S	Bend	trans	-95.2	153.3	163	95	0	0	0	0	109.6	L405 H409 D410	L405-S407 PolarHBondContact O-N 3.04Å; S407-H409 PolarHBondContact O-N 2.85Å; S407-H409 WeakPolarHBondContact OG-CB 3.46Å; S407-H409 PolarHBondContact OG-N 2.62Å; S407-D410 WeakPolarHBondContact CB-OD2 3.49Å; S407-D410 PolarHBondContact O-N 2.92Å; S407-D410 VanDerWaalsContact O-N 3.14Å; S407-D410 PolarHBondContact OG-OD2 3.12Å
408	N	57.9	Low	64.5	Low	152 Å²	152	73.5 Å²	73.5	81%	0.813	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-13.9	178	-72.8	-18.8	0	0	0	113.6
409	H	63.8	Low	67.1	Low	148 Å²	148	73.9 Å²	73.9	69%	0.685	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-34.5	176.8	176	-90.3	0	0	0	112.5	S407 P412	S407-H409 PolarHBondContact O-N 2.85Å; S407-H409 WeakPolarHBondContact OG-CB 3.46Å; S407-H409 PolarHBondContact OG-N 2.62Å; H409-P412 WeakPolarHBondContact O-CD 3.45Å
410	D	72.1	Confident	69.9	Low	12 Å²	12	68.4 Å²	68.4	6%	0.064	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-17	-167.8	-41.2	-56.3	0	0	0	112	L405 S407 F413 F414 Y472	L405-D410 HydrophobicContact CB-CB 4.44Å; L405-D410 HydrophobicContact CD2-CB 4.25Å; S407-D410 WeakPolarHBondContact CB-OD2 3.49Å; S407-D410 PolarHBondContact O-N 2.92Å; S407-D410 VanDerWaalsContact O-N 3.14Å; S407-D410 PolarHBondContact OG-OD2 3.12Å; D410-F413 WeakPolarHBondContact O-CB 3.44Å; D410-F413 PolarHBondContact O-N 3.13Å; D410-F413 VanDerWaalsContact O-N 3.12Å; D410-F414 HydrophobicContact CB-CE2 4.27Å; D410-F414 WeakPolarHBondContact O-CD2 3.47Å; D410-Y472 PolarHBondContact OD1-OH 3.2Å
411	L	78.9	Confident	72.6	Confident	85 Å²	85	62.4 Å²	62.4	45%	0.445	35%	0.349	S	S	.	.	H	α-helix	trans	-50.1	-40.8	177.3	-179.3	62.5	0	0	0	114.9	F413 F414 Q415	L411-F413 VanDerWaalsContact C-N 3.28Å; L411-F413 PolarHBondContact O-N 2.97Å; L411-F414 PolarHBondContact O-N 2.95Å; L411-Q415 HydrophobicContact CD1-CG 4.11Å; L411-Q415 HydrophobicContact CG-CG 4.25Å; L411-Q415 WeakPolarHBondContact O-CG 3.34Å; L411-Q415 PolarHBondContact O-N 2.97Å
412	P	85.9	Confident	75.3	Confident	75 Å²	75	67.1 Å²	67.1	49%	0.487	36%	0.361	S	S	.	.	H	α-helix	trans	-62.1	-32.7	179.2	-23.7	35.6	0	0	0	113.7	H409 Q416	H409-P412 WeakPolarHBondContact O-CD 3.45Å; P412-Q416 PolarHBondContact O-N 3.48Å
413	F	87.3	Confident	77.9	Confident	7 Å²	7	67.8 Å²	67.8	3%	0.031	36%	0.36	C	S	.	.	H	α-helix	trans	-66.2	-45.3	174.8	162.1	-107.2	0	0	0	110.9	V386 D410 L411 Q416 L417 M466 A467 H470 Y472	V386-F413 HydrophobicContact CG1-CE1 4.12Å; D410-F413 WeakPolarHBondContact O-CB 3.44Å; D410-F413 PolarHBondContact O-N 3.13Å; D410-F413 VanDerWaalsContact O-N 3.12Å; L411-F413 VanDerWaalsContact C-N 3.28Å; L411-F413 PolarHBondContact O-N 2.97Å; F413-Q416 PolarHBondContact O-N 3.34Å; F413-L417 HydrophobicContact CZ-CD2 4.44Å; F413-L417 VanDerWaalsContact O-CB 3.3Å; F413-L417 WeakPolarHBondContact O-CB 3.25Å; F413-L417 PolarHBondContact O-N 3.43Å; F413-M466 HydrophobicContact CE2-CB 4.22Å; F413-A467 HydrophobicContact CE2-CB 4.36Å; F413-A467 HydrophobicContact CZ-CB 4.12Å; F413-H470 HydrophobicContact CD2-CB 4.08Å; F413-H470 AromaticContact CD2-CG 3.86Å; F413-H470 AromaticContact CD2-ND1 3.66Å; F413-Y472 HydrophobicContact CB-CE2 4.13Å; F413-Y472 HydrophobicContact CD1-CD2 4.33Å; F413-Y472 HydrophobicContact CD1-CE2 4.34Å; F413-Y472 HydrophobicContact CD2-CD2 4.41Å; F413-Y472 HydrophobicContact CG-CD2 4.2Å; F413-Y472 HydrophobicContact CG-CE2 4.11Å
414	F	88.1	Confident	80.3	Confident	19 Å²	19	64.2 Å²	64.2	8%	0.083	34%	0.338	C	S	.	.	H	α-helix	trans	-68.1	-36.2	178.1	-67.7	-69.8	0	0	0	112.8	L405 D410 L411 L417 V418 I431 M440	L405-F414 HydrophobicContact CB-CE2 4.06Å; L405-F414 HydrophobicContact CB-CZ 4.22Å; L405-F414 HydrophobicContact CD1-CZ 4.35Å; D410-F414 HydrophobicContact CB-CE2 4.27Å; D410-F414 WeakPolarHBondContact O-CD2 3.47Å; L411-F414 PolarHBondContact O-N 2.95Å; F414-L417 HydrophobicContact CD1-CD2 4.31Å; F414-L417 WeakPolarHBondContact O-CB 3.42Å; F414-L417 PolarHBondContact O-N 2.98Å; F414-V418 WeakPolarHBondContact O-CG2 3.36Å; F414-V418 PolarHBondContact O-N 2.84Å; F414-I431 HydrophobicContact CB-CD1 4.44Å; F414-I431 HydrophobicContact CD1-CD1 4.05Å; F414-I431 HydrophobicContact CD1-CG2 4.24Å; F414-I431 HydrophobicContact CE1-CG2 4.4Å; F414-M440 HydrophobicContact CE1-CG 4.03Å; F414-M440 HydrophobicContact CE1-SD 3.97Å; F414-M440 HydrophobicContact CE2-SD 4.37Å; F414-M440 HydrophobicContact CZ-CG 3.96Å; F414-M440 HydrophobicContact CZ-SD 3.58Å; F414-M440 VanDerWaalsContact CZ-SD 3.58Å
415	Q	90.3	Very high	82.5	Confident	107 Å²	107	61 Å²	61	50%	0.5	32%	0.324	S	S	.	.	H	α-helix	trans	-61.1	-52.3	172.6	-74.1	176	-29	0	0	111	L411 L417 V418 D419	L411-Q415 HydrophobicContact CD1-CG 4.11Å; L411-Q415 HydrophobicContact CG-CG 4.25Å; L411-Q415 WeakPolarHBondContact O-CG 3.34Å; L411-Q415 PolarHBondContact O-N 2.97Å; Q415-L417 VanDerWaalsContact C-N 3.26Å; Q415-L417 PolarHBondContact O-N 2.8Å; Q415-V418 PolarHBondContact O-N 3.09Å; Q415-D419 PolarHBondContact O-N 3.25Å
416	Q	92.8	Very high	84.6	Confident	77 Å²	77	60.8 Å²	60.8	36%	0.36	32%	0.323	S	S	.	.	H	α-helix	trans	-62.9	-34.2	178	-163.7	-178.3	31.7	0	0	112.1	P412 F413 S420 M466 H470	P412-Q416 PolarHBondContact O-N 3.48Å; F413-Q416 PolarHBondContact O-N 3.34Å; Q416-S420 WeakPolarHBondContact O-CB 3.41Å; Q416-S420 PolarHBondContact O-N 3.2Å; Q416-S420 PolarHBondContact O-OG 2.95Å; Q416-M466 HydrophobicContact CB-CE 4.25Å; Q416-M466 HydrophobicContact CG-CE 3.9Å; Q416-M466 WeakPolarHBondContact O-CE 3.31Å; Q416-H470 PolarHBondContact OE1-CE1 2.94Å; Q416-H470 PolarHBondContact OE1-NE2 3.38Å
417	L	93.8	Very high	86.7	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-59.5	-49.6	174.4	178.7	66.5	0	0	0	111.2	F413 F414 Q415 S420 M421 I428 I431 I463 M466	F413-L417 HydrophobicContact CZ-CD2 4.44Å; F413-L417 VanDerWaalsContact O-CB 3.3Å; F413-L417 WeakPolarHBondContact O-CB 3.25Å; F413-L417 PolarHBondContact O-N 3.43Å; F414-L417 HydrophobicContact CD1-CD2 4.31Å; F414-L417 WeakPolarHBondContact O-CB 3.42Å; F414-L417 PolarHBondContact O-N 2.98Å; Q415-L417 VanDerWaalsContact C-N 3.26Å; Q415-L417 PolarHBondContact O-N 2.8Å; L417-S420 PolarHBondContact O-N 2.91Å; L417-M421 HydrophobicContact CD1-CE 3.57Å; L417-M421 HydrophobicContact CD1-CG 3.94Å; L417-M421 HydrophobicContact CG-CG 4.44Å; L417-M421 WeakPolarHBondContact O-CB 3.05Å; L417-M421 VanDerWaalsContact O-CG 3.23Å; L417-M421 WeakPolarHBondContact O-CG 3.44Å; L417-M421 PolarHBondContact O-N 3.31Å; L417-I428 HydrophobicContact CG-CD1 4.24Å; L417-I431 HydrophobicContact CD2-CD1 4.41Å; L417-I463 HydrophobicContact CD1-CB 4.06Å; L417-I463 HydrophobicContact CD1-CG1 3.9Å; L417-I463 HydrophobicContact CD2-CD1 3.79Å; L417-I463 HydrophobicContact CD2-CG1 3.93Å; L417-M466 HydrophobicContact CD1-SD 3.9Å
418	V	95.3	Very high	88.7	Confident	47 Å²	47	54.9 Å²	54.9	29%	0.285	29%	0.289	S	S	.	.	H	α-helix	trans	-59.6	-52.8	176.9	172.9	0	0	0	0	110.8	F414 Q415 S420 M421 Y422 I428 I431	F414-V418 WeakPolarHBondContact O-CG2 3.36Å; F414-V418 PolarHBondContact O-N 2.84Å; Q415-V418 PolarHBondContact O-N 3.09Å; V418-S420 VanDerWaalsContact C-N 3.26Å; V418-S420 PolarHBondContact O-N 3.41Å; V418-M421 PolarHBondContact O-N 3.14Å; V418-Y422 WeakPolarHBondContact O-CB 3.43Å; V418-Y422 PolarHBondContact O-N 3.24Å; V418-I428 HydrophobicContact CG2-CB 4.25Å; V418-I428 HydrophobicContact CG2-CD1 4.32Å; V418-I428 HydrophobicContact CG2-CG2 4.22Å; V418-I431 HydrophobicContact CG2-CD1 3.84Å
419	D	95.6	Very high	90.5	Very high	105 Å²	105	50.6 Å²	50.6	56%	0.561	27%	0.265	S	S	*	.	H	α-helix	trans	-57.3	-40.1	179.9	-66.9	-24.8	0	0	0	112.1	Q415 C423	Q415-D419 PolarHBondContact O-N 3.25Å; D419-C423 PolarHBondContact O-N 3.23Å; D419-C423 VanDerWaalsContact O-N 3.15Å; D419-C423 PolarHBondContact O-SG 2.98Å
420	S	96.2	Very high	91.8	Very high	7 Å²	7	45.8 Å²	45.8	5%	0.049	25%	0.249	C	C	.	.	H	α-helix	trans	-77	-36.1	-177.4	-59.2	0	0	0	0	113	Q416 L417 V418 M424 M466	Q416-S420 WeakPolarHBondContact O-CB 3.41Å; Q416-S420 PolarHBondContact O-N 3.2Å; Q416-S420 PolarHBondContact O-OG 2.95Å; L417-S420 PolarHBondContact O-N 2.91Å; V418-S420 VanDerWaalsContact C-N 3.26Å; V418-S420 PolarHBondContact O-N 3.41Å; S420-M424 WeakPolarHBondContact O-CB 3.31Å; S420-M424 WeakPolarHBondContact O-CG 3.37Å; S420-M424 PolarHBondContact O-N 3.37Å; S420-M466 VanDerWaalsContact CB-SD 3.53Å; S420-M466 WeakPolarHBondContact OG-CE 3.47Å
421	M	96.4	Very high	92.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-73.2	-35.4	176.1	-63.9	-57.4	142.7	0	0	111.1	W335 L417 V418 M424 G425 A426 I428 F459 G462 M466	W335-M421 HydrophobicContact CE3-CE 4.18Å; W335-M421 HydrophobicContact CH2-CE 3.64Å; W335-M421 HydrophobicContact CH2-SD 4.13Å; W335-M421 HydrophobicContact CZ3-CE 3.39Å; W335-M421 HydrophobicContact CZ3-SD 4.12Å; L417-M421 HydrophobicContact CD1-CE 3.57Å; L417-M421 HydrophobicContact CD1-CG 3.94Å; L417-M421 HydrophobicContact CG-CG 4.44Å; L417-M421 WeakPolarHBondContact O-CB 3.05Å; L417-M421 VanDerWaalsContact O-CG 3.23Å; L417-M421 WeakPolarHBondContact O-CG 3.44Å; L417-M421 PolarHBondContact O-N 3.31Å; V418-M421 PolarHBondContact O-N 3.14Å; M421-M424 CarbonylContact O-C 3.44Å; M421-M424 WeakPolarHBondContact O-CA 3.37Å; M421-M424 PolarHBondContact O-N 3.25Å; M421-M424 VanDerWaalsContact O-N 3.08Å; M421-G425 PolarHBondContact O-N 2.65Å; M421-G425 VanDerWaalsContact O-N 3.15Å; M421-A426 CarbonylContact C-O 3.57Å; M421-A426 HydrophobicContact CB-CB 4.31Å; M421-A426 VanDerWaalsContact CB-O 3.26Å; M421-A426 WeakPolarHBondContact CB-O 3.38Å; M421-A426 CarbonylContact O-C 3.49Å; M421-A426 PolarHBondContact O-N 2.7Å; M421-I428 HydrophobicContact CB-CD1 3.99Å; M421-I428 HydrophobicContact CB-CG1 4.16Å; M421-I428 HydrophobicContact CG-CD1 4Å; M421-F459 HydrophobicContact CG-CD2 4.23Å; M421-F459 HydrophobicContact SD-CD2 4.46Å; M421-G462 VanDerWaalsContact CE-C 3.43Å; M421-M466 HydrophobicContact CE-CG 4.25Å; M421-M466 HydrophobicContact CE-SD 3.48Å; M421-M466 WeakPolarHBondContact CE-SD 3.33Å
422	Y	96.5	Very high	93.2	Very high	156 Å²	156	45.4 Å²	45.4	61%	0.612	25%	0.252	S	S	*	.	H	α-helix	trans	-56.7	-51.3	169.1	-177.5	-96	0	0	0	111.7	V418 M424 G425 D427	V418-Y422 WeakPolarHBondContact O-CB 3.43Å; V418-Y422 PolarHBondContact O-N 3.24Å; Y422-M424 PolarHBondContact O-N 3.49Å; Y422-M424 VanDerWaalsContact O-N 3.14Å; Y422-G425 PolarHBondContact O-N 2.81Å; Y422-D427 HydrophobicContact CD2-CB 4.39Å
423	C	94.8	Very high	93.2	Very high	78 Å²	78	44.5 Å²	44.5	53%	0.527	25%	0.247	S	C	.	.	H	α-helix	trans	-56.9	-29.5	174.7	-67.6	0	0	0	0	113.4	P334 D419	P334-C423 HydrophobicContact CG-CB 3.73Å; D419-C423 PolarHBondContact O-N 3.23Å; D419-C423 VanDerWaalsContact O-N 3.15Å; D419-C423 PolarHBondContact O-SG 2.98Å
424	M	95.5	Very high	93	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.02	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-2.9	178.5	-76.4	-61.1	-56.4	0	0	114.7	R331 V332 L333 P334 W335 R341 S420 M421 Y422 T458	R331-M424 HydrophobicContact CB-CE 3.68Å; R331-M424 HydrophobicContact CB-SD 3.69Å; R331-M424 HydrophobicContact CG-CE 4.32Å; V332-M424 VanDerWaalsContact O-SD 3.33Å; L333-M424 HydrophobicContact CD2-CE 3.68Å; L333-M424 HydrophobicContact CD2-SD 3.81Å; L333-M424 HydrophobicContact CG-SD 4.46Å; P334-M424 HydrophobicContact CG-CG 4.4Å; W335-M424 HydrophobicContact CH2-CG 3.73Å; W335-M424 HydrophobicContact CZ3-CG 3.75Å; R341-M424 HydrophobicContact CB-CE 4.49Å; S420-M424 WeakPolarHBondContact O-CB 3.31Å; S420-M424 WeakPolarHBondContact O-CG 3.37Å; S420-M424 PolarHBondContact O-N 3.37Å; M421-M424 CarbonylContact O-C 3.44Å; M421-M424 WeakPolarHBondContact O-CA 3.37Å; M421-M424 PolarHBondContact O-N 3.25Å; M421-M424 VanDerWaalsContact O-N 3.08Å; Y422-M424 PolarHBondContact O-N 3.49Å; Y422-M424 VanDerWaalsContact O-N 3.14Å; M424-T458 HydrophobicContact CB-CG2 3.95Å; M424-T458 HydrophobicContact CE-CG2 3.8Å
425	G	92.9	Very high	92.5	Very high	29 Å²	29	49.8 Å²	49.8	30%	0.299	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	37.8	-174.1	0	0	0	0	0	113.1	M421 Y422	M421-G425 PolarHBondContact O-N 2.65Å; M421-G425 VanDerWaalsContact O-N 3.15Å; Y422-G425 PolarHBondContact O-N 2.81Å
426	A	96.3	Very high	91.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.27	C	S	.	.			trans	-129.7	67.4	170.2	0	0	0	0	0	108.9	M421 I428 S455 T458 F459	M421-A426 CarbonylContact C-O 3.57Å; M421-A426 HydrophobicContact CB-CB 4.31Å; M421-A426 VanDerWaalsContact CB-O 3.26Å; M421-A426 WeakPolarHBondContact CB-O 3.38Å; M421-A426 CarbonylContact O-C 3.49Å; M421-A426 PolarHBondContact O-N 2.7Å; A426-I428 PolarHBondContact O-N 3.16Å; A426-S455 WeakPolarHBondContact CA-OG 3.25Å; A426-T458 HydrophobicContact CB-CG2 4.44Å; A426-F459 HydrophobicContact CB-CB 4.44Å
427	D	95.9	Very high	90.9	Very high	32 Å²	32	45.2 Å²	45.2	17%	0.171	28%	0.277	C	S	.	.			trans	-60.4	132.2	-173.1	-170.8	23.4	0	0	0	111.7	Y422 L444 R445	Y422-D427 HydrophobicContact CD2-CB 4.39Å; D427-L444 WeakPolarHBondContact O-CA 3.46Å; D427-R445 HydrophobicContact CB-CB 3.85Å; D427-R445 PolarHBondContact O-N 3.33Å; D427-R445 WeakPolarHBondContact OD2-CD 3.33Å; D427-R445 IonicContact OD2-NH1 3.31Å; D427-R445 PolarHBondContact OD2-NH1 3.48Å
428	I	97.2	Very high	90.1	Very high	13 Å²	13	45.3 Å²	45.3	7%	0.067	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	112.4	-177.8	-63.6	-178	0	0	0	108.4	L417 V418 M421 A426 I431 I442 L444 F459	L417-I428 HydrophobicContact CG-CD1 4.24Å; V418-I428 HydrophobicContact CG2-CB 4.25Å; V418-I428 HydrophobicContact CG2-CD1 4.32Å; V418-I428 HydrophobicContact CG2-CG2 4.22Å; M421-I428 HydrophobicContact CB-CD1 3.99Å; M421-I428 HydrophobicContact CB-CG1 4.16Å; M421-I428 HydrophobicContact CG-CD1 4Å; A426-I428 PolarHBondContact O-N 3.16Å; I428-I431 HydrophobicContact CG2-CD1 4.19Å; I428-I431 HydrophobicContact CG2-CG1 3.73Å; I428-I442 HydrophobicContact CD1-CG2 4.15Å; I428-I442 HydrophobicContact CG1-CG2 4.28Å; I428-I442 HydrophobicContact CG2-CG2 3.79Å; I428-L444 HydrophobicContact CG1-CD2 3.95Å; I428-F459 HydrophobicContact CD1-CD2 4.23Å; I428-F459 HydrophobicContact CD1-CE2 4.02Å
429	D	94.3	Very high	89.6	Confident	61 Å²	61	43.1 Å²	43.1	33%	0.326	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	-37.1	-178.5	179.1	73.7	0	0	0	112	N443 R575	D429-N443 HydrophobicContact CB-CB 4.35Å; D429-N443 PolarHBondContact N-O 3.18Å; D429-R575 IonicContact OD1-NH2 2.74Å; D429-R575 PolarHBondContact OD1-NH2 3.41Å; D429-R575 IonicContact OD2-CZ 2.7Å; D429-R575 IonicContact OD2-NH1 2.77Å; D429-R575 IonicContact OD2-NH2 3.07Å; D429-R575 PolarHBondContact OD2-NH2 2.9Å
430	S	92.4	Very high	89.2	Confident	48 Å²	48	38.1 Å²	38.1	34%	0.336	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	159.4	171.4	52.2	0	0	0	0	113.5	N443	S430-N443 PolarHBondContact N-O 3.49Å; S430-N443 PolarHBondContact O-N 3.01Å; S430-N443 WeakPolarHBondContact OG-CB 3.07Å; S430-N443 PolarHBondContact OG-ND2 3.16Å
431	I	91.3	Very high	89.1	Confident	50 Å²	50	41 Å²	41	26%	0.256	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	134.4	171.1	-56.8	179.6	0	0	0	108	F414 L417 V418 I428 M440 E441 I442	F414-I431 HydrophobicContact CB-CD1 4.44Å; F414-I431 HydrophobicContact CD1-CD1 4.05Å; F414-I431 HydrophobicContact CD1-CG2 4.24Å; F414-I431 HydrophobicContact CE1-CG2 4.4Å; L417-I431 HydrophobicContact CD2-CD1 4.41Å; V418-I431 HydrophobicContact CG2-CD1 3.84Å; I428-I431 HydrophobicContact CG2-CD1 4.19Å; I428-I431 HydrophobicContact CG2-CG1 3.73Å; I431-M440 HydrophobicContact CG2-SD 4.43Å; I431-E441 CarbonylContact C-O 3.42Å; I431-E441 WeakPolarHBondContact CA-O 3.36Å; I431-I442 HydrophobicContact CG1-CG1 4.19Å; I431-I442 HydrophobicContact CG1-CG2 4.28Å; I431-I442 HydrophobicContact CG2-CG1 4.33Å
432	A	88.6	Confident	89.1	Confident	39 Å²	39	41.1 Å²	41.1	32%	0.322	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	162.3	178.3	0	0	0	0	0	111.8	M440 E441	A432-M440 CarbonylContact O-C 3.53Å; A432-M440 VanDerWaalsContact O-CA 3.29Å; A432-M440 WeakPolarHBondContact O-CA 3.48Å; A432-E441 HydrophobicContact CB-CB 4.5Å; A432-E441 PolarHBondContact N-O 2.78Å; A432-E441 PolarHBondContact O-N 2.81Å
433	S	85.8	Confident	89.1	Confident	55 Å²	55	34.9 Å²	34.9	39%	0.385	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	126.3	166.5	-167.7	0	0	0	0	109.7
434	A	84	Confident	89.2	Confident	21 Å²	21	31.2 Å²	31.2	17%	0.174	20%	0.204	C	C	.	.			trans	-84.1	-167.2	168.9	0	0	0	0	0	110.5	E383 Q439	E383-A434 HydrophobicContact CG-CB 4.41Å; A434-Q439 HydrophobicContact CB-CB 4.05Å; A434-Q439 HydrophobicContact CB-CG 3.78Å; A434-Q439 PolarHBondContact N-O 2.97Å
435	S	77.9	Confident	89.2	Confident	117 Å²	117	37.3 Å²	37.3	82%	0.818	23%	0.226	S	C	*	.	S	Bend	trans	-76.2	-30.8	-171.9	63.4	0	0	0	0	115.1	Q439	S435-Q439 PolarHBondContact OG-OE1 3.26Å
436	G	74.6	Confident	89.4	Confident	10 Å²	10	37.3 Å²	37.3	10%	0.103	22%	0.221	C	C	.	.	S	Bend	trans	-82.5	150.1	179.4	0	0	0	0	0	113.8	G438 Q439	G436-G438 PolarHBondContact O-N 2.96Å; G436-Q439 WeakPolarHBondContact O-CB 3.41Å; G436-Q439 PolarHBondContact O-N 3.46Å
437	P	74.3	Confident	89.4	Confident	78 Å²	78	39.6 Å²	39.6	51%	0.506	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	127.2	171.6	-22.1	33.5	0	0	0	111.7	A402 Q439	A402-P437 HydrophobicContact CB-CB 3.72Å; A402-P437 HydrophobicContact CB-CG 4.41Å; P437-Q439 PolarHBondContact O-N 2.88Å
438	G	75.8	Confident	89.4	Confident	2 Å²	2	42.1 Å²	42.1	2%	0.021	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	2.4	-173.3	0	0	0	0	0	114.7	V386 G436	V386-G438 PolarHBondContact N-O 2.87Å; G436-G438 PolarHBondContact O-N 2.96Å
439	Q	85.3	Confident	89.4	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	121.4	176.8	-161.8	-170.7	22.6	0	0	110.1	E383 C384 A434 S435 G436 P437 Y483 N484	E383-Q439 HydrophobicContact CB-CG 4.45Å; E383-Q439 PolarHBondContact OE2-NE2 3.35Å; C384-Q439 CarbonylContact O-C 3.5Å; C384-Q439 WeakPolarHBondContact O-CA 3.4Å; A434-Q439 HydrophobicContact CB-CB 4.05Å; A434-Q439 HydrophobicContact CB-CG 3.78Å; A434-Q439 PolarHBondContact N-O 2.97Å; S435-Q439 PolarHBondContact OG-OE1 3.26Å; G436-Q439 WeakPolarHBondContact O-CB 3.41Å; G436-Q439 PolarHBondContact O-N 3.46Å; P437-Q439 PolarHBondContact O-N 2.88Å; Q439-Y483 PolarHBondContact NE2-O 3.3Å; Q439-N484 PolarHBondContact NE2-OD1 3.47Å
440	M	88.4	Confident	89.6	Confident	1 Å²	1	41 Å²	41	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	137.2	177.7	-59.4	-75.4	98.7	0	0	109.4	E383 C384 V386 L405 L406 F414 I431 A432 I442	E383-M440 CarbonylContact C-O 3.6Å; E383-M440 VanDerWaalsContact CA-O 3.28Å; E383-M440 WeakPolarHBondContact CA-O 3.24Å; C384-M440 PolarHBondContact N-O 3.07Å; C384-M440 PolarHBondContact O-N 3.29Å; V386-M440 HydrophobicContact CG2-CG 4.33Å; L405-M440 HydrophobicContact CB-CE 4.24Å; L406-M440 HydrophobicContact CD1-CE 4.03Å; L406-M440 HydrophobicContact CD1-SD 4.09Å; F414-M440 HydrophobicContact CE1-CG 4.03Å; F414-M440 HydrophobicContact CE1-SD 3.97Å; F414-M440 HydrophobicContact CE2-SD 4.37Å; F414-M440 HydrophobicContact CZ-CG 3.96Å; F414-M440 HydrophobicContact CZ-SD 3.58Å; F414-M440 VanDerWaalsContact CZ-SD 3.58Å; I431-M440 HydrophobicContact CG2-SD 4.43Å; A432-M440 CarbonylContact O-C 3.53Å; A432-M440 VanDerWaalsContact O-CA 3.29Å; A432-M440 WeakPolarHBondContact O-CA 3.48Å; M440-I442 HydrophobicContact CB-CD1 3.76Å
441	E	93	Very high	89.8	Confident	68 Å²	68	40.4 Å²	40.4	32%	0.318	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	131.8	160.8	-173.4	-169.6	99.3	0	0	108.3	T381 I431 A432 N443	T381-E441 HydrophobicContact CG2-CG 3.6Å; I431-E441 CarbonylContact C-O 3.42Å; I431-E441 WeakPolarHBondContact CA-O 3.36Å; A432-E441 HydrophobicContact CB-CB 4.5Å; A432-E441 PolarHBondContact N-O 2.78Å; A432-E441 PolarHBondContact O-N 2.81Å; E441-N443 PolarHBondContact OE1-ND2 3.14Å
442	I	95.7	Very high	90.2	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	120.4	173.6	-57.5	88.2	0	0	0	108.8	T381 Y382 C384 I428 I431 M440 L444 F459	T381-I442 WeakPolarHBondContact CA-O 3.33Å; Y382-I442 PolarHBondContact N-O 3.37Å; Y382-I442 PolarHBondContact O-N 2.81Å; C384-I442 VanDerWaalsContact SG-CD1 3.5Å; I428-I442 HydrophobicContact CD1-CG2 4.15Å; I428-I442 HydrophobicContact CG1-CG2 4.28Å; I428-I442 HydrophobicContact CG2-CG2 3.79Å; I431-I442 HydrophobicContact CG1-CG1 4.19Å; I431-I442 HydrophobicContact CG1-CG2 4.28Å; I431-I442 HydrophobicContact CG2-CG1 4.33Å; M440-I442 HydrophobicContact CB-CD1 3.76Å; I442-L444 HydrophobicContact CG2-CD2 4.36Å; I442-F459 HydrophobicContact CB-CE1 4.32Å; I442-F459 HydrophobicContact CB-CE2 4.4Å; I442-F459 HydrophobicContact CB-CZ 3.73Å; I442-F459 HydrophobicContact CD1-CZ 4.04Å; I442-F459 HydrophobicContact CG1-CE2 4.45Å; I442-F459 HydrophobicContact CG1-CZ 3.82Å; I442-F459 HydrophobicContact CG2-CE1 4.37Å; I442-F459 HydrophobicContact CG2-CE2 3.84Å; I442-F459 HydrophobicContact CG2-CZ 3.66Å
443	N	96.4	Very high	90.6	Very high	25 Å²	25	36.2 Å²	36.2	13%	0.134	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	122.9	174.4	-65.7	-76.1	0	0	0	109.3	T381 D429 S430 E441	T381-N443 WeakPolarHBondContact CB-OD1 3.12Å; T381-N443 WeakPolarHBondContact CG2-OD1 3.49Å; T381-N443 PolarHBondContact OG1-OD1 3.03Å; D429-N443 HydrophobicContact CB-CB 4.35Å; D429-N443 PolarHBondContact N-O 3.18Å; S430-N443 PolarHBondContact N-O 3.49Å; S430-N443 PolarHBondContact O-N 3.01Å; S430-N443 WeakPolarHBondContact OG-CB 3.07Å; S430-N443 PolarHBondContact OG-ND2 3.16Å; E441-N443 PolarHBondContact OE1-ND2 3.14Å
444	L	97.8	Very high	91.2	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.01	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	153.3	170.4	-57.7	-177.6	0	0	0	110.6	S379 F380 D427 I428 I442 A456 F459	S379-L444 WeakPolarHBondContact CB-O 3.35Å; F380-L444 HydrophobicContact CB-CD1 4.43Å; F380-L444 WeakPolarHBondContact O-CB 3.41Å; F380-L444 PolarHBondContact O-N 3.37Å; D427-L444 WeakPolarHBondContact O-CA 3.46Å; I428-L444 HydrophobicContact CG1-CD2 3.95Å; I442-L444 HydrophobicContact CG2-CD2 4.36Å; L444-A456 HydrophobicContact CD1-CB 4.2Å; L444-F459 HydrophobicContact CD1-CB 4.03Å; L444-F459 HydrophobicContact CD1-CD1 4.4Å; L444-F459 HydrophobicContact CD1-CG 4.31Å; L444-F459 HydrophobicContact CD2-CB 4.23Å; L444-F459 HydrophobicContact CD2-CD1 4.42Å; L444-F459 HydrophobicContact CD2-CD2 4.12Å; L444-F459 HydrophobicContact CD2-CG 3.99Å
