A0A087XRB8_POEFO Loading...

Phosphatidylinositol glycan anchor biosynthesis class T

AlphaFold DB , UniProt , Accession A0A087XRB8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 641 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31	Very low	39.1	Very low	243 Å²	243	139.9 Å²	139.9	100%	1.197	82%	0.816	S	S	*	*				0	91.8	0	-65.3	175.8	-165.1	0	0	106
2	A	30.1	Very low	39.7	Very low	104 Å²	104	139.4 Å²	139.4	86%	0.86	81%	0.806	S	S	*	*				108.2	115.5	85.2	0	0	0	0	0	109
3	A	36.6	Very low	40.3	Very low	94 Å²	94	137.8 Å²	137.8	78%	0.777	79%	0.792	S	S	*	*			trans	-68.4	-178.7	168.3	0	0	0	0	0	110.4
4	P	47.2	Very low	40.7	Very low	106 Å²	106	135.8 Å²	135.8	69%	0.688	78%	0.777	S	S	*	*			cis	-157.5	179.2	29.1	43.4	-19.7	0	0	0	121.1
5	R	34.4	Very low	41.3	Very low	231 Å²	231	133.7 Å²	133.7	87%	0.872	77%	0.767	S	S	*	*			trans	68.4	123.6	147.4	-74.9	159.2	-173.4	-170.2	1.9	119.2
6	C	43.3	Very low	41.5	Very low	130 Å²	130	134.6 Å²	134.6	88%	0.878	76%	0.76	S	S	*	*			cis	64.1	87.5	31	-148	0	0	0	0	115.4
7	S	36.6	Very low	42.1	Very low	115 Å²	115	132.5 Å²	132.5	80%	0.804	75%	0.745	S	S	*	*			trans	-167.7	39.7	166.2	-168.5	0	0	0	0	115.2
8	R	41.1	Very low	42.1	Very low	233 Å²	233	134.7 Å²	134.7	88%	0.879	74%	0.741	S	S	*	*	S	Bend	trans	-131.4	-11.4	176.4	-76.4	-168.5	177.2	-174.1	-0.2	117.4
9	C	44.6	Very low	42.3	Very low	112 Å²	112	131.1 Å²	131.1	76%	0.757	73%	0.726	S	S	*	*	S	Bend	trans	-89.3	-19.6	179.6	-88.4	0	0	0	0	115.1
10	A	43.9	Very low	42.3	Very low	72 Å²	72	130.5 Å²	130.5	60%	0.595	72%	0.721	S	S	*	*	H	α-helix	trans	-78.8	-28.2	-175.6	0	0	0	0	0	114.2
11	C	41.8	Very low	42.3	Very low	99 Å²	99	132.2 Å²	132.2	67%	0.669	72%	0.718	S	S	*	*	H	α-helix	trans	-75.2	-27.1	-178.2	-75.7	0	0	0	0	114	V15	C11-V15 WeakPolarHBondContact O-CG2 2.76Å; C11-V15 PolarHBondContact O-N 2.8Å
12	L	45.6	Very low	42.7	Very low	134 Å²	134	125.6 Å²	125.6	70%	0.702	69%	0.691	S	S	*	*	H	α-helix	trans	-76	-29.3	-179.6	-84.5	158.2	0	0	0	112.6
13	L	47.4	Very low	43.1	Very low	119 Å²	119	126.4 Å²	126.4	62%	0.623	69%	0.685	S	S	*	*	H	α-helix	trans	-77.7	-32.9	176.6	-89.7	153.5	0	0	0	112.8	I17	L13-I17 WeakPolarHBondContact O-CD1 3.4Å; L13-I17 WeakPolarHBondContact O-CG1 3.43Å; L13-I17 PolarHBondContact O-N 2.89Å
14	L	45.9	Very low	43.1	Very low	109 Å²	109	127.6 Å²	127.6	57%	0.571	68%	0.682	S	S	*	*	H	α-helix	trans	-72.5	-31.6	178	-84.5	161.3	0	0	0	113.3	Y18	L14-Y18 PolarHBondContact O-N 3.23Å
15	V	49.6	Very low	42.6	Very low	105 Å²	105	128.6 Å²	128.6	64%	0.636	68%	0.68	S	S	*	*	H	α-helix	trans	-72.2	-32.7	176.9	175.5	0	0	0	0	111.7	C11 S19	C11-V15 WeakPolarHBondContact O-CG2 2.76Å; C11-V15 PolarHBondContact O-N 2.8Å; V15-S19 PolarHBondContact O-N 3.29Å; V15-S19 PolarHBondContact O-OG 3.39Å
16	F	44.9	Very low	42.6	Very low	147 Å²	147	122.5 Å²	122.5	65%	0.645	67%	0.673	S	S	*	*	H	α-helix	trans	-75.9	-29.5	177.7	-115.1	-86.6	0	0	0	113.5	S19	F16-S19 PolarHBondContact O-OG 2.65Å; F16-S19 VanDerWaalsContact O-OG 3.12Å
17	I	51.9	Low	42	Very low	99 Å²	99	125.2 Å²	125.2	51%	0.508	67%	0.673	S	S	.	*	H	α-helix	trans	-80	-32.4	178.3	-65.4	167.1	0	0	0	111.1	L13 Y21	L13-I17 WeakPolarHBondContact O-CD1 3.4Å; L13-I17 WeakPolarHBondContact O-CG1 3.43Å; L13-I17 PolarHBondContact O-N 2.89Å; I17-Y21 PolarHBondContact O-N 3.06Å
18	Y	42	Very low	41.7	Very low	172 Å²	172	129.1 Å²	129.1	68%	0.675	68%	0.679	S	S	*	*	H	α-helix	trans	-73.3	-29.8	177.2	-110.1	-88.6	0	0	0	113.8	L14 V22	L14-Y18 PolarHBondContact O-N 3.23Å; Y18-V22 WeakPolarHBondContact O-CG2 3.22Å
19	S	45.2	Very low	41.3	Very low	67 Å²	67	123.7 Å²	123.7	47%	0.469	67%	0.674	S	S	.	*	H	α-helix	trans	-73.7	-30.3	176.8	55.8	0	0	0	0	113.1	V15 F16	V15-S19 PolarHBondContact O-N 3.29Å; V15-S19 PolarHBondContact O-OG 3.39Å; F16-S19 PolarHBondContact O-OG 2.65Å; F16-S19 VanDerWaalsContact O-OG 3.12Å
20	L	43.1	Very low	40.5	Very low	118 Å²	118	125 Å²	125	62%	0.618	68%	0.678	S	S	*	*	H	α-helix	trans	-76.8	-28.1	175.6	-88.2	154.3	0	0	0	113.1
21	Y	41.1	Very low	39.9	Very low	167 Å²	167	127.8 Å²	127.8	66%	0.655	69%	0.691	S	S	*	*	H	α-helix	trans	-78.7	-25	-180	-125.7	-89.3	0	0	0	113.8	I17 I25	I17-Y21 PolarHBondContact O-N 3.06Å; Y21-I25 HydrophobicContact CD1-CD1 4.16Å; Y21-I25 HydrophobicContact CE1-CD1 4.27Å
22	V	40.2	Very low	39.1	Very low	105 Å²	105	126.8 Å²	126.8	64%	0.636	70%	0.697	S	S	*	*	H	α-helix	trans	-81.6	-21.2	-179.1	174.9	0	0	0	0	112.5	Y18	Y18-V22 WeakPolarHBondContact O-CG2 3.22Å
23	V	39.2	Very low	38.1	Very low	120 Å²	120	127.3 Å²	127.3	73%	0.727	70%	0.7	S	S	*	*	S	Bend	trans	-85.2	-16.3	-179.7	178.1	0	0	0	0	112.8
24	V	37	Very low	37.1	Very low	119 Å²	119	128.6 Å²	128.6	72%	0.721	70%	0.703	S	S	*	*	S	Bend	trans	-98.4	-5.3	-173	178.9	0	0	0	0	113.9
25	I	36.2	Very low	36.1	Very low	127 Å²	127	130.7 Å²	130.7	65%	0.651	71%	0.71	S	S	*	*	S	Bend	trans	-109.3	-0.7	-175.6	-62.2	177.9	0	0	0	114	Y21	Y21-I25 HydrophobicContact CD1-CD1 4.16Å; Y21-I25 HydrophobicContact CE1-CD1 4.27Å
26	S	33.2	Very low	35	Very low	103 Å²	103	134.2 Å²	134.2	72%	0.72	72%	0.719	S	S	*	*	S	Bend	trans	-114.8	80.8	173.2	-77.7	0	0	0	0	111.5
27	E	31.4	Very low	34.1	Very low	187 Å²	187	132 Å²	132	87%	0.874	73%	0.728	S	S	*	*			trans	178.5	97.5	140.2	-100.1	167.8	-171	0	0	111.3
28	E	29.9	Very low	32.7	Very low	198 Å²	198	132.6 Å²	132.6	93%	0.925	74%	0.741	S	S	*	*			trans	-122.4	128.7	143.1	-91.5	-172	166.8	0	0	106.5
29	P	33.2	Very low	31.9	Very low	119 Å²	119	131 Å²	131	77%	0.773	75%	0.748	S	S	*	*			trans	-125	125.6	156.5	32.5	-18.5	0	0	0	111.9
30	T	27.3	Very low	31	Very low	138 Å²	138	133.9 Å²	133.9	85%	0.847	76%	0.763	S	S	*	*			trans	-77.5	158.8	158.3	43.7	0	0	0	0	111.3
31	P	32.6	Very low	30.1	Very low	132 Å²	132	136.8 Å²	136.8	86%	0.857	77%	0.774	S	S	*	*			trans	-95.3	154.1	-147.3	36.5	-33.9	0	0	0	114.5
32	G	24.4	Very low	29.3	Very low	78 Å²	78	136.2 Å²	136.2	80%	0.804	78%	0.782	S	S	*	*			trans	-170.3	105.2	171.7	0	0	0	0	0	114.2
33	N	24.4	Very low	28.8	Very low	145 Å²	145	136.6 Å²	136.6	78%	0.775	79%	0.786	S	S	*	*			trans	19.4	139.6	154.9	-99.9	17.9	0	0	0	124.4
34	E	26.4	Very low	28.2	Very low	145 Å²	145	139.5 Å²	139.5	68%	0.678	79%	0.792	S	S	*	*			trans	99.1	107.5	137.1	-77.4	166.8	-148.9	0	0	121.5
35	Q	25.1	Very low	27.7	Very low	154 Å²	154	140.5 Å²	140.5	72%	0.72	80%	0.799	S	S	*	*				49	107	125.6	-62.2	178.8	-2.8	0	0	119.2
36	H	26.3	Very low	27	Very low	179 Å²	179	139 Å²	139	83%	0.829	81%	0.805	S	S	*	*				172.3	152	99.5	-101.5	-72.1	0	0	0	112
37	A	25.1	Very low	26.6	Very low	99 Å²	99	138.5 Å²	138.5	82%	0.818	81%	0.807	S	S	*	*			trans	-64.6	146.3	-174.1	0	0	0	0	0	115.1
38	S	24.3	Very low	26.2	Very low	113 Å²	113	138.4 Å²	138.4	79%	0.79	81%	0.807	S	S	*	*			trans	-148	128.8	154.8	61.3	0	0	0	0	112.3
39	V	24.9	Very low	25.9	Very low	137 Å²	137	134.5 Å²	134.5	83%	0.83	80%	0.797	S	S	*	*			trans	-55.7	141.7	172.1	172.6	0	0	0	0	111.5
40	V	25.9	Very low	25.5	Very low	129 Å²	129	137.9 Å²	137.9	78%	0.782	80%	0.802	S	S	*	*			trans	-112.8	113.1	172.2	175.5	0	0	0	0	108.7
41	E	24.5	Very low	25.2	Very low	179 Å²	179	140.9 Å²	140.9	84%	0.836	80%	0.804	S	S	*	*			trans	-97.6	135.3	161.3	-85.7	-177.9	156.5	0	0	109.4
42	N	24.4	Very low	24.8	Very low	155 Å²	155	143.5 Å²	143.5	83%	0.829	80%	0.804	S	S	*	*			trans	-108.1	134.3	171.9	-107.9	-10.5	0	0	0	108.9
43	P	30	Very low	24.9	Very low	112 Å²	112	145.7 Å²	145.7	73%	0.727	81%	0.805	S	S	*	*			trans	-108.1	165	171.2	36.7	-27.6	0	0	0	113.7
44	Q	25	Very low	24.9	Very low	182 Å²	182	145.6 Å²	145.6	85%	0.85	81%	0.809	S	S	*	*			trans	98.2	124.8	173.2	-55.1	-176.8	-12.7	0	0	113.6
45	T	26.7	Very low	24.8	Very low	139 Å²	139	146.1 Å²	146.1	85%	0.853	81%	0.812	S	S	*	*			cis	-160.7	146.6	46.9	-38.8	0	0	0	0	111.2
46	A	22.6	Very low	24.9	Very low	96 Å²	96	148.1 Å²	148.1	79%	0.793	82%	0.821	S	S	*	*			trans	-101.8	146.8	174.8	0	0	0	0	0	111.7
47	A	23.9	Very low	24.9	Very low	92 Å²	92	149.4 Å²	149.4	76%	0.76	82%	0.819	S	S	*	*			trans	-157.9	115.9	148.7	0	0	0	0	0	110.9
48	E	23.8	Very low	24.8	Very low	185 Å²	185	155.4 Å²	155.4	86%	0.864	82%	0.82	S	S	*	*			trans	52.5	124.5	146.6	-60.3	176	170.1	0	0	118.8
49	T	23.5	Very low	24.9	Very low	117 Å²	117	162 Å²	162	72%	0.718	83%	0.828	S	S	*	*				-173.8	143.8	73.2	-49.5	0	0	0	0	111.6
50	E	24	Very low	24.9	Very low	190 Å²	190	163.4 Å²	163.4	89%	0.888	83%	0.825	S	S	*	*			trans	70.8	140.6	154.6	-81.9	168.8	179.3	0	0	124
51	K	22.4	Very low	24.8	Very low	201 Å²	201	162 Å²	162	87%	0.874	83%	0.827	S	S	*	*			trans	-107.1	149.6	-165.5	-72.1	175.6	172.4	175.8	0	112.9
52	Q	24.2	Very low	24.8	Very low	186 Å²	186	159.9 Å²	159.9	87%	0.869	83%	0.827	S	S	*	*			trans	117.9	152.8	146.7	-70.6	-173.3	-37.8	0	0	115.8
53	P	25.9	Very low	24.8	Very low	125 Å²	125	160.8 Å²	160.8	81%	0.812	83%	0.826	S	S	*	*				-112.5	152.5	-69.4	32.8	-16.9	0	0	0	111.4
54	T	23.1	Very low	24.6	Very low	143 Å²	143	162 Å²	162	88%	0.877	83%	0.831	S	S	*	*			trans	-87.5	114.6	-178.8	-27.1	0	0	0	0	110.8
55	E	25.4	Very low	24.6	Very low	156 Å²	156	160.2 Å²	160.2	73%	0.729	83%	0.827	S	S	*	*			trans	-77.6	121.9	159	-93.1	-175.4	162.9	0	0	109.2	R57	E55-R57 PolarHBondContact O-N 3.28Å
56	E	26.9	Very low	24.4	Very low	195 Å²	195	162.5 Å²	162.5	91%	0.911	83%	0.828	S	S	*	*			trans	-67.8	108.9	167.2	-74.4	179.6	149	0	0	109.8
57	R	25.4	Very low	24.5	Very low	206 Å²	206	164.3 Å²	164.3	78%	0.777	83%	0.83	S	S	*	*			trans	-104.1	102.2	163.3	-77.7	-172.4	-176.3	-175	1.6	110.4	E55	E55-R57 PolarHBondContact O-N 3.28Å
58	R	24.8	Very low	24.5	Very low	226 Å²	226	165.7 Å²	165.7	85%	0.853	83%	0.828	S	S	*	*			trans	-58.9	127.1	163.8	-151.4	177.5	-152.1	177.3	5.1	108.7	E60	R58-E60 PolarHBondContact O-N 3.32Å
59	W	24.7	Very low	24.7	Very low	252 Å²	252	162.7 Å²	162.7	96%	0.955	83%	0.825	S	S	*	*			trans	-75.9	105.3	172.9	-70.4	95.3	0	0	0	109.3
60	E	26.2	Very low	24.7	Very low	166 Å²	166	163.8 Å²	163.8	78%	0.776	83%	0.826	S	S	*	*			trans	-88.8	136.9	168.5	-94.1	172.5	173.9	0	0	110.6	R58 T62	R58-E60 PolarHBondContact O-N 3.32Å; E60-T62 PolarHBondContact O-N 2.85Å
61	A	23.8	Very low	24.9	Very low	99 Å²	99	162 Å²	162	82%	0.818	82%	0.823	S	S	*	*			trans	-67.8	125	177	0	0	0	0	0	110.4	Q63	A61-Q63 PolarHBondContact O-N 2.84Å
62	T	24.3	Very low	25.1	Very low	135 Å²	135	156.7 Å²	156.7	83%	0.828	82%	0.816	S	S	*	*			trans	-78.5	107.4	176.3	-34.2	0	0	0	0	109.4	E60	E60-T62 PolarHBondContact O-N 2.85Å
63	Q	24.6	Very low	25.2	Very low	174 Å²	174	152.6 Å²	152.6	81%	0.813	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-72.1	137.9	160.5	-73.3	-177.1	-20.9	0	0	108.7	A61	A61-Q63 PolarHBondContact O-N 2.84Å
64	V	25.3	Very low	25.2	Very low	138 Å²	138	151.2 Å²	151.2	84%	0.836	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-100.1	118.4	171.9	177	0	0	0	0	107.1
65	D	24.2	Very low	25.3	Very low	143 Å²	143	152 Å²	152	77%	0.765	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-67.3	126.3	178.4	-77.2	-43.8	0	0	0	111.9
66	E	23.6	Very low	25.4	Very low	188 Å²	188	154.3 Å²	154.3	88%	0.879	82%	0.82	S	S	*	*			trans	-85.9	112.4	159.1	-78.9	-177.4	155.7	0	0	108.7
67	T	23.7	Very low	25.5	Very low	134 Å²	134	153.7 Å²	153.7	82%	0.822	82%	0.817	S	S	*	*			trans	-88.7	114.1	170.6	51.6	0	0	0	0	110.5
68	V	24.1	Very low	25.6	Very low	121 Å²	121	151.4 Å²	151.4	73%	0.733	82%	0.821	S	S	*	*			trans	-89.6	144.2	165.6	177.8	0	0	0	0	109.5
69	P	28.2	Very low	25.7	Very low	121 Å²	121	147.9 Å²	147.9	79%	0.786	82%	0.818	S	S	*	*			trans	-118.3	126.6	148.7	24.6	-8.2	0	0	0	112
70	D	24.8	Very low	26	Very low	141 Å²	141	141.9 Å²	141.9	75%	0.754	81%	0.811	S	S	*	*			trans	-63.8	152.2	158.4	-72.4	-40.7	0	0	0	109.2
71	D	27.7	Very low	26	Very low	152 Å²	152	140.5 Å²	140.5	81%	0.813	81%	0.814	S	S	*	*				-171.2	155.6	51.2	-128.2	-26	0	0	0	112.8
72	A	26.1	Very low	26.4	Very low	89 Å²	89	141.3 Å²	141.3	74%	0.736	81%	0.811	S	S	*	*			trans	75.9	117.9	146.4	0	0	0	0	0	124.7
73	A	26.6	Very low	26.6	Very low	100 Å²	100	142.8 Å²	142.8	83%	0.826	81%	0.813	S	S	*	*				112	101.6	127	0	0	0	0	0	121.1
74	A	26.3	Very low	26.9	Very low	97 Å²	97	139.9 Å²	139.9	80%	0.802	81%	0.812	S	S	*	*				65.4	118	128.2	0	0	0	0	0	123.4
75	N	24.8	Very low	27.1	Very low	158 Å²	158	139.4 Å²	139.4	85%	0.845	81%	0.809	S	S	*	*			trans	60	110.9	141.3	-85.1	-9.5	0	0	0	120.7
76	K	26.7	Very low	27.5	Very low	205 Å²	205	140.5 Å²	140.5	89%	0.891	82%	0.815	S	S	*	*				-179.9	140.6	105.5	-97.3	170.7	-178.3	-179.6	0	111.9
77	Q	28.6	Very low	27.7	Very low	182 Å²	182	137.4 Å²	137.4	85%	0.85	81%	0.809	S	S	*	*			trans	-64.4	140.5	169.4	-67.9	161.8	-29.7	0	0	110.3
78	D	27.5	Very low	28.1	Very low	159 Å²	159	136.2 Å²	136.2	85%	0.85	81%	0.806	S	S	*	*			trans	-164.7	153.6	147.9	-91.4	-34.2	0	0	0	112.1
79	L	28.8	Very low	28.5	Very low	152 Å²	152	136.3 Å²	136.3	80%	0.796	81%	0.807	S	S	*	*			trans	-63.5	166.5	-160.3	-69.8	131.1	0	0	0	118.2
80	P	29.2	Very low	29.1	Very low	125 Å²	125	135.8 Å²	135.8	81%	0.812	80%	0.803	S	S	*	*			trans	-81.6	141.8	-177.4	32.6	-32.3	0	0	0	113.4
81	V	27.9	Very low	30.1	Very low	137 Å²	137	133.7 Å²	133.7	83%	0.83	80%	0.797	S	S	*	*			trans	-111.1	140.3	172.3	177.9	0	0	0	0	108.1
82	P	32.4	Very low	31.4	Very low	117 Å²	117	132.2 Å²	132.2	76%	0.76	79%	0.789	S	S	*	*			trans	-81.9	157.4	-154.9	31.6	-34.6	0	0	0	114.9	S84	P82-S84 PolarHBondContact O-N 3Å
83	D	27.7	Very low	33.7	Very low	165 Å²	165	134.8 Å²	134.8	88%	0.882	78%	0.783	S	S	*	*			trans	-39.5	116.8	179.4	-65.7	-42.8	0	0	0	114	V85	D83-V85 PolarHBondContact O-N 2.9Å
84	S	30	Very low	36.5	Very low	113 Å²	113	130.8 Å²	130.8	79%	0.79	75%	0.748	S	S	*	*			trans	-71.3	120.8	162.4	47.7	0	0	0	0	109.2	P82 L86	P82-S84 PolarHBondContact O-N 3Å; S84-L86 PolarHBondContact O-N 3.07Å; S84-L86 VanDerWaalsContact O-N 3.07Å
85	V	30.8	Very low	39.6	Very low	128 Å²	128	128.3 Å²	128.3	78%	0.776	72%	0.72	S	S	*	*			trans	-28.6	106.7	166.7	-179.9	0	0	0	0	111.9	D83 T87	D83-V85 PolarHBondContact O-N 2.9Å; V85-T87 VanDerWaalsContact C-N 3.33Å; V85-T87 PolarHBondContact O-N 2.77Å
86	L	31.9	Very low	43	Very low	167 Å²	167	120.9 Å²	120.9	87%	0.874	68%	0.68	S	S	*	*			trans	-59.8	100.3	158.3	-89.1	152.1	0	0	0	107.2	S84 S88	S84-L86 PolarHBondContact O-N 3.07Å; S84-L86 VanDerWaalsContact O-N 3.07Å; L86-S88 PolarHBondContact O-N 3.11Å
87	T	27.6	Very low	46.2	Very low	123 Å²	123	112 Å²	112	76%	0.755	64%	0.642	S	S	*	*			trans	-54.3	105.8	163.6	27.5	0	0	0	0	107.8	V85 T89	V85-T87 VanDerWaalsContact C-N 3.33Å; V85-T87 PolarHBondContact O-N 2.77Å; T87-T89 PolarHBondContact O-N 2.76Å
88	S	32.1	Very low	49.5	Very low	108 Å²	108	103.5 Å²	103.5	76%	0.755	60%	0.602	S	S	*	*			trans	-56.5	107.6	170.3	57.7	0	0	0	0	108.1	L86	L86-S88 PolarHBondContact O-N 3.11Å
89	T	33.2	Very low	52.8	Low	124 Å²	124	96.2 Å²	96.2	76%	0.761	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-51	128.1	157.1	32.5	0	0	0	0	106.8	T87	T87-T89 PolarHBondContact O-N 2.76Å
90	P	41.3	Very low	56	Low	109 Å²	109	89 Å²	89	71%	0.708	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-56.3	130.7	176.5	22.9	-30.7	0	0	0	107	L92	P90-L92 PolarHBondContact O-N 3.12Å
91	P	45.7	Very low	59.2	Low	97 Å²	97	83 Å²	83	63%	0.63	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-60.9	119.3	-178.6	24.1	-31.4	0	0	0	107.3	K93	P91-K93 WeakPolarHBondContact O-CG 3.23Å; P91-K93 PolarHBondContact O-N 2.96Å; P91-K93 VanDerWaalsContact O-N 3.15Å
92	L	54.3	Low	62.4	Low	121 Å²	121	76.6 Å²	76.6	63%	0.634	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-58	117.4	165.2	-71.4	160.4	0	0	0	106.3	P90 D94 E121 R134	P90-L92 PolarHBondContact O-N 3.12Å; L92-D94 PolarHBondContact O-N 2.92Å; L92-E121 WeakPolarHBondContact CA-OE2 3.24Å; L92-E121 HydrophobicContact CD2-CB 4.44Å; L92-R134 PolarHBondContact O-NH1 3.18Å
93	K	73.6	Confident	65.3	Low	143 Å²	143	71.8 Å²	71.8	62%	0.622	41%	0.414	S	S	*	.			trans	-100.9	71.4	-170.8	-77	179	-175.1	177.5	0	109.8	P91 E95 E121	P91-K93 WeakPolarHBondContact O-CG 3.23Å; P91-K93 PolarHBondContact O-N 2.96Å; P91-K93 VanDerWaalsContact O-N 3.15Å; K93-E95 PolarHBondContact O-N 3.39Å; K93-E121 PolarHBondContact N-OE2 3.17Å
94	D	86.5	Confident	68.2	Low	17 Å²	17	64.7 Å²	64.7	9%	0.091	38%	0.377	C	S	.	.			trans	-55.8	130.3	161	-71	-5.4	0	0	0	109	L92 V119 E121 R134 L135	L92-D94 PolarHBondContact O-N 2.92Å; D94-V119 WeakPolarHBondContact CA-O 3.25Å; D94-E121 PolarHBondContact OD1-N 2.79Å; D94-R134 WeakPolarHBondContact OD2-CB 3.48Å; D94-R134 WeakPolarHBondContact OD2-CD 3.34Å; D94-L135 HydrophobicContact CB-CB 4.24Å; D94-L135 HydrophobicContact CB-CD1 3.86Å; D94-L135 HydrophobicContact CB-CG 4.03Å
95	E	91.7	Very high	71	Confident	44 Å²	44	59.4 Å²	59.4	21%	0.206	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	124.5	-173.1	-168.5	177.4	169.5	0	0	109.3	K93 Q97 T118 V119 S343 K551	K93-E95 PolarHBondContact O-N 3.39Å; E95-Q97 HydrophobicContact CG-CG 4.4Å; E95-Q97 PolarHBondContact OE1-NE2 3.26Å; E95-T118 WeakPolarHBondContact O-CA 3.41Å; E95-V119 HydrophobicContact CB-CB 4.48Å; E95-V119 PolarHBondContact N-O 2.8Å; E95-V119 PolarHBondContact O-N 3.42Å; E95-S343 VanDerWaalsContact CG-OG 3.3Å; E95-S343 WeakPolarHBondContact CG-OG 3.01Å; E95-S343 PolarHBondContact OE1-OG 2.63Å; E95-K551 IonicContact OE2-NZ 2.75Å; E95-K551 PolarHBondContact OE2-NZ 2.82Å
96	F	95	Very high	73.3	Confident	3 Å²	3	56 Å²	56	1%	0.013	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	135.4	172.3	178.3	-116.3	0	0	0	110.1	E98 F116 R117 T118 L135 L260 P261 C339 A342 S343	F96-E98 HydrophobicContact CE1-CB 4.4Å; F96-E98 HydrophobicContact CZ-CB 4.35Å; F96-F116 HydrophobicContact CE2-CB 4.1Å; F96-F116 HydrophobicContact CE2-CD1 4.35Å; F96-F116 HydrophobicContact CZ-CB 4.44Å; F96-F116 AromaticContact CZ-CD1 3.85Å; F96-F116 HydrophobicContact CZ-CD1 3.85Å; F96-R117 CarbonylContact C-O 3.53Å; F96-R117 VanDerWaalsContact CA-O 3.3Å; F96-R117 WeakPolarHBondContact CA-O 3.33Å; F96-R117 VanDerWaalsContact CD2-O 3.31Å; F96-R117 WeakPolarHBondContact CD2-O 3.34Å; F96-T118 VanDerWaalsContact CD2-OG1 3.32Å; F96-T118 WeakPolarHBondContact CD2-OG1 3.48Å; F96-L135 HydrophobicContact CB-CD1 3.95Å; F96-L260 HydrophobicContact CE2-CD2 4.37Å; F96-L260 HydrophobicContact CZ-CD2 4.42Å; F96-P261 HydrophobicContact CB-CG 4.36Å; F96-P261 HydrophobicContact CD1-CG 4.17Å; F96-P261 HydrophobicContact CD2-CG 3.76Å; F96-P261 HydrophobicContact CE1-CG 4.45Å; F96-P261 HydrophobicContact CE2-CG 4.03Å; F96-P261 HydrophobicContact CG-CG 3.84Å; F96-P261 HydrophobicContact CZ-CG 4.38Å; F96-C339 HydrophobicContact CE1-CB 4.31Å; F96-C339 VanDerWaalsContact CE1-SG 3.56Å; F96-A342 HydrophobicContact CD1-CB 3.65Å; F96-A342 HydrophobicContact CE1-CB 4Å; F96-A342 CarbonylContact O-C 3.56Å; F96-A342 WeakPolarHBondContact O-CA 3.5Å; F96-S343 PolarHBondContact O-N 3.31Å; F96-S343 PolarHBondContact O-OG 3.07Å
97	Q	95.4	Very high	75.5	Confident	18 Å²	18	50.1 Å²	50.1	8%	0.084	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	142.4	177	-63.8	-178.5	-14.6	0	0	109.9	E95 F116 R117 S343 S344 L555	E95-Q97 HydrophobicContact CG-CG 4.4Å; E95-Q97 PolarHBondContact OE1-NE2 3.26Å; Q97-F116 WeakPolarHBondContact O-CA 3.19Å; Q97-R117 HydrophobicContact CB-CB 4.4Å; Q97-R117 VanDerWaalsContact CD-NH2 3.32Å; Q97-R117 PolarHBondContact N-O 3.1Å; Q97-R117 PolarHBondContact O-N 2.91Å; Q97-R117 VanDerWaalsContact OE1-CZ 3.31Å; Q97-S343 VanDerWaalsContact CG-OG 3.23Å; Q97-S343 WeakPolarHBondContact CG-OG 3.41Å; Q97-S344 WeakPolarHBondContact CA-O 3.34Å; Q97-L555 HydrophobicContact CB-CD1 4.07Å
98	E	96.8	Very high	78	Confident	3 Å²	3	44.7 Å²	44.7	1%	0.014	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	137.4	176.3	67.5	-179	173.2	0	0	110.6	F96 F116 G267 L268 C339 A342 S344 S345 K346	F96-E98 HydrophobicContact CE1-CB 4.4Å; F96-E98 HydrophobicContact CZ-CB 4.35Å; E98-F116 HydrophobicContact CB-CD1 3.55Å; E98-F116 HydrophobicContact CB-CE1 3.73Å; E98-G267 WeakPolarHBondContact OE1-CA 3.3Å; E98-L268 HydrophobicContact CB-CD1 4Å; E98-L268 HydrophobicContact CG-CD1 3.94Å; E98-L268 HydrophobicContact CG-CG 4.17Å; E98-L268 PolarHBondContact OE2-N 3.46Å; E98-C339 WeakPolarHBondContact OE1-CB 3.47Å; E98-C339 PolarHBondContact OE1-N 3.25Å; E98-C339 VanDerWaalsContact OE1-N 3.16Å; E98-A342 HydrophobicContact CG-CB 4.28Å; E98-S344 PolarHBondContact N-O 3.43Å; E98-S345 VanDerWaalsContact CD-OG 3.26Å; E98-S345 VanDerWaalsContact CG-OG 3.27Å; E98-S345 WeakPolarHBondContact CG-OG 3.39Å; E98-S345 WeakPolarHBondContact O-CA 3.36Å; E98-S345 VanDerWaalsContact OE1-CB 3.3Å; E98-S345 WeakPolarHBondContact OE1-CB 3.49Å; E98-S345 PolarHBondContact OE1-OG 2.85Å; E98-K346 PolarHBondContact O-N 3.44Å; E98-K346 VanDerWaalsContact O-N 3.16Å
99	E	96.4	Very high	80.7	Confident	6 Å²	6	40.1 Å²	40.1	3%	0.028	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	151.8	172.8	64.6	178.6	-150.5	0	0	112.3	F114 Q115 L268 K346 Y348 L555 F556	E99-F114 WeakPolarHBondContact O-CA 3.23Å; E99-Q115 HydrophobicContact CG-CB 3.59Å; E99-Q115 HydrophobicContact CG-CG 4.19Å; E99-Q115 PolarHBondContact N-O 3.12Å; E99-Q115 PolarHBondContact O-N 2.99Å; E99-Q115 WeakPolarHBondContact OE1-CG 3.44Å; E99-L268 VanDerWaalsContact CA-CD1 3.48Å; E99-K346 WeakPolarHBondContact CA-O 3.28Å; E99-Y348 HydrophobicContact CB-CD2 4.28Å; E99-Y348 HydrophobicContact CB-CE2 3.96Å; E99-L555 VanDerWaalsContact CD-N 3.26Å; E99-L555 HydrophobicContact CG-CB 4.29Å; E99-L555 HydrophobicContact CG-CD1 3.83Å; E99-L555 HydrophobicContact CG-CG 4.33Å; E99-L555 VanDerWaalsContact OE1-C 3.31Å; E99-L555 VanDerWaalsContact OE1-CA 3.24Å; E99-L555 WeakPolarHBondContact OE1-CA 3.42Å; E99-L555 WeakPolarHBondContact OE1-CB 3.5Å; E99-L555 PolarHBondContact OE1-N 3.37Å; E99-L555 WeakPolarHBondContact OE2-CB 3.29Å; E99-L555 WeakPolarHBondContact OE2-CG 3.28Å; E99-L555 PolarHBondContact OE2-N 3.31Å; E99-F556 WeakPolarHBondContact OE1-CD1 3.37Å; E99-F556 PolarHBondContact OE1-N 2.94Å
100	L	97.3	Very high	83.4	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	120.5	172.1	166	59.8	0	0	0	107.6	I102 A112 S113 F114 L268 L271 L327 K346 I347 Y348	L100-I102 HydrophobicContact CD1-CG1 4.13Å; L100-I102 HydrophobicContact CD2-CD1 4.15Å; L100-I102 HydrophobicContact CD2-CG1 4.3Å; L100-I102 HydrophobicContact CG-CD1 4.39Å; L100-I102 HydrophobicContact CG-CG1 4.03Å; L100-A112 HydrophobicContact CD1-CB 4.2Å; L100-S113 WeakPolarHBondContact CA-O 2.93Å; L100-F114 HydrophobicContact CB-CD1 4.18Å; L100-F114 HydrophobicContact CB-CE1 4.27Å; L100-F114 HydrophobicContact CD1-CD1 3.92Å; L100-F114 HydrophobicContact CD1-CD2 3.92Å; L100-F114 HydrophobicContact CD1-CE1 3.79Å; L100-F114 HydrophobicContact CD1-CE2 3.77Å; L100-F114 HydrophobicContact CD1-CG 3.99Å; L100-F114 HydrophobicContact CD1-CZ 3.7Å; L100-F114 HydrophobicContact CD2-CE1 3.85Å; L100-F114 HydrophobicContact CD2-CZ 4.01Å; L100-F114 HydrophobicContact CG-CD1 4.44Å; L100-F114 HydrophobicContact CG-CE1 4.18Å; L100-F114 HydrophobicContact CG-CZ 4.42Å; L100-L268 HydrophobicContact CB-CD1 3.86Å; L100-L268 HydrophobicContact CB-CD2 3.99Å; L100-L268 HydrophobicContact CD2-CD2 4.38Å; L100-L271 HydrophobicContact CD2-CD1 3.97Å; L100-L327 HydrophobicContact CD2-CD2 4.36Å; L100-K346 PolarHBondContact N-O 3.15Å; L100-I347 HydrophobicContact CB-CG1 4.4Å; L100-I347 HydrophobicContact CB-CG2 4.47Å; L100-I347 HydrophobicContact CD2-CG2 4.33Å; L100-I347 HydrophobicContact CG-CG2 4.27Å; L100-I347 CarbonylContact O-C 3.52Å; L100-I347 VanDerWaalsContact O-CA 3.27Å; L100-I347 WeakPolarHBondContact O-CA 3.4Å; L100-Y348 PolarHBondContact O-N 3.37Å
101	V	96.2	Very high	86	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	128.2	169.1	59.6	0	0	0	0	109.9	A112 S113 Y170 Y348 F381 F556	V101-A112 WeakPolarHBondContact O-CA 3.46Å; V101-S113 PolarHBondContact N-O 3.1Å; V101-S113 PolarHBondContact O-N 3.47Å; V101-Y170 HydrophobicContact CB-CE2 4.26Å; V101-Y170 HydrophobicContact CG1-CD2 3.66Å; V101-Y170 HydrophobicContact CG1-CE2 3.36Å; V101-Y170 HydrophobicContact CG2-CE2 3.85Å; V101-Y348 CarbonylContact C-O 3.57Å; V101-Y348 VanDerWaalsContact CA-O 3.31Å; V101-Y348 WeakPolarHBondContact CA-O 3.3Å; V101-F381 HydrophobicContact CG2-CD1 4.36Å; V101-F381 HydrophobicContact CG2-CE1 3.98Å; V101-F556 HydrophobicContact CB-CD1 3.75Å; V101-F556 HydrophobicContact CB-CE1 3.83Å; V101-F556 HydrophobicContact CB-CG 4.38Å; V101-F556 HydrophobicContact CG1-CB 4.13Å; V101-F556 HydrophobicContact CG1-CD1 3.73Å; V101-F556 HydrophobicContact CG1-CE1 4.3Å; V101-F556 HydrophobicContact CG1-CG 3.96Å; V101-F556 HydrophobicContact CG2-CD1 4.31Å; V101-F556 HydrophobicContact CG2-CE1 4.06Å; V101-F556 HydrophobicContact CG2-CZ 4.28Å
102	I	95.1	Very high	88.3	Confident	3 Å²	3	24.4 Å²	24.4	2%	0.015	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	121.9	175.5	-60.5	174.4	0	0	0	107.4	L100 I110 Y111 L327 M330 I347 Y348 I349 D350 I402	L100-I102 HydrophobicContact CD1-CG1 4.13Å; L100-I102 HydrophobicContact CD2-CD1 4.15Å; L100-I102 HydrophobicContact CD2-CG1 4.3Å; L100-I102 HydrophobicContact CG-CD1 4.39Å; L100-I102 HydrophobicContact CG-CG1 4.03Å; I102-I110 HydrophobicContact CG2-CG2 3.62Å; I102-Y111 CarbonylContact C-O 3.54Å; I102-Y111 WeakPolarHBondContact CA-O 3.3Å; I102-L327 HydrophobicContact CD1-CD2 3.95Å; I102-M330 HydrophobicContact CD1-CE 4.33Å; I102-I347 HydrophobicContact CD1-CG2 4.42Å; I102-Y348 PolarHBondContact N-O 2.83Å; I102-I349 HydrophobicContact CB-CG1 4.4Å; I102-I349 WeakPolarHBondContact O-CA 3.44Å; I102-D350 PolarHBondContact O-N 3.14Å; I102-I402 HydrophobicContact CG2-CD1 4.18Å
103	R	92.4	Very high	90.4	Very high	16 Å²	16	18.7 Å²	18.7	6%	0.06	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	111.8	177.5	-177.4	-179.3	175.7	-171.1	-1	109.3	L105 Y111 D350 R379	R103-L105 HydrophobicContact CG-CD2 4.17Å; R103-L105 PolarHBondContact O-N 3.39Å; R103-Y111 HydrophobicContact CB-CD1 4.22Å; R103-Y111 PolarHBondContact N-O 2.76Å; R103-Y111 PolarHBondContact O-N 2.85Å; R103-D350 HydrophobicContact CB-CB 4.24Å; R103-D350 HydrophobicContact CG-CB 4.07Å; R103-R379 VanDerWaalsContact NE-NH1 3.13Å
104	P	89.5	Confident	91.5	Very high	15 Å²	15	11.9 Å²	11.9	10%	0.097	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	129.7	163.8	-20.1	33.6	0	0	0	109.6	W325 F360 I402 W404	P104-W325 HydrophobicContact CB-CZ3 4.28Å; P104-F360 HydrophobicContact CB-CE1 4.28Å; P104-F360 HydrophobicContact CG-CE1 3.9Å; P104-F360 HydrophobicContact CG-CZ 3.94Å; P104-I402 HydrophobicContact CG-CD1 4.24Å; P104-W404 HydrophobicContact CB-CH2 3.79Å; P104-W404 HydrophobicContact CB-CZ2 3.66Å
105	L	87.8	Confident	92	Very high	2 Å²	2	11.1 Å²	11.1	1%	0.01	6%	0.06	C	C	.	.			trans	-100.1	153	-179.8	-58.9	177.9	0	0	0	110.9	R103 S107 G108 D109 W166 V312	R103-L105 HydrophobicContact CG-CD2 4.17Å; R103-L105 PolarHBondContact O-N 3.39Å; L105-S107 PolarHBondContact O-N 3.24Å; L105-G108 WeakPolarHBondContact O-CA 3.34Å; L105-G108 PolarHBondContact O-N 2.86Å; L105-D109 HydrophobicContact CB-CB 4.38Å; L105-D109 WeakPolarHBondContact CB-O 3.41Å; L105-D109 HydrophobicContact CD1-CB 3.96Å; L105-D109 PolarHBondContact N-O 3.23Å; L105-W166 HydrophobicContact CD1-CB 3.78Å; L105-W166 VanDerWaalsContact CD1-CD1 3.48Å; L105-W166 HydrophobicContact CD1-CG 3.72Å; L105-W166 WeakPolarHBondContact CD2-O 2.93Å; L105-V312 HydrophobicContact CD1-CG1 4.24Å
106	H	80	Confident	92.2	Very high	57 Å²	57	9.1 Å²	9.1	26%	0.264	5%	0.05	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-28.5	178.2	-55.6	92.4	0	0	0	113.1	G108 D353 D410	H106-G108 PolarHBondContact O-N 3.37Å; H106-G108 VanDerWaalsContact O-N 3.1Å; H106-D353 IonicContact NE2-OD2 3.32Å; H106-D410 PolarHBondContact CD2-O 3.47Å; H106-D410 VanDerWaalsContact CD2-O 3.25Å
107	S	78.4	Confident	92.3	Very high	44 Å²	44	10.2 Å²	10.2	31%	0.308	5%	0.054	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-12.4	172.6	58.2	0	0	0	0	113	L105 D109	L105-S107 PolarHBondContact O-N 3.24Å; S107-D109 VanDerWaalsContact C-N 3.28Å; S107-D109 WeakPolarHBondContact OG-CB 3.27Å; S107-D109 PolarHBondContact OG-N 2.99Å; S107-D109 PolarHBondContact OG-OD2 2.95Å
108	G	80.1	Confident	92.3	Very high	8 Å²	8	9.3 Å²	9.3	8%	0.082	5%	0.05	C	C	.	.	S	Bend	trans	83.5	1.4	-165.9	0	0	0	0	0	112.1	L105 H106 L315 W325	L105-G108 WeakPolarHBondContact O-CA 3.34Å; L105-G108 PolarHBondContact O-N 2.86Å; H106-G108 PolarHBondContact O-N 3.37Å; H106-G108 VanDerWaalsContact O-N 3.1Å; G108-L315 WeakPolarHBondContact O-CB 3.44Å; G108-L315 WeakPolarHBondContact O-CD1 3.1Å; G108-W325 VanDerWaalsContact O-CH2 3.23Å; G108-W325 WeakPolarHBondContact O-CH2 3.28Å; G108-W325 WeakPolarHBondContact O-CZ2 3.36Å
109	D	87.7	Confident	92.1	Very high	12 Å²	12	10.1 Å²	10.1	6%	0.064	6%	0.056	C	C	.	.			trans	-76	167.5	171.7	-60.7	-41.9	0	0	0	111.4	L105 S107 W166 V312 D314	L105-D109 HydrophobicContact CB-CB 4.38Å; L105-D109 WeakPolarHBondContact CB-O 3.41Å; L105-D109 HydrophobicContact CD1-CB 3.96Å; L105-D109 PolarHBondContact N-O 3.23Å; S107-D109 VanDerWaalsContact C-N 3.28Å; S107-D109 WeakPolarHBondContact OG-CB 3.27Å; S107-D109 PolarHBondContact OG-N 2.99Å; S107-D109 PolarHBondContact OG-OD2 2.95Å; D109-W166 PolarHBondContact OD2-NE1 3.43Å; D109-V312 HydrophobicContact CB-CG1 3.85Å; D109-D314 WeakPolarHBondContact OD1-CA 3.46Å
110	I	90.8	Very high	91.7	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	127.8	168.9	-57.2	168.1	0	0	0	110.3	I102 V312 F313 W325 M330	I102-I110 HydrophobicContact CG2-CG2 3.62Å; I110-V312 WeakPolarHBondContact O-CA 3.36Å; I110-F313 PolarHBondContact N-O 2.87Å; I110-F313 VanDerWaalsContact N-O 3.09Å; I110-F313 PolarHBondContact O-N 2.78Å; I110-W325 HydrophobicContact CD1-CB 3.41Å; I110-W325 VanDerWaalsContact CD1-CB 3.41Å; I110-W325 VanDerWaalsContact CD1-CD1 3.48Å; I110-W325 HydrophobicContact CD1-CD2 3.03Å; I110-W325 HydrophobicContact CD1-CE3 3.36Å; I110-W325 HydrophobicContact CD1-CG 3.06Å; I110-W325 HydrophobicContact CD1-CH2 4.1Å; I110-W325 HydrophobicContact CD1-CZ2 3.89Å; I110-W325 HydrophobicContact CD1-CZ3 3.85Å; I110-W325 HydrophobicContact CG1-CD2 3.47Å; I110-W325 VanDerWaalsContact CG1-CD2 3.47Å; I110-W325 VanDerWaalsContact CG1-CE2 3.46Å; I110-W325 HydrophobicContact CG1-CE3 3.44Å; I110-W325 VanDerWaalsContact CG1-CE3 3.44Å; I110-W325 HydrophobicContact CG1-CG 4.04Å; I110-W325 HydrophobicContact CG1-CH2 3.33Å; I110-W325 HydrophobicContact CG1-CZ2 3.41Å; I110-W325 VanDerWaalsContact CG1-CZ2 3.41Å; I110-W325 HydrophobicContact CG1-CZ3 3.33Å; I110-M330 HydrophobicContact CB-SD 4.46Å; I110-M330 HydrophobicContact CD1-CE 4.42Å; I110-M330 HydrophobicContact CD1-CG 4.31Å; I110-M330 HydrophobicContact CD1-SD 3.62Å; I110-M330 HydrophobicContact CG2-SD 4.04Å