445	R	96.1	Very high	91.9	Very high	131 Å²	131	33.5 Å²	33.5	49%	0.494	19%	0.188	S	C	.	.	P	Polyproline II helix	trans	-63.1	140.7	175	-164.8	-171.2	-165	83.6	12.9	111	D427	D427-R445 HydrophobicContact CB-CB 3.85Å; D427-R445 PolarHBondContact O-N 3.33Å; D427-R445 WeakPolarHBondContact OD2-CD 3.33Å; D427-R445 IonicContact OD2-NH1 3.31Å; D427-R445 PolarHBondContact OD2-NH1 3.48Å
446	P	95.7	Very high	92.8	Very high	30 Å²	30	28 Å²	28	20%	0.195	15%	0.149	C	C	.	.	P	Polyproline II helix	trans	-61.6	137.3	168.9	-25.1	34.9	0	0	0	113	H377 S378	H377-P446 VanDerWaalsContact CE1-CB 3.47Å; H377-P446 WeakPolarHBondContact CE1-CB 3.22Å; S378-P446 WeakPolarHBondContact O-CA 3.48Å
447	E	96.9	Very high	93.9	Very high	47 Å²	47	27.5 Å²	27.5	22%	0.22	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	162.8	176.4	-65.3	-172.7	159.8	0	0	111.2	H377 S378 A451 A452	H377-E447 WeakPolarHBondContact CA-O 3.5Å; S378-E447 PolarHBondContact N-O 2.82Å; S378-E447 PolarHBondContact O-N 3.41Å; E447-A451 HydrophobicContact CB-CB 4.16Å; E447-A451 WeakPolarHBondContact OE2-CB 3.48Å; E447-A452 HydrophobicContact CB-CB 4.25Å; E447-A452 PolarHBondContact OE2-N 3.3Å
448	F	97.2	Very high	95	Very high	85 Å²	85	24 Å²	24	37%	0.373	12%	0.122	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	135.5	178.6	-76.3	-79.3	0	0	0	112.8	S375 L376 H377 W493	S375-F448 VanDerWaalsContact OG-CD1 3.29Å; S375-F448 WeakPolarHBondContact OG-CD1 3.36Å; L376-F448 WeakPolarHBondContact O-CA 3.46Å; H377-F448 HydrophobicContact CB-CD1 3.83Å; H377-F448 HydrophobicContact CB-CE1 3.61Å; H377-F448 HydrophobicContact CB-CZ 4.12Å; H377-F448 AromaticContact CD2-CD2 3.71Å; H377-F448 AromaticContact CD2-CE1 3.96Å; H377-F448 AromaticContact CD2-CE2 3.61Å; H377-F448 AromaticContact CD2-CG 3.92Å; H377-F448 AromaticContact CD2-CZ 3.75Å; F448-W493 HydrophobicContact CE1-CB 4.14Å; F448-W493 HydrophobicContact CE1-CD2 4.37Å; F448-W493 AromaticContact CE1-CG 3.98Å; F448-W493 HydrophobicContact CE1-CG 3.98Å; F448-W493 HydrophobicContact CZ-CD2 4.28Å; F448-W493 HydrophobicContact CZ-CG 4.36Å
449	G	96.1	Very high	96	Very high	15 Å²	15	24 Å²	24	16%	0.155	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	-135.3	171.1	0	0	0	0	0	114	L376 A451	L376-G449 PolarHBondContact O-N 2.92Å; G449-A451 PolarHBondContact O-N 3.01Å
450	I	97.9	Very high	96.4	Very high	36 Å²	36	24.6 Å²	24.6	19%	0.185	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-23.5	-171.3	-164.4	63.4	0	0	0	113	R359 A362 K363 L366 A452 A453 D454 Y591	R359-I450 HydrophobicContact CG-CD1 4.29Å; R359-I450 HydrophobicContact CG-CG1 4.44Å; A362-I450 HydrophobicContact CB-CD1 3.64Å; K363-I450 HydrophobicContact CG-CB 4.32Å; K363-I450 HydrophobicContact CG-CD1 3.96Å; K363-I450 HydrophobicContact CG-CG1 3.86Å; L366-I450 HydrophobicContact CD1-CB 4.05Å; L366-I450 HydrophobicContact CD1-CD1 4.29Å; I450-A452 VanDerWaalsContact C-N 3.29Å; I450-A452 PolarHBondContact O-N 3.18Å; I450-A453 PolarHBondContact O-N 3.33Å; I450-D454 PolarHBondContact O-N 3.38Å; I450-Y591 HydrophobicContact CD1-CD1 3.87Å; I450-Y591 HydrophobicContact CD1-CE1 4.2Å
451	A	97.9	Very high	96.5	Very high	35 Å²	35	25.9 Å²	25.9	29%	0.289	13%	0.131	S	C	.	.	H	α-helix	trans	-58.4	-40.7	-175	0	0	0	0	0	111.7	E447 G449 A453 D454 S455	E447-A451 HydrophobicContact CB-CB 4.16Å; E447-A451 WeakPolarHBondContact OE2-CB 3.48Å; G449-A451 PolarHBondContact O-N 3.01Å; A451-A453 VanDerWaalsContact C-N 3.26Å; A451-A453 PolarHBondContact O-N 2.97Å; A451-D454 CarbonylContact O-C 3.53Å; A451-D454 PolarHBondContact O-N 3.2Å; A451-D454 VanDerWaalsContact O-N 3.1Å; A451-S455 VanDerWaalsContact O-CB 3.25Å; A451-S455 WeakPolarHBondContact O-CB 3.22Å; A451-S455 PolarHBondContact O-N 3.42Å
452	A	98	Very high	96.5	Very high	2 Å²	2	22.7 Å²	22.7	2%	0.017	12%	0.117	C	C	.	.	H	α-helix	trans	-55.9	-36.9	175.3	0	0	0	0	0	113.7	S378 F380 E447 I450 A456	S378-A452 WeakPolarHBondContact O-CB 3.44Å; S378-A452 WeakPolarHBondContact OG-CB 3.45Å; F380-A452 WeakPolarHBondContact CD2-O 3.39Å; E447-A452 HydrophobicContact CB-CB 4.25Å; E447-A452 PolarHBondContact OE2-N 3.3Å; I450-A452 VanDerWaalsContact C-N 3.29Å; I450-A452 PolarHBondContact O-N 3.18Å; A452-A456 WeakPolarHBondContact O-CB 3.16Å; A452-A456 PolarHBondContact O-N 3.36Å; A452-A456 VanDerWaalsContact O-N 3.12Å
453	A	98.3	Very high	96.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-83	-33.8	176.6	0	0	0	0	0	112.8	F380 I450 A451 S455 A456 F457 P590 Y591 L594	F380-A453 HydrophobicContact CE2-CB 4.36Å; I450-A453 PolarHBondContact O-N 3.33Å; A451-A453 VanDerWaalsContact C-N 3.26Å; A451-A453 PolarHBondContact O-N 2.97Å; A453-S455 VanDerWaalsContact C-N 3.34Å; A453-A456 PolarHBondContact O-N 3.21Å; A453-F457 WeakPolarHBondContact O-CB 3.5Å; A453-F457 PolarHBondContact O-N 3.18Å; A453-P590 HydrophobicContact CB-CB 4.3Å; A453-Y591 HydrophobicContact CB-CD1 3.49Å; A453-Y591 VanDerWaalsContact CB-CD1 3.49Å; A453-Y591 HydrophobicContact CB-CE1 3.77Å; A453-Y591 HydrophobicContact CB-CG 4.19Å; A453-L594 HydrophobicContact CB-CD2 3.88Å
454	D	98.4	Very high	96	Very high	16 Å²	16	25.1 Å²	25.1	9%	0.086	13%	0.126	C	C	.	.	H	α-helix	trans	-61.9	-42.8	170.8	-75.2	-23.9	0	0	0	110.9	I343 R359 I450 A451 T458 Y591	I343-D454 HydrophobicContact CD1-CB 3.79Å; R359-D454 IonicContact CZ-OD1 3.16Å; R359-D454 IonicContact CZ-OD2 3.76Å; R359-D454 IonicContact NE-OD1 3.57Å; R359-D454 PolarHBondContact NE-OD1 3.44Å; R359-D454 IonicContact NE-OD2 2.72Å; R359-D454 IonicContact NH2-OD1 3.57Å; R359-D454 PolarHBondContact NH2-OD1 2.86Å; R359-D454 IonicContact NH2-OD2 3.46Å; R359-D454 PolarHBondContact NH2-OD2 3.15Å; I450-D454 PolarHBondContact O-N 3.38Å; A451-D454 CarbonylContact O-C 3.53Å; A451-D454 PolarHBondContact O-N 3.2Å; A451-D454 VanDerWaalsContact O-N 3.1Å; D454-T458 VanDerWaalsContact O-CB 3.29Å; D454-T458 WeakPolarHBondContact O-CB 3.4Å; D454-T458 PolarHBondContact O-N 2.97Å; D454-T458 PolarHBondContact O-OG1 3.4Å; D454-Y591 WeakPolarHBondContact OD1-CE1 3.2Å; D454-Y591 PolarHBondContact OD1-OH 3.22Å
455	S	97.8	Very high	95.6	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-59	-55.1	173	167.2	0	0	0	0	111	A426 A451 A453 F457 T458 F459	A426-S455 WeakPolarHBondContact CA-OG 3.25Å; A451-S455 VanDerWaalsContact O-CB 3.25Å; A451-S455 WeakPolarHBondContact O-CB 3.22Å; A451-S455 PolarHBondContact O-N 3.42Å; A453-S455 VanDerWaalsContact C-N 3.34Å; S455-F457 PolarHBondContact O-N 3.2Å; S455-T458 WeakPolarHBondContact O-CA 3.48Å; S455-T458 WeakPolarHBondContact O-CB 3.26Å; S455-T458 PolarHBondContact O-N 3.25Å; S455-T458 VanDerWaalsContact O-N 3.09Å; S455-F459 PolarHBondContact O-N 2.92Å
456	A	97.9	Very high	95.3	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-57.8	-43.2	176.6	0	0	0	0	0	113.8	F380 Y382 L444 A452 A453 T458 F459 R460 P590	F380-A456 HydrophobicContact CB-CB 4.07Å; F380-A456 HydrophobicContact CD1-CB 4.43Å; F380-A456 HydrophobicContact CD2-CB 3.47Å; F380-A456 VanDerWaalsContact CD2-CB 3.47Å; F380-A456 HydrophobicContact CE2-CB 3.96Å; F380-A456 HydrophobicContact CG-CB 3.74Å; Y382-A456 HydrophobicContact CE2-CB 3.9Å; L444-A456 HydrophobicContact CD1-CB 4.2Å; A452-A456 WeakPolarHBondContact O-CB 3.16Å; A452-A456 PolarHBondContact O-N 3.36Å; A452-A456 VanDerWaalsContact O-N 3.12Å; A453-A456 PolarHBondContact O-N 3.21Å; A456-T458 VanDerWaalsContact C-N 3.33Å; A456-T458 PolarHBondContact O-N 2.95Å; A456-F459 PolarHBondContact O-N 2.95Å; A456-R460 WeakPolarHBondContact O-CB 3.29Å; A456-R460 VanDerWaalsContact O-CG 3.31Å; A456-R460 WeakPolarHBondContact O-CG 3.33Å; A456-R460 PolarHBondContact O-N 3.26Å; A456-P590 HydrophobicContact CB-CB 3.74Å; A456-P590 HydrophobicContact CB-CG 4.2Å
457	F	97.4	Very high	94.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.6	-38.1	175.2	171.7	-113	0	0	0	112.4	R341 I343 A453 S455 T461 P590 Y591	R341-F457 VanDerWaalsContact NH2-CD1 3.33Å; I343-F457 HydrophobicContact CD1-CD1 4.27Å; I343-F457 HydrophobicContact CG2-CE1 4.49Å; A453-F457 WeakPolarHBondContact O-CB 3.5Å; A453-F457 PolarHBondContact O-N 3.18Å; S455-F457 PolarHBondContact O-N 3.2Å; F457-T461 PolarHBondContact O-N 3.26Å; F457-T461 PolarHBondContact O-OG1 2.69Å; F457-P590 HydrophobicContact CB-CG 4.13Å; F457-Y591 HydrophobicContact CB-CE2 3.79Å; F457-Y591 WeakPolarHBondContact CB-OH 3.15Å; F457-Y591 HydrophobicContact CD1-CE2 4.28Å; F457-Y591 WeakPolarHBondContact CD1-OH 3.34Å; F457-Y591 AromaticContact CD2-CE2 3.98Å; F457-Y591 HydrophobicContact CD2-CE2 3.98Å; F457-Y591 AromaticContact CG-CE2 3.78Å; F457-Y591 HydrophobicContact CG-CE2 3.78Å; F457-Y591 AromaticContact CG-CZ 3.97Å; F457-Y591 WeakPolarHBondContact CG-OH 3.43Å
458	T	96.9	Very high	94.3	Very high	6 Å²	6	27.6 Å²	27.6	4%	0.037	13%	0.132	C	C	.	.	H	α-helix	trans	-67.1	-49.1	175.9	-56.7	0	0	0	0	110.8	R341 M424 A426 D454 S455 A456 T461 G462	R341-T458 VanDerWaalsContact CZ-OG1 3.29Å; R341-T458 PolarHBondContact NH1-OG1 3.48Å; R341-T458 PolarHBondContact NH2-OG1 3.42Å; M424-T458 HydrophobicContact CB-CG2 3.95Å; M424-T458 HydrophobicContact CE-CG2 3.8Å; A426-T458 HydrophobicContact CB-CG2 4.44Å; D454-T458 VanDerWaalsContact O-CB 3.29Å; D454-T458 WeakPolarHBondContact O-CB 3.4Å; D454-T458 PolarHBondContact O-N 2.97Å; D454-T458 PolarHBondContact O-OG1 3.4Å; S455-T458 WeakPolarHBondContact O-CA 3.48Å; S455-T458 WeakPolarHBondContact O-CB 3.26Å; S455-T458 PolarHBondContact O-N 3.25Å; S455-T458 VanDerWaalsContact O-N 3.09Å; A456-T458 VanDerWaalsContact C-N 3.33Å; A456-T458 PolarHBondContact O-N 2.95Å; T458-T461 PolarHBondContact O-N 3.49Å; T458-G462 PolarHBondContact O-N 3.06Å
459	F	97.1	Very high	93.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-57.3	-51.7	176.1	172.3	-105.5	0	0	0	112.6	Y382 M421 A426 I428 I442 L444 S455 A456 T461 G462 I463 F476	Y382-F459 AromaticContact CD2-CD1 3.83Å; Y382-F459 HydrophobicContact CD2-CD1 3.83Å; Y382-F459 AromaticContact CD2-CE1 3.98Å; Y382-F459 HydrophobicContact CD2-CE1 3.98Å; Y382-F459 HydrophobicContact CE2-CD1 4.41Å; M421-F459 HydrophobicContact CG-CD2 4.23Å; M421-F459 HydrophobicContact SD-CD2 4.46Å; A426-F459 HydrophobicContact CB-CB 4.44Å; I428-F459 HydrophobicContact CD1-CD2 4.23Å; I428-F459 HydrophobicContact CD1-CE2 4.02Å; I442-F459 HydrophobicContact CB-CE1 4.32Å; I442-F459 HydrophobicContact CB-CE2 4.4Å; I442-F459 HydrophobicContact CB-CZ 3.73Å; I442-F459 HydrophobicContact CD1-CZ 4.04Å; I442-F459 HydrophobicContact CG1-CE2 4.45Å; I442-F459 HydrophobicContact CG1-CZ 3.82Å; I442-F459 HydrophobicContact CG2-CE1 4.37Å; I442-F459 HydrophobicContact CG2-CE2 3.84Å; I442-F459 HydrophobicContact CG2-CZ 3.66Å; L444-F459 HydrophobicContact CD1-CB 4.03Å; L444-F459 HydrophobicContact CD1-CD1 4.4Å; L444-F459 HydrophobicContact CD1-CG 4.31Å; L444-F459 HydrophobicContact CD2-CB 4.23Å; L444-F459 HydrophobicContact CD2-CD1 4.42Å; L444-F459 HydrophobicContact CD2-CD2 4.12Å; L444-F459 HydrophobicContact CD2-CG 3.99Å; S455-F459 PolarHBondContact O-N 2.92Å; A456-F459 PolarHBondContact O-N 2.95Å; F459-T461 PolarHBondContact O-N 3.3Å; F459-T461 VanDerWaalsContact O-N 3.07Å; F459-G462 PolarHBondContact O-N 3.31Å; F459-I463 HydrophobicContact CE2-CB 4.23Å; F459-I463 HydrophobicContact CE2-CD1 4.05Å; F459-I463 HydrophobicContact CZ-CB 4.48Å; F459-I463 HydrophobicContact CZ-CD1 3.84Å; F459-I463 HydrophobicContact CZ-CG2 4.47Å; F459-I463 WeakPolarHBondContact O-CG2 3.21Å; F459-I463 PolarHBondContact O-N 3.32Å; F459-F476 HydrophobicContact CD1-CZ 4.23Å; F459-F476 AromaticContact CE1-CE1 3.93Å; F459-F476 HydrophobicContact CE1-CE1 3.93Å; F459-F476 AromaticContact CE1-CZ 3.78Å; F459-F476 HydrophobicContact CE1-CZ 3.78Å; F459-F476 HydrophobicContact CZ-CZ 4.49Å
460	R	94.2	Very high	93	Very high	14 Å²	14	31.8 Å²	31.8	5%	0.053	15%	0.147	C	C	.	.	H	α-helix	trans	-57.8	-25.4	-179.5	-74	177.1	89.8	-138.6	14.1	114.1	G271 Y382 A456 K464 F476 A586 M587 A588	G271-R460 PolarHBondContact O-NH1 2.93Å; Y382-R460 HydrophobicContact CD2-CG 4.46Å; Y382-R460 HydrophobicContact CE2-CG 3.96Å; A456-R460 WeakPolarHBondContact O-CB 3.29Å; A456-R460 VanDerWaalsContact O-CG 3.31Å; A456-R460 WeakPolarHBondContact O-CG 3.33Å; A456-R460 PolarHBondContact O-N 3.26Å; R460-K464 WeakPolarHBondContact O-CD 3.49Å; R460-K464 VanDerWaalsContact O-CE 3.32Å; R460-K464 WeakPolarHBondContact O-CE 3.2Å; R460-F476 HydrophobicContact CB-CE2 3.98Å; R460-F476 HydrophobicContact CB-CZ 4.26Å; R460-F476 HydrophobicContact CG-CE1 4.42Å; R460-F476 HydrophobicContact CG-CE2 4.05Å; R460-F476 HydrophobicContact CG-CZ 3.98Å; R460-F476 WeakPolarHBondContact O-CE2 3.11Å; R460-A586 PolarHBondContact NE-O 3Å; R460-A586 PolarHBondContact NH2-O 2.94Å; R460-M587 PolarHBondContact NH2-O 2.76Å; R460-A588 PolarHBondContact NH1-O 2.96Å; R460-A588 PolarHBondContact NH2-O 3.27Å; R460-A588 VanDerWaalsContact NH2-O 3.11Å
461	T	90.4	Very high	92.2	Very high	27 Å²	27	33.4 Å²	33.4	17%	0.166	16%	0.161	C	C	.	.	H	α-helix	trans	-90.6	-48.7	177.1	-52.7	0	0	0	0	110.4	F457 T458 F459 K464 E465	F457-T461 PolarHBondContact O-N 3.26Å; F457-T461 PolarHBondContact O-OG1 2.69Å; T458-T461 PolarHBondContact O-N 3.49Å; F459-T461 PolarHBondContact O-N 3.3Å; F459-T461 VanDerWaalsContact O-N 3.07Å; T461-K464 WeakPolarHBondContact O-CB 3.17Å; T461-K464 PolarHBondContact O-N 2.99Å; T461-E465 PolarHBondContact O-N 3.1Å
462	G	92.9	Very high	91.5	Very high	1 Å²	1	33 Å²	33	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-63.5	-44.3	-174.8	0	0	0	0	0	114.1	W335 M421 T458 F459 K464 E465 M466	W335-G462 VanDerWaalsContact CZ2-CA 3.46Å; M421-G462 VanDerWaalsContact CE-C 3.43Å; T458-G462 PolarHBondContact O-N 3.06Å; F459-G462 PolarHBondContact O-N 3.31Å; G462-K464 PolarHBondContact O-N 3.12Å; G462-E465 PolarHBondContact O-N 3Å; G462-E465 VanDerWaalsContact O-N 3.14Å; G462-M466 WeakPolarHBondContact O-CB 3.37Å; G462-M466 WeakPolarHBondContact O-CG 3.4Å; G462-M466 PolarHBondContact O-N 3.15Å
463	I	92.4	Very high	90.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59.5	-31.9	178.1	-165.7	173.8	0	0	0	112	L417 F459 A467 A474 F476	L417-I463 HydrophobicContact CD1-CB 4.06Å; L417-I463 HydrophobicContact CD1-CG1 3.9Å; L417-I463 HydrophobicContact CD2-CD1 3.79Å; L417-I463 HydrophobicContact CD2-CG1 3.93Å; F459-I463 HydrophobicContact CE2-CB 4.23Å; F459-I463 HydrophobicContact CE2-CD1 4.05Å; F459-I463 HydrophobicContact CZ-CB 4.48Å; F459-I463 HydrophobicContact CZ-CD1 3.84Å; F459-I463 HydrophobicContact CZ-CG2 4.47Å; F459-I463 WeakPolarHBondContact O-CG2 3.21Å; F459-I463 PolarHBondContact O-N 3.32Å; I463-A467 WeakPolarHBondContact O-CB 3.5Å; I463-A467 PolarHBondContact O-N 3.14Å; I463-A474 HydrophobicContact CD1-CB 4.45Å; I463-A474 HydrophobicContact CG1-CB 4.05Å; I463-A474 HydrophobicContact CG2-CB 4.15Å; I463-F476 HydrophobicContact CG2-CE2 3.76Å; I463-F476 HydrophobicContact CG2-CZ 3.65Å
464	K	89.4	Confident	90.1	Very high	77 Å²	77	36.1 Å²	36.1	34%	0.335	17%	0.169	S	C	.	.	H	α-helix	trans	-72.7	-39.2	177.9	-62.2	179.5	-178.4	171.9	0	112.5	R460 T461 G462 R468 A474 F476	R460-K464 WeakPolarHBondContact O-CD 3.49Å; R460-K464 VanDerWaalsContact O-CE 3.32Å; R460-K464 WeakPolarHBondContact O-CE 3.2Å; T461-K464 WeakPolarHBondContact O-CB 3.17Å; T461-K464 PolarHBondContact O-N 2.99Å; G462-K464 PolarHBondContact O-N 3.12Å; K464-R468 VanDerWaalsContact O-CG 3.25Å; K464-R468 WeakPolarHBondContact O-CG 3.37Å; K464-R468 PolarHBondContact O-N 2.77Å; K464-A474 HydrophobicContact CG-CB 4.35Å; K464-F476 VanDerWaalsContact CE-CD2 3.46Å
465	E	89.6	Confident	89.6	Confident	61 Å²	61	37.1 Å²	37.1	29%	0.285	18%	0.178	S	C	.	.	H	α-helix	trans	-69.6	-42.3	174.7	-69.2	-170.4	-165	0	0	111.2	R263 W335 T461 G462 R468 K469	R263-E465 IonicContact CZ-OE1 3.8Å; R263-E465 IonicContact CZ-OE2 2.79Å; R263-E465 IonicContact NH1-OE1 3.28Å; R263-E465 PolarHBondContact NH1-OE1 3.02Å; R263-E465 IonicContact NH1-OE2 2.83Å; R263-E465 PolarHBondContact NH1-OE2 3.04Å; R263-E465 IonicContact NH2-OE1 2.92Å; R263-E465 PolarHBondContact NH2-OE1 3.05Å; R263-E465 IonicContact NH2-OE2 3.34Å; R263-E465 PolarHBondContact NH2-OE2 2.77Å; W335-E465 PolarHBondContact NE1-OE2 3.3Å; T461-E465 PolarHBondContact O-N 3.1Å; G462-E465 PolarHBondContact O-N 3Å; G462-E465 VanDerWaalsContact O-N 3.14Å; E465-R468 PolarHBondContact O-N 3.19Å; E465-K469 PolarHBondContact O-N 3.02Å
466	M	89.8	Confident	89.1	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-68.5	-42.1	178.9	-70	-166.9	70.2	0	0	113.5	W335 F413 Q416 L417 S420 M421 G462 R468 K469 H470	W335-M466 HydrophobicContact CB-CG 3.92Å; W335-M466 HydrophobicContact CD2-CG 3.7Å; W335-M466 HydrophobicContact CD2-SD 4.19Å; W335-M466 HydrophobicContact CE3-CG 3.65Å; W335-M466 HydrophobicContact CE3-SD 3.49Å; W335-M466 HydrophobicContact CG-CG 3.84Å; W335-M466 HydrophobicContact CZ3-CG 4.38Å; W335-M466 HydrophobicContact CZ3-SD 3.96Å; F413-M466 HydrophobicContact CE2-CB 4.22Å; Q416-M466 HydrophobicContact CB-CE 4.25Å; Q416-M466 HydrophobicContact CG-CE 3.9Å; Q416-M466 WeakPolarHBondContact O-CE 3.31Å; L417-M466 HydrophobicContact CD1-SD 3.9Å; S420-M466 VanDerWaalsContact CB-SD 3.53Å; S420-M466 WeakPolarHBondContact OG-CE 3.47Å; M421-M466 HydrophobicContact CE-CG 4.25Å; M421-M466 HydrophobicContact CE-SD 3.48Å; M421-M466 WeakPolarHBondContact CE-SD 3.33Å; G462-M466 WeakPolarHBondContact O-CB 3.37Å; G462-M466 WeakPolarHBondContact O-CG 3.4Å; G462-M466 PolarHBondContact O-N 3.15Å; M466-R468 VanDerWaalsContact C-N 3.32Å; M466-R468 PolarHBondContact O-N 3.3Å; M466-K469 WeakPolarHBondContact O-CB 3.5Å; M466-K469 PolarHBondContact O-N 2.93Å; M466-H470 PolarHBondContact O-N 2.86Å; M466-H470 PolarHBondContact O-ND1 3.08Å
467	A	86.3	Confident	88.5	Confident	0 Å²	0	43 Å²	43	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-57.3	-47.6	175.4	0	0	0	0	0	110.5	F413 I463 K469 H470 S471 Y472 A474	F413-A467 HydrophobicContact CE2-CB 4.36Å; F413-A467 HydrophobicContact CZ-CB 4.12Å; I463-A467 WeakPolarHBondContact O-CB 3.5Å; I463-A467 PolarHBondContact O-N 3.14Å; A467-K469 PolarHBondContact O-N 2.91Å; A467-H470 CarbonylContact O-C 3.56Å; A467-H470 WeakPolarHBondContact O-CA 3.48Å; A467-H470 PolarHBondContact O-N 3.17Å; A467-S471 PolarHBondContact O-N 3.15Å; A467-Y472 CarbonylContact C-O 3.55Å; A467-Y472 PolarHBondContact O-N 3.28Å; A467-Y472 VanDerWaalsContact O-O 3.09Å; A467-A474 HydrophobicContact CB-CB 3.89Å
468	R	84.3	Confident	87.7	Confident	200 Å²	200	43 Å²	43	76%	0.755	20%	0.203	S	C	*	.	H	α-helix	trans	-65.7	-24.6	-179.5	-68.2	179	76.7	162.7	8	113.6	K464 E465 M466 H470 Y472	K464-R468 VanDerWaalsContact O-CG 3.25Å; K464-R468 WeakPolarHBondContact O-CG 3.37Å; K464-R468 PolarHBondContact O-N 2.77Å; E465-R468 PolarHBondContact O-N 3.19Å; M466-R468 VanDerWaalsContact C-N 3.32Å; M466-R468 PolarHBondContact O-N 3.3Å; R468-H470 VanDerWaalsContact C-N 3.26Å; R468-Y472 WeakPolarHBondContact CA-O 3.32Å; R468-Y472 PolarHBondContact N-O 3.02Å
469	K	83.9	Confident	86.6	Confident	123 Å²	123	45.8 Å²	45.8	54%	0.535	22%	0.218	S	C	.	.	H	α-helix	trans	-71.7	-20	172.2	-165.6	173	-174.8	174.6	0	113	W335 E465 M466 A467	W335-K469 HydrophobicContact CB-CD 4.48Å; W335-K469 PolarHBondContact O-NZ 3.32Å; E465-K469 PolarHBondContact O-N 3.02Å; M466-K469 WeakPolarHBondContact O-CB 3.5Å; M466-K469 PolarHBondContact O-N 2.93Å; A467-K469 PolarHBondContact O-N 2.91Å
470	H	81.8	Confident	85.2	Confident	66 Å²	66	49.6 Å²	49.6	31%	0.306	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	18.2	-177.8	-66.8	92.1	0	0	0	113.2	F413 Q416 M466 A467 R468 Y472	F413-H470 HydrophobicContact CD2-CB 4.08Å; F413-H470 AromaticContact CD2-CG 3.86Å; F413-H470 AromaticContact CD2-ND1 3.66Å; Q416-H470 PolarHBondContact OE1-CE1 2.94Å; Q416-H470 PolarHBondContact OE1-NE2 3.38Å; M466-H470 PolarHBondContact O-N 2.86Å; M466-H470 PolarHBondContact O-ND1 3.08Å; A467-H470 CarbonylContact O-C 3.56Å; A467-H470 WeakPolarHBondContact O-CA 3.48Å; A467-H470 PolarHBondContact O-N 3.17Å; R468-H470 VanDerWaalsContact C-N 3.26Å; H470-Y472 VanDerWaalsContact C-N 3.26Å; H470-Y472 HydrophobicContact CB-CD2 3.66Å; H470-Y472 HydrophobicContact CB-CE2 3.93Å; H470-Y472 WeakPolarHBondContact O-CD2 3.16Å; H470-Y472 PolarHBondContact O-N 3.1Å
471	S	81.7	Confident	84	Confident	69 Å²	69	52.6 Å²	52.6	48%	0.483	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	39.6	-173.5	-59.1	0	0	0	0	113.8	A389 A467	A389-S471 WeakPolarHBondContact CA-O 3.36Å; A389-S471 VanDerWaalsContact CB-O 3.24Å; A389-S471 WeakPolarHBondContact CB-O 3.48Å; A389-S471 PolarHBondContact N-O 2.75Å; A467-S471 PolarHBondContact O-N 3.15Å
472	Y	82.6	Confident	83.3	Confident	27 Å²	27	53.1 Å²	53.1	11%	0.106	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	163.4	163.9	-58.6	-77.9	0	0	0	111.4	V386 L387 L405 D410 F413 A467 R468 H470	V386-Y472 HydrophobicContact CG1-CD1 4.15Å; V386-Y472 HydrophobicContact CG1-CG 4.09Å; L387-Y472 CarbonylContact O-C 3.52Å; L387-Y472 WeakPolarHBondContact O-CA 3.45Å; L387-Y472 WeakPolarHBondContact O-CB 3.19Å; L405-Y472 HydrophobicContact CD2-CE1 4.17Å; D410-Y472 PolarHBondContact OD1-OH 3.2Å; F413-Y472 HydrophobicContact CB-CE2 4.13Å; F413-Y472 HydrophobicContact CD1-CD2 4.33Å; F413-Y472 HydrophobicContact CD1-CE2 4.34Å; F413-Y472 HydrophobicContact CD2-CD2 4.41Å; F413-Y472 HydrophobicContact CG-CD2 4.2Å; F413-Y472 HydrophobicContact CG-CE2 4.11Å; A467-Y472 CarbonylContact C-O 3.55Å; A467-Y472 PolarHBondContact O-N 3.28Å; A467-Y472 VanDerWaalsContact O-O 3.09Å; R468-Y472 WeakPolarHBondContact CA-O 3.32Å; R468-Y472 PolarHBondContact N-O 3.02Å; H470-Y472 VanDerWaalsContact C-N 3.26Å; H470-Y472 HydrophobicContact CB-CD2 3.66Å; H470-Y472 HydrophobicContact CB-CE2 3.93Å; H470-Y472 WeakPolarHBondContact O-CD2 3.16Å; H470-Y472 PolarHBondContact O-N 3.1Å
473	I	83.1	Confident	82.9	Confident	58 Å²	58	55.1 Å²	55.1	30%	0.297	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	122.4	167.8	-67.5	165.8	0	0	0	107.7	V386 L387 A389 L398	V386-I473 WeakPolarHBondContact CA-O 3.16Å; L387-I473 PolarHBondContact N-O 2.84Å; L387-I473 PolarHBondContact O-N 3.49Å; A389-I473 HydrophobicContact CB-CD1 4.13Å; A389-I473 HydrophobicContact CB-CG1 4Å; L398-I473 HydrophobicContact CD2-CD1 3.74Å
474	A	85.2	Confident	82.8	Confident	9 Å²	9	55.1 Å²	55.1	7%	0.074	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	127.4	170.8	0	0	0	0	0	110.4	C385 V386 I463 K464 A467	C385-A474 CarbonylContact O-C 3.55Å; C385-A474 WeakPolarHBondContact O-CA 3.47Å; V386-A474 HydrophobicContact CG2-CB 4.4Å; I463-A474 HydrophobicContact CD1-CB 4.45Å; I463-A474 HydrophobicContact CG1-CB 4.05Å; I463-A474 HydrophobicContact CG2-CB 4.15Å; K464-A474 HydrophobicContact CG-CB 4.35Å; A467-A474 HydrophobicContact CB-CB 3.89Å
475	S	86.2	Confident	82.9	Confident	38 Å²	38	52.2 Å²	52.2	27%	0.266	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	133	-178.8	-171.3	0	0	0	0	111.9	C384 C385 F477	C384-S475 CarbonylContact C-O 3.6Å; C384-S475 WeakPolarHBondContact CA-O 3.32Å; C384-S475 WeakPolarHBondContact CB-O 3.38Å; C385-S475 PolarHBondContact N-O 3.4Å; C385-S475 PolarHBondContact O-N 3.5Å; S475-F477 WeakPolarHBondContact OG-CB 3.4Å; S475-F477 PolarHBondContact OG-N 2.89Å
476	F	88.3	Confident	83.1	Confident	6 Å²	6	49.4 Å²	49.4	3%	0.026	26%	0.26	C	S	.	.			trans	-104.2	11.6	169.5	-59	-81.3	0	0	0	111.6	Y382 C384 F459 R460 I463 K464 A586 M587	Y382-F476 HydrophobicContact CG-CE1 4.21Å; C384-F476 HydrophobicContact CB-CD1 3.38Å; C384-F476 HydrophobicContact CB-CE1 3.46Å; C384-F476 VanDerWaalsContact CB-CE1 3.46Å; C384-F476 HydrophobicContact CB-CG 4.16Å; C384-F476 HydrophobicContact CB-CZ 4.24Å; F459-F476 HydrophobicContact CD1-CZ 4.23Å; F459-F476 AromaticContact CE1-CE1 3.93Å; F459-F476 HydrophobicContact CE1-CE1 3.93Å; F459-F476 AromaticContact CE1-CZ 3.78Å; F459-F476 HydrophobicContact CE1-CZ 3.78Å; F459-F476 HydrophobicContact CZ-CZ 4.49Å; R460-F476 HydrophobicContact CB-CE2 3.98Å; R460-F476 HydrophobicContact CB-CZ 4.26Å; R460-F476 HydrophobicContact CG-CE1 4.42Å; R460-F476 HydrophobicContact CG-CE2 4.05Å; R460-F476 HydrophobicContact CG-CZ 3.98Å; R460-F476 WeakPolarHBondContact O-CE2 3.11Å; I463-F476 HydrophobicContact CG2-CE2 3.76Å; I463-F476 HydrophobicContact CG2-CZ 3.65Å; K464-F476 VanDerWaalsContact CE-CD2 3.46Å; F476-A586 HydrophobicContact CB-CB 3.82Å; F476-A586 HydrophobicContact CD1-CB 3.75Å; F476-A586 HydrophobicContact CG-CB 4.24Å; F476-M587 WeakPolarHBondContact O-CG 3.39Å
477	F	84.9	Confident	83.5	Confident	121 Å²	121	50 Å²	50	53%	0.531	26%	0.264	S	S	.	.			trans	-67.3	144.3	179.1	-169.9	-109.7	0	0	0	110.1	S475 D479 N484 M587	S475-F477 WeakPolarHBondContact OG-CB 3.4Å; S475-F477 PolarHBondContact OG-N 2.89Å; F477-D479 HydrophobicContact CD1-CB 4.15Å; F477-D479 HydrophobicContact CE1-CB 3.83Å; F477-N484 PolarHBondContact O-ND2 3.46Å; F477-M587 HydrophobicContact CD2-CE 3.72Å; F477-M587 HydrophobicContact CD2-SD 4.05Å; F477-M587 HydrophobicContact CE2-CE 3.9Å; F477-M587 HydrophobicContact CE2-SD 4.44Å
478	T	80	Confident	84	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.264	C	S	.	.			trans	-115.6	127.1	173.8	-75.2	0	0	0	0	107.6	L482 Y483 N484 C539 S585 M587	T478-L482 WeakPolarHBondContact CA-O 3.48Å; T478-Y483 HydrophobicContact CG2-CD2 3.53Å; T478-Y483 HydrophobicContact CG2-CE2 4.15Å; T478-Y483 HydrophobicContact CG2-CG 4.3Å; T478-N484 PolarHBondContact OG1-N 2.96Å; T478-N484 PolarHBondContact OG1-O 2.89Å; T478-C539 HydrophobicContact CG2-CB 4.41Å; T478-S585 PolarHBondContact OG1-OG 3.04Å; T478-S585 VanDerWaalsContact OG1-OG 3.12Å; T478-M587 PolarHBondContact N-SD 3.09Å; T478-M587 VanDerWaalsContact N-SD 3.38Å
479	D	74.4	Confident	84.7	Confident	63 Å²	63	41.2 Å²	41.2	34%	0.337	23%	0.233	S	C	.	.			trans	-122.4	-172.1	178.2	74.4	25.7	0	0	0	112.1	F477 G481 L482	F477-D479 HydrophobicContact CD1-CB 4.15Å; F477-D479 HydrophobicContact CE1-CB 3.83Å; D479-G481 PolarHBondContact O-N 2.99Å; D479-G481 WeakPolarHBondContact OD1-CA 3.33Å; D479-G481 PolarHBondContact OD1-N 3.35Å; D479-L482 PolarHBondContact N-O 3.2Å; D479-L482 PolarHBondContact OD1-N 2.99Å
480	D	67.6	Low	85.3	Confident	81 Å²	81	35.4 Å²	35.4	43%	0.433	21%	0.207	S	C	.	.	S	Bend	trans	-69.2	-12.3	-176.1	-108.6	57	0	0	0	114.5	S541 K545	D480-S541 WeakPolarHBondContact OD1-CB 3.43Å; D480-S541 PolarHBondContact OD1-OG 3.12Å; D480-K545 VanDerWaalsContact CG-NZ 3.34Å; D480-K545 PolarHBondContact O-NZ 3.46Å; D480-K545 WeakPolarHBondContact OD2-CE 3.27Å; D480-K545 IonicContact OD2-NZ 3.65Å; D480-K545 PolarHBondContact OD2-NZ 3.44Å
481	G	68.7	Low	86	Confident	76 Å²	76	32.5 Å²	32.5	78%	0.784	20%	0.195	S	C	*	.	S	Bend	trans	-121.8	-18.9	179.1	0	0	0	0	0	114.9	D479	D479-G481 PolarHBondContact O-N 2.99Å; D479-G481 WeakPolarHBondContact OD1-CA 3.33Å; D479-G481 PolarHBondContact OD1-N 3.35Å
482	L	76.6	Confident	86.7	Confident	39 Å²	39	29.2 Å²	29.2	20%	0.204	17%	0.172	C	C	.	.			trans	-137.9	111.5	-176.2	-172.7	50.7	0	0	0	111.7	C385 T478 D479	C385-L482 WeakPolarHBondContact SG-CD2 3.16Å; T478-L482 WeakPolarHBondContact CA-O 3.48Å; D479-L482 PolarHBondContact N-O 3.2Å; D479-L482 PolarHBondContact OD1-N 2.99Å
483	Y	85.3	Confident	87.3	Confident	43 Å²	43	29.2 Å²	29.2	17%	0.169	17%	0.171	C	C	.	.			trans	-94.4	130.5	176.4	-176.1	-93.1	0	0	0	111.3	Q439 T478 A485 C539 H542 G584	Q439-Y483 PolarHBondContact NE2-O 3.3Å; T478-Y483 HydrophobicContact CG2-CD2 3.53Å; T478-Y483 HydrophobicContact CG2-CE2 4.15Å; T478-Y483 HydrophobicContact CG2-CG 4.3Å; Y483-A485 HydrophobicContact CD1-CB 4.37Å; Y483-A485 HydrophobicContact CE1-CB 3.8Å; Y483-C539 HydrophobicContact CE2-CB 4.47Å; Y483-H542 HydrophobicContact CD2-CB 3.86Å; Y483-H542 AromaticContact CD2-CE1 3.95Å; Y483-H542 AromaticContact CD2-CG 3.58Å; Y483-H542 AromaticContact CD2-ND1 3.22Å; Y483-H542 WeakPolarHBondContact CD2-ND1 3.3Å; Y483-H542 AromaticContact CE2-ND1 3.93Å; Y483-H542 AromaticContact CG-CE1 3.65Å; Y483-H542 AromaticContact CG-CG 3.87Å; Y483-H542 AromaticContact CG-ND1 3.41Å; Y483-G584 PolarHBondContact OH-O 2.85Å; Y483-G584 VanDerWaalsContact OH-O 3.06Å
484	N	88.4	Confident	87.9	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.164	C	C	.	.			trans	-111	111.5	171.4	-77.2	-61.6	0	0	0	109.7	E383 C384 C385 Q439 F477 T478 S585 A586	E383-N484 HydrophobicContact CB-CB 4.21Å; E383-N484 WeakPolarHBondContact O-CB 3.44Å; E383-N484 PolarHBondContact O-OD1 3.24Å; C384-N484 WeakPolarHBondContact CA-OD1 3.34Å; C384-N484 PolarHBondContact N-OD1 3.49Å; C385-N484 PolarHBondContact SG-ND2 3.37Å; Q439-N484 PolarHBondContact NE2-OD1 3.47Å; F477-N484 PolarHBondContact O-ND2 3.46Å; T478-N484 PolarHBondContact OG1-N 2.96Å; T478-N484 PolarHBondContact OG1-O 2.89Å; N484-S585 CarbonylContact O-C 3.59Å; N484-S585 WeakPolarHBondContact O-CA 3.49Å; N484-S585 PolarHBondContact O-OG 2.91Å; N484-A586 HydrophobicContact CB-CB 3.95Å; N484-A586 PolarHBondContact O-N 2.83Å
485	A	92.1	Very high	88.2	Confident	15 Å²	15	29.1 Å²	29.1	12%	0.124	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-71.2	147.8	176	0	0	0	0	0	112.9	E383 Y483 V487 A586	E383-A485 HydrophobicContact CG-CB 4.14Å; E383-A485 PolarHBondContact N-O 2.96Å; E383-A485 VanDerWaalsContact OE2-CB 3.23Å; E383-A485 WeakPolarHBondContact OE2-CB 3.48Å; E383-A485 PolarHBondContact OE2-N 2.84Å; Y483-A485 HydrophobicContact CD1-CB 4.37Å; Y483-A485 HydrophobicContact CE1-CB 3.8Å; A485-V487 HydrophobicContact CB-CG2 4.41Å; A485-A586 WeakPolarHBondContact O-CB 3.41Å
486	G	95.1	Very high	88.5	Confident	3 Å²	3	33.4 Å²	33.4	3%	0.031	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	85.9	171.7	0	0	0	0	0	109	T381 G584	T381-G486 CarbonylContact O-C 3.54Å; T381-G486 WeakPolarHBondContact O-CA 3.35Å; G486-G584 PolarHBondContact N-O 3.28Å; G486-G584 CarbonylContact O-C 3.6Å; G486-G584 VanDerWaalsContact O-CA 3.28Å; G486-G584 WeakPolarHBondContact O-CA 3.36Å
487	V	96.9	Very high	88.7	Confident	14 Å²	14	34.1 Å²	34.1	9%	0.085	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	136.1	-174.3	-179	0	0	0	0	109.8	F380 T381 A485 D580 N581 K582	F380-V487 WeakPolarHBondContact CA-O 3.35Å; T381-V487 PolarHBondContact N-O 3.5Å; T381-V487 PolarHBondContact O-N 2.85Å; A485-V487 HydrophobicContact CB-CG2 4.41Å; V487-D580 HydrophobicContact CG1-CB 3.77Å; V487-N581 WeakPolarHBondContact CA-O 3.46Å; V487-K582 HydrophobicContact CG1-CG 4.11Å; V487-K582 HydrophobicContact CG2-CG 4.08Å
488	L	97.9	Very high	89	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	100.5	167.6	178.7	75.2	0	0	0	109.4	F380 H490 N581 V593 L594 T597	F380-L488 HydrophobicContact CD1-CD1 4.29Å; F380-L488 HydrophobicContact CD2-CD1 4.15Å; F380-L488 HydrophobicContact CE1-CB 4.49Å; F380-L488 HydrophobicContact CE1-CD1 3.93Å; F380-L488 HydrophobicContact CE2-CD1 3.78Å; F380-L488 HydrophobicContact CG-CD1 4.4Å; F380-L488 HydrophobicContact CZ-CD1 3.66Å; L488-H490 HydrophobicContact CG-CB 4.38Å; L488-H490 PolarHBondContact O-CE1 2.84Å; L488-H490 PolarHBondContact O-ND1 3.03Å; L488-H490 VanDerWaalsContact O-ND1 3.16Å; L488-N581 HydrophobicContact CB-CB 4.4Å; L488-N581 PolarHBondContact N-O 3.09Å; L488-N581 PolarHBondContact O-N 2.82Å; L488-V593 HydrophobicContact CB-CG1 3.9Å; L488-V593 HydrophobicContact CD2-CG1 4.14Å; L488-L594 HydrophobicContact CD1-CD1 4.1Å; L488-L594 HydrophobicContact CD2-CD1 4.25Å; L488-T597 HydrophobicContact CD2-CG2 3.88Å; L488-T597 WeakPolarHBondContact CD2-OG1 3.4Å
489	S	97.2	Very high	89.5	Confident	13 Å²	13	46.2 Å²	46.2	9%	0.091	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	121.6	169.9	-58.7	0	0	0	0	108.7	S378 S379 I579 D580	S378-S489 CarbonylContact C-O 3.52Å; S378-S489 WeakPolarHBondContact CA-O 3.36Å; S378-S489 WeakPolarHBondContact CB-O 3.04Å; S379-S489 PolarHBondContact N-O 2.72Å; S379-S489 PolarHBondContact O-N 2.98Å; S489-I579 WeakPolarHBondContact CA-O 3.48Å; S489-D580 VanDerWaalsContact CB-OD1 3.3Å; S489-D580 WeakPolarHBondContact CB-OD1 3.46Å; S489-D580 PolarHBondContact OG-OD1 3.34Å
490	H	97.6	Very high	90.4	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	150.6	-173.9	65	-74.9	0	0	0	113.9	L376 H377 L488 W518 L522 H578 I579 N581	L376-H490 HydrophobicContact CD1-CB 4.16Å; H377-H490 CarbonylContact O-C 3.47Å; H377-H490 WeakPolarHBondContact O-CA 3.3Å; L488-H490 HydrophobicContact CG-CB 4.38Å; L488-H490 PolarHBondContact O-CE1 2.84Å; L488-H490 PolarHBondContact O-ND1 3.03Å; L488-H490 VanDerWaalsContact O-ND1 3.16Å; H490-W518 AromaticContact CD2-CE2 3.96Å; H490-W518 AromaticContact CD2-NE1 3.44Å; H490-W518 PolarHBondContact CD2-NE1 3.16Å; H490-L522 VanDerWaalsContact NE2-CD1 3.34Å; H490-L522 WeakPolarHBondContact NE2-CD1 3.35Å; H490-H578 WeakPolarHBondContact O-CA 3.37Å; H490-H578 WeakPolarHBondContact O-CB 3.43Å; H490-I579 PolarHBondContact CE1-O 3.43Å; H490-I579 PolarHBondContact N-O 3.17Å; H490-I579 PolarHBondContact ND1-O 2.91Å; H490-I579 WeakPolarHBondContact NE2-CG2 3.45Å; H490-I579 PolarHBondContact NE2-O 3.32Å; H490-I579 PolarHBondContact O-N 2.81Å; H490-N581 WeakPolarHBondContact NE2-CB 3.07Å
491	S	96.1	Very high	91.6	Very high	5 Å²	5	41.2 Å²	41.2	4%	0.035	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	144.3	177.1	55	0	0	0	0	110.2	H377 W493	H377-S491 PolarHBondContact N-O 3.11Å; H377-S491 PolarHBondContact O-N 2.9Å; H377-S491 PolarHBondContact O-OG 2.78Å; S491-W493 PolarHBondContact OG-NE1 3.22Å
492	L	96.3	Very high	92.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	136.4	175.5	-162.1	71	0	0	0	110.3	L369 F374 L501 F502 I514 W518 I605	L369-L492 HydrophobicContact CD1-CD1 4.07Å; L369-L492 HydrophobicContact CD2-CD1 4.04Å; L369-L492 HydrophobicContact CG-CD1 4.4Å; F374-L492 HydrophobicContact CB-CD1 3.93Å; F374-L492 HydrophobicContact CB-CD2 4.4Å; F374-L492 HydrophobicContact CB-CG 4.22Å; F374-L492 HydrophobicContact CD1-CD2 3.92Å; F374-L492 HydrophobicContact CD1-CG 4.34Å; F374-L492 HydrophobicContact CE1-CD2 4.31Å; F374-L492 HydrophobicContact CG-CD1 4.47Å; F374-L492 HydrophobicContact CG-CD2 4.08Å; F374-L492 HydrophobicContact CG-CG 4.41Å; L492-L501 WeakPolarHBondContact O-CB 3.33Å; L492-L501 PolarHBondContact O-N 3.21Å; L492-F502 HydrophobicContact CB-CD1 3.7Å; L492-F502 HydrophobicContact CB-CE1 3.29Å; L492-F502 HydrophobicContact CB-CZ 3.82Å; L492-F502 HydrophobicContact CD2-CE1 4.33Å; L492-F502 HydrophobicContact CG-CE1 4.43Å; L492-I514 HydrophobicContact CD2-CG1 4.27Å; L492-W518 HydrophobicContact CD1-CE3 4.3Å; L492-W518 HydrophobicContact CD1-CH2 4.17Å; L492-W518 HydrophobicContact CD1-CZ3 3.84Å; L492-W518 HydrophobicContact CD2-CE3 4.15Å; L492-W518 HydrophobicContact CD2-CZ3 4.42Å; L492-I605 HydrophobicContact CD2-CD1 3.91Å
493	W	96.4	Very high	93.1	Very high	27 Å²	27	41 Å²	41	10%	0.102	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	167.9	-178.6	-69.5	68.2	0	0	0	110.6	F374 S375 H377 F448 S491 R499 L501 E576	F374-W493 CarbonylContact C-O 3.57Å; F374-W493 WeakPolarHBondContact CA-O 3.32Å; S375-W493 PolarHBondContact N-O 2.63Å; S375-W493 PolarHBondContact O-N 3.28Å; H377-W493 VanDerWaalsContact CB-CD1 3.46Å; H377-W493 HydrophobicContact CB-CG 4.38Å; H377-W493 AromaticContact CG-NE1 3.93Å; H377-W493 AromaticContact ND1-NE1 3.79Å; F448-W493 HydrophobicContact CE1-CB 4.14Å; F448-W493 HydrophobicContact CE1-CD2 4.37Å; F448-W493 AromaticContact CE1-CG 3.98Å; F448-W493 HydrophobicContact CE1-CG 3.98Å; F448-W493 HydrophobicContact CZ-CD2 4.28Å; F448-W493 HydrophobicContact CZ-CG 4.36Å; S491-W493 PolarHBondContact OG-NE1 3.22Å; W493-R499 WeakPolarHBondContact CA-O 3.43Å; W493-L501 VanDerWaalsContact C-CD1 3.44Å; W493-L501 WeakPolarHBondContact O-CD1 3.24Å; W493-E576 HydrophobicContact CH2-CG 4.07Å; W493-E576 HydrophobicContact CZ2-CB 4.25Å; W493-E576 HydrophobicContact CZ2-CG 3.85Å
494	D	94.8	Very high	92.5	Very high	28 Å²	28	40.6 Å²	40.6	15%	0.15	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	161.5	165	67.4	53.4	0	0	0	112.2	S375 N496 G497 R498 R499	S375-D494 VanDerWaalsContact CB-O 3.24Å; S375-D494 WeakPolarHBondContact CB-O 3.28Å; D494-N496 PolarHBondContact O-N 2.87Å; D494-N496 VanDerWaalsContact OD1-CA 3.31Å; D494-N496 WeakPolarHBondContact OD1-CA 3.33Å; D494-N496 WeakPolarHBondContact OD1-CB 3.26Å; D494-N496 PolarHBondContact OD1-N 2.9Å; D494-G497 PolarHBondContact O-N 3.44Å; D494-G497 PolarHBondContact OD1-N 3.01Å; D494-R498 PolarHBondContact OD1-N 3.2Å; D494-R499 PolarHBondContact N-O 3.07Å; D494-R499 VanDerWaalsContact N-O 3.09Å; D494-R499 VanDerWaalsContact OD2-CB 3.32Å; D494-R499 WeakPolarHBondContact OD2-CB 3.4Å; D494-R499 PolarHBondContact OD2-N 3.18Å
495	A	92.1	Very high	91.2	Very high	37 Å²	37	44.7 Å²	44.7	31%	0.306	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-16.2	-180	0	0	0	0	0	115.3	G373	G373-A495 PolarHBondContact O-N 2.63Å
496	N	91.8	Very high	89.5	Confident	128 Å²	128	52.6 Å²	52.6	68%	0.684	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-2.3	177.3	-57.5	-70.5	0	0	0	112.7	D494 R498	D494-N496 PolarHBondContact O-N 2.87Å; D494-N496 VanDerWaalsContact OD1-CA 3.31Å; D494-N496 WeakPolarHBondContact OD1-CA 3.33Å; D494-N496 WeakPolarHBondContact OD1-CB 3.26Å; D494-N496 PolarHBondContact OD1-N 2.9Å; N496-R498 VanDerWaalsContact C-N 3.28Å; N496-R498 HydrophobicContact CB-CG 3.88Å; N496-R498 PolarHBondContact O-N 3.44Å
497	G	91.9	Very high	87.5	Confident	21 Å²	21	59 Å²	59	22%	0.216	31%	0.306	C	S	.	.	S	Bend	trans	66.2	24.8	-175.1	0	0	0	0	0	113.9	D494	D494-G497 PolarHBondContact O-N 3.44Å; D494-G497 PolarHBondContact OD1-N 3.01Å
498	R	91.1	Very high	85.3	Confident	207 Å²	207	66.9 Å²	66.9	78%	0.781	34%	0.341	S	S	*	.			trans	-97.3	-34.5	-171.2	-68.1	-175.4	-179.3	-159.3	-0	114.9	D494 N496	D494-R498 PolarHBondContact OD1-N 3.2Å; N496-R498 VanDerWaalsContact C-N 3.28Å; N496-R498 HydrophobicContact CB-CG 3.88Å; N496-R498 PolarHBondContact O-N 3.44Å
499	R	91.6	Very high	83.4	Confident	168 Å²	168	70.9 Å²	70.9	63%	0.634	37%	0.366	S	S	*	.	S	Bend	trans	-129.2	125.8	179.9	-173.5	-178.1	63.4	-177.5	-0.7	110.7	W493 D494	W493-R499 WeakPolarHBondContact CA-O 3.43Å; D494-R499 PolarHBondContact N-O 3.07Å; D494-R499 VanDerWaalsContact N-O 3.09Å; D494-R499 VanDerWaalsContact OD2-CB 3.32Å; D494-R499 WeakPolarHBondContact OD2-CB 3.4Å; D494-R499 PolarHBondContact OD2-N 3.18Å
500	S	92.6	Very high	82.1	Confident	15 Å²	15	73.9 Å²	73.9	11%	0.105	38%	0.381	C	S	.	.	B	Isolated β-bridge	trans	-62.2	135.9	167.1	177.7	0	0	0	0	109.6
501	L	93.7	Very high	81.5	Confident	25 Å²	25	74.3 Å²	74.3	13%	0.131	38%	0.383	C	S	.	.	S	Bend	trans	-102.5	-9.5	-178.6	-59	179.9	0	0	0	112.6	F374 L492 W493 S512 I514	F374-L501 HydrophobicContact CD1-CD1 3.5Å; F374-L501 HydrophobicContact CE1-CD1 3.8Å; L492-L501 WeakPolarHBondContact O-CB 3.33Å; L492-L501 PolarHBondContact O-N 3.21Å; W493-L501 VanDerWaalsContact C-CD1 3.44Å; W493-L501 WeakPolarHBondContact O-CD1 3.24Å; L501-S512 VanDerWaalsContact O-CB 3.3Å; L501-S512 WeakPolarHBondContact O-CB 3.2Å; L501-S512 PolarHBondContact O-OG 2.87Å; L501-I514 HydrophobicContact CB-CG2 3.95Å; L501-I514 WeakPolarHBondContact O-CG2 3.34Å
502	F	92.3	Very high	81.3	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	39%	0.386	C	S	.	.	S	Bend	trans	-81.3	-25.5	177.3	-79.7	2.7	0	0	0	113.5	L492 L511 S512 W518 T577 I579	L492-F502 HydrophobicContact CB-CD1 3.7Å; L492-F502 HydrophobicContact CB-CE1 3.29Å; L492-F502 HydrophobicContact CB-CZ 3.82Å; L492-F502 HydrophobicContact CD2-CE1 4.33Å; L492-F502 HydrophobicContact CG-CE1 4.43Å; F502-L511 HydrophobicContact CB-CD2 3.99Å; F502-L511 HydrophobicContact CD2-CD2 4.48Å; F502-L511 HydrophobicContact CG-CD2 4.28Å; F502-S512 PolarHBondContact O-N 3.23Å; F502-S512 PolarHBondContact O-OG 3.47Å; F502-W518 HydrophobicContact CE1-CB 4.04Å; F502-W518 HydrophobicContact CE1-CD2 4.4Å; F502-W518 AromaticContact CE1-CG 3.98Å; F502-W518 HydrophobicContact CE1-CG 3.98Å; F502-W518 HydrophobicContact CZ-CB 4.23Å; F502-W518 AromaticContact CZ-CD1 3.57Å; F502-W518 HydrophobicContact CZ-CD2 4.12Å; F502-W518 AromaticContact CZ-CG 3.73Å; F502-W518 HydrophobicContact CZ-CG 3.73Å; F502-W518 AromaticContact CZ-NE1 3.84Å; F502-T577 HydrophobicContact CB-CG2 4.41Å; F502-T577 WeakPolarHBondContact CB-O 3.47Å; F502-I579 HydrophobicContact CD2-CD1 4.29Å; F502-I579 HydrophobicContact CD2-CG1 4.24Å; F502-I579 HydrophobicContact CE2-CB 4.5Å; F502-I579 HydrophobicContact CE2-CD1 3.67Å; F502-I579 HydrophobicContact CE2-CG1 3.88Å; F502-I579 HydrophobicContact CZ-CD1 4.06Å
503	Q	84	Confident	81.1	Confident	111 Å²	111	80.2 Å²	80.2	52%	0.519	41%	0.412	S	S	.	.	B	Isolated β-bridge	trans	-75.8	132.2	180	-169.4	172.2	12.3	0	0	111.3
504	S	73	Confident	80.9	Confident	33 Å²	33	81 Å²	81	23%	0.231	42%	0.417	C	S	.	.			trans	-83.1	138.7	166.9	-170.7	0	0	0	0	110.6	E506 D510	S504-E506 VanDerWaalsContact C-N 3.3Å; S504-E506 PolarHBondContact O-N 2.95Å; S504-D510 WeakPolarHBondContact CB-O 3.49Å
505	G	60.9	Low	80.9	Confident	86 Å²	86	79.7 Å²	79.7	89%	0.887	41%	0.41	S	S	*	.	S	Bend	trans	-77.7	-10	-177.6	0	0	0	0	0	115.2
506	E	56.7	Low	80.9	Confident	182 Å²	182	82.3 Å²	82.3	85%	0.85	41%	0.412	S	S	*	.	S	Bend	trans	-111.5	-17.1	-168	-61.7	-179	160	0	0	114.1	S504	S504-E506 VanDerWaalsContact C-N 3.3Å; S504-E506 PolarHBondContact O-N 2.95Å
507	K	52.5	Low	81.1	Confident	138 Å²	138	77.9 Å²	77.9	60%	0.6	39%	0.387	S	S	*	.			trans	-150.9	135.2	178.5	-68.5	177.3	-177.9	172.2	0	110.7	V509 D510	K507-V509 PolarHBondContact O-N 2.98Å; K507-V509 VanDerWaalsContact O-N 3.14Å; K507-D510 WeakPolarHBondContact CD-OD2 3.24Å; K507-D510 IonicContact NZ-OD2 2.63Å
508	E	51.7	Low	81.3	Confident	179 Å²	179	76.9 Å²	76.9	84%	0.836	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-13.5	-175.5	-60.1	-177.4	128.1	0	0	115
509	V	56.7	Low	81.5	Confident	85 Å²	85	67 Å²	67	52%	0.515	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-21	-167.3	-172.9	0	0	0	0	113.6	K507	K507-V509 PolarHBondContact O-N 2.98Å; K507-V509 VanDerWaalsContact O-N 3.14Å
510	D	70.1	Confident	81.6	Confident	76 Å²	76	59 Å²	59	41%	0.406	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-97.6	132.6	-169.5	-67.9	-32.2	0	0	0	112.7	S504 K507	S504-D510 WeakPolarHBondContact CB-O 3.49Å; K507-D510 WeakPolarHBondContact CD-OD2 3.24Å; K507-D510 IonicContact NZ-OD2 2.63Å
511	L	86.1	Confident	81.8	Confident	9 Å²	9	58.3 Å²	58.3	5%	0.047	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-60.9	140.1	165.7	-82.2	176.3	0	0	0	110.6	F502 R516 L519 I569 T577 I579	F502-L511 HydrophobicContact CB-CD2 3.99Å; F502-L511 HydrophobicContact CD2-CD2 4.48Å; F502-L511 HydrophobicContact CG-CD2 4.28Å; L511-R516 HydrophobicContact CB-CG 3.85Å; L511-R516 PolarHBondContact O-NH1 2.86Å; L511-L519 HydrophobicContact CD1-CB 4.38Å; L511-L519 HydrophobicContact CD1-CD2 3.75Å; L511-I569 HydrophobicContact CD1-CD1 3.58Å; L511-I569 HydrophobicContact CD1-CG1 3.92Å; L511-I569 HydrophobicContact CD1-CG2 4.28Å; L511-I569 HydrophobicContact CD2-CG2 4.06Å; L511-I569 HydrophobicContact CG-CD1 4.12Å; L511-I569 HydrophobicContact CG-CG1 4.44Å; L511-I569 HydrophobicContact CG-CG2 3.89Å; L511-T577 HydrophobicContact CD2-CG2 3.82Å; L511-I579 HydrophobicContact CD1-CD1 4.39Å
512	S	90.9	Very high	81.9	Confident	15 Å²	15	57.1 Å²	57.1	11%	0.105	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-58.1	164.9	168.3	73.2	0	0	0	0	112.5	L501 F502 I514 G515 R516	L501-S512 VanDerWaalsContact O-CB 3.3Å; L501-S512 WeakPolarHBondContact O-CB 3.2Å; L501-S512 PolarHBondContact O-OG 2.87Å; F502-S512 PolarHBondContact O-N 3.23Å; F502-S512 PolarHBondContact O-OG 3.47Å; S512-I514 VanDerWaalsContact C-N 3.3Å; S512-I514 PolarHBondContact O-N 2.92Å; S512-I514 WeakPolarHBondContact OG-CG2 3.29Å; S512-G515 PolarHBondContact O-N 2.89Å; S512-G515 VanDerWaalsContact O-N 3.13Å; S512-G515 PolarHBondContact OG-N 2.75Å; S512-R516 WeakPolarHBondContact O-CG 3.33Å; S512-R516 PolarHBondContact O-N 3Å
513	E	91.5	Very high	82	Confident	115 Å²	115	57.3 Å²	57.3	54%	0.537	30%	0.299	S	S	.	.	H	α-helix	trans	-57.2	-41.7	177.2	-166.9	-165.4	150	0	0	112.8	R516 K517	E513-R516 PolarHBondContact O-N 2.97Å; E513-K517 WeakPolarHBondContact O-CG 3.25Å; E513-K517 PolarHBondContact O-N 3.15Å; E513-K517 WeakPolarHBondContact OE1-CE 3.47Å; E513-K517 IonicContact OE1-NZ 3.83Å; E513-K517 PolarHBondContact OE1-NZ 3.34Å
514	I	93.6	Very high	82.4	Confident	43 Å²	43	54.2 Å²	54.2	22%	0.221	29%	0.287	C	S	.	.	H	α-helix	trans	-69.7	-33.9	178.2	-165.1	77.5	0	0	0	111.7	F374 L492 L501 S512 W518 I605	F374-I514 HydrophobicContact CE1-CD1 4.43Å; F374-I514 HydrophobicContact CE1-CG1 4.36Å; F374-I514 HydrophobicContact CZ-CD1 4Å; F374-I514 HydrophobicContact CZ-CG1 4.39Å; L492-I514 HydrophobicContact CD2-CG1 4.27Å; L501-I514 HydrophobicContact CB-CG2 3.95Å; L501-I514 WeakPolarHBondContact O-CG2 3.34Å; S512-I514 VanDerWaalsContact C-N 3.3Å; S512-I514 PolarHBondContact O-N 2.92Å; S512-I514 WeakPolarHBondContact OG-CG2 3.29Å; I514-W518 WeakPolarHBondContact O-CB 3.31Å; I514-W518 PolarHBondContact O-N 3.49Å; I514-I605 HydrophobicContact CD1-CB 4.29Å; I514-I605 HydrophobicContact CD1-CD1 3.73Å; I514-I605 HydrophobicContact CD1-CG1 3.66Å; I514-I605 HydrophobicContact CD1-CG2 3.71Å; I514-I605 HydrophobicContact CG1-CD1 3.91Å; I514-I605 HydrophobicContact CG1-CG1 4.17Å