111	Y	94.4	Very high	91.1	Very high	1 Å²	1	12.3 Å²	12.3	0%	0.004	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	123.6	166.4	174.9	-138.8	0	0	0	111	I102 R103 S113 W161 Y170 N310 V311 V312	I102-Y111 CarbonylContact C-O 3.54Å; I102-Y111 WeakPolarHBondContact CA-O 3.3Å; R103-Y111 HydrophobicContact CB-CD1 4.22Å; R103-Y111 PolarHBondContact N-O 2.76Å; R103-Y111 PolarHBondContact O-N 2.85Å; Y111-S113 WeakPolarHBondContact OH-CB 3.36Å; Y111-W161 HydrophobicContact CD1-CH2 4.11Å; Y111-W161 AromaticContact CD2-CH2 3.78Å; Y111-W161 HydrophobicContact CD2-CH2 3.78Å; Y111-W161 HydrophobicContact CD2-CZ3 4.02Å; Y111-W161 HydrophobicContact CE1-CH2 4.11Å; Y111-W161 AromaticContact CE2-CH2 3.81Å; Y111-W161 HydrophobicContact CE2-CH2 3.81Å; Y111-W161 AromaticContact CE2-CZ3 3.88Å; Y111-W161 HydrophobicContact CE2-CZ3 3.88Å; Y111-W161 AromaticContact CG-CH2 3.95Å; Y111-W161 HydrophobicContact CG-CH2 3.95Å; Y111-W161 AromaticContact CZ-CH2 3.97Å; Y111-Y170 HydrophobicContact CD1-CD2 4.4Å; Y111-Y170 HydrophobicContact CD1-CE2 4.12Å; Y111-Y170 AromaticContact CE1-CD2 3.42Å; Y111-Y170 HydrophobicContact CE1-CD2 3.42Å; Y111-Y170 VanDerWaalsContact CE1-CD2 3.42Å; Y111-Y170 AromaticContact CE1-CE2 3.56Å; Y111-Y170 HydrophobicContact CE1-CE2 3.56Å; Y111-Y170 HydrophobicContact CE1-CG 4.28Å; Y111-Y170 AromaticContact CZ-CD2 3.97Å; Y111-N310 HydrophobicContact CE2-CB 3.97Å; Y111-N310 PolarHBondContact OH-OD1 2.88Å; Y111-V311 WeakPolarHBondContact CD2-O 3.19Å; Y111-V312 HydrophobicContact CD2-CG2 4.08Å
112	A	95.7	Very high	90.2	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.2	171.7	0	0	0	0	0	109.8	L100 V101 F114 N310 V311 F313 F331	L100-A112 HydrophobicContact CD1-CB 4.2Å; V101-A112 WeakPolarHBondContact O-CA 3.46Å; A112-F114 HydrophobicContact CB-CE2 4.44Å; A112-N310 WeakPolarHBondContact O-CA 3.39Å; A112-V311 PolarHBondContact N-O 2.92Å; A112-V311 PolarHBondContact O-N 2.95Å; A112-F313 HydrophobicContact CB-CE2 4.49Å; A112-F331 HydrophobicContact CB-CZ 3.99Å
113	S	96.9	Very high	89	Confident	0 Å²	0	16 Å²	16	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	115.4	176.2	-175	0	0	0	0	110.1	L100 V101 Y111 Q115 L309 N310	L100-S113 WeakPolarHBondContact CA-O 2.93Å; V101-S113 PolarHBondContact N-O 3.1Å; V101-S113 PolarHBondContact O-N 3.47Å; Y111-S113 WeakPolarHBondContact OH-CB 3.36Å; S113-Q115 PolarHBondContact OG-NE2 2.91Å; S113-Q115 VanDerWaalsContact OG-NE2 3.07Å; S113-L309 WeakPolarHBondContact CA-O 3.29Å; S113-N310 VanDerWaalsContact CB-OD1 3.29Å; S113-N310 WeakPolarHBondContact CB-OD1 3.18Å; S113-N310 PolarHBondContact OG-OD1 3.12Å
114	F	97.2	Very high	87.6	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	135	172.5	-63.7	-99.2	0	0	0	109.2	E99 L100 A112 F116 L268 L271 L272 T308 L309 F331	E99-F114 WeakPolarHBondContact O-CA 3.23Å; L100-F114 HydrophobicContact CB-CD1 4.18Å; L100-F114 HydrophobicContact CB-CE1 4.27Å; L100-F114 HydrophobicContact CD1-CD1 3.92Å; L100-F114 HydrophobicContact CD1-CD2 3.92Å; L100-F114 HydrophobicContact CD1-CE1 3.79Å; L100-F114 HydrophobicContact CD1-CE2 3.77Å; L100-F114 HydrophobicContact CD1-CG 3.99Å; L100-F114 HydrophobicContact CD1-CZ 3.7Å; L100-F114 HydrophobicContact CD2-CE1 3.85Å; L100-F114 HydrophobicContact CD2-CZ 4.01Å; L100-F114 HydrophobicContact CG-CD1 4.44Å; L100-F114 HydrophobicContact CG-CE1 4.18Å; L100-F114 HydrophobicContact CG-CZ 4.42Å; A112-F114 HydrophobicContact CB-CE2 4.44Å; F114-F116 HydrophobicContact CB-CE2 3.82Å; F114-F116 HydrophobicContact CB-CZ 4.37Å; F114-F116 HydrophobicContact CD1-CZ 4.32Å; F114-L268 HydrophobicContact CD1-CB 4.26Å; F114-L268 HydrophobicContact CE1-CB 4.39Å; F114-L271 HydrophobicContact CE1-CB 4.24Å; F114-L271 HydrophobicContact CE1-CD1 4.12Å; F114-L271 HydrophobicContact CZ-CB 4.17Å; F114-L271 HydrophobicContact CZ-CD1 4.27Å; F114-L272 HydrophobicContact CD1-CD2 4.07Å; F114-L272 HydrophobicContact CD2-CD2 3.95Å; F114-L272 HydrophobicContact CE1-CD2 3.93Å; F114-L272 HydrophobicContact CE2-CD2 3.83Å; F114-L272 HydrophobicContact CG-CD2 4.07Å; F114-L272 HydrophobicContact CZ-CD2 3.82Å; F114-T308 VanDerWaalsContact O-CA 3.3Å; F114-T308 WeakPolarHBondContact O-CA 3.23Å; F114-L309 HydrophobicContact CB-CB 4.21Å; F114-L309 HydrophobicContact CD2-CD2 3.63Å; F114-L309 HydrophobicContact CE2-CD2 4.08Å; F114-L309 HydrophobicContact CG-CD2 4.49Å; F114-L309 PolarHBondContact N-O 3Å; F114-L309 PolarHBondContact O-N 2.99Å; F114-F331 AromaticContact CE2-CE1 3.75Å; F114-F331 HydrophobicContact CE2-CE1 3.75Å; F114-F331 AromaticContact CE2-CZ 3.67Å; F114-F331 HydrophobicContact CE2-CZ 3.67Å; F114-F331 HydrophobicContact CZ-CD1 4.46Å; F114-F331 AromaticContact CZ-CE1 3.76Å; F114-F331 HydrophobicContact CZ-CE1 3.76Å; F114-F331 HydrophobicContact CZ-CE2 4.19Å; F114-F331 AromaticContact CZ-CZ 3.6Å; F114-F331 HydrophobicContact CZ-CZ 3.6Å
115	Q	96.7	Very high	86.2	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.005	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	127.7	174.4	-53.1	-74.9	-28.2	0	0	109.1	E99 S113 L555 F556	E99-Q115 HydrophobicContact CG-CB 3.59Å; E99-Q115 HydrophobicContact CG-CG 4.19Å; E99-Q115 PolarHBondContact N-O 3.12Å; E99-Q115 PolarHBondContact O-N 2.99Å; E99-Q115 WeakPolarHBondContact OE1-CG 3.44Å; S113-Q115 PolarHBondContact OG-NE2 2.91Å; S113-Q115 VanDerWaalsContact OG-NE2 3.07Å; Q115-L555 HydrophobicContact CB-CB 4.28Å; Q115-F556 HydrophobicContact CG-CB 4.18Å
116	F	97	Very high	84.9	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.009	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	127.7	174.4	-56.1	-86.5	0	0	0	108.5	F96 Q97 E98 F114 W256 L260 L268 A269 L272 R306 Q307	F96-F116 HydrophobicContact CE2-CB 4.1Å; F96-F116 HydrophobicContact CE2-CD1 4.35Å; F96-F116 HydrophobicContact CZ-CB 4.44Å; F96-F116 AromaticContact CZ-CD1 3.85Å; F96-F116 HydrophobicContact CZ-CD1 3.85Å; Q97-F116 WeakPolarHBondContact O-CA 3.19Å; E98-F116 HydrophobicContact CB-CD1 3.55Å; E98-F116 HydrophobicContact CB-CE1 3.73Å; F114-F116 HydrophobicContact CB-CE2 3.82Å; F114-F116 HydrophobicContact CB-CZ 4.37Å; F114-F116 HydrophobicContact CD1-CZ 4.32Å; F116-W256 AromaticContact CD2-CH2 3.79Å; F116-W256 HydrophobicContact CD2-CH2 3.79Å; F116-W256 AromaticContact CE2-CH2 3.75Å; F116-W256 HydrophobicContact CE2-CH2 3.75Å; F116-W256 HydrophobicContact CE2-CZ3 4.3Å; F116-L260 HydrophobicContact CB-CD2 3.59Å; F116-L260 HydrophobicContact CD1-CD1 4.47Å; F116-L260 HydrophobicContact CD1-CD2 3.84Å; F116-L260 HydrophobicContact CD2-CD1 4.39Å; F116-L260 HydrophobicContact CD2-CD2 3.9Å; F116-L260 HydrophobicContact CE1-CD1 4.33Å; F116-L260 HydrophobicContact CE1-CD2 4.49Å; F116-L260 HydrophobicContact CE2-CD1 4.26Å; F116-L260 HydrophobicContact CG-CD1 4.5Å; F116-L260 HydrophobicContact CG-CD2 3.5Å; F116-L260 VanDerWaalsContact CG-CD2 3.5Å; F116-L260 HydrophobicContact CZ-CD1 4.22Å; F116-L268 HydrophobicContact CE1-CB 4.06Å; F116-L268 HydrophobicContact CZ-CB 4.12Å; F116-A269 HydrophobicContact CE1-CB 4.49Å; F116-A269 HydrophobicContact CZ-CB 4.35Å; F116-L272 HydrophobicContact CE2-CD1 4.3Å; F116-L272 HydrophobicContact CZ-CD1 4.37Å; F116-R306 WeakPolarHBondContact O-CA 3.46Å; F116-Q307 HydrophobicContact CB-CB 4.24Å; F116-Q307 PolarHBondContact N-O 3.33Å; F116-Q307 PolarHBondContact O-N 3.19Å
117	R	95.7	Very high	83.8	Confident	26 Å²	26	31.5 Å²	31.5	10%	0.098	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.2	175.8	-177.6	168.3	57.3	-173.9	5.1	109.7	F96 Q97 V119 E304 L305 L555	F96-R117 CarbonylContact C-O 3.53Å; F96-R117 VanDerWaalsContact CA-O 3.3Å; F96-R117 WeakPolarHBondContact CA-O 3.33Å; F96-R117 VanDerWaalsContact CD2-O 3.31Å; F96-R117 WeakPolarHBondContact CD2-O 3.34Å; Q97-R117 HydrophobicContact CB-CB 4.4Å; Q97-R117 VanDerWaalsContact CD-NH2 3.32Å; Q97-R117 PolarHBondContact N-O 3.1Å; Q97-R117 PolarHBondContact O-N 2.91Å; Q97-R117 VanDerWaalsContact OE1-CZ 3.31Å; R117-V119 HydrophobicContact CG-CG2 3.95Å; R117-E304 WeakPolarHBondContact CD-OE1 3.28Å; R117-E304 HydrophobicContact CG-CG 3.93Å; R117-L305 WeakPolarHBondContact CA-O 3.43Å; R117-L555 HydrophobicContact CB-CD1 4.15Å; R117-L555 HydrophobicContact CB-CD2 4.26Å
118	T	95.4	Very high	82.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	116.2	165.5	-52.9	0	0	0	0	108.2	E95 F96 L135 L305	E95-T118 WeakPolarHBondContact O-CA 3.41Å; F96-T118 VanDerWaalsContact CD2-OG1 3.32Å; F96-T118 WeakPolarHBondContact CD2-OG1 3.48Å; T118-L135 HydrophobicContact CG2-CB 3.95Å; T118-L305 PolarHBondContact N-O 3.04Å; T118-L305 PolarHBondContact O-N 2.83Å
119	V	92.6	Very high	81.7	Confident	20 Å²	20	42.2 Å²	42.2	12%	0.121	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	126	171.7	-178.3	0	0	0	0	108.3	D94 E95 R117	D94-V119 WeakPolarHBondContact CA-O 3.25Å; E95-V119 HydrophobicContact CB-CB 4.48Å; E95-V119 PolarHBondContact N-O 2.8Å; E95-V119 PolarHBondContact O-N 3.42Å; R117-V119 HydrophobicContact CG-CG2 3.95Å
120	W	90.1	Very high	80.5	Confident	13 Å²	13	43.9 Å²	43.9	5%	0.049	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	116.2	177.9	-174.2	36.8	0	0	0	110	T122 V130 Y133 F136 S302 L303	W120-T122 HydrophobicContact CD2-CG2 3.71Å; W120-T122 HydrophobicContact CE3-CG2 3.47Å; W120-T122 VanDerWaalsContact CE3-CG2 3.47Å; W120-T122 HydrophobicContact CG-CG2 4.41Å; W120-T122 HydrophobicContact CH2-CG2 4.06Å; W120-T122 HydrophobicContact CZ2-CG2 4.32Å; W120-T122 HydrophobicContact CZ3-CG2 3.64Å; W120-T122 PolarHBondContact O-N 3.17Å; W120-T122 VanDerWaalsContact O-N 3.08Å; W120-V130 HydrophobicContact CH2-CB 4Å; W120-V130 HydrophobicContact CH2-CG1 3.76Å; W120-V130 HydrophobicContact CH2-CG2 3.86Å; W120-V130 HydrophobicContact CZ2-CB 4.1Å; W120-V130 HydrophobicContact CZ2-CG1 3.34Å; W120-V130 HydrophobicContact CZ2-CG2 4.26Å; W120-Y133 AromaticContact CH2-CD1 3.35Å; W120-Y133 HydrophobicContact CH2-CD1 3.35Å; W120-Y133 AromaticContact CH2-CE1 3.22Å; W120-Y133 HydrophobicContact CH2-CE1 3.22Å; W120-Y133 HydrophobicContact CH2-CG 4.43Å; W120-Y133 AromaticContact CZ2-CD1 3.38Å; W120-Y133 HydrophobicContact CZ2-CD1 3.38Å; W120-Y133 AromaticContact CZ2-CE1 3.72Å; W120-Y133 HydrophobicContact CZ2-CE1 3.72Å; W120-Y133 HydrophobicContact CZ2-CG 4.11Å; W120-Y133 HydrophobicContact CZ3-CD1 4.03Å; W120-Y133 AromaticContact CZ3-CE1 3.93Å; W120-Y133 HydrophobicContact CZ3-CE1 3.93Å; W120-F136 HydrophobicContact CB-CB 3.97Å; W120-F136 HydrophobicContact CB-CD2 3.65Å; W120-F136 HydrophobicContact CB-CE2 4.44Å; W120-F136 HydrophobicContact CB-CG 4.05Å; W120-F136 HydrophobicContact CD2-CB 3.96Å; W120-F136 HydrophobicContact CD2-CD1 4.49Å; W120-F136 HydrophobicContact CD2-CD2 4.38Å; W120-F136 HydrophobicContact CD2-CG 4.04Å; W120-F136 HydrophobicContact CE3-CB 4.38Å; W120-F136 HydrophobicContact CE3-CD1 4.07Å; W120-F136 HydrophobicContact CE3-CD2 4.24Å; W120-F136 HydrophobicContact CE3-CE1 4.43Å; W120-F136 AromaticContact CE3-CG 3.97Å; W120-F136 HydrophobicContact CE3-CG 3.97Å; W120-F136 HydrophobicContact CG-CB 3.78Å; W120-F136 HydrophobicContact CG-CD2 4.2Å; W120-F136 HydrophobicContact CG-CG 4.11Å; W120-F136 HydrophobicContact CZ3-CD1 4.43Å; W120-S302 WeakPolarHBondContact O-CB 3.38Å; W120-L303 HydrophobicContact CE3-CB 4.48Å; W120-L303 HydrophobicContact CE3-CD2 4.17Å; W120-L303 PolarHBondContact N-O 3.17Å; W120-L303 PolarHBondContact O-N 3.22Å
121	E	84.3	Confident	79.1	Confident	39 Å²	39	48.5 Å²	48.5	18%	0.182	27%	0.265	C	S	.	.			trans	-79.3	92	-178.9	-64.4	-170.8	156.6	0	0	109.8	L92 K93 D94 Q294	L92-E121 WeakPolarHBondContact CA-OE2 3.24Å; L92-E121 HydrophobicContact CD2-CB 4.44Å; K93-E121 PolarHBondContact N-OE2 3.17Å; D94-E121 PolarHBondContact OD1-N 2.79Å; E121-Q294 PolarHBondContact OE1-NE2 3.33Å; E121-Q294 PolarHBondContact OE2-NE2 3.09Å
122	T	76.2	Confident	78.3	Confident	21 Å²	21	55.7 Å²	55.7	13%	0.129	30%	0.299	C	S	.	.			trans	-146.9	137.7	175.1	-165.4	0	0	0	0	111.4	W120 F124	W120-T122 HydrophobicContact CD2-CG2 3.71Å; W120-T122 HydrophobicContact CE3-CG2 3.47Å; W120-T122 VanDerWaalsContact CE3-CG2 3.47Å; W120-T122 HydrophobicContact CG-CG2 4.41Å; W120-T122 HydrophobicContact CH2-CG2 4.06Å; W120-T122 HydrophobicContact CZ2-CG2 4.32Å; W120-T122 HydrophobicContact CZ3-CG2 3.64Å; W120-T122 PolarHBondContact O-N 3.17Å; W120-T122 VanDerWaalsContact O-N 3.08Å; T122-F124 HydrophobicContact CG2-CB 4.38Å; T122-F124 PolarHBondContact O-N 3.45Å
123	D	69.4	Low	77.7	Confident	60 Å²	60	57.3 Å²	57.3	32%	0.321	31%	0.305	S	S	.	.			trans	-75.2	76.7	170.8	-80.7	-22.4	0	0	0	109.7	T125 R126	D123-T125 PolarHBondContact O-N 3.44Å; D123-R126 PolarHBondContact O-N 3.49Å
124	F	64.8	Low	77.3	Confident	37 Å²	37	65.2 Å²	65.2	16%	0.162	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-59	-22.1	-177.8	-175.6	-109.8	0	0	0	113.3	T122 I144 V149	T122-F124 HydrophobicContact CG2-CB 4.38Å; T122-F124 PolarHBondContact O-N 3.45Å; F124-I144 HydrophobicContact CE1-CG2 4.04Å; F124-I144 HydrophobicContact CE2-CG2 3.61Å; F124-I144 HydrophobicContact CZ-CB 4.5Å; F124-I144 HydrophobicContact CZ-CG2 3.36Å; F124-V149 WeakPolarHBondContact CE1-O 3.42Å; F124-V149 WeakPolarHBondContact CZ-O 3Å
125	T	60.1	Low	77	Confident	103 Å²	103	66.2 Å²	66.2	63%	0.632	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-76.2	-17.5	-178.8	55.4	0	0	0	0	114.5	D123	D123-T125 PolarHBondContact O-N 3.44Å
126	R	60	Low	76.9	Confident	203 Å²	203	66.4 Å²	66.4	77%	0.766	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-98.4	6.7	-173.9	-75.5	-173.2	-178.8	-179.1	3.4	115.1	D123 S128	D123-R126 PolarHBondContact O-N 3.49Å; R126-S128 PolarHBondContact O-N 3.27Å
127	G	55.7	Low	76.7	Confident	72 Å²	72	67 Å²	67	74%	0.742	35%	0.345	S	S	*	.			trans	60.5	20.1	172.3	0	0	0	0	0	114.9	K129	G127-K129 PolarHBondContact O-N 3.44Å
128	S	56.6	Low	76.5	Confident	69 Å²	69	71.7 Å²	71.7	48%	0.483	37%	0.366	S	S	.	.			trans	-70.4	131.5	176.9	56.5	0	0	0	0	109.6	R126 V130	R126-S128 PolarHBondContact O-N 3.27Å; S128-V130 WeakPolarHBondContact O-CG2 3.39Å; S128-V130 PolarHBondContact O-N 3.45Å
129	K	57.6	Low	76.4	Confident	208 Å²	208	74.1 Å²	74.1	90%	0.904	38%	0.383	S	S	*	.			trans	-62.7	107.2	174.7	-74.3	-177.6	178.6	177.8	0	108.5	G127 S131	G127-K129 PolarHBondContact O-N 3.44Å; K129-S131 PolarHBondContact O-N 3.27Å
130	V	63.1	Low	76.5	Confident	47 Å²	47	73.2 Å²	73.2	29%	0.285	38%	0.377	S	S	.	.			trans	-74.8	122.3	-178.1	-167	0	0	0	0	110.2	W120 S128	W120-V130 HydrophobicContact CH2-CB 4Å; W120-V130 HydrophobicContact CH2-CG1 3.76Å; W120-V130 HydrophobicContact CH2-CG2 3.86Å; W120-V130 HydrophobicContact CZ2-CB 4.1Å; W120-V130 HydrophobicContact CZ2-CG1 3.34Å; W120-V130 HydrophobicContact CZ2-CG2 4.26Å; S128-V130 WeakPolarHBondContact O-CG2 3.39Å; S128-V130 PolarHBondContact O-N 3.45Å
131	S	60.9	Low	76.5	Confident	97 Å²	97	72.7 Å²	72.7	68%	0.678	38%	0.376	S	S	*	.			trans	-84.1	-30.6	-178.2	51.8	0	0	0	0	113.2	K129	K129-S131 PolarHBondContact O-N 3.27Å
132	H	78.1	Confident	76.8	Confident	152 Å²	152	75.7 Å²	75.7	70%	0.704	39%	0.39	S	S	*	.			trans	-139.1	132.6	-174.7	-61.5	-68.9	0	0	0	112.8
133	Y	83.4	Confident	77.6	Confident	34 Å²	34	75.2 Å²	75.2	13%	0.133	39%	0.387	C	S	.	.			trans	-101.3	-10.9	-179.1	-65.8	-91.3	0	0	0	113.8	W120 L135 F136 K138	W120-Y133 AromaticContact CH2-CD1 3.35Å; W120-Y133 HydrophobicContact CH2-CD1 3.35Å; W120-Y133 AromaticContact CH2-CE1 3.22Å; W120-Y133 HydrophobicContact CH2-CE1 3.22Å; W120-Y133 HydrophobicContact CH2-CG 4.43Å; W120-Y133 AromaticContact CZ2-CD1 3.38Å; W120-Y133 HydrophobicContact CZ2-CD1 3.38Å; W120-Y133 AromaticContact CZ2-CE1 3.72Å; W120-Y133 HydrophobicContact CZ2-CE1 3.72Å; W120-Y133 HydrophobicContact CZ2-CG 4.11Å; W120-Y133 HydrophobicContact CZ3-CD1 4.03Å; W120-Y133 AromaticContact CZ3-CE1 3.93Å; W120-Y133 HydrophobicContact CZ3-CE1 3.93Å; Y133-L135 PolarHBondContact O-N 3.26Å; Y133-F136 VanDerWaalsContact CB-O 3.27Å; Y133-F136 WeakPolarHBondContact CB-O 3.36Å; Y133-F136 HydrophobicContact CD1-CD1 4.23Å; Y133-F136 WeakPolarHBondContact O-CB 3.44Å; Y133-F136 PolarHBondContact O-N 3.34Å; Y133-K138 HydrophobicContact CD2-CB 3.93Å; Y133-K138 HydrophobicContact CD2-CD 4.48Å; Y133-K138 HydrophobicContact CD2-CG 3.86Å; Y133-K138 HydrophobicContact CE2-CB 4.38Å; Y133-K138 HydrophobicContact CE2-CG 3.87Å; Y133-K138 HydrophobicContact CG-CB 4.2Å
134	R	88.1	Confident	78.7	Confident	166 Å²	166	72.5 Å²	72.5	63%	0.626	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	40.6	-91.6	-179.4	-178.1	-171.6	160.4	-176	-9.5	114	L92 D94	L92-R134 PolarHBondContact O-NH1 3.18Å; D94-R134 WeakPolarHBondContact OD2-CB 3.48Å; D94-R134 WeakPolarHBondContact OD2-CD 3.34Å
135	L	91.9	Very high	79.9	Confident	20 Å²	20	74 Å²	74	11%	0.105	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-24.4	179.2	-62.2	-175.8	0	0	0	113.6	D94 F96 T118 Y133 P261 L341	D94-L135 HydrophobicContact CB-CB 4.24Å; D94-L135 HydrophobicContact CB-CD1 3.86Å; D94-L135 HydrophobicContact CB-CG 4.03Å; F96-L135 HydrophobicContact CB-CD1 3.95Å; T118-L135 HydrophobicContact CG2-CB 3.95Å; Y133-L135 PolarHBondContact O-N 3.26Å; L135-P261 HydrophobicContact CB-CG 4.39Å; L135-P261 HydrophobicContact CD2-CB 4.25Å; L135-L341 HydrophobicContact CD2-CB 4.32Å; L135-L341 HydrophobicContact CD2-CD1 4.15Å
136	F	93.3	Very high	81.4	Confident	6 Å²	6	76.3 Å²	76.3	3%	0.026	39%	0.389	C	S	.	.	S	Bend	trans	-74.9	139.4	-179.3	-162.4	-88.2	0	0	0	111.1	W120 Y133 K138 L140 I144 L303 L305	W120-F136 HydrophobicContact CB-CB 3.97Å; W120-F136 HydrophobicContact CB-CD2 3.65Å; W120-F136 HydrophobicContact CB-CE2 4.44Å; W120-F136 HydrophobicContact CB-CG 4.05Å; W120-F136 HydrophobicContact CD2-CB 3.96Å; W120-F136 HydrophobicContact CD2-CD1 4.49Å; W120-F136 HydrophobicContact CD2-CD2 4.38Å; W120-F136 HydrophobicContact CD2-CG 4.04Å; W120-F136 HydrophobicContact CE3-CB 4.38Å; W120-F136 HydrophobicContact CE3-CD1 4.07Å; W120-F136 HydrophobicContact CE3-CD2 4.24Å; W120-F136 HydrophobicContact CE3-CE1 4.43Å; W120-F136 AromaticContact CE3-CG 3.97Å; W120-F136 HydrophobicContact CE3-CG 3.97Å; W120-F136 HydrophobicContact CG-CB 3.78Å; W120-F136 HydrophobicContact CG-CD2 4.2Å; W120-F136 HydrophobicContact CG-CG 4.11Å; W120-F136 HydrophobicContact CZ3-CD1 4.43Å; Y133-F136 VanDerWaalsContact CB-O 3.27Å; Y133-F136 WeakPolarHBondContact CB-O 3.36Å; Y133-F136 HydrophobicContact CD1-CD1 4.23Å; Y133-F136 WeakPolarHBondContact O-CB 3.44Å; Y133-F136 PolarHBondContact O-N 3.34Å; F136-K138 PolarHBondContact O-N 2.73Å; F136-L140 HydrophobicContact CE1-CB 4.12Å; F136-I144 HydrophobicContact CE1-CD1 4.1Å; F136-I144 HydrophobicContact CZ-CD1 3.91Å; F136-L303 HydrophobicContact CE2-CD2 3.95Å; F136-L303 HydrophobicContact CE2-CG 4.4Å; F136-L303 HydrophobicContact CZ-CD2 3.73Å; F136-L305 HydrophobicContact CD2-CB 4.11Å; F136-L305 HydrophobicContact CE2-CB 3.5Å; F136-L305 VanDerWaalsContact CE2-CB 3.5Å; F136-L305 HydrophobicContact CE2-CD2 4.28Å; F136-L305 HydrophobicContact CE2-CG 4.47Å; F136-L305 HydrophobicContact CZ-CB 4.21Å
137	P	94.2	Very high	83	Confident	15 Å²	15	67.1 Å²	67.1	10%	0.097	35%	0.354	C	S	.	.			trans	-69.2	117.8	178.9	26.2	-34	0	0	0	111.7	S139 L140 G141 L259 L305	P137-S139 PolarHBondContact O-N 2.96Å; P137-L140 HydrophobicContact CG-CB 4.22Å; P137-L140 HydrophobicContact CG-CD1 3.93Å; P137-L140 HydrophobicContact CG-CG 4.26Å; P137-L140 PolarHBondContact O-N 2.86Å; P137-L140 VanDerWaalsContact O-N 3.16Å; P137-G141 PolarHBondContact O-N 3.22Å; P137-L259 HydrophobicContact CB-CB 4.29Å; P137-L259 HydrophobicContact CB-CD2 3.6Å; P137-L259 HydrophobicContact CG-CB 4.2Å; P137-L259 HydrophobicContact CG-CD2 3.9Å; P137-L305 VanDerWaalsContact CD-CD2 3.43Å; P137-L305 HydrophobicContact CG-CD2 3.47Å; P137-L305 VanDerWaalsContact CG-CD2 3.47Å
138	K	91.7	Very high	84.8	Confident	124 Å²	124	65.3 Å²	65.3	54%	0.539	33%	0.33	S	S	.	.	H	α-helix	trans	-51.8	-39.1	178.8	177.4	178.1	176.2	-178.5	0	113.2	Y133 F136 L140 G141 Q142	Y133-K138 HydrophobicContact CD2-CB 3.93Å; Y133-K138 HydrophobicContact CD2-CD 4.48Å; Y133-K138 HydrophobicContact CD2-CG 3.86Å; Y133-K138 HydrophobicContact CE2-CB 4.38Å; Y133-K138 HydrophobicContact CE2-CG 3.87Å; Y133-K138 HydrophobicContact CG-CB 4.2Å; F136-K138 PolarHBondContact O-N 2.73Å; K138-L140 PolarHBondContact O-N 2.85Å; K138-G141 PolarHBondContact O-N 3.33Å; K138-Q142 HydrophobicContact CG-CG 4.15Å; K138-Q142 WeakPolarHBondContact O-CB 3.46Å; K138-Q142 VanDerWaalsContact O-CG 3.32Å; K138-Q142 WeakPolarHBondContact O-CG 3.44Å; K138-Q142 PolarHBondContact O-N 2.6Å
139	S	92.6	Very high	86.5	Confident	51 Å²	51	62 Å²	62	36%	0.357	31%	0.308	S	S	.	.	H	α-helix	trans	-58	-46.6	-179.4	48.9	0	0	0	0	112	P137 V143	P137-S139 PolarHBondContact O-N 2.96Å; S139-V143 WeakPolarHBondContact O-CG2 3.3Å; S139-V143 PolarHBondContact O-N 3.37Å
140	L	93.9	Very high	88.2	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-73	-41.2	176.8	-65.9	-178.6	0	0	0	111.3	F136 P137 K138 Q142 V143 I144 I204 F205 L259 V287 I289 L305	F136-L140 HydrophobicContact CE1-CB 4.12Å; P137-L140 HydrophobicContact CG-CB 4.22Å; P137-L140 HydrophobicContact CG-CD1 3.93Å; P137-L140 HydrophobicContact CG-CG 4.26Å; P137-L140 PolarHBondContact O-N 2.86Å; P137-L140 VanDerWaalsContact O-N 3.16Å; K138-L140 PolarHBondContact O-N 2.85Å; L140-Q142 VanDerWaalsContact C-N 3.28Å; L140-Q142 PolarHBondContact O-N 2.87Å; L140-V143 WeakPolarHBondContact O-CB 3.36Å; L140-V143 PolarHBondContact O-N 3.28Å; L140-V143 VanDerWaalsContact O-N 3.08Å; L140-I144 HydrophobicContact CB-CD1 4.18Å; L140-I144 WeakPolarHBondContact O-CB 3.25Å; L140-I144 WeakPolarHBondContact O-CD1 3.38Å; L140-I144 WeakPolarHBondContact O-CG1 3.45Å; L140-I144 PolarHBondContact O-N 2.65Å; L140-I204 HydrophobicContact CD2-CG2 4.44Å; L140-F205 HydrophobicContact CD2-CE2 4.43Å; L140-F205 HydrophobicContact CD2-CZ 4.33Å; L140-L259 HydrophobicContact CD1-CD1 3.75Å; L140-L259 HydrophobicContact CD1-CD2 3.84Å; L140-L259 HydrophobicContact CD1-CG 4.36Å; L140-L259 HydrophobicContact CG-CD2 3.9Å; L140-V287 HydrophobicContact CD1-CG1 4.15Å; L140-I289 HydrophobicContact CB-CD1 4.38Å; L140-I289 HydrophobicContact CD1-CD1 4.12Å; L140-L305 HydrophobicContact CD1-CD1 4.06Å; L140-L305 HydrophobicContact CD1-CD2 4.39Å
141	G	91.5	Very high	89.7	Confident	2 Å²	2	53 Å²	53	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-58.6	-40.4	-179.7	0	0	0	0	0	112.9	P137 K138 S145	P137-G141 PolarHBondContact O-N 3.22Å; K138-G141 PolarHBondContact O-N 3.33Å; G141-S145 WeakPolarHBondContact O-CB 3.33Å; G141-S145 PolarHBondContact O-N 3.18Å; G141-S145 VanDerWaalsContact O-N 3.09Å
142	Q	90.6	Very high	91.4	Very high	102 Å²	102	48.4 Å²	48.4	48%	0.477	23%	0.23	S	C	.	.	H	α-helix	trans	-66.9	-39.9	174.7	-72.7	-177.7	-40.7	0	0	112.9	K138 L140 K146	K138-Q142 HydrophobicContact CG-CG 4.15Å; K138-Q142 WeakPolarHBondContact O-CB 3.46Å; K138-Q142 VanDerWaalsContact O-CG 3.32Å; K138-Q142 WeakPolarHBondContact O-CG 3.44Å; K138-Q142 PolarHBondContact O-N 2.6Å; L140-Q142 VanDerWaalsContact C-N 3.28Å; L140-Q142 PolarHBondContact O-N 2.87Å; Q142-K146 WeakPolarHBondContact O-CB 3.05Å; Q142-K146 PolarHBondContact O-N 3.47Å
143	V	92.9	Very high	92.3	Very high	11 Å²	11	41.2 Å²	41.2	7%	0.067	20%	0.197	C	C	.	.	H	α-helix	trans	-63.2	-50.3	177.2	171.8	0	0	0	0	110.2	S139 L140 S145 K146 F147 L197 V200 L201 I204	S139-V143 WeakPolarHBondContact O-CG2 3.3Å; S139-V143 PolarHBondContact O-N 3.37Å; L140-V143 WeakPolarHBondContact O-CB 3.36Å; L140-V143 PolarHBondContact O-N 3.28Å; L140-V143 VanDerWaalsContact O-N 3.08Å; V143-S145 VanDerWaalsContact C-N 3.32Å; V143-S145 PolarHBondContact O-N 3.02Å; V143-K146 PolarHBondContact O-N 2.87Å; V143-F147 HydrophobicContact CG1-CD2 3.84Å; V143-F147 HydrophobicContact CG1-CE2 4.24Å; V143-F147 VanDerWaalsContact O-CD2 3.28Å; V143-F147 WeakPolarHBondContact O-CD2 3.37Å; V143-F147 PolarHBondContact O-N 3.39Å; V143-L197 HydrophobicContact CG1-CD1 3.43Å; V143-L197 VanDerWaalsContact CG1-CD1 3.43Å; V143-V200 HydrophobicContact CG2-CG1 3.86Å; V143-L201 HydrophobicContact CG1-CD2 4.3Å; V143-I204 HydrophobicContact CG2-CD1 3.47Å; V143-I204 VanDerWaalsContact CG2-CD1 3.47Å
144	I	92.3	Very high	92.9	Very high	3 Å²	3	39.7 Å²	39.7	2%	0.015	19%	0.191	C	C	.	.	H	α-helix	trans	-61.3	-43.6	-176.8	-63.2	153.8	0	0	0	110.5	F124 F136 L140 S148 V149 I289 L303	F124-I144 HydrophobicContact CE1-CG2 4.04Å; F124-I144 HydrophobicContact CE2-CG2 3.61Å; F124-I144 HydrophobicContact CZ-CB 4.5Å; F124-I144 HydrophobicContact CZ-CG2 3.36Å; F136-I144 HydrophobicContact CE1-CD1 4.1Å; F136-I144 HydrophobicContact CZ-CD1 3.91Å; L140-I144 HydrophobicContact CB-CD1 4.18Å; L140-I144 WeakPolarHBondContact O-CB 3.25Å; L140-I144 WeakPolarHBondContact O-CD1 3.38Å; L140-I144 WeakPolarHBondContact O-CG1 3.45Å; L140-I144 PolarHBondContact O-N 2.65Å; I144-S148 PolarHBondContact O-N 2.96Å; I144-V149 HydrophobicContact CG2-CB 4.29Å; I144-V149 WeakPolarHBondContact CG2-O 3.35Å; I144-V149 PolarHBondContact O-N 3.1Å; I144-I289 HydrophobicContact CD1-CD1 3.43Å; I144-I289 VanDerWaalsContact CD1-CD1 3.43Å; I144-I289 HydrophobicContact CD1-CG2 3.98Å; I144-I289 HydrophobicContact CG1-CD1 4.12Å; I144-L303 HydrophobicContact CD1-CD2 4.13Å
145	S	89.8	Confident	93.3	Very high	69 Å²	69	31.8 Å²	31.8	48%	0.483	16%	0.162	S	C	.	.	H	α-helix	trans	-69	-41.2	176.1	176.1	0	0	0	0	113.1	G141 V143	G141-S145 WeakPolarHBondContact O-CB 3.33Å; G141-S145 PolarHBondContact O-N 3.18Å; G141-S145 VanDerWaalsContact O-N 3.09Å; V143-S145 VanDerWaalsContact C-N 3.32Å; V143-S145 PolarHBondContact O-N 3.02Å
146	K	91.5	Very high	93.5	Very high	152 Å²	152	31 Å²	31	66%	0.661	16%	0.157	S	C	*	.	H	α-helix	trans	-67.4	-41.5	-178	179.2	178.9	175.8	-175.5	0	112.5	Q142 V143	Q142-K146 WeakPolarHBondContact O-CB 3.05Å; Q142-K146 PolarHBondContact O-N 3.47Å; V143-K146 PolarHBondContact O-N 2.87Å
147	F	93.6	Very high	93.6	Very high	9 Å²	9	30.8 Å²	30.8	4%	0.039	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	10	-176.3	-63.2	-70.1	0	0	0	113.1	V143 V149 F183 E196 L197 V200	V143-F147 HydrophobicContact CG1-CD2 3.84Å; V143-F147 HydrophobicContact CG1-CE2 4.24Å; V143-F147 VanDerWaalsContact O-CD2 3.28Å; V143-F147 WeakPolarHBondContact O-CD2 3.37Å; V143-F147 PolarHBondContact O-N 3.39Å; F147-V149 HydrophobicContact CB-CG2 3.89Å; F147-V149 PolarHBondContact O-N 2.86Å; F147-F183 WeakPolarHBondContact O-CD1 3.41Å; F147-E196 HydrophobicContact CD1-CB 4.47Å; F147-E196 HydrophobicContact CE1-CB 3.56Å; F147-E196 HydrophobicContact CZ-CB 4.12Å; F147-L197 HydrophobicContact CB-CD1 4.34Å; F147-L197 HydrophobicContact CD2-CB 4.47Å; F147-L197 HydrophobicContact CD2-CD1 3.69Å; F147-L197 HydrophobicContact CE2-CD1 4.23Å; F147-L197 HydrophobicContact CG-CB 4.34Å; F147-L197 HydrophobicContact CG-CD1 4.13Å; F147-V200 HydrophobicContact CE2-CB 4.19Å; F147-V200 HydrophobicContact CE2-CG1 4.42Å; F147-V200 HydrophobicContact CE2-CG2 3.97Å; F147-V200 HydrophobicContact CZ-CB 4.45Å; F147-V200 HydrophobicContact CZ-CG2 3.81Å
148	S	92.7	Very high	93.6	Very high	34 Å²	34	33.5 Å²	33.5	24%	0.238	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.4	46.8	-177.2	-60.6	0	0	0	0	112.5	I144 Q184	I144-S148 PolarHBondContact O-N 2.96Å; S148-Q184 WeakPolarHBondContact O-CB 3.32Å; S148-Q184 WeakPolarHBondContact O-CG 3.35Å; S148-Q184 PolarHBondContact O-N 3.18Å
149	V	93.6	Very high	93.6	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	127	-179.5	174.4	0	0	0	0	108.9	F124 I144 F147 E151 L152 V181 F183 L197	F124-V149 WeakPolarHBondContact CE1-O 3.42Å; F124-V149 WeakPolarHBondContact CZ-O 3Å; I144-V149 HydrophobicContact CG2-CB 4.29Å; I144-V149 WeakPolarHBondContact CG2-O 3.35Å; I144-V149 PolarHBondContact O-N 3.1Å; F147-V149 HydrophobicContact CB-CG2 3.89Å; F147-V149 PolarHBondContact O-N 2.86Å; V149-E151 WeakPolarHBondContact CG1-O 3.49Å; V149-L152 HydrophobicContact CG1-CB 3.95Å; V149-L152 HydrophobicContact CG1-CD1 4.26Å; V149-V181 HydrophobicContact CB-CG1 4.47Å; V149-V181 HydrophobicContact CG1-CG1 3.68Å; V149-V181 HydrophobicContact CG2-CG1 4.08Å; V149-F183 HydrophobicContact CG2-CD1 4.28Å; V149-F183 HydrophobicContact CG2-CE1 4.07Å; V149-L197 HydrophobicContact CG2-CD1 4.38Å; V149-L197 HydrophobicContact CG2-CD2 3.91Å
150	R	91.8	Very high	93.5	Very high	64 Å²	64	32 Å²	32	24%	0.242	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-51.4	174.6	-175.5	-154.6	-170.9	107.2	36.4	111.2	W182 Q184 I229 A230 P291	R150-W182 WeakPolarHBondContact CA-O 3.15Å; R150-W182 HydrophobicContact CB-CB 4.33Å; R150-W182 VanDerWaalsContact CB-O 3.29Å; R150-W182 WeakPolarHBondContact CB-O 3.15Å; R150-W182 PolarHBondContact N-O 2.73Å; R150-Q184 HydrophobicContact CB-CG 4.28Å; R150-I229 PolarHBondContact NE-O 3.48Å; R150-I229 PolarHBondContact NH2-O 2.71Å; R150-A230 VanDerWaalsContact NH2-CA 3.28Å; R150-P291 HydrophobicContact CG-CG 4.47Å
151	E	94.6	Very high	93.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	139.6	178.1	-57.9	-170.4	176.1	0	0	109.6	V149 H153 V181 W182 P226 L227 G228 I289 R290	V149-E151 WeakPolarHBondContact CG1-O 3.49Å; E151-H153 IonicContact OE2-NE2 2.71Å; E151-V181 WeakPolarHBondContact O-CA 3.48Å; E151-V181 WeakPolarHBondContact O-CG1 3.37Å; E151-W182 HydrophobicContact CB-CB 4.07Å; E151-W182 HydrophobicContact CB-CG 4.47Å; E151-W182 HydrophobicContact CG-CB 4.49Å; E151-W182 PolarHBondContact N-O 2.89Å; E151-W182 VanDerWaalsContact N-O 3.11Å; E151-W182 PolarHBondContact O-N 3.03Å; E151-P226 WeakPolarHBondContact OE1-CB 3.43Å; E151-P226 WeakPolarHBondContact OE2-CA 3.45Å; E151-L227 PolarHBondContact OE1-N 3Å; E151-L227 PolarHBondContact OE2-N 3.12Å; E151-G228 VanDerWaalsContact OE1-CA 3.24Å; E151-G228 WeakPolarHBondContact OE1-CA 3.47Å; E151-G228 PolarHBondContact OE1-N 2.8Å; E151-I289 VanDerWaalsContact CA-O 3.28Å; E151-I289 WeakPolarHBondContact CA-O 3.29Å; E151-R290 HydrophobicContact CG-CB 4.32Å
152	L	96.8	Very high	93.4	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	124.5	-179.4	-172.8	95.2	0	0	0	108.7	V149 L179 V181 L197 L201 H288 I289	V149-L152 HydrophobicContact CG1-CB 3.95Å; V149-L152 HydrophobicContact CG1-CD1 4.26Å; L152-L179 HydrophobicContact CD1-CD1 4.42Å; L152-V181 HydrophobicContact CD1-CG1 4.3Å; L152-V181 HydrophobicContact CD1-CG2 3.47Å; L152-V181 VanDerWaalsContact CD1-CG2 3.47Å; L152-V181 HydrophobicContact CG-CG2 4.33Å; L152-L197 HydrophobicContact CD1-CD2 4.17Å; L152-L201 HydrophobicContact CD1-CD1 3.92Å; L152-L201 HydrophobicContact CD2-CD2 4.38Å; L152-H288 CarbonylContact O-C 3.53Å; L152-H288 WeakPolarHBondContact O-CA 3.37Å; L152-I289 HydrophobicContact CB-CB 4.11Å; L152-I289 HydrophobicContact CB-CD1 4.38Å; L152-I289 HydrophobicContact CB-CG1 4.33Å; L152-I289 HydrophobicContact CD2-CD1 3.95Å; L152-I289 HydrophobicContact CD2-CG1 4.44Å; L152-I289 PolarHBondContact N-O 2.83Å; L152-I289 PolarHBondContact O-N 2.85Å