515	G	93.7	Very high	83.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-66.5	-40.9	170.9	0	0	0	0	0	113	S512 W518 L519	S512-G515 PolarHBondContact O-N 2.89Å; S512-G515 VanDerWaalsContact O-N 3.13Å; S512-G515 PolarHBondContact OG-N 2.75Å; G515-W518 PolarHBondContact O-N 3.11Å; G515-L519 WeakPolarHBondContact O-CB 3.49Å; G515-L519 PolarHBondContact O-N 3.38Å
516	R	92.6	Very high	85.2	Confident	93 Å²	93	48.8 Å²	48.8	35%	0.351	24%	0.236	S	C	.	.	H	α-helix	trans	-64.8	-40.5	174.9	-66.5	-170.6	-53.5	-98.9	12.2	111.9	L511 S512 E513 A520 I611	L511-R516 HydrophobicContact CB-CG 3.85Å; L511-R516 PolarHBondContact O-NH1 2.86Å; S512-R516 WeakPolarHBondContact O-CG 3.33Å; S512-R516 PolarHBondContact O-N 3Å; E513-R516 PolarHBondContact O-N 2.97Å; R516-A520 WeakPolarHBondContact O-CB 3.24Å; R516-A520 PolarHBondContact O-N 3.21Å; R516-I611 HydrophobicContact CB-CG2 4.24Å; R516-I611 HydrophobicContact CG-CG2 4.47Å
517	K	95.4	Very high	86.9	Confident	34 Å²	34	41.1 Å²	41.1	15%	0.148	20%	0.203	C	C	.	.	H	α-helix	trans	-64.1	-44.7	173.8	-74.7	174.4	-174.6	175.4	0	112.4	E513 A520 G521 G604 I605 N608	E513-K517 WeakPolarHBondContact O-CG 3.25Å; E513-K517 PolarHBondContact O-N 3.15Å; E513-K517 WeakPolarHBondContact OE1-CE 3.47Å; E513-K517 IonicContact OE1-NZ 3.83Å; E513-K517 PolarHBondContact OE1-NZ 3.34Å; K517-A520 PolarHBondContact O-N 3.33Å; K517-G521 PolarHBondContact O-N 2.94Å; K517-G521 VanDerWaalsContact O-N 3.08Å; K517-G604 CarbonylContact O-C 3.52Å; K517-G604 VanDerWaalsContact O-CA 3.3Å; K517-G604 WeakPolarHBondContact O-CA 3.49Å; K517-I605 HydrophobicContact CB-CG1 4.38Å; K517-N608 WeakPolarHBondContact CE-OD1 3.44Å; K517-N608 PolarHBondContact NZ-OD1 2.94Å
518	W	96.9	Very high	89	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.4	-50.2	174.7	-177.8	-81.9	0	0	0	111.4	L369 L376 H490 L492 F502 I514 G515 A520 G521 L522 T597 I605	L369-W518 HydrophobicContact CD1-CH2 4.38Å; L369-W518 HydrophobicContact CD1-CZ3 3.93Å; L369-W518 HydrophobicContact CD2-CH2 4.5Å; L376-W518 HydrophobicContact CD1-CH2 4.14Å; L376-W518 HydrophobicContact CD1-CZ2 4Å; H490-W518 AromaticContact CD2-CE2 3.96Å; H490-W518 AromaticContact CD2-NE1 3.44Å; H490-W518 PolarHBondContact CD2-NE1 3.16Å; L492-W518 HydrophobicContact CD1-CE3 4.3Å; L492-W518 HydrophobicContact CD1-CH2 4.17Å; L492-W518 HydrophobicContact CD1-CZ3 3.84Å; L492-W518 HydrophobicContact CD2-CE3 4.15Å; L492-W518 HydrophobicContact CD2-CZ3 4.42Å; F502-W518 HydrophobicContact CE1-CB 4.04Å; F502-W518 HydrophobicContact CE1-CD2 4.4Å; F502-W518 AromaticContact CE1-CG 3.98Å; F502-W518 HydrophobicContact CE1-CG 3.98Å; F502-W518 HydrophobicContact CZ-CB 4.23Å; F502-W518 AromaticContact CZ-CD1 3.57Å; F502-W518 HydrophobicContact CZ-CD2 4.12Å; F502-W518 AromaticContact CZ-CG 3.73Å; F502-W518 HydrophobicContact CZ-CG 3.73Å; F502-W518 AromaticContact CZ-NE1 3.84Å; I514-W518 WeakPolarHBondContact O-CB 3.31Å; I514-W518 PolarHBondContact O-N 3.49Å; G515-W518 PolarHBondContact O-N 3.11Å; W518-A520 PolarHBondContact O-N 2.86Å; W518-G521 WeakPolarHBondContact O-CA 3.37Å; W518-G521 PolarHBondContact O-N 2.94Å; W518-G521 VanDerWaalsContact O-N 3.12Å; W518-L522 WeakPolarHBondContact O-CG 3.48Å; W518-L522 PolarHBondContact O-N 2.93Å; W518-T597 HydrophobicContact CZ2-CG2 4.44Å; W518-I605 HydrophobicContact CE3-CD1 3.75Å; W518-I605 HydrophobicContact CZ3-CD1 4.37Å
519	L	94.9	Very high	91.1	Very high	1 Å²	1	26 Å²	26	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-63.6	-37.5	178.4	179.7	57.6	0	0	0	113	L511 G515 G521 L522 L523 C558 F567 I569 I579 I611	L511-L519 HydrophobicContact CD1-CB 4.38Å; L511-L519 HydrophobicContact CD1-CD2 3.75Å; G515-L519 WeakPolarHBondContact O-CB 3.49Å; G515-L519 PolarHBondContact O-N 3.38Å; L519-G521 VanDerWaalsContact C-N 3.3Å; L519-G521 PolarHBondContact O-N 3.45Å; L519-L522 HydrophobicContact CD1-CD1 4.49Å; L519-L522 PolarHBondContact O-N 3.48Å; L519-L523 HydrophobicContact CD1-CD1 4.46Å; L519-L523 HydrophobicContact CD1-CG 4.49Å; L519-L523 HydrophobicContact CG-CD1 4.24Å; L519-L523 WeakPolarHBondContact O-CG 3.05Å; L519-L523 PolarHBondContact O-N 3.34Å; L519-C558 HydrophobicContact CD1-CB 4.16Å; L519-C558 HydrophobicContact CD2-CB 4.07Å; L519-C558 HydrophobicContact CG-CB 4.46Å; L519-F567 HydrophobicContact CD1-CB 3.55Å; L519-F567 HydrophobicContact CD1-CD2 4.29Å; L519-F567 HydrophobicContact CD1-CG 3.95Å; L519-I569 HydrophobicContact CD2-CD1 3.75Å; L519-I569 HydrophobicContact CD2-CG1 4.09Å; L519-I579 HydrophobicContact CB-CD1 4.12Å; L519-I579 HydrophobicContact CD1-CD1 4.4Å; L519-I611 HydrophobicContact CB-CD1 4.29Å; L519-I611 HydrophobicContact CD2-CD1 3.49Å; L519-I611 VanDerWaalsContact CD2-CD1 3.49Å; L519-I611 HydrophobicContact CG-CD1 3.66Å
520	A	94.3	Very high	93	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60.6	-39.2	172.7	0	0	0	0	0	111.8	R516 K517 W518 L523 T524 L609 I611 I614	R516-A520 WeakPolarHBondContact O-CB 3.24Å; R516-A520 PolarHBondContact O-N 3.21Å; K517-A520 PolarHBondContact O-N 3.33Å; W518-A520 PolarHBondContact O-N 2.86Å; A520-L523 PolarHBondContact O-N 3.38Å; A520-T524 WeakPolarHBondContact O-CB 3.44Å; A520-T524 PolarHBondContact O-N 3Å; A520-T524 PolarHBondContact O-OG1 2.8Å; A520-L609 HydrophobicContact CB-CB 3.66Å; A520-L609 WeakPolarHBondContact CB-O 3.35Å; A520-I611 HydrophobicContact CB-CB 4.28Å; A520-I614 HydrophobicContact CB-CD1 3.84Å
521	G	96.1	Very high	94.2	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-63	-46.6	171	0	0	0	0	0	113.4	K517 W518 L519 L523 T524 H525 A600	K517-G521 PolarHBondContact O-N 2.94Å; K517-G521 VanDerWaalsContact O-N 3.08Å; W518-G521 WeakPolarHBondContact O-CA 3.37Å; W518-G521 PolarHBondContact O-N 2.94Å; W518-G521 VanDerWaalsContact O-N 3.12Å; L519-G521 VanDerWaalsContact C-N 3.3Å; L519-G521 PolarHBondContact O-N 3.45Å; G521-L523 VanDerWaalsContact C-N 3.27Å; G521-L523 PolarHBondContact O-N 3.21Å; G521-T524 PolarHBondContact O-N 3.48Å; G521-H525 PolarHBondContact O-CD2 3Å; G521-H525 PolarHBondContact O-N 3.14Å; G521-A600 CarbonylContact C-O 3.55Å; G521-A600 WeakPolarHBondContact CA-O 3.32Å
522	L	96.3	Very high	94.6	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-57.8	-39.3	175.7	-62.9	-175.7	0	0	0	112.7	H490 W518 L519 S526 L529 F567 I579 T597 A600	H490-L522 VanDerWaalsContact NE2-CD1 3.34Å; H490-L522 WeakPolarHBondContact NE2-CD1 3.35Å; W518-L522 WeakPolarHBondContact O-CG 3.48Å; W518-L522 PolarHBondContact O-N 2.93Å; L519-L522 HydrophobicContact CD1-CD1 4.49Å; L519-L522 PolarHBondContact O-N 3.48Å; L522-S526 PolarHBondContact O-N 3.42Å; L522-L529 HydrophobicContact CD2-CD1 4.23Å; L522-F567 HydrophobicContact CB-CD1 4.17Å; L522-F567 HydrophobicContact CB-CE1 3.74Å; L522-F567 HydrophobicContact CB-CE2 4.17Å; L522-F567 HydrophobicContact CB-CZ 3.73Å; L522-F567 HydrophobicContact CD1-CD1 3.98Å; L522-F567 HydrophobicContact CD1-CE1 4.07Å; L522-F567 HydrophobicContact CG-CE1 4.41Å; L522-F567 WeakPolarHBondContact O-CE2 3.33Å; L522-F567 VanDerWaalsContact O-CZ 3.25Å; L522-F567 WeakPolarHBondContact O-CZ 3.42Å; L522-I579 HydrophobicContact CD1-CG2 4.29Å; L522-T597 HydrophobicContact CD2-CG2 3.76Å; L522-A600 HydrophobicContact CD2-CB 4Å
523	L	94	Very high	94.9	Very high	4 Å²	4	17.6 Å²	17.6	2%	0.021	9%	0.086	C	C	.	.	H	α-helix	trans	-67.1	-53.1	173.9	-72.8	162.1	0	0	0	111.2	L519 A520 G521 H525 S526 A556 C558 F567 I611 I614 F625	L519-L523 HydrophobicContact CD1-CD1 4.46Å; L519-L523 HydrophobicContact CD1-CG 4.49Å; L519-L523 HydrophobicContact CG-CD1 4.24Å; L519-L523 WeakPolarHBondContact O-CG 3.05Å; L519-L523 PolarHBondContact O-N 3.34Å; A520-L523 PolarHBondContact O-N 3.38Å; G521-L523 VanDerWaalsContact C-N 3.27Å; G521-L523 PolarHBondContact O-N 3.21Å; L523-H525 PolarHBondContact O-N 3.38Å; L523-S526 WeakPolarHBondContact O-CB 3.38Å; L523-S526 PolarHBondContact O-N 3.21Å; L523-S526 PolarHBondContact O-OG 2.84Å; L523-S526 VanDerWaalsContact O-OG 3.09Å; L523-A556 HydrophobicContact CD2-CB 4.25Å; L523-C558 HydrophobicContact CD1-CB 4.41Å; L523-F567 HydrophobicContact CD2-CD2 3.71Å; L523-F567 HydrophobicContact CD2-CE2 3.93Å; L523-F567 HydrophobicContact CG-CD2 4.09Å; L523-F567 HydrophobicContact CG-CE2 4.24Å; L523-I611 HydrophobicContact CD1-CD1 3.88Å; L523-I611 HydrophobicContact CD1-CG1 3.95Å; L523-I614 HydrophobicContact CB-CD1 4.41Å; L523-I614 HydrophobicContact CD1-CG2 4.12Å; L523-F625 HydrophobicContact CB-CD1 4.2Å; L523-F625 HydrophobicContact CB-CE1 4.43Å; L523-F625 WeakPolarHBondContact O-CD1 3.44Å
524	T	93.7	Very high	94.9	Very high	45 Å²	45	12.1 Å²	12.1	28%	0.276	6%	0.061	S	C	.	.	H	α-helix	trans	-56.1	-34.3	-178.8	-66.5	0	0	0	0	113.6	A520 G521 L609	A520-T524 WeakPolarHBondContact O-CB 3.44Å; A520-T524 PolarHBondContact O-N 3Å; A520-T524 PolarHBondContact O-OG1 2.8Å; G521-T524 PolarHBondContact O-N 3.48Å; T524-L609 HydrophobicContact CG2-CD1 4.31Å
525	H	95.6	Very high	94.6	Very high	6 Å²	6	10.7 Å²	10.7	3%	0.028	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	7.1	-179.8	-65.2	-68	0	0	0	113.5	G521 L523 A527 A528 L529 A600 D603 R607 D641 I644	G521-H525 PolarHBondContact O-CD2 3Å; G521-H525 PolarHBondContact O-N 3.14Å; L523-H525 PolarHBondContact O-N 3.38Å; H525-A527 VanDerWaalsContact C-N 3.26Å; H525-A527 PolarHBondContact O-N 2.79Å; H525-A527 VanDerWaalsContact O-N 3.09Å; H525-A528 PolarHBondContact O-N 3.02Å; H525-A528 VanDerWaalsContact O-N 3.16Å; H525-L529 HydrophobicContact CB-CD1 4.46Å; H525-L529 HydrophobicContact CB-CG 4.16Å; H525-L529 WeakPolarHBondContact O-CG 3.43Å; H525-L529 PolarHBondContact O-N 3.49Å; H525-A600 HydrophobicContact CB-CB 3.73Å; H525-D603 IonicContact NE2-OD2 3.62Å; H525-D603 PolarHBondContact NE2-OD2 3.04Å; H525-R607 PolarHBondContact NE2-NH2 2.84Å; H525-R607 VanDerWaalsContact NE2-NH2 3.15Å; H525-D641 IonicContact CE1-OD1 2.72Å; H525-D641 PolarHBondContact CE1-OD1 2.99Å; H525-D641 IonicContact CE1-OD2 3.21Å; H525-D641 IonicContact CG-OD2 3.89Å; H525-D641 VanDerWaalsContact ND1-CG 3.32Å; H525-D641 IonicContact ND1-OD1 3.48Å; H525-D641 PolarHBondContact ND1-OD1 2.9Å; H525-D641 VanDerWaalsContact ND1-OD1 3.16Å; H525-D641 IonicContact ND1-OD2 2.78Å; H525-D641 PolarHBondContact ND1-OD2 2.89Å; H525-I644 HydrophobicContact CB-CD1 4.09Å; H525-I644 HydrophobicContact CB-CG1 4Å
526	S	95.3	Very high	94.2	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-58.6	-31.9	-166.6	67.7	0	0	0	0	114.7	L522 L523 S530 A556	L522-S526 PolarHBondContact O-N 3.42Å; L523-S526 WeakPolarHBondContact O-CB 3.38Å; L523-S526 PolarHBondContact O-N 3.21Å; L523-S526 PolarHBondContact O-OG 2.84Å; L523-S526 VanDerWaalsContact O-OG 3.09Å; S526-S530 VanDerWaalsContact O-CB 3.3Å; S526-S530 WeakPolarHBondContact O-CB 3.36Å; S526-S530 PolarHBondContact O-N 3.43Å; S526-A556 VanDerWaalsContact CB-CB 3.41Å; S526-A556 VanDerWaalsContact OG-CB 3.32Å; S526-A556 WeakPolarHBondContact OG-CB 3.19Å
527	A	94.1	Very high	93.8	Very high	20 Å²	20	9.1 Å²	9.1	17%	0.165	5%	0.053	C	C	.	.	H	α-helix	trans	-64.6	-53.3	177.7	0	0	0	0	0	111.3	H525 S530 C531 A626 P628 A637	H525-A527 VanDerWaalsContact C-N 3.26Å; H525-A527 PolarHBondContact O-N 2.79Å; H525-A527 VanDerWaalsContact O-N 3.09Å; A527-S530 PolarHBondContact O-N 2.94Å; A527-S530 PolarHBondContact O-OG 2.68Å; A527-C531 PolarHBondContact O-N 2.75Å; A527-A626 WeakPolarHBondContact CB-O 3.4Å; A527-P628 HydrophobicContact CB-CG 4.33Å; A527-A637 HydrophobicContact CB-CB 3.82Å
528	A	95.8	Very high	93.2	Very high	1 Å²	1	8.1 Å²	8.1	1%	0.008	5%	0.052	C	C	.	.	H	α-helix	trans	-64.3	-41.1	175.7	0	0	0	0	0	112.4	H525 S530 C531 L532 L638 D641 I644	H525-A528 PolarHBondContact O-N 3.02Å; H525-A528 VanDerWaalsContact O-N 3.16Å; A528-S530 VanDerWaalsContact C-N 3.32Å; A528-S530 PolarHBondContact O-N 3.39Å; A528-C531 VanDerWaalsContact O-CB 3.27Å; A528-C531 WeakPolarHBondContact O-CB 3.42Å; A528-C531 PolarHBondContact O-N 2.96Å; A528-C531 VanDerWaalsContact O-N 3.16Å; A528-L532 PolarHBondContact O-N 2.98Å; A528-L638 HydrophobicContact CB-CD1 4.02Å; A528-D641 HydrophobicContact CB-CB 3.68Å; A528-D641 WeakPolarHBondContact CB-OD2 3.36Å; A528-I644 HydrophobicContact CB-CB 4.47Å; A528-I644 HydrophobicContact CB-CG1 4.39Å; A528-I644 HydrophobicContact CB-CG2 4.47Å
529	L	96.7	Very high	92.7	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-57.8	-44.5	172.8	-65.7	-173	0	0	0	111.2	L522 H525 C531 L532 M533 F567 L583 A596 A600 I644	L522-L529 HydrophobicContact CD2-CD1 4.23Å; H525-L529 HydrophobicContact CB-CD1 4.46Å; H525-L529 HydrophobicContact CB-CG 4.16Å; H525-L529 WeakPolarHBondContact O-CG 3.43Å; H525-L529 PolarHBondContact O-N 3.49Å; L529-C531 PolarHBondContact O-N 3.49Å; L529-L532 PolarHBondContact O-N 2.92Å; L529-M533 HydrophobicContact CB-CE 4.07Å; L529-M533 HydrophobicContact CB-SD 3.99Å; L529-M533 HydrophobicContact CD1-CE 4.31Å; L529-M533 HydrophobicContact CD2-CE 3.82Å; L529-M533 HydrophobicContact CG-CE 4.28Å; L529-M533 VanDerWaalsContact O-CB 3.26Å; L529-M533 WeakPolarHBondContact O-CB 3.26Å; L529-M533 WeakPolarHBondContact O-CG 3.41Å; L529-M533 PolarHBondContact O-N 2.91Å; L529-F567 HydrophobicContact CD1-CZ 4.47Å; L529-L583 HydrophobicContact CB-CD1 4.13Å; L529-A596 HydrophobicContact CD2-CB 3.64Å; L529-A596 WeakPolarHBondContact CD2-O 3.46Å; L529-A600 HydrophobicContact CD1-CB 3.86Å; L529-A600 HydrophobicContact CD2-CB 4.03Å; L529-A600 HydrophobicContact CG-CB 4.29Å; L529-I644 HydrophobicContact CD2-CD1 4.28Å
530	S	95.1	Very high	92.3	Very high	2 Å²	2	8.4 Å²	8.4	1%	0.014	5%	0.054	C	C	.	.	H	α-helix	trans	-62.1	-30.3	179	84.6	0	0	0	0	112.9	S526 A527 A528 S534 R540	S526-S530 VanDerWaalsContact O-CB 3.3Å; S526-S530 WeakPolarHBondContact O-CB 3.36Å; S526-S530 PolarHBondContact O-N 3.43Å; A527-S530 PolarHBondContact O-N 2.94Å; A527-S530 PolarHBondContact O-OG 2.68Å; A528-S530 VanDerWaalsContact C-N 3.32Å; A528-S530 PolarHBondContact O-N 3.39Å; S530-S534 WeakPolarHBondContact O-CB 3.37Å; S530-S534 PolarHBondContact O-N 2.91Å; S530-R540 PolarHBondContact O-NH2 2.81Å
531	C	95.3	Very high	91.8	Very high	1 Å²	1	10.3 Å²	10.3	1%	0.007	7%	0.067	C	C	.	.	H	α-helix	trans	-63.2	-48.8	175.1	-169.4	0	0	0	0	111.6	A527 A528 L529 P535 A634 L638	A527-C531 PolarHBondContact O-N 2.75Å; A528-C531 VanDerWaalsContact O-CB 3.27Å; A528-C531 WeakPolarHBondContact O-CB 3.42Å; A528-C531 PolarHBondContact O-N 2.96Å; A528-C531 VanDerWaalsContact O-N 3.16Å; L529-C531 PolarHBondContact O-N 3.49Å; C531-P535 WeakPolarHBondContact O-CA 3.13Å; C531-A634 HydrophobicContact CB-CB 3.87Å; C531-A634 VanDerWaalsContact CB-O 3.27Å; C531-A634 WeakPolarHBondContact CB-O 3.42Å; C531-A634 PolarHBondContact SG-O 3.38Å; C531-L638 HydrophobicContact CB-CB 4.1Å; C531-L638 HydrophobicContact CB-CD2 4.42Å
532	L	96.1	Very high	91.2	Very high	4 Å²	4	13.2 Å²	13.2	2%	0.021	8%	0.08	C	C	.	.	H	α-helix	trans	-74.8	-34.8	-177.1	-62.9	164.7	0	0	0	112.8	A528 L529 I592 A596 L638 I644 L648 F652 F656	A528-L532 PolarHBondContact O-N 2.98Å; L529-L532 PolarHBondContact O-N 2.92Å; L532-I592 HydrophobicContact CB-CG2 3.96Å; L532-I592 HydrophobicContact CD2-CG2 3.96Å; L532-I592 HydrophobicContact CG-CG2 4.41Å; L532-A596 HydrophobicContact CD1-CB 3.76Å; L532-L638 HydrophobicContact CD1-CD1 3.9Å; L532-L638 HydrophobicContact CD2-CD1 4.26Å; L532-L638 HydrophobicContact CD2-CD2 3.91Å; L532-L638 HydrophobicContact CG-CD1 4.05Å; L532-L638 HydrophobicContact CG-CD2 4.29Å; L532-I644 HydrophobicContact CD1-CG2 3.87Å; L532-L648 HydrophobicContact CD1-CD1 3.47Å; L532-L648 VanDerWaalsContact CD1-CD1 3.47Å; L532-L648 HydrophobicContact CD2-CD1 4.18Å; L532-L648 HydrophobicContact CG-CD1 4.5Å; L532-F652 HydrophobicContact CD2-CE1 4.14Å; L532-F656 HydrophobicContact CD2-CD1 4.21Å; L532-F656 HydrophobicContact CD2-CE1 3.97Å; L532-F656 HydrophobicContact CD2-CE2 4.36Å; L532-F656 HydrophobicContact CD2-CZ 4.04Å
533	M	95.5	Very high	90.5	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-92.7	-22.8	-173.7	-61	174.6	179.4	0	0	113.8	L529 P535 N581 L583 G584 S585 A588 V593 A596 T597	L529-M533 HydrophobicContact CB-CE 4.07Å; L529-M533 HydrophobicContact CB-SD 3.99Å; L529-M533 HydrophobicContact CD1-CE 4.31Å; L529-M533 HydrophobicContact CD2-CE 3.82Å; L529-M533 HydrophobicContact CG-CE 4.28Å; L529-M533 VanDerWaalsContact O-CB 3.26Å; L529-M533 WeakPolarHBondContact O-CB 3.26Å; L529-M533 WeakPolarHBondContact O-CG 3.41Å; L529-M533 PolarHBondContact O-N 2.91Å; M533-P535 WeakPolarHBondContact O-CD 3.32Å; M533-N581 WeakPolarHBondContact CE-ND2 3.33Å; M533-N581 PolarHBondContact SD-ND2 2.96Å; M533-L583 HydrophobicContact SD-CB 4.22Å; M533-G584 VanDerWaalsContact O-CA 3.31Å; M533-G584 WeakPolarHBondContact O-CA 3.39Å; M533-S585 PolarHBondContact O-N 3.18Å; M533-A588 WeakPolarHBondContact O-CB 3.47Å; M533-V593 HydrophobicContact CE-CG1 4.31Å; M533-V593 HydrophobicContact CG-CG1 4.28Å; M533-V593 HydrophobicContact CG-CG2 4.17Å; M533-V593 HydrophobicContact SD-CG1 4.49Å; M533-A596 HydrophobicContact CE-CB 4Å; M533-T597 WeakPolarHBondContact CE-OG1 3.41Å
534	S	92.4	Very high	90	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.007	10%	0.1	C	C	.	.	S	Bend	trans	-123.4	68.1	170.7	-78.7	0	0	0	0	110.5	S530 G536 R540 L583	S530-S534 WeakPolarHBondContact O-CB 3.37Å; S530-S534 PolarHBondContact O-N 2.91Å; S534-G536 VanDerWaalsContact C-N 3.33Å; S534-G536 PolarHBondContact O-N 3.43Å; S534-R540 PolarHBondContact O-NH2 3.16Å; S534-L583 PolarHBondContact OG-O 3.18Å
535	P	87.9	Confident	89.4	Confident	13 Å²	13	19.5 Å²	19.5	8%	0.084	11%	0.112	C	C	.	.			trans	-83.5	1.5	-165.7	35.5	-39.6	0	0	0	114.8	C531 M533 F656 K660	C531-P535 WeakPolarHBondContact O-CA 3.13Å; M533-P535 WeakPolarHBondContact O-CD 3.32Å; P535-F656 HydrophobicContact CB-CE2 4.48Å; P535-F656 HydrophobicContact CB-CZ 4.12Å; P535-K660 WeakPolarHBondContact O-CE 3.42Å; P535-K660 PolarHBondContact O-NZ 3.45Å
536	G	84	Confident	88.4	Confident	4 Å²	4	23.4 Å²	23.4	4%	0.041	14%	0.136	C	C	.	.	S	Bend	trans	-99.7	149.9	-178.3	0	0	0	0	0	113.2	S534 G538 C539 R540	S534-G536 VanDerWaalsContact C-N 3.33Å; S534-G536 PolarHBondContact O-N 3.43Å; G536-G538 PolarHBondContact O-N 2.95Å; G536-C539 VanDerWaalsContact O-CB 3.26Å; G536-C539 WeakPolarHBondContact O-CB 3.48Å; G536-C539 PolarHBondContact O-N 3.49Å; G536-C539 VanDerWaalsContact O-N 3.14Å; G536-R540 PolarHBondContact O-N 3.43Å
537	L	84.4	Confident	87.4	Confident	55 Å²	55	25 Å²	25	29%	0.288	14%	0.144	S	C	.	.	H	α-helix	trans	-58.6	-46.6	176.9	-69	171.3	0	0	0	112.2	C539 R540 S541 L631 I664 Q667	L537-C539 PolarHBondContact O-N 3.05Å; L537-R540 WeakPolarHBondContact O-CA 3.43Å; L537-R540 WeakPolarHBondContact O-CB 3.23Å; L537-R540 PolarHBondContact O-N 3.31Å; L537-S541 PolarHBondContact O-N 3.01Å; L537-L631 HydrophobicContact CD2-CB 3.98Å; L537-L631 HydrophobicContact CD2-CD2 3.66Å; L537-L631 HydrophobicContact CD2-CG 4.49Å; L537-L631 HydrophobicContact CG-CD2 4.24Å; L537-I664 HydrophobicContact CD2-CG1 4.05Å; L537-Q667 HydrophobicContact CD1-CB 3.64Å; L537-Q667 HydrophobicContact CD1-CG 3.87Å
538	G	83.3	Confident	86.1	Confident	13 Å²	13	33.8 Å²	33.8	13%	0.134	18%	0.179	C	C	.	.	H	α-helix	trans	-58.5	-30.8	175.9	0	0	0	0	0	113.8	G536 R540 S541 H542	G536-G538 PolarHBondContact O-N 2.95Å; G538-R540 VanDerWaalsContact C-N 3.29Å; G538-R540 PolarHBondContact O-N 2.86Å; G538-S541 PolarHBondContact O-N 2.73Å; G538-H542 PolarHBondContact O-N 2.97Å
539	C	85.4	Confident	84.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.6	-38.4	173.9	-48.5	0	0	0	0	111.1	T478 Y483 G536 L537 I543	T478-C539 HydrophobicContact CG2-CB 4.41Å; Y483-C539 HydrophobicContact CE2-CB 4.47Å; G536-C539 VanDerWaalsContact O-CB 3.26Å; G536-C539 WeakPolarHBondContact O-CB 3.48Å; G536-C539 PolarHBondContact O-N 3.49Å; G536-C539 VanDerWaalsContact O-N 3.14Å; L537-C539 PolarHBondContact O-N 3.05Å; C539-I543 WeakPolarHBondContact O-CD1 3.34Å; C539-I543 VanDerWaalsContact O-CG1 3.26Å; C539-I543 WeakPolarHBondContact O-CG1 3.34Å; C539-I543 PolarHBondContact O-N 3.01Å; C539-I543 VanDerWaalsContact O-N 3.13Å
540	R	87.8	Confident	83.2	Confident	8 Å²	8	43.8 Å²	43.8	3%	0.03	24%	0.239	C	C	.	.	H	α-helix	trans	-71.9	-42.5	175.5	-65.1	-67.9	175.5	-122.4	-27.7	111.8	S530 S534 G536 L537 G538 H542 I543 A544 P628 L631	S530-R540 PolarHBondContact O-NH2 2.81Å; S534-R540 PolarHBondContact O-NH2 3.16Å; G536-R540 PolarHBondContact O-N 3.43Å; L537-R540 WeakPolarHBondContact O-CA 3.43Å; L537-R540 WeakPolarHBondContact O-CB 3.23Å; L537-R540 PolarHBondContact O-N 3.31Å; G538-R540 VanDerWaalsContact C-N 3.29Å; G538-R540 PolarHBondContact O-N 2.86Å; R540-H542 VanDerWaalsContact C-N 3.31Å; R540-H542 PolarHBondContact O-N 3.46Å; R540-I543 PolarHBondContact O-N 2.94Å; R540-A544 WeakPolarHBondContact O-CB 3.17Å; R540-A544 PolarHBondContact O-N 3.25Å; R540-P628 WeakPolarHBondContact CD-O 3.12Å; R540-P628 PolarHBondContact NH1-O 3.29Å; R540-L631 HydrophobicContact CG-CB 4.25Å
541	S	83.4	Confident	81.6	Confident	39 Å²	39	52.8 Å²	52.8	27%	0.273	28%	0.278	S	S	.	.	H	α-helix	trans	-54.3	-46.9	172.4	-60.9	0	0	0	0	112.2	D480 L537 G538 A544 K545	D480-S541 WeakPolarHBondContact OD1-CB 3.43Å; D480-S541 PolarHBondContact OD1-OG 3.12Å; L537-S541 PolarHBondContact O-N 3.01Å; G538-S541 PolarHBondContact O-N 2.73Å; S541-A544 PolarHBondContact O-N 3.38Å; S541-K545 WeakPolarHBondContact O-CG 3.46Å; S541-K545 PolarHBondContact O-N 3.04Å
542	H	83.4	Confident	80.3	Confident	61 Å²	61	61.5 Å²	61.5	28%	0.282	31%	0.311	S	S	.	.	H	α-helix	trans	-63.8	-43.7	178.3	-179.5	-102.5	0	0	0	112.6	Y483 G538 R540 A544 K545 T546	Y483-H542 HydrophobicContact CD2-CB 3.86Å; Y483-H542 AromaticContact CD2-CE1 3.95Å; Y483-H542 AromaticContact CD2-CG 3.58Å; Y483-H542 AromaticContact CD2-ND1 3.22Å; Y483-H542 WeakPolarHBondContact CD2-ND1 3.3Å; Y483-H542 AromaticContact CE2-ND1 3.93Å; Y483-H542 AromaticContact CG-CE1 3.65Å; Y483-H542 AromaticContact CG-CG 3.87Å; Y483-H542 AromaticContact CG-ND1 3.41Å; G538-H542 PolarHBondContact O-N 2.97Å; R540-H542 VanDerWaalsContact C-N 3.31Å; R540-H542 PolarHBondContact O-N 3.46Å; H542-A544 VanDerWaalsContact C-N 3.33Å; H542-A544 PolarHBondContact O-N 2.9Å; H542-K545 PolarHBondContact O-N 3.15Å; H542-T546 PolarHBondContact O-N 2.87Å; H542-T546 PolarHBondContact O-OG1 3.44Å
543	I	82.4	Confident	79.2	Confident	21 Å²	21	64.4 Å²	64.4	11%	0.108	33%	0.329	C	S	.	.	H	α-helix	trans	-57.9	-45.9	173.5	-73.7	165.9	0	0	0	110.7	C539 R540 T546 L554 V629	C539-I543 WeakPolarHBondContact O-CD1 3.34Å; C539-I543 VanDerWaalsContact O-CG1 3.26Å; C539-I543 WeakPolarHBondContact O-CG1 3.34Å; C539-I543 PolarHBondContact O-N 3.01Å; C539-I543 VanDerWaalsContact O-N 3.13Å; R540-I543 PolarHBondContact O-N 2.94Å; I543-T546 WeakPolarHBondContact O-CB 3.26Å; I543-T546 PolarHBondContact O-N 3.02Å; I543-L554 HydrophobicContact CG2-CD2 3.72Å; I543-V629 HydrophobicContact CG2-CB 4.47Å; I543-V629 HydrophobicContact CG2-CG1 4.16Å
544	A	81.9	Confident	78.5	Confident	40 Å²	40	67 Å²	67	33%	0.331	34%	0.343	S	S	.	.	H	α-helix	trans	-63.5	-43.4	177.7	0	0	0	0	0	112.5	R540 S541 H542 T546 I547	R540-A544 WeakPolarHBondContact O-CB 3.17Å; R540-A544 PolarHBondContact O-N 3.25Å; S541-A544 PolarHBondContact O-N 3.38Å; H542-A544 VanDerWaalsContact C-N 3.33Å; H542-A544 PolarHBondContact O-N 2.9Å; A544-T546 VanDerWaalsContact C-N 3.25Å; A544-T546 PolarHBondContact O-N 2.72Å; A544-I547 WeakPolarHBondContact O-CB 3.27Å; A544-I547 PolarHBondContact O-N 3.21Å
545	K	81.2	Confident	78.2	Confident	121 Å²	121	69.7 Å²	69.7	53%	0.526	35%	0.353	S	S	.	.	H	α-helix	trans	-64.9	-26.5	177.1	-72.3	179.9	-172.5	-170.4	0	113.8	D480 S541 H542 I547	D480-K545 VanDerWaalsContact CG-NZ 3.34Å; D480-K545 PolarHBondContact O-NZ 3.46Å; D480-K545 WeakPolarHBondContact OD2-CE 3.27Å; D480-K545 IonicContact OD2-NZ 3.65Å; D480-K545 PolarHBondContact OD2-NZ 3.44Å; S541-K545 WeakPolarHBondContact O-CG 3.46Å; S541-K545 PolarHBondContact O-N 3.04Å; H542-K545 PolarHBondContact O-N 3.15Å; K545-I547 PolarHBondContact O-N 3.1Å
546	T	74.1	Confident	78.2	Confident	88 Å²	88	69.4 Å²	69.4	54%	0.54	35%	0.352	S	S	.	.	H	α-helix	trans	-66.6	-24.2	174.3	-57	0	0	0	0	111.6	H542 I543 A544 K548	H542-T546 PolarHBondContact O-N 2.87Å; H542-T546 PolarHBondContact O-OG1 3.44Å; I543-T546 WeakPolarHBondContact O-CB 3.26Å; I543-T546 PolarHBondContact O-N 3.02Å; A544-T546 VanDerWaalsContact C-N 3.25Å; A544-T546 PolarHBondContact O-N 2.72Å; T546-K548 PolarHBondContact O-N 3.16Å
547	I	74.9	Confident	78.4	Confident	32 Å²	32	72.2 Å²	72.2	16%	0.164	37%	0.368	C	S	.	.			trans	-89.8	95.9	-177.9	-59.5	166.4	0	0	0	109.8	A544 K545 D549 R552 L554 V629	A544-I547 WeakPolarHBondContact O-CB 3.27Å; A544-I547 PolarHBondContact O-N 3.21Å; K545-I547 PolarHBondContact O-N 3.1Å; I547-D549 WeakPolarHBondContact CG2-O 3.28Å; I547-D549 PolarHBondContact O-N 2.71Å; I547-R552 HydrophobicContact CG2-CB 4.2Å; I547-R552 VanDerWaalsContact CG2-O 3.22Å; I547-R552 WeakPolarHBondContact CG2-O 3.3Å; I547-L554 HydrophobicContact CD1-CB 3.82Å; I547-L554 HydrophobicContact CG1-CB 4.33Å; I547-V629 HydrophobicContact CD1-CG1 3.43Å; I547-V629 VanDerWaalsContact CD1-CG1 3.43Å
548	K	67.8	Low	78.7	Confident	206 Å²	206	70.9 Å²	70.9	90%	0.896	36%	0.363	S	S	*	.	S	Bend	trans	-70	-11.8	-178.1	-63.2	-174.4	178.8	-177.9	0	115.7	T546	T546-K548 PolarHBondContact O-N 3.16Å
549	D	69.6	Low	78.8	Confident	78 Å²	78	71.1 Å²	71.1	42%	0.417	37%	0.366	S	S	.	.	S	Bend	trans	-127.6	113.8	176.2	171.6	9.8	0	0	0	108.8	I547 K551 R552	I547-D549 WeakPolarHBondContact CG2-O 3.28Å; I547-D549 PolarHBondContact O-N 2.71Å; D549-K551 PolarHBondContact O-N 3.32Å; D549-K551 WeakPolarHBondContact OD1-CB 3.31Å; D549-K551 PolarHBondContact OD1-N 3.03Å; D549-R552 HydrophobicContact CB-CB 4.21Å; D549-R552 WeakPolarHBondContact O-CB 3.46Å; D549-R552 PolarHBondContact O-N 3.18Å
550	P	61.1	Low	78.9	Confident	133 Å²	133	74 Å²	74	86%	0.864	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-15.9	179.1	-27.1	35.8	0	0	0	115.5
551	K	62.6	Low	78.9	Confident	190 Å²	190	76.6 Å²	76.6	83%	0.826	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-13.6	174.6	-61.2	178.7	-179.6	177.8	0	113.4	D549 V553	D549-K551 PolarHBondContact O-N 3.32Å; D549-K551 WeakPolarHBondContact OD1-CB 3.31Å; D549-K551 PolarHBondContact OD1-N 3.03Å; K551-V553 PolarHBondContact O-N 3.37Å
552	R	67.6	Low	79	Confident	184 Å²	184	77.6 Å²	77.6	69%	0.694	40%	0.402	S	S	*	.			trans	-87.7	107.8	-176.4	-177	176.4	179.6	175.8	0.1	110.9	I547 D549	I547-R552 HydrophobicContact CG2-CB 4.2Å; I547-R552 VanDerWaalsContact CG2-O 3.22Å; I547-R552 WeakPolarHBondContact CG2-O 3.3Å; D549-R552 HydrophobicContact CB-CB 4.21Å; D549-R552 WeakPolarHBondContact O-CB 3.46Å; D549-R552 PolarHBondContact O-N 3.18Å
553	V	72.3	Confident	79.1	Confident	66 Å²	66	79.4 Å²	79.4	40%	0.4	41%	0.414	S	S	.	.			trans	-62.3	136.2	166.3	-179.1	0	0	0	0	109.6	K551 Y555 A626	K551-V553 PolarHBondContact O-N 3.37Å; V553-Y555 HydrophobicContact CB-CE1 4.03Å; V553-Y555 HydrophobicContact CB-CE2 4.21Å; V553-Y555 HydrophobicContact CG1-CD1 4Å; V553-Y555 HydrophobicContact CG1-CE1 3.49Å; V553-Y555 VanDerWaalsContact CG1-CE1 3.49Å; V553-Y555 HydrophobicContact CG1-CE2 4.44Å; V553-A626 HydrophobicContact CG1-CB 3.63Å
554	L	82.1	Confident	79.3	Confident	55 Å²	55	83.3 Å²	83.3	29%	0.288	44%	0.443	S	S	.	.			trans	-83.7	133.5	168	178.9	65.4	0	0	0	109.1	I543 I547 A626 I627	I543-L554 HydrophobicContact CG2-CD2 3.72Å; I547-L554 HydrophobicContact CD1-CB 3.82Å; I547-L554 HydrophobicContact CG1-CB 4.33Å; L554-A626 CarbonylContact O-C 3.6Å; L554-A626 WeakPolarHBondContact O-CA 3.45Å; L554-I627 HydrophobicContact CD2-CB 4.14Å; L554-I627 HydrophobicContact CD2-CD1 4.22Å; L554-I627 HydrophobicContact CD2-CG2 4.22Å; L554-I627 HydrophobicContact CG-CB 4.22Å; L554-I627 HydrophobicContact CG-CD1 4.23Å; L554-I627 PolarHBondContact O-N 2.91Å
555	Y	85.5	Confident	79.6	Confident	56 Å²	56	81.7 Å²	81.7	22%	0.22	43%	0.429	C	S	.	.	B	Isolated β-bridge	trans	-116.3	148.5	177.7	-58.9	-67.4	0	0	0	110.4	V553 T557 Q622 F625 A626	V553-Y555 HydrophobicContact CB-CE1 4.03Å; V553-Y555 HydrophobicContact CB-CE2 4.21Å; V553-Y555 HydrophobicContact CG1-CD1 4Å; V553-Y555 HydrophobicContact CG1-CE1 3.49Å; V553-Y555 VanDerWaalsContact CG1-CE1 3.49Å; V553-Y555 HydrophobicContact CG1-CE2 4.44Å; Y555-T557 PolarHBondContact O-N 2.89Å; Y555-Q622 HydrophobicContact CD1-CB 4.31Å; Y555-Q622 WeakPolarHBondContact CD1-O 3.41Å; Y555-Q622 HydrophobicContact CE1-CB 4.15Å; Y555-Q622 WeakPolarHBondContact CE1-O 3.26Å; Y555-Q622 HydrophobicContact CE2-CB 4.47Å; Y555-F625 CarbonylContact C-O 3.06Å; Y555-F625 WeakPolarHBondContact CA-O 3.16Å; Y555-A626 HydrophobicContact CD1-CB 4.3Å; Y555-A626 HydrophobicContact CE1-CB 4.26Å
556	A	87.9	Confident	80.1	Confident	8 Å²	8	76.8 Å²	76.8	7%	0.066	41%	0.41	C	S	.	.			trans	-68.6	128.4	167.7	0	0	0	0	0	110.1	L523 S526 S566 F567 F625 I627	L523-A556 HydrophobicContact CD2-CB 4.25Å; S526-A556 VanDerWaalsContact CB-CB 3.41Å; S526-A556 VanDerWaalsContact OG-CB 3.32Å; S526-A556 WeakPolarHBondContact OG-CB 3.19Å; A556-S566 WeakPolarHBondContact CA-OG 3.49Å; A556-F567 HydrophobicContact CB-CE2 4.12Å; A556-F625 HydrophobicContact CB-CB 4.47Å; A556-F625 PolarHBondContact N-O 3.12Å; A556-I627 HydrophobicContact CB-CD1 4.02Å; A556-I627 HydrophobicContact CB-CG1 4.2Å
557	T	88.7	Confident	81.1	Confident	62 Å²	62	72.6 Å²	72.6	38%	0.38	38%	0.384	S	S	.	.			trans	-117.2	153.6	-176.2	49.8	0	0	0	0	111.5	Y555 S565 S566 F567	Y555-T557 PolarHBondContact O-N 2.89Å; T557-S565 WeakPolarHBondContact OG1-CA 3.34Å; T557-S566 PolarHBondContact N-OG 3.27Å; T557-S566 VanDerWaalsContact N-OG 3.09Å; T557-S566 CarbonylContact O-C 3.54Å; T557-S566 WeakPolarHBondContact O-CA 3.45Å; T557-S566 WeakPolarHBondContact O-CB 3.3Å; T557-S566 PolarHBondContact O-N 3.29Å; T557-S566 PolarHBondContact OG1-N 3.12Å; T557-S566 VanDerWaalsContact OG1-N 3.11Å; T557-S566 PolarHBondContact OG1-OG 2.74Å; T557-F567 PolarHBondContact O-N 3.45Å
558	C	88.9	Confident	82	Confident	27 Å²	27	71 Å²	71	18%	0.182	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	147.4	171.1	64.3	0	0	0	0	111.3	L519 L523 F567	L519-C558 HydrophobicContact CD1-CB 4.16Å; L519-C558 HydrophobicContact CD2-CB 4.07Å; L519-C558 HydrophobicContact CG-CB 4.46Å; L523-C558 HydrophobicContact CD1-CB 4.41Å; C558-F567 VanDerWaalsContact CA-O 3.27Å; C558-F567 WeakPolarHBondContact CA-O 3.14Å; C558-F567 HydrophobicContact CB-CB 4.17Å
559	G	86.2	Confident	83.2	Confident	19 Å²	19	61.9 Å²	61.9	20%	0.196	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	156.6	178.9	0	0	0	0	0	112.1	S565 F567 N568 I569	G559-S565 PolarHBondContact N-OG 3.04Å; G559-F567 PolarHBondContact N-O 3.25Å; G559-N568 PolarHBondContact O-OD1 2.8Å; G559-I569 PolarHBondContact O-N 2.76Å
560	C	87.8	Confident	84.2	Confident	59 Å²	59	59.6 Å²	59.6	40%	0.399	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	121.5	175.8	-67.8	0	0	0	0	110.9	D562 I569	C560-D562 PolarHBondContact O-N 3.16Å; C560-D562 VanDerWaalsContact O-N 3.1Å; C560-I569 CarbonylContact C-O 3.47Å; C560-I569 WeakPolarHBondContact CA-O 3.47Å
561	N	86.4	Confident	85.3	Confident	64 Å²	64	54.6 Å²	54.6	34%	0.342	29%	0.291	S	S	.	.	S	Bend	trans	59.2	12.4	179.8	-48.9	-50.2	0	0	0	115.2	N563 N568 I569 C571 H572	N561-N563 PolarHBondContact O-N 3.16Å; N561-N568 VanDerWaalsContact C-OD1 3.27Å; N561-N568 WeakPolarHBondContact CA-OD1 3.38Å; N561-N568 PolarHBondContact N-OD1 2.97Å; N561-I569 PolarHBondContact N-O 2.9Å; N561-I569 PolarHBondContact OD1-O 3.12Å; N561-C571 PolarHBondContact ND2-SG 2.84Å; N561-C571 PolarHBondContact OD1-N 2.84Å; N561-H572 VanDerWaalsContact CG-ND1 3.33Å; N561-H572 PolarHBondContact OD1-CE1 2.81Å; N561-H572 PolarHBondContact OD1-ND1 3.48Å
562	D	87.1	Confident	86	Confident	59 Å²	59	50.5 Å²	50.5	32%	0.316	28%	0.275	S	S	.	.			trans	-85.4	106.2	177.8	168.6	30.4	0	0	0	111.5	C560 S564 S565 N568	C560-D562 PolarHBondContact O-N 3.16Å; C560-D562 VanDerWaalsContact O-N 3.1Å; D562-S564 VanDerWaalsContact CG-OG 3.26Å; D562-S564 PolarHBondContact O-N 3.09Å; D562-S564 VanDerWaalsContact O-N 3.16Å; D562-S564 WeakPolarHBondContact OD1-CA 3.3Å; D562-S564 WeakPolarHBondContact OD1-CB 3.48Å; D562-S564 PolarHBondContact OD1-N 3.25Å; D562-S564 PolarHBondContact OD1-OG 3.19Å; D562-S564 PolarHBondContact OD2-OG 2.88Å; D562-S564 VanDerWaalsContact OD2-OG 3.09Å; D562-S565 PolarHBondContact O-N 3.41Å; D562-S565 VanDerWaalsContact O-N 3.17Å; D562-S565 VanDerWaalsContact OD2-CB 3.31Å; D562-S565 WeakPolarHBondContact OD2-CB 3.49Å; D562-S565 PolarHBondContact OD2-N 3.33Å; D562-S565 VanDerWaalsContact OD2-N 3.09Å; D562-S565 PolarHBondContact OD2-OG 3.32Å; D562-N568 VanDerWaalsContact C-ND2 3.26Å; D562-N568 PolarHBondContact N-OD1 2.96Å; D562-N568 WeakPolarHBondContact O-CB 3.39Å; D562-N568 PolarHBondContact O-ND2 2.91Å; D562-N568 VanDerWaalsContact O-ND2 3.07Å
563	N	85.7	Confident	86	Confident	100 Å²	100	45.2 Å²	45.2	54%	0.535	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-8.6	179	-69.9	-21	0	0	0	114.2	N561 N568 K570 K582	N561-N563 PolarHBondContact O-N 3.16Å; N563-N568 PolarHBondContact OD1-ND2 2.89Å; N563-K570 PolarHBondContact OD1-NZ 3.44Å; N563-K582 PolarHBondContact O-NZ 2.81Å
564	S	85.2	Confident	85.8	Confident	102 Å²	102	46 Å²	46	71%	0.713	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-13.3	173	76.2	0	0	0	0	114.2	D562	D562-S564 VanDerWaalsContact CG-OG 3.26Å; D562-S564 PolarHBondContact O-N 3.09Å; D562-S564 VanDerWaalsContact O-N 3.16Å; D562-S564 WeakPolarHBondContact OD1-CA 3.3Å; D562-S564 WeakPolarHBondContact OD1-CB 3.48Å; D562-S564 PolarHBondContact OD1-N 3.25Å; D562-S564 PolarHBondContact OD1-OG 3.19Å; D562-S564 PolarHBondContact OD2-OG 2.88Å; D562-S564 VanDerWaalsContact OD2-OG 3.09Å
565	S	89.4	Confident	85.4	Confident	7 Å²	7	48.4 Å²	48.4	5%	0.049	30%	0.304	C	S	.	.	S	Bend	trans	-73.9	146	177.5	-81.8	0	0	0	0	113.2	T557 G559 D562 F567	T557-S565 WeakPolarHBondContact OG1-CA 3.34Å; G559-S565 PolarHBondContact N-OG 3.04Å; D562-S565 PolarHBondContact O-N 3.41Å; D562-S565 VanDerWaalsContact O-N 3.17Å; D562-S565 VanDerWaalsContact OD2-CB 3.31Å; D562-S565 WeakPolarHBondContact OD2-CB 3.49Å; D562-S565 PolarHBondContact OD2-N 3.33Å; D562-S565 VanDerWaalsContact OD2-N 3.09Å; D562-S565 PolarHBondContact OD2-OG 3.32Å; S565-F567 VanDerWaalsContact C-N 3.33Å
566	S	91.6	Very high	85.5	Confident	17 Å²	17	49.8 Å²	49.8	12%	0.119	31%	0.313	C	S	.	.	S	Bend	trans	-66.1	-34.8	174.7	-46	0	0	0	0	112.7	A556 T557 K582	A556-S566 WeakPolarHBondContact CA-OG 3.49Å; T557-S566 PolarHBondContact N-OG 3.27Å; T557-S566 VanDerWaalsContact N-OG 3.09Å; T557-S566 CarbonylContact O-C 3.54Å; T557-S566 WeakPolarHBondContact O-CA 3.45Å; T557-S566 WeakPolarHBondContact O-CB 3.3Å; T557-S566 PolarHBondContact O-N 3.29Å; T557-S566 PolarHBondContact OG1-N 3.12Å; T557-S566 VanDerWaalsContact OG1-N 3.11Å; T557-S566 PolarHBondContact OG1-OG 2.74Å; S566-K582 WeakPolarHBondContact O-CB 3.32Å; S566-K582 PolarHBondContact O-N 2.81Å
567	F	94.4	Very high	85.6	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	93.9	174.1	-58.4	-68.6	0	0	0	109	L519 L522 L523 L529 A556 T557 C558 G559 S565 I579 D580 N581 L583	L519-F567 HydrophobicContact CD1-CB 3.55Å; L519-F567 HydrophobicContact CD1-CD2 4.29Å; L519-F567 HydrophobicContact CD1-CG 3.95Å; L522-F567 HydrophobicContact CB-CD1 4.17Å; L522-F567 HydrophobicContact CB-CE1 3.74Å; L522-F567 HydrophobicContact CB-CE2 4.17Å; L522-F567 HydrophobicContact CB-CZ 3.73Å; L522-F567 HydrophobicContact CD1-CD1 3.98Å; L522-F567 HydrophobicContact CD1-CE1 4.07Å; L522-F567 HydrophobicContact CG-CE1 4.41Å; L522-F567 WeakPolarHBondContact O-CE2 3.33Å; L522-F567 VanDerWaalsContact O-CZ 3.25Å; L522-F567 WeakPolarHBondContact O-CZ 3.42Å; L523-F567 HydrophobicContact CD2-CD2 3.71Å; L523-F567 HydrophobicContact CD2-CE2 3.93Å; L523-F567 HydrophobicContact CG-CD2 4.09Å; L523-F567 HydrophobicContact CG-CE2 4.24Å; L529-F567 HydrophobicContact CD1-CZ 4.47Å; A556-F567 HydrophobicContact CB-CE2 4.12Å; T557-F567 PolarHBondContact O-N 3.45Å; C558-F567 VanDerWaalsContact CA-O 3.27Å; C558-F567 WeakPolarHBondContact CA-O 3.14Å; C558-F567 HydrophobicContact CB-CB 4.17Å; G559-F567 PolarHBondContact N-O 3.25Å; S565-F567 VanDerWaalsContact C-N 3.33Å; F567-I579 HydrophobicContact CB-CG2 4.12Å; F567-D580 WeakPolarHBondContact CA-O 2.91Å; F567-N581 HydrophobicContact CD1-CB 4.24Å; F567-N581 HydrophobicContact CE1-CB 4.25Å; F567-N581 WeakPolarHBondContact CE1-OD1 3.36Å; F567-L583 HydrophobicContact CE1-CD1 4.05Å; F567-L583 HydrophobicContact CE1-CG 4.38Å; F567-L583 HydrophobicContact CE2-CD1 4.25Å; F567-L583 HydrophobicContact CZ-CD1 3.5Å; F567-L583 VanDerWaalsContact CZ-CD1 3.5Å; F567-L583 HydrophobicContact CZ-CG 4.16Å
568	N	93.4	Very high	85.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	118.3	-177.1	-177.3	4.7	0	0	0	110.2	G559 N561 D562 N563 K570 I579 D580	G559-N568 PolarHBondContact O-OD1 2.8Å; N561-N568 VanDerWaalsContact C-OD1 3.27Å; N561-N568 WeakPolarHBondContact CA-OD1 3.38Å; N561-N568 PolarHBondContact N-OD1 2.97Å; D562-N568 VanDerWaalsContact C-ND2 3.26Å; D562-N568 PolarHBondContact N-OD1 2.96Å; D562-N568 WeakPolarHBondContact O-CB 3.39Å; D562-N568 PolarHBondContact O-ND2 2.91Å; D562-N568 VanDerWaalsContact O-ND2 3.07Å; N563-N568 PolarHBondContact OD1-ND2 2.89Å; N568-K570 VanDerWaalsContact ND2-CE 3.34Å; N568-K570 WeakPolarHBondContact ND2-CE 3.5Å; N568-K570 PolarHBondContact ND2-NZ 3.04Å; N568-I579 WeakPolarHBondContact O-CA 3.45Å; N568-D580 HydrophobicContact CB-CB 4.2Å; N568-D580 PolarHBondContact N-O 2.94Å; N568-D580 PolarHBondContact O-N 3.25Å
569	I	93.3	Very high	86.2	Confident	14 Å²	14	46.9 Å²	46.9	7%	0.072	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	115.7	177.3	-53.6	162.3	0	0	0	108	L511 L519 G559 C560 N561 T577	L511-I569 HydrophobicContact CD1-CD1 3.58Å; L511-I569 HydrophobicContact CD1-CG1 3.92Å; L511-I569 HydrophobicContact CD1-CG2 4.28Å; L511-I569 HydrophobicContact CD2-CG2 4.06Å; L511-I569 HydrophobicContact CG-CD1 4.12Å; L511-I569 HydrophobicContact CG-CG1 4.44Å; L511-I569 HydrophobicContact CG-CG2 3.89Å; L519-I569 HydrophobicContact CD2-CD1 3.75Å; L519-I569 HydrophobicContact CD2-CG1 4.09Å; G559-I569 PolarHBondContact O-N 2.76Å; C560-I569 CarbonylContact C-O 3.47Å; C560-I569 WeakPolarHBondContact CA-O 3.47Å; N561-I569 PolarHBondContact N-O 2.9Å; N561-I569 PolarHBondContact OD1-O 3.12Å; I569-T577 HydrophobicContact CG2-CG2 4.2Å
570	K	90.6	Very high	86.7	Confident	30 Å²	30	46.8 Å²	46.8	13%	0.13	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	116.9	178.5	-62.6	-69.8	-169.2	171.2	0	109.8	N563 N568 T577 H578 D580	N563-K570 PolarHBondContact OD1-NZ 3.44Å; N568-K570 VanDerWaalsContact ND2-CE 3.34Å; N568-K570 WeakPolarHBondContact ND2-CE 3.5Å; N568-K570 PolarHBondContact ND2-NZ 3.04Å; K570-T577 WeakPolarHBondContact O-CA 3.41Å; K570-H578 VanDerWaalsContact CB-CE1 3.46Å; K570-H578 WeakPolarHBondContact CB-CE1 3.44Å; K570-H578 WeakPolarHBondContact CB-NE2 3.37Å; K570-H578 PolarHBondContact N-O 3.05Å; K570-H578 PolarHBondContact O-N 3.2Å; K570-H578 VanDerWaalsContact O-N 3.16Å; K570-D580 WeakPolarHBondContact CE-OD2 3.02Å; K570-D580 IonicContact NZ-OD2 2.62Å
571	C	84.7	Confident	87.2	Confident	28 Å²	28	44 Å²	44	19%	0.189	27%	0.268	C	S	.	.			trans	-127.8	32.7	179.9	54.6	0	0	0	0	112.9	N561 T577	N561-C571 PolarHBondContact ND2-SG 2.84Å; N561-C571 PolarHBondContact OD1-N 2.84Å; C571-T577 HydrophobicContact CB-CG2 4.48Å
572	H	76.3	Confident	87.6	Confident	103 Å²	103	44.6 Å²	44.6	48%	0.477	27%	0.267	S	S	.	.			trans	-143.7	177.3	-175.4	69.3	-88.6	0	0	0	113	N561 G574	N561-H572 VanDerWaalsContact CG-ND1 3.33Å; N561-H572 PolarHBondContact OD1-CE1 2.81Å; N561-H572 PolarHBondContact OD1-ND1 3.48Å; H572-G574 PolarHBondContact O-N 2.87Å
573	G	67.6	Low	87.8	Confident	74 Å²	74	42.5 Å²	42.5	76%	0.763	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	13	172.7	0	0	0	0	0	115	R575	G573-R575 PolarHBondContact O-N 3.01Å
574	G	69.5	Low	88.1	Confident	82 Å²	82	37.8 Å²	37.8	85%	0.845	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.2	2.2	-177.6	0	0	0	0	0	114.6	H572	H572-G574 PolarHBondContact O-N 2.87Å
575	R	73.2	Confident	88.5	Confident	105 Å²	105	32.9 Å²	32.9	40%	0.396	20%	0.197	S	C	.	.	S	Bend	trans	-86	154.1	167.5	-74.5	-170.2	175	171.9	3.9	111	D429 G573	D429-R575 IonicContact OD1-NH2 2.74Å; D429-R575 PolarHBondContact OD1-NH2 3.41Å; D429-R575 IonicContact OD2-CZ 2.7Å; D429-R575 IonicContact OD2-NH1 2.77Å; D429-R575 IonicContact OD2-NH2 3.07Å; D429-R575 PolarHBondContact OD2-NH2 2.9Å; G573-R575 PolarHBondContact O-N 3.01Å
576	E	86.6	Confident	88.7	Confident	85 Å²	85	32.6 Å²	32.6	40%	0.397	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-66.4	153.1	176.5	-52.7	78.9	-174.8	0	0	110.6	W493 H578	W493-E576 HydrophobicContact CH2-CG 4.07Å; W493-E576 HydrophobicContact CZ2-CB 4.25Å; W493-E576 HydrophobicContact CZ2-CG 3.85Å; E576-H578 PolarHBondContact O-N 2.93Å; E576-H578 VanDerWaalsContact O-N 3.12Å; E576-H578 PolarHBondContact O-ND1 3.41Å
577	T	91.6	Very high	88.7	Confident	9 Å²	9	34.1 Å²	34.1	6%	0.055	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-60.4	118.3	-177.4	-44.7	0	0	0	0	111.5	F502 L511 I569 K570 C571	F502-T577 HydrophobicContact CB-CG2 4.41Å; F502-T577 WeakPolarHBondContact CB-O 3.47Å; L511-T577 HydrophobicContact CD2-CG2 3.82Å; I569-T577 HydrophobicContact CG2-CG2 4.2Å; K570-T577 WeakPolarHBondContact O-CA 3.41Å; C571-T577 HydrophobicContact CB-CG2 4.48Å
578	H	94.4	Very high	88.7	Confident	27 Å²	27	34.2 Å²	34.2	13%	0.125	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	165.1	-178.8	56.2	-81.1	0	0	0	111.8	H490 K570 E576 D580	H490-H578 WeakPolarHBondContact O-CA 3.37Å; H490-H578 WeakPolarHBondContact O-CB 3.43Å; K570-H578 VanDerWaalsContact CB-CE1 3.46Å; K570-H578 WeakPolarHBondContact CB-CE1 3.44Å; K570-H578 WeakPolarHBondContact CB-NE2 3.37Å; K570-H578 PolarHBondContact N-O 3.05Å; K570-H578 PolarHBondContact O-N 3.2Å; K570-H578 VanDerWaalsContact O-N 3.16Å; E576-H578 PolarHBondContact O-N 2.93Å; E576-H578 VanDerWaalsContact O-N 3.12Å; E576-H578 PolarHBondContact O-ND1 3.41Å; H578-D580 IonicContact CD2-OD1 3.15Å
579	I	96.1	Very high	88.8	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	122.5	176.3	-59.2	171.1	0	0	0	108.2	S489 H490 F502 L511 L519 L522 F567 N568	S489-I579 WeakPolarHBondContact CA-O 3.48Å; H490-I579 PolarHBondContact CE1-O 3.43Å; H490-I579 PolarHBondContact N-O 3.17Å; H490-I579 PolarHBondContact ND1-O 2.91Å; H490-I579 WeakPolarHBondContact NE2-CG2 3.45Å; H490-I579 PolarHBondContact NE2-O 3.32Å; H490-I579 PolarHBondContact O-N 2.81Å; F502-I579 HydrophobicContact CD2-CD1 4.29Å; F502-I579 HydrophobicContact CD2-CG1 4.24Å; F502-I579 HydrophobicContact CE2-CB 4.5Å; F502-I579 HydrophobicContact CE2-CD1 3.67Å; F502-I579 HydrophobicContact CE2-CG1 3.88Å; F502-I579 HydrophobicContact CZ-CD1 4.06Å; L511-I579 HydrophobicContact CD1-CD1 4.39Å; L519-I579 HydrophobicContact CB-CD1 4.12Å; L519-I579 HydrophobicContact CD1-CD1 4.4Å; L522-I579 HydrophobicContact CD1-CG2 4.29Å; F567-I579 HydrophobicContact CB-CG2 4.12Å; N568-I579 WeakPolarHBondContact O-CA 3.45Å
580	D	96.8	Very high	89	Confident	17 Å²	17	33.8 Å²	33.8	9%	0.091	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	110.9	166.1	-68.6	-13.6	0	0	0	109	V487 S489 F567 N568 K570 H578 K582	V487-D580 HydrophobicContact CG1-CB 3.77Å; S489-D580 VanDerWaalsContact CB-OD1 3.3Å; S489-D580 WeakPolarHBondContact CB-OD1 3.46Å; S489-D580 PolarHBondContact OG-OD1 3.34Å; F567-D580 WeakPolarHBondContact CA-O 2.91Å; N568-D580 HydrophobicContact CB-CB 4.2Å; N568-D580 PolarHBondContact N-O 2.94Å; N568-D580 PolarHBondContact O-N 3.25Å; K570-D580 WeakPolarHBondContact CE-OD2 3.02Å; K570-D580 IonicContact NZ-OD2 2.62Å; H578-D580 IonicContact CD2-OD1 3.15Å; D580-K582 HydrophobicContact CB-CG 4.18Å; D580-K582 PolarHBondContact O-N 3.03Å
581	N	97.1	Very high	89.4	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	103.8	168.1	179.4	-2.1	0	0	0	109.4	V487 L488 H490 M533 F567 L583 T597	V487-N581 WeakPolarHBondContact CA-O 3.46Å; L488-N581 HydrophobicContact CB-CB 4.4Å; L488-N581 PolarHBondContact N-O 3.09Å; L488-N581 PolarHBondContact O-N 2.82Å; H490-N581 WeakPolarHBondContact NE2-CB 3.07Å; M533-N581 WeakPolarHBondContact CE-ND2 3.33Å; M533-N581 PolarHBondContact SD-ND2 2.96Å; F567-N581 HydrophobicContact CD1-CB 4.24Å; F567-N581 HydrophobicContact CE1-CB 4.25Å; F567-N581 WeakPolarHBondContact CE1-OD1 3.36Å; N581-L583 WeakPolarHBondContact OD1-CB 3.37Å; N581-L583 PolarHBondContact OD1-N 3.28Å; N581-T597 PolarHBondContact ND2-OG1 2.85Å