153	H	97.6	Very high	93.5	Very high	2 Å²	2	33 Å²	33	1%	0.009	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	119.1	176.3	-61.2	-89.5	0	0	0	109.5	E151 L179 W180 H288 F559	E151-H153 IonicContact OE2-NE2 2.71Å; H153-L179 WeakPolarHBondContact O-CA 3.21Å; H153-W180 HydrophobicContact CB-CD2 3.84Å; H153-W180 HydrophobicContact CB-CG 4.08Å; H153-W180 HydrophobicContact CB-CH2 4.47Å; H153-W180 HydrophobicContact CB-CZ2 3.69Å; H153-W180 AromaticContact CD2-CD2 3.8Å; H153-W180 AromaticContact CD2-CE2 3.53Å; H153-W180 AromaticContact CD2-CE3 3.73Å; H153-W180 AromaticContact CD2-CH2 3.11Å; H153-W180 WeakPolarHBondContact CD2-CH2 3.1Å; H153-W180 AromaticContact CD2-CZ2 3.21Å; H153-W180 WeakPolarHBondContact CD2-CZ2 3.22Å; H153-W180 AromaticContact CD2-CZ3 3.4Å; H153-W180 WeakPolarHBondContact CD2-CZ3 3.15Å; H153-W180 AromaticContact CE1-CH2 3.88Å; H153-W180 AromaticContact CE1-CZ2 3.92Å; H153-W180 AromaticContact CG-CE2 3.41Å; H153-W180 VanDerWaalsContact CG-CE2 3.41Å; H153-W180 AromaticContact CG-CH2 3.67Å; H153-W180 AromaticContact CG-CZ2 3.22Å; H153-W180 AromaticContact CG-NE1 3.84Å; H153-W180 PolarHBondContact N-O 3.43Å; H153-W180 AromaticContact ND1-CZ2 3.67Å; H153-W180 AromaticContact NE2-CH2 3.28Å; H153-W180 VanDerWaalsContact NE2-CH2 3.28Å; H153-W180 WeakPolarHBondContact NE2-CH2 3.43Å; H153-W180 AromaticContact NE2-CZ2 3.67Å; H153-W180 AromaticContact NE2-CZ3 3.79Å; H153-W180 PolarHBondContact O-N 3.15Å; H153-H288 AromaticContact CG-ND1 3.66Å; H153-H288 WeakPolarHBondContact ND1-CB 3.29Å; H153-H288 AromaticContact ND1-CG 3.45Å; H153-H288 AromaticContact ND1-ND1 3.04Å; H153-H288 PolarHBondContact ND1-ND1 2.82Å; H153-F559 AromaticContact CE1-CZ 4Å; H153-F559 AromaticContact ND1-CZ 3.93Å
154	I	96.9	Very high	93.3	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	135.2	177.6	-172.9	168.9	0	0	0	110	F156 E178 L179 F205 L209 A286 V287	I154-F156 HydrophobicContact CD1-CE1 4.3Å; I154-F156 HydrophobicContact CD1-CE2 3.56Å; I154-F156 HydrophobicContact CD1-CZ 3.38Å; I154-F156 HydrophobicContact CG1-CD2 4.43Å; I154-F156 HydrophobicContact CG1-CE2 3.8Å; I154-F156 HydrophobicContact CG1-CZ 3.93Å; I154-E178 WeakPolarHBondContact CA-O 3.27Å; I154-L179 HydrophobicContact CB-CD1 3.95Å; I154-L179 HydrophobicContact CD1-CD1 4.39Å; I154-L179 HydrophobicContact CG1-CD1 4.29Å; I154-F205 HydrophobicContact CD1-CD2 3.99Å; I154-F205 HydrophobicContact CD1-CE2 4.26Å; I154-F205 HydrophobicContact CG2-CE2 4.16Å; I154-F205 HydrophobicContact CG2-CZ 4.21Å; I154-L209 HydrophobicContact CD1-CD1 3.42Å; I154-L209 VanDerWaalsContact CD1-CD1 3.42Å; I154-L209 HydrophobicContact CD1-CD2 4.32Å; I154-L209 HydrophobicContact CD1-CG 4.47Å; I154-A286 CarbonylContact O-C 3.58Å; I154-A286 WeakPolarHBondContact O-CA 3.41Å; I154-A286 VanDerWaalsContact O-CB 3.29Å; I154-A286 WeakPolarHBondContact O-CB 3.48Å; I154-V287 HydrophobicContact CG2-CB 3.69Å; I154-V287 HydrophobicContact CG2-CG2 4.46Å; I154-V287 WeakPolarHBondContact CG2-O 3.15Å; I154-V287 PolarHBondContact N-O 2.92Å; I154-V287 PolarHBondContact O-N 3.38Å
155	S	96.4	Very high	93.1	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.007	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	146.5	172.8	71.5	0	0	0	0	110.8	A177 E178 Q285	S155-A177 VanDerWaalsContact O-CA 3.29Å; S155-A177 WeakPolarHBondContact O-CA 3.36Å; S155-E178 PolarHBondContact N-O 2.85Å; S155-E178 PolarHBondContact O-N 3.39Å; S155-E178 PolarHBondContact OG-OE2 2.54Å; S155-Q285 WeakPolarHBondContact CA-O 3.23Å
156	F	96.1	Very high	93.1	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.009	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	117.6	174.5	-60.7	-79.2	0	0	0	108.1	I154 G176 A177 F205 A207 L209 V248 S284 Q285	I154-F156 HydrophobicContact CD1-CE1 4.3Å; I154-F156 HydrophobicContact CD1-CE2 3.56Å; I154-F156 HydrophobicContact CD1-CZ 3.38Å; I154-F156 HydrophobicContact CG1-CD2 4.43Å; I154-F156 HydrophobicContact CG1-CE2 3.8Å; I154-F156 HydrophobicContact CG1-CZ 3.93Å; F156-G176 WeakPolarHBondContact CA-O 3.39Å; F156-A177 HydrophobicContact CD1-CB 3.74Å; F156-A177 HydrophobicContact CE1-CB 3.87Å; F156-F205 HydrophobicContact CE2-CB 3.91Å; F156-F205 HydrophobicContact CE2-CD1 4.17Å; F156-F205 AromaticContact CE2-CG 3.97Å; F156-F205 HydrophobicContact CE2-CG 3.97Å; F156-F205 HydrophobicContact CZ-CB 3.83Å; F156-F205 HydrophobicContact CZ-CG 4.26Å; F156-A207 HydrophobicContact CD1-CB 4.41Å; F156-A207 HydrophobicContact CE1-CB 3.4Å; F156-A207 HydrophobicContact CZ-CB 3.61Å; F156-L209 HydrophobicContact CE1-CD2 3.94Å; F156-L209 HydrophobicContact CE1-CG 4.41Å; F156-L209 HydrophobicContact CZ-CD1 4.16Å; F156-L209 HydrophobicContact CZ-CD2 4.26Å; F156-L209 HydrophobicContact CZ-CG 4.42Å; F156-V248 VanDerWaalsContact C-CG2 3.47Å; F156-V248 HydrophobicContact CB-CG1 4.31Å; F156-V248 HydrophobicContact CB-CG2 3.93Å; F156-S284 WeakPolarHBondContact O-CA 3.29Å; F156-Q285 HydrophobicContact CB-CG 3.96Å; F156-Q285 HydrophobicContact CD2-CG 4.34Å; F156-Q285 PolarHBondContact N-O 3.13Å; F156-Q285 PolarHBondContact O-N 2.91Å
157	T	95.5	Very high	93.1	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.018	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	130.6	-172.1	-49.8	0	0	0	0	111.7	S173 P174 G176 V248 F282 H283 S284	T157-S173 VanDerWaalsContact OG1-CB 3.23Å; T157-S173 WeakPolarHBondContact OG1-CB 3.41Å; T157-P174 WeakPolarHBondContact CB-O 3.27Å; T157-P174 PolarHBondContact OG1-O 3.18Å; T157-G176 PolarHBondContact N-O 3.19Å; T157-G176 PolarHBondContact O-N 3.22Å; T157-V248 VanDerWaalsContact N-CG2 3.35Å; T157-F282 HydrophobicContact CG2-CD2 4.17Å; T157-F282 HydrophobicContact CG2-CE2 3.28Å; T157-F282 HydrophobicContact CG2-CZ 3.53Å; T157-H283 CarbonylContact C-O 3.49Å; T157-H283 WeakPolarHBondContact CA-O 3.31Å; T157-S284 PolarHBondContact OG1-OG 3.21Å
158	Q	93.3	Very high	92.9	Very high	72 Å²	72	29.4 Å²	29.4	34%	0.336	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	127.8	170.1	-174.7	179.7	2.5	0	0	109.3	V248 H283	Q158-V248 HydrophobicContact CB-CB 4.16Å; Q158-V248 HydrophobicContact CB-CG2 3.92Å; Q158-H283 PolarHBondContact N-O 3.45Å; Q158-H283 PolarHBondContact O-N 2.92Å; Q158-H283 VanDerWaalsContact O-N 3.16Å
159	G	91.3	Very high	92.9	Very high	35 Å²	35	28.2 Å²	28.2	36%	0.361	14%	0.135	S	C	.	.	S	Bend	trans	83	-179.6	-171.4	0	0	0	0	0	112.2	P175	G159-P175 WeakPolarHBondContact O-CB 3.36Å
160	Y	90.4	Very high	92.7	Very high	107 Å²	107	28.5 Å²	28.5	42%	0.42	14%	0.136	S	C	.	.			trans	-122.7	149.2	175.6	63.1	-88.5	0	0	0	109.6	R162 E575	Y160-R162 HydrophobicContact CD2-CG 4.25Å; Y160-R162 HydrophobicContact CE2-CG 3.81Å; Y160-R162 PolarHBondContact O-N 3.3Å; Y160-E575 HydrophobicContact CD2-CG 4.23Å; Y160-E575 HydrophobicContact CE2-CG 4.47Å
161	W	93.1	Very high	92.7	Very high	27 Å²	27	25.7 Å²	25.7	10%	0.102	13%	0.126	C	C	.	.			trans	-75.7	119.6	-178.8	-173.8	-90.9	0	0	0	111	Y111 T163 W166 G167 P169 F282 V312	Y111-W161 HydrophobicContact CD1-CH2 4.11Å; Y111-W161 AromaticContact CD2-CH2 3.78Å; Y111-W161 HydrophobicContact CD2-CH2 3.78Å; Y111-W161 HydrophobicContact CD2-CZ3 4.02Å; Y111-W161 HydrophobicContact CE1-CH2 4.11Å; Y111-W161 AromaticContact CE2-CH2 3.81Å; Y111-W161 HydrophobicContact CE2-CH2 3.81Å; Y111-W161 AromaticContact CE2-CZ3 3.88Å; Y111-W161 HydrophobicContact CE2-CZ3 3.88Å; Y111-W161 AromaticContact CG-CH2 3.95Å; Y111-W161 HydrophobicContact CG-CH2 3.95Å; Y111-W161 AromaticContact CZ-CH2 3.97Å; W161-T163 PolarHBondContact O-N 3.31Å; W161-T163 VanDerWaalsContact O-N 3.1Å; W161-W166 AromaticContact CD2-CE3 3.75Å; W161-W166 HydrophobicContact CD2-CE3 3.75Å; W161-W166 HydrophobicContact CD2-CZ3 4.39Å; W161-W166 AromaticContact CE3-CE3 3.76Å; W161-W166 HydrophobicContact CE3-CE3 3.76Å; W161-W166 HydrophobicContact CE3-CZ3 4.17Å; W161-W166 HydrophobicContact CG-CE3 4.2Å; W161-W166 HydrophobicContact CH2-CB 4.23Å; W161-W166 HydrophobicContact CH2-CE3 4.44Å; W161-W166 HydrophobicContact CZ2-CB 3.62Å; W161-W166 HydrophobicContact CZ2-CE3 4.42Å; W161-W166 HydrophobicContact CZ3-CE3 4.12Å; W161-G167 PolarHBondContact NE1-O 3.49Å; W161-P169 HydrophobicContact CD2-CB 3.97Å; W161-P169 HydrophobicContact CD2-CG 4.16Å; W161-P169 HydrophobicContact CE3-CB 4.2Å; W161-P169 HydrophobicContact CG-CG 4.33Å; W161-P169 HydrophobicContact CH2-CB 3.94Å; W161-P169 HydrophobicContact CZ2-CB 3.7Å; W161-P169 HydrophobicContact CZ2-CG 4.42Å; W161-P169 HydrophobicContact CZ3-CB 4.19Å; W161-F282 HydrophobicContact CB-CE2 4.23Å; W161-F282 AromaticContact CE3-CD1 3.85Å; W161-F282 HydrophobicContact CE3-CD1 3.85Å; W161-F282 HydrophobicContact CE3-CD2 4.48Å; W161-F282 AromaticContact CE3-CE1 3.68Å; W161-F282 HydrophobicContact CE3-CE1 3.68Å; W161-F282 HydrophobicContact CE3-CE2 4.32Å; W161-F282 HydrophobicContact CE3-CG 4.25Å; W161-F282 AromaticContact CE3-CZ 3.93Å; W161-F282 HydrophobicContact CE3-CZ 3.93Å; W161-F282 HydrophobicContact CZ3-CD1 4.02Å; W161-F282 HydrophobicContact CZ3-CE1 4.02Å; W161-V312 HydrophobicContact CH2-CG2 4.17Å; W161-V312 HydrophobicContact CZ3-CG2 3.72Å
162	R	91.8	Very high	92.6	Very high	94 Å²	94	26.7 Å²	26.7	36%	0.355	13%	0.133	S	C	.	.			trans	-85.5	78.5	179.3	-60.1	-178.2	-173.5	165.6	4	110.6	Y160 M164 Q165 W166	Y160-R162 HydrophobicContact CD2-CG 4.25Å; Y160-R162 HydrophobicContact CE2-CG 3.81Å; Y160-R162 PolarHBondContact O-N 3.3Å; R162-M164 PolarHBondContact O-N 3.35Å; R162-M164 VanDerWaalsContact O-N 3.12Å; R162-Q165 HydrophobicContact CB-CB 4.14Å; R162-Q165 HydrophobicContact CB-CG 4.48Å; R162-Q165 PolarHBondContact O-N 3.43Å; R162-W166 HydrophobicContact CB-CD2 3.88Å; R162-W166 HydrophobicContact CB-CE3 3.91Å; R162-W166 HydrophobicContact CB-CG 4.45Å; R162-W166 HydrophobicContact CB-CH2 4.28Å; R162-W166 HydrophobicContact CB-CZ2 4.27Å; R162-W166 HydrophobicContact CB-CZ3 4.12Å; R162-W166 HydrophobicContact CG-CE3 4.39Å; R162-W166 HydrophobicContact CG-CH2 3.91Å; R162-W166 HydrophobicContact CG-CZ2 4.08Å; R162-W166 HydrophobicContact CG-CZ3 4.09Å; R162-W166 VanDerWaalsContact N-CZ3 3.35Å; R162-W166 PolarHBondContact O-N 2.75Å
163	T	91.1	Very high	92.5	Very high	6 Å²	6	27 Å²	27	4%	0.037	14%	0.135	C	C	.	.	H	α-helix	trans	-52.8	-37.7	-174.2	-46	0	0	0	0	113.5	W161 G167 P414 H417	W161-T163 PolarHBondContact O-N 3.31Å; W161-T163 VanDerWaalsContact O-N 3.1Å; T163-G167 CarbonylContact O-C 3.53Å; T163-G167 WeakPolarHBondContact O-CA 3.21Å; T163-G167 PolarHBondContact O-N 2.96Å; T163-P414 HydrophobicContact CG2-CB 3.95Å; T163-P414 HydrophobicContact CG2-CG 3.93Å; T163-H417 WeakPolarHBondContact CB-ND1 3.49Å
164	M	88.8	Confident	92.4	Very high	54 Å²	54	27.1 Å²	27.1	27%	0.266	14%	0.136	S	C	.	.	H	α-helix	trans	-65.3	-39.6	177.2	-72.8	-64.9	-70.1	0	0	112.7	R162 M411 R413 P414 H417	R162-M164 PolarHBondContact O-N 3.35Å; R162-M164 VanDerWaalsContact O-N 3.12Å; M164-M411 HydrophobicContact CB-CE 4.22Å; M164-M411 HydrophobicContact CE-CE 3.98Å; M164-M411 WeakPolarHBondContact O-CE 3.37Å; M164-R413 HydrophobicContact CE-CG 4.4Å; M164-P414 HydrophobicContact SD-CG 3.85Å; M164-H417 HydrophobicContact SD-CB 4.37Å
165	Q	88.5	Confident	92.2	Very high	78 Å²	78	27.9 Å²	27.9	36%	0.364	14%	0.141	S	C	.	.	H	α-helix	trans	-85.1	-40	-177.1	-66.5	177.1	2.1	0	0	112.3	R162	R162-Q165 HydrophobicContact CB-CB 4.14Å; R162-Q165 HydrophobicContact CB-CG 4.48Å; R162-Q165 PolarHBondContact O-N 3.43Å
166	W	90.5	Very high	92.1	Very high	2 Å²	2	28 Å²	28	1%	0.008	14%	0.143	C	C	.	.	H	α-helix	trans	-102.2	-7.7	-170.7	-55.3	-25.3	0	0	0	113.3	L105 D109 W161 R162 F282 V312	L105-W166 HydrophobicContact CD1-CB 3.78Å; L105-W166 VanDerWaalsContact CD1-CD1 3.48Å; L105-W166 HydrophobicContact CD1-CG 3.72Å; L105-W166 WeakPolarHBondContact CD2-O 2.93Å; D109-W166 PolarHBondContact OD2-NE1 3.43Å; W161-W166 AromaticContact CD2-CE3 3.75Å; W161-W166 HydrophobicContact CD2-CE3 3.75Å; W161-W166 HydrophobicContact CD2-CZ3 4.39Å; W161-W166 AromaticContact CE3-CE3 3.76Å; W161-W166 HydrophobicContact CE3-CE3 3.76Å; W161-W166 HydrophobicContact CE3-CZ3 4.17Å; W161-W166 HydrophobicContact CG-CE3 4.2Å; W161-W166 HydrophobicContact CH2-CB 4.23Å; W161-W166 HydrophobicContact CH2-CE3 4.44Å; W161-W166 HydrophobicContact CZ2-CB 3.62Å; W161-W166 HydrophobicContact CZ2-CE3 4.42Å; W161-W166 HydrophobicContact CZ3-CE3 4.12Å; R162-W166 HydrophobicContact CB-CD2 3.88Å; R162-W166 HydrophobicContact CB-CE3 3.91Å; R162-W166 HydrophobicContact CB-CG 4.45Å; R162-W166 HydrophobicContact CB-CH2 4.28Å; R162-W166 HydrophobicContact CB-CZ2 4.27Å; R162-W166 HydrophobicContact CB-CZ3 4.12Å; R162-W166 HydrophobicContact CG-CE3 4.39Å; R162-W166 HydrophobicContact CG-CH2 3.91Å; R162-W166 HydrophobicContact CG-CZ2 4.08Å; R162-W166 HydrophobicContact CG-CZ3 4.09Å; R162-W166 VanDerWaalsContact N-CZ3 3.35Å; R162-W166 PolarHBondContact O-N 2.75Å; W166-F282 HydrophobicContact CH2-CB 3.73Å; W166-F282 HydrophobicContact CZ3-CB 3.68Å; W166-F282 HydrophobicContact CZ3-CD2 4.25Å; W166-F282 HydrophobicContact CZ3-CG 4.03Å; W166-V312 HydrophobicContact CD2-CG1 4.22Å; W166-V312 HydrophobicContact CD2-CG2 4.23Å; W166-V312 HydrophobicContact CE3-CG2 4.06Å; W166-V312 HydrophobicContact CH2-CB 4.43Å; W166-V312 HydrophobicContact CH2-CG1 4.48Å; W166-V312 HydrophobicContact CZ2-CB 4.36Å; W166-V312 HydrophobicContact CZ2-CG1 3.93Å; W166-V312 HydrophobicContact CZ3-CG2 4.21Å
167	G	89.9	Confident	92.1	Very high	14 Å²	14	28 Å²	28	14%	0.144	14%	0.143	C	C	.	.			trans	72.2	-155.5	-172.9	0	0	0	0	0	111.8	W161 T163	W161-G167 PolarHBondContact NE1-O 3.49Å; T163-G167 CarbonylContact O-C 3.53Å; T163-G167 WeakPolarHBondContact O-CA 3.21Å; T163-G167 PolarHBondContact O-N 2.96Å
168	Q	90.6	Very high	92.2	Very high	20 Å²	20	28.2 Å²	28.2	9%	0.093	14%	0.144	C	C	.	.			trans	-86.2	132.9	179.9	-67.6	-66.9	-15.3	0	0	111.7	L375 P414 L416 I570	Q168-L375 HydrophobicContact CB-CD1 3.71Å; Q168-P414 HydrophobicContact CG-CB 4.49Å; Q168-L416 PolarHBondContact NE2-O 2.82Å; Q168-I570 HydrophobicContact CB-CD1 4.12Å; Q168-I570 HydrophobicContact CG-CD1 3.54Å; Q168-I570 VanDerWaalsContact OE1-CD1 3.26Å
169	P	92	Very high	92.4	Very high	8 Å²	8	24.9 Å²	24.9	5%	0.052	13%	0.128	C	C	.	.			trans	-75	152.7	175.2	31.9	-31.1	0	0	0	110.4	W161 L171 P172	W161-P169 HydrophobicContact CD2-CB 3.97Å; W161-P169 HydrophobicContact CD2-CG 4.16Å; W161-P169 HydrophobicContact CE3-CB 4.2Å; W161-P169 HydrophobicContact CG-CG 4.33Å; W161-P169 HydrophobicContact CH2-CB 3.94Å; W161-P169 HydrophobicContact CZ2-CB 3.7Å; W161-P169 HydrophobicContact CZ2-CG 4.42Å; W161-P169 HydrophobicContact CZ3-CB 4.19Å; P169-L171 VanDerWaalsContact C-N 3.29Å; P169-L171 PolarHBondContact O-N 3Å; P169-P172 HydrophobicContact CG-CB 4Å
170	Y	90.5	Very high	92.7	Very high	7 Å²	7	23.5 Å²	23.5	3%	0.027	11%	0.112	C	C	.	.	S	Bend	trans	-63.1	-39.3	172.3	-60	-54.8	0	0	0	111.7	V101 Y111 V374 F556	V101-Y170 HydrophobicContact CB-CE2 4.26Å; V101-Y170 HydrophobicContact CG1-CD2 3.66Å; V101-Y170 HydrophobicContact CG1-CE2 3.36Å; V101-Y170 HydrophobicContact CG2-CE2 3.85Å; Y111-Y170 HydrophobicContact CD1-CD2 4.4Å; Y111-Y170 HydrophobicContact CD1-CE2 4.12Å; Y111-Y170 AromaticContact CE1-CD2 3.42Å; Y111-Y170 HydrophobicContact CE1-CD2 3.42Å; Y111-Y170 VanDerWaalsContact CE1-CD2 3.42Å; Y111-Y170 AromaticContact CE1-CE2 3.56Å; Y111-Y170 HydrophobicContact CE1-CE2 3.56Å; Y111-Y170 HydrophobicContact CE1-CG 4.28Å; Y111-Y170 AromaticContact CZ-CD2 3.97Å; Y170-V374 HydrophobicContact CD1-CG1 3.66Å; Y170-V374 HydrophobicContact CE1-CG1 3.6Å; Y170-F556 HydrophobicContact CD1-CD2 4.08Å; Y170-F556 HydrophobicContact CD2-CB 4.24Å; Y170-F556 HydrophobicContact CE1-CD2 4.06Å; Y170-F556 HydrophobicContact CG-CB 4.07Å; Y170-F556 HydrophobicContact CG-CD2 4.43Å
171	L	91.4	Very high	93	Very high	6 Å²	6	18.4 Å²	18.4	3%	0.031	9%	0.092	C	C	.	.	S	Bend	trans	-131.3	114.9	172.9	-71.2	177.6	0	0	0	109.9	P169 T308 N310 F559 F560	P169-L171 VanDerWaalsContact C-N 3.29Å; P169-L171 PolarHBondContact O-N 3Å; L171-T308 HydrophobicContact CD1-CG2 3.43Å; L171-T308 VanDerWaalsContact CD1-CG2 3.43Å; L171-N310 PolarHBondContact O-ND2 3.21Å; L171-F559 HydrophobicContact CD2-CB 3.55Å; L171-F559 HydrophobicContact CD2-CD1 3.31Å; L171-F559 HydrophobicContact CD2-CD2 4.39Å; L171-F559 HydrophobicContact CD2-CE1 4.08Å; L171-F559 HydrophobicContact CD2-CG 3.49Å; L171-F559 VanDerWaalsContact CD2-CG 3.49Å; L171-F560 HydrophobicContact CD2-CE2 4.12Å
172	P	92.8	Very high	93.1	Very high	21 Å²	21	17.4 Å²	17.4	14%	0.136	9%	0.088	C	C	.	.			trans	-77	146.2	178.6	33.5	-35.6	0	0	0	110.3	P169 F560 R571 Y573	P169-P172 HydrophobicContact CG-CB 4Å; P172-F560 HydrophobicContact CG-CZ 4.37Å; P172-R571 WeakPolarHBondContact CB-O 3.22Å; P172-R571 HydrophobicContact CG-CB 3.94Å; P172-R571 HydrophobicContact CG-CG 4.46Å; P172-R571 WeakPolarHBondContact CG-O 3.46Å; P172-Y573 HydrophobicContact CB-CD2 3.89Å; P172-Y573 HydrophobicContact CB-CE2 3.81Å; P172-Y573 HydrophobicContact CG-CE2 4.14Å
173	S	93.9	Very high	93.3	Very high	8 Å²	8	13 Å²	13	6%	0.056	7%	0.072	C	C	.	.			trans	-145.8	137.9	172.2	-52.9	0	0	0	0	109.5	T157 S284	T157-S173 VanDerWaalsContact OG1-CB 3.23Å; T157-S173 WeakPolarHBondContact OG1-CB 3.41Å; S173-S284 WeakPolarHBondContact CB-OG 3.42Å; S173-S284 PolarHBondContact OG-OG 2.98Å
174	P	94.8	Very high	93.3	Very high	3 Å²	3	14.5 Å²	14.5	2%	0.019	8%	0.078	C	C	.	.			trans	-74.6	157.9	175.7	31.5	-32.7	0	0	0	110.8	T157 E178 Y573	T157-P174 WeakPolarHBondContact CB-O 3.27Å; T157-P174 PolarHBondContact OG1-O 3.18Å; P174-E178 WeakPolarHBondContact CD-OE2 3.43Å; P174-E178 HydrophobicContact CG-CB 3.47Å; P174-E178 VanDerWaalsContact CG-CB 3.47Å; P174-E178 HydrophobicContact CG-CG 3.98Å; P174-Y573 HydrophobicContact CB-CD1 3.56Å; P174-Y573 HydrophobicContact CB-CE1 3.97Å; P174-Y573 HydrophobicContact CB-CG 3.85Å; P174-Y573 HydrophobicContact CG-CD1 3.97Å; P174-Y573 HydrophobicContact CG-CE1 3.83Å; P174-Y573 HydrophobicContact CG-CG 4.45Å
175	P	93.9	Very high	93.4	Very high	18 Å²	18	18.2 Å²	18.2	12%	0.117	10%	0.099	C	C	.	.	S	Bend	trans	-61.9	144.1	170.3	27.4	-34.8	0	0	0	111.7	G159 S532 P576	G159-P175 WeakPolarHBondContact O-CB 3.36Å; P175-S532 VanDerWaalsContact CD-OG 3.28Å; P175-S532 WeakPolarHBondContact CD-OG 3.38Å; P175-S532 WeakPolarHBondContact CG-OG 3.42Å; P175-P576 HydrophobicContact CB-CG 4.19Å; P175-P576 HydrophobicContact CG-CB 3.99Å; P175-P576 HydrophobicContact CG-CG 3.58Å
176	G	94.9	Very high	93.4	Very high	4 Å²	4	18.6 Å²	18.6	4%	0.041	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	84.3	-150.4	-175.4	0	0	0	0	0	112	F156 T157 L243 E246	F156-G176 WeakPolarHBondContact CA-O 3.39Å; T157-G176 PolarHBondContact N-O 3.19Å; T157-G176 PolarHBondContact O-N 3.22Å; G176-L243 WeakPolarHBondContact CA-O 3.2Å; G176-E246 VanDerWaalsContact CA-O 3.3Å; G176-E246 WeakPolarHBondContact CA-O 3.47Å
177	A	96.3	Very high	93.5	Very high	2 Å²	2	19.3 Å²	19.3	2%	0.017	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	137.5	173.4	0	0	0	0	0	111.8	S155 F156 L209 T242 L243 E246	S155-A177 VanDerWaalsContact O-CA 3.29Å; S155-A177 WeakPolarHBondContact O-CA 3.36Å; F156-A177 HydrophobicContact CD1-CB 3.74Å; F156-A177 HydrophobicContact CE1-CB 3.87Å; A177-L209 HydrophobicContact CB-CD2 4Å; A177-T242 CarbonylContact O-C 3.49Å; A177-T242 VanDerWaalsContact O-CA 3.31Å; A177-T242 WeakPolarHBondContact O-CA 3.19Å; A177-L243 HydrophobicContact CB-CB 4.28Å; A177-L243 PolarHBondContact N-O 2.79Å; A177-L243 PolarHBondContact O-N 2.77Å; A177-E246 HydrophobicContact CB-CB 3.8Å; A177-E246 HydrophobicContact CB-CG 3.8Å
178	E	96.6	Very high	93.6	Very high	7 Å²	7	25.6 Å²	25.6	3%	0.033	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134.3	170.3	172.9	-165.4	-143.6	0	0	108.7	I154 S155 P174 Y240 T242 Y573	I154-E178 WeakPolarHBondContact CA-O 3.27Å; S155-E178 PolarHBondContact N-O 2.85Å; S155-E178 PolarHBondContact O-N 3.39Å; S155-E178 PolarHBondContact OG-OE2 2.54Å; P174-E178 WeakPolarHBondContact CD-OE2 3.43Å; P174-E178 HydrophobicContact CG-CB 3.47Å; P174-E178 VanDerWaalsContact CG-CB 3.47Å; P174-E178 HydrophobicContact CG-CG 3.98Å; E178-Y240 HydrophobicContact CG-CE2 3.88Å; E178-Y240 WeakPolarHBondContact OE1-CE2 3.33Å; E178-T242 HydrophobicContact CB-CG2 4.28Å; E178-T242 HydrophobicContact CG-CG2 4.26Å; E178-Y573 WeakPolarHBondContact OE1-CE1 3.47Å; E178-Y573 PolarHBondContact OE1-OH 3.41Å; E178-Y573 PolarHBondContact OE2-OH 3.35Å
179	L	97.5	Very high	93.9	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	126.6	176.3	179.4	65.8	0	0	0	109.3	L152 H153 I154 V181 W194 T198 L201 I212 Y240 A241	L152-L179 HydrophobicContact CD1-CD1 4.42Å; H153-L179 WeakPolarHBondContact O-CA 3.21Å; I154-L179 HydrophobicContact CB-CD1 3.95Å; I154-L179 HydrophobicContact CD1-CD1 4.39Å; I154-L179 HydrophobicContact CG1-CD1 4.29Å; L179-V181 HydrophobicContact CD1-CG2 3.89Å; L179-V181 HydrophobicContact CG-CG2 4.15Å; L179-W194 HydrophobicContact CB-CH2 4.2Å; L179-W194 HydrophobicContact CD2-CH2 3.45Å; L179-W194 VanDerWaalsContact CD2-CH2 3.45Å; L179-W194 HydrophobicContact CD2-CZ2 4.31Å; L179-W194 HydrophobicContact CD2-CZ3 3.64Å; L179-W194 HydrophobicContact CG-CH2 3.59Å; L179-W194 HydrophobicContact CG-CZ3 3.87Å; L179-T198 HydrophobicContact CD2-CG2 3.74Å; L179-L201 HydrophobicContact CD1-CD1 4.02Å; L179-L201 HydrophobicContact CD2-CD1 4.12Å; L179-I212 HydrophobicContact CB-CD1 4.05Å; L179-I212 HydrophobicContact CD2-CD1 3.87Å; L179-Y240 WeakPolarHBondContact O-CA 3.37Å; L179-A241 PolarHBondContact N-O 3.44Å; L179-A241 PolarHBondContact O-N 2.73Å
180	W	97.3	Very high	94.1	Very high	7 Å²	7	29 Å²	29	3%	0.027	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	140.6	167.5	62.3	-79	0	0	0	112.2	H153 W182 F224 L227 L238 R239 Y240	H153-W180 HydrophobicContact CB-CD2 3.84Å; H153-W180 HydrophobicContact CB-CG 4.08Å; H153-W180 HydrophobicContact CB-CH2 4.47Å; H153-W180 HydrophobicContact CB-CZ2 3.69Å; H153-W180 AromaticContact CD2-CD2 3.8Å; H153-W180 AromaticContact CD2-CE2 3.53Å; H153-W180 AromaticContact CD2-CE3 3.73Å; H153-W180 AromaticContact CD2-CH2 3.11Å; H153-W180 WeakPolarHBondContact CD2-CH2 3.1Å; H153-W180 AromaticContact CD2-CZ2 3.21Å; H153-W180 WeakPolarHBondContact CD2-CZ2 3.22Å; H153-W180 AromaticContact CD2-CZ3 3.4Å; H153-W180 WeakPolarHBondContact CD2-CZ3 3.15Å; H153-W180 AromaticContact CE1-CH2 3.88Å; H153-W180 AromaticContact CE1-CZ2 3.92Å; H153-W180 AromaticContact CG-CE2 3.41Å; H153-W180 VanDerWaalsContact CG-CE2 3.41Å; H153-W180 AromaticContact CG-CH2 3.67Å; H153-W180 AromaticContact CG-CZ2 3.22Å; H153-W180 AromaticContact CG-NE1 3.84Å; H153-W180 PolarHBondContact N-O 3.43Å; H153-W180 AromaticContact ND1-CZ2 3.67Å; H153-W180 AromaticContact NE2-CH2 3.28Å; H153-W180 VanDerWaalsContact NE2-CH2 3.28Å; H153-W180 WeakPolarHBondContact NE2-CH2 3.43Å; H153-W180 AromaticContact NE2-CZ2 3.67Å; H153-W180 AromaticContact NE2-CZ3 3.79Å; H153-W180 PolarHBondContact O-N 3.15Å; W180-W182 AromaticContact CE3-CD1 3.85Å; W180-W182 AromaticContact CE3-NE1 3.76Å; W180-W182 AromaticContact CZ3-CD1 3.61Å; W180-W182 AromaticContact CZ3-NE1 3.44Å; W180-F224 AromaticContact CD1-CE1 3.79Å; W180-F224 AromaticContact CD2-CD1 3.59Å; W180-F224 HydrophobicContact CD2-CD1 3.59Å; W180-F224 AromaticContact CD2-CE1 3.95Å; W180-F224 HydrophobicContact CD2-CE1 3.95Å; W180-F224 AromaticContact CE2-CD1 3.76Å; W180-F224 AromaticContact CE2-CE1 3.84Å; W180-F224 AromaticContact CE3-CD1 3.9Å; W180-F224 HydrophobicContact CE3-CD1 3.9Å; W180-F224 AromaticContact CG-CD1 3.91Å; W180-F224 HydrophobicContact CG-CD1 3.91Å; W180-F224 AromaticContact CG-CE1 3.93Å; W180-F224 HydrophobicContact CG-CE1 3.93Å; W180-F224 HydrophobicContact CZ2-CD1 4.22Å; W180-F224 HydrophobicContact CZ2-CE1 4.5Å; W180-F224 HydrophobicContact CZ3-CD1 4.36Å; W180-F224 AromaticContact NE1-CE1 3.72Å; W180-L227 HydrophobicContact CH2-CD1 3.77Å; W180-L227 HydrophobicContact CH2-CG 3.88Å; W180-L227 HydrophobicContact CZ2-CD1 3.89Å; W180-L227 HydrophobicContact CZ2-CG 4.48Å; W180-L238 HydrophobicContact CE3-CD1 4.23Å; W180-R239 CarbonylContact C-O 3.56Å; W180-R239 WeakPolarHBondContact CA-O 3.41Å; W180-R239 WeakPolarHBondContact CB-O 3.23Å; W180-Y240 HydrophobicContact CB-CD2 3.75Å; W180-Y240 HydrophobicContact CB-CG 4.41Å; W180-Y240 HydrophobicContact CG-CD2 4.26Å
181	V	97.2	Very high	94.3	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	132.9	-166.3	-179.2	0	0	0	0	109.2	V149 E151 L152 L179 F183 W194 L197 L238 R239	V149-V181 HydrophobicContact CB-CG1 4.47Å; V149-V181 HydrophobicContact CG1-CG1 3.68Å; V149-V181 HydrophobicContact CG2-CG1 4.08Å; E151-V181 WeakPolarHBondContact O-CA 3.48Å; E151-V181 WeakPolarHBondContact O-CG1 3.37Å; L152-V181 HydrophobicContact CD1-CG1 4.3Å; L152-V181 HydrophobicContact CD1-CG2 3.47Å; L152-V181 VanDerWaalsContact CD1-CG2 3.47Å; L152-V181 HydrophobicContact CG-CG2 4.33Å; L179-V181 HydrophobicContact CD1-CG2 3.89Å; L179-V181 HydrophobicContact CG-CG2 4.15Å; V181-F183 HydrophobicContact CB-CE2 4.34Å; V181-F183 HydrophobicContact CG1-CD1 4.49Å; V181-F183 HydrophobicContact CG1-CD2 4.27Å; V181-F183 HydrophobicContact CG1-CE1 4.19Å; V181-F183 HydrophobicContact CG1-CE2 3.96Å; V181-F183 HydrophobicContact CG1-CZ 3.92Å; V181-W194 HydrophobicContact CB-CE3 4.5Å; V181-W194 HydrophobicContact CB-CZ3 3.99Å; V181-W194 HydrophobicContact CG2-CE3 4.49Å; V181-W194 HydrophobicContact CG2-CZ3 3.69Å; V181-L197 HydrophobicContact CB-CD2 4.45Å; V181-L197 HydrophobicContact CG1-CD2 3.9Å; V181-L197 HydrophobicContact CG2-CD2 4.06Å; V181-L238 WeakPolarHBondContact O-CA 3.36Å; V181-R239 PolarHBondContact N-O 2.91Å; V181-R239 PolarHBondContact O-N 2.8Å
182	W	96.1	Very high	94.6	Very high	5 Å²	5	34.6 Å²	34.6	2%	0.019	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	121.7	165.8	-71.8	89.1	0	0	0	108.5	R150 E151 W180 F224 P226 D234 H235 F237 L238	R150-W182 WeakPolarHBondContact CA-O 3.15Å; R150-W182 HydrophobicContact CB-CB 4.33Å; R150-W182 VanDerWaalsContact CB-O 3.29Å; R150-W182 WeakPolarHBondContact CB-O 3.15Å; R150-W182 PolarHBondContact N-O 2.73Å; E151-W182 HydrophobicContact CB-CB 4.07Å; E151-W182 HydrophobicContact CB-CG 4.47Å; E151-W182 HydrophobicContact CG-CB 4.49Å; E151-W182 PolarHBondContact N-O 2.89Å; E151-W182 VanDerWaalsContact N-O 3.11Å; E151-W182 PolarHBondContact O-N 3.03Å; W180-W182 AromaticContact CE3-CD1 3.85Å; W180-W182 AromaticContact CE3-NE1 3.76Å; W180-W182 AromaticContact CZ3-CD1 3.61Å; W180-W182 AromaticContact CZ3-NE1 3.44Å; W182-F224 WeakPolarHBondContact CZ2-O 3.48Å; W182-P226 HydrophobicContact CD2-CG 4.02Å; W182-P226 HydrophobicContact CE3-CG 4.33Å; W182-P226 HydrophobicContact CH2-CG 4.26Å; W182-P226 HydrophobicContact CZ2-CG 3.93Å; W182-P226 HydrophobicContact CZ3-CG 4.44Å; W182-D234 WeakPolarHBondContact CZ3-O 3.35Å; W182-H235 AromaticContact CH2-ND1 3.78Å; W182-F237 WeakPolarHBondContact CA-O 3.44Å; W182-L238 HydrophobicContact CD2-CB 4.14Å; W182-L238 HydrophobicContact CD2-CD1 4.17Å; W182-L238 HydrophobicContact CE3-CB 4.04Å; W182-L238 HydrophobicContact CG-CD1 4.36Å; W182-L238 HydrophobicContact CH2-CB 3.95Å; W182-L238 HydrophobicContact CH2-CD2 4.19Å; W182-L238 HydrophobicContact CZ2-CB 4.02Å; W182-L238 HydrophobicContact CZ2-CD1 4.16Å; W182-L238 HydrophobicContact CZ2-CD2 3.76Å; W182-L238 HydrophobicContact CZ2-CG 4.19Å; W182-L238 HydrophobicContact CZ3-CB 3.96Å
183	F	95.1	Very high	94.8	Very high	3 Å²	3	35 Å²	35	1%	0.013	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	158.9	171.2	-66.2	-82.6	0	0	0	111	F147 V149 V181 V187 V190 W194 L197 F237 R239	F147-F183 WeakPolarHBondContact O-CD1 3.41Å; V149-F183 HydrophobicContact CG2-CD1 4.28Å; V149-F183 HydrophobicContact CG2-CE1 4.07Å; V181-F183 HydrophobicContact CB-CE2 4.34Å; V181-F183 HydrophobicContact CG1-CD1 4.49Å; V181-F183 HydrophobicContact CG1-CD2 4.27Å; V181-F183 HydrophobicContact CG1-CE1 4.19Å; V181-F183 HydrophobicContact CG1-CE2 3.96Å; V181-F183 HydrophobicContact CG1-CZ 3.92Å; F183-V187 HydrophobicContact CB-CB 4.41Å; F183-V187 HydrophobicContact CB-CG2 4.13Å; F183-V187 HydrophobicContact CD1-CG2 4.37Å; F183-V190 HydrophobicContact CD2-CG1 3.49Å; F183-V190 VanDerWaalsContact CD2-CG1 3.49Å; F183-V190 HydrophobicContact CE2-CG1 3.79Å; F183-V190 HydrophobicContact CG-CG1 4.28Å; F183-W194 HydrophobicContact CE2-CB 4.38Å; F183-W194 HydrophobicContact CE2-CE3 4.29Å; F183-W194 HydrophobicContact CZ-CB 4.27Å; F183-W194 HydrophobicContact CZ-CE3 4.25Å; F183-L197 HydrophobicContact CE1-CD2 4.03Å; F183-L197 HydrophobicContact CZ-CD2 3.86Å; F183-F237 HydrophobicContact CB-CB 4.23Å; F183-F237 HydrophobicContact CB-CD1 4.27Å; F183-F237 WeakPolarHBondContact CD2-O 3.21Å; F183-F237 PolarHBondContact N-O 2.8Å; F183-R239 HydrophobicContact CE2-CG 4.12Å
184	Q	91.2	Very high	94.9	Very high	36 Å²	36	35 Å²	35	17%	0.168	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-69.6	156.1	167.3	-68.1	-179.4	19.8	0	0	110.7	S148 R150 T186 V187 F237	S148-Q184 WeakPolarHBondContact O-CB 3.32Å; S148-Q184 WeakPolarHBondContact O-CG 3.35Å; S148-Q184 PolarHBondContact O-N 3.18Å; R150-Q184 HydrophobicContact CB-CG 4.28Å; Q184-T186 WeakPolarHBondContact CB-OG1 3.23Å; Q184-T186 PolarHBondContact O-N 3.09Å; Q184-T186 VanDerWaalsContact O-N 3.14Å; Q184-T186 PolarHBondContact OE1-OG1 2.93Å; Q184-V187 PolarHBondContact O-N 2.89Å; Q184-F237 VanDerWaalsContact O-CD1 3.31Å; Q184-F237 WeakPolarHBondContact O-CD1 3.31Å; Q184-F237 WeakPolarHBondContact O-CE1 3.48Å
185	D	90.1	Very high	95	Very high	132 Å²	132	41.4 Å²	41.4	71%	0.706	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-13.3	175	56.4	-7.6	0	0	0	114	V187 F237	D185-V187 VanDerWaalsContact C-N 3.29Å; D185-V187 PolarHBondContact O-N 3.07Å; D185-F237 HydrophobicContact CB-CE2 4.3Å; D185-F237 HydrophobicContact CB-CZ 4.21Å
186	T	89.7	Confident	95.1	Very high	87 Å²	87	45.7 Å²	45.7	53%	0.534	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-16.5	175.8	57.6	0	0	0	0	113.9	Q184	Q184-T186 WeakPolarHBondContact CB-OG1 3.23Å; Q184-T186 PolarHBondContact O-N 3.09Å; Q184-T186 VanDerWaalsContact O-N 3.14Å; Q184-T186 PolarHBondContact OE1-OG1 2.93Å
187	V	92.4	Very high	95.3	Very high	16 Å²	16	45.5 Å²	45.5	10%	0.097	25%	0.247	C	C	.	.			trans	-79	122.1	-177.3	179.7	0	0	0	0	110.4	F183 Q184 D185 V190 T193 F237	F183-V187 HydrophobicContact CB-CB 4.41Å; F183-V187 HydrophobicContact CB-CG2 4.13Å; F183-V187 HydrophobicContact CD1-CG2 4.37Å; Q184-V187 PolarHBondContact O-N 2.89Å; D185-V187 VanDerWaalsContact C-N 3.29Å; D185-V187 PolarHBondContact O-N 3.07Å; V187-V190 HydrophobicContact CG1-CG2 4.06Å; V187-T193 HydrophobicContact CG1-CG2 3.98Å; V187-F237 WeakPolarHBondContact O-CE1 3.25Å