582	K	94.7	Very high	90	Very high	76 Å²	76	31.1 Å²	31.1	33%	0.33	18%	0.184	S	C	.	.			trans	-96.1	10.1	-176.7	-58.7	-167.6	63	173.5	0	114.2	V487 N563 S566 D580 G584	V487-K582 HydrophobicContact CG1-CG 4.11Å; V487-K582 HydrophobicContact CG2-CG 4.08Å; N563-K582 PolarHBondContact O-NZ 2.81Å; S566-K582 WeakPolarHBondContact O-CB 3.32Å; S566-K582 PolarHBondContact O-N 2.81Å; D580-K582 HydrophobicContact CB-CG 4.18Å; D580-K582 PolarHBondContact O-N 3.03Å; K582-G584 PolarHBondContact O-N 2.63Å
583	L	92.3	Very high	91.1	Very high	15 Å²	15	26.4 Å²	26.4	8%	0.079	16%	0.163	C	C	.	.	S	Bend	trans	-71.5	-8.4	172.9	-62.7	-179.5	0	0	0	113.4	L529 M533 S534 F567 N581 I627	L529-L583 HydrophobicContact CB-CD1 4.13Å; M533-L583 HydrophobicContact SD-CB 4.22Å; S534-L583 PolarHBondContact OG-O 3.18Å; F567-L583 HydrophobicContact CE1-CD1 4.05Å; F567-L583 HydrophobicContact CE1-CG 4.38Å; F567-L583 HydrophobicContact CE2-CD1 4.25Å; F567-L583 HydrophobicContact CZ-CD1 3.5Å; F567-L583 VanDerWaalsContact CZ-CD1 3.5Å; F567-L583 HydrophobicContact CZ-CG 4.16Å; N581-L583 WeakPolarHBondContact OD1-CB 3.37Å; N581-L583 PolarHBondContact OD1-N 3.28Å; L583-I627 HydrophobicContact CD2-CD1 3.58Å; L583-I627 HydrophobicContact CD2-CG1 4.43Å
584	G	91.4	Very high	92.5	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.01	13%	0.126	C	C	.	.			trans	-90.1	144.1	-175.2	0	0	0	0	0	115.6	Y483 G486 M533 K582	Y483-G584 PolarHBondContact OH-O 2.85Å; Y483-G584 VanDerWaalsContact OH-O 3.06Å; G486-G584 PolarHBondContact N-O 3.28Å; G486-G584 CarbonylContact O-C 3.6Å; G486-G584 VanDerWaalsContact O-CA 3.28Å; G486-G584 WeakPolarHBondContact O-CA 3.36Å; M533-G584 VanDerWaalsContact O-CA 3.31Å; M533-G584 WeakPolarHBondContact O-CA 3.39Å; K582-G584 PolarHBondContact O-N 2.63Å
585	S	93.8	Very high	93.9	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.086	C	C	.	.	B	Isolated β-bridge	trans	-104.4	153.1	164.1	173.2	0	0	0	0	110	T478 N484 M533 M587 A588	T478-S585 PolarHBondContact OG1-OG 3.04Å; T478-S585 VanDerWaalsContact OG1-OG 3.12Å; N484-S585 CarbonylContact O-C 3.59Å; N484-S585 WeakPolarHBondContact O-CA 3.49Å; N484-S585 PolarHBondContact O-OG 2.91Å; M533-S585 PolarHBondContact O-N 3.18Å; S585-M587 PolarHBondContact O-N 3.04Å; S585-M587 PolarHBondContact OG-N 3.09Å; S585-A588 WeakPolarHBondContact O-CB 3.44Å; S585-A588 PolarHBondContact O-N 3.2Å
586	A	93.1	Very high	95.1	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-13	176.2	0	0	0	0	0	113.8	Y382 E383 R460 F476 N484 A485 A588	Y382-A586 HydrophobicContact CD1-CB 3.74Å; Y382-A586 HydrophobicContact CE1-CB 4.4Å; E383-A586 VanDerWaalsContact O-CB 3.3Å; E383-A586 WeakPolarHBondContact O-CB 3.49Å; R460-A586 PolarHBondContact NE-O 3Å; R460-A586 PolarHBondContact NH2-O 2.94Å; F476-A586 HydrophobicContact CB-CB 3.82Å; F476-A586 HydrophobicContact CD1-CB 3.75Å; F476-A586 HydrophobicContact CG-CB 4.24Å; N484-A586 HydrophobicContact CB-CB 3.95Å; N484-A586 PolarHBondContact O-N 2.83Å; A485-A586 WeakPolarHBondContact O-CB 3.41Å; A586-A588 VanDerWaalsContact C-N 3.27Å; A586-A588 PolarHBondContact O-N 3.43Å
587	M	91	Very high	95.7	Very high	49 Å²	49	9.9 Å²	9.9	24%	0.241	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-21.9	169.2	-65.8	-171.5	67.9	0	0	113.6	R460 F476 F477 T478 S585	R460-M587 PolarHBondContact NH2-O 2.76Å; F476-M587 WeakPolarHBondContact O-CG 3.39Å; F477-M587 HydrophobicContact CD2-CE 3.72Å; F477-M587 HydrophobicContact CD2-SD 4.05Å; F477-M587 HydrophobicContact CE2-CE 3.9Å; F477-M587 HydrophobicContact CE2-SD 4.44Å; T478-M587 PolarHBondContact N-SD 3.09Å; T478-M587 VanDerWaalsContact N-SD 3.38Å; S585-M587 PolarHBondContact O-N 3.04Å; S585-M587 PolarHBondContact OG-N 3.09Å
588	A	94.4	Very high	96	Very high	2 Å²	2	9.5 Å²	9.5	2%	0.017	5%	0.046	C	C	.	.	S	Bend	trans	-63.5	156.1	-173.5	0	0	0	0	0	114.6	R460 M533 S585 A586 V593	R460-A588 PolarHBondContact NH1-O 2.96Å; R460-A588 PolarHBondContact NH2-O 3.27Å; R460-A588 VanDerWaalsContact NH2-O 3.11Å; M533-A588 WeakPolarHBondContact O-CB 3.47Å; S585-A588 WeakPolarHBondContact O-CB 3.44Å; S585-A588 PolarHBondContact O-N 3.2Å; A586-A588 VanDerWaalsContact C-N 3.27Å; A586-A588 PolarHBondContact O-N 3.43Å; A588-V593 HydrophobicContact CB-CG2 3.54Å
589	N	96.4	Very high	96.2	Very high	6 Å²	6	8.4 Å²	8.4	3%	0.032	4%	0.041	C	C	.	.			trans	-82.5	114.5	172.5	-174.4	-27.3	0	0	0	109.7	D268 L269 G271 P358 Y591 I592 V593	D268-N589 PolarHBondContact O-ND2 2.95Å; L269-N589 PolarHBondContact O-ND2 2.82Å; G271-N589 VanDerWaalsContact CA-CG 3.45Å; G271-N589 WeakPolarHBondContact CA-ND2 3.3Å; G271-N589 PolarHBondContact N-ND2 3.21Å; G271-N589 VanDerWaalsContact N-ND2 3.2Å; P358-N589 VanDerWaalsContact CG-ND2 3.28Å; P358-N589 WeakPolarHBondContact CG-ND2 3.42Å; N589-Y591 VanDerWaalsContact C-N 3.26Å; N589-Y591 PolarHBondContact O-N 3.37Å; N589-Y591 WeakPolarHBondContact OD1-CD2 3.5Å; N589-Y591 PolarHBondContact OD1-N 3.01Å; N589-I592 HydrophobicContact CB-CB 4.13Å; N589-I592 HydrophobicContact CB-CG1 3.92Å; N589-I592 PolarHBondContact O-N 3.39Å; N589-V593 WeakPolarHBondContact O-CG2 3.33Å; N589-V593 PolarHBondContact O-N 3Å
590	P	97.7	Very high	96.3	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-58.5	-36.7	-172.3	21.4	-32.1	0	0	0	113	F380 A453 A456 F457 I592 V593 L594	F380-P590 HydrophobicContact CE1-CB 3.89Å; F380-P590 HydrophobicContact CE2-CB 4.1Å; F380-P590 HydrophobicContact CZ-CB 3.64Å; F380-P590 WeakPolarHBondContact CZ-O 3.49Å; A453-P590 HydrophobicContact CB-CB 4.3Å; A456-P590 HydrophobicContact CB-CB 3.74Å; A456-P590 HydrophobicContact CB-CG 4.2Å; F457-P590 HydrophobicContact CB-CG 4.13Å; P590-I592 VanDerWaalsContact C-N 3.33Å; P590-I592 PolarHBondContact O-N 3.45Å; P590-V593 PolarHBondContact O-N 3.12Å; P590-L594 WeakPolarHBondContact O-CB 3.36Å; P590-L594 PolarHBondContact O-N 3.37Å
591	Y	98.6	Very high	96.3	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-64.8	-37.6	177.3	-54.4	-77.2	0	0	0	112.1	T267 P358 R359 I450 A453 D454 F457 N589 A595	T267-Y591 HydrophobicContact CG2-CD2 3.7Å; T267-Y591 HydrophobicContact CG2-CE2 3.73Å; P358-Y591 HydrophobicContact CB-CD2 4.33Å; P358-Y591 HydrophobicContact CB-CG 4.39Å; P358-Y591 WeakPolarHBondContact O-CB 3.21Å; R359-Y591 HydrophobicContact CB-CD1 3.96Å; R359-Y591 HydrophobicContact CB-CE1 4.02Å; R359-Y591 HydrophobicContact CB-CG 4.23Å; R359-Y591 HydrophobicContact CG-CD1 3.94Å; R359-Y591 HydrophobicContact CG-CE1 3.68Å; I450-Y591 HydrophobicContact CD1-CD1 3.87Å; I450-Y591 HydrophobicContact CD1-CE1 4.2Å; A453-Y591 HydrophobicContact CB-CD1 3.49Å; A453-Y591 VanDerWaalsContact CB-CD1 3.49Å; A453-Y591 HydrophobicContact CB-CE1 3.77Å; A453-Y591 HydrophobicContact CB-CG 4.19Å; D454-Y591 WeakPolarHBondContact OD1-CE1 3.2Å; D454-Y591 PolarHBondContact OD1-OH 3.22Å; F457-Y591 HydrophobicContact CB-CE2 3.79Å; F457-Y591 WeakPolarHBondContact CB-OH 3.15Å; F457-Y591 HydrophobicContact CD1-CE2 4.28Å; F457-Y591 WeakPolarHBondContact CD1-OH 3.34Å; F457-Y591 AromaticContact CD2-CE2 3.98Å; F457-Y591 HydrophobicContact CD2-CE2 3.98Å; F457-Y591 AromaticContact CG-CE2 3.78Å; F457-Y591 HydrophobicContact CG-CE2 3.78Å; F457-Y591 AromaticContact CG-CZ 3.97Å; F457-Y591 WeakPolarHBondContact CG-OH 3.43Å; N589-Y591 VanDerWaalsContact C-N 3.26Å; N589-Y591 PolarHBondContact O-N 3.37Å; N589-Y591 WeakPolarHBondContact OD1-CD2 3.5Å; N589-Y591 PolarHBondContact OD1-N 3.01Å; Y591-A595 WeakPolarHBondContact O-CB 3.42Å; Y591-A595 PolarHBondContact O-N 3.44Å
592	I	98.2	Very high	96.3	Very high	1 Å²	1	7.6 Å²	7.6	1%	0.005	4%	0.037	C	C	.	.	H	α-helix	trans	-72.9	-38.7	176.7	-57.6	-53	0	0	0	111.3	P358 L532 N589 P590 L594 A595 A596 F652	P358-I592 HydrophobicContact CB-CD1 3.58Å; P358-I592 HydrophobicContact CB-CG1 3.93Å; P358-I592 HydrophobicContact CG-CD1 4.07Å; P358-I592 HydrophobicContact CG-CG1 4.31Å; L532-I592 HydrophobicContact CB-CG2 3.96Å; L532-I592 HydrophobicContact CD2-CG2 3.96Å; L532-I592 HydrophobicContact CG-CG2 4.41Å; N589-I592 HydrophobicContact CB-CB 4.13Å; N589-I592 HydrophobicContact CB-CG1 3.92Å; N589-I592 PolarHBondContact O-N 3.39Å; P590-I592 VanDerWaalsContact C-N 3.33Å; P590-I592 PolarHBondContact O-N 3.45Å; I592-L594 VanDerWaalsContact C-N 3.32Å; I592-L594 PolarHBondContact O-N 3.08Å; I592-A595 PolarHBondContact O-N 3Å; I592-A596 WeakPolarHBondContact O-CB 3.35Å; I592-A596 PolarHBondContact O-N 2.94Å; I592-F652 HydrophobicContact CD1-CD2 4.34Å; I592-F652 HydrophobicContact CD1-CE1 4.15Å; I592-F652 HydrophobicContact CD1-CE2 3.49Å; I592-F652 VanDerWaalsContact CD1-CE2 3.49Å; I592-F652 HydrophobicContact CD1-CZ 3.39Å; I592-F652 HydrophobicContact CG1-CE2 4.1Å; I592-F652 HydrophobicContact CG1-CZ 3.81Å; I592-F652 HydrophobicContact CG2-CZ 4.15Å
593	V	98.3	Very high	96.5	Very high	4 Å²	4	4.4 Å²	4.4	2%	0.024	2%	0.024	C	C	.	.	H	α-helix	trans	-60.1	-44.1	174	179.6	0	0	0	0	110.6	F380 L488 M533 A588 N589 P590 T597	F380-V593 HydrophobicContact CE1-CB 4.01Å; F380-V593 HydrophobicContact CE1-CG1 3.97Å; F380-V593 HydrophobicContact CZ-CB 4.41Å; L488-V593 HydrophobicContact CB-CG1 3.9Å; L488-V593 HydrophobicContact CD2-CG1 4.14Å; M533-V593 HydrophobicContact CE-CG1 4.31Å; M533-V593 HydrophobicContact CG-CG1 4.28Å; M533-V593 HydrophobicContact CG-CG2 4.17Å; M533-V593 HydrophobicContact SD-CG1 4.49Å; A588-V593 HydrophobicContact CB-CG2 3.54Å; N589-V593 WeakPolarHBondContact O-CG2 3.33Å; N589-V593 PolarHBondContact O-N 3Å; P590-V593 PolarHBondContact O-N 3.12Å; V593-T597 VanDerWaalsContact O-CB 3.32Å; V593-T597 WeakPolarHBondContact O-CB 3.41Å; V593-T597 PolarHBondContact O-N 2.89Å; V593-T597 VanDerWaalsContact O-N 3.1Å; V593-T597 PolarHBondContact O-OG1 3.04Å
594	L	98.3	Very high	96.7	Very high	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-67	-46.3	177.5	-165.3	69.8	0	0	0	111.9	L366 L376 A453 L488 P590 I592 T598	L366-L594 HydrophobicContact CD1-CD2 3.99Å; L376-L594 HydrophobicContact CD2-CD1 3.61Å; L376-L594 HydrophobicContact CD2-CG 4.28Å; A453-L594 HydrophobicContact CB-CD2 3.88Å; L488-L594 HydrophobicContact CD1-CD1 4.1Å; L488-L594 HydrophobicContact CD2-CD1 4.25Å; P590-L594 WeakPolarHBondContact O-CB 3.36Å; P590-L594 PolarHBondContact O-N 3.37Å; I592-L594 VanDerWaalsContact C-N 3.32Å; I592-L594 PolarHBondContact O-N 3.08Å; L594-T598 WeakPolarHBondContact O-CB 3.41Å; L594-T598 PolarHBondContact O-N 3.33Å; L594-T598 PolarHBondContact O-OG1 3.25Å
595	A	98.4	Very high	96.9	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-59.2	-53.5	177.1	0	0	0	0	0	112.1	I361 A362 L365 Y591 I592 T597 T598 A599 L648	I361-A595 HydrophobicContact CG2-CB 4.1Å; A362-A595 HydrophobicContact CB-CB 4.34Å; L365-A595 HydrophobicContact CD1-CB 3.83Å; Y591-A595 WeakPolarHBondContact O-CB 3.42Å; Y591-A595 PolarHBondContact O-N 3.44Å; I592-A595 PolarHBondContact O-N 3Å; A595-T597 PolarHBondContact O-N 3.16Å; A595-T598 WeakPolarHBondContact O-CB 3.43Å; A595-T598 PolarHBondContact O-N 3.45Å; A595-T598 VanDerWaalsContact O-N 3.16Å; A595-A599 PolarHBondContact O-N 3.04Å; A595-L648 HydrophobicContact CB-CD2 3.79Å
596	A	98.3	Very high	97	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-66.5	-40.3	-176.2	0	0	0	0	0	112.2	L529 L532 M533 I592 T598 A599 A600	L529-A596 HydrophobicContact CD2-CB 3.64Å; L529-A596 WeakPolarHBondContact CD2-O 3.46Å; L532-A596 HydrophobicContact CD1-CB 3.76Å; M533-A596 HydrophobicContact CE-CB 4Å; I592-A596 WeakPolarHBondContact O-CB 3.35Å; I592-A596 PolarHBondContact O-N 2.94Å; A596-T598 VanDerWaalsContact C-N 3.32Å; A596-T598 PolarHBondContact O-N 2.96Å; A596-A599 PolarHBondContact O-N 3.26Å; A596-A600 PolarHBondContact O-N 3.44Å
597	T	98.4	Very high	97.1	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-60.5	-42.8	172.1	-54.2	0	0	0	0	111	L488 W518 L522 M533 N581 V593 A595 G601	L488-T597 HydrophobicContact CD2-CG2 3.88Å; L488-T597 WeakPolarHBondContact CD2-OG1 3.4Å; W518-T597 HydrophobicContact CZ2-CG2 4.44Å; L522-T597 HydrophobicContact CD2-CG2 3.76Å; M533-T597 WeakPolarHBondContact CE-OG1 3.41Å; N581-T597 PolarHBondContact ND2-OG1 2.85Å; V593-T597 VanDerWaalsContact O-CB 3.32Å; V593-T597 WeakPolarHBondContact O-CB 3.41Å; V593-T597 PolarHBondContact O-N 2.89Å; V593-T597 VanDerWaalsContact O-N 3.1Å; V593-T597 PolarHBondContact O-OG1 3.04Å; A595-T597 PolarHBondContact O-N 3.16Å; T597-G601 PolarHBondContact O-N 3.19Å
598	T	98.4	Very high	97.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-63.4	-43.6	177	-57.2	0	0	0	0	111.6	L365 L369 L594 A595 A596 L602	L365-T598 HydrophobicContact CB-CG2 4.08Å; L369-T598 HydrophobicContact CB-CG2 4.24Å; L369-T598 HydrophobicContact CD2-CG2 4.11Å; L594-T598 WeakPolarHBondContact O-CB 3.41Å; L594-T598 PolarHBondContact O-N 3.33Å; L594-T598 PolarHBondContact O-OG1 3.25Å; A595-T598 WeakPolarHBondContact O-CB 3.43Å; A595-T598 PolarHBondContact O-N 3.45Å; A595-T598 VanDerWaalsContact O-N 3.16Å; A596-T598 VanDerWaalsContact C-N 3.32Å; A596-T598 PolarHBondContact O-N 2.96Å; T598-L602 WeakPolarHBondContact O-CB 3.21Å; T598-L602 PolarHBondContact O-N 2.93Å
599	A	98.4	Very high	97.1	Very high	4 Å²	4	20.1 Å²	20.1	3%	0.033	9%	0.09	C	C	.	.	H	α-helix	trans	-61.6	-52	178.9	0	0	0	0	0	112.2	L365 A595 A596 L602 D603 I644 A647	L365-A599 HydrophobicContact CD1-CB 4.31Å; L365-A599 HydrophobicContact CD2-CB 4.43Å; A595-A599 PolarHBondContact O-N 3.04Å; A596-A599 PolarHBondContact O-N 3.26Å; A599-L602 PolarHBondContact O-N 3.44Å; A599-D603 WeakPolarHBondContact O-CB 3.45Å; A599-D603 PolarHBondContact O-N 3.05Å; A599-I644 HydrophobicContact CB-CD1 3.85Å; A599-A647 HydrophobicContact CB-CB 3.55Å
600	A	98.1	Very high	96.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.4	-46	-179.9	0	0	0	0	0	112.7	G521 L522 H525 L529 A596 L602 D603 G604 I644	G521-A600 CarbonylContact C-O 3.55Å; G521-A600 WeakPolarHBondContact CA-O 3.32Å; L522-A600 HydrophobicContact CD2-CB 4Å; H525-A600 HydrophobicContact CB-CB 3.73Å; L529-A600 HydrophobicContact CD1-CB 3.86Å; L529-A600 HydrophobicContact CD2-CB 4.03Å; L529-A600 HydrophobicContact CG-CB 4.29Å; A596-A600 PolarHBondContact O-N 3.44Å; A600-L602 PolarHBondContact O-N 2.58Å; A600-D603 PolarHBondContact O-N 3.18Å; A600-G604 PolarHBondContact O-N 2.91Å; A600-I644 HydrophobicContact CB-CD1 4.01Å
601	G	97.6	Very high	95.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-64.8	-38.4	178.3	0	0	0	0	0	113.1	T597 G604 I605	T597-G601 PolarHBondContact O-N 3.19Å; G601-G604 PolarHBondContact O-N 2.91Å; G601-I605 WeakPolarHBondContact O-CG1 3.25Å; G601-I605 PolarHBondContact O-N 2.91Å
602	L	97.2	Very high	93.9	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-72.7	-34.1	178.4	-171.9	56.6	0	0	0	112.7	Q368 L369 L372 T598 A599 A600 I605 R606	Q368-L602 HydrophobicContact CB-CD2 4.26Å; L369-L602 HydrophobicContact CD1-CD1 3.91Å; L369-L602 HydrophobicContact CD1-CD2 4.45Å; L372-L602 HydrophobicContact CD1-CD1 3.79Å; L372-L602 HydrophobicContact CD1-CD2 4.23Å; L372-L602 HydrophobicContact CD1-CG 4.38Å; T598-L602 WeakPolarHBondContact O-CB 3.21Å; T598-L602 PolarHBondContact O-N 2.93Å; A599-L602 PolarHBondContact O-N 3.44Å; A600-L602 PolarHBondContact O-N 2.58Å; L602-I605 PolarHBondContact O-N 2.17Å; L602-R606 WeakPolarHBondContact O-CB 3.47Å; L602-R606 VanDerWaalsContact O-CG 3.25Å; L602-R606 WeakPolarHBondContact O-CG 3.44Å; L602-R606 PolarHBondContact O-N 3.01Å
603	D	97.6	Very high	92.2	Very high	10 Å²	10	34.1 Å²	34.1	5%	0.053	16%	0.161	C	C	.	.	H	α-helix	trans	-61.8	-47.1	168.5	174.6	81.7	0	0	0	111.7	H525 A599 A600 I605 R606 R607 I643	H525-D603 IonicContact NE2-OD2 3.62Å; H525-D603 PolarHBondContact NE2-OD2 3.04Å; A599-D603 WeakPolarHBondContact O-CB 3.45Å; A599-D603 PolarHBondContact O-N 3.05Å; A600-D603 PolarHBondContact O-N 3.18Å; D603-I605 PolarHBondContact O-N 2.94Å; D603-R606 PolarHBondContact O-N 3.32Å; D603-R607 PolarHBondContact O-N 3.3Å; D603-R607 IonicContact OD1-CZ 3.61Å; D603-R607 IonicContact OD1-NE 2.87Å; D603-R607 PolarHBondContact OD1-NE 2.65Å; D603-R607 IonicContact OD1-NH2 2.72Å; D603-R607 IonicContact OD2-CZ 3.21Å; D603-R607 IonicContact OD2-NE 3.65Å; D603-R607 PolarHBondContact OD2-NE 3.38Å; D603-R607 IonicContact OD2-NH2 2.62Å; D603-R607 PolarHBondContact OD2-NH2 2.93Å; D603-I643 HydrophobicContact CB-CG2 3.86Å
604	G	96.6	Very high	90.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-55.1	-37.1	178.1	0	0	0	0	0	113.3	K517 A600 G601 N608 L609	K517-G604 CarbonylContact O-C 3.52Å; K517-G604 VanDerWaalsContact O-CA 3.3Å; K517-G604 WeakPolarHBondContact O-CA 3.49Å; A600-G604 PolarHBondContact O-N 2.91Å; G601-G604 PolarHBondContact O-N 2.91Å; G604-N608 WeakPolarHBondContact O-CA 3.45Å; G604-N608 PolarHBondContact O-N 2.87Å; G604-L609 PolarHBondContact O-N 2.84Å
605	I	96.1	Very high	88.5	Confident	22 Å²	22	39.3 Å²	39.3	11%	0.113	19%	0.188	C	C	.	.	H	α-helix	trans	-66.2	-54.8	169.5	-65.3	171.9	0	0	0	111.3	F374 L492 I514 K517 W518 G601 L602 D603 R607 N608	F374-I605 HydrophobicContact CE2-CD1 4.2Å; F374-I605 HydrophobicContact CE2-CG2 4.36Å; F374-I605 HydrophobicContact CZ-CD1 4.43Å; L492-I605 HydrophobicContact CD2-CD1 3.91Å; I514-I605 HydrophobicContact CD1-CB 4.29Å; I514-I605 HydrophobicContact CD1-CD1 3.73Å; I514-I605 HydrophobicContact CD1-CG1 3.66Å; I514-I605 HydrophobicContact CD1-CG2 3.71Å; I514-I605 HydrophobicContact CG1-CD1 3.91Å; I514-I605 HydrophobicContact CG1-CG1 4.17Å; K517-I605 HydrophobicContact CB-CG1 4.38Å; W518-I605 HydrophobicContact CE3-CD1 3.75Å; W518-I605 HydrophobicContact CZ3-CD1 4.37Å; G601-I605 WeakPolarHBondContact O-CG1 3.25Å; G601-I605 PolarHBondContact O-N 2.91Å; L602-I605 PolarHBondContact O-N 2.17Å; D603-I605 PolarHBondContact O-N 2.94Å; I605-R607 PolarHBondContact O-N 3.09Å; I605-N608 PolarHBondContact O-N 2.91Å; I605-N608 VanDerWaalsContact O-N 3.09Å
606	R	95.8	Very high	86.3	Confident	128 Å²	128	45.7 Å²	45.7	48%	0.483	22%	0.222	S	C	.	.	H	α-helix	trans	-58.4	-45	-176	-74.9	166.6	173.3	166.6	-2.6	112.7	L602 D603 N608	L602-R606 WeakPolarHBondContact O-CB 3.47Å; L602-R606 VanDerWaalsContact O-CG 3.25Å; L602-R606 WeakPolarHBondContact O-CG 3.44Å; L602-R606 PolarHBondContact O-N 3.01Å; D603-R606 PolarHBondContact O-N 3.32Å; R606-N608 VanDerWaalsContact C-N 3.32Å; R606-N608 PolarHBondContact O-ND2 3.17Å
607	R	95.3	Very high	84.1	Confident	115 Å²	115	48.1 Å²	48.1	43%	0.434	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-1.1	177.8	-67.5	-163.6	-68.9	160.8	-4	113.9	H525 D603 I605 L609	H525-R607 PolarHBondContact NE2-NH2 2.84Å; H525-R607 VanDerWaalsContact NE2-NH2 3.15Å; D603-R607 PolarHBondContact O-N 3.3Å; D603-R607 IonicContact OD1-CZ 3.61Å; D603-R607 IonicContact OD1-NE 2.87Å; D603-R607 PolarHBondContact OD1-NE 2.65Å; D603-R607 IonicContact OD1-NH2 2.72Å; D603-R607 IonicContact OD2-CZ 3.21Å; D603-R607 IonicContact OD2-NE 3.65Å; D603-R607 PolarHBondContact OD2-NE 3.38Å; D603-R607 IonicContact OD2-NH2 2.62Å; D603-R607 PolarHBondContact OD2-NH2 2.93Å; I605-R607 PolarHBondContact O-N 3.09Å; R607-L609 VanDerWaalsContact C-N 3.31Å; R607-L609 HydrophobicContact CB-CD2 3.68Å; R607-L609 HydrophobicContact CB-CG 3.97Å; R607-L609 PolarHBondContact O-N 3.19Å
608	N	93.8	Very high	81.6	Confident	97 Å²	97	51.9 Å²	51.9	52%	0.519	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	44.7	-178.6	-68.5	-90	0	0	0	113.3	K517 G604 I605 R606 N610	K517-N608 WeakPolarHBondContact CE-OD1 3.44Å; K517-N608 PolarHBondContact NZ-OD1 2.94Å; G604-N608 WeakPolarHBondContact O-CA 3.45Å; G604-N608 PolarHBondContact O-N 2.87Å; I605-N608 PolarHBondContact O-N 2.91Å; I605-N608 VanDerWaalsContact O-N 3.09Å; R606-N608 VanDerWaalsContact C-N 3.32Å; R606-N608 PolarHBondContact O-ND2 3.17Å; N608-N610 PolarHBondContact O-N 2.9Å
609	L	91.6	Very high	79.2	Confident	35 Å²	35	56.5 Å²	56.5	18%	0.183	29%	0.286	C	S	.	.			trans	-65.7	133.8	-174.5	-57.5	-177	0	0	0	111.5	A520 T524 G604 R607	A520-L609 HydrophobicContact CB-CB 3.66Å; A520-L609 WeakPolarHBondContact CB-O 3.35Å; T524-L609 HydrophobicContact CG2-CD1 4.31Å; G604-L609 PolarHBondContact O-N 2.84Å; R607-L609 VanDerWaalsContact C-N 3.31Å; R607-L609 HydrophobicContact CB-CD2 3.68Å; R607-L609 HydrophobicContact CB-CG 3.97Å; R607-L609 PolarHBondContact O-N 3.19Å
610	N	82.8	Confident	76.7	Confident	63 Å²	63	58.9 Å²	58.9	34%	0.337	31%	0.311	S	S	.	.			trans	-100.2	124	178.2	-174.4	3.5	0	0	0	111.3	N608 E612 N613	N608-N610 PolarHBondContact O-N 2.9Å; N610-E612 VanDerWaalsContact C-N 3.33Å; N610-E612 PolarHBondContact O-N 3.18Å; N610-E612 PolarHBondContact OD1-N 2.99Å; N610-N613 HydrophobicContact CB-CB 4.45Å; N610-N613 PolarHBondContact O-N 3.15Å
611	I	74.9	Confident	74.3	Confident	15 Å²	15	63.8 Å²	63.8	8%	0.077	33%	0.333	C	S	.	.	S	Bend	trans	-69.4	-24.6	178	-159.5	170	0	0	0	113.7	R516 L519 A520 L523 I614 L615	R516-I611 HydrophobicContact CB-CG2 4.24Å; R516-I611 HydrophobicContact CG-CG2 4.47Å; L519-I611 HydrophobicContact CB-CD1 4.29Å; L519-I611 HydrophobicContact CD2-CD1 3.49Å; L519-I611 VanDerWaalsContact CD2-CD1 3.49Å; L519-I611 HydrophobicContact CG-CD1 3.66Å; A520-I611 HydrophobicContact CB-CB 4.28Å; L523-I611 HydrophobicContact CD1-CD1 3.88Å; L523-I611 HydrophobicContact CD1-CG1 3.95Å; I611-I614 WeakPolarHBondContact O-CA 3.39Å; I611-I614 WeakPolarHBondContact O-CB 3.39Å; I611-I614 PolarHBondContact O-N 3.46Å; I611-I614 VanDerWaalsContact O-N 3.09Å; I611-L615 HydrophobicContact CD1-CD1 4.44Å; I611-L615 HydrophobicContact CG1-CD1 4Å; I611-L615 HydrophobicContact CG1-CG 4.28Å; I611-L615 WeakPolarHBondContact O-CG 3.34Å; I611-L615 PolarHBondContact O-N 3.08Å
612	E	69	Low	72.1	Confident	111 Å²	111	66.6 Å²	66.6	52%	0.519	35%	0.346	S	S	.	.	H	α-helix	trans	-69.8	-36.3	176.1	-64.1	172.8	172.5	0	0	111.2	N610 I614 L615 N616	N610-E612 VanDerWaalsContact C-N 3.33Å; N610-E612 PolarHBondContact O-N 3.18Å; N610-E612 PolarHBondContact OD1-N 2.99Å; E612-I614 PolarHBondContact O-N 3.42Å; E612-L615 PolarHBondContact O-N 3.21Å; E612-N616 VanDerWaalsContact O-CB 3.27Å; E612-N616 WeakPolarHBondContact O-CB 3.33Å; E612-N616 PolarHBondContact O-N 3.06Å; E612-N616 PolarHBondContact O-ND2 2.77Å