188	T	92.6	Very high	95.3	Very high	147 Å²	147	45.5 Å²	45.5	90%	0.902	25%	0.247	S	C	*	.	S	Bend	trans	-83.2	-45.1	179.4	50.9	0	0	0	0	112.9
189	D	95.6	Very high	95.3	Very high	85 Å²	85	48.9 Å²	48.9	46%	0.455	27%	0.265	S	S	.	.			trans	-113.1	94.9	178.1	-170.2	-17.4	0	0	0	110.7	D191 A192 T193	D189-D191 PolarHBondContact OD1-N 2.87Å; D189-A192 HydrophobicContact CB-CB 4.22Å; D189-A192 VanDerWaalsContact CG-CB 3.44Å; D189-A192 PolarHBondContact OD1-N 2.95Å; D189-A192 WeakPolarHBondContact OD2-CB 3.09Å; D189-T193 WeakPolarHBondContact O-CB 3.34Å; D189-T193 VanDerWaalsContact O-CG2 3.3Å; D189-T193 WeakPolarHBondContact O-CG2 2.94Å; D189-T193 PolarHBondContact O-N 2.91Å; D189-T193 PolarHBondContact O-OG1 2.81Å
190	V	96.3	Very high	95.3	Very high	14 Å²	14	51.4 Å²	51.4	9%	0.085	28%	0.281	C	S	.	.	H	α-helix	trans	-71.6	-32.8	-178.1	-178.7	0	0	0	0	111.6	F183 V187 T193 W194 F237 R239	F183-V190 HydrophobicContact CD2-CG1 3.49Å; F183-V190 VanDerWaalsContact CD2-CG1 3.49Å; F183-V190 HydrophobicContact CE2-CG1 3.79Å; F183-V190 HydrophobicContact CG-CG1 4.28Å; V187-V190 HydrophobicContact CG1-CG2 4.06Å; V190-T193 WeakPolarHBondContact CA-OG1 3.23Å; V190-T193 PolarHBondContact O-OG1 2.77Å; V190-W194 WeakPolarHBondContact O-CB 3.47Å; V190-W194 PolarHBondContact O-N 2.95Å; V190-F237 HydrophobicContact CG2-CD1 3.8Å; V190-F237 HydrophobicContact CG2-CE1 4.2Å; V190-R239 HydrophobicContact CG1-CG 3.98Å; V190-R239 VanDerWaalsContact CG1-CZ 3.47Å
191	D	95.5	Very high	95.3	Very high	90 Å²	90	51.1 Å²	51.1	48%	0.481	28%	0.279	S	S	.	.	H	α-helix	trans	-75.9	-40.6	-176.2	-69.5	-30.9	0	0	0	112	D189 K195 R239	D189-D191 PolarHBondContact OD1-N 2.87Å; D191-K195 PolarHBondContact O-N 2.88Å; D191-K195 VanDerWaalsContact O-N 3.07Å; D191-R239 IonicContact OD1-CZ 3.17Å; D191-R239 IonicContact OD1-NE 3.8Å; D191-R239 PolarHBondContact OD1-NE 3.4Å; D191-R239 IonicContact OD1-NH2 2.74Å; D191-R239 PolarHBondContact OD1-NH2 2.8Å; D191-R239 IonicContact OD2-NH2 3.75Å
192	A	96.1	Very high	95.2	Very high	40 Å²	40	52.1 Å²	52.1	33%	0.331	29%	0.286	S	S	.	.	H	α-helix	trans	-64.2	-46.8	173.8	0	0	0	0	0	111.2	D189 W194 K195 E196	D189-A192 HydrophobicContact CB-CB 4.22Å; D189-A192 VanDerWaalsContact CG-CB 3.44Å; D189-A192 PolarHBondContact OD1-N 2.95Å; D189-A192 WeakPolarHBondContact OD2-CB 3.09Å; A192-W194 VanDerWaalsContact C-N 3.33Å; A192-W194 PolarHBondContact O-N 2.86Å; A192-K195 PolarHBondContact O-N 2.78Å; A192-E196 PolarHBondContact O-N 2.89Å
193	T	97.1	Very high	95.1	Very high	30 Å²	30	54.6 Å²	54.6	18%	0.184	31%	0.313	C	S	.	.	H	α-helix	trans	-64.8	-36.7	178.3	51	0	0	0	0	112.3	V187 D189 V190 E196 L197	V187-T193 HydrophobicContact CG1-CG2 3.98Å; D189-T193 WeakPolarHBondContact O-CB 3.34Å; D189-T193 VanDerWaalsContact O-CG2 3.3Å; D189-T193 WeakPolarHBondContact O-CG2 2.94Å; D189-T193 PolarHBondContact O-N 2.91Å; D189-T193 PolarHBondContact O-OG1 2.81Å; V190-T193 WeakPolarHBondContact CA-OG1 3.23Å; V190-T193 PolarHBondContact O-OG1 2.77Å; T193-E196 PolarHBondContact O-N 3.05Å; T193-L197 WeakPolarHBondContact O-CB 3.19Å; T193-L197 PolarHBondContact O-N 3.16Å
194	W	97.1	Very high	95.1	Very high	7 Å²	7	56.2 Å²	56.2	3%	0.027	32%	0.322	C	S	.	.	H	α-helix	trans	-58.7	-46.3	171.4	171.7	-116.3	0	0	0	112.8	L179 V181 F183 V190 A192 L197 T198 I212 T217 R239 A241	L179-W194 HydrophobicContact CB-CH2 4.2Å; L179-W194 HydrophobicContact CD2-CH2 3.45Å; L179-W194 VanDerWaalsContact CD2-CH2 3.45Å; L179-W194 HydrophobicContact CD2-CZ2 4.31Å; L179-W194 HydrophobicContact CD2-CZ3 3.64Å; L179-W194 HydrophobicContact CG-CH2 3.59Å; L179-W194 HydrophobicContact CG-CZ3 3.87Å; V181-W194 HydrophobicContact CB-CE3 4.5Å; V181-W194 HydrophobicContact CB-CZ3 3.99Å; V181-W194 HydrophobicContact CG2-CE3 4.49Å; V181-W194 HydrophobicContact CG2-CZ3 3.69Å; F183-W194 HydrophobicContact CE2-CB 4.38Å; F183-W194 HydrophobicContact CE2-CE3 4.29Å; F183-W194 HydrophobicContact CZ-CB 4.27Å; F183-W194 HydrophobicContact CZ-CE3 4.25Å; V190-W194 WeakPolarHBondContact O-CB 3.47Å; V190-W194 PolarHBondContact O-N 2.95Å; A192-W194 VanDerWaalsContact C-N 3.33Å; A192-W194 PolarHBondContact O-N 2.86Å; W194-L197 PolarHBondContact O-N 2.87Å; W194-T198 HydrophobicContact CD2-CG2 4Å; W194-T198 HydrophobicContact CE3-CG2 4.16Å; W194-T198 HydrophobicContact CH2-CG2 4.23Å; W194-T198 HydrophobicContact CZ2-CG2 4.05Å; W194-T198 HydrophobicContact CZ3-CG2 4.26Å; W194-T198 VanDerWaalsContact O-CG2 3.3Å; W194-T198 WeakPolarHBondContact O-CG2 3.45Å; W194-T198 PolarHBondContact O-N 3.47Å; W194-T198 PolarHBondContact O-OG1 2.77Å; W194-I212 HydrophobicContact CZ2-CG2 3.46Å; W194-I212 VanDerWaalsContact CZ2-CG2 3.46Å; W194-T217 HydrophobicContact CZ2-CG2 4.19Å; W194-T217 PolarHBondContact NE1-OG1 3.25Å; W194-R239 HydrophobicContact CB-CG 4.16Å; W194-R239 HydrophobicContact CD2-CB 3.66Å; W194-R239 HydrophobicContact CD2-CG 3.99Å; W194-R239 HydrophobicContact CE3-CB 3.65Å; W194-R239 HydrophobicContact CE3-CG 4.22Å; W194-R239 HydrophobicContact CG-CB 4.19Å; W194-R239 HydrophobicContact CG-CG 3.98Å; W194-R239 HydrophobicContact CH2-CB 4.03Å; W194-R239 HydrophobicContact CZ2-CB 4.05Å; W194-R239 HydrophobicContact CZ3-CB 3.86Å; W194-A241 HydrophobicContact CH2-CB 4.45Å; W194-A241 HydrophobicContact CZ2-CB 3.78Å
195	K	96.8	Very high	95.3	Very high	139 Å²	139	54.5 Å²	54.5	60%	0.604	31%	0.314	S	S	*	.	H	α-helix	trans	-64.6	-39.9	177.3	-173.4	177.8	179.6	179.4	0	112.1	D191 A192 T198 N199	D191-K195 PolarHBondContact O-N 2.88Å; D191-K195 VanDerWaalsContact O-N 3.07Å; A192-K195 PolarHBondContact O-N 2.78Å; K195-T198 WeakPolarHBondContact CA-OG1 3.37Å; K195-T198 PolarHBondContact O-OG1 3.37Å; K195-N199 PolarHBondContact O-N 2.6Å; K195-N199 PolarHBondContact O-ND2 3.32Å
196	E	96.8	Very high	95.5	Very high	108 Å²	108	51.8 Å²	51.8	51%	0.505	31%	0.305	S	S	.	.	H	α-helix	trans	-69	-41.6	176	-68.9	-176.6	-173.5	0	0	112	F147 A192 T193 N199 V200	F147-E196 HydrophobicContact CD1-CB 4.47Å; F147-E196 HydrophobicContact CE1-CB 3.56Å; F147-E196 HydrophobicContact CZ-CB 4.12Å; A192-E196 PolarHBondContact O-N 2.89Å; T193-E196 PolarHBondContact O-N 3.05Å; E196-N199 PolarHBondContact O-N 3.42Å; E196-V200 WeakPolarHBondContact O-CG2 3.42Å; E196-V200 PolarHBondContact O-N 3Å
197	L	97.4	Very high	95.7	Very high	0 Å²	0	48 Å²	48	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.8	-48.3	178.9	177.1	64	0	0	0	111.5	V143 F147 V149 L152 V181 F183 T193 W194 N199 V200 L201	V143-L197 HydrophobicContact CG1-CD1 3.43Å; V143-L197 VanDerWaalsContact CG1-CD1 3.43Å; F147-L197 HydrophobicContact CB-CD1 4.34Å; F147-L197 HydrophobicContact CD2-CB 4.47Å; F147-L197 HydrophobicContact CD2-CD1 3.69Å; F147-L197 HydrophobicContact CE2-CD1 4.23Å; F147-L197 HydrophobicContact CG-CB 4.34Å; F147-L197 HydrophobicContact CG-CD1 4.13Å; V149-L197 HydrophobicContact CG2-CD1 4.38Å; V149-L197 HydrophobicContact CG2-CD2 3.91Å; L152-L197 HydrophobicContact CD1-CD2 4.17Å; V181-L197 HydrophobicContact CB-CD2 4.45Å; V181-L197 HydrophobicContact CG1-CD2 3.9Å; V181-L197 HydrophobicContact CG2-CD2 4.06Å; F183-L197 HydrophobicContact CE1-CD2 4.03Å; F183-L197 HydrophobicContact CZ-CD2 3.86Å; T193-L197 WeakPolarHBondContact O-CB 3.19Å; T193-L197 PolarHBondContact O-N 3.16Å; W194-L197 PolarHBondContact O-N 2.87Å; L197-N199 VanDerWaalsContact C-N 3.31Å; L197-N199 PolarHBondContact O-N 2.78Å; L197-V200 PolarHBondContact O-N 3.13Å; L197-V200 VanDerWaalsContact O-N 3.14Å; L197-L201 HydrophobicContact CD1-CD1 3.94Å; L197-L201 HydrophobicContact CD1-CD2 4.46Å; L197-L201 HydrophobicContact CD1-CG 3.98Å; L197-L201 HydrophobicContact CD2-CD1 4.42Å; L197-L201 HydrophobicContact CG-CD1 3.81Å; L197-L201 HydrophobicContact CG-CG 4.25Å; L197-L201 WeakPolarHBondContact O-CB 3.45Å; L197-L201 VanDerWaalsContact O-CG 3.31Å; L197-L201 WeakPolarHBondContact O-CG 3.5Å; L197-L201 PolarHBondContact O-N 2.64Å
198	T	97.2	Very high	95.7	Very high	1 Å²	1	49 Å²	49	1%	0.006	29%	0.29	C	S	.	.	H	α-helix	trans	-59.7	-39.6	179	47.5	0	0	0	0	112.2	L179 W194 K195 S202 I212	L179-T198 HydrophobicContact CD2-CG2 3.74Å; W194-T198 HydrophobicContact CD2-CG2 4Å; W194-T198 HydrophobicContact CE3-CG2 4.16Å; W194-T198 HydrophobicContact CH2-CG2 4.23Å; W194-T198 HydrophobicContact CZ2-CG2 4.05Å; W194-T198 HydrophobicContact CZ3-CG2 4.26Å; W194-T198 VanDerWaalsContact O-CG2 3.3Å; W194-T198 WeakPolarHBondContact O-CG2 3.45Å; W194-T198 PolarHBondContact O-N 3.47Å; W194-T198 PolarHBondContact O-OG1 2.77Å; K195-T198 WeakPolarHBondContact CA-OG1 3.37Å; K195-T198 PolarHBondContact O-OG1 3.37Å; T198-S202 WeakPolarHBondContact O-CB 3.48Å; T198-S202 PolarHBondContact O-N 2.97Å; T198-I212 HydrophobicContact CG2-CB 3.91Å; T198-I212 HydrophobicContact CG2-CD1 4.16Å; T198-I212 HydrophobicContact CG2-CG2 3.87Å
199	N	96.6	Very high	95.9	Very high	78 Å²	78	42 Å²	42	42%	0.417	25%	0.247	S	C	.	.	H	α-helix	trans	-64.8	-40.6	173.8	-76.7	-53.5	0	0	0	112.9	K195 E196 L197 S202 G203 N210	K195-N199 PolarHBondContact O-N 2.6Å; K195-N199 PolarHBondContact O-ND2 3.32Å; E196-N199 PolarHBondContact O-N 3.42Å; L197-N199 VanDerWaalsContact C-N 3.31Å; L197-N199 PolarHBondContact O-N 2.78Å; N199-S202 WeakPolarHBondContact O-CB 3.45Å; N199-G203 PolarHBondContact O-N 2.86Å; N199-N210 VanDerWaalsContact OD1-CB 3.26Å; N199-N210 WeakPolarHBondContact OD1-CB 3.44Å
200	V	97.1	Very high	95.8	Very high	55 Å²	55	41.5 Å²	41.5	33%	0.333	24%	0.244	S	C	.	.	H	α-helix	trans	-69.8	-42.9	177.1	174.5	0	0	0	0	111.4	V143 F147 E196 L197 S202 G203 I204	V143-V200 HydrophobicContact CG2-CG1 3.86Å; F147-V200 HydrophobicContact CE2-CB 4.19Å; F147-V200 HydrophobicContact CE2-CG1 4.42Å; F147-V200 HydrophobicContact CE2-CG2 3.97Å; F147-V200 HydrophobicContact CZ-CB 4.45Å; F147-V200 HydrophobicContact CZ-CG2 3.81Å; E196-V200 WeakPolarHBondContact O-CG2 3.42Å; E196-V200 PolarHBondContact O-N 3Å; L197-V200 PolarHBondContact O-N 3.13Å; L197-V200 VanDerWaalsContact O-N 3.14Å; V200-S202 VanDerWaalsContact C-N 3.29Å; V200-S202 PolarHBondContact O-N 3Å; V200-G203 PolarHBondContact O-N 2.9Å; V200-I204 HydrophobicContact CG1-CD1 3.97Å; V200-I204 WeakPolarHBondContact O-CG1 3.44Å; V200-I204 PolarHBondContact O-N 3.19Å; V200-I204 VanDerWaalsContact O-N 3.08Å
201	L	96.8	Very high	95.6	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.1	-35.9	177.8	-68.3	175.5	0	0	0	111.8	V143 L152 L179 L197 G203 I204 F205 L209	V143-L201 HydrophobicContact CG1-CD2 4.3Å; L152-L201 HydrophobicContact CD1-CD1 3.92Å; L152-L201 HydrophobicContact CD2-CD2 4.38Å; L179-L201 HydrophobicContact CD1-CD1 4.02Å; L179-L201 HydrophobicContact CD2-CD1 4.12Å; L197-L201 HydrophobicContact CD1-CD1 3.94Å; L197-L201 HydrophobicContact CD1-CD2 4.46Å; L197-L201 HydrophobicContact CD1-CG 3.98Å; L197-L201 HydrophobicContact CD2-CD1 4.42Å; L197-L201 HydrophobicContact CG-CD1 3.81Å; L197-L201 HydrophobicContact CG-CG 4.25Å; L197-L201 WeakPolarHBondContact O-CB 3.45Å; L197-L201 VanDerWaalsContact O-CG 3.31Å; L197-L201 WeakPolarHBondContact O-CG 3.5Å; L197-L201 PolarHBondContact O-N 2.64Å; L201-G203 VanDerWaalsContact C-N 3.29Å; L201-G203 PolarHBondContact O-N 3.06Å; L201-I204 PolarHBondContact O-N 2.67Å; L201-F205 HydrophobicContact CD2-CD2 4.47Å; L201-F205 HydrophobicContact CD2-CE2 4.1Å; L201-F205 PolarHBondContact O-N 3.08Å; L201-L209 HydrophobicContact CB-CD1 3.73Å
202	S	95.6	Very high	95.6	Very high	21 Å²	21	43.2 Å²	43.2	15%	0.147	25%	0.246	C	C	.	.	H	α-helix	trans	-53.7	-46.9	172.2	170.2	0	0	0	0	111.3	T198 N199 V200 C206 A207	T198-S202 WeakPolarHBondContact O-CB 3.48Å; T198-S202 PolarHBondContact O-N 2.97Å; N199-S202 WeakPolarHBondContact O-CB 3.45Å; V200-S202 VanDerWaalsContact C-N 3.29Å; V200-S202 PolarHBondContact O-N 3Å; S202-C206 WeakPolarHBondContact O-CA 3.45Å; S202-C206 PolarHBondContact O-N 3.06Å; S202-A207 VanDerWaalsContact CA-O 3.25Å; S202-A207 WeakPolarHBondContact CA-O 3.34Å; S202-A207 WeakPolarHBondContact CB-O 3.49Å; S202-A207 PolarHBondContact O-N 2.83Å; S202-A207 VanDerWaalsContact O-N 3.08Å; S202-A207 PolarHBondContact OG-O 3.01Å
203	G	94.5	Very high	95.5	Very high	57 Å²	57	44.7 Å²	44.7	59%	0.588	25%	0.249	S	C	*	.	H	α-helix	trans	-67.6	-38.5	176.4	0	0	0	0	0	114.1	N199 V200 L201	N199-G203 PolarHBondContact O-N 2.86Å; V200-G203 PolarHBondContact O-N 2.9Å; L201-G203 VanDerWaalsContact C-N 3.29Å; L201-G203 PolarHBondContact O-N 3.06Å
204	I	94.9	Very high	95.3	Very high	38 Å²	38	46.9 Å²	46.9	20%	0.195	27%	0.266	C	S	.	.	H	α-helix	trans	-68.2	-44	-179.3	-69.4	171.9	0	0	0	111.5	L140 V143 V200 L201 P255	L140-I204 HydrophobicContact CD2-CG2 4.44Å; V143-I204 HydrophobicContact CG2-CD1 3.47Å; V143-I204 VanDerWaalsContact CG2-CD1 3.47Å; V200-I204 HydrophobicContact CG1-CD1 3.97Å; V200-I204 WeakPolarHBondContact O-CG1 3.44Å; V200-I204 PolarHBondContact O-N 3.19Å; V200-I204 VanDerWaalsContact O-N 3.08Å; L201-I204 PolarHBondContact O-N 2.67Å; I204-P255 WeakPolarHBondContact O-CB 3.18Å
205	F	95.4	Very high	95.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-95.4	0.5	-175.6	-70.3	-71.9	0	0	0	113.9	L140 I154 F156 L201 A207 N252 L259 V287	L140-F205 HydrophobicContact CD2-CE2 4.43Å; L140-F205 HydrophobicContact CD2-CZ 4.33Å; I154-F205 HydrophobicContact CD1-CD2 3.99Å; I154-F205 HydrophobicContact CD1-CE2 4.26Å; I154-F205 HydrophobicContact CG2-CE2 4.16Å; I154-F205 HydrophobicContact CG2-CZ 4.21Å; F156-F205 HydrophobicContact CE2-CB 3.91Å; F156-F205 HydrophobicContact CE2-CD1 4.17Å; F156-F205 AromaticContact CE2-CG 3.97Å; F156-F205 HydrophobicContact CE2-CG 3.97Å; F156-F205 HydrophobicContact CZ-CB 3.83Å; F156-F205 HydrophobicContact CZ-CG 4.26Å; L201-F205 HydrophobicContact CD2-CD2 4.47Å; L201-F205 HydrophobicContact CD2-CE2 4.1Å; L201-F205 PolarHBondContact O-N 3.08Å; F205-A207 VanDerWaalsContact C-N 3.25Å; F205-A207 HydrophobicContact CB-CB 4.39Å; F205-A207 PolarHBondContact O-N 2.96Å; F205-N252 PolarHBondContact O-ND2 3.25Å; F205-L259 HydrophobicContact CE1-CD1 3.96Å; F205-L259 HydrophobicContact CZ-CD1 4.2Å; F205-V287 HydrophobicContact CE1-CG2 3.8Å; F205-V287 HydrophobicContact CZ-CB 4.21Å; F205-V287 HydrophobicContact CZ-CG2 3.86Å
206	C	94.3	Very high	95	Very high	75 Å²	75	43 Å²	43	51%	0.507	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	45.4	-174.7	-58.2	0	0	0	0	111.9	S202 N252	S202-C206 WeakPolarHBondContact O-CA 3.45Å; S202-C206 PolarHBondContact O-N 3.06Å; C206-N252 PolarHBondContact O-ND2 3.35Å
207	A	93.8	Very high	95	Very high	6 Å²	6	38.6 Å²	38.6	5%	0.05	23%	0.233	C	C	.	.	S	Bend	trans	-125.9	158.4	-176	0	0	0	0	0	110.5	F156 S202 F205 L209 E246	F156-A207 HydrophobicContact CD1-CB 4.41Å; F156-A207 HydrophobicContact CE1-CB 3.4Å; F156-A207 HydrophobicContact CZ-CB 3.61Å; S202-A207 VanDerWaalsContact CA-O 3.25Å; S202-A207 WeakPolarHBondContact CA-O 3.34Å; S202-A207 WeakPolarHBondContact CB-O 3.49Å; S202-A207 PolarHBondContact O-N 2.83Å; S202-A207 VanDerWaalsContact O-N 3.08Å; S202-A207 PolarHBondContact OG-O 3.01Å; F205-A207 VanDerWaalsContact C-N 3.25Å; F205-A207 HydrophobicContact CB-CB 4.39Å; F205-A207 PolarHBondContact O-N 2.96Å; A207-L209 HydrophobicContact CB-CG 4.04Å; A207-L209 PolarHBondContact O-N 2.78Å; A207-E246 WeakPolarHBondContact CA-OE1 3.41Å; A207-E246 WeakPolarHBondContact CB-OE1 3.39Å
208	S	93.2	Very high	94.9	Very high	39 Å²	39	38.7 Å²	38.7	27%	0.273	23%	0.234	S	C	.	.			trans	-83.6	37.2	-177.8	-29.7	0	0	0	0	113.5	N210 F211 L243 E246	S208-N210 VanDerWaalsContact CA-OD1 3.26Å; S208-N210 WeakPolarHBondContact CA-OD1 3.08Å; S208-N210 PolarHBondContact O-N 3.33Å; S208-N210 VanDerWaalsContact O-N 3.11Å; S208-N210 PolarHBondContact O-OD1 2.99Å; S208-F211 WeakPolarHBondContact O-CB 3.46Å; S208-F211 WeakPolarHBondContact O-CD2 3.47Å; S208-F211 PolarHBondContact O-N 3.43Å; S208-L243 WeakPolarHBondContact O-CD1 3.29Å; S208-E246 WeakPolarHBondContact CB-OE2 3.45Å; S208-E246 PolarHBondContact N-OE1 2.92Å; S208-E246 PolarHBondContact OG-OE1 3.01Å; S208-E246 PolarHBondContact OG-OE2 3.42Å
209	L	95	Very high	94.9	Very high	0 Å²	0	42 Å²	42	0%	0	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-63.8	-15.6	179.2	-56.9	174.3	0	0	0	113	I154 F156 A177 L201 A207 F211 I212	I154-L209 HydrophobicContact CD1-CD1 3.42Å; I154-L209 VanDerWaalsContact CD1-CD1 3.42Å; I154-L209 HydrophobicContact CD1-CD2 4.32Å; I154-L209 HydrophobicContact CD1-CG 4.47Å; F156-L209 HydrophobicContact CE1-CD2 3.94Å; F156-L209 HydrophobicContact CE1-CG 4.41Å; F156-L209 HydrophobicContact CZ-CD1 4.16Å; F156-L209 HydrophobicContact CZ-CD2 4.26Å; F156-L209 HydrophobicContact CZ-CG 4.42Å; A177-L209 HydrophobicContact CB-CD2 4Å; L201-L209 HydrophobicContact CB-CD1 3.73Å; A207-L209 HydrophobicContact CB-CG 4.04Å; A207-L209 PolarHBondContact O-N 2.78Å; L209-F211 PolarHBondContact O-N 3.35Å; L209-I212 HydrophobicContact CB-CD1 4.33Å; L209-I212 HydrophobicContact CD2-CD1 4.15Å; L209-I212 VanDerWaalsContact O-CB 3.24Å; L209-I212 WeakPolarHBondContact O-CB 3.29Å; L209-I212 WeakPolarHBondContact O-CG1 3.46Å; L209-I212 PolarHBondContact O-N 2.89Å
210	N	93.4	Very high	94.8	Very high	73 Å²	73	38.3 Å²	38.3	39%	0.39	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-63.9	-15	171.5	63.9	-49.4	0	0	0	113.4	N199 S208	N199-N210 VanDerWaalsContact OD1-CB 3.26Å; N199-N210 WeakPolarHBondContact OD1-CB 3.44Å; S208-N210 VanDerWaalsContact CA-OD1 3.26Å; S208-N210 WeakPolarHBondContact CA-OD1 3.08Å; S208-N210 PolarHBondContact O-N 3.33Å; S208-N210 VanDerWaalsContact O-N 3.11Å; S208-N210 PolarHBondContact O-OD1 2.99Å
211	F	93.5	Very high	94.6	Very high	134 Å²	134	37.2 Å²	37.2	59%	0.588	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-79.1	-2.9	168.8	-66.6	-60.4	0	0	0	113.5	S208 L209 D213 N216 L243	S208-F211 WeakPolarHBondContact O-CB 3.46Å; S208-F211 WeakPolarHBondContact O-CD2 3.47Å; S208-F211 PolarHBondContact O-N 3.43Å; L209-F211 PolarHBondContact O-N 3.35Å; F211-D213 PolarHBondContact O-N 3.09Å; F211-N216 PolarHBondContact O-ND2 2.87Å; F211-L243 HydrophobicContact CB-CD1 4.33Å; F211-L243 HydrophobicContact CB-CD2 4.27Å
212	I	95.6	Very high	94.3	Very high	6 Å²	6	38.2 Å²	38.2	3%	0.031	23%	0.233	C	C	.	.			trans	-73.5	118.3	168.1	-62.8	174.1	0	0	0	108.1	L179 W194 T198 L209 N216 A241 L243	L179-I212 HydrophobicContact CB-CD1 4.05Å; L179-I212 HydrophobicContact CD2-CD1 3.87Å; W194-I212 HydrophobicContact CZ2-CG2 3.46Å; W194-I212 VanDerWaalsContact CZ2-CG2 3.46Å; T198-I212 HydrophobicContact CG2-CB 3.91Å; T198-I212 HydrophobicContact CG2-CD1 4.16Å; T198-I212 HydrophobicContact CG2-CG2 3.87Å; L209-I212 HydrophobicContact CB-CD1 4.33Å; L209-I212 HydrophobicContact CD2-CD1 4.15Å; L209-I212 VanDerWaalsContact O-CB 3.24Å; L209-I212 WeakPolarHBondContact O-CB 3.29Å; L209-I212 WeakPolarHBondContact O-CG1 3.46Å; L209-I212 PolarHBondContact O-N 2.89Å; I212-N216 WeakPolarHBondContact CA-OD1 3.34Å; I212-A241 HydrophobicContact CD1-CB 4.17Å; I212-A241 HydrophobicContact CG1-CB 4.21Å; I212-A241 HydrophobicContact CG2-CB 3.56Å; I212-L243 HydrophobicContact CD1-CD1 4.38Å; I212-L243 HydrophobicContact CG1-CD1 3.79Å; I212-L243 HydrophobicContact CG1-CD2 4.24Å; I212-L243 HydrophobicContact CG1-CG 3.88Å
213	D	93.5	Very high	94	Very high	72 Å²	72	37.4 Å²	37.4	39%	0.385	23%	0.227	S	C	.	.			trans	-138.6	-172.4	-179.1	71.9	1.6	0	0	0	110	F211 T215 N216 T217	F211-D213 PolarHBondContact O-N 3.09Å; D213-T215 PolarHBondContact O-N 3.18Å; D213-T215 WeakPolarHBondContact OD1-CA 3.48Å; D213-T215 VanDerWaalsContact OD1-CB 3.26Å; D213-T215 WeakPolarHBondContact OD1-CB 3.27Å; D213-T215 PolarHBondContact OD1-N 3.03Å; D213-T215 PolarHBondContact OD1-OG1 2.97Å; D213-T215 PolarHBondContact OD2-OG1 2.91Å; D213-N216 PolarHBondContact N-OD1 2.85Å; D213-N216 PolarHBondContact O-N 3.12Å; D213-N216 PolarHBondContact O-OD1 2.96Å; D213-N216 PolarHBondContact OD1-N 3.12Å; D213-N216 PolarHBondContact OD1-OD1 3.25Å; D213-T217 VanDerWaalsContact O-CB 3.26Å; D213-T217 WeakPolarHBondContact O-CB 3.35Å; D213-T217 PolarHBondContact O-N 3.26Å; D213-T217 PolarHBondContact O-OG1 2.76Å
214	S	93.6	Very high	94	Very high	76 Å²	76	34.7 Å²	34.7	53%	0.531	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-21.8	178.9	66	0	0	0	0	112.8	N216 M487 R488	S214-N216 VanDerWaalsContact C-N 3.34Å; S214-N216 PolarHBondContact O-N 3.4Å; S214-M487 CarbonylContact C-O 3.51Å; S214-M487 WeakPolarHBondContact CB-O 3.44Å; S214-M487 PolarHBondContact OG-O 3.28Å; S214-R488 WeakPolarHBondContact O-CA 3.45Å
215	T	93.2	Very high	93.8	Very high	32 Å²	32	39.4 Å²	39.4	20%	0.196	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-18.2	-174.8	77.9	0	0	0	0	113.8	D213 R486 M487 P489	D213-T215 PolarHBondContact O-N 3.18Å; D213-T215 WeakPolarHBondContact OD1-CA 3.48Å; D213-T215 VanDerWaalsContact OD1-CB 3.26Å; D213-T215 WeakPolarHBondContact OD1-CB 3.27Å; D213-T215 PolarHBondContact OD1-N 3.03Å; D213-T215 PolarHBondContact OD1-OG1 2.97Å; D213-T215 PolarHBondContact OD2-OG1 2.91Å; T215-R486 WeakPolarHBondContact CG2-O 3.3Å; T215-M487 PolarHBondContact N-O 3Å; T215-P489 VanDerWaalsContact O-CD 3.24Å; T215-P489 WeakPolarHBondContact O-CD 3.34Å
216	N	94.1	Very high	93.6	Very high	31 Å²	31	40.2 Å²	40.2	17%	0.166	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.8	5.9	177.2	61.2	13.9	0	0	0	113.8	F211 I212 D213 S214 A241 L243	F211-N216 PolarHBondContact O-ND2 2.87Å; I212-N216 WeakPolarHBondContact CA-OD1 3.34Å; D213-N216 PolarHBondContact N-OD1 2.85Å; D213-N216 PolarHBondContact O-N 3.12Å; D213-N216 PolarHBondContact O-OD1 2.96Å; D213-N216 PolarHBondContact OD1-N 3.12Å; D213-N216 PolarHBondContact OD1-OD1 3.25Å; S214-N216 VanDerWaalsContact C-N 3.34Å; S214-N216 PolarHBondContact O-N 3.4Å; N216-A241 WeakPolarHBondContact O-CA 3.44Å; N216-A241 WeakPolarHBondContact O-CB 3.47Å; N216-L243 VanDerWaalsContact ND2-CD2 3.3Å; N216-L243 WeakPolarHBondContact ND2-CD2 3.26Å
217	T	96.4	Very high	93.4	Very high	16 Å²	16	37.5 Å²	37.5	10%	0.098	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	137.2	174.5	-58.6	0	0	0	0	110.7	W194 D213 R239 Y240 P489	W194-T217 HydrophobicContact CZ2-CG2 4.19Å; W194-T217 PolarHBondContact NE1-OG1 3.25Å; D213-T217 VanDerWaalsContact O-CB 3.26Å; D213-T217 WeakPolarHBondContact O-CB 3.35Å; D213-T217 PolarHBondContact O-N 3.26Å; D213-T217 PolarHBondContact O-OG1 2.76Å; T217-R239 HydrophobicContact CG2-CB 4.17Å; T217-R239 HydrophobicContact CG2-CG 4.43Å; T217-Y240 CarbonylContact C-O 3.53Å; T217-Y240 WeakPolarHBondContact CA-O 3.3Å; T217-P489 WeakPolarHBondContact O-CD 3.49Å
218	V	96.2	Very high	93	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.018	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	164.4	174	-66.9	0	0	0	0	111.6	P220 Y240 P489 L491	V218-P220 HydrophobicContact CG2-CG 4.18Å; V218-P220 WeakPolarHBondContact O-CD 3.37Å; V218-Y240 HydrophobicContact CG2-CD1 3.52Å; V218-Y240 HydrophobicContact CG2-CE1 4.4Å; V218-Y240 HydrophobicContact CG2-CG 4.3Å; V218-Y240 PolarHBondContact N-O 3.12Å; V218-Y240 PolarHBondContact O-N 3.08Å; V218-P489 HydrophobicContact CG1-CG 3.4Å; V218-L491 HydrophobicContact CB-CD1 4.13Å; V218-L491 HydrophobicContact CB-CD2 4.46Å; V218-L491 HydrophobicContact CG1-CB 4.21Å; V218-L491 HydrophobicContact CG1-CD1 4.36Å; V218-L491 HydrophobicContact CG2-CD1 4.22Å
219	E	95.7	Very high	92.6	Very high	70 Å²	70	38.2 Å²	38.2	33%	0.327	21%	0.209	S	C	.	.			trans	-118.6	83.2	177	-59.5	179.6	-176	0	0	109.7	S221 R239	E219-S221 PolarHBondContact O-N 3.07Å; E219-R239 IonicContact OE1-CZ 3.25Å; E219-R239 IonicContact OE1-NE 2.9Å; E219-R239 IonicContact OE1-NH1 2.68Å; E219-R239 PolarHBondContact OE1-NH1 2.75Å; E219-R239 VanDerWaalsContact OE1-NH1 3.1Å; E219-R239 IonicContact OE1-NH2 3Å; E219-R239 PolarHBondContact OE1-NH2 2.76Å
220	P	95.1	Very high	91.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.224	C	C	.	.			trans	-63.1	132.7	179.3	-22.1	33.4	0	0	0	112	V218 F224 H235 L238 Y240 L450	V218-P220 HydrophobicContact CG2-CG 4.18Å; V218-P220 WeakPolarHBondContact O-CD 3.37Å; P220-F224 HydrophobicContact CB-CD2 4.16Å; P220-F224 HydrophobicContact CG-CD2 4.05Å; P220-H235 PolarHBondContact O-ND1 2.62Å; P220-L238 HydrophobicContact CB-CD2 4.2Å; P220-L238 HydrophobicContact CG-CD2 4.29Å; P220-L238 WeakPolarHBondContact O-CD2 3.4Å; P220-Y240 HydrophobicContact CG-CG 4.24Å; P220-L450 HydrophobicContact CB-CD1 4.15Å; P220-L450 HydrophobicContact CG-CD1 4.29Å; P220-L450 HydrophobicContact CG-CD2 4.29Å
221	S	91.9	Very high	90.7	Very high	32 Å²	32	44.2 Å²	44.2	22%	0.224	25%	0.246	C	C	.	.	S	Bend	trans	-94.3	-14.8	-178	68.8	0	0	0	0	113.7	E219 H235 Y477 E493	E219-S221 PolarHBondContact O-N 3.07Å; S221-H235 VanDerWaalsContact C-CE1 3.48Å; S221-H235 PolarHBondContact O-CE1 3Å; S221-H235 PolarHBondContact O-ND1 3.22Å; S221-H235 PolarHBondContact O-NE2 2.87Å; S221-H235 VanDerWaalsContact O-NE2 3.11Å; S221-Y477 PolarHBondContact OG-OH 2.88Å; S221-E493 WeakPolarHBondContact CA-OE2 3.35Å; S221-E493 WeakPolarHBondContact CB-OE2 3.24Å; S221-E493 PolarHBondContact N-OE1 2.86Å; S221-E493 PolarHBondContact N-OE2 2.97Å; S221-E493 PolarHBondContact OG-OE2 2.94Å
222	A	90.8	Very high	89.5	Confident	21 Å²	21	39.9 Å²	39.9	17%	0.174	24%	0.239	C	C	.	.	S	Bend	trans	-136.4	-41.4	-175.9	0	0	0	0	0	114.3	F224 L448 Y477 E493	A222-F224 PolarHBondContact O-N 3.16Å; A222-L448 VanDerWaalsContact C-CD2 3.49Å; A222-L448 HydrophobicContact CB-CD1 4.18Å; A222-L448 HydrophobicContact CB-CD2 3.64Å; A222-Y477 HydrophobicContact CB-CE1 4.19Å; A222-E493 PolarHBondContact N-OE1 2.95Å; A222-E493 PolarHBondContact N-OE2 2.57Å
223	S	90.6	Very high	88.7	Confident	5 Å²	5	43.4 Å²	43.4	4%	0.035	26%	0.261	C	S	.	.	S	Bend	trans	-70.4	-31.7	-166.7	-172.4	0	0	0	0	114.3	L448 E493 R571	S223-L448 VanDerWaalsContact CA-CD2 3.49Å; S223-E493 PolarHBondContact N-OE1 3.37Å; S223-R571 PolarHBondContact O-NH2 3.11Å
224	F	92.8	Very high	88.5	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	26%	0.258	C	S	.	.			trans	-110	118.2	178.6	-73.6	-97.6	0	0	0	109.3	W180 W182 P220 A222 L238 Y240 L450 V534	W180-F224 AromaticContact CD1-CE1 3.79Å; W180-F224 AromaticContact CD2-CD1 3.59Å; W180-F224 HydrophobicContact CD2-CD1 3.59Å; W180-F224 AromaticContact CD2-CE1 3.95Å; W180-F224 HydrophobicContact CD2-CE1 3.95Å; W180-F224 AromaticContact CE2-CD1 3.76Å; W180-F224 AromaticContact CE2-CE1 3.84Å; W180-F224 AromaticContact CE3-CD1 3.9Å; W180-F224 HydrophobicContact CE3-CD1 3.9Å; W180-F224 AromaticContact CG-CD1 3.91Å; W180-F224 HydrophobicContact CG-CD1 3.91Å; W180-F224 AromaticContact CG-CE1 3.93Å; W180-F224 HydrophobicContact CG-CE1 3.93Å; W180-F224 HydrophobicContact CZ2-CD1 4.22Å; W180-F224 HydrophobicContact CZ2-CE1 4.5Å; W180-F224 HydrophobicContact CZ3-CD1 4.36Å; W180-F224 AromaticContact NE1-CE1 3.72Å; W182-F224 WeakPolarHBondContact CZ2-O 3.48Å; P220-F224 HydrophobicContact CB-CD2 4.16Å; P220-F224 HydrophobicContact CG-CD2 4.05Å; A222-F224 PolarHBondContact O-N 3.16Å; F224-L238 HydrophobicContact CB-CD2 3.82Å; F224-Y240 HydrophobicContact CD1-CD2 4.33Å; F224-Y240 HydrophobicContact CD2-CD2 4.16Å; F224-Y240 HydrophobicContact CD2-CE2 4.49Å; F224-Y240 AromaticContact CE1-CD2 3.82Å; F224-Y240 HydrophobicContact CE1-CD2 3.82Å; F224-Y240 AromaticContact CE1-CE2 3.79Å; F224-Y240 HydrophobicContact CE1-CE2 3.79Å; F224-Y240 AromaticContact CE2-CD2 3.66Å; F224-Y240 HydrophobicContact CE2-CD2 3.66Å; F224-Y240 AromaticContact CE2-CE2 3.57Å; F224-Y240 HydrophobicContact CE2-CE2 3.57Å; F224-Y240 HydrophobicContact CE2-CG 4.39Å; F224-Y240 HydrophobicContact CG-CD2 4.49Å; F224-Y240 AromaticContact CZ-CD2 3.49Å; F224-Y240 HydrophobicContact CZ-CD2 3.49Å; F224-Y240 VanDerWaalsContact CZ-CD2 3.49Å; F224-Y240 AromaticContact CZ-CE2 3.15Å; F224-Y240 HydrophobicContact CZ-CE2 3.15Å; F224-L450 HydrophobicContact CD2-CD2 3.94Å; F224-L450 HydrophobicContact CE2-CD2 3.45Å; F224-L450 VanDerWaalsContact CE2-CD2 3.45Å; F224-V534 HydrophobicContact CE2-CG1 4.42Å; F224-V534 HydrophobicContact CE2-CG2 4.4Å; F224-V534 HydrophobicContact CZ-CG1 4.37Å; F224-V534 HydrophobicContact CZ-CG2 4.44Å
225	K	90.9	Very high	88.4	Confident	137 Å²	137	41.4 Å²	41.4	60%	0.596	24%	0.243	S	C	*	.			trans	-117.3	152.5	172.6	-65.2	-176.3	-180	179	0	108.6	L227	K225-L227 PolarHBondContact O-N 2.87Å
226	P	91.1	Very high	88.4	Confident	17 Å²	17	47.6 Å²	47.6	11%	0.11	26%	0.262	C	S	.	.			trans	-54.8	134.1	173.3	-24	34.3	0	0	0	110.7	E151 W182 A230 T233	E151-P226 WeakPolarHBondContact OE1-CB 3.43Å; E151-P226 WeakPolarHBondContact OE2-CA 3.45Å; W182-P226 HydrophobicContact CD2-CG 4.02Å; W182-P226 HydrophobicContact CE3-CG 4.33Å; W182-P226 HydrophobicContact CH2-CG 4.26Å; W182-P226 HydrophobicContact CZ2-CG 3.93Å; W182-P226 HydrophobicContact CZ3-CG 4.44Å; P226-A230 HydrophobicContact CB-CB 3.78Å; P226-A230 HydrophobicContact CG-CB 3.87Å; P226-T233 HydrophobicContact CG-CG2 4.15Å
227	L	90.1	Very high	88.4	Confident	18 Å²	18	47.5 Å²	47.5	9%	0.094	26%	0.261	C	S	.	.	S	Bend	trans	-92.2	-18.3	179	-67.2	178.1	0	0	0	112.4	E151 W180 K225 R290 F559 F560 P561	E151-L227 PolarHBondContact OE1-N 3Å; E151-L227 PolarHBondContact OE2-N 3.12Å; W180-L227 HydrophobicContact CH2-CD1 3.77Å; W180-L227 HydrophobicContact CH2-CG 3.88Å; W180-L227 HydrophobicContact CZ2-CD1 3.89Å; W180-L227 HydrophobicContact CZ2-CG 4.48Å; K225-L227 PolarHBondContact O-N 2.87Å; L227-R290 PolarHBondContact O-NH1 3.19Å; L227-F559 HydrophobicContact CD1-CD1 4.24Å; L227-F559 HydrophobicContact CD1-CE1 3.45Å; L227-F559 VanDerWaalsContact CD1-CE1 3.45Å; L227-F559 HydrophobicContact CD1-CZ 3.83Å; L227-F560 HydrophobicContact CD1-CD1 4.45Å; L227-F560 HydrophobicContact CD1-CE1 4.25Å; L227-F560 HydrophobicContact CD2-CD1 3.7Å; L227-F560 HydrophobicContact CD2-CE1 4.11Å; L227-P561 HydrophobicContact CD2-CG 4.47Å
228	G	86.1	Confident	88.4	Confident	21 Å²	21	46.8 Å²	46.8	22%	0.216	26%	0.256	C	S	.	.	S	Bend	trans	-98.8	-162.5	172.6	0	0	0	0	0	112.6	E151 A230 P291	E151-G228 VanDerWaalsContact OE1-CA 3.24Å; E151-G228 WeakPolarHBondContact OE1-CA 3.47Å; E151-G228 PolarHBondContact OE1-N 2.8Å; G228-A230 PolarHBondContact O-N 2.71Å; G228-P291 CarbonylContact C-O 3.32Å; G228-P291 WeakPolarHBondContact CA-O 3.46Å
229	I	84.2	Confident	88.4	Confident	39 Å²	39	47.1 Å²	47.1	20%	0.2	26%	0.257	C	S	.	.			trans	-68.8	123.9	179	-55.3	157.3	0	0	0	110.5	R150 P291 C293 C298 T301	R150-I229 PolarHBondContact NE-O 3.48Å; R150-I229 PolarHBondContact NH2-O 2.71Å; I229-P291 PolarHBondContact N-O 2.66Å; I229-C293 HydrophobicContact CD1-CB 4.24Å; I229-C293 WeakPolarHBondContact CD1-SG 3.24Å; I229-C298 WeakPolarHBondContact CD1-SG 3.1Å; I229-T301 HydrophobicContact CD1-CG2 3.84Å