613	N	60.4	Low	70.2	Confident	112 Å²	112	75.7 Å²	75.7	60%	0.599	38%	0.381	S	S	*	.	H	α-helix	trans	-68.1	-14.7	171.7	-68.5	-4.4	0	0	0	112.5	N610 K617	N610-N613 HydrophobicContact CB-CB 4.45Å; N610-N613 PolarHBondContact O-N 3.15Å; N613-K617 WeakPolarHBondContact O-CD 3.28Å; N613-K617 WeakPolarHBondContact O-CE 3.41Å; N613-K617 WeakPolarHBondContact O-CG 3.23Å
614	I	59.7	Low	68.5	Low	15 Å²	15	80.3 Å²	80.3	8%	0.077	40%	0.402	C	S	.	.	H	α-helix	trans	-90.1	-50	175.7	-71.7	174	0	0	0	110	A520 L523 I611 E612 K617 F625	A520-I614 HydrophobicContact CB-CD1 3.84Å; L523-I614 HydrophobicContact CB-CD1 4.41Å; L523-I614 HydrophobicContact CD1-CG2 4.12Å; I611-I614 WeakPolarHBondContact O-CA 3.39Å; I611-I614 WeakPolarHBondContact O-CB 3.39Å; I611-I614 PolarHBondContact O-N 3.46Å; I611-I614 VanDerWaalsContact O-N 3.09Å; E612-I614 PolarHBondContact O-N 3.42Å; I614-K617 WeakPolarHBondContact O-CB 3.4Å; I614-K617 PolarHBondContact O-N 3.36Å; I614-F625 HydrophobicContact CB-CE2 4.46Å; I614-F625 HydrophobicContact CB-CZ 4.01Å; I614-F625 HydrophobicContact CD1-CE1 4.25Å; I614-F625 HydrophobicContact CD1-CZ 4.36Å; I614-F625 HydrophobicContact CG1-CE1 4.18Å; I614-F625 HydrophobicContact CG1-CZ 3.79Å; I614-F625 HydrophobicContact CG2-CD1 4.46Å; I614-F625 HydrophobicContact CG2-CD2 4.29Å; I614-F625 HydrophobicContact CG2-CE1 3.88Å; I614-F625 HydrophobicContact CG2-CE2 3.69Å; I614-F625 HydrophobicContact CG2-CZ 3.48Å; I614-F625 VanDerWaalsContact CG2-CZ 3.48Å
615	L	59.8	Low	67.4	Low	97 Å²	97	80.7 Å²	80.7	51%	0.508	40%	0.404	S	S	.	.	H	α-helix	trans	-74.1	-32.3	-175	-69.4	169.2	0	0	0	113.8	I611 E612 K617	I611-L615 HydrophobicContact CD1-CD1 4.44Å; I611-L615 HydrophobicContact CG1-CD1 4Å; I611-L615 HydrophobicContact CG1-CG 4.28Å; I611-L615 WeakPolarHBondContact O-CG 3.34Å; I611-L615 PolarHBondContact O-N 3.08Å; E612-L615 PolarHBondContact O-N 3.21Å; L615-K617 PolarHBondContact O-N 2.92Å
616	N	52.9	Low	66.9	Low	134 Å²	134	81 Å²	81	72%	0.717	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	4.9	179	-65.5	-41.2	0	0	0	113.8	E612	E612-N616 VanDerWaalsContact O-CB 3.27Å; E612-N616 WeakPolarHBondContact O-CB 3.33Å; E612-N616 PolarHBondContact O-N 3.06Å; E612-N616 PolarHBondContact O-ND2 2.77Å
617	K	52.5	Low	66.6	Low	52 Å²	52	75.4 Å²	75.4	23%	0.226	39%	0.389	C	S	.	.	S	Bend	trans	-73.4	137	176.3	-81.7	177.4	179	-173.5	0	111.6	N613 I614 L615 Q621 Q622 E624 F625	N613-K617 WeakPolarHBondContact O-CD 3.28Å; N613-K617 WeakPolarHBondContact O-CE 3.41Å; N613-K617 WeakPolarHBondContact O-CG 3.23Å; I614-K617 WeakPolarHBondContact O-CB 3.4Å; I614-K617 PolarHBondContact O-N 3.36Å; L615-K617 PolarHBondContact O-N 2.92Å; K617-Q621 HydrophobicContact CB-CB 3.81Å; K617-Q621 HydrophobicContact CD-CB 4.21Å; K617-Q621 HydrophobicContact CG-CB 4.04Å; K617-Q622 HydrophobicContact CB-CG 4.39Å; K617-Q622 PolarHBondContact O-NE2 3.4Å; K617-E624 IonicContact NZ-OE1 3.88Å; K617-E624 PolarHBondContact NZ-OE1 3.03Å; K617-E624 IonicContact NZ-OE2 2.67Å; K617-E624 PolarHBondContact NZ-OE2 3.23Å; K617-F625 HydrophobicContact CD-CE2 4.47Å
618	T	45.9	Very low	66.3	Low	79 Å²	79	70.8 Å²	70.8	49%	0.485	37%	0.374	S	S	.	.			trans	-62.2	158.3	176.1	62.5	0	0	0	0	111.5	G620 Q621 Q622	T618-G620 PolarHBondContact O-N 2.87Å; T618-Q621 VanDerWaalsContact N-OE1 3.09Å; T618-Q621 WeakPolarHBondContact O-CA 3.41Å; T618-Q621 WeakPolarHBondContact O-CB 3.4Å; T618-Q621 PolarHBondContact O-N 2.8Å; T618-Q621 PolarHBondContact OG1-OE1 3.14Å; T618-Q622 PolarHBondContact O-N 2.84Å; T618-Q622 VanDerWaalsContact O-N 3.12Å
619	P	47.5	Very low	66.1	Low	97 Å²	97	68.9 Å²	68.9	63%	0.63	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-21.9	-178.3	-28.5	36.6	0	0	0	115.6
620	G	45.8	Very low	66	Low	54 Å²	54	73.3 Å²	73.3	56%	0.557	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-24.8	172.4	0	0	0	0	0	114.2	T618 R623	T618-G620 PolarHBondContact O-N 2.87Å; G620-R623 WeakPolarHBondContact O-CG 3.23Å
621	Q	47.3	Very low	66.3	Low	102 Å²	102	70.6 Å²	70.6	48%	0.477	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-15.6	179	-68.7	165.6	-44.4	0	0	112.8	K617 T618 R623	K617-Q621 HydrophobicContact CB-CB 3.81Å; K617-Q621 HydrophobicContact CD-CB 4.21Å; K617-Q621 HydrophobicContact CG-CB 4.04Å; T618-Q621 VanDerWaalsContact N-OE1 3.09Å; T618-Q621 WeakPolarHBondContact O-CA 3.41Å; T618-Q621 WeakPolarHBondContact O-CB 3.4Å; T618-Q621 PolarHBondContact O-N 2.8Å; T618-Q621 PolarHBondContact OG1-OE1 3.14Å; Q621-R623 PolarHBondContact O-N 2.6Å; Q621-R623 VanDerWaalsContact O-N 3.09Å
622	Q	52.4	Low	67.1	Low	59 Å²	59	72.9 Å²	72.9	28%	0.276	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-67.1	-4	174.6	-70.1	174.5	11.1	0	0	113.8	Y555 K617 T618 E624 F625	Y555-Q622 HydrophobicContact CD1-CB 4.31Å; Y555-Q622 WeakPolarHBondContact CD1-O 3.41Å; Y555-Q622 HydrophobicContact CE1-CB 4.15Å; Y555-Q622 WeakPolarHBondContact CE1-O 3.26Å; Y555-Q622 HydrophobicContact CE2-CB 4.47Å; K617-Q622 HydrophobicContact CB-CG 4.39Å; K617-Q622 PolarHBondContact O-NE2 3.4Å; T618-Q622 PolarHBondContact O-N 2.84Å; T618-Q622 VanDerWaalsContact O-N 3.12Å; Q622-E624 PolarHBondContact O-N 2.8Å; Q622-E624 VanDerWaalsContact O-N 3.08Å; Q622-F625 PolarHBondContact O-N 2.95Å
623	R	56.3	Low	68.2	Low	193 Å²	193	71.1 Å²	71.1	73%	0.728	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-49.9	-29.8	173.4	-75.3	-176.6	174.5	-159	-0.1	114.4	G620 Q621 F625 A626	G620-R623 WeakPolarHBondContact O-CG 3.23Å; Q621-R623 PolarHBondContact O-N 2.6Å; Q621-R623 VanDerWaalsContact O-N 3.09Å; R623-F625 PolarHBondContact O-N 3.31Å; R623-F625 VanDerWaalsContact O-N 3.15Å; R623-A626 WeakPolarHBondContact O-CB 3.22Å; R623-A626 PolarHBondContact O-N 3.13Å
624	E	62.5	Low	69.8	Low	107 Å²	107	65.8 Å²	65.8	50%	0.5	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-58.2	-22.4	175.8	-69.6	168.7	-151.1	0	0	113.8	K617 Q622	K617-E624 IonicContact NZ-OE1 3.88Å; K617-E624 PolarHBondContact NZ-OE1 3.03Å; K617-E624 IonicContact NZ-OE2 2.67Å; K617-E624 PolarHBondContact NZ-OE2 3.23Å; Q622-E624 PolarHBondContact O-N 2.8Å; Q622-E624 VanDerWaalsContact O-N 3.08Å
625	F	73	Confident	71.5	Confident	8 Å²	8	65.2 Å²	65.2	4%	0.035	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-110.5	14.3	-176.4	-42.8	-62.6	0	0	0	112.4	L523 Y555 A556 I614 K617 Q622 R623 I627	L523-F625 HydrophobicContact CB-CD1 4.2Å; L523-F625 HydrophobicContact CB-CE1 4.43Å; L523-F625 WeakPolarHBondContact O-CD1 3.44Å; Y555-F625 CarbonylContact C-O 3.06Å; Y555-F625 WeakPolarHBondContact CA-O 3.16Å; A556-F625 HydrophobicContact CB-CB 4.47Å; A556-F625 PolarHBondContact N-O 3.12Å; I614-F625 HydrophobicContact CB-CE2 4.46Å; I614-F625 HydrophobicContact CB-CZ 4.01Å; I614-F625 HydrophobicContact CD1-CE1 4.25Å; I614-F625 HydrophobicContact CD1-CZ 4.36Å; I614-F625 HydrophobicContact CG1-CE1 4.18Å; I614-F625 HydrophobicContact CG1-CZ 3.79Å; I614-F625 HydrophobicContact CG2-CD1 4.46Å; I614-F625 HydrophobicContact CG2-CD2 4.29Å; I614-F625 HydrophobicContact CG2-CE1 3.88Å; I614-F625 HydrophobicContact CG2-CE2 3.69Å; I614-F625 HydrophobicContact CG2-CZ 3.48Å; I614-F625 VanDerWaalsContact CG2-CZ 3.48Å; K617-F625 HydrophobicContact CD-CE2 4.47Å; Q622-F625 PolarHBondContact O-N 2.95Å; R623-F625 PolarHBondContact O-N 3.31Å; R623-F625 VanDerWaalsContact O-N 3.15Å; F625-I627 PolarHBondContact O-N 3.32Å
626	A	85.2	Confident	73.1	Confident	29 Å²	29	65.7 Å²	65.7	24%	0.24	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-63.7	125.5	-178.2	0	0	0	0	0	111.2	A527 V553 L554 Y555 R623 P628	A527-A626 WeakPolarHBondContact CB-O 3.4Å; V553-A626 HydrophobicContact CG1-CB 3.63Å; L554-A626 CarbonylContact O-C 3.6Å; L554-A626 WeakPolarHBondContact O-CA 3.45Å; Y555-A626 HydrophobicContact CD1-CB 4.3Å; Y555-A626 HydrophobicContact CE1-CB 4.26Å; R623-A626 WeakPolarHBondContact O-CB 3.22Å; R623-A626 PolarHBondContact O-N 3.13Å; A626-P628 WeakPolarHBondContact O-CD 3.35Å
627	I	89.3	Confident	75.1	Confident	10 Å²	10	60.2 Å²	60.2	5%	0.051	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-89	117.6	174.7	-64.5	172.5	0	0	0	108.2	L554 A556 L583 F625 V629	L554-I627 HydrophobicContact CD2-CB 4.14Å; L554-I627 HydrophobicContact CD2-CD1 4.22Å; L554-I627 HydrophobicContact CD2-CG2 4.22Å; L554-I627 HydrophobicContact CG-CB 4.22Å; L554-I627 HydrophobicContact CG-CD1 4.23Å; L554-I627 PolarHBondContact O-N 2.91Å; A556-I627 HydrophobicContact CB-CD1 4.02Å; A556-I627 HydrophobicContact CB-CG1 4.2Å; L583-I627 HydrophobicContact CD2-CD1 3.58Å; L583-I627 HydrophobicContact CD2-CG1 4.43Å; F625-I627 PolarHBondContact O-N 3.32Å; I627-V629 PolarHBondContact O-N 3.45Å
628	P	90.3	Very high	77.2	Confident	18 Å²	18	57.8 Å²	57.8	12%	0.117	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-66.4	130.3	-179	-24.1	36.9	0	0	0	112.7	A527 R540 A626 N633 A634 A637	A527-P628 HydrophobicContact CB-CG 4.33Å; R540-P628 WeakPolarHBondContact CD-O 3.12Å; R540-P628 PolarHBondContact NH1-O 3.29Å; A626-P628 WeakPolarHBondContact O-CD 3.35Å; P628-N633 HydrophobicContact CB-CB 3.86Å; P628-A634 HydrophobicContact CB-CB 4Å; P628-A634 HydrophobicContact CG-CB 4.37Å; P628-A637 HydrophobicContact CG-CB 4.06Å
629	V	88.4	Confident	79.5	Confident	56 Å²	56	56.8 Å²	56.8	34%	0.339	31%	0.306	S	S	.	.	S	Bend	trans	-90.4	-9.8	-175.4	-52.4	0	0	0	0	113.4	I543 I547 I627	I543-V629 HydrophobicContact CG2-CB 4.47Å; I543-V629 HydrophobicContact CG2-CG1 4.16Å; I547-V629 HydrophobicContact CD1-CG1 3.43Å; I547-V629 VanDerWaalsContact CD1-CG1 3.43Å; I627-V629 PolarHBondContact O-N 3.45Å
630	K	89.8	Confident	81.8	Confident	129 Å²	129	59.6 Å²	59.6	56%	0.561	31%	0.311	S	S	*	.	S	Bend	trans	-113	158.6	170.4	-71	-170.4	169.8	-163	0	109.7	N633 A634	K630-N633 HydrophobicContact CB-CB 4.5Å; K630-N633 WeakPolarHBondContact CB-OD1 3.46Å; K630-A634 PolarHBondContact O-N 3.24Å
631	L	90.1	Very high	84.2	Confident	5 Å²	5	58 Å²	58	3%	0.026	29%	0.29	C	S	.	.	H	α-helix	trans	-73.9	-39	178.1	-168.5	56.3	0	0	0	111.7	L537 R540 N633 A634 L635 I664	L537-L631 HydrophobicContact CD2-CB 3.98Å; L537-L631 HydrophobicContact CD2-CD2 3.66Å; L537-L631 HydrophobicContact CD2-CG 4.49Å; L537-L631 HydrophobicContact CG-CD2 4.24Å; R540-L631 HydrophobicContact CG-CB 4.25Å; L631-N633 PolarHBondContact O-N 2.86Å; L631-A634 HydrophobicContact CD1-CB 4.5Å; L631-A634 CarbonylContact O-C 3.58Å; L631-A634 WeakPolarHBondContact O-CA 3.12Å; L631-A634 WeakPolarHBondContact O-CB 3.35Å; L631-A634 PolarHBondContact O-N 2.88Å; L631-L635 HydrophobicContact CG-CD1 4.33Å; L631-L635 HydrophobicContact CG-CG 4.49Å; L631-L635 WeakPolarHBondContact O-CG 3.49Å; L631-L635 PolarHBondContact O-N 2.87Å; L631-I664 HydrophobicContact CB-CD1 3.98Å; L631-I664 HydrophobicContact CB-CG1 4.36Å; L631-I664 HydrophobicContact CD2-CD1 4.03Å; L631-I664 HydrophobicContact CD2-CG1 3.95Å; L631-I664 HydrophobicContact CG-CD1 3.98Å; L631-I664 HydrophobicContact CG-CG1 4.41Å
632	D	91.7	Very high	86.6	Confident	64 Å²	64	59.5 Å²	59.5	34%	0.342	30%	0.297	S	S	.	.	H	α-helix	trans	-55	-53.8	176.7	-50.2	-87.3	0	0	0	112	A634 L635 E636 I664	D632-A634 PolarHBondContact O-N 3.06Å; D632-A634 VanDerWaalsContact O-N 3.16Å; D632-L635 CarbonylContact O-C 3.58Å; D632-L635 WeakPolarHBondContact O-CA 3.41Å; D632-L635 WeakPolarHBondContact O-CB 3.41Å; D632-L635 PolarHBondContact O-N 2.94Å; D632-E636 WeakPolarHBondContact O-CG 3.34Å; D632-E636 PolarHBondContact O-N 2.75Å; D632-I664 WeakPolarHBondContact OD1-CD1 3.27Å
633	N	92.5	Very high	88.7	Confident	73 Å²	73	58.9 Å²	58.9	39%	0.39	29%	0.294	S	S	.	.	H	α-helix	trans	-62.6	-22.9	177.2	-60.7	105.5	0	0	0	113.1	P628 K630 L631 E636 A637	P628-N633 HydrophobicContact CB-CB 3.86Å; K630-N633 HydrophobicContact CB-CB 4.5Å; K630-N633 WeakPolarHBondContact CB-OD1 3.46Å; L631-N633 PolarHBondContact O-N 2.86Å; N633-E636 WeakPolarHBondContact CA-OE2 3.3Å; N633-E636 PolarHBondContact ND2-OE2 2.62Å; N633-A637 VanDerWaalsContact O-CB 3.3Å; N633-A637 WeakPolarHBondContact O-CB 3.39Å; N633-A637 PolarHBondContact O-N 2.98Å; N633-A637 VanDerWaalsContact O-N 3.11Å
634	A	93.6	Very high	90.7	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-79	-32.8	172.1	0	0	0	0	0	112.2	C531 P628 K630 L631 D632 L638	C531-A634 HydrophobicContact CB-CB 3.87Å; C531-A634 VanDerWaalsContact CB-O 3.27Å; C531-A634 WeakPolarHBondContact CB-O 3.42Å; C531-A634 PolarHBondContact SG-O 3.38Å; P628-A634 HydrophobicContact CB-CB 4Å; P628-A634 HydrophobicContact CG-CB 4.37Å; K630-A634 PolarHBondContact O-N 3.24Å; L631-A634 HydrophobicContact CD1-CB 4.5Å; L631-A634 CarbonylContact O-C 3.58Å; L631-A634 WeakPolarHBondContact O-CA 3.12Å; L631-A634 WeakPolarHBondContact O-CB 3.35Å; L631-A634 PolarHBondContact O-N 2.88Å; D632-A634 PolarHBondContact O-N 3.06Å; D632-A634 VanDerWaalsContact O-N 3.16Å; A634-L638 WeakPolarHBondContact O-CB 3.48Å; A634-L638 PolarHBondContact O-N 3.31Å
635	L	94.2	Very high	92.3	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-73.2	-37.1	174.1	-62.8	168.5	0	0	0	111.5	L631 D632 L638 A639 F656 I657 K660 K661 I664	L631-L635 HydrophobicContact CG-CD1 4.33Å; L631-L635 HydrophobicContact CG-CG 4.49Å; L631-L635 WeakPolarHBondContact O-CG 3.49Å; L631-L635 PolarHBondContact O-N 2.87Å; D632-L635 CarbonylContact O-C 3.58Å; D632-L635 WeakPolarHBondContact O-CA 3.41Å; D632-L635 WeakPolarHBondContact O-CB 3.41Å; D632-L635 PolarHBondContact O-N 2.94Å; L635-L638 PolarHBondContact O-N 2.97Å; L635-A639 WeakPolarHBondContact O-CB 3.38Å; L635-A639 PolarHBondContact O-N 3.33Å; L635-F656 HydrophobicContact CD2-CD1 4.47Å; L635-F656 HydrophobicContact CD2-CE1 4.25Å; L635-I657 HydrophobicContact CD2-CG1 4.14Å; L635-K660 HydrophobicContact CD1-CB 3.76Å; L635-K660 HydrophobicContact CD2-CB 3.6Å; L635-K660 HydrophobicContact CD2-CG 4.07Å; L635-K660 HydrophobicContact CG-CB 4.28Å; L635-K661 HydrophobicContact CD1-CG 4.03Å; L635-I664 HydrophobicContact CD1-CD1 3.88Å
636	E	94.8	Very high	93.4	Very high	106 Å²	106	50 Å²	50	50%	0.495	28%	0.275	S	S	.	.	H	α-helix	trans	-60.1	-54.8	169.2	-68.7	171.2	159.3	0	0	110.4	D632 N633 L638 A639 E640	D632-E636 WeakPolarHBondContact O-CG 3.34Å; D632-E636 PolarHBondContact O-N 2.75Å; N633-E636 WeakPolarHBondContact CA-OE2 3.3Å; N633-E636 PolarHBondContact ND2-OE2 2.62Å; E636-L638 PolarHBondContact O-N 2.55Å; E636-A639 PolarHBondContact O-N 2.77Å; E636-E640 PolarHBondContact O-N 3.07Å
637	A	94.6	Very high	94	Very high	20 Å²	20	49.9 Å²	49.9	17%	0.165	27%	0.273	C	S	.	.	H	α-helix	trans	-62.2	-28.8	178.6	0	0	0	0	0	113.8	A527 P628 N633 D641	A527-A637 HydrophobicContact CB-CB 3.82Å; P628-A637 HydrophobicContact CG-CB 4.06Å; N633-A637 VanDerWaalsContact O-CB 3.3Å; N633-A637 WeakPolarHBondContact O-CB 3.39Å; N633-A637 PolarHBondContact O-N 2.98Å; N633-A637 VanDerWaalsContact O-N 3.11Å; A637-D641 PolarHBondContact O-N 3.13Å
638	L	96.3	Very high	94.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-69	-43.7	170.3	176.7	61	0	0	0	111.5	A528 C531 L532 A634 L635 E636 D641 I644 C645 F656 I657	A528-L638 HydrophobicContact CB-CD1 4.02Å; C531-L638 HydrophobicContact CB-CB 4.1Å; C531-L638 HydrophobicContact CB-CD2 4.42Å; L532-L638 HydrophobicContact CD1-CD1 3.9Å; L532-L638 HydrophobicContact CD2-CD1 4.26Å; L532-L638 HydrophobicContact CD2-CD2 3.91Å; L532-L638 HydrophobicContact CG-CD1 4.05Å; L532-L638 HydrophobicContact CG-CD2 4.29Å; A634-L638 WeakPolarHBondContact O-CB 3.48Å; A634-L638 PolarHBondContact O-N 3.31Å; L635-L638 PolarHBondContact O-N 2.97Å; E636-L638 PolarHBondContact O-N 2.55Å; L638-D641 PolarHBondContact O-N 3.5Å; L638-I644 HydrophobicContact CD1-CG2 4.04Å; L638-C645 PolarHBondContact O-SG 3.38Å; L638-F656 HydrophobicContact CD2-CD1 3.75Å; L638-F656 HydrophobicContact CD2-CE1 3.89Å; L638-I657 HydrophobicContact CD2-CD1 4.44Å; L638-I657 HydrophobicContact CD2-CG1 4.19Å
639	A	95.1	Very high	94.5	Very high	58 Å²	58	49.9 Å²	49.9	48%	0.479	28%	0.278	S	S	.	.	H	α-helix	trans	-68.7	-33.2	-179.2	0	0	0	0	0	113.4	L635 E636 D641 I657	L635-A639 WeakPolarHBondContact O-CB 3.38Å; L635-A639 PolarHBondContact O-N 3.33Å; E636-A639 PolarHBondContact O-N 2.77Å; A639-D641 VanDerWaalsContact C-N 3.32Å; A639-I657 HydrophobicContact CB-CD1 4.05Å
640	E	95.5	Very high	94.5	Very high	157 Å²	157	53.3 Å²	53.3	73%	0.734	29%	0.291	S	S	*	.	H	α-helix	trans	-72.3	-25.3	175	-68.3	-177	160.9	0	0	112.7	E636 H642	E636-E640 PolarHBondContact O-N 3.07Å; E640-H642 VanDerWaalsContact C-N 3.28Å; E640-H642 PolarHBondContact O-N 3.41Å
641	D	96.4	Very high	94.4	Very high	20 Å²	20	48.6 Å²	48.6	11%	0.107	27%	0.273	C	S	.	.			trans	-78.5	74.9	177.9	-164.3	-25.6	0	0	0	111.8	H525 A528 A637 L638 A639 I643 I644 C645	H525-D641 IonicContact CE1-OD1 2.72Å; H525-D641 PolarHBondContact CE1-OD1 2.99Å; H525-D641 IonicContact CE1-OD2 3.21Å; H525-D641 IonicContact CG-OD2 3.89Å; H525-D641 VanDerWaalsContact ND1-CG 3.32Å; H525-D641 IonicContact ND1-OD1 3.48Å; H525-D641 PolarHBondContact ND1-OD1 2.9Å; H525-D641 VanDerWaalsContact ND1-OD1 3.16Å; H525-D641 IonicContact ND1-OD2 2.78Å; H525-D641 PolarHBondContact ND1-OD2 2.89Å; A528-D641 HydrophobicContact CB-CB 3.68Å; A528-D641 WeakPolarHBondContact CB-OD2 3.36Å; A637-D641 PolarHBondContact O-N 3.13Å; L638-D641 PolarHBondContact O-N 3.5Å; A639-D641 VanDerWaalsContact C-N 3.32Å; D641-I643 PolarHBondContact O-N 2.87Å; D641-I643 VanDerWaalsContact O-N 3.1Å; D641-I643 PolarHBondContact OD1-N 2.83Å; D641-I644 HydrophobicContact CB-CB 4.26Å; D641-I644 VanDerWaalsContact CG-CG1 3.46Å; D641-I644 PolarHBondContact O-N 2.72Å; D641-I644 WeakPolarHBondContact OD1-CG1 3.36Å; D641-I644 PolarHBondContact OD1-N 2.87Å; D641-I644 WeakPolarHBondContact OD2-CG1 3.34Å; D641-C645 WeakPolarHBondContact O-CB 3.42Å; D641-C645 PolarHBondContact O-N 2.95Å; D641-C645 PolarHBondContact O-SG 3.46Å
642	H	96.3	Very high	94.4	Very high	134 Å²	134	48.4 Å²	48.4	62%	0.62	27%	0.272	S	S	*	.	H	α-helix	trans	-54.7	-25.8	177.5	65.3	-80	0	0	0	114.2	E640 S646	E640-H642 VanDerWaalsContact C-N 3.28Å; E640-H642 PolarHBondContact O-N 3.41Å; H642-S646 WeakPolarHBondContact O-CB 3.38Å; H642-S646 PolarHBondContact O-N 2.9Å
643	I	96.9	Very high	94.5	Very high	45 Å²	45	45.9 Å²	45.9	23%	0.231	26%	0.259	C	S	.	.	H	α-helix	trans	-72.4	-52.6	177.3	-60.4	-61.9	0	0	0	109.9	D603 D641 C645 S646 A647	D603-I643 HydrophobicContact CB-CG2 3.86Å; D641-I643 PolarHBondContact O-N 2.87Å; D641-I643 VanDerWaalsContact O-N 3.1Å; D641-I643 PolarHBondContact OD1-N 2.83Å; I643-C645 VanDerWaalsContact C-N 3.32Å; I643-C645 PolarHBondContact O-N 3.16Å; I643-S646 PolarHBondContact O-N 3.06Å; I643-A647 VanDerWaalsContact O-CB 3.26Å; I643-A647 WeakPolarHBondContact O-CB 2.76Å; I643-A647 PolarHBondContact O-N 3.38Å
644	I	97.8	Very high	94.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.9	-38.8	176.7	-63.3	-62.1	0	0	0	110.6	H525 A528 L529 L532 A599 A600 L638 D641 A647 L648	H525-I644 HydrophobicContact CB-CD1 4.09Å; H525-I644 HydrophobicContact CB-CG1 4Å; A528-I644 HydrophobicContact CB-CB 4.47Å; A528-I644 HydrophobicContact CB-CG1 4.39Å; A528-I644 HydrophobicContact CB-CG2 4.47Å; L529-I644 HydrophobicContact CD2-CD1 4.28Å; L532-I644 HydrophobicContact CD1-CG2 3.87Å; A599-I644 HydrophobicContact CB-CD1 3.85Å; A600-I644 HydrophobicContact CB-CD1 4.01Å; L638-I644 HydrophobicContact CD1-CG2 4.04Å; D641-I644 HydrophobicContact CB-CB 4.26Å; D641-I644 VanDerWaalsContact CG-CG1 3.46Å; D641-I644 PolarHBondContact O-N 2.72Å; D641-I644 WeakPolarHBondContact OD1-CG1 3.36Å; D641-I644 PolarHBondContact OD1-N 2.87Å; D641-I644 WeakPolarHBondContact OD2-CG1 3.34Å; I644-A647 PolarHBondContact O-N 2.86Å; I644-L648 HydrophobicContact CG2-CD1 3.64Å; I644-L648 HydrophobicContact CG2-CG 4.26Å; I644-L648 WeakPolarHBondContact O-CB 3.3Å; I644-L648 WeakPolarHBondContact O-CG 3.05Å; I644-L648 PolarHBondContact O-N 3.01Å
645	C	96.8	Very high	93.9	Very high	22 Å²	22	46.3 Å²	46.3	15%	0.149	26%	0.258	C	S	.	.	H	α-helix	trans	-58.5	-50.1	174.3	-73.1	0	0	0	0	112.6	L638 D641 I643 A647 G649 V653	L638-C645 PolarHBondContact O-SG 3.38Å; D641-C645 WeakPolarHBondContact O-CB 3.42Å; D641-C645 PolarHBondContact O-N 2.95Å; D641-C645 PolarHBondContact O-SG 3.46Å; I643-C645 VanDerWaalsContact C-N 3.32Å; I643-C645 PolarHBondContact O-N 3.16Å; C645-A647 VanDerWaalsContact C-N 3.33Å; C645-A647 PolarHBondContact O-N 2.59Å; C645-G649 PolarHBondContact O-N 2.81Å; C645-V653 HydrophobicContact CB-CG2 4.42Å
646	S	96.8	Very high	93.7	Very high	100 Å²	100	46.4 Å²	46.4	70%	0.699	26%	0.259	S	S	*	.	H	α-helix	trans	-67.4	-33.2	179.3	-173.6	0	0	0	0	112.5	H642 I643	H642-S646 WeakPolarHBondContact O-CB 3.38Å; H642-S646 PolarHBondContact O-N 2.9Å; I643-S646 PolarHBondContact O-N 3.06Å
647	A	97.2	Very high	93.5	Very high	26 Å²	26	42.7 Å²	42.7	22%	0.215	24%	0.242	C	C	.	.	H	α-helix	trans	-73.1	-37.4	178.8	0	0	0	0	0	113.5	L365 A599 I643 I644 C645	L365-A647 HydrophobicContact CD2-CB 4.08Å; A599-A647 HydrophobicContact CB-CB 3.55Å; I643-A647 VanDerWaalsContact O-CB 3.26Å; I643-A647 WeakPolarHBondContact O-CB 2.76Å; I643-A647 PolarHBondContact O-N 3.38Å; I644-A647 PolarHBondContact O-N 2.86Å; C645-A647 VanDerWaalsContact C-N 3.33Å; C645-A647 PolarHBondContact O-N 2.59Å
648	L	96.4	Very high	93.1	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-85.1	-21.6	177.5	-62.3	174	0	0	0	113	I361 L365 L532 A595 I644 F652 V653	I361-L648 HydrophobicContact CG2-CB 4.36Å; I361-L648 HydrophobicContact CG2-CD2 3.72Å; L365-L648 HydrophobicContact CD1-CD2 4.08Å; L532-L648 HydrophobicContact CD1-CD1 3.47Å; L532-L648 VanDerWaalsContact CD1-CD1 3.47Å; L532-L648 HydrophobicContact CD2-CD1 4.18Å; L532-L648 HydrophobicContact CG-CD1 4.5Å; A595-L648 HydrophobicContact CB-CD2 3.79Å; I644-L648 HydrophobicContact CG2-CD1 3.64Å; I644-L648 HydrophobicContact CG2-CG 4.26Å; I644-L648 WeakPolarHBondContact O-CB 3.3Å; I644-L648 WeakPolarHBondContact O-CG 3.05Å; I644-L648 PolarHBondContact O-N 3.01Å; L648-F652 HydrophobicContact CB-CD1 3.94Å; L648-F652 HydrophobicContact CB-CE1 4.43Å; L648-F652 HydrophobicContact CD1-CD1 4.45Å; L648-F652 HydrophobicContact CD1-CE1 4.15Å; L648-V653 HydrophobicContact CB-CG2 4.12Å
649	G	93.1	Very high	92.6	Very high	24 Å²	24	43.4 Å²	43.4	25%	0.247	25%	0.247	C	C	.	.			trans	92.9	127.4	178.6	0	0	0	0	0	112.7	C645 F652 V653	C645-G649 PolarHBondContact O-N 2.81Å; G649-F652 WeakPolarHBondContact O-CB 3.45Å; G649-F652 PolarHBondContact O-N 2.62Å; G649-V653 WeakPolarHBondContact O-CG2 3.13Å; G649-V653 PolarHBondContact O-N 2.67Å