230	A	80.4	Confident	88.5	Confident	39 Å²	39	44 Å²	44	32%	0.322	24%	0.242	S	C	.	.			trans	-134.1	127.1	173.4	0	0	0	0	0	115.3	R150 P226 G228 G232	R150-A230 VanDerWaalsContact NH2-CA 3.28Å; P226-A230 HydrophobicContact CB-CB 3.78Å; P226-A230 HydrophobicContact CG-CB 3.87Å; G228-A230 PolarHBondContact O-N 2.71Å; A230-G232 PolarHBondContact O-N 3.41Å
231	N	68.5	Low	88.6	Confident	160 Å²	160	44 Å²	44	86%	0.856	24%	0.243	S	C	*	.	S	Bend	trans	-82.9	4.9	176.1	-66.2	-5.3	0	0	0	113.1
232	G	69.3	Low	88.7	Confident	43 Å²	43	43.4 Å²	43.4	44%	0.443	24%	0.238	S	C	.	.			trans	170.2	158.6	-178.6	0	0	0	0	0	111	A230	A230-G232 PolarHBondContact O-N 3.41Å
233	T	79	Confident	89	Confident	80 Å²	80	43.4 Å²	43.4	49%	0.491	24%	0.235	S	C	.	.			trans	-122	77.4	179.2	54.8	0	0	0	0	109.5	P226 H235	P226-T233 HydrophobicContact CG-CG2 4.15Å; T233-H235 PolarHBondContact O-CD2 3.33Å
234	D	89.1	Confident	89.1	Confident	61 Å²	61	44.4 Å²	44.4	33%	0.326	24%	0.241	S	C	.	.			trans	-89.4	104.3	169.1	-173.9	-8.4	0	0	0	109.1	W182 R236 F237	W182-D234 WeakPolarHBondContact CZ3-O 3.35Å; D234-R236 PolarHBondContact O-N 3.02Å; D234-R236 VanDerWaalsContact O-N 3.1Å; D234-R236 WeakPolarHBondContact OD1-CB 3.48Å; D234-R236 VanDerWaalsContact OD1-CG 3.3Å; D234-R236 WeakPolarHBondContact OD1-CG 3.46Å; D234-R236 PolarHBondContact OD1-N 3.19Å; D234-R236 VanDerWaalsContact OD1-N 3.14Å; D234-R236 IonicContact OD1-NE 3.38Å; D234-R236 PolarHBondContact OD1-NE 3.47Å; D234-R236 VanDerWaalsContact OD1-NE 3.14Å; D234-R236 IonicContact OD2-CZ 3.94Å; D234-R236 VanDerWaalsContact OD2-CZ 3.25Å; D234-R236 IonicContact OD2-NE 3.54Å; D234-R236 PolarHBondContact OD2-NE 2.7Å; D234-R236 IonicContact OD2-NH2 3.9Å; D234-R236 PolarHBondContact OD2-NH2 2.81Å; D234-F237 HydrophobicContact CB-CD2 3.94Å; D234-F237 HydrophobicContact CB-CE2 4.17Å; D234-F237 PolarHBondContact O-N 2.91Å
235	H	90.6	Very high	88.9	Confident	45 Å²	45	50.1 Å²	50.1	21%	0.208	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-64.1	-13.7	-174.7	-65	-87.6	0	0	0	113.5	W182 P220 S221 T233 F237 L238	W182-H235 AromaticContact CH2-ND1 3.78Å; P220-H235 PolarHBondContact O-ND1 2.62Å; S221-H235 VanDerWaalsContact C-CE1 3.48Å; S221-H235 PolarHBondContact O-CE1 3Å; S221-H235 PolarHBondContact O-ND1 3.22Å; S221-H235 PolarHBondContact O-NE2 2.87Å; S221-H235 VanDerWaalsContact O-NE2 3.11Å; T233-H235 PolarHBondContact O-CD2 3.33Å; H235-F237 PolarHBondContact O-N 2.92Å; H235-L238 WeakPolarHBondContact O-CB 3.4Å; H235-L238 PolarHBondContact O-N 2.76Å
236	R	92.6	Very high	89	Confident	161 Å²	161	44.7 Å²	44.7	61%	0.608	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-61.4	-24.2	174.1	-63.9	-177.6	-62.7	156.8	2.6	112.9	D234 R239	D234-R236 PolarHBondContact O-N 3.02Å; D234-R236 VanDerWaalsContact O-N 3.1Å; D234-R236 WeakPolarHBondContact OD1-CB 3.48Å; D234-R236 VanDerWaalsContact OD1-CG 3.3Å; D234-R236 WeakPolarHBondContact OD1-CG 3.46Å; D234-R236 PolarHBondContact OD1-N 3.19Å; D234-R236 VanDerWaalsContact OD1-N 3.14Å; D234-R236 IonicContact OD1-NE 3.38Å; D234-R236 PolarHBondContact OD1-NE 3.47Å; D234-R236 VanDerWaalsContact OD1-NE 3.14Å; D234-R236 IonicContact OD2-CZ 3.94Å; D234-R236 VanDerWaalsContact OD2-CZ 3.25Å; D234-R236 IonicContact OD2-NE 3.54Å; D234-R236 PolarHBondContact OD2-NE 2.7Å; D234-R236 IonicContact OD2-NH2 3.9Å; D234-R236 PolarHBondContact OD2-NH2 2.81Å; R236-R239 PolarHBondContact O-NH1 3.22Å
237	F	94.7	Very high	88.6	Confident	30 Å²	30	49.1 Å²	49.1	13%	0.132	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-91.2	2.1	176.6	-61.3	-76	0	0	0	113.6	W182 F183 Q184 D185 V187 V190 D234 H235	W182-F237 WeakPolarHBondContact CA-O 3.44Å; F183-F237 HydrophobicContact CB-CB 4.23Å; F183-F237 HydrophobicContact CB-CD1 4.27Å; F183-F237 WeakPolarHBondContact CD2-O 3.21Å; F183-F237 PolarHBondContact N-O 2.8Å; Q184-F237 VanDerWaalsContact O-CD1 3.31Å; Q184-F237 WeakPolarHBondContact O-CD1 3.31Å; Q184-F237 WeakPolarHBondContact O-CE1 3.48Å; D185-F237 HydrophobicContact CB-CE2 4.3Å; D185-F237 HydrophobicContact CB-CZ 4.21Å; V187-F237 WeakPolarHBondContact O-CE1 3.25Å; V190-F237 HydrophobicContact CG2-CD1 3.8Å; V190-F237 HydrophobicContact CG2-CE1 4.2Å; D234-F237 HydrophobicContact CB-CD2 3.94Å; D234-F237 HydrophobicContact CB-CE2 4.17Å; D234-F237 PolarHBondContact O-N 2.91Å; H235-F237 PolarHBondContact O-N 2.92Å
238	L	96.3	Very high	88.5	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	133.9	175.4	173.9	62.6	0	0	0	109.9	W180 V181 W182 P220 F224 H235	W180-L238 HydrophobicContact CE3-CD1 4.23Å; V181-L238 WeakPolarHBondContact O-CA 3.36Å; W182-L238 HydrophobicContact CD2-CB 4.14Å; W182-L238 HydrophobicContact CD2-CD1 4.17Å; W182-L238 HydrophobicContact CE3-CB 4.04Å; W182-L238 HydrophobicContact CG-CD1 4.36Å; W182-L238 HydrophobicContact CH2-CB 3.95Å; W182-L238 HydrophobicContact CH2-CD2 4.19Å; W182-L238 HydrophobicContact CZ2-CB 4.02Å; W182-L238 HydrophobicContact CZ2-CD1 4.16Å; W182-L238 HydrophobicContact CZ2-CD2 3.76Å; W182-L238 HydrophobicContact CZ2-CG 4.19Å; W182-L238 HydrophobicContact CZ3-CB 3.96Å; P220-L238 HydrophobicContact CB-CD2 4.2Å; P220-L238 HydrophobicContact CG-CD2 4.29Å; P220-L238 WeakPolarHBondContact O-CD2 3.4Å; F224-L238 HydrophobicContact CB-CD2 3.82Å; H235-L238 WeakPolarHBondContact O-CB 3.4Å; H235-L238 PolarHBondContact O-N 2.76Å
239	R	97	Very high	88.5	Confident	10 Å²	10	50 Å²	50	4%	0.038	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	134.9	163.4	-64.6	-66.5	178.9	-89.1	11.5	109.1	W180 V181 F183 V190 D191 W194 T217 E219 R236	W180-R239 CarbonylContact C-O 3.56Å; W180-R239 WeakPolarHBondContact CA-O 3.41Å; W180-R239 WeakPolarHBondContact CB-O 3.23Å; V181-R239 PolarHBondContact N-O 2.91Å; V181-R239 PolarHBondContact O-N 2.8Å; F183-R239 HydrophobicContact CE2-CG 4.12Å; V190-R239 HydrophobicContact CG1-CG 3.98Å; V190-R239 VanDerWaalsContact CG1-CZ 3.47Å; D191-R239 IonicContact OD1-CZ 3.17Å; D191-R239 IonicContact OD1-NE 3.8Å; D191-R239 PolarHBondContact OD1-NE 3.4Å; D191-R239 IonicContact OD1-NH2 2.74Å; D191-R239 PolarHBondContact OD1-NH2 2.8Å; D191-R239 IonicContact OD2-NH2 3.75Å; W194-R239 HydrophobicContact CB-CG 4.16Å; W194-R239 HydrophobicContact CD2-CB 3.66Å; W194-R239 HydrophobicContact CD2-CG 3.99Å; W194-R239 HydrophobicContact CE3-CB 3.65Å; W194-R239 HydrophobicContact CE3-CG 4.22Å; W194-R239 HydrophobicContact CG-CB 4.19Å; W194-R239 HydrophobicContact CG-CG 3.98Å; W194-R239 HydrophobicContact CH2-CB 4.03Å; W194-R239 HydrophobicContact CZ2-CB 4.05Å; W194-R239 HydrophobicContact CZ3-CB 3.86Å; T217-R239 HydrophobicContact CG2-CB 4.17Å; T217-R239 HydrophobicContact CG2-CG 4.43Å; E219-R239 IonicContact OE1-CZ 3.25Å; E219-R239 IonicContact OE1-NE 2.9Å; E219-R239 IonicContact OE1-NH1 2.68Å; E219-R239 PolarHBondContact OE1-NH1 2.75Å; E219-R239 VanDerWaalsContact OE1-NH1 3.1Å; E219-R239 IonicContact OE1-NH2 3Å; E219-R239 PolarHBondContact OE1-NH2 2.76Å; R236-R239 PolarHBondContact O-NH1 3.22Å
240	Y	97.4	Very high	88.7	Confident	4 Å²	4	51.2 Å²	51.2	2%	0.016	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	132.5	175.4	172.1	-86.5	0	0	0	109.1	E178 L179 W180 T217 V218 P220 F224 T242 L450	E178-Y240 HydrophobicContact CG-CE2 3.88Å; E178-Y240 WeakPolarHBondContact OE1-CE2 3.33Å; L179-Y240 WeakPolarHBondContact O-CA 3.37Å; W180-Y240 HydrophobicContact CB-CD2 3.75Å; W180-Y240 HydrophobicContact CB-CG 4.41Å; W180-Y240 HydrophobicContact CG-CD2 4.26Å; T217-Y240 CarbonylContact C-O 3.53Å; T217-Y240 WeakPolarHBondContact CA-O 3.3Å; V218-Y240 HydrophobicContact CG2-CD1 3.52Å; V218-Y240 HydrophobicContact CG2-CE1 4.4Å; V218-Y240 HydrophobicContact CG2-CG 4.3Å; V218-Y240 PolarHBondContact N-O 3.12Å; V218-Y240 PolarHBondContact O-N 3.08Å; P220-Y240 HydrophobicContact CG-CG 4.24Å; F224-Y240 HydrophobicContact CD1-CD2 4.33Å; F224-Y240 HydrophobicContact CD2-CD2 4.16Å; F224-Y240 HydrophobicContact CD2-CE2 4.49Å; F224-Y240 AromaticContact CE1-CD2 3.82Å; F224-Y240 HydrophobicContact CE1-CD2 3.82Å; F224-Y240 AromaticContact CE1-CE2 3.79Å; F224-Y240 HydrophobicContact CE1-CE2 3.79Å; F224-Y240 AromaticContact CE2-CD2 3.66Å; F224-Y240 HydrophobicContact CE2-CD2 3.66Å; F224-Y240 AromaticContact CE2-CE2 3.57Å; F224-Y240 HydrophobicContact CE2-CE2 3.57Å; F224-Y240 HydrophobicContact CE2-CG 4.39Å; F224-Y240 HydrophobicContact CG-CD2 4.49Å; F224-Y240 AromaticContact CZ-CD2 3.49Å; F224-Y240 HydrophobicContact CZ-CD2 3.49Å; F224-Y240 VanDerWaalsContact CZ-CD2 3.49Å; F224-Y240 AromaticContact CZ-CE2 3.15Å; F224-Y240 HydrophobicContact CZ-CE2 3.15Å; Y240-T242 HydrophobicContact CE1-CG2 3.75Å; Y240-T242 HydrophobicContact CE2-CG2 4.37Å; Y240-T242 WeakPolarHBondContact OH-CG2 3.13Å; Y240-L450 HydrophobicContact CE1-CD2 4.48Å
241	A	96.9	Very high	89.1	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.008	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	155.1	174	0	0	0	0	0	111.4	L179 W194 I212 N216	L179-A241 PolarHBondContact N-O 3.44Å; L179-A241 PolarHBondContact O-N 2.73Å; W194-A241 HydrophobicContact CH2-CB 4.45Å; W194-A241 HydrophobicContact CZ2-CB 3.78Å; I212-A241 HydrophobicContact CD1-CB 4.17Å; I212-A241 HydrophobicContact CG1-CB 4.21Å; I212-A241 HydrophobicContact CG2-CB 3.56Å; N216-A241 WeakPolarHBondContact O-CA 3.44Å; N216-A241 WeakPolarHBondContact O-CB 3.47Å
242	T	95.4	Very high	90.2	Very high	19 Å²	19	47.2 Å²	47.2	12%	0.117	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	142.9	173.9	60	0	0	0	0	110.7	A177 E178 Y240	A177-T242 CarbonylContact O-C 3.49Å; A177-T242 VanDerWaalsContact O-CA 3.31Å; A177-T242 WeakPolarHBondContact O-CA 3.19Å; E178-T242 HydrophobicContact CB-CG2 4.28Å; E178-T242 HydrophobicContact CG-CG2 4.26Å; Y240-T242 HydrophobicContact CE1-CG2 3.75Å; Y240-T242 HydrophobicContact CE2-CG2 4.37Å; Y240-T242 WeakPolarHBondContact OH-CG2 3.13Å
243	L	95.4	Very high	91.3	Very high	21 Å²	21	45.4 Å²	45.4	11%	0.11	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	87.6	172.2	-65.5	178.3	0	0	0	108.2	G176 A177 S208 F211 I212 N216 R245 E246	G176-L243 WeakPolarHBondContact CA-O 3.2Å; A177-L243 HydrophobicContact CB-CB 4.28Å; A177-L243 PolarHBondContact N-O 2.79Å; A177-L243 PolarHBondContact O-N 2.77Å; S208-L243 WeakPolarHBondContact O-CD1 3.29Å; F211-L243 HydrophobicContact CB-CD1 4.33Å; F211-L243 HydrophobicContact CB-CD2 4.27Å; I212-L243 HydrophobicContact CD1-CD1 4.38Å; I212-L243 HydrophobicContact CG1-CD1 3.79Å; I212-L243 HydrophobicContact CG1-CD2 4.24Å; I212-L243 HydrophobicContact CG1-CG 3.88Å; N216-L243 VanDerWaalsContact ND2-CD2 3.3Å; N216-L243 WeakPolarHBondContact ND2-CD2 3.26Å; L243-R245 PolarHBondContact O-N 2.94Å; L243-R245 VanDerWaalsContact O-N 3.1Å; L243-E246 HydrophobicContact CB-CB 3.87Å; L243-E246 WeakPolarHBondContact O-CB 3.41Å; L243-E246 PolarHBondContact O-N 3.35Å; L243-E246 VanDerWaalsContact O-N 3.09Å
244	P	93.1	Very high	92	Very high	27 Å²	27	45.4 Å²	45.4	18%	0.175	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-16.5	-176.4	26.3	-35.7	0	0	0	113.6
245	R	89.5	Confident	92.2	Very high	119 Å²	119	43.4 Å²	43.4	45%	0.449	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-10.4	177.4	-65.3	-174.4	80.7	-156.7	15.2	114.1	L243 I247 T521 Y529	L243-R245 PolarHBondContact O-N 2.94Å; L243-R245 VanDerWaalsContact O-N 3.1Å; R245-I247 PolarHBondContact O-N 2.87Å; R245-T521 VanDerWaalsContact NH1-CB 3.29Å; R245-T521 VanDerWaalsContact NH2-CB 3.34Å; R245-T521 PolarHBondContact NH2-OG1 3.49Å; R245-Y529 HydrophobicContact CG-CD2 3.44Å; R245-Y529 VanDerWaalsContact CG-CD2 3.44Å; R245-Y529 HydrophobicContact CG-CE2 4.2Å; R245-Y529 HydrophobicContact CG-CG 4.03Å
246	E	92.2	Very high	92.4	Very high	23 Å²	23	41.3 Å²	41.3	11%	0.107	20%	0.204	C	C	.	.			trans	-71.9	104.7	-179.1	-177.9	62.7	-174.9	0	0	109.1	G176 A177 A207 S208 L243	G176-E246 VanDerWaalsContact CA-O 3.3Å; G176-E246 WeakPolarHBondContact CA-O 3.47Å; A177-E246 HydrophobicContact CB-CB 3.8Å; A177-E246 HydrophobicContact CB-CG 3.8Å; A207-E246 WeakPolarHBondContact CA-OE1 3.41Å; A207-E246 WeakPolarHBondContact CB-OE1 3.39Å; S208-E246 WeakPolarHBondContact CB-OE2 3.45Å; S208-E246 PolarHBondContact N-OE1 2.92Å; S208-E246 PolarHBondContact OG-OE1 3.01Å; S208-E246 PolarHBondContact OG-OE2 3.42Å; L243-E246 HydrophobicContact CB-CB 3.87Å; L243-E246 WeakPolarHBondContact O-CB 3.41Å; L243-E246 PolarHBondContact O-N 3.35Å; L243-E246 VanDerWaalsContact O-N 3.09Å
247	I	82.7	Confident	92.5	Very high	111 Å²	111	35 Å²	35	57%	0.569	18%	0.181	S	C	*	.			trans	-77.4	141.6	-179.5	-58.3	170.8	0	0	0	108.5	R245 C249	R245-I247 PolarHBondContact O-N 2.87Å; I247-C249 PolarHBondContact O-N 2.96Å
248	V	87.4	Confident	92.5	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.024	21%	0.209	C	C	.	.			trans	-75.2	121	170.4	-163.7	0	0	0	0	108.8	F156 T157 Q158 F278 Q285	F156-V248 VanDerWaalsContact C-CG2 3.47Å; F156-V248 HydrophobicContact CB-CG1 4.31Å; F156-V248 HydrophobicContact CB-CG2 3.93Å; T157-V248 VanDerWaalsContact N-CG2 3.35Å; Q158-V248 HydrophobicContact CB-CB 4.16Å; Q158-V248 HydrophobicContact CB-CG2 3.92Å; V248-F278 HydrophobicContact CB-CE1 4.18Å; V248-F278 HydrophobicContact CG1-CE1 3.85Å; V248-F278 HydrophobicContact CG1-CZ 4.15Å; V248-F278 WeakPolarHBondContact O-CE1 3.37Å; V248-Q285 HydrophobicContact CG1-CG 4.48Å
249	C	86.9	Confident	92.5	Very high	53 Å²	53	41.8 Å²	41.8	36%	0.358	21%	0.211	S	C	.	.			trans	-106.8	158.5	179	-62.3	0	0	0	0	110.6	I247 E251 N252 F278	I247-C249 PolarHBondContact O-N 2.96Å; C249-E251 HydrophobicContact CB-CB 4.44Å; C249-E251 VanDerWaalsContact CB-OE2 3.29Å; C249-E251 WeakPolarHBondContact CB-OE2 3.41Å; C249-E251 PolarHBondContact O-N 3.31Å; C249-E251 VanDerWaalsContact O-N 3.15Å; C249-N252 WeakPolarHBondContact CA-OD1 3.3Å; C249-N252 WeakPolarHBondContact CB-OD1 3.07Å; C249-N252 PolarHBondContact N-OD1 3.01Å; C249-N252 WeakPolarHBondContact O-CB 3.33Å; C249-N252 PolarHBondContact O-N 3.48Å; C249-N252 PolarHBondContact O-OD1 3.47Å; C249-N252 VanDerWaalsContact O-OD1 3.12Å; C249-F278 VanDerWaalsContact C-CZ 3.47Å; C249-F278 VanDerWaalsContact O-CZ 3.23Å; C249-F278 WeakPolarHBondContact O-CZ 3.43Å
250	T	88.3	Confident	92.4	Very high	64 Å²	64	41.7 Å²	41.7	39%	0.393	21%	0.211	S	C	.	.	H	α-helix	trans	-60.6	-26.5	177.5	64.7	0	0	0	0	112.6	N252 L253 F278	T250-N252 VanDerWaalsContact C-N 3.28Å; T250-N252 PolarHBondContact O-N 3.47Å; T250-L253 PolarHBondContact O-N 3.07Å; T250-F278 HydrophobicContact CG2-CD1 4.46Å; T250-F278 HydrophobicContact CG2-CD2 3.78Å; T250-F278 HydrophobicContact CG2-CE2 3.93Å; T250-F278 HydrophobicContact CG2-CG 4.08Å; T250-F278 HydrophobicContact CG2-CZ 4.33Å
251	E	88.3	Confident	92.2	Very high	115 Å²	115	43.3 Å²	43.3	54%	0.537	22%	0.222	S	C	.	.	H	α-helix	trans	-65.8	-28	177.7	-67.6	82.1	169	0	0	111.6	C249 P255	C249-E251 HydrophobicContact CB-CB 4.44Å; C249-E251 VanDerWaalsContact CB-OE2 3.29Å; C249-E251 WeakPolarHBondContact CB-OE2 3.41Å; C249-E251 PolarHBondContact O-N 3.31Å; C249-E251 VanDerWaalsContact O-N 3.15Å; E251-P255 WeakPolarHBondContact O-CD 3.03Å; E251-P255 WeakPolarHBondContact O-CG 3.46Å
252	N	92.3	Very high	92.1	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-75.9	-27.8	176.7	-53.4	102.4	0	0	0	112.6	F205 C206 C249 T250 P255 W256 Q285	F205-N252 PolarHBondContact O-ND2 3.25Å; C206-N252 PolarHBondContact O-ND2 3.35Å; C249-N252 WeakPolarHBondContact CA-OD1 3.3Å; C249-N252 WeakPolarHBondContact CB-OD1 3.07Å; C249-N252 PolarHBondContact N-OD1 3.01Å; C249-N252 WeakPolarHBondContact O-CB 3.33Å; C249-N252 PolarHBondContact O-N 3.48Å; C249-N252 PolarHBondContact O-OD1 3.47Å; C249-N252 VanDerWaalsContact O-OD1 3.12Å; T250-N252 VanDerWaalsContact C-N 3.28Å; T250-N252 PolarHBondContact O-N 3.47Å; N252-P255 WeakPolarHBondContact O-CD 3.27Å; N252-P255 WeakPolarHBondContact O-CG 3.47Å; N252-W256 WeakPolarHBondContact O-CB 3.48Å; N252-W256 PolarHBondContact O-N 3.03Å; N252-Q285 PolarHBondContact O-NE2 2.71Å
253	L	92.9	Very high	91.8	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-70.5	-36.3	-177.9	-178.3	63.7	0	0	0	111.5	T250 W256 K257 L277 F278 L309	T250-L253 PolarHBondContact O-N 3.07Å; L253-W256 HydrophobicContact CD1-CE3 4.31Å; L253-W256 PolarHBondContact O-N 3.11Å; L253-K257 HydrophobicContact CD1-CD 4.1Å; L253-K257 HydrophobicContact CD1-CG 4.03Å; L253-K257 HydrophobicContact CD2-CD 4.36Å; L253-K257 HydrophobicContact CG-CD 3.88Å; L253-K257 HydrophobicContact CG-CG 4.19Å; L253-K257 WeakPolarHBondContact O-CB 3.17Å; L253-K257 VanDerWaalsContact O-CG 3.29Å; L253-K257 WeakPolarHBondContact O-CG 3.4Å; L253-K257 PolarHBondContact O-N 2.77Å; L253-L277 HydrophobicContact CD1-CD1 4.48Å; L253-L277 HydrophobicContact CD2-CD1 3.76Å; L253-F278 HydrophobicContact CB-CE2 4.43Å; L253-F278 HydrophobicContact CD2-CE2 4.34Å; L253-L309 HydrophobicContact CD1-CD1 3.82Å
254	T	92.1	Very high	91.5	Very high	79 Å²	79	46.1 Å²	46.1	49%	0.485	25%	0.247	S	C	.	.	H	α-helix	trans	-60.7	-53.8	-179.4	-61	0	0	0	0	113.3	W256 K257 K258	T254-W256 VanDerWaalsContact C-N 3.32Å; T254-W256 PolarHBondContact O-N 2.63Å; T254-K257 PolarHBondContact O-N 3.4Å; T254-K258 WeakPolarHBondContact O-CG 3.13Å; T254-K258 PolarHBondContact O-N 3.4Å; T254-K258 VanDerWaalsContact O-N 3.1Å
255	P	94	Very high	91.5	Very high	20 Å²	20	53.6 Å²	53.6	13%	0.13	28%	0.277	C	S	.	.	H	α-helix	trans	-64.4	-36.5	175.4	24.3	-31.1	0	0	0	112	I204 E251 N252 K257 K258 L259	I204-P255 WeakPolarHBondContact O-CB 3.18Å; E251-P255 WeakPolarHBondContact O-CD 3.03Å; E251-P255 WeakPolarHBondContact O-CG 3.46Å; N252-P255 WeakPolarHBondContact O-CD 3.27Å; N252-P255 WeakPolarHBondContact O-CG 3.47Å; P255-K257 PolarHBondContact O-N 3.29Å; P255-K258 WeakPolarHBondContact O-CB 3.21Å; P255-K258 PolarHBondContact O-N 3.26Å; P255-K258 VanDerWaalsContact O-N 3.17Å; P255-L259 PolarHBondContact O-N 3.16Å
256	W	95.3	Very high	91.7	Very high	1 Å²	1	48.1 Å²	48.1	0%	0.004	26%	0.257	C	S	.	.	H	α-helix	trans	-59.5	-45.5	175.7	-174.6	98.2	0	0	0	111.9	F116 N252 L253 T254 K258 L259 L260 L272 A286 Q307 T308 L309	F116-W256 AromaticContact CD2-CH2 3.79Å; F116-W256 HydrophobicContact CD2-CH2 3.79Å; F116-W256 AromaticContact CE2-CH2 3.75Å; F116-W256 HydrophobicContact CE2-CH2 3.75Å; F116-W256 HydrophobicContact CE2-CZ3 4.3Å; N252-W256 WeakPolarHBondContact O-CB 3.48Å; N252-W256 PolarHBondContact O-N 3.03Å; L253-W256 HydrophobicContact CD1-CE3 4.31Å; L253-W256 PolarHBondContact O-N 3.11Å; T254-W256 VanDerWaalsContact C-N 3.32Å; T254-W256 PolarHBondContact O-N 2.63Å; W256-K258 VanDerWaalsContact C-N 3.32Å; W256-K258 PolarHBondContact O-N 3.25Å; W256-L259 WeakPolarHBondContact O-CB 3.41Å; W256-L259 PolarHBondContact O-N 2.87Å; W256-L260 HydrophobicContact CZ3-CD1 4.01Å; W256-L272 HydrophobicContact CH2-CD1 4.26Å; W256-L272 HydrophobicContact CZ3-CD1 3.6Å; W256-A286 PolarHBondContact NE1-O 2.85Å; W256-Q307 HydrophobicContact CH2-CB 4.24Å; W256-Q307 HydrophobicContact CZ2-CB 3.59Å; W256-Q307 PolarHBondContact O-NE2 2.84Å; W256-T308 WeakPolarHBondContact CZ2-O 3.4Å; W256-L309 HydrophobicContact CH2-CB 3.96Å; W256-L309 HydrophobicContact CH2-CD1 4.45Å; W256-L309 HydrophobicContact CZ2-CB 4.12Å; W256-L309 HydrophobicContact CZ3-CD1 4.42Å
257	K	94.9	Very high	91.8	Very high	27 Å²	27	47.1 Å²	47.1	12%	0.117	25%	0.253	C	S	.	.	H	α-helix	trans	-67.7	-29	176.5	-70.7	-179.7	72.6	176.9	0	113.1	L253 T254 P255 L259 L260 S264 A269 L272	L253-K257 HydrophobicContact CD1-CD 4.1Å; L253-K257 HydrophobicContact CD1-CG 4.03Å; L253-K257 HydrophobicContact CD2-CD 4.36Å; L253-K257 HydrophobicContact CG-CD 3.88Å; L253-K257 HydrophobicContact CG-CG 4.19Å; L253-K257 WeakPolarHBondContact O-CB 3.17Å; L253-K257 VanDerWaalsContact O-CG 3.29Å; L253-K257 WeakPolarHBondContact O-CG 3.4Å; L253-K257 PolarHBondContact O-N 2.77Å; T254-K257 PolarHBondContact O-N 3.4Å; P255-K257 PolarHBondContact O-N 3.29Å; K257-L259 PolarHBondContact O-N 3.47Å; K257-L260 WeakPolarHBondContact O-CB 3.46Å; K257-L260 PolarHBondContact O-N 3.09Å; K257-S264 VanDerWaalsContact CE-CB 3.46Å; K257-S264 VanDerWaalsContact NZ-CB 3.29Å; K257-A269 WeakPolarHBondContact CE-O 3.41Å; K257-A269 PolarHBondContact NZ-O 2.92Å; K257-L272 HydrophobicContact CD-CB 4.01Å; K257-L272 HydrophobicContact CG-CD1 4.36Å; K257-L272 PolarHBondContact NZ-O 2.03Å
258	K	94.3	Very high	92.4	Very high	165 Å²	165	41.8 Å²	41.8	72%	0.717	23%	0.226	S	C	*	.	H	α-helix	trans	-66.3	-18.7	176.6	-77.7	177.3	179	177.9	0	113.1	T254 P255 W256 L260	T254-K258 WeakPolarHBondContact O-CG 3.13Å; T254-K258 PolarHBondContact O-N 3.4Å; T254-K258 VanDerWaalsContact O-N 3.1Å; P255-K258 WeakPolarHBondContact O-CB 3.21Å; P255-K258 PolarHBondContact O-N 3.26Å; P255-K258 VanDerWaalsContact O-N 3.17Å; W256-K258 VanDerWaalsContact C-N 3.32Å; W256-K258 PolarHBondContact O-N 3.25Å; K258-L260 VanDerWaalsContact C-N 3.29Å
259	L	95.3	Very high	92.8	Very high	9 Å²	9	41.8 Å²	41.8	5%	0.047	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-18.8	176.2	-58.8	172.8	0	0	0	112.9	P137 L140 F205 P255 W256 K257 V287	P137-L259 HydrophobicContact CB-CB 4.29Å; P137-L259 HydrophobicContact CB-CD2 3.6Å; P137-L259 HydrophobicContact CG-CB 4.2Å; P137-L259 HydrophobicContact CG-CD2 3.9Å; L140-L259 HydrophobicContact CD1-CD1 3.75Å; L140-L259 HydrophobicContact CD1-CD2 3.84Å; L140-L259 HydrophobicContact CD1-CG 4.36Å; L140-L259 HydrophobicContact CG-CD2 3.9Å; F205-L259 HydrophobicContact CE1-CD1 3.96Å; F205-L259 HydrophobicContact CZ-CD1 4.2Å; P255-L259 PolarHBondContact O-N 3.16Å; W256-L259 WeakPolarHBondContact O-CB 3.41Å; W256-L259 PolarHBondContact O-N 2.87Å; K257-L259 PolarHBondContact O-N 3.47Å; L259-V287 HydrophobicContact CD1-CG2 4.18Å
260	L	96.1	Very high	93.1	Very high	8 Å²	8	40.1 Å²	40.1	4%	0.042	21%	0.214	C	C	.	.	S	Bend	trans	-78.1	138.3	-179.1	-61.9	172.3	0	0	0	111	F96 F116 W256 K257 K258 C262 G263 A269	F96-L260 HydrophobicContact CE2-CD2 4.37Å; F96-L260 HydrophobicContact CZ-CD2 4.42Å; F116-L260 HydrophobicContact CB-CD2 3.59Å; F116-L260 HydrophobicContact CD1-CD1 4.47Å; F116-L260 HydrophobicContact CD1-CD2 3.84Å; F116-L260 HydrophobicContact CD2-CD1 4.39Å; F116-L260 HydrophobicContact CD2-CD2 3.9Å; F116-L260 HydrophobicContact CE1-CD1 4.33Å; F116-L260 HydrophobicContact CE1-CD2 4.49Å; F116-L260 HydrophobicContact CE2-CD1 4.26Å; F116-L260 HydrophobicContact CG-CD1 4.5Å; F116-L260 HydrophobicContact CG-CD2 3.5Å; F116-L260 VanDerWaalsContact CG-CD2 3.5Å; F116-L260 HydrophobicContact CZ-CD1 4.22Å; W256-L260 HydrophobicContact CZ3-CD1 4.01Å; K257-L260 WeakPolarHBondContact O-CB 3.46Å; K257-L260 PolarHBondContact O-N 3.09Å; K258-L260 VanDerWaalsContact C-N 3.29Å; L260-C262 VanDerWaalsContact C-N 3.34Å; L260-C262 PolarHBondContact O-N 3.1Å; L260-G263 PolarHBondContact O-N 2.86Å; L260-A269 HydrophobicContact CD1-CB 3.69Å
261	P	93.9	Very high	93.5	Very high	37 Å²	37	37 Å²	37	24%	0.24	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-40.9	-178.7	-27.9	35.3	0	0	0	114.6	F96 L135 G263 L341	F96-P261 HydrophobicContact CB-CG 4.36Å; F96-P261 HydrophobicContact CD1-CG 4.17Å; F96-P261 HydrophobicContact CD2-CG 3.76Å; F96-P261 HydrophobicContact CE1-CG 4.45Å; F96-P261 HydrophobicContact CE2-CG 4.03Å; F96-P261 HydrophobicContact CG-CG 3.84Å; F96-P261 HydrophobicContact CZ-CG 4.38Å; L135-P261 HydrophobicContact CB-CG 4.39Å; L135-P261 HydrophobicContact CD2-CB 4.25Å; P261-G263 VanDerWaalsContact C-N 3.34Å; P261-L341 HydrophobicContact CB-CB 4.34Å; P261-L341 HydrophobicContact CB-CD1 3.73Å
262	C	93.1	Very high	93.7	Very high	20 Å²	20	31.7 Å²	31.7	14%	0.135	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	1	176.8	-73.7	0	0	0	0	113.7	L260 S264 K265 A266 C339 P340	L260-C262 VanDerWaalsContact C-N 3.34Å; L260-C262 PolarHBondContact O-N 3.1Å; C262-S264 PolarHBondContact O-N 2.78Å; C262-K265 PolarHBondContact O-N 2.79Å; C262-A266 HydrophobicContact CB-CB 4.47Å; C262-C339 HydrophobicContact CB-CB 3.81Å; C262-C339 WeakPolarHBondContact CB-SG 3.4Å; C262-C339 VanDerWaalsContact SG-CA 3.58Å; C262-C339 WeakPolarHBondContact SG-CB 3.44Å; C262-C339 CovalentContact SG-SG 2.03Å; C262-C339 PolarHBondContact SG-SG 2.83Å; C262-P340 VanDerWaalsContact SG-CD 3.59Å
263	G	90.9	Very high	93.6	Very high	20 Å²	20	34.6 Å²	34.6	21%	0.206	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	-122	-176.5	0	0	0	0	0	112.3	L260 P261 A269	L260-G263 PolarHBondContact O-N 2.86Å; P261-G263 VanDerWaalsContact C-N 3.34Å; G263-A269 WeakPolarHBondContact O-CB 3.32Å
264	S	89.1	Confident	93.4	Very high	60 Å²	60	36.9 Å²	36.9	42%	0.42	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	10.7	177.9	60.9	0	0	0	0	114.1	K257 C262	K257-S264 VanDerWaalsContact CE-CB 3.46Å; K257-S264 VanDerWaalsContact NZ-CB 3.29Å; C262-S264 PolarHBondContact O-N 2.78Å
265	K	91.8	Very high	93.2	Very high	184 Å²	184	39 Å²	39	80%	0.8	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-36.5	-167.9	-64.3	-177.7	179.6	179.6	0	113.1	C262	C262-K265 PolarHBondContact O-N 2.79Å
266	A	93.7	Very high	92.8	Very high	5 Å²	5	41.7 Å²	41.7	4%	0.041	21%	0.213	C	C	.	.	S	Bend	trans	-141.7	162.9	-176.4	0	0	0	0	0	111.1	C262 E337	C262-A266 HydrophobicContact CB-CB 4.47Å; A266-E337 HydrophobicContact CB-CG 4.14Å; A266-E337 WeakPolarHBondContact CB-OE1 3.31Å
267	G	94.5	Very high	92.5	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.01	21%	0.213	C	C	.	.	S	Bend	trans	74.3	-160.4	178.6	0	0	0	0	0	114.1	E98 A269 V270 L335 E337	E98-G267 WeakPolarHBondContact OE1-CA 3.3Å; G267-A269 PolarHBondContact O-N 3.09Å; G267-V270 WeakPolarHBondContact O-CB 3.38Å; G267-V270 WeakPolarHBondContact O-CG2 3.25Å; G267-V270 PolarHBondContact O-N 2.75Å; G267-L335 WeakPolarHBondContact O-CD2 3.22Å; G267-E337 PolarHBondContact N-O 2.74Å
268	L	96.2	Very high	92.1	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-66.9	-26.4	-173.6	-67.5	175.1	0	0	0	112.7	E98 E99 L100 F114 F116 V270 L271 L335 I347 L386	E98-L268 HydrophobicContact CB-CD1 4Å; E98-L268 HydrophobicContact CG-CD1 3.94Å; E98-L268 HydrophobicContact CG-CG 4.17Å; E98-L268 PolarHBondContact OE2-N 3.46Å; E99-L268 VanDerWaalsContact CA-CD1 3.48Å; L100-L268 HydrophobicContact CB-CD1 3.86Å; L100-L268 HydrophobicContact CB-CD2 3.99Å; L100-L268 HydrophobicContact CD2-CD2 4.38Å; F114-L268 HydrophobicContact CD1-CB 4.26Å; F114-L268 HydrophobicContact CE1-CB 4.39Å; F116-L268 HydrophobicContact CE1-CB 4.06Å; F116-L268 HydrophobicContact CZ-CB 4.12Å; L268-V270 PolarHBondContact O-N 2.82Å; L268-V270 VanDerWaalsContact O-N 3.09Å; L268-L271 WeakPolarHBondContact O-CB 3.26Å; L268-L271 PolarHBondContact O-N 2.9Å; L268-L271 VanDerWaalsContact O-N 3.09Å; L268-L335 HydrophobicContact CD2-CD1 3.91Å; L268-L335 HydrophobicContact CD2-CD2 4.43Å; L268-I347 HydrophobicContact CD2-CD1 4.31Å; L268-I347 HydrophobicContact CD2-CG1 3.97Å; L268-L386 HydrophobicContact CD2-CD1 3.55Å; L268-L386 HydrophobicContact CG-CD1 4.07Å
269	A	95.1	Very high	91.7	Very high	3 Å²	3	41.7 Å²	41.7	3%	0.025	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-63.6	-15.1	178.8	0	0	0	0	0	114.1	F116 K257 L260 G263 G267 L271 L272	F116-A269 HydrophobicContact CE1-CB 4.49Å; F116-A269 HydrophobicContact CZ-CB 4.35Å; K257-A269 WeakPolarHBondContact CE-O 3.41Å; K257-A269 PolarHBondContact NZ-O 2.92Å; L260-A269 HydrophobicContact CD1-CB 3.69Å; G263-A269 WeakPolarHBondContact O-CB 3.32Å; G267-A269 PolarHBondContact O-N 3.09Å; A269-L271 VanDerWaalsContact C-N 3.27Å; A269-L271 PolarHBondContact O-N 3.19Å; A269-L272 HydrophobicContact CB-CD1 4.33Å; A269-L272 WeakPolarHBondContact O-CB 3.35Å; A269-L272 PolarHBondContact O-N 2.99Å
270	V	94.4	Very high	91.4	Very high	18 Å²	18	42.2 Å²	42.2	11%	0.109	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-64.6	-32.1	173.9	172.6	0	0	0	0	111.6	G267 L268 L272 R333	G267-V270 WeakPolarHBondContact O-CB 3.38Å; G267-V270 WeakPolarHBondContact O-CG2 3.25Å; G267-V270 PolarHBondContact O-N 2.75Å; L268-V270 PolarHBondContact O-N 2.82Å; L268-V270 VanDerWaalsContact O-N 3.09Å; V270-L272 PolarHBondContact O-N 2.84Å; V270-R333 WeakPolarHBondContact O-CD 3.36Å; V270-R333 PolarHBondContact O-NH1 3.46Å
271	L	94.7	Very high	91.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-71.8	-17.8	178.4	-62.7	176	0	0	0	112.8	L100 F114 L268 A269 K273 L327 F331 R333 L335	L100-L271 HydrophobicContact CD2-CD1 3.97Å; F114-L271 HydrophobicContact CE1-CB 4.24Å; F114-L271 HydrophobicContact CE1-CD1 4.12Å; F114-L271 HydrophobicContact CZ-CB 4.17Å; F114-L271 HydrophobicContact CZ-CD1 4.27Å; L268-L271 WeakPolarHBondContact O-CB 3.26Å; L268-L271 PolarHBondContact O-N 2.9Å; L268-L271 VanDerWaalsContact O-N 3.09Å; A269-L271 VanDerWaalsContact C-N 3.27Å; A269-L271 PolarHBondContact O-N 3.19Å; L271-K273 VanDerWaalsContact C-N 3.31Å; L271-K273 PolarHBondContact O-N 2.8Å; L271-L327 HydrophobicContact CD1-CD2 4.23Å; L271-F331 HydrophobicContact CB-CB 3.98Å; L271-F331 HydrophobicContact CB-CD1 4.24Å; L271-F331 HydrophobicContact CB-CD2 4.25Å; L271-F331 HydrophobicContact CB-CG 3.9Å; L271-F331 HydrophobicContact CD1-CD2 4.23Å; L271-F331 HydrophobicContact CD2-CB 3.99Å; L271-F331 HydrophobicContact CD2-CD2 4.33Å; L271-F331 HydrophobicContact CD2-CG 4.39Å; L271-F331 WeakPolarHBondContact O-CB 3.31Å; L271-F331 WeakPolarHBondContact O-CD1 3.44Å; L271-R333 HydrophobicContact CD2-CB 4.19Å; L271-L335 HydrophobicContact CD1-CD1 4.06Å; L271-L335 HydrophobicContact CD1-CD2 4.01Å; L271-L335 HydrophobicContact CD1-CG 4.05Å; L271-L335 HydrophobicContact CD2-CD2 4.19Å; L271-L335 HydrophobicContact CD2-CG 4.15Å; L271-L335 HydrophobicContact CG-CD2 3.8Å; L271-L335 HydrophobicContact CG-CG 4.14Å
272	L	93.4	Very high	91.2	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	22%	0.222	C	C	.	.			trans	-79.4	75.3	-173.7	-53.8	-179.2	0	0	0	111.8	F114 F116 W256 K257 A269 V270 L277 L309	F114-L272 HydrophobicContact CD1-CD2 4.07Å; F114-L272 HydrophobicContact CD2-CD2 3.95Å; F114-L272 HydrophobicContact CE1-CD2 3.93Å; F114-L272 HydrophobicContact CE2-CD2 3.83Å; F114-L272 HydrophobicContact CG-CD2 4.07Å; F114-L272 HydrophobicContact CZ-CD2 3.82Å; F116-L272 HydrophobicContact CE2-CD1 4.3Å; F116-L272 HydrophobicContact CZ-CD1 4.37Å; W256-L272 HydrophobicContact CH2-CD1 4.26Å; W256-L272 HydrophobicContact CZ3-CD1 3.6Å; K257-L272 HydrophobicContact CD-CB 4.01Å; K257-L272 HydrophobicContact CG-CD1 4.36Å; K257-L272 PolarHBondContact NZ-O 2.03Å; A269-L272 HydrophobicContact CB-CD1 4.33Å; A269-L272 WeakPolarHBondContact O-CB 3.35Å; A269-L272 PolarHBondContact O-N 2.99Å; V270-L272 PolarHBondContact O-N 2.84Å; L272-L277 HydrophobicContact CB-CD1 4.29Å; L272-L277 HydrophobicContact CD2-CD1 4.48Å; L272-L309 HydrophobicContact CD1-CD1 4.39Å; L272-L309 HydrophobicContact CD2-CD1 4.03Å; L272-L309 HydrophobicContact CD2-CD2 3.85Å; L272-L309 HydrophobicContact CD2-CG 4.49Å