650	E	88.6	Confident	92.3	Very high	129 Å²	129	41 Å²	41	60%	0.603	23%	0.226	S	C	*	.	H	α-helix	trans	-46.2	-47.4	-177.1	169.2	176.8	-136.9	0	0	114.9	F652 V653 Q654	E650-F652 VanDerWaalsContact C-N 3.3Å; E650-F652 PolarHBondContact O-N 2.85Å; E650-V653 PolarHBondContact O-N 3.02Å; E650-V653 VanDerWaalsContact O-N 3.12Å; E650-Q654 HydrophobicContact CG-CG 4.05Å; E650-Q654 WeakPolarHBondContact O-CG 3.29Å; E650-Q654 PolarHBondContact O-N 3.12Å; E650-Q654 PolarHBondContact OE1-NE2 3.09Å
651	P	87.2	Confident	91.9	Very high	30 Å²	30	38.7 Å²	38.7	20%	0.195	21%	0.213	C	C	.	.	H	α-helix	trans	-62.8	-32.1	-179.7	-24.5	35.5	0	0	0	114	R355 T356 Y655	R355-P651 HydrophobicContact CB-CB 4.38Å; R355-P651 HydrophobicContact CB-CG 4.42Å; T356-P651 HydrophobicContact CG2-CB 4.5Å; P651-Y655 VanDerWaalsContact O-CB 3.28Å; P651-Y655 WeakPolarHBondContact O-CB 3.46Å; P651-Y655 PolarHBondContact O-N 3.11Å
652	F	91.3	Very high	91.3	Very high	1 Å²	1	40.1 Å²	40.1	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-69.9	-45.8	173.4	168.4	-94.5	0	0	0	110.8	L269 I361 L532 I592 L648 G649 E650 Y655 F656	L269-F652 HydrophobicContact CD2-CD2 3.85Å; L269-F652 HydrophobicContact CD2-CE2 3.69Å; I361-F652 HydrophobicContact CD1-CB 3.62Å; I361-F652 HydrophobicContact CD1-CD1 4.22Å; I361-F652 HydrophobicContact CD1-CD2 3.61Å; I361-F652 HydrophobicContact CD1-CE2 4.39Å; I361-F652 HydrophobicContact CD1-CG 3.52Å; L532-F652 HydrophobicContact CD2-CE1 4.14Å; I592-F652 HydrophobicContact CD1-CD2 4.34Å; I592-F652 HydrophobicContact CD1-CE1 4.15Å; I592-F652 HydrophobicContact CD1-CE2 3.49Å; I592-F652 VanDerWaalsContact CD1-CE2 3.49Å; I592-F652 HydrophobicContact CD1-CZ 3.39Å; I592-F652 HydrophobicContact CG1-CE2 4.1Å; I592-F652 HydrophobicContact CG1-CZ 3.81Å; I592-F652 HydrophobicContact CG2-CZ 4.15Å; L648-F652 HydrophobicContact CB-CD1 3.94Å; L648-F652 HydrophobicContact CB-CE1 4.43Å; L648-F652 HydrophobicContact CD1-CD1 4.45Å; L648-F652 HydrophobicContact CD1-CE1 4.15Å; G649-F652 WeakPolarHBondContact O-CB 3.45Å; G649-F652 PolarHBondContact O-N 2.62Å; E650-F652 VanDerWaalsContact C-N 3.3Å; E650-F652 PolarHBondContact O-N 2.85Å; F652-Y655 PolarHBondContact O-N 2.8Å; F652-F656 HydrophobicContact CE1-CB 4.29Å; F652-F656 HydrophobicContact CZ-CB 4.21Å; F652-F656 AromaticContact CZ-CD2 3.99Å; F652-F656 HydrophobicContact CZ-CD2 3.99Å; F652-F656 HydrophobicContact CZ-CG 4.31Å; F652-F656 VanDerWaalsContact O-CB 3.3Å; F652-F656 WeakPolarHBondContact O-CB 3.37Å; F652-F656 PolarHBondContact O-N 2.84Å
653	V	92.3	Very high	90.7	Very high	10 Å²	10	36.2 Å²	36.2	6%	0.061	20%	0.2	C	C	.	.	H	α-helix	trans	-66.7	-48.9	-174.3	177.9	0	0	0	0	111.2	C645 L648 G649 E650 Y655 F656 I657	C645-V653 HydrophobicContact CB-CG2 4.42Å; L648-V653 HydrophobicContact CB-CG2 4.12Å; G649-V653 WeakPolarHBondContact O-CG2 3.13Å; G649-V653 PolarHBondContact O-N 2.67Å; E650-V653 PolarHBondContact O-N 3.02Å; E650-V653 VanDerWaalsContact O-N 3.12Å; V653-Y655 VanDerWaalsContact C-N 3.28Å; V653-Y655 PolarHBondContact O-N 3.42Å; V653-F656 PolarHBondContact O-N 3.49Å; V653-I657 HydrophobicContact CG1-CD1 3.82Å; V653-I657 WeakPolarHBondContact O-CG1 3.47Å; V653-I657 PolarHBondContact O-N 3.09Å
654	Q	88.4	Confident	90.1	Very high	69 Å²	69	34.6 Å²	34.6	32%	0.322	19%	0.192	S	C	.	.	H	α-helix	trans	-57.5	-44.3	177.1	-67.9	-175.2	7.1	0	0	110.8	V309 E650 I657 A658	V309-Q654 HydrophobicContact CG1-CB 3.76Å; E650-Q654 HydrophobicContact CG-CG 4.05Å; E650-Q654 WeakPolarHBondContact O-CG 3.29Å; E650-Q654 PolarHBondContact O-N 3.12Å; E650-Q654 PolarHBondContact OE1-NE2 3.09Å; Q654-I657 PolarHBondContact O-N 2.86Å; Q654-A658 WeakPolarHBondContact O-CB 3.47Å; Q654-A658 PolarHBondContact O-N 3.36Å
655	Y	85.4	Confident	89.5	Confident	13 Å²	13	39.7 Å²	39.7	5%	0.051	22%	0.216	C	C	.	.	H	α-helix	trans	-69.3	-41.8	-180	-156.5	-77	0	0	0	112.8	L269 E299 T301 F317 P651 F652 V653 I657 A658 M659	L269-Y655 HydrophobicContact CD1-CD1 3.3Å; L269-Y655 HydrophobicContact CD1-CE1 3.57Å; L269-Y655 HydrophobicContact CD1-CG 4.39Å; E299-Y655 HydrophobicContact CB-CE1 3.9Å; E299-Y655 HydrophobicContact CB-CE2 4.32Å; E299-Y655 WeakPolarHBondContact CB-OH 3.39Å; E299-Y655 HydrophobicContact CG-CE1 4.45Å; E299-Y655 PolarHBondContact O-OH 3.42Å; T301-Y655 WeakPolarHBondContact CB-OH 3.17Å; T301-Y655 PolarHBondContact N-OH 3.31Å; T301-Y655 VanDerWaalsContact N-OH 3.14Å; T301-Y655 WeakPolarHBondContact OG1-CE1 3.22Å; T301-Y655 PolarHBondContact OG1-OH 3.02Å; F317-Y655 HydrophobicContact CD1-CE2 4.35Å; F317-Y655 HydrophobicContact CE1-CD2 4.28Å; F317-Y655 AromaticContact CE1-CE2 3.52Å; F317-Y655 HydrophobicContact CE1-CE2 3.52Å; F317-Y655 HydrophobicContact CZ-CD2 4.42Å; F317-Y655 AromaticContact CZ-CE2 3.84Å; F317-Y655 HydrophobicContact CZ-CE2 3.84Å; P651-Y655 VanDerWaalsContact O-CB 3.28Å; P651-Y655 WeakPolarHBondContact O-CB 3.46Å; P651-Y655 PolarHBondContact O-N 3.11Å; F652-Y655 PolarHBondContact O-N 2.8Å; V653-Y655 VanDerWaalsContact C-N 3.28Å; V653-Y655 PolarHBondContact O-N 3.42Å; Y655-I657 VanDerWaalsContact C-N 3.33Å; Y655-I657 PolarHBondContact O-N 3.49Å; Y655-A658 PolarHBondContact O-N 2.86Å; Y655-M659 WeakPolarHBondContact O-CB 3.45Å; Y655-M659 PolarHBondContact O-N 2.92Å
656	F	90.1	Very high	88.7	Confident	7 Å²	7	41.3 Å²	41.3	3%	0.031	23%	0.225	C	C	.	.	H	α-helix	trans	-59.8	-44	174.6	-179.5	-89.1	0	0	0	111	L532 P535 L635 L638 F652 V653 M659 K660	L532-F656 HydrophobicContact CD2-CD1 4.21Å; L532-F656 HydrophobicContact CD2-CE1 3.97Å; L532-F656 HydrophobicContact CD2-CE2 4.36Å; L532-F656 HydrophobicContact CD2-CZ 4.04Å; P535-F656 HydrophobicContact CB-CE2 4.48Å; P535-F656 HydrophobicContact CB-CZ 4.12Å; L635-F656 HydrophobicContact CD2-CD1 4.47Å; L635-F656 HydrophobicContact CD2-CE1 4.25Å; L638-F656 HydrophobicContact CD2-CD1 3.75Å; L638-F656 HydrophobicContact CD2-CE1 3.89Å; F652-F656 HydrophobicContact CE1-CB 4.29Å; F652-F656 HydrophobicContact CZ-CB 4.21Å; F652-F656 AromaticContact CZ-CD2 3.99Å; F652-F656 HydrophobicContact CZ-CD2 3.99Å; F652-F656 HydrophobicContact CZ-CG 4.31Å; F652-F656 VanDerWaalsContact O-CB 3.3Å; F652-F656 WeakPolarHBondContact O-CB 3.37Å; F652-F656 PolarHBondContact O-N 2.84Å; V653-F656 PolarHBondContact O-N 3.49Å; F656-M659 HydrophobicContact CD2-CE 4.11Å; F656-M659 HydrophobicContact CE2-CE 4.37Å; F656-K660 HydrophobicContact CD1-CG 4.31Å; F656-K660 HydrophobicContact CE1-CG 3.98Å; F656-K660 HydrophobicContact CZ-CG 4.12Å; F656-K660 WeakPolarHBondContact O-CB 3.32Å; F656-K660 WeakPolarHBondContact O-CG 3.49Å; F656-K660 PolarHBondContact O-N 3.46Å
657	I	90.3	Very high	87.7	Confident	27 Å²	27	40.6 Å²	40.6	14%	0.138	21%	0.211	C	C	.	.	H	α-helix	trans	-66.1	-44.7	177.8	-67.4	170	0	0	0	111.3	L635 L638 A639 V653 Q654 Y655 K660 K661	L635-I657 HydrophobicContact CD2-CG1 4.14Å; L638-I657 HydrophobicContact CD2-CD1 4.44Å; L638-I657 HydrophobicContact CD2-CG1 4.19Å; A639-I657 HydrophobicContact CB-CD1 4.05Å; V653-I657 HydrophobicContact CG1-CD1 3.82Å; V653-I657 WeakPolarHBondContact O-CG1 3.47Å; V653-I657 PolarHBondContact O-N 3.09Å; Q654-I657 PolarHBondContact O-N 2.86Å; Y655-I657 VanDerWaalsContact C-N 3.33Å; Y655-I657 PolarHBondContact O-N 3.49Å; I657-K660 PolarHBondContact O-N 2.88Å; I657-K661 HydrophobicContact CG2-CD 4.33Å; I657-K661 WeakPolarHBondContact O-CG 3.5Å; I657-K661 PolarHBondContact O-N 3.36Å
658	A	86.8	Confident	86.6	Confident	30 Å²	30	44.9 Å²	44.9	25%	0.248	23%	0.227	C	C	.	.	H	α-helix	trans	-61	-46.1	177.1	0	0	0	0	0	112.1	Q654 Y655 K660 K661 F662	Q654-A658 WeakPolarHBondContact O-CB 3.47Å; Q654-A658 PolarHBondContact O-N 3.36Å; Y655-A658 PolarHBondContact O-N 2.86Å; A658-K660 VanDerWaalsContact C-N 3.32Å; A658-K660 PolarHBondContact O-N 3.05Å; A658-K661 PolarHBondContact O-N 3.32Å; A658-F662 PolarHBondContact O-N 3.31Å
659	M	85.8	Confident	85.4	Confident	6 Å²	6	50 Å²	50	3%	0.03	25%	0.253	C	S	.	.	H	α-helix	trans	-57.8	-42.4	175	-177.1	-167.7	78.5	0	0	111.7	L269 H270 Y655 F656 F662 E663	L269-M659 HydrophobicContact CB-CE 4.38Å; L269-M659 HydrophobicContact CB-SD 3.87Å; L269-M659 HydrophobicContact CD1-SD 3.92Å; H270-M659 PolarHBondContact CE1-SD 3.26Å; Y655-M659 WeakPolarHBondContact O-CB 3.45Å; Y655-M659 PolarHBondContact O-N 2.92Å; F656-M659 HydrophobicContact CD2-CE 4.11Å; F656-M659 HydrophobicContact CE2-CE 4.37Å; M659-F662 PolarHBondContact O-N 2.93Å; M659-E663 PolarHBondContact O-N 2.97Å; M659-E663 VanDerWaalsContact O-N 3.07Å
660	K	88.4	Confident	84.3	Confident	8 Å²	8	51.7 Å²	51.7	4%	0.035	26%	0.257	C	S	.	.	H	α-helix	trans	-75.2	-32.8	179.5	-69.9	-46.7	-167.7	-179.7	0	114.7	P535 L635 F656 I657 A658 F662 E663 I664	P535-K660 WeakPolarHBondContact O-CE 3.42Å; P535-K660 PolarHBondContact O-NZ 3.45Å; L635-K660 HydrophobicContact CD1-CB 3.76Å; L635-K660 HydrophobicContact CD2-CB 3.6Å; L635-K660 HydrophobicContact CD2-CG 4.07Å; L635-K660 HydrophobicContact CG-CB 4.28Å; F656-K660 HydrophobicContact CD1-CG 4.31Å; F656-K660 HydrophobicContact CE1-CG 3.98Å; F656-K660 HydrophobicContact CZ-CG 4.12Å; F656-K660 WeakPolarHBondContact O-CB 3.32Å; F656-K660 WeakPolarHBondContact O-CG 3.49Å; F656-K660 PolarHBondContact O-N 3.46Å; I657-K660 PolarHBondContact O-N 2.88Å; A658-K660 VanDerWaalsContact C-N 3.32Å; A658-K660 PolarHBondContact O-N 3.05Å; K660-F662 VanDerWaalsContact C-N 3.33Å; K660-E663 HydrophobicContact CD-CG 4.45Å; K660-E663 WeakPolarHBondContact CD-OE1 3.18Å; K660-E663 WeakPolarHBondContact CD-OE2 3.46Å; K660-E663 IonicContact NZ-OE1 3.45Å; K660-E663 PolarHBondContact NZ-OE1 2.91Å; K660-E663 IonicContact NZ-OE2 2.63Å; K660-E663 PolarHBondContact NZ-OE2 3.09Å; K660-E663 PolarHBondContact O-N 2.74Å; K660-I664 WeakPolarHBondContact O-CG1 3.22Å; K660-I664 PolarHBondContact O-N 2.85Å; K660-I664 VanDerWaalsContact O-N 3.16Å
661	K	87.6	Confident	83.3	Confident	107 Å²	107	48.4 Å²	48.4	47%	0.465	24%	0.243	S	C	.	.	H	α-helix	trans	-63.7	-41.1	169.7	-71.2	-172.7	175.8	-168.5	0	111.3	L635 I657 A658 E663 I664 E665	L635-K661 HydrophobicContact CD1-CG 4.03Å; I657-K661 HydrophobicContact CG2-CD 4.33Å; I657-K661 WeakPolarHBondContact O-CG 3.5Å; I657-K661 PolarHBondContact O-N 3.36Å; A658-K661 PolarHBondContact O-N 3.32Å; K661-E663 PolarHBondContact O-N 2.77Å; K661-I664 WeakPolarHBondContact O-CB 3.41Å; K661-I664 PolarHBondContact O-N 3.12Å; K661-I664 VanDerWaalsContact O-N 3.15Å; K661-E665 WeakPolarHBondContact O-CG 3.39Å; K661-E665 PolarHBondContact O-N 3.31Å
662	F	83.8	Confident	82.1	Confident	51 Å²	51	52.7 Å²	52.7	22%	0.224	26%	0.26	C	S	.	.	H	α-helix	trans	-63	-37.7	174	-172.8	-85.3	0	0	0	113.3	L302 A658 M659 K660 I664 T666	L302-F662 HydrophobicContact CB-CD1 4.07Å; L302-F662 HydrophobicContact CB-CE1 3.43Å; L302-F662 VanDerWaalsContact CB-CE1 3.43Å; L302-F662 HydrophobicContact CB-CE2 4.45Å; L302-F662 HydrophobicContact CB-CZ 3.64Å; L302-F662 HydrophobicContact CD1-CE1 3.98Å; L302-F662 HydrophobicContact CG-CE1 4.31Å; A658-F662 PolarHBondContact O-N 3.31Å; M659-F662 PolarHBondContact O-N 2.93Å; K660-F662 VanDerWaalsContact C-N 3.33Å; F662-I664 VanDerWaalsContact C-N 3.32Å; F662-I664 PolarHBondContact O-N 2.98Å; F662-T666 WeakPolarHBondContact CD1-OG1 3.48Å; F662-T666 WeakPolarHBondContact CE1-OG1 3.44Å; F662-T666 WeakPolarHBondContact O-CB 3.38Å; F662-T666 PolarHBondContact O-N 3.26Å; F662-T666 PolarHBondContact O-OG1 2.82Å
663	E	83.4	Confident	80.4	Confident	51 Å²	51	58.6 Å²	58.6	24%	0.238	28%	0.283	C	S	.	.	H	α-helix	trans	-60.7	-39.5	172.6	-76.7	179.1	-150.5	0	0	112.3	H270 M659 K660 K661 Q667	H270-E663 IonicContact CE1-OE1 3.68Å; H270-E663 PolarHBondContact CE1-OE1 2.98Å; H270-E663 VanDerWaalsContact CE1-OE1 3.31Å; H270-E663 IonicContact ND1-OE1 3.54Å; M659-E663 PolarHBondContact O-N 2.97Å; M659-E663 VanDerWaalsContact O-N 3.07Å; K660-E663 HydrophobicContact CD-CG 4.45Å; K660-E663 WeakPolarHBondContact CD-OE1 3.18Å; K660-E663 WeakPolarHBondContact CD-OE2 3.46Å; K660-E663 IonicContact NZ-OE1 3.45Å; K660-E663 PolarHBondContact NZ-OE1 2.91Å; K660-E663 IonicContact NZ-OE2 2.63Å; K660-E663 PolarHBondContact NZ-OE2 3.09Å; K660-E663 PolarHBondContact O-N 2.74Å; K661-E663 PolarHBondContact O-N 2.77Å; E663-Q667 PolarHBondContact O-N 3.26Å
664	I	85.6	Confident	78.7	Confident	11 Å²	11	61.5 Å²	61.5	6%	0.056	30%	0.298	C	S	.	.	H	α-helix	trans	-66.3	-56.2	176.9	-63.2	161.6	0	0	0	110.1	L537 L631 D632 L635 K660 K661 F662 T666 Q667 E668	L537-I664 HydrophobicContact CD2-CG1 4.05Å; L631-I664 HydrophobicContact CB-CD1 3.98Å; L631-I664 HydrophobicContact CB-CG1 4.36Å; L631-I664 HydrophobicContact CD2-CD1 4.03Å; L631-I664 HydrophobicContact CD2-CG1 3.95Å; L631-I664 HydrophobicContact CG-CD1 3.98Å; L631-I664 HydrophobicContact CG-CG1 4.41Å; D632-I664 WeakPolarHBondContact OD1-CD1 3.27Å; L635-I664 HydrophobicContact CD1-CD1 3.88Å; K660-I664 WeakPolarHBondContact O-CG1 3.22Å; K660-I664 PolarHBondContact O-N 2.85Å; K660-I664 VanDerWaalsContact O-N 3.16Å; K661-I664 WeakPolarHBondContact O-CB 3.41Å; K661-I664 PolarHBondContact O-N 3.12Å; K661-I664 VanDerWaalsContact O-N 3.15Å; F662-I664 VanDerWaalsContact C-N 3.32Å; F662-I664 PolarHBondContact O-N 2.98Å; I664-T666 PolarHBondContact O-N 3.02Å; I664-T666 VanDerWaalsContact O-N 3.17Å; I664-Q667 PolarHBondContact O-N 3.29Å; I664-E668 HydrophobicContact CG2-CG 4.43Å; I664-E668 PolarHBondContact O-N 3.35Å
665	E	83.6	Confident	77.1	Confident	108 Å²	108	62.9 Å²	62.9	51%	0.505	30%	0.303	S	S	.	.	H	α-helix	trans	-53.3	-39.1	178.9	-70.6	171.2	-155.9	0	0	112.2	K661 L669	K661-E665 WeakPolarHBondContact O-CG 3.39Å; K661-E665 PolarHBondContact O-N 3.31Å; E665-L669 VanDerWaalsContact O-CG 3.28Å; E665-L669 WeakPolarHBondContact O-CG 3.49Å; E665-L669 PolarHBondContact O-N 3.03Å; E665-L669 VanDerWaalsContact O-N 3.12Å
666	T	79.9	Confident	75.1	Confident	56 Å²	56	65.2 Å²	65.2	34%	0.344	32%	0.321	S	S	.	.	H	α-helix	trans	-69.9	-41.5	179.4	-56.8	0	0	0	0	112.2	F662 I664 L669 D670	F662-T666 WeakPolarHBondContact CD1-OG1 3.48Å; F662-T666 WeakPolarHBondContact CE1-OG1 3.44Å; F662-T666 WeakPolarHBondContact O-CB 3.38Å; F662-T666 PolarHBondContact O-N 3.26Å; F662-T666 PolarHBondContact O-OG1 2.82Å; I664-T666 PolarHBondContact O-N 3.02Å; I664-T666 VanDerWaalsContact O-N 3.17Å; T666-L669 PolarHBondContact O-N 3.49Å; T666-D670 PolarHBondContact O-N 2.89Å
667	Q	77.4	Confident	72.4	Confident	85 Å²	85	69.4 Å²	69.4	40%	0.397	34%	0.343	S	S	.	.	H	α-helix	trans	-67.1	-40.8	176.8	-174.9	66.1	54.6	0	0	111.2	L537 E663 I664 L669 D670 D671	L537-Q667 HydrophobicContact CD1-CB 3.64Å; L537-Q667 HydrophobicContact CD1-CG 3.87Å; E663-Q667 PolarHBondContact O-N 3.26Å; I664-Q667 PolarHBondContact O-N 3.29Å; Q667-L669 VanDerWaalsContact C-N 3.34Å; Q667-L669 PolarHBondContact O-N 2.86Å; Q667-D670 PolarHBondContact O-N 3.36Å; Q667-D671 PolarHBondContact NE2-OD1 3.04Å; Q667-D671 WeakPolarHBondContact O-CB 3.15Å; Q667-D671 PolarHBondContact O-N 3.01Å
668	E	73.1	Confident	70.1	Confident	116 Å²	116	75.1 Å²	75.1	54%	0.542	37%	0.369	S	S	.	.	H	α-helix	trans	-60.8	-43.1	177.2	-70	-175	143.3	0	0	111.4	I664 D671 E672	I664-E668 HydrophobicContact CG2-CG 4.43Å; I664-E668 PolarHBondContact O-N 3.35Å; E668-D671 PolarHBondContact O-N 3.31Å; E668-E672 WeakPolarHBondContact O-CB 3.41Å; E668-E672 WeakPolarHBondContact O-CG 3.36Å; E668-E672 PolarHBondContact O-N 3.16Å
669	L	70.9	Confident	67.9	Low	111 Å²	111	82.9 Å²	82.9	58%	0.581	39%	0.393	S	S	*	.	H	α-helix	trans	-66.4	-36.9	175.1	-71.8	169.5	0	0	0	113.6	E665 T666 Q667 R673	E665-L669 VanDerWaalsContact O-CG 3.28Å; E665-L669 WeakPolarHBondContact O-CG 3.49Å; E665-L669 PolarHBondContact O-N 3.03Å; E665-L669 VanDerWaalsContact O-N 3.12Å; T666-L669 PolarHBondContact O-N 3.49Å; Q667-L669 VanDerWaalsContact C-N 3.34Å; Q667-L669 PolarHBondContact O-N 2.86Å; L669-R673 WeakPolarHBondContact O-CB 3.27Å; L669-R673 PolarHBondContact O-N 2.93Å
670	D	69.8	Low	65.7	Low	60 Å²	60	91.2 Å²	91.2	32%	0.321	43%	0.429	S	S	.	.	H	α-helix	trans	-65.6	-44.2	173.8	-99.6	-13.7	0	0	0	110.9	T666 Q667 R673 N674	T666-D670 PolarHBondContact O-N 2.89Å; Q667-D670 PolarHBondContact O-N 3.36Å; D670-R673 PolarHBondContact O-N 3.29Å; D670-R673 IonicContact OD1-CZ 3.71Å; D670-R673 IonicContact OD1-NH1 2.91Å; D670-R673 PolarHBondContact OD1-NH1 3.17Å; D670-R673 IonicContact OD1-NH2 3.79Å; D670-R673 PolarHBondContact OD1-NH2 3.09Å; D670-N674 WeakPolarHBondContact O-CB 3.34Å; D670-N674 PolarHBondContact O-N 3.5Å; D670-N674 PolarHBondContact O-ND2 3.35Å; D670-N674 VanDerWaalsContact O-ND2 3.14Å; D670-N674 PolarHBondContact O-OD1 2.6Å
671	D	67.8	Low	63.3	Low	60 Å²	60	100.3 Å²	100.3	32%	0.321	48%	0.477	S	S	.	.	H	α-helix	trans	-66.1	-43.3	177.1	-83.3	16.6	0	0	0	112.5	Q667 E668 N674 K675	Q667-D671 PolarHBondContact NE2-OD1 3.04Å; Q667-D671 WeakPolarHBondContact O-CB 3.15Å; Q667-D671 PolarHBondContact O-N 3.01Å; E668-D671 PolarHBondContact O-N 3.31Å; D671-N674 PolarHBondContact O-N 3.45Å; D671-K675 WeakPolarHBondContact O-CD 3.48Å; D671-K675 VanDerWaalsContact O-CG 3.24Å; D671-K675 WeakPolarHBondContact O-CG 3.4Å; D671-K675 PolarHBondContact O-N 2.93Å
672	E	62.4	Low	62.1	Low	119 Å²	119	100 Å²	100	56%	0.556	48%	0.477	S	S	*	.	H	α-helix	trans	-61.5	-46.6	174.4	-80.1	-169.1	161.8	0	0	111.2	E668 N674 K675 C676	E668-E672 WeakPolarHBondContact O-CB 3.41Å; E668-E672 WeakPolarHBondContact O-CG 3.36Å; E668-E672 PolarHBondContact O-N 3.16Å; E672-N674 VanDerWaalsContact C-N 3.28Å; E672-N674 PolarHBondContact O-N 2.75Å; E672-K675 PolarHBondContact O-N 3.35Å; E672-C676 WeakPolarHBondContact O-CB 3.31Å; E672-C676 PolarHBondContact O-N 3.43Å; E672-C676 PolarHBondContact O-SG 3.07Å; E672-C676 VanDerWaalsContact O-SG 3.38Å
673	R	55.8	Low	60.9	Low	126 Å²	126	102.6 Å²	102.6	48%	0.475	49%	0.49	S	S	.	.	H	α-helix	trans	-58.5	-43.1	175.2	-175.8	-163.2	61.6	-122.9	-18.3	111.1	L669 D670 C676 L677	L669-R673 WeakPolarHBondContact O-CB 3.27Å; L669-R673 PolarHBondContact O-N 2.93Å; D670-R673 PolarHBondContact O-N 3.29Å; D670-R673 IonicContact OD1-CZ 3.71Å; D670-R673 IonicContact OD1-NH1 2.91Å; D670-R673 PolarHBondContact OD1-NH1 3.17Å; D670-R673 IonicContact OD1-NH2 3.79Å; D670-R673 PolarHBondContact OD1-NH2 3.09Å; R673-C676 PolarHBondContact O-N 3.14Å; R673-L677 HydrophobicContact CG-CD1 4.21Å; R673-L677 VanDerWaalsContact O-CG 3.3Å; R673-L677 WeakPolarHBondContact O-CG 3.2Å; R673-L677 PolarHBondContact O-N 3.03Å
674	N	55.4	Low	59.7	Low	70 Å²	70	105.4 Å²	105.4	37%	0.374	51%	0.505	S	S	.	.	H	α-helix	trans	-65.2	-45.4	-179.9	-61.9	-15.7	0	0	0	111	D670 D671 E672 C676 L677 E678	D670-N674 WeakPolarHBondContact O-CB 3.34Å; D670-N674 PolarHBondContact O-N 3.5Å; D670-N674 PolarHBondContact O-ND2 3.35Å; D670-N674 VanDerWaalsContact O-ND2 3.14Å; D670-N674 PolarHBondContact O-OD1 2.6Å; D671-N674 PolarHBondContact O-N 3.45Å; E672-N674 VanDerWaalsContact C-N 3.28Å; E672-N674 PolarHBondContact O-N 2.75Å; N674-C676 PolarHBondContact O-N 3.48Å; N674-L677 WeakPolarHBondContact O-CB 3.49Å; N674-L677 PolarHBondContact O-N 2.81Å; N674-E678 PolarHBondContact O-N 2.99Å
675	K	55.8	Low	58.2	Low	98 Å²	98	111 Å²	111	43%	0.426	53%	0.531	S	S	.	.	H	α-helix	trans	-60.2	-43.7	173.6	-68.5	158	-167.6	157.2	0	112.1	D671 E672 L677 E678 Y679	D671-K675 WeakPolarHBondContact O-CD 3.48Å; D671-K675 VanDerWaalsContact O-CG 3.24Å; D671-K675 WeakPolarHBondContact O-CG 3.4Å; D671-K675 PolarHBondContact O-N 2.93Å; E672-K675 PolarHBondContact O-N 3.35Å; K675-L677 VanDerWaalsContact C-N 3.31Å; K675-L677 PolarHBondContact O-N 2.73Å; K675-E678 CarbonylContact O-C 3.58Å; K675-E678 WeakPolarHBondContact O-CB 3.38Å; K675-E678 PolarHBondContact O-N 3.34Å; K675-E678 VanDerWaalsContact O-N 3.15Å; K675-Y679 HydrophobicContact CB-CE2 4.34Å; K675-Y679 WeakPolarHBondContact O-CD2 3.36Å; K675-Y679 PolarHBondContact O-N 3.09Å
676	C	42.7	Very low	56.6	Low	63 Å²	63	111.2 Å²	111.2	43%	0.426	53%	0.533	S	S	.	.	H	α-helix	trans	-61.2	-39.2	175.5	-75	0	0	0	0	112	E672 R673 N674 E678 Y679 F680	E672-C676 WeakPolarHBondContact O-CB 3.31Å; E672-C676 PolarHBondContact O-N 3.43Å; E672-C676 PolarHBondContact O-SG 3.07Å; E672-C676 VanDerWaalsContact O-SG 3.38Å; R673-C676 PolarHBondContact O-N 3.14Å; N674-C676 PolarHBondContact O-N 3.48Å; C676-E678 VanDerWaalsContact C-N 3.34Å; C676-Y679 PolarHBondContact O-N 2.68Å; C676-F680 WeakPolarHBondContact O-CD2 3.48Å; C676-F680 PolarHBondContact O-N 3.29Å
677	L	33.2	Very low	55	Low	95 Å²	95	114.9 Å²	114.9	50%	0.497	55%	0.545	S	S	.	.	H	α-helix	trans	-64.7	-38.1	173.9	-70.6	166.4	0	0	0	111.7	R673 N674 K675 Y679 F680 I681	R673-L677 HydrophobicContact CG-CD1 4.21Å; R673-L677 VanDerWaalsContact O-CG 3.3Å; R673-L677 WeakPolarHBondContact O-CG 3.2Å; R673-L677 PolarHBondContact O-N 3.03Å; N674-L677 WeakPolarHBondContact O-CB 3.49Å; N674-L677 PolarHBondContact O-N 2.81Å; K675-L677 VanDerWaalsContact C-N 3.31Å; K675-L677 PolarHBondContact O-N 2.73Å; L677-Y679 VanDerWaalsContact C-N 3.29Å; L677-Y679 PolarHBondContact O-N 2.85Å; L677-F680 PolarHBondContact O-N 3.1Å; L677-I681 WeakPolarHBondContact O-CD1 3.18Å; L677-I681 WeakPolarHBondContact O-CG1 3.42Å
678	E	42.9	Very low	53.4	Low	147 Å²	147	117 Å²	117	69%	0.687	56%	0.556	S	S	*	*	H	α-helix	trans	-66.8	-25.3	172.6	-69.2	176.9	173.4	0	0	113.6	N674 K675 C676	N674-E678 PolarHBondContact O-N 2.99Å; K675-E678 CarbonylContact O-C 3.58Å; K675-E678 WeakPolarHBondContact O-CB 3.38Å; K675-E678 PolarHBondContact O-N 3.34Å; K675-E678 VanDerWaalsContact O-N 3.15Å; C676-E678 VanDerWaalsContact C-N 3.34Å
679	Y	41.3	Very low	51.9	Low	192 Å²	192	117.1 Å²	117.1	75%	0.753	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-6.5	173.6	-70.2	-56.4	0	0	0	114.6	K675 C676 L677	K675-Y679 HydrophobicContact CB-CE2 4.34Å; K675-Y679 WeakPolarHBondContact O-CD2 3.36Å; K675-Y679 PolarHBondContact O-N 3.09Å; C676-Y679 PolarHBondContact O-N 2.68Å; L677-Y679 VanDerWaalsContact C-N 3.29Å; L677-Y679 PolarHBondContact O-N 2.85Å
680	F	39.3	Very low	50.3	Low	181 Å²	181	117.6 Å²	117.6	79%	0.794	56%	0.555	S	S	*	*			trans	-116.9	19.7	-179.9	-70.3	-56	0	0	0	113.5	C676 L677	C676-F680 WeakPolarHBondContact O-CD2 3.48Å; C676-F680 PolarHBondContact O-N 3.29Å; L677-F680 PolarHBondContact O-N 3.1Å
681	I	37.4	Very low	48.5	Very low	200 Å²	200	122.8 Å²	122.8	100%	1.026	58%	0.576	S	S	*	*			trans	-120.4	0	173.9	-65.4	168.5	0	0	0	109.2	L677	L677-I681 WeakPolarHBondContact O-CD1 3.18Å; L677-I681 WeakPolarHBondContact O-CG1 3.42Å

Retrieved 681 of 681 residues in 1447.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).