273	K	90.4	Very high	91.2	Very high	63 Å²	63	41.5 Å²	41.5	27%	0.274	22%	0.216	S	C	.	.			trans	-96.1	128.5	173.2	-84.1	-170.8	169.5	174.5	0	111	L271 E275 K276 L277 S332 R333	L271-K273 VanDerWaalsContact C-N 3.31Å; L271-K273 PolarHBondContact O-N 2.8Å; K273-E275 PolarHBondContact O-N 2.83Å; K273-K276 PolarHBondContact O-N 2.87Å; K273-L277 WeakPolarHBondContact O-CG 3.45Å; K273-L277 PolarHBondContact O-N 2.83Å; K273-S332 PolarHBondContact NZ-O 3.38Å; K273-R333 HydrophobicContact CD-CG 4.13Å
274	S	89.5	Confident	91.4	Very high	53 Å²	53	40.5 Å²	40.5	37%	0.371	21%	0.206	S	C	.	.	H	α-helix	trans	-55	-50.6	179.2	48.3	0	0	0	0	112.3	K276 L277 F278	S274-K276 VanDerWaalsContact C-N 3.28Å; S274-K276 PolarHBondContact O-N 2.84Å; S274-K276 VanDerWaalsContact O-N 3.07Å; S274-L277 PolarHBondContact O-N 2.86Å; S274-F278 VanDerWaalsContact O-CD2 3.27Å; S274-F278 WeakPolarHBondContact O-CD2 3.44Å; S274-F278 PolarHBondContact O-N 2.89Å
275	E	86.5	Confident	91.7	Very high	124 Å²	124	37.7 Å²	37.7	58%	0.579	19%	0.186	S	C	*	.	H	α-helix	trans	-46.8	-47.7	-175.8	-170.5	-171.9	166.5	0	0	113.3	K273 H279	K273-E275 PolarHBondContact O-N 2.83Å; E275-H279 PolarHBondContact O-CD2 2.87Å
276	K	86.9	Confident	92	Very high	75 Å²	75	29 Å²	29	33%	0.326	15%	0.148	S	C	.	.	H	α-helix	trans	-80.4	-34.5	179.3	-69.7	-61.5	-176.2	-172.9	0	114.2	K273 S274 H279 M330 S332	K273-K276 PolarHBondContact O-N 2.87Å; S274-K276 VanDerWaalsContact C-N 3.28Å; S274-K276 PolarHBondContact O-N 2.84Å; S274-K276 VanDerWaalsContact O-N 3.07Å; K276-H279 PolarHBondContact O-N 2.84Å; K276-M330 WeakPolarHBondContact CB-O 3.49Å; K276-M330 WeakPolarHBondContact CG-O 3.18Å; K276-S332 WeakPolarHBondContact CE-OG 3.17Å; K276-S332 VanDerWaalsContact CG-OG 3.23Å; K276-S332 WeakPolarHBondContact CG-OG 3.18Å
277	L	88.4	Confident	92.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.7	-40.8	-177.9	-69.1	174.3	0	0	0	112	L253 L272 K273 S274 H279 S280 L309 V311 F331	L253-L277 HydrophobicContact CD1-CD1 4.48Å; L253-L277 HydrophobicContact CD2-CD1 3.76Å; L272-L277 HydrophobicContact CB-CD1 4.29Å; L272-L277 HydrophobicContact CD2-CD1 4.48Å; K273-L277 WeakPolarHBondContact O-CG 3.45Å; K273-L277 PolarHBondContact O-N 2.83Å; S274-L277 PolarHBondContact O-N 2.86Å; L277-H279 VanDerWaalsContact C-N 3.32Å; L277-H279 PolarHBondContact O-N 2.73Å; L277-S280 VanDerWaalsContact O-CB 3.26Å; L277-S280 WeakPolarHBondContact O-CB 3.47Å; L277-S280 PolarHBondContact O-N 2.81Å; L277-S280 PolarHBondContact O-OG 3.39Å; L277-L309 HydrophobicContact CD1-CD1 4.25Å; L277-L309 HydrophobicContact CD2-CD2 4.09Å; L277-V311 HydrophobicContact CD2-CB 4.43Å; L277-V311 HydrophobicContact CD2-CG1 4.14Å; L277-V311 HydrophobicContact CD2-CG2 3.49Å; L277-V311 VanDerWaalsContact CD2-CG2 3.49Å; L277-F331 HydrophobicContact CD2-CD1 4.46Å; L277-F331 HydrophobicContact CD2-CE1 4.17Å
278	F	85.4	Confident	92.3	Very high	34 Å²	34	29.5 Å²	29.5	15%	0.149	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-7.4	-176.5	-71.6	-90	0	0	0	113.9	V248 C249 T250 L253 S274	V248-F278 HydrophobicContact CB-CE1 4.18Å; V248-F278 HydrophobicContact CG1-CE1 3.85Å; V248-F278 HydrophobicContact CG1-CZ 4.15Å; V248-F278 WeakPolarHBondContact O-CE1 3.37Å; C249-F278 VanDerWaalsContact C-CZ 3.47Å; C249-F278 VanDerWaalsContact O-CZ 3.23Å; C249-F278 WeakPolarHBondContact O-CZ 3.43Å; T250-F278 HydrophobicContact CG2-CD1 4.46Å; T250-F278 HydrophobicContact CG2-CD2 3.78Å; T250-F278 HydrophobicContact CG2-CE2 3.93Å; T250-F278 HydrophobicContact CG2-CG 4.08Å; T250-F278 HydrophobicContact CG2-CZ 4.33Å; L253-F278 HydrophobicContact CB-CE2 4.43Å; L253-F278 HydrophobicContact CD2-CE2 4.34Å; S274-F278 VanDerWaalsContact O-CD2 3.27Å; S274-F278 WeakPolarHBondContact O-CD2 3.44Å; S274-F278 PolarHBondContact O-N 2.89Å
279	H	86.4	Confident	92.3	Very high	160 Å²	160	29.5 Å²	29.5	74%	0.741	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.2	4.1	168.6	-74.2	-52.1	0	0	0	113.3	E275 K276 L277	E275-H279 PolarHBondContact O-CD2 2.87Å; K276-H279 PolarHBondContact O-N 2.84Å; L277-H279 VanDerWaalsContact C-N 3.32Å; L277-H279 PolarHBondContact O-N 2.73Å
280	S	90	Very high	92.2	Very high	20 Å²	20	30.2 Å²	30.2	14%	0.14	15%	0.152	C	C	.	.	S	Bend	trans	-78.1	162.2	177.2	72.3	0	0	0	0	112	L277 F282 V311 V312	L277-S280 VanDerWaalsContact O-CB 3.26Å; L277-S280 WeakPolarHBondContact O-CB 3.47Å; L277-S280 PolarHBondContact O-N 2.81Å; L277-S280 PolarHBondContact O-OG 3.39Å; S280-F282 VanDerWaalsContact C-N 3.3Å; S280-F282 PolarHBondContact OG-O 2.86Å; S280-F282 VanDerWaalsContact OG-O 3.11Å; S280-V311 VanDerWaalsContact CB-CG1 3.44Å; S280-V311 WeakPolarHBondContact OG-CG1 3.49Å; S280-V312 WeakPolarHBondContact CB-O 3.39Å
281	S	90.8	Very high	92	Very high	42 Å²	42	30.2 Å²	30.2	29%	0.294	15%	0.152	S	C	.	.	S	Bend	trans	-73.2	-25.5	179.1	-67.9	0	0	0	0	113	V312	S281-V312 PolarHBondContact N-O 2.74Å
282	F	93.7	Very high	91.8	Very high	6 Å²	6	31.5 Å²	31.5	3%	0.026	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	133.6	178	174.8	-90	0	0	0	108.9	T157 W161 W166 S280 N310 V311 V312	T157-F282 HydrophobicContact CG2-CD2 4.17Å; T157-F282 HydrophobicContact CG2-CE2 3.28Å; T157-F282 HydrophobicContact CG2-CZ 3.53Å; W161-F282 HydrophobicContact CB-CE2 4.23Å; W161-F282 AromaticContact CE3-CD1 3.85Å; W161-F282 HydrophobicContact CE3-CD1 3.85Å; W161-F282 HydrophobicContact CE3-CD2 4.48Å; W161-F282 AromaticContact CE3-CE1 3.68Å; W161-F282 HydrophobicContact CE3-CE1 3.68Å; W161-F282 HydrophobicContact CE3-CE2 4.32Å; W161-F282 HydrophobicContact CE3-CG 4.25Å; W161-F282 AromaticContact CE3-CZ 3.93Å; W161-F282 HydrophobicContact CE3-CZ 3.93Å; W161-F282 HydrophobicContact CZ3-CD1 4.02Å; W161-F282 HydrophobicContact CZ3-CE1 4.02Å; W166-F282 HydrophobicContact CH2-CB 3.73Å; W166-F282 HydrophobicContact CZ3-CB 3.68Å; W166-F282 HydrophobicContact CZ3-CD2 4.25Å; W166-F282 HydrophobicContact CZ3-CG 4.03Å; S280-F282 VanDerWaalsContact C-N 3.3Å; S280-F282 PolarHBondContact OG-O 2.86Å; S280-F282 VanDerWaalsContact OG-O 3.11Å; F282-N310 HydrophobicContact CE1-CB 4.17Å; F282-V311 CarbonylContact O-C 3.59Å; F282-V311 VanDerWaalsContact O-CA 3.29Å; F282-V311 WeakPolarHBondContact O-CA 3.46Å; F282-V312 HydrophobicContact CB-CB 4.06Å; F282-V312 HydrophobicContact CB-CG2 4.08Å; F282-V312 HydrophobicContact CD1-CG2 4.22Å; F282-V312 PolarHBondContact O-N 2.88Å
283	H	94.1	Very high	91.5	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	124.2	175.1	166.8	-94	0	0	0	109.5	T157 Q158 N310	T157-H283 CarbonylContact C-O 3.49Å; T157-H283 WeakPolarHBondContact CA-O 3.31Å; Q158-H283 PolarHBondContact N-O 3.45Å; Q158-H283 PolarHBondContact O-N 2.92Å; Q158-H283 VanDerWaalsContact O-N 3.16Å; H283-N310 CarbonylContact C-O 3.57Å; H283-N310 WeakPolarHBondContact CA-O 3.46Å
284	S	95.3	Very high	91	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	133.6	171.7	168.8	0	0	0	0	109.9	F156 T157 S173 L309 N310	F156-S284 WeakPolarHBondContact O-CA 3.29Å; T157-S284 PolarHBondContact OG1-OG 3.21Å; S173-S284 WeakPolarHBondContact CB-OG 3.42Å; S173-S284 PolarHBondContact OG-OG 2.98Å; S284-L309 CarbonylContact O-C 3.58Å; S284-L309 VanDerWaalsContact O-CA 3.29Å; S284-L309 WeakPolarHBondContact O-CA 3.27Å; S284-N310 PolarHBondContact N-O 2.67Å; S284-N310 PolarHBondContact O-N 3.27Å
285	Q	95.4	Very high	90.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	135.4	168.8	60.5	172.9	35.4	0	0	109.5	S155 F156 V248 N252 T308	S155-Q285 WeakPolarHBondContact CA-O 3.23Å; F156-Q285 HydrophobicContact CB-CG 3.96Å; F156-Q285 HydrophobicContact CD2-CG 4.34Å; F156-Q285 PolarHBondContact N-O 3.13Å; F156-Q285 PolarHBondContact O-N 2.91Å; V248-Q285 HydrophobicContact CG1-CG 4.48Å; N252-Q285 PolarHBondContact O-NE2 2.71Å; Q285-T308 CarbonylContact C-O 3.53Å; Q285-T308 WeakPolarHBondContact CA-O 3.35Å
286	A	96.4	Very high	89.8	Confident	1 Å²	1	38 Å²	38	1%	0.008	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	157.1	-178.7	0	0	0	0	0	112.5	I154 W256 Q307 T308	I154-A286 CarbonylContact O-C 3.58Å; I154-A286 WeakPolarHBondContact O-CA 3.41Å; I154-A286 VanDerWaalsContact O-CB 3.29Å; I154-A286 WeakPolarHBondContact O-CB 3.48Å; W256-A286 PolarHBondContact NE1-O 2.85Å; A286-Q307 WeakPolarHBondContact O-CA 3.4Å; A286-T308 WeakPolarHBondContact CB-OG1 3.01Å; A286-T308 PolarHBondContact N-O 3.01Å; A286-T308 PolarHBondContact O-N 2.86Å
287	V	97.2	Very high	89.3	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.006	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	125.1	172.1	179.5	0	0	0	0	107.9	L140 I154 F205 L259 I289 L305 Q307	L140-V287 HydrophobicContact CD1-CG1 4.15Å; I154-V287 HydrophobicContact CG2-CB 3.69Å; I154-V287 HydrophobicContact CG2-CG2 4.46Å; I154-V287 WeakPolarHBondContact CG2-O 3.15Å; I154-V287 PolarHBondContact N-O 2.92Å; I154-V287 PolarHBondContact O-N 3.38Å; F205-V287 HydrophobicContact CE1-CG2 3.8Å; F205-V287 HydrophobicContact CZ-CB 4.21Å; F205-V287 HydrophobicContact CZ-CG2 3.86Å; L259-V287 HydrophobicContact CD1-CG2 4.18Å; V287-I289 HydrophobicContact CG1-CG1 4.31Å; V287-L305 HydrophobicContact CG1-CD1 3.44Å; V287-L305 VanDerWaalsContact CG1-CD1 3.44Å; V287-Q307 HydrophobicContact CG2-CG 4.3Å
288	H	97.4	Very high	89	Confident	16 Å²	16	40.7 Å²	40.7	7%	0.074	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	134.9	179.5	-54.7	-58.8	0	0	0	109.4	L152 H153 R306 F559	L152-H288 CarbonylContact O-C 3.53Å; L152-H288 WeakPolarHBondContact O-CA 3.37Å; H153-H288 AromaticContact CG-ND1 3.66Å; H153-H288 WeakPolarHBondContact ND1-CB 3.29Å; H153-H288 AromaticContact ND1-CG 3.45Å; H153-H288 AromaticContact ND1-ND1 3.04Å; H153-H288 PolarHBondContact ND1-ND1 2.82Å; H288-R306 HydrophobicContact CB-CB 4.1Å; H288-R306 PolarHBondContact N-O 3.03Å; H288-R306 PolarHBondContact O-N 2.63Å; H288-F559 HydrophobicContact CB-CE2 3.67Å; H288-F559 HydrophobicContact CB-CZ 3.64Å; H288-F559 AromaticContact CD2-CE2 3.67Å; H288-F559 AromaticContact CD2-CZ 3.46Å; H288-F559 VanDerWaalsContact CD2-CZ 3.46Å; H288-F559 WeakPolarHBondContact CD2-CZ 3.34Å; H288-F559 AromaticContact CG-CE2 3.79Å; H288-F559 AromaticContact CG-CZ 3.42Å; H288-F559 VanDerWaalsContact CG-CZ 3.42Å; H288-F559 AromaticContact ND1-CZ 4Å
289	I	95.9	Very high	88.8	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	124.3	-178.6	-50.5	-174.3	0	0	0	107.4	L140 I144 E151 L152 V287 L303 E304 L305	L140-I289 HydrophobicContact CB-CD1 4.38Å; L140-I289 HydrophobicContact CD1-CD1 4.12Å; I144-I289 HydrophobicContact CD1-CD1 3.43Å; I144-I289 VanDerWaalsContact CD1-CD1 3.43Å; I144-I289 HydrophobicContact CD1-CG2 3.98Å; I144-I289 HydrophobicContact CG1-CD1 4.12Å; E151-I289 VanDerWaalsContact CA-O 3.28Å; E151-I289 WeakPolarHBondContact CA-O 3.29Å; L152-I289 HydrophobicContact CB-CB 4.11Å; L152-I289 HydrophobicContact CB-CD1 4.38Å; L152-I289 HydrophobicContact CB-CG1 4.33Å; L152-I289 HydrophobicContact CD2-CD1 3.95Å; L152-I289 HydrophobicContact CD2-CG1 4.44Å; L152-I289 PolarHBondContact N-O 2.83Å; L152-I289 PolarHBondContact O-N 2.85Å; V287-I289 HydrophobicContact CG1-CG1 4.31Å; I289-L303 HydrophobicContact CG2-CD1 3.78Å; I289-L303 HydrophobicContact CG2-CD2 3.86Å; I289-L303 HydrophobicContact CG2-CG 3.77Å; I289-E304 VanDerWaalsContact CA-O 3.3Å; I289-E304 WeakPolarHBondContact CA-O 3.08Å; I289-L305 HydrophobicContact CD1-CD1 4.2Å; I289-L305 HydrophobicContact CG1-CD1 3.86Å
290	R	93.4	Very high	88.6	Confident	18 Å²	18	41.7 Å²	41.7	7%	0.068	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	152.3	-180	63.9	175.5	179.9	-174	-6.7	111.9	E151 L227 V292 E304 F559	E151-R290 HydrophobicContact CG-CB 4.32Å; L227-R290 PolarHBondContact O-NH1 3.19Å; R290-V292 HydrophobicContact CG-CG1 4.05Å; R290-E304 HydrophobicContact CG-CB 4.28Å; R290-E304 IonicContact CZ-OE2 2.94Å; R290-E304 VanDerWaalsContact CZ-OE2 3.24Å; R290-E304 PolarHBondContact N-O 3.03Å; R290-E304 VanDerWaalsContact N-O 3.07Å; R290-E304 IonicContact NE-OE2 3.1Å; R290-E304 PolarHBondContact NE-OE2 2.97Å; R290-E304 IonicContact NH2-OE1 2.75Å; R290-E304 IonicContact NH2-OE2 3.76Å; R290-E304 PolarHBondContact NH2-OE2 3.32Å; R290-E304 PolarHBondContact O-N 2.92Å; R290-F559 PolarHBondContact NH1-O 2.74Å
291	P	91.4	Very high	88.4	Confident	17 Å²	17	42.1 Å²	42.1	11%	0.11	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	133.7	171.4	30.3	-31.5	0	0	0	110.3	R150 G228 I229 S302	R150-P291 HydrophobicContact CG-CG 4.47Å; G228-P291 CarbonylContact C-O 3.32Å; G228-P291 WeakPolarHBondContact CA-O 3.46Å; I229-P291 PolarHBondContact N-O 2.66Å; P291-S302 CarbonylContact C-O 3.57Å; P291-S302 WeakPolarHBondContact CA-O 3.4Å
292	V	89.4	Confident	88.3	Confident	28 Å²	28	40.3 Å²	40.3	17%	0.17	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	156.2	177.6	-58.6	0	0	0	0	111.3	R290 S302 E304	R290-V292 HydrophobicContact CG-CG1 4.05Å; V292-S302 WeakPolarHBondContact CG2-OG 3.48Å; V292-S302 PolarHBondContact N-O 2.9Å; V292-S302 PolarHBondContact O-N 3.38Å; V292-S302 PolarHBondContact O-OG 3.3Å; V292-E304 HydrophobicContact CG1-CB 3.74Å; V292-E304 WeakPolarHBondContact CG1-OE2 3.09Å; V292-E304 HydrophobicContact CG2-CB 3.97Å
293	C	86.7	Confident	88.2	Confident	62 Å²	62	40.1 Å²	40.1	42%	0.419	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	131	-178.9	-59.6	0	0	0	0	108.4	I229 C298	I229-C293 HydrophobicContact CD1-CB 4.24Å; I229-C293 WeakPolarHBondContact CD1-SG 3.24Å; C293-C298 HydrophobicContact CB-CB 3.73Å; C293-C298 WeakPolarHBondContact CB-SG 3.33Å; C293-C298 WeakPolarHBondContact SG-CB 3.32Å; C293-C298 CovalentContact SG-SG 2.04Å; C293-C298 PolarHBondContact SG-SG 2.85Å
294	Q	80.4	Confident	88.1	Confident	63 Å²	63	40.2 Å²	40.2	29%	0.294	21%	0.214	S	C	.	.	S	Bend	trans	-76.8	-43.2	173.2	-174.1	-177.5	16	0	0	110.7	E121 T300	E121-Q294 PolarHBondContact OE1-NE2 3.33Å; E121-Q294 PolarHBondContact OE2-NE2 3.09Å; Q294-T300 PolarHBondContact N-O 3.14Å; Q294-T300 VanDerWaalsContact N-O 3.14Å; Q294-T300 PolarHBondContact OE1-OG1 2.81Å
295	D	77.5	Confident	88.2	Confident	80 Å²	80	40.2 Å²	40.2	43%	0.428	21%	0.214	S	C	.	.	S	Bend	trans	-112.5	154.1	179.8	-58.5	-39.5	0	0	0	111.2	P297 C298 T300	D295-P297 HydrophobicContact CB-CG 4.12Å; D295-C298 VanDerWaalsContact O-CA 3.29Å; D295-C298 WeakPolarHBondContact O-CA 3.35Å; D295-C298 PolarHBondContact O-N 2.79Å; D295-T300 PolarHBondContact OD2-OG1 3.23Å
296	E	72.8	Confident	88.2	Confident	174 Å²	174	40.4 Å²	40.4	81%	0.813	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.3	-46.6	173.1	-69.4	-67.1	163.1	0	0	114.3	C298	E296-C298 PolarHBondContact O-N 2.94Å; E296-C298 VanDerWaalsContact O-N 3.14Å
297	P	77.5	Confident	88.2	Confident	88 Å²	88	40.4 Å²	40.4	57%	0.571	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	1.4	174.6	30.2	-38.9	0	0	0	114.4	D295 K299	D295-P297 HydrophobicContact CB-CG 4.12Å; P297-K299 VanDerWaalsContact C-N 3.26Å; P297-K299 HydrophobicContact CB-CG 4.25Å; P297-K299 HydrophobicContact CG-CD 4.47Å; P297-K299 HydrophobicContact CG-CG 4.32Å; P297-K299 PolarHBondContact O-N 2.91Å
298	C	81.3	Confident	88.2	Confident	42 Å²	42	40.3 Å²	40.3	28%	0.284	21%	0.214	S	C	.	.			trans	49.7	39.7	179	-154.4	0	0	0	0	114.5	I229 C293 D295 E296	I229-C298 WeakPolarHBondContact CD1-SG 3.1Å; C293-C298 HydrophobicContact CB-CB 3.73Å; C293-C298 WeakPolarHBondContact CB-SG 3.33Å; C293-C298 WeakPolarHBondContact SG-CB 3.32Å; C293-C298 CovalentContact SG-SG 2.04Å; C293-C298 PolarHBondContact SG-SG 2.85Å; D295-C298 VanDerWaalsContact O-CA 3.29Å; D295-C298 WeakPolarHBondContact O-CA 3.35Å; D295-C298 PolarHBondContact O-N 2.79Å; E296-C298 PolarHBondContact O-N 2.94Å; E296-C298 VanDerWaalsContact O-N 3.14Å
299	K	81	Confident	88.2	Confident	177 Å²	177	39.6 Å²	39.6	77%	0.77	21%	0.21	S	C	*	.			trans	-75.5	-37.8	178.5	-70.6	-178.2	179.9	177.7	0	112.2	P297	P297-K299 VanDerWaalsContact C-N 3.26Å; P297-K299 HydrophobicContact CB-CG 4.25Å; P297-K299 HydrophobicContact CG-CD 4.47Å; P297-K299 HydrophobicContact CG-CG 4.32Å; P297-K299 PolarHBondContact O-N 2.91Å
300	T	82.1	Confident	88.2	Confident	39 Å²	39	39.6 Å²	39.6	24%	0.239	21%	0.21	C	C	.	.	S	Bend	trans	-111.8	144.5	175.2	51.2	0	0	0	0	109.9	Q294 D295	Q294-T300 PolarHBondContact N-O 3.14Å; Q294-T300 VanDerWaalsContact N-O 3.14Å; Q294-T300 PolarHBondContact OE1-OG1 2.81Å; D295-T300 PolarHBondContact OD2-OG1 3.23Å
301	T	86.3	Confident	88.2	Confident	28 Å²	28	38.7 Å²	38.7	17%	0.172	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	145.5	-179.6	59	0	0	0	0	109.6	I229	I229-T301 HydrophobicContact CD1-CG2 3.84Å
302	S	89.3	Confident	88.4	Confident	4 Å²	4	37.9 Å²	37.9	3%	0.028	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	163.1	170.8	58.4	0	0	0	0	109.6	W120 P291 V292	W120-S302 WeakPolarHBondContact O-CB 3.38Å; P291-S302 CarbonylContact C-O 3.57Å; P291-S302 WeakPolarHBondContact CA-O 3.4Å; V292-S302 WeakPolarHBondContact CG2-OG 3.48Å; V292-S302 PolarHBondContact N-O 2.9Å; V292-S302 PolarHBondContact O-N 3.38Å; V292-S302 PolarHBondContact O-OG 3.3Å
303	L	90.5	Very high	88.5	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	122.1	177.9	-163	70.1	0	0	0	109.6	W120 F136 I144 I289	W120-L303 HydrophobicContact CE3-CB 4.48Å; W120-L303 HydrophobicContact CE3-CD2 4.17Å; W120-L303 PolarHBondContact N-O 3.17Å; W120-L303 PolarHBondContact O-N 3.22Å; F136-L303 HydrophobicContact CE2-CD2 3.95Å; F136-L303 HydrophobicContact CE2-CG 4.4Å; F136-L303 HydrophobicContact CZ-CD2 3.73Å; I144-L303 HydrophobicContact CD1-CD2 4.13Å; I289-L303 HydrophobicContact CG2-CD1 3.78Å; I289-L303 HydrophobicContact CG2-CD2 3.86Å; I289-L303 HydrophobicContact CG2-CG 3.77Å
304	E	93.5	Very high	88.4	Confident	4 Å²	4	37.7 Å²	37.7	2%	0.019	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	120.7	174.1	-173.7	-172.6	-175.6	0	0	109.4	R117 I289 R290 V292 R306	R117-E304 WeakPolarHBondContact CD-OE1 3.28Å; R117-E304 HydrophobicContact CG-CG 3.93Å; I289-E304 VanDerWaalsContact CA-O 3.3Å; I289-E304 WeakPolarHBondContact CA-O 3.08Å; R290-E304 HydrophobicContact CG-CB 4.28Å; R290-E304 IonicContact CZ-OE2 2.94Å; R290-E304 VanDerWaalsContact CZ-OE2 3.24Å; R290-E304 PolarHBondContact N-O 3.03Å; R290-E304 VanDerWaalsContact N-O 3.07Å; R290-E304 IonicContact NE-OE2 3.1Å; R290-E304 PolarHBondContact NE-OE2 2.97Å; R290-E304 IonicContact NH2-OE1 2.75Å; R290-E304 IonicContact NH2-OE2 3.76Å; R290-E304 PolarHBondContact NH2-OE2 3.32Å; R290-E304 PolarHBondContact O-N 2.92Å; V292-E304 HydrophobicContact CG1-CB 3.74Å; V292-E304 WeakPolarHBondContact CG1-OE2 3.09Å; V292-E304 HydrophobicContact CG2-CB 3.97Å; E304-R306 IonicContact OE1-CZ 2.73Å; E304-R306 VanDerWaalsContact OE1-CZ 3.26Å; E304-R306 IonicContact OE1-NE 3.8Å; E304-R306 PolarHBondContact OE1-NE 2.85Å; E304-R306 VanDerWaalsContact OE1-NE 3.13Å; E304-R306 IonicContact OE1-NH2 3.43Å; E304-R306 PolarHBondContact OE1-NH2 3.16Å
305	L	95.9	Very high	87.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	119.4	162.5	168.9	66.5	0	0	0	109	R117 T118 F136 P137 L140 V287 I289 Q307	R117-L305 WeakPolarHBondContact CA-O 3.43Å; T118-L305 PolarHBondContact N-O 3.04Å; T118-L305 PolarHBondContact O-N 2.83Å; F136-L305 HydrophobicContact CD2-CB 4.11Å; F136-L305 HydrophobicContact CE2-CB 3.5Å; F136-L305 VanDerWaalsContact CE2-CB 3.5Å; F136-L305 HydrophobicContact CE2-CD2 4.28Å; F136-L305 HydrophobicContact CE2-CG 4.47Å; F136-L305 HydrophobicContact CZ-CB 4.21Å; P137-L305 VanDerWaalsContact CD-CD2 3.43Å; P137-L305 HydrophobicContact CG-CD2 3.47Å; P137-L305 VanDerWaalsContact CG-CD2 3.47Å; L140-L305 HydrophobicContact CD1-CD1 4.06Å; L140-L305 HydrophobicContact CD1-CD2 4.39Å; V287-L305 HydrophobicContact CG1-CD1 3.44Å; V287-L305 VanDerWaalsContact CG1-CD1 3.44Å; I289-L305 HydrophobicContact CD1-CD1 4.2Å; I289-L305 HydrophobicContact CG1-CD1 3.86Å; L305-Q307 HydrophobicContact CD1-CG 4.1Å; L305-Q307 HydrophobicContact CG-CG 4.16Å
306	R	96.1	Very high	87.1	Confident	3 Å²	3	39 Å²	39	1%	0.011	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	114	178.6	175.9	66.7	60.2	168.8	16.1	109.1	F116 H288 E304 T308 L555 F559	F116-R306 WeakPolarHBondContact O-CA 3.46Å; H288-R306 HydrophobicContact CB-CB 4.1Å; H288-R306 PolarHBondContact N-O 3.03Å; H288-R306 PolarHBondContact O-N 2.63Å; E304-R306 IonicContact OE1-CZ 2.73Å; E304-R306 VanDerWaalsContact OE1-CZ 3.26Å; E304-R306 IonicContact OE1-NE 3.8Å; E304-R306 PolarHBondContact OE1-NE 2.85Å; E304-R306 VanDerWaalsContact OE1-NE 3.13Å; E304-R306 IonicContact OE1-NH2 3.43Å; E304-R306 PolarHBondContact OE1-NH2 3.16Å; R306-T308 HydrophobicContact CG-CG2 3.72Å; R306-L555 VanDerWaalsContact NH1-CD1 3.3Å; R306-L555 VanDerWaalsContact NH2-CD2 3.29Å; R306-F559 HydrophobicContact CB-CE2 4.28Å; R306-F559 HydrophobicContact CG-CD2 3.96Å; R306-F559 HydrophobicContact CG-CE2 3.9Å
307	Q	97.2	Very high	86.1	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	132	175.2	-59.6	-178.8	-118.3	0	0	109.6	F116 W256 A286 V287 L305	F116-Q307 HydrophobicContact CB-CB 4.24Å; F116-Q307 PolarHBondContact N-O 3.33Å; F116-Q307 PolarHBondContact O-N 3.19Å; W256-Q307 HydrophobicContact CH2-CB 4.24Å; W256-Q307 HydrophobicContact CZ2-CB 3.59Å; W256-Q307 PolarHBondContact O-NE2 2.84Å; A286-Q307 WeakPolarHBondContact O-CA 3.4Å; V287-Q307 HydrophobicContact CG2-CG 4.3Å; L305-Q307 HydrophobicContact CD1-CG 4.1Å; L305-Q307 HydrophobicContact CG-CG 4.16Å
308	T	96.9	Very high	85	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	141.3	-171.4	80.6	0	0	0	0	109.9	F114 L171 W256 Q285 A286 R306	F114-T308 VanDerWaalsContact O-CA 3.3Å; F114-T308 WeakPolarHBondContact O-CA 3.23Å; L171-T308 HydrophobicContact CD1-CG2 3.43Å; L171-T308 VanDerWaalsContact CD1-CG2 3.43Å; W256-T308 WeakPolarHBondContact CZ2-O 3.4Å; Q285-T308 CarbonylContact C-O 3.53Å; Q285-T308 WeakPolarHBondContact CA-O 3.35Å; A286-T308 WeakPolarHBondContact CB-OG1 3.01Å; A286-T308 PolarHBondContact N-O 3.01Å; A286-T308 PolarHBondContact O-N 2.86Å; R306-T308 HydrophobicContact CG-CG2 3.72Å
309	L	96.2	Very high	83.6	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	117.2	177.2	-176.5	150.2	0	0	0	108.9	S113 F114 L253 W256 L272 L277 S284 V311	S113-L309 WeakPolarHBondContact CA-O 3.29Å; F114-L309 HydrophobicContact CB-CB 4.21Å; F114-L309 HydrophobicContact CD2-CD2 3.63Å; F114-L309 HydrophobicContact CE2-CD2 4.08Å; F114-L309 HydrophobicContact CG-CD2 4.49Å; F114-L309 PolarHBondContact N-O 3Å; F114-L309 PolarHBondContact O-N 2.99Å; L253-L309 HydrophobicContact CD1-CD1 3.82Å; W256-L309 HydrophobicContact CH2-CB 3.96Å; W256-L309 HydrophobicContact CH2-CD1 4.45Å; W256-L309 HydrophobicContact CZ2-CB 4.12Å; W256-L309 HydrophobicContact CZ3-CD1 4.42Å; L272-L309 HydrophobicContact CD1-CD1 4.39Å; L272-L309 HydrophobicContact CD2-CD1 4.03Å; L272-L309 HydrophobicContact CD2-CD2 3.85Å; L272-L309 HydrophobicContact CD2-CG 4.49Å; L277-L309 HydrophobicContact CD1-CD1 4.25Å; L277-L309 HydrophobicContact CD2-CD2 4.09Å; S284-L309 CarbonylContact O-C 3.58Å; S284-L309 VanDerWaalsContact O-CA 3.29Å; S284-L309 WeakPolarHBondContact O-CA 3.27Å; L309-V311 HydrophobicContact CD2-CG2 3.3Å; L309-V311 HydrophobicContact CG-CG2 4.45Å
310	N	95.9	Very high	82.3	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	130.1	-174.4	-68.8	-24.4	0	0	0	109.2	Y111 A112 S113 L171 F282 H283 S284	Y111-N310 HydrophobicContact CE2-CB 3.97Å; Y111-N310 PolarHBondContact OH-OD1 2.88Å; A112-N310 WeakPolarHBondContact O-CA 3.39Å; S113-N310 VanDerWaalsContact CB-OD1 3.29Å; S113-N310 WeakPolarHBondContact CB-OD1 3.18Å; S113-N310 PolarHBondContact OG-OD1 3.12Å; L171-N310 PolarHBondContact O-ND2 3.21Å; F282-N310 HydrophobicContact CE1-CB 4.17Å; H283-N310 CarbonylContact C-O 3.57Å; H283-N310 WeakPolarHBondContact CA-O 3.46Å; S284-N310 PolarHBondContact N-O 2.67Å; S284-N310 PolarHBondContact O-N 3.27Å
311	V	95.4	Very high	81.1	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	136.9	-175.9	-162.4	0	0	0	0	110.2	Y111 A112 L277 S280 F282 L309 F313	Y111-V311 WeakPolarHBondContact CD2-O 3.19Å; A112-V311 PolarHBondContact N-O 2.92Å; A112-V311 PolarHBondContact O-N 2.95Å; L277-V311 HydrophobicContact CD2-CB 4.43Å; L277-V311 HydrophobicContact CD2-CG1 4.14Å; L277-V311 HydrophobicContact CD2-CG2 3.49Å; L277-V311 VanDerWaalsContact CD2-CG2 3.49Å; S280-V311 VanDerWaalsContact CB-CG1 3.44Å; S280-V311 WeakPolarHBondContact OG-CG1 3.49Å; F282-V311 CarbonylContact O-C 3.59Å; F282-V311 VanDerWaalsContact O-CA 3.29Å; F282-V311 WeakPolarHBondContact O-CA 3.46Å; L309-V311 HydrophobicContact CD2-CG2 3.3Å; L309-V311 HydrophobicContact CG-CG2 4.45Å; V311-F313 HydrophobicContact CB-CE2 3.99Å; V311-F313 HydrophobicContact CB-CZ 4.31Å; V311-F313 HydrophobicContact CG1-CD2 4.16Å; V311-F313 HydrophobicContact CG1-CE1 4.04Å; V311-F313 HydrophobicContact CG1-CE2 3.66Å; V311-F313 HydrophobicContact CG1-CZ 3.6Å
312	V	94.6	Very high	80.2	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	115.8	170.6	-175.6	0	0	0	0	110.1	L105 D109 I110 Y111 W161 W166 S280 S281 F282	L105-V312 HydrophobicContact CD1-CG1 4.24Å; D109-V312 HydrophobicContact CB-CG1 3.85Å; I110-V312 WeakPolarHBondContact O-CA 3.36Å; Y111-V312 HydrophobicContact CD2-CG2 4.08Å; W161-V312 HydrophobicContact CH2-CG2 4.17Å; W161-V312 HydrophobicContact CZ3-CG2 3.72Å; W166-V312 HydrophobicContact CD2-CG1 4.22Å; W166-V312 HydrophobicContact CD2-CG2 4.23Å; W166-V312 HydrophobicContact CE3-CG2 4.06Å; W166-V312 HydrophobicContact CH2-CB 4.43Å; W166-V312 HydrophobicContact CH2-CG1 4.48Å; W166-V312 HydrophobicContact CZ2-CB 4.36Å; W166-V312 HydrophobicContact CZ2-CG1 3.93Å; W166-V312 HydrophobicContact CZ3-CG2 4.21Å; S280-V312 WeakPolarHBondContact CB-O 3.39Å; S281-V312 PolarHBondContact N-O 2.74Å; F282-V312 HydrophobicContact CB-CB 4.06Å; F282-V312 HydrophobicContact CB-CG2 4.08Å; F282-V312 HydrophobicContact CD1-CG2 4.22Å; F282-V312 PolarHBondContact O-N 2.88Å
313	F	90.9	Very high	79.6	Confident	25 Å²	25	45.2 Å²	45.2	11%	0.11	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	126.4	176.6	-64.5	-79.8	0	0	0	110.5	I110 A112 V311 M330 F331	I110-F313 PolarHBondContact N-O 2.87Å; I110-F313 VanDerWaalsContact N-O 3.09Å; I110-F313 PolarHBondContact O-N 2.78Å; A112-F313 HydrophobicContact CB-CE2 4.49Å; V311-F313 HydrophobicContact CB-CE2 3.99Å; V311-F313 HydrophobicContact CB-CZ 4.31Å; V311-F313 HydrophobicContact CG1-CD2 4.16Å; V311-F313 HydrophobicContact CG1-CE1 4.04Å; V311-F313 HydrophobicContact CG1-CE2 3.66Å; V311-F313 HydrophobicContact CG1-CZ 3.6Å; F313-M330 HydrophobicContact CD2-CB 4.26Å; F313-M330 HydrophobicContact CD2-CG 4.03Å; F313-M330 HydrophobicContact CD2-SD 3.95Å; F313-M330 WeakPolarHBondContact CE1-O 3.49Å; F313-M330 HydrophobicContact CE2-CB 4Å; F313-M330 HydrophobicContact CE2-CG 4.27Å; F313-M330 HydrophobicContact CE2-SD 4.23Å; F313-M330 HydrophobicContact CG-CG 4.3Å; F313-M330 HydrophobicContact CZ-CB 4.13Å; F313-F331 AromaticContact CE2-CE1 3.71Å; F313-F331 HydrophobicContact CE2-CE1 3.71Å; F313-F331 HydrophobicContact CE2-CE2 4.49Å; F313-F331 AromaticContact CE2-CZ 3.69Å; F313-F331 HydrophobicContact CE2-CZ 3.69Å; F313-F331 HydrophobicContact CZ-CD1 4.07Å; F313-F331 AromaticContact CZ-CE1 3.62Å; F313-F331 HydrophobicContact CZ-CE1 3.62Å; F313-F331 HydrophobicContact CZ-CZ 4.07Å
314	D	85.3	Confident	79.3	Confident	61 Å²	61	47.5 Å²	47.5	33%	0.326	28%	0.283	S	S	.	.			trans	-75.4	130.6	175.6	-172.5	-12	0	0	0	111.2	D109 H316 A317	D109-D314 WeakPolarHBondContact OD1-CA 3.46Å; D314-H316 WeakPolarHBondContact OD1-CB 3.41Å; D314-H316 IonicContact OD1-CD2 3.72Å; D314-H316 PolarHBondContact OD1-CD2 3.04Å; D314-H316 IonicContact OD1-CG 3.96Å; D314-H316 PolarHBondContact OD1-N 3.28Å; D314-A317 HydrophobicContact CB-CB 4.31Å
315	L	70.8	Confident	78.9	Confident	22 Å²	22	48 Å²	48	12%	0.115	29%	0.285	C	S	.	.	S	Bend	trans	-62.9	-40.3	173.3	-170.2	86.7	0	0	0	112.4	G108 A317 S318 R323 W325	G108-L315 WeakPolarHBondContact O-CB 3.44Å; G108-L315 WeakPolarHBondContact O-CD1 3.1Å; L315-A317 VanDerWaalsContact C-N 3.34Å; L315-A317 PolarHBondContact O-N 2.79Å; L315-S318 PolarHBondContact O-N 2.77Å; L315-R323 HydrophobicContact CD1-CB 4.25Å; L315-R323 HydrophobicContact CD1-CG 4.14Å; L315-R323 HydrophobicContact CD2-CG 4.09Å; L315-W325 VanDerWaalsContact CD1-CE2 3.49Å; L315-W325 HydrophobicContact CD1-CH2 4.33Å; L315-W325 HydrophobicContact CD1-CZ2 3.21Å; L315-W325 HydrophobicContact CG-CZ2 4.47Å
316	H	59.4	Low	78.6	Confident	149 Å²	149	48.3 Å²	48.3	69%	0.69	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-72.4	-27	-171.2	-66.3	-75.3	0	0	0	112.9	D314 S318	D314-H316 WeakPolarHBondContact OD1-CB 3.41Å; D314-H316 IonicContact OD1-CD2 3.72Å; D314-H316 PolarHBondContact OD1-CD2 3.04Å; D314-H316 IonicContact OD1-CG 3.96Å; D314-H316 PolarHBondContact OD1-N 3.28Å; H316-S318 PolarHBondContact O-N 2.61Å
317	A	52.3	Low	78.4	Confident	82 Å²	82	48.2 Å²	48.2	68%	0.678	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-70.2	-16.1	177.4	0	0	0	0	0	113.5	D314 L315 G319	D314-A317 HydrophobicContact CB-CB 4.31Å; L315-A317 VanDerWaalsContact C-N 3.34Å; L315-A317 PolarHBondContact O-N 2.79Å; A317-G319 VanDerWaalsContact C-N 3.27Å; A317-G319 PolarHBondContact O-N 2.85Å
318	S	54.4	Low	78.1	Confident	57 Å²	57	53.6 Å²	53.6	40%	0.399	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-77.1	-5.1	-175	-170.3	0	0	0	0	114.7	L315 H316 Q320	L315-S318 PolarHBondContact O-N 2.77Å; H316-S318 PolarHBondContact O-N 2.61Å; S318-Q320 PolarHBondContact O-N 2.87Å
319	G	52.1	Low	77.7	Confident	77 Å²	77	56.7 Å²	56.7	79%	0.794	32%	0.324	S	S	*	.			trans	62.1	-6.6	167.2	0	0	0	0	0	117.6	A317	A317-G319 VanDerWaalsContact C-N 3.27Å; A317-G319 PolarHBondContact O-N 2.85Å
320	Q	53.5	Low	77.4	Confident	133 Å²	133	57.3 Å²	57.3	62%	0.621	33%	0.327	S	S	*	.	S	Bend	trans	-110.9	122.3	178.4	-66.1	-168.3	-18.8	0	0	108.3	S318 K322	S318-Q320 PolarHBondContact O-N 2.87Å; Q320-K322 PolarHBondContact O-N 2.84Å
321	G	56.7	Low	77.2	Confident	92 Å²	92	57.3 Å²	57.3	95%	0.948	33%	0.327	S	S	*	.	S	Bend	trans	-61.5	10.5	-178.7	0	0	0	0	0	116.3
322	K	67.2	Low	76.9	Confident	143 Å²	143	58.7 Å²	58.7	62%	0.622	34%	0.336	S	S	*	.	S	Bend	trans	-101.2	117.6	171.5	-66.5	-174.3	177.7	-174.9	0	109.5	Q320 E324	Q320-K322 PolarHBondContact O-N 2.84Å; K322-E324 HydrophobicContact CB-CG 4.32Å; K322-E324 PolarHBondContact O-N 3.24Å
323	R	76.3	Confident	76.7	Confident	97 Å²	97	63.3 Å²	63.3	37%	0.366	35%	0.354	S	S	.	.			trans	-74.1	74.7	174.3	-61.8	-172.4	-177.6	-175.5	-1.2	110	L315 W404	L315-R323 HydrophobicContact CD1-CB 4.25Å; L315-R323 HydrophobicContact CD1-CG 4.14Å; L315-R323 HydrophobicContact CD2-CG 4.09Å; R323-W404 HydrophobicContact CB-CB 3.85Å; R323-W404 HydrophobicContact CB-CG 4.05Å; R323-W404 PolarHBondContact O-N 3.01Å; R323-W404 VanDerWaalsContact O-N 3.12Å
324	E	83.8	Confident	76.8	Confident	50 Å²	50	63.9 Å²	63.9	23%	0.234	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	127	-178.4	-75.3	175	-172.8	0	0	110.5	K322 K329 L401 I402 R403	K322-E324 HydrophobicContact CB-CG 4.32Å; K322-E324 PolarHBondContact O-N 3.24Å; E324-K329 VanDerWaalsContact O-CD 3.3Å; E324-K329 WeakPolarHBondContact O-CD 3.43Å; E324-K329 PolarHBondContact O-NZ 2.89Å; E324-K329 IonicContact OE2-NZ 3.54Å; E324-L401 HydrophobicContact CB-CD1 4.45Å; E324-I402 WeakPolarHBondContact CA-O 3.36Å; E324-R403 HydrophobicContact CG-CB 4.41Å; E324-R403 HydrophobicContact CG-CG 4.02Å
325	W	85.4	Confident	77.2	Confident	15 Å²	15	61 Å²	61	6%	0.057	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	139.6	-179.3	-55.4	-54.6	0	0	0	111.8	P104 G108 I110 L315 L401 I402 W404	P104-W325 HydrophobicContact CB-CZ3 4.28Å; G108-W325 VanDerWaalsContact O-CH2 3.23Å; G108-W325 WeakPolarHBondContact O-CH2 3.28Å; G108-W325 WeakPolarHBondContact O-CZ2 3.36Å; I110-W325 HydrophobicContact CD1-CB 3.41Å; I110-W325 VanDerWaalsContact CD1-CB 3.41Å; I110-W325 VanDerWaalsContact CD1-CD1 3.48Å; I110-W325 HydrophobicContact CD1-CD2 3.03Å; I110-W325 HydrophobicContact CD1-CE3 3.36Å; I110-W325 HydrophobicContact CD1-CG 3.06Å; I110-W325 HydrophobicContact CD1-CH2 4.1Å; I110-W325 HydrophobicContact CD1-CZ2 3.89Å; I110-W325 HydrophobicContact CD1-CZ3 3.85Å; I110-W325 HydrophobicContact CG1-CD2 3.47Å; I110-W325 VanDerWaalsContact CG1-CD2 3.47Å; I110-W325 VanDerWaalsContact CG1-CE2 3.46Å; I110-W325 HydrophobicContact CG1-CE3 3.44Å; I110-W325 VanDerWaalsContact CG1-CE3 3.44Å; I110-W325 HydrophobicContact CG1-CG 4.04Å; I110-W325 HydrophobicContact CG1-CH2 3.33Å; I110-W325 HydrophobicContact CG1-CZ2 3.41Å; I110-W325 VanDerWaalsContact CG1-CZ2 3.41Å; I110-W325 HydrophobicContact CG1-CZ3 3.33Å; L315-W325 VanDerWaalsContact CD1-CE2 3.49Å; L315-W325 HydrophobicContact CD1-CH2 4.33Å; L315-W325 HydrophobicContact CD1-CZ2 3.21Å; L315-W325 HydrophobicContact CG-CZ2 4.47Å; W325-L401 CarbonylContact O-C 3.49Å; W325-L401 WeakPolarHBondContact O-CA 3.26Å; W325-L401 WeakPolarHBondContact O-CD1 3.45Å; W325-I402 HydrophobicContact CB-CB 4.48Å; W325-I402 HydrophobicContact CE3-CB 3.95Å; W325-I402 HydrophobicContact CE3-CD1 4.44Å; W325-I402 HydrophobicContact CE3-CG2 3.88Å; W325-I402 HydrophobicContact CZ3-CG2 4.35Å; W325-I402 PolarHBondContact N-O 2.83Å; W325-I402 PolarHBondContact O-N 3.08Å; W325-W404 AromaticContact CD2-NE1 3.8Å; W325-W404 AromaticContact CE2-NE1 3.86Å; W325-W404 AromaticContact CE3-CD1 3.97Å; W325-W404 AromaticContact CE3-NE1 3.2Å; W325-W404 AromaticContact CH2-CE2 3.41Å; W325-W404 VanDerWaalsContact CH2-CE2 3.41Å; W325-W404 AromaticContact CH2-CZ2 3.41Å; W325-W404 HydrophobicContact CH2-CZ2 3.41Å; W325-W404 VanDerWaalsContact CH2-CZ2 3.41Å; W325-W404 AromaticContact CH2-NE1 2.88Å; W325-W404 AromaticContact CZ2-NE1 3.44Å; W325-W404 AromaticContact CZ3-CD1 3.89Å; W325-W404 AromaticContact CZ3-CE2 3.29Å; W325-W404 AromaticContact CZ3-CZ2 3.36Å; W325-W404 HydrophobicContact CZ3-CZ2 3.36Å; W325-W404 AromaticContact CZ3-NE1 2.74Å
326	S	91.1	Very high	78.3	Confident	7 Å²	7	63.7 Å²	63.7	5%	0.049	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	159	171.8	66.9	0	0	0	0	110.8	F328 K329 M330 N399 V400	S326-F328 PolarHBondContact O-N 3.07Å; S326-K329 PolarHBondContact O-N 2.86Å; S326-K329 PolarHBondContact OG-N 3.22Å; S326-K329 VanDerWaalsContact OG-N 3.12Å; S326-M330 PolarHBondContact O-N 2.9Å; S326-N399 WeakPolarHBondContact CB-OD1 3.41Å; S326-V400 WeakPolarHBondContact CA-O 3.46Å
327	L	91.5	Very high	79.9	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-51.1	-40.8	171.2	-65.3	178.5	0	0	0	110.6	L100 I102 L271 M330 F331 R333 L335 I347 N399 V400	L100-L327 HydrophobicContact CD2-CD2 4.36Å; I102-L327 HydrophobicContact CD1-CD2 3.95Å; L271-L327 HydrophobicContact CD1-CD2 4.23Å; L327-M330 HydrophobicContact CD2-CE 4.25Å; L327-M330 PolarHBondContact O-N 2.82Å; L327-F331 HydrophobicContact CD2-CD2 4.24Å; L327-F331 HydrophobicContact CD2-CE2 4.22Å; L327-F331 WeakPolarHBondContact O-CB 3.37Å; L327-F331 PolarHBondContact O-N 3.27Å; L327-R333 CarbonylContact C-O 3.58Å; L327-R333 VanDerWaalsContact C-O 3.32Å; L327-L335 HydrophobicContact CD1-CD1 4.07Å; L327-L335 HydrophobicContact CD1-CG 4.47Å; L327-I347 HydrophobicContact CD1-CD1 4.43Å; L327-N399 PolarHBondContact N-OD1 3.33Å; L327-V400 HydrophobicContact CD1-CB 4.35Å; L327-V400 HydrophobicContact CD1-CG2 4.16Å; L327-V400 HydrophobicContact CG-CB 4.33Å; L327-V400 PolarHBondContact N-O 3.49Å
328	F	91.2	Very high	81.9	Confident	114 Å²	114	58.6 Å²	58.6	50%	0.5	33%	0.327	S	S	.	.	H	α-helix	trans	-63.2	-44.1	175.5	-172.9	-98	0	0	0	113.2	S326 S332 R333 T334 N399	S326-F328 PolarHBondContact O-N 3.07Å; F328-S332 WeakPolarHBondContact O-CA 3.3Å; F328-S332 PolarHBondContact O-N 2.7Å; F328-R333 WeakPolarHBondContact CA-O 3.24Å; F328-R333 PolarHBondContact N-O 3.27Å; F328-T334 HydrophobicContact CB-CG2 4Å; F328-T334 HydrophobicContact CD2-CG2 4.19Å; F328-N399 PolarHBondContact N-OD1 2.89Å
329	K	88.3	Confident	83.8	Confident	66 Å²	66	56.1 Å²	56.1	29%	0.287	31%	0.31	S	S	.	.	H	α-helix	trans	-65	-42.9	178.3	-76.4	-178.7	-179.3	-178.7	0	112	E324 S326	E324-K329 VanDerWaalsContact O-CD 3.3Å; E324-K329 WeakPolarHBondContact O-CD 3.43Å; E324-K329 PolarHBondContact O-NZ 2.89Å; E324-K329 IonicContact OE2-NZ 3.54Å; S326-K329 PolarHBondContact O-N 2.86Å; S326-K329 PolarHBondContact OG-N 3.22Å; S326-K329 VanDerWaalsContact OG-N 3.12Å
330	M	88.9	Confident	85.8	Confident	12 Å²	12	57.7 Å²	57.7	6%	0.059	31%	0.306	C	S	.	.	H	α-helix	trans	-72.1	-44.6	-178.6	-71.1	-176.6	-79.8	0	0	112.7	I102 I110 K276 F313 S326 L327	I102-M330 HydrophobicContact CD1-CE 4.33Å; I110-M330 HydrophobicContact CB-SD 4.46Å; I110-M330 HydrophobicContact CD1-CE 4.42Å; I110-M330 HydrophobicContact CD1-CG 4.31Å; I110-M330 HydrophobicContact CD1-SD 3.62Å; I110-M330 HydrophobicContact CG2-SD 4.04Å; K276-M330 WeakPolarHBondContact CB-O 3.49Å; K276-M330 WeakPolarHBondContact CG-O 3.18Å; F313-M330 HydrophobicContact CD2-CB 4.26Å; F313-M330 HydrophobicContact CD2-CG 4.03Å; F313-M330 HydrophobicContact CD2-SD 3.95Å; F313-M330 WeakPolarHBondContact CE1-O 3.49Å; F313-M330 HydrophobicContact CE2-CB 4Å; F313-M330 HydrophobicContact CE2-CG 4.27Å; F313-M330 HydrophobicContact CE2-SD 4.23Å; F313-M330 HydrophobicContact CG-CG 4.3Å; F313-M330 HydrophobicContact CZ-CB 4.13Å; S326-M330 PolarHBondContact O-N 2.9Å; L327-M330 HydrophobicContact CD2-CE 4.25Å; L327-M330 PolarHBondContact O-N 2.82Å
331	F	91.2	Very high	87.7	Confident	1 Å²	1	55.5 Å²	55.5	0%	0.004	30%	0.298	C	S	.	.	H	α-helix	trans	-116.2	-1.2	-167.4	-60	-69.2	0	0	0	113.8	A112 F114 L271 L277 F313 L327 R333	A112-F331 HydrophobicContact CB-CZ 3.99Å; F114-F331 AromaticContact CE2-CE1 3.75Å; F114-F331 HydrophobicContact CE2-CE1 3.75Å; F114-F331 AromaticContact CE2-CZ 3.67Å; F114-F331 HydrophobicContact CE2-CZ 3.67Å; F114-F331 HydrophobicContact CZ-CD1 4.46Å; F114-F331 AromaticContact CZ-CE1 3.76Å; F114-F331 HydrophobicContact CZ-CE1 3.76Å; F114-F331 HydrophobicContact CZ-CE2 4.19Å; F114-F331 AromaticContact CZ-CZ 3.6Å; F114-F331 HydrophobicContact CZ-CZ 3.6Å; L271-F331 HydrophobicContact CB-CB 3.98Å; L271-F331 HydrophobicContact CB-CD1 4.24Å; L271-F331 HydrophobicContact CB-CD2 4.25Å; L271-F331 HydrophobicContact CB-CG 3.9Å; L271-F331 HydrophobicContact CD1-CD2 4.23Å; L271-F331 HydrophobicContact CD2-CB 3.99Å; L271-F331 HydrophobicContact CD2-CD2 4.33Å; L271-F331 HydrophobicContact CD2-CG 4.39Å; L271-F331 WeakPolarHBondContact O-CB 3.31Å; L271-F331 WeakPolarHBondContact O-CD1 3.44Å; L277-F331 HydrophobicContact CD2-CD1 4.46Å; L277-F331 HydrophobicContact CD2-CE1 4.17Å; F313-F331 AromaticContact CE2-CE1 3.71Å; F313-F331 HydrophobicContact CE2-CE1 3.71Å; F313-F331 HydrophobicContact CE2-CE2 4.49Å; F313-F331 AromaticContact CE2-CZ 3.69Å; F313-F331 HydrophobicContact CE2-CZ 3.69Å; F313-F331 HydrophobicContact CZ-CD1 4.07Å; F313-F331 AromaticContact CZ-CE1 3.62Å; F313-F331 HydrophobicContact CZ-CE1 3.62Å; F313-F331 HydrophobicContact CZ-CZ 4.07Å; L327-F331 HydrophobicContact CD2-CD2 4.24Å; L327-F331 HydrophobicContact CD2-CE2 4.22Å; L327-F331 WeakPolarHBondContact O-CB 3.37Å; L327-F331 PolarHBondContact O-N 3.27Å; F331-R333 PolarHBondContact O-N 2.88Å; F331-R333 VanDerWaalsContact O-N 3.12Å
332	S	90	Very high	89.5	Confident	29 Å²	29	51.9 Å²	51.9	20%	0.203	26%	0.259	C	S	.	.	S	Bend	trans	54.5	27.5	-176	-55.5	0	0	0	0	113.8	K273 K276 F328	K273-S332 PolarHBondContact NZ-O 3.38Å; K276-S332 WeakPolarHBondContact CE-OG 3.17Å; K276-S332 VanDerWaalsContact CG-OG 3.23Å; K276-S332 WeakPolarHBondContact CG-OG 3.18Å; F328-S332 WeakPolarHBondContact O-CA 3.3Å; F328-S332 PolarHBondContact O-N 2.7Å
333	R	91.3	Very high	90.8	Very high	98 Å²	98	48.4 Å²	48.4	37%	0.37	25%	0.253	S	S	.	.			trans	-153.7	154.3	178.4	-75.4	-165.4	162.9	170.9	5.4	110.7	V270 L271 K273 L327 F328 F331	V270-R333 WeakPolarHBondContact O-CD 3.36Å; V270-R333 PolarHBondContact O-NH1 3.46Å; L271-R333 HydrophobicContact CD2-CB 4.19Å; K273-R333 HydrophobicContact CD-CG 4.13Å; L327-R333 CarbonylContact C-O 3.58Å; L327-R333 VanDerWaalsContact C-O 3.32Å; F328-R333 WeakPolarHBondContact CA-O 3.24Å; F328-R333 PolarHBondContact N-O 3.27Å; F331-R333 PolarHBondContact O-N 2.88Å; F331-R333 VanDerWaalsContact O-N 3.12Å
334	T	92.8	Very high	91.6	Very high	36 Å²	36	45 Å²	45	22%	0.221	24%	0.244	C	C	.	.			trans	-111.4	164.6	168.3	58.6	0	0	0	0	109	F328 S397 N399	F328-T334 HydrophobicContact CB-CG2 4Å; F328-T334 HydrophobicContact CD2-CG2 4.19Å; T334-S397 VanDerWaalsContact CB-OG 3.3Å; T334-S397 WeakPolarHBondContact CB-OG 3.15Å; T334-S397 PolarHBondContact OG1-OG 3.39Å; T334-N399 HydrophobicContact CG2-CB 3.66Å
335	L	93.9	Very high	92.2	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.01	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-93.3	131.3	178.6	-69.8	167.6	0	0	0	110.2	G267 L268 L271 L327 I347 L386 F392 S397 L398	G267-L335 WeakPolarHBondContact O-CD2 3.22Å; L268-L335 HydrophobicContact CD2-CD1 3.91Å; L268-L335 HydrophobicContact CD2-CD2 4.43Å; L271-L335 HydrophobicContact CD1-CD1 4.06Å; L271-L335 HydrophobicContact CD1-CD2 4.01Å; L271-L335 HydrophobicContact CD1-CG 4.05Å; L271-L335 HydrophobicContact CD2-CD2 4.19Å; L271-L335 HydrophobicContact CD2-CG 4.15Å; L271-L335 HydrophobicContact CG-CD2 3.8Å; L271-L335 HydrophobicContact CG-CG 4.14Å; L327-L335 HydrophobicContact CD1-CD1 4.07Å; L327-L335 HydrophobicContact CD1-CG 4.47Å; L335-I347 HydrophobicContact CD1-CD1 3.49Å; L335-I347 VanDerWaalsContact CD1-CD1 3.49Å; L335-L386 HydrophobicContact CD1-CD1 3.97Å; L335-L386 HydrophobicContact CD1-CD2 4.21Å; L335-F392 HydrophobicContact CB-CE1 4.23Å; L335-F392 WeakPolarHBondContact O-CD1 3.24Å; L335-S397 CarbonylContact O-C 3.59Å; L335-S397 WeakPolarHBondContact O-CA 3.21Å; L335-L398 HydrophobicContact CB-CB 4.32Å; L335-L398 HydrophobicContact CD1-CD2 4.44Å; L335-L398 PolarHBondContact N-O 2.89Å; L335-L398 PolarHBondContact O-N 2.79Å
336	T	92.7	Very high	92.7	Very high	78 Å²	78	44.9 Å²	44.9	48%	0.479	24%	0.243	S	C	.	.			trans	-111.2	-29	-178.8	52.5	0	0	0	0	113	F392	T336-F392 VanDerWaalsContact C-CE1 3.45Å
337	E	92.8	Very high	92.9	Very high	103 Å²	103	44.6 Å²	44.6	48%	0.481	24%	0.241	S	C	.	.			trans	-153.8	153.6	-177.9	60.6	-178.8	-171.2	0	0	111.2	A266 G267	A266-E337 HydrophobicContact CB-CG 4.14Å; A266-E337 WeakPolarHBondContact CB-OE1 3.31Å; G267-E337 PolarHBondContact N-O 2.74Å
338	A	94.3	Very high	93.1	Very high	21 Å²	21	45.3 Å²	45.3	17%	0.174	24%	0.244	C	C	.	.			trans	-75.5	160.8	167.8	0	0	0	0	0	111.5	P340 L386	A338-P340 WeakPolarHBondContact O-CD 3.4Å; A338-L386 HydrophobicContact CB-CB 3.92Å; A338-L386 WeakPolarHBondContact CB-O 3.28Å
339	C	95.1	Very high	93.3	Very high	4 Å²	4	39.9 Å²	39.9	3%	0.027	22%	0.22	C	C	.	.			trans	-65.8	121.4	170.3	168.3	0	0	0	0	110	F96 E98 C262 L341 A342	F96-C339 HydrophobicContact CE1-CB 4.31Å; F96-C339 VanDerWaalsContact CE1-SG 3.56Å; E98-C339 WeakPolarHBondContact OE1-CB 3.47Å; E98-C339 PolarHBondContact OE1-N 3.25Å; E98-C339 VanDerWaalsContact OE1-N 3.16Å; C262-C339 HydrophobicContact CB-CB 3.81Å; C262-C339 WeakPolarHBondContact CB-SG 3.4Å; C262-C339 VanDerWaalsContact SG-CA 3.58Å; C262-C339 WeakPolarHBondContact SG-CB 3.44Å; C262-C339 CovalentContact SG-SG 2.03Å; C262-C339 PolarHBondContact SG-SG 2.83Å; C339-L341 PolarHBondContact O-N 2.96Å; C339-L341 VanDerWaalsContact O-N 3.12Å; C339-A342 HydrophobicContact CB-CB 3.93Å; C339-A342 WeakPolarHBondContact O-CB 3.08Å; C339-A342 PolarHBondContact O-N 2.88Å
340	P	94.1	Very high	93.5	Very high	110 Å²	110	37 Å²	37	71%	0.714	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-17.6	-177.5	24.8	-36.3	0	0	0	114.1	C262 A338	C262-P340 VanDerWaalsContact SG-CD 3.59Å; A338-P340 WeakPolarHBondContact O-CD 3.4Å
341	L	93.9	Very high	93.6	Very high	88 Å²	88	37.3 Å²	37.3	46%	0.461	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-7.6	176.6	-59.1	176.5	0	0	0	112.8	L135 P261 C339	L135-L341 HydrophobicContact CD2-CB 4.32Å; L135-L341 HydrophobicContact CD2-CD1 4.15Å; P261-L341 HydrophobicContact CB-CB 4.34Å; P261-L341 HydrophobicContact CB-CD1 3.73Å; C339-L341 PolarHBondContact O-N 2.96Å; C339-L341 VanDerWaalsContact O-N 3.12Å
342	A	94.6	Very high	93.4	Very high	16 Å²	16	39.2 Å²	39.2	13%	0.132	22%	0.222	C	C	.	.			trans	-83.6	128.5	-179	0	0	0	0	0	111	F96 E98 C339 S344	F96-A342 HydrophobicContact CD1-CB 3.65Å; F96-A342 HydrophobicContact CE1-CB 4Å; F96-A342 CarbonylContact O-C 3.56Å; F96-A342 WeakPolarHBondContact O-CA 3.5Å; E98-A342 HydrophobicContact CG-CB 4.28Å; C339-A342 HydrophobicContact CB-CB 3.93Å; C339-A342 WeakPolarHBondContact O-CB 3.08Å; C339-A342 PolarHBondContact O-N 2.88Å; A342-S344 VanDerWaalsContact C-N 3.32Å
343	S	93.6	Very high	92.9	Very high	70 Å²	70	41.1 Å²	41.1	49%	0.49	23%	0.23	S	C	.	.	S	Bend	trans	-70.6	-27.9	170	60.2	0	0	0	0	112.8	E95 F96 Q97	E95-S343 VanDerWaalsContact CG-OG 3.3Å; E95-S343 WeakPolarHBondContact CG-OG 3.01Å; E95-S343 PolarHBondContact OE1-OG 2.63Å; F96-S343 PolarHBondContact O-N 3.31Å; F96-S343 PolarHBondContact O-OG 3.07Å; Q97-S343 VanDerWaalsContact CG-OG 3.23Å; Q97-S343 WeakPolarHBondContact CG-OG 3.41Å
344	S	93.8	Very high	92.4	Very high	26 Å²	26	36.9 Å²	36.9	18%	0.182	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	134	175.6	175.4	0	0	0	0	109.4	Q97 E98 A342	Q97-S344 WeakPolarHBondContact CA-O 3.34Å; E98-S344 PolarHBondContact N-O 3.43Å; A342-S344 VanDerWaalsContact C-N 3.32Å
345	S	95.6	Very high	91.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	103.5	178.2	-175.8	0	0	0	0	109.4	E98 L386	E98-S345 VanDerWaalsContact CD-OG 3.26Å; E98-S345 VanDerWaalsContact CG-OG 3.27Å; E98-S345 WeakPolarHBondContact CG-OG 3.39Å; E98-S345 WeakPolarHBondContact O-CA 3.36Å; E98-S345 VanDerWaalsContact OE1-CB 3.3Å; E98-S345 WeakPolarHBondContact OE1-CB 3.49Å; E98-S345 PolarHBondContact OE1-OG 2.85Å; S345-L386 WeakPolarHBondContact O-CB 3.4Å; S345-L386 PolarHBondContact O-N 2.76Å; S345-L386 WeakPolarHBondContact OG-CD1 3.11Å
346	K	95.7	Very high	90.2	Very high	62 Å²	62	48 Å²	48	27%	0.27	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	144.9	-169.3	-64.5	-179.5	-177.6	178.5	0	113	E98 E99 L100 Y348 V383 Y384	E98-K346 PolarHBondContact O-N 3.44Å; E98-K346 VanDerWaalsContact O-N 3.16Å; E99-K346 WeakPolarHBondContact CA-O 3.28Å; L100-K346 PolarHBondContact N-O 3.15Å; K346-Y348 HydrophobicContact CB-CD2 4.48Å; K346-Y348 HydrophobicContact CB-CE2 3.8Å; K346-Y348 WeakPolarHBondContact CD-OH 3.48Å; K346-V383 HydrophobicContact CB-CG1 4.41Å; K346-V383 HydrophobicContact CD-CG1 4.28Å; K346-Y384 WeakPolarHBondContact CA-O 3.21Å
347	I	96.3	Very high	89.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	130.7	168	-52.8	175.2	0	0	0	108.5	L100 I102 L268 L327 L335 I349 V383 Y384 L386 L398	L100-I347 HydrophobicContact CB-CG1 4.4Å; L100-I347 HydrophobicContact CB-CG2 4.47Å; L100-I347 HydrophobicContact CD2-CG2 4.33Å; L100-I347 HydrophobicContact CG-CG2 4.27Å; L100-I347 CarbonylContact O-C 3.52Å; L100-I347 VanDerWaalsContact O-CA 3.27Å; L100-I347 WeakPolarHBondContact O-CA 3.4Å; I102-I347 HydrophobicContact CD1-CG2 4.42Å; L268-I347 HydrophobicContact CD2-CD1 4.31Å; L268-I347 HydrophobicContact CD2-CG1 3.97Å; L327-I347 HydrophobicContact CD1-CD1 4.43Å; L335-I347 HydrophobicContact CD1-CD1 3.49Å; L335-I347 VanDerWaalsContact CD1-CD1 3.49Å; I347-I349 HydrophobicContact CG2-CG1 4.4Å; I347-V383 CarbonylContact O-C 3.57Å; I347-V383 WeakPolarHBondContact O-CA 3.4Å; I347-Y384 HydrophobicContact CB-CD2 4.44Å; I347-Y384 PolarHBondContact N-O 3.03Å; I347-Y384 PolarHBondContact O-N 3.49Å; I347-L386 HydrophobicContact CD1-CD1 4.3Å; I347-L386 HydrophobicContact CD1-CD2 4.05Å; I347-L386 HydrophobicContact CG1-CD1 4.13Å; I347-L386 HydrophobicContact CG1-CD2 4.38Å; I347-L386 HydrophobicContact CG1-CG 4.37Å; I347-L398 HydrophobicContact CD1-CD2 3.83Å
348	Y	95.8	Very high	88.3	Confident	15 Å²	15	48.6 Å²	48.6	6%	0.059	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	132.3	175.4	-61.2	-88	0	0	0	109	E99 L100 V101 I102 K346 F381 S382 V383 P554 F556	E99-Y348 HydrophobicContact CB-CD2 4.28Å; E99-Y348 HydrophobicContact CB-CE2 3.96Å; L100-Y348 PolarHBondContact O-N 3.37Å; V101-Y348 CarbonylContact C-O 3.57Å; V101-Y348 VanDerWaalsContact CA-O 3.31Å; V101-Y348 WeakPolarHBondContact CA-O 3.3Å; I102-Y348 PolarHBondContact N-O 2.83Å; K346-Y348 HydrophobicContact CB-CD2 4.48Å; K346-Y348 HydrophobicContact CB-CE2 3.8Å; K346-Y348 WeakPolarHBondContact CD-OH 3.48Å; Y348-F381 HydrophobicContact CD1-CB 3.99Å; Y348-F381 HydrophobicContact CD1-CG 4.44Å; Y348-S382 CarbonylContact C-O 3.58Å; Y348-S382 WeakPolarHBondContact CA-O 3.33Å; Y348-V383 HydrophobicContact CD1-CG1 4.4Å; Y348-V383 HydrophobicContact CD1-CG2 3.67Å; Y348-V383 HydrophobicContact CE1-CG1 4.09Å; Y348-V383 HydrophobicContact CE1-CG2 3.72Å; Y348-P554 HydrophobicContact CE2-CB 4.49Å; Y348-F556 HydrophobicContact CD1-CE1 4.47Å; Y348-F556 AromaticContact CD2-CE1 3.74Å; Y348-F556 HydrophobicContact CD2-CE1 3.74Å; Y348-F556 HydrophobicContact CE2-CE1 4.23Å; Y348-F556 AromaticContact CG-CE1 3.87Å; Y348-F556 HydrophobicContact CG-CE1 3.87Å; Y348-F556 HydrophobicContact CG-CZ 4.41Å
349	I	94.4	Very high	87.5	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	122.1	171.6	-55.8	-170.8	0	0	0	108.1	I102 I347 V351 L362 F381 S382 Y384 V400 I402	I102-I349 HydrophobicContact CB-CG1 4.4Å; I102-I349 WeakPolarHBondContact O-CA 3.44Å; I347-I349 HydrophobicContact CG2-CG1 4.4Å; I349-V351 HydrophobicContact CG2-CG1 4.46Å; I349-V351 PolarHBondContact O-N 3.17Å; I349-L362 HydrophobicContact CD1-CD2 4.18Å; I349-L362 HydrophobicContact CG2-CD1 4.36Å; I349-L362 HydrophobicContact CG2-CD2 4.11Å; I349-F381 CarbonylContact O-C 3.47Å; I349-F381 VanDerWaalsContact O-CA 3.24Å; I349-F381 WeakPolarHBondContact O-CA 3.33Å; I349-S382 PolarHBondContact N-O 2.85Å; I349-S382 PolarHBondContact O-N 2.74Å; I349-Y384 HydrophobicContact CD1-CD2 4.44Å; I349-Y384 HydrophobicContact CD1-CE2 3.74Å; I349-Y384 HydrophobicContact CG1-CE2 4.17Å; I349-V400 HydrophobicContact CD1-CB 4.35Å; I349-V400 HydrophobicContact CD1-CG1 3.39Å; I349-I402 HydrophobicContact CG2-CD1 4.18Å
350	D	92.5	Very high	87	Confident	6 Å²	6	50.6 Å²	50.6	3%	0.032	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	115.4	178.6	-161.6	-19.8	0	0	0	109.6	I102 R103 T352 R379 F381	I102-D350 PolarHBondContact O-N 3.14Å; R103-D350 HydrophobicContact CB-CB 4.24Å; R103-D350 HydrophobicContact CG-CB 4.07Å; D350-T352 VanDerWaalsContact OD1-CB 3.25Å; D350-T352 WeakPolarHBondContact OD1-CB 3.36Å; D350-T352 PolarHBondContact OD1-N 3.38Å; D350-T352 VanDerWaalsContact OD1-N 3.1Å; D350-T352 PolarHBondContact OD1-OG1 2.96Å; D350-R379 IonicContact OD2-CZ 2.74Å; D350-R379 IonicContact OD2-NH1 2.74Å; D350-R379 PolarHBondContact OD2-NH1 2.98Å; D350-F381 HydrophobicContact CB-CD1 4.04Å; D350-F381 HydrophobicContact CB-CE1 3.79Å
351	V	91.2	Very high	86.8	Confident	19 Å²	19	47.8 Å²	47.8	12%	0.115	26%	0.258	C	S	.	.			trans	-117.4	13.2	179.1	-64.3	0	0	0	0	111.5	I349 D353 N354 F360 L362 L369 T380	I349-V351 HydrophobicContact CG2-CG1 4.46Å; I349-V351 PolarHBondContact O-N 3.17Å; V351-D353 VanDerWaalsContact C-N 3.31Å; V351-D353 PolarHBondContact O-N 2.78Å; V351-N354 CarbonylContact O-C 3.59Å; V351-N354 PolarHBondContact O-N 3.12Å; V351-F360 HydrophobicContact CG1-CE2 4.13Å; V351-F360 HydrophobicContact CG1-CZ 4.09Å; V351-L362 HydrophobicContact CG1-CD1 3.81Å; V351-L369 HydrophobicContact CG2-CD2 4.46Å; V351-T380 VanDerWaalsContact CG2-O 3.28Å; V351-T380 WeakPolarHBondContact CG2-O 3.39Å; V351-T380 PolarHBondContact N-O 2.04Å
352	T	87.1	Confident	86.6	Confident	40 Å²	40	44.6 Å²	44.6	25%	0.245	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-44.8	-175.2	-51.5	0	0	0	0	112.7	D350 N354 R379 T380	D350-T352 VanDerWaalsContact OD1-CB 3.25Å; D350-T352 WeakPolarHBondContact OD1-CB 3.36Å; D350-T352 PolarHBondContact OD1-N 3.38Å; D350-T352 VanDerWaalsContact OD1-N 3.1Å; D350-T352 PolarHBondContact OD1-OG1 2.96Å; T352-N354 PolarHBondContact O-N 3.4Å; T352-R379 HydrophobicContact CG2-CG 4.47Å; T352-R379 VanDerWaalsContact OG1-CA 3.28Å; T352-R379 WeakPolarHBondContact OG1-CA 3.43Å; T352-R379 WeakPolarHBondContact OG1-CB 3.38Å; T352-T380 VanDerWaalsContact CA-OG1 3.27Å; T352-T380 WeakPolarHBondContact CA-OG1 3.27Å; T352-T380 PolarHBondContact N-O 2.95Å; T352-T380 PolarHBondContact N-OG1 3.07Å; T352-T380 PolarHBondContact OG1-N 2.75Å; T352-T380 PolarHBondContact OG1-O 3.41Å
353	D	80.5	Confident	86.4	Confident	70 Å²	70	47 Å²	47	37%	0.374	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	8.3	-178.2	-55.7	-45.3	0	0	0	112.5	H106 V351 P355 Q359	H106-D353 IonicContact NE2-OD2 3.32Å; V351-D353 VanDerWaalsContact C-N 3.31Å; V351-D353 PolarHBondContact O-N 2.78Å; D353-P355 VanDerWaalsContact C-CD 3.5Å; D353-Q359 PolarHBondContact O-NE2 2.84Å; D353-Q359 PolarHBondContact O-OE1 2.82Å
354	N	80.4	Confident	86.2	Confident	9 Å²	9	46.3 Å²	46.3	5%	0.048	25%	0.251	C	S	.	.			trans	-133.6	57.5	-175.1	-170.1	36.4	0	0	0	113.3	V351 T352 E356 E357 D358 Q359 F360	V351-N354 CarbonylContact O-C 3.59Å; V351-N354 PolarHBondContact O-N 3.12Å; T352-N354 PolarHBondContact O-N 3.4Å; N354-E356 PolarHBondContact O-N 3.43Å; N354-E357 VanDerWaalsContact OD1-C 3.28Å; N354-E357 VanDerWaalsContact OD1-CA 3.23Å; N354-E357 WeakPolarHBondContact OD1-CA 3.48Å; N354-D358 PolarHBondContact OD1-N 3.15Å; N354-D358 VanDerWaalsContact OD1-N 3.07Å; N354-Q359 HydrophobicContact CB-CB 4.38Å; N354-Q359 PolarHBondContact OD1-N 2.84Å; N354-F360 HydrophobicContact CB-CD1 4.18Å; N354-F360 HydrophobicContact CB-CE1 3.63Å; N354-F360 HydrophobicContact CB-CZ 3.87Å; N354-F360 WeakPolarHBondContact ND2-CD2 3.16Å; N354-F360 WeakPolarHBondContact ND2-CE2 3.32Å; N354-F360 WeakPolarHBondContact ND2-CG 3.33Å; N354-F360 WeakPolarHBondContact ND2-CZ 3.29Å; N354-F360 PolarHBondContact ND2-O 3.27Å
355	P	68.9	Low	85.8	Confident	118 Å²	118	48.5 Å²	48.5	77%	0.766	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-27.6	-172.9	26.6	-34.7	0	0	0	115	D353	D353-P355 VanDerWaalsContact C-CD 3.5Å
356	E	71.3	Confident	85.3	Confident	153 Å²	153	50.5 Å²	50.5	72%	0.715	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	16.3	-179.1	-62.3	-169.3	-179.2	0	0	113.6	N354 D358	N354-E356 PolarHBondContact O-N 3.43Å; E356-D358 PolarHBondContact O-N 3.03Å
357	E	73.9	Confident	84.6	Confident	90 Å²	90	56.5 Å²	56.5	42%	0.421	31%	0.311	S	S	.	.	S	Bend	trans	56.8	25.9	-172.8	-60.1	-172.4	174.5	0	0	114.7	N354 K405	N354-E357 VanDerWaalsContact OD1-C 3.28Å; N354-E357 VanDerWaalsContact OD1-CA 3.23Å; N354-E357 WeakPolarHBondContact OD1-CA 3.48Å; E357-K405 WeakPolarHBondContact O-CD 2.86Å; E357-K405 PolarHBondContact O-NZ 3.34Å
358	D	72.4	Confident	84.2	Confident	104 Å²	104	60.3 Å²	60.3	56%	0.556	33%	0.331	S	S	*	.	S	Bend	trans	-71.7	-36.4	179.3	-72.5	-30.6	0	0	0	112.7	N354 E356 K405	N354-D358 PolarHBondContact OD1-N 3.15Å; N354-D358 VanDerWaalsContact OD1-N 3.07Å; E356-D358 PolarHBondContact O-N 3.03Å; D358-K405 WeakPolarHBondContact O-CB 3.1Å
359	Q	77.3	Confident	83.9	Confident	62 Å²	62	65.1 Å²	65.1	29%	0.29	36%	0.357	S	S	.	.	S	Bend	trans	-84.5	-47.1	-176	-63.8	-170.7	0.9	0	0	111.6	D353 N354 W404 K405 S406	D353-Q359 PolarHBondContact O-NE2 2.84Å; D353-Q359 PolarHBondContact O-OE1 2.82Å; N354-Q359 HydrophobicContact CB-CB 4.38Å; N354-Q359 PolarHBondContact OD1-N 2.84Å; Q359-W404 HydrophobicContact CB-CE3 4.49Å; Q359-W404 HydrophobicContact CB-CZ3 4.18Å; Q359-K405 PolarHBondContact O-N 2.81Å; Q359-S406 PolarHBondContact O-N 3.41Å
360	F	84.6	Confident	83.7	Confident	4 Å²	4	67 Å²	67	2%	0.018	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	155.5	178.9	62.2	-95.9	0	0	0	112.4	P104 V351 N354 L362 I402 R403 W404	P104-F360 HydrophobicContact CB-CE1 4.28Å; P104-F360 HydrophobicContact CG-CE1 3.9Å; P104-F360 HydrophobicContact CG-CZ 3.94Å; V351-F360 HydrophobicContact CG1-CE2 4.13Å; V351-F360 HydrophobicContact CG1-CZ 4.09Å; N354-F360 HydrophobicContact CB-CD1 4.18Å; N354-F360 HydrophobicContact CB-CE1 3.63Å; N354-F360 HydrophobicContact CB-CZ 3.87Å; N354-F360 WeakPolarHBondContact ND2-CD2 3.16Å; N354-F360 WeakPolarHBondContact ND2-CE2 3.32Å; N354-F360 WeakPolarHBondContact ND2-CG 3.33Å; N354-F360 WeakPolarHBondContact ND2-CZ 3.29Å; N354-F360 PolarHBondContact ND2-O 3.27Å; F360-L362 HydrophobicContact CD2-CD2 3.95Å; F360-L362 HydrophobicContact CD2-CG 4.22Å; F360-L362 HydrophobicContact CE2-CD1 4.41Å; F360-L362 HydrophobicContact CE2-CD2 3.77Å; F360-L362 HydrophobicContact CE2-CG 4Å; F360-I402 HydrophobicContact CB-CG2 3.81Å; F360-I402 HydrophobicContact CD2-CG2 3.64Å; F360-I402 HydrophobicContact CE2-CG2 4.39Å; F360-I402 HydrophobicContact CG-CG2 3.8Å; F360-R403 CarbonylContact C-O 3.48Å; F360-R403 WeakPolarHBondContact CA-O 3.4Å; F360-R403 WeakPolarHBondContact CB-O 3.29Å; F360-W404 HydrophobicContact CB-CD2 4.19Å; F360-W404 HydrophobicContact CB-CE3 4.12Å; F360-W404 HydrophobicContact CD1-CE3 4.34Å; F360-W404 HydrophobicContact CD1-CH2 4.16Å; F360-W404 AromaticContact CD1-CZ3 3.97Å; F360-W404 HydrophobicContact CD1-CZ3 3.97Å
361	E	88.6	Confident	83.6	Confident	52 Å²	52	72.9 Å²	72.9	24%	0.243	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	144.7	173.3	-70.1	173.1	165.7	0	0	110.9	I402 R403 K405	E361-I402 WeakPolarHBondContact O-CA 3.16Å; E361-R403 PolarHBondContact N-O 3.04Å; E361-R403 PolarHBondContact O-N 2.97Å; E361-R403 IonicContact OE1-NH2 3.8Å; E361-R403 IonicContact OE2-CZ 3.24Å; E361-R403 VanDerWaalsContact OE2-CZ 3.24Å; E361-R403 IonicContact OE2-NE 3.06Å; E361-R403 PolarHBondContact OE2-NE 3.11Å; E361-R403 IonicContact OE2-NH2 2.65Å; E361-R403 PolarHBondContact OE2-NH2 3.47Å; E361-K405 HydrophobicContact CG-CD 4.28Å; E361-K405 WeakPolarHBondContact OE1-CE 3.5Å; E361-K405 IonicContact OE1-NZ 2.8Å; E361-K405 PolarHBondContact OE1-NZ 2.88Å
362	L	89.8	Confident	83.5	Confident	21 Å²	21	72.5 Å²	72.5	11%	0.11	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	134.3	175.3	-63.9	-179.8	0	0	0	111.3	I349 V351 F360 L401 I402	I349-L362 HydrophobicContact CD1-CD2 4.18Å; I349-L362 HydrophobicContact CG2-CD1 4.36Å; I349-L362 HydrophobicContact CG2-CD2 4.11Å; V351-L362 HydrophobicContact CG1-CD1 3.81Å; F360-L362 HydrophobicContact CD2-CD2 3.95Å; F360-L362 HydrophobicContact CD2-CG 4.22Å; F360-L362 HydrophobicContact CE2-CD1 4.41Å; F360-L362 HydrophobicContact CE2-CD2 3.77Å; F360-L362 HydrophobicContact CE2-CG 4Å; L362-L401 WeakPolarHBondContact CA-O 3.4Å; L362-I402 HydrophobicContact CD2-CB 4.42Å; L362-I402 HydrophobicContact CD2-CD1 4.28Å; L362-I402 HydrophobicContact CD2-CG1 3.69Å; L362-I402 HydrophobicContact CD2-CG2 4.49Å
363	S	89.9	Confident	83.5	Confident	65 Å²	65	72.7 Å²	72.7	46%	0.455	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	124.8	173.2	169	0	0	0	0	110.5	L401	S363-L401 PolarHBondContact N-O 2.95Å; S363-L401 PolarHBondContact O-N 2.97Å
364	P	90.3	Very high	83.9	Confident	57 Å²	57	69.5 Å²	69.5	37%	0.37	38%	0.38	S	S	.	.	S	Bend	cis	-70.6	143.3	-3.7	28.7	-32.3	0	0	0	111.6	Y384 L398	P364-Y384 HydrophobicContact CG-CE1 4.15Å; P364-Y384 VanDerWaalsContact O-CE1 3.29Å; P364-Y384 WeakPolarHBondContact O-CE1 3.42Å; P364-Y384 PolarHBondContact O-OH 2.76Å; P364-L398 HydrophobicContact CG-CD1 4Å
365	A	85.3	Confident	84.2	Confident	71 Å²	71	70.7 Å²	70.7	59%	0.587	39%	0.387	S	S	*	.			trans	-68.2	145.9	173.2	0	0	0	0	0	110.5
366	T	84.3	Confident	84.9	Confident	42 Å²	42	65.1 Å²	65.1	26%	0.258	35%	0.351	S	S	.	.			trans	-133.5	142.8	174.4	177.5	0	0	0	0	109.3	L368 S382 V383 Y384	T366-L368 PolarHBondContact OG1-N 3.36Å; T366-S382 WeakPolarHBondContact CG2-OG 3.25Å; T366-V383 PolarHBondContact OG1-O 3.35Å; T366-Y384 HydrophobicContact CG2-CD1 4.22Å; T366-Y384 HydrophobicContact CG2-CD2 4.4Å; T366-Y384 HydrophobicContact CG2-CE1 3.76Å; T366-Y384 HydrophobicContact CG2-CE2 3.96Å
367	H	81.6	Confident	85.7	Confident	188 Å²	188	60.8 Å²	60.8	87%	0.87	33%	0.332	S	S	*	.			trans	-90.5	-4.5	175.7	-58.6	-63.5	0	0	0	112.5	L369	H367-L369 PolarHBondContact O-N 3.45Å; H367-L369 VanDerWaalsContact O-N 3.11Å
368	L	87.8	Confident	86.4	Confident	81 Å²	81	64.1 Å²	64.1	42%	0.424	34%	0.341	S	S	.	.			trans	-77.1	100.4	179.5	-172.3	67.2	0	0	0	109.4	T366 V383	T366-L368 PolarHBondContact OG1-N 3.36Å; L368-V383 HydrophobicContact CB-CB 4.42Å; L368-V383 HydrophobicContact CD2-CB 3.78Å; L368-V383 HydrophobicContact CD2-CG1 3.84Å; L368-V383 HydrophobicContact CG-CB 3.91Å; L368-V383 HydrophobicContact CG-CG1 4.48Å; L368-V383 PolarHBondContact O-N 2.74Å
369	L	90.2	Very high	87.3	Confident	116 Å²	116	60.4 Å²	60.4	61%	0.607	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	141.1	175.2	-63	175.9	0	0	0	110.4	V351 H367 F381	V351-L369 HydrophobicContact CG2-CD2 4.46Å; H367-L369 PolarHBondContact O-N 3.45Å; H367-L369 VanDerWaalsContact O-N 3.11Å; L369-F381 CarbonylContact C-O 3.51Å; L369-F381 WeakPolarHBondContact CA-O 3.17Å
370	S	90.4	Very high	88	Confident	39 Å²	39	59.3 Å²	59.3	27%	0.273	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	140	171.8	179.7	0	0	0	0	109.8	F381	S370-F381 PolarHBondContact N-O 2.89Å; S370-F381 PolarHBondContact O-N 3.09Å
371	Q	90.1	Very high	88.4	Confident	130 Å²	130	59.1 Å²	59.1	61%	0.607	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	133.5	173.9	-74.9	-177.6	-4.4	0	0	109.6	R379 T380	Q371-R379 WeakPolarHBondContact CA-O 3.35Å; Q371-T380 HydrophobicContact CG-CG2 3.71Å
372	A	88.2	Confident	88.7	Confident	11 Å²	11	56.8 Å²	56.8	9%	0.091	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	147.2	174.1	0	0	0	0	0	110.6	V374 R379 F381 P554	A372-V374 HydrophobicContact CB-CG2 4.23Å; A372-R379 PolarHBondContact N-O 3.42Å; A372-R379 PolarHBondContact O-N 3.17Å; A372-F381 HydrophobicContact CB-CD2 4.5Å; A372-F381 HydrophobicContact CB-CE2 4.13Å; A372-P554 HydrophobicContact CB-CG 3.64Å
373	V	88.6	Confident	88.9	Confident	43 Å²	43	56.1 Å²	56.1	26%	0.261	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	120.7	170.3	-177.9	0	0	0	0	107.6	D377 V543 M545	V373-D377 CarbonylContact C-O 3.52Å; V373-D377 WeakPolarHBondContact CA-O 3.42Å; V373-V543 HydrophobicContact CG2-CG1 4.12Å; V373-M545 HydrophobicContact CG1-CE 3.74Å; V373-M545 HydrophobicContact CG1-SD 3.53Å; V373-M545 VanDerWaalsContact CG1-SD 3.53Å
374	V	87.9	Confident	89.2	Confident	3 Å²	3	53.4 Å²	53.4	2%	0.018	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	121	-177.4	-169.1	0	0	0	0	108.8	Y170 A372 G376 D377 F381 F556	Y170-V374 HydrophobicContact CD1-CG1 3.66Å; Y170-V374 HydrophobicContact CE1-CG1 3.6Å; A372-V374 HydrophobicContact CB-CG2 4.23Å; V374-G376 VanDerWaalsContact C-N 3.26Å; V374-G376 PolarHBondContact O-N 3.39Å; V374-D377 PolarHBondContact N-O 3.38Å; V374-D377 PolarHBondContact O-N 3.49Å; V374-F381 HydrophobicContact CG2-CE2 4.21Å; V374-F381 HydrophobicContact CG2-CZ 4.2Å; V374-F556 HydrophobicContact CG2-CD2 4.35Å; V374-F556 HydrophobicContact CG2-CE2 3.83Å
375	L	85.8	Confident	89.3	Confident	35 Å²	35	51.8 Å²	51.8	18%	0.183	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	40.7	175.4	-59.2	174.8	0	0	0	114.6	Q168 Y568	Q168-L375 HydrophobicContact CB-CD1 3.71Å; L375-Y568 VanDerWaalsContact C-CE2 3.47Å; L375-Y568 VanDerWaalsContact C-CZ 3.4Å; L375-Y568 HydrophobicContact CB-CD2 4.31Å; L375-Y568 HydrophobicContact CB-CE2 3.89Å; L375-Y568 HydrophobicContact CD2-CD2 4.14Å; L375-Y568 HydrophobicContact CD2-CE2 4.15Å; L375-Y568 WeakPolarHBondContact O-CE1 3.36Å; L375-Y568 WeakPolarHBondContact O-CE2 3.32Å; L375-Y568 PolarHBondContact O-OH 3.3Å; L375-Y568 VanDerWaalsContact O-OH 3.06Å
376	G	84.7	Confident	89.8	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.01	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	109.6	-24.5	175.6	0	0	0	0	0	113.6	V374 S541 T542 V543 Y568	V374-G376 VanDerWaalsContact C-N 3.26Å; V374-G376 PolarHBondContact O-N 3.39Å; G376-S541 WeakPolarHBondContact CA-OG 3.42Å; G376-S541 PolarHBondContact O-OG 2.88Å; G376-T542 PolarHBondContact O-N 2.76Å; G376-T542 PolarHBondContact O-OG1 3.38Å; G376-V543 PolarHBondContact O-N 3.36Å; G376-Y568 VanDerWaalsContact CA-CE1 3.45Å
377	D	87.2	Confident	90.1	Very high	61 Å²	61	50.2 Å²	50.2	33%	0.326	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	145	-160.7	-62	-30.5	0	0	0	112.1	V373 V374 R379 T542	V373-D377 CarbonylContact C-O 3.52Å; V373-D377 WeakPolarHBondContact CA-O 3.42Å; V374-D377 PolarHBondContact N-O 3.38Å; V374-D377 PolarHBondContact O-N 3.49Å; D377-R379 PolarHBondContact O-N 3.1Å; D377-T542 PolarHBondContact OD1-OG1 3.47Å; D377-T542 VanDerWaalsContact OD1-OG1 3.1Å
378	R	89.9	Confident	90.6	Very high	161 Å²	161	46 Å²	46	61%	0.608	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	116.1	173.3	-175.2	178.2	63.4	-165.4	-1.3	109.6	V543	R378-V543 HydrophobicContact CB-CG2 4.24Å
379	R	90.6	Very high	90.5	Very high	26 Å²	26	50.7 Å²	50.7	10%	0.098	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	145.4	-179.3	-64.9	-172.5	178.5	-122.9	-9.2	111.6	R103 D350 T352 Q371 A372 D377 F381	R103-R379 VanDerWaalsContact NE-NH1 3.13Å; D350-R379 IonicContact OD2-CZ 2.74Å; D350-R379 IonicContact OD2-NH1 2.74Å; D350-R379 PolarHBondContact OD2-NH1 2.98Å; T352-R379 HydrophobicContact CG2-CG 4.47Å; T352-R379 VanDerWaalsContact OG1-CA 3.28Å; T352-R379 WeakPolarHBondContact OG1-CA 3.43Å; T352-R379 WeakPolarHBondContact OG1-CB 3.38Å; Q371-R379 WeakPolarHBondContact CA-O 3.35Å; A372-R379 PolarHBondContact N-O 3.42Å; A372-R379 PolarHBondContact O-N 3.17Å; D377-R379 PolarHBondContact O-N 3.1Å; R379-F381 HydrophobicContact CB-CD2 4.42Å; R379-F381 HydrophobicContact CB-CE2 3.55Å; R379-F381 HydrophobicContact CB-CZ 3.68Å
380	T	92.4	Very high	90.4	Very high	38 Å²	38	51.2 Å²	51.2	23%	0.233	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	128.9	175.7	48.6	0	0	0	0	109.8	V351 T352 Q371	V351-T380 VanDerWaalsContact CG2-O 3.28Å; V351-T380 WeakPolarHBondContact CG2-O 3.39Å; V351-T380 PolarHBondContact N-O 2.04Å; T352-T380 VanDerWaalsContact CA-OG1 3.27Å; T352-T380 WeakPolarHBondContact CA-OG1 3.27Å; T352-T380 PolarHBondContact N-O 2.95Å; T352-T380 PolarHBondContact N-OG1 3.07Å; T352-T380 PolarHBondContact OG1-N 2.75Å; T352-T380 PolarHBondContact OG1-O 3.41Å; Q371-T380 HydrophobicContact CG-CG2 3.71Å
381	F	93.6	Very high	90.4	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	135.5	-178.6	-60.6	-83.7	0	0	0	111	V101 Y348 I349 D350 L369 S370 A372 V374 R379 F556	V101-F381 HydrophobicContact CG2-CD1 4.36Å; V101-F381 HydrophobicContact CG2-CE1 3.98Å; Y348-F381 HydrophobicContact CD1-CB 3.99Å; Y348-F381 HydrophobicContact CD1-CG 4.44Å; I349-F381 CarbonylContact O-C 3.47Å; I349-F381 VanDerWaalsContact O-CA 3.24Å; I349-F381 WeakPolarHBondContact O-CA 3.33Å; D350-F381 HydrophobicContact CB-CD1 4.04Å; D350-F381 HydrophobicContact CB-CE1 3.79Å; L369-F381 CarbonylContact C-O 3.51Å; L369-F381 WeakPolarHBondContact CA-O 3.17Å; S370-F381 PolarHBondContact N-O 2.89Å; S370-F381 PolarHBondContact O-N 3.09Å; A372-F381 HydrophobicContact CB-CD2 4.5Å; A372-F381 HydrophobicContact CB-CE2 4.13Å; V374-F381 HydrophobicContact CG2-CE2 4.21Å; V374-F381 HydrophobicContact CG2-CZ 4.2Å; R379-F381 HydrophobicContact CB-CD2 4.42Å; R379-F381 HydrophobicContact CB-CE2 3.55Å; R379-F381 HydrophobicContact CB-CZ 3.68Å; F381-F556 HydrophobicContact CD1-CZ 4.47Å; F381-F556 HydrophobicContact CD2-CZ 4.35Å; F381-F556 HydrophobicContact CE1-CE2 4.33Å; F381-F556 HydrophobicContact CE1-CZ 4.08Å; F381-F556 HydrophobicContact CE2-CE2 4.05Å; F381-F556 AromaticContact CE2-CZ 3.95Å; F381-F556 HydrophobicContact CE2-CZ 3.95Å; F381-F556 AromaticContact CZ-CE2 3.75Å; F381-F556 HydrophobicContact CZ-CE2 3.75Å; F381-F556 AromaticContact CZ-CZ 3.81Å; F381-F556 HydrophobicContact CZ-CZ 3.81Å
382	S	94.1	Very high	90.3	Very high	4 Å²	4	45.2 Å²	45.2	3%	0.028	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	127.7	164.4	177.6	0	0	0	0	109.4	Y348 I349 T366	Y348-S382 CarbonylContact C-O 3.58Å; Y348-S382 WeakPolarHBondContact CA-O 3.33Å; I349-S382 PolarHBondContact N-O 2.85Å; I349-S382 PolarHBondContact O-N 2.74Å; T366-S382 WeakPolarHBondContact CG2-OG 3.25Å
383	V	94.6	Very high	90.1	Very high	6 Å²	6	47 Å²	47	4%	0.036	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	130	-170.3	-172.3	0	0	0	0	111.6	K346 I347 Y348 T366 L368	K346-V383 HydrophobicContact CB-CG1 4.41Å; K346-V383 HydrophobicContact CD-CG1 4.28Å; I347-V383 CarbonylContact O-C 3.57Å; I347-V383 WeakPolarHBondContact O-CA 3.4Å; Y348-V383 HydrophobicContact CD1-CG1 4.4Å; Y348-V383 HydrophobicContact CD1-CG2 3.67Å; Y348-V383 HydrophobicContact CE1-CG1 4.09Å; Y348-V383 HydrophobicContact CE1-CG2 3.72Å; T366-V383 PolarHBondContact OG1-O 3.35Å; L368-V383 HydrophobicContact CB-CB 4.42Å; L368-V383 HydrophobicContact CD2-CB 3.78Å; L368-V383 HydrophobicContact CD2-CG1 3.84Å; L368-V383 HydrophobicContact CG-CB 3.91Å; L368-V383 HydrophobicContact CG-CG1 4.48Å; L368-V383 PolarHBondContact O-N 2.74Å
384	Y	94.8	Very high	89.8	Confident	8 Å²	8	51.8 Å²	51.8	3%	0.031	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	110.2	169.4	-57.7	-95.6	0	0	0	108.8	K346 I347 I349 P364 T366 T391 L398 V400	K346-Y384 WeakPolarHBondContact CA-O 3.21Å; I347-Y384 HydrophobicContact CB-CD2 4.44Å; I347-Y384 PolarHBondContact N-O 3.03Å; I347-Y384 PolarHBondContact O-N 3.49Å; I349-Y384 HydrophobicContact CD1-CD2 4.44Å; I349-Y384 HydrophobicContact CD1-CE2 3.74Å; I349-Y384 HydrophobicContact CG1-CE2 4.17Å; P364-Y384 HydrophobicContact CG-CE1 4.15Å; P364-Y384 VanDerWaalsContact O-CE1 3.29Å; P364-Y384 WeakPolarHBondContact O-CE1 3.42Å; P364-Y384 PolarHBondContact O-OH 2.76Å; T366-Y384 HydrophobicContact CG2-CD1 4.22Å; T366-Y384 HydrophobicContact CG2-CD2 4.4Å; T366-Y384 HydrophobicContact CG2-CE1 3.76Å; T366-Y384 HydrophobicContact CG2-CE2 3.96Å; Y384-T391 HydrophobicContact CD1-CG2 4.35Å; Y384-L398 HydrophobicContact CD1-CD1 4.32Å; Y384-V400 HydrophobicContact CD1-CG2 4.5Å; Y384-V400 HydrophobicContact CD2-CG2 4.36Å; Y384-V400 HydrophobicContact CE1-CG2 4.39Å; Y384-V400 HydrophobicContact CE2-CG1 4.22Å; Y384-V400 HydrophobicContact CE2-CG2 4.25Å; Y384-V400 HydrophobicContact CG-CG2 4.48Å
385	D	94.3	Very high	89.5	Confident	23 Å²	23	57.3 Å²	57.3	12%	0.123	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	111.1	176.6	-165.6	-29	0	0	0	109.8	T387 Q388 T391	D385-T387 VanDerWaalsContact CG-OG1 3.32Å; D385-T387 PolarHBondContact O-N 2.95Å; D385-T387 WeakPolarHBondContact OD1-CB 3.28Å; D385-T387 PolarHBondContact OD1-N 3.28Å; D385-T387 PolarHBondContact OD1-OG1 2.86Å; D385-Q388 HydrophobicContact CB-CG 4.18Å; D385-Q388 PolarHBondContact O-N 3Å; D385-T391 WeakPolarHBondContact O-CB 3.46Å; D385-T391 PolarHBondContact O-OG1 3.2Å
386	L	93.9	Very high	89.6	Confident	2 Å²	2	65.1 Å²	65.1	1%	0.01	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-12.2	-176.6	-58	179.7	0	0	0	112.3	L268 L335 A338 S345 I347 Q388 T391 F392 L398	L268-L386 HydrophobicContact CD2-CD1 3.55Å; L268-L386 HydrophobicContact CG-CD1 4.07Å; L335-L386 HydrophobicContact CD1-CD1 3.97Å; L335-L386 HydrophobicContact CD1-CD2 4.21Å; A338-L386 HydrophobicContact CB-CB 3.92Å; A338-L386 WeakPolarHBondContact CB-O 3.28Å; S345-L386 WeakPolarHBondContact O-CB 3.4Å; S345-L386 PolarHBondContact O-N 2.76Å; S345-L386 WeakPolarHBondContact OG-CD1 3.11Å; I347-L386 HydrophobicContact CD1-CD1 4.3Å; I347-L386 HydrophobicContact CD1-CD2 4.05Å; I347-L386 HydrophobicContact CG1-CD1 4.13Å; I347-L386 HydrophobicContact CG1-CD2 4.38Å; I347-L386 HydrophobicContact CG1-CG 4.37Å; L386-Q388 PolarHBondContact O-N 3.26Å; L386-T391 HydrophobicContact CD2-CG2 4.27Å; L386-F392 HydrophobicContact CB-CZ 4.17Å; L386-F392 HydrophobicContact CD2-CE1 4.29Å; L386-F392 HydrophobicContact CD2-CZ 4.13Å; L386-F392 WeakPolarHBondContact O-CE2 3.44Å; L386-L398 HydrophobicContact CD2-CD2 3.51Å
387	T	92.2	Very high	89.9	Confident	78 Å²	78	67 Å²	67	48%	0.479	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-19.8	174.5	68.2	0	0	0	0	112	D385	D385-T387 VanDerWaalsContact CG-OG1 3.32Å; D385-T387 PolarHBondContact O-N 2.95Å; D385-T387 WeakPolarHBondContact OD1-CB 3.28Å; D385-T387 PolarHBondContact OD1-N 3.28Å; D385-T387 PolarHBondContact OD1-OG1 2.86Å
388	Q	91	Very high	90.2	Very high	100 Å²	100	64.2 Å²	64.2	47%	0.467	34%	0.338	S	S	.	.	S	Bend	trans	-90.5	126.3	-179.5	-59.2	-177.3	7.8	0	0	111	D385 L386 V390 T391	D385-Q388 HydrophobicContact CB-CG 4.18Å; D385-Q388 PolarHBondContact O-N 3Å; L386-Q388 PolarHBondContact O-N 3.26Å; Q388-V390 PolarHBondContact O-N 2.95Å; Q388-T391 WeakPolarHBondContact O-CB 3.33Å; Q388-T391 PolarHBondContact O-N 2.9Å; Q388-T391 PolarHBondContact O-OG1 2.79Å
389	Q	86.7	Confident	90.3	Very high	179 Å²	179	59.3 Å²	59.3	84%	0.836	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-62.3	-29.1	179.7	-68.8	-179.9	-4.4	0	0	113.1	T391 F392	Q389-T391 PolarHBondContact O-N 2.95Å; Q389-F392 PolarHBondContact O-N 2.84Å
390	V	88.4	Confident	90.4	Very high	127 Å²	127	58.3 Å²	58.3	77%	0.77	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-59.6	-33	179	-178.2	0	0	0	0	111.4	Q388 F392 G393	Q388-V390 PolarHBondContact O-N 2.95Å; V390-F392 VanDerWaalsContact C-N 3.26Å; V390-F392 PolarHBondContact O-N 3.02Å; V390-G393 PolarHBondContact O-N 3.13Å
391	T	88.8	Confident	90.4	Very high	25 Å²	25	58.7 Å²	58.7	15%	0.153	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-61.2	-32.3	-178.3	-53.7	0	0	0	0	112.7	Y384 D385 L386 Q388 Q389 G393 L398	Y384-T391 HydrophobicContact CD1-CG2 4.35Å; D385-T391 WeakPolarHBondContact O-CB 3.46Å; D385-T391 PolarHBondContact O-OG1 3.2Å; L386-T391 HydrophobicContact CD2-CG2 4.27Å; Q388-T391 WeakPolarHBondContact O-CB 3.33Å; Q388-T391 PolarHBondContact O-N 2.9Å; Q388-T391 PolarHBondContact O-OG1 2.79Å; Q389-T391 PolarHBondContact O-N 2.95Å; T391-G393 VanDerWaalsContact C-N 3.28Å; T391-G393 PolarHBondContact O-N 2.79Å; T391-L398 HydrophobicContact CG2-CD1 4.27Å; T391-L398 HydrophobicContact CG2-CD2 3.98Å; T391-L398 WeakPolarHBondContact O-CD1 3.44Å
392	F	88.1	Confident	90.1	Very high	19 Å²	19	58.9 Å²	58.9	8%	0.083	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-84	-2.2	179.9	-59.6	-79.8	0	0	0	113.9	L335 T336 L386 Q389 V390 R396 S397 L398	L335-F392 HydrophobicContact CB-CE1 4.23Å; L335-F392 WeakPolarHBondContact O-CD1 3.24Å; T336-F392 VanDerWaalsContact C-CE1 3.45Å; L386-F392 HydrophobicContact CB-CZ 4.17Å; L386-F392 HydrophobicContact CD2-CE1 4.29Å; L386-F392 HydrophobicContact CD2-CZ 4.13Å; L386-F392 WeakPolarHBondContact O-CE2 3.44Å; Q389-F392 PolarHBondContact O-N 2.84Å; V390-F392 VanDerWaalsContact C-N 3.26Å; V390-F392 PolarHBondContact O-N 3.02Å; F392-R396 WeakPolarHBondContact O-CA 3.35Å; F392-R396 PolarHBondContact O-N 3.02Å; F392-S397 PolarHBondContact O-N 2.76Å; F392-S397 VanDerWaalsContact O-N 3.09Å; F392-L398 HydrophobicContact CD1-CB 3.89Å; F392-L398 HydrophobicContact CE1-CB 4.26Å
393	G	84.7	Confident	89.8	Confident	48 Å²	48	64.3 Å²	64.3	50%	0.495	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	-163	-178.1	0	0	0	0	0	113.6	V390 T391 V395 R396	V390-G393 PolarHBondContact O-N 3.13Å; T391-G393 VanDerWaalsContact C-N 3.28Å; T391-G393 PolarHBondContact O-N 2.79Å; G393-V395 VanDerWaalsContact C-N 3.3Å; G393-V395 PolarHBondContact O-N 2.83Å; G393-R396 PolarHBondContact O-N 2.91Å
394	T	82.1	Confident	89.3	Confident	144 Å²	144	66.1 Å²	66.1	88%	0.883	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-27.6	179.6	50.3	0	0	0	0	113.1	R396	T394-R396 VanDerWaalsContact C-N 3.27Å; T394-R396 PolarHBondContact O-N 2.98Å
395	V	82.4	Confident	88.6	Confident	118 Å²	118	70.6 Å²	70.6	72%	0.715	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-3.2	-175.7	-165.8	0	0	0	0	112	G393 S397	G393-V395 VanDerWaalsContact C-N 3.3Å; G393-V395 PolarHBondContact O-N 2.83Å; V395-S397 PolarHBondContact O-N 2.92Å
396	R	87.1	Confident	87.5	Confident	200 Å²	200	71.7 Å²	71.7	76%	0.755	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	36.6	-175.9	-61	-173.4	178	-177.2	-0.5	112.8	F392 G393 T394	F392-R396 WeakPolarHBondContact O-CA 3.35Å; F392-R396 PolarHBondContact O-N 3.02Å; G393-R396 PolarHBondContact O-N 2.91Å; T394-R396 VanDerWaalsContact C-N 3.27Å; T394-R396 PolarHBondContact O-N 2.98Å
397	S	91.8	Very high	86	Confident	40 Å²	40	76.6 Å²	76.6	28%	0.28	41%	0.407	S	S	.	.			trans	-150.3	114.8	-176.1	-179.7	0	0	0	0	108.8	T334 L335 F392 V395	T334-S397 VanDerWaalsContact CB-OG 3.3Å; T334-S397 WeakPolarHBondContact CB-OG 3.15Å; T334-S397 PolarHBondContact OG1-OG 3.39Å; L335-S397 CarbonylContact O-C 3.59Å; L335-S397 WeakPolarHBondContact O-CA 3.21Å; F392-S397 PolarHBondContact O-N 2.76Å; F392-S397 VanDerWaalsContact O-N 3.09Å; V395-S397 PolarHBondContact O-N 2.92Å
398	L	92.6	Very high	84.4	Confident	3 Å²	3	80.9 Å²	80.9	2%	0.016	42%	0.422	C	S	.	.	B	Isolated β-bridge	trans	-90.3	118.7	174.3	179.8	71.6	0	0	0	109.1	L335 I347 P364 Y384 L386 T391 F392 V400	L335-L398 HydrophobicContact CB-CB 4.32Å; L335-L398 HydrophobicContact CD1-CD2 4.44Å; L335-L398 PolarHBondContact N-O 2.89Å; L335-L398 PolarHBondContact O-N 2.79Å; I347-L398 HydrophobicContact CD1-CD2 3.83Å; P364-L398 HydrophobicContact CG-CD1 4Å; Y384-L398 HydrophobicContact CD1-CD1 4.32Å; L386-L398 HydrophobicContact CD2-CD2 3.51Å; T391-L398 HydrophobicContact CG2-CD1 4.27Å; T391-L398 HydrophobicContact CG2-CD2 3.98Å; T391-L398 WeakPolarHBondContact O-CD1 3.44Å; F392-L398 HydrophobicContact CD1-CB 3.89Å; F392-L398 HydrophobicContact CE1-CB 4.26Å; L398-V400 HydrophobicContact CD1-CG2 3.92Å; L398-V400 HydrophobicContact CD2-CG2 4.08Å; L398-V400 HydrophobicContact CG-CG2 3.94Å
399	N	93.1	Very high	82.8	Confident	58 Å²	58	78.1 Å²	78.1	31%	0.31	42%	0.42	S	S	.	.			trans	-128	90.6	170	-172.4	28.2	0	0	0	108.6	S326 L327 F328 T334 L401	S326-N399 WeakPolarHBondContact CB-OD1 3.41Å; L327-N399 PolarHBondContact N-OD1 3.33Å; F328-N399 PolarHBondContact N-OD1 2.89Å; T334-N399 HydrophobicContact CG2-CB 3.66Å; N399-L401 PolarHBondContact O-N 3.43Å
400	V	92.3	Very high	81.6	Confident	4 Å²	4	76.7 Å²	76.7	2%	0.024	42%	0.418	C	S	.	.			trans	-68.9	127.1	178.5	-171.4	0	0	0	0	109	S326 L327 I349 Y384 L398	S326-V400 WeakPolarHBondContact CA-O 3.46Å; L327-V400 HydrophobicContact CD1-CB 4.35Å; L327-V400 HydrophobicContact CD1-CG2 4.16Å; L327-V400 HydrophobicContact CG-CB 4.33Å; L327-V400 PolarHBondContact N-O 3.49Å; I349-V400 HydrophobicContact CD1-CB 4.35Å; I349-V400 HydrophobicContact CD1-CG1 3.39Å; Y384-V400 HydrophobicContact CD1-CG2 4.5Å; Y384-V400 HydrophobicContact CD2-CG2 4.36Å; Y384-V400 HydrophobicContact CE1-CG2 4.39Å; Y384-V400 HydrophobicContact CE2-CG1 4.22Å; Y384-V400 HydrophobicContact CE2-CG2 4.25Å; Y384-V400 HydrophobicContact CG-CG2 4.48Å; L398-V400 HydrophobicContact CD1-CG2 3.92Å; L398-V400 HydrophobicContact CD2-CG2 4.08Å; L398-V400 HydrophobicContact CG-CG2 3.94Å
401	L	91.1	Very high	80.6	Confident	47 Å²	47	75 Å²	75	25%	0.246	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	131.1	179.3	178.7	81	0	0	0	109.1	E324 W325 L362 S363 N399	E324-L401 HydrophobicContact CB-CD1 4.45Å; W325-L401 CarbonylContact O-C 3.49Å; W325-L401 WeakPolarHBondContact O-CA 3.26Å; W325-L401 WeakPolarHBondContact O-CD1 3.45Å; L362-L401 WeakPolarHBondContact CA-O 3.4Å; S363-L401 PolarHBondContact N-O 2.95Å; S363-L401 PolarHBondContact O-N 2.97Å; N399-L401 PolarHBondContact O-N 3.43Å
402	I	88.6	Confident	79.6	Confident	4 Å²	4	79.4 Å²	79.4	2%	0.021	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	120.6	170.3	-52.9	-175.6	0	0	0	107.3	I102 P104 E324 W325 I349 F360 E361 L362	I102-I402 HydrophobicContact CG2-CD1 4.18Å; P104-I402 HydrophobicContact CG-CD1 4.24Å; E324-I402 WeakPolarHBondContact CA-O 3.36Å; W325-I402 HydrophobicContact CB-CB 4.48Å; W325-I402 HydrophobicContact CE3-CB 3.95Å; W325-I402 HydrophobicContact CE3-CD1 4.44Å; W325-I402 HydrophobicContact CE3-CG2 3.88Å; W325-I402 HydrophobicContact CZ3-CG2 4.35Å; W325-I402 PolarHBondContact N-O 2.83Å; W325-I402 PolarHBondContact O-N 3.08Å; I349-I402 HydrophobicContact CG2-CD1 4.18Å; F360-I402 HydrophobicContact CB-CG2 3.81Å; F360-I402 HydrophobicContact CD2-CG2 3.64Å; F360-I402 HydrophobicContact CE2-CG2 4.39Å; F360-I402 HydrophobicContact CG-CG2 3.8Å; E361-I402 WeakPolarHBondContact O-CA 3.16Å; L362-I402 HydrophobicContact CD2-CB 4.42Å; L362-I402 HydrophobicContact CD2-CD1 4.28Å; L362-I402 HydrophobicContact CD2-CG1 3.69Å; L362-I402 HydrophobicContact CD2-CG2 4.49Å
403	R	87.8	Confident	79.3	Confident	117 Å²	117	86.9 Å²	86.9	44%	0.442	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	116.1	178	-177.6	173	78.6	153.8	5.6	109.9	E324 F360 E361	E324-R403 HydrophobicContact CG-CB 4.41Å; E324-R403 HydrophobicContact CG-CG 4.02Å; F360-R403 CarbonylContact C-O 3.48Å; F360-R403 WeakPolarHBondContact CA-O 3.4Å; F360-R403 WeakPolarHBondContact CB-O 3.29Å; E361-R403 PolarHBondContact N-O 3.04Å; E361-R403 PolarHBondContact O-N 2.97Å; E361-R403 IonicContact OE1-NH2 3.8Å; E361-R403 IonicContact OE2-CZ 3.24Å; E361-R403 VanDerWaalsContact OE2-CZ 3.24Å; E361-R403 IonicContact OE2-NE 3.06Å; E361-R403 PolarHBondContact OE2-NE 3.11Å; E361-R403 IonicContact OE2-NH2 2.65Å; E361-R403 PolarHBondContact OE2-NH2 3.47Å
404	W	83.7	Confident	79.4	Confident	44 Å²	44	85.1 Å²	85.1	17%	0.167	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	141.7	177.9	-68.3	89.8	0	0	0	112.5	P104 R323 W325 Q359 F360	P104-W404 HydrophobicContact CB-CH2 3.79Å; P104-W404 HydrophobicContact CB-CZ2 3.66Å; R323-W404 HydrophobicContact CB-CB 3.85Å; R323-W404 HydrophobicContact CB-CG 4.05Å; R323-W404 PolarHBondContact O-N 3.01Å; R323-W404 VanDerWaalsContact O-N 3.12Å; W325-W404 AromaticContact CD2-NE1 3.8Å; W325-W404 AromaticContact CE2-NE1 3.86Å; W325-W404 AromaticContact CE3-CD1 3.97Å; W325-W404 AromaticContact CE3-NE1 3.2Å; W325-W404 AromaticContact CH2-CE2 3.41Å; W325-W404 VanDerWaalsContact CH2-CE2 3.41Å; W325-W404 AromaticContact CH2-CZ2 3.41Å; W325-W404 HydrophobicContact CH2-CZ2 3.41Å; W325-W404 VanDerWaalsContact CH2-CZ2 3.41Å; W325-W404 AromaticContact CH2-NE1 2.88Å; W325-W404 AromaticContact CZ2-NE1 3.44Å; W325-W404 AromaticContact CZ3-CD1 3.89Å; W325-W404 AromaticContact CZ3-CE2 3.29Å; W325-W404 AromaticContact CZ3-CZ2 3.36Å; W325-W404 HydrophobicContact CZ3-CZ2 3.36Å; W325-W404 AromaticContact CZ3-NE1 2.74Å; Q359-W404 HydrophobicContact CB-CE3 4.49Å; Q359-W404 HydrophobicContact CB-CZ3 4.18Å; F360-W404 HydrophobicContact CB-CD2 4.19Å; F360-W404 HydrophobicContact CB-CE3 4.12Å; F360-W404 HydrophobicContact CD1-CE3 4.34Å; F360-W404 HydrophobicContact CD1-CH2 4.16Å; F360-W404 AromaticContact CD1-CZ3 3.97Å; F360-W404 HydrophobicContact CD1-CZ3 3.97Å
405	K	80.4	Confident	79.8	Confident	103 Å²	103	80.4 Å²	80.4	45%	0.448	40%	0.402	S	S	.	.			trans	-105.9	-43.6	170.8	-71.2	173.3	172.7	157.2	0	111.8	E357 D358 Q359 E361	E357-K405 WeakPolarHBondContact O-CD 2.86Å; E357-K405 PolarHBondContact O-NZ 3.34Å; D358-K405 WeakPolarHBondContact O-CB 3.1Å; Q359-K405 PolarHBondContact O-N 2.81Å; E361-K405 HydrophobicContact CG-CD 4.28Å; E361-K405 WeakPolarHBondContact OE1-CE 3.5Å; E361-K405 IonicContact OE1-NZ 2.8Å; E361-K405 PolarHBondContact OE1-NZ 2.88Å
406	S	70.7	Confident	80.3	Confident	45 Å²	45	74.8 Å²	74.8	32%	0.315	37%	0.368	S	S	.	.			trans	-90.6	150.9	-177.6	-172.7	0	0	0	0	112.5	Q359 E408	Q359-S406 PolarHBondContact O-N 3.41Å; S406-E408 PolarHBondContact OG-N 3.37Å; S406-E408 PolarHBondContact OG-O 3.32Å
407	T	61.8	Low	80.6	Confident	105 Å²	105	65.7 Å²	65.7	64%	0.644	33%	0.334	S	S	*	.	S	Bend	trans	-105.9	-12.7	174	54.1	0	0	0	0	113.6
408	E	58.4	Low	80.8	Confident	168 Å²	168	63.9 Å²	63.9	79%	0.785	32%	0.321	S	S	*	.			trans	-110.1	125.4	-176.1	-64.6	-175.2	171	0	0	109.8	S406	S406-E408 PolarHBondContact OG-N 3.37Å; S406-E408 PolarHBondContact OG-O 3.32Å
409	G	58.8	Low	80.9	Confident	42 Å²	42	66.5 Å²	66.5	43%	0.433	33%	0.333	S	S	.	.			trans	-139.8	123.1	170.2	0	0	0	0	0	108.3	M411	G409-M411 PolarHBondContact O-N 3.29Å
410	D	61.6	Low	81	Confident	150 Å²	150	64.2 Å²	64.2	80%	0.802	32%	0.32	S	S	*	.			trans	-68.5	125.6	175.9	-85.2	-25.8	0	0	0	109.8	H106 L412	H106-D410 PolarHBondContact CD2-O 3.47Å; H106-D410 VanDerWaalsContact CD2-O 3.25Å; D410-L412 PolarHBondContact O-N 2.95Å; D410-L412 VanDerWaalsContact O-N 3.12Å
411	M	65.8	Low	81.1	Confident	90 Å²	90	68.7 Å²	68.7	44%	0.443	34%	0.337	S	S	.	.			trans	-75.7	103.1	178.6	-167.7	-179.1	103.2	0	0	109.9	M164 G409 R413	M164-M411 HydrophobicContact CB-CE 4.22Å; M164-M411 HydrophobicContact CE-CE 3.98Å; M164-M411 WeakPolarHBondContact O-CE 3.37Å; G409-M411 PolarHBondContact O-N 3.29Å; M411-R413 PolarHBondContact O-N 2.93Å
412	L	69.6	Low	81.3	Confident	119 Å²	119	68.7 Å²	68.7	62%	0.623	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-67.4	123.4	171.2	-69.6	173.1	0	0	0	110.1	D410	D410-L412 PolarHBondContact O-N 2.95Å; D410-L412 VanDerWaalsContact O-N 3.12Å
413	R	79.9	Confident	81.4	Confident	176 Å²	176	69.9 Å²	69.9	66%	0.664	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-68.3	133.2	176.6	-65.1	-174.1	-176.5	-146.4	-0.3	109.9	M164 M411	M164-R413 HydrophobicContact CE-CG 4.4Å; M411-R413 PolarHBondContact O-N 2.93Å
414	P	88.4	Confident	81.3	Confident	10 Å²	10	67.2 Å²	67.2	7%	0.065	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-63	144.7	176.1	29	-37.3	0	0	0	110.6	T163 M164 Q168 L416 H417 N439	T163-P414 HydrophobicContact CG2-CB 3.95Å; T163-P414 HydrophobicContact CG2-CG 3.93Å; M164-P414 HydrophobicContact SD-CG 3.85Å; Q168-P414 HydrophobicContact CG-CB 4.49Å; P414-L416 VanDerWaalsContact C-N 3.32Å; P414-L416 PolarHBondContact O-N 2.82Å; P414-H417 HydrophobicContact CG-CB 4.15Å; P414-N439 WeakPolarHBondContact O-CB 3.36Å; P414-N439 PolarHBondContact O-ND2 2.98Å
415	L	89.6	Confident	81	Confident	45 Å²	45	75.9 Å²	75.9	24%	0.236	39%	0.392	C	S	.	.	S	Bend	trans	-60	-40.9	-178.4	-74.5	171.9	0	0	0	113.3	N439 H440 V539 Y568	L415-N439 PolarHBondContact O-N 2.83Å; L415-H440 HydrophobicContact CD2-CB 4.31Å; L415-V539 HydrophobicContact CD1-CG1 4.15Å; L415-Y568 WeakPolarHBondContact CD1-OH 3.26Å
416	L	93.4	Very high	81.1	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.005	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	136.4	174.6	-179.7	62.4	0	0	0	108.5	Q168 P414 Y437 F445 L498 V535 A537 I570 V572	Q168-L416 PolarHBondContact NE2-O 2.82Å; P414-L416 VanDerWaalsContact C-N 3.32Å; P414-L416 PolarHBondContact O-N 2.82Å; L416-Y437 WeakPolarHBondContact CA-O 3.5Å; L416-F445 HydrophobicContact CB-CZ 4.47Å; L416-F445 HydrophobicContact CD1-CE2 4.19Å; L416-F445 HydrophobicContact CD1-CZ 4.31Å; L416-L498 HydrophobicContact CD1-CD1 3.78Å; L416-V535 HydrophobicContact CD2-CG1 4.26Å; L416-A537 HydrophobicContact CD2-CB 3.9Å; L416-I570 HydrophobicContact CD2-CG2 3.79Å; L416-V572 HydrophobicContact CD2-CG2 4.09Å; L416-V572 HydrophobicContact CG-CG2 4.3Å
417	H	93.7	Very high	81.6	Confident	9 Å²	9	75.3 Å²	75.3	4%	0.042	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	150.4	171.5	174.8	51.1	0	0	0	108.7	T163 M164 P414 E419 Y437	T163-H417 WeakPolarHBondContact CB-ND1 3.49Å; M164-H417 HydrophobicContact SD-CB 4.37Å; P414-H417 HydrophobicContact CG-CB 4.15Å; H417-E419 IonicContact CD2-OE1 3.91Å; H417-E419 IonicContact CE1-OE1 3.74Å; H417-E419 VanDerWaalsContact NE2-CD 3.26Å; H417-E419 WeakPolarHBondContact NE2-CG 3.06Å; H417-E419 IonicContact NE2-OE1 3.57Å; H417-E419 PolarHBondContact NE2-OE1 2.76Å; H417-Y437 HydrophobicContact CB-CD2 4.29Å; H417-Y437 AromaticContact CD2-CD2 3.57Å; H417-Y437 AromaticContact CD2-CE2 3.82Å; H417-Y437 PolarHBondContact N-O 2.91Å; H417-Y437 PolarHBondContact O-N 3.1Å
418	A	95.2	Very high	82.8	Confident	1 Å²	1	76.6 Å²	76.6	1%	0.008	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	139.8	178.2	0	0	0	0	0	110.5	L435 M436 V535 V572 T574	A418-L435 CarbonylContact C-O 3.59Å; A418-L435 WeakPolarHBondContact CA-O 3.45Å; A418-M436 HydrophobicContact CB-CG 4.39Å; A418-V535 HydrophobicContact CB-CB 4.49Å; A418-V535 HydrophobicContact CB-CG2 3.84Å; A418-V572 HydrophobicContact CB-CG1 4.27Å; A418-T574 HydrophobicContact CB-CG2 3.67Å
419	E	94.9	Very high	84.4	Confident	58 Å²	58	72 Å²	72	27%	0.271	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	150.9	-179.7	-62.4	174.6	165.1	0	0	109.4	H417 T434 L435 Y437 E575	H417-E419 IonicContact CD2-OE1 3.91Å; H417-E419 IonicContact CE1-OE1 3.74Å; H417-E419 VanDerWaalsContact NE2-CD 3.26Å; H417-E419 WeakPolarHBondContact NE2-CG 3.06Å; H417-E419 IonicContact NE2-OE1 3.57Å; H417-E419 PolarHBondContact NE2-OE1 2.76Å; E419-T434 WeakPolarHBondContact O-CA 3.47Å; E419-L435 HydrophobicContact CB-CB 4.46Å; E419-L435 PolarHBondContact N-O 3.05Å; E419-L435 PolarHBondContact O-N 3Å; E419-Y437 HydrophobicContact CB-CE2 4.39Å; E419-Y437 HydrophobicContact CG-CE2 3.97Å; E419-Y437 WeakPolarHBondContact OE2-CE2 3.46Å; E419-Y437 PolarHBondContact OE2-OH 3.02Å; E419-E575 VanDerWaalsContact CA-OE2 3.27Å; E419-E575 WeakPolarHBondContact CA-OE2 3.48Å
420	R	94.5	Very high	86.1	Confident	10 Å²	10	70.2 Å²	70.2	4%	0.038	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	136.2	177.5	-161.4	-171.9	179.1	-161.7	4.8	111.4	I432 H433 D451 G531 T574 E575 L577	R420-I432 HydrophobicContact CG-CG2 4.3Å; R420-H433 WeakPolarHBondContact CA-O 3.34Å; R420-H433 WeakPolarHBondContact CG-O 3.5Å; R420-D451 IonicContact CZ-OD1 3.58Å; R420-D451 IonicContact CZ-OD2 3.78Å; R420-D451 IonicContact NE-OD2 3.26Å; R420-D451 IonicContact NH1-OD1 3.13Å; R420-D451 IonicContact NH2-OD1 3.83Å; R420-D451 PolarHBondContact NH2-OD1 3.09Å; R420-D451 IonicContact NH2-OD2 2.75Å; R420-D451 PolarHBondContact NH2-OD2 3.1Å; R420-G531 PolarHBondContact NH1-O 2.9Å; R420-T574 HydrophobicContact CB-CG2 4.15Å; R420-E575 PolarHBondContact N-OE2 3.48Å; R420-L577 HydrophobicContact CB-CD2 4.04Å; R420-L577 HydrophobicContact CG-CD1 4.17Å; R420-L577 HydrophobicContact CG-CD2 3.7Å; R420-L577 HydrophobicContact CG-CG 4.22Å; R420-L577 VanDerWaalsContact NE-CD1 3.29Å
421	Y	95.4	Very high	87.8	Confident	99 Å²	99	66.2 Å²	66.2	39%	0.388	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	163.3	176.2	63.8	-90.3	0	0	0	111.8	A423 H433 L435	Y421-A423 HydrophobicContact CE2-CB 4.3Å; Y421-H433 HydrophobicContact CD1-CB 4.15Å; Y421-H433 HydrophobicContact CD2-CB 4.09Å; Y421-H433 HydrophobicContact CE1-CB 3.67Å; Y421-H433 HydrophobicContact CE2-CB 3.59Å; Y421-H433 AromaticContact CE2-CD2 3.63Å; Y421-H433 AromaticContact CE2-CG 3.55Å; Y421-H433 HydrophobicContact CG-CB 4.34Å; Y421-H433 AromaticContact CZ-CG 3.58Å; Y421-H433 PolarHBondContact N-O 2.8Å; Y421-H433 PolarHBondContact O-N 2.81Å; Y421-H433 PolarHBondContact OH-ND1 3.09Å; Y421-L435 HydrophobicContact CE1-CD1 3.88Å; Y421-L435 HydrophobicContact CE1-CG 4.21Å
422	V	94.4	Very high	89.2	Confident	46 Å²	46	62.1 Å²	62.1	28%	0.279	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	131.4	176.2	177.5	0	0	0	0	109.1	E431 F510 L577 V579	V422-E431 CarbonylContact C-O 3.54Å; V422-E431 WeakPolarHBondContact CA-O 3.34Å; V422-F510 HydrophobicContact CG1-CE1 3.99Å; V422-F510 HydrophobicContact CG1-CZ 3.81Å; V422-L577 HydrophobicContact CG2-CB 3.84Å; V422-L577 HydrophobicContact CG2-CD1 3.63Å; V422-L577 HydrophobicContact CG2-CD2 3.99Å; V422-L577 HydrophobicContact CG2-CG 4.03Å; V422-V579 HydrophobicContact CG2-CG2 4.01Å
423	A	92.3	Very high	90.5	Very high	30 Å²	30	57.4 Å²	57.4	25%	0.248	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	170	174.1	0	0	0	0	0	111	Y421 G430 E431	Y421-A423 HydrophobicContact CE2-CB 4.3Å; A423-G430 CarbonylContact O-C 3.54Å; A423-G430 WeakPolarHBondContact O-CA 3.34Å; A423-E431 HydrophobicContact CB-CB 4.44Å; A423-E431 PolarHBondContact N-O 2.8Å; A423-E431 PolarHBondContact O-N 2.77Å
424	G	85.5	Confident	91.3	Very high	60 Å²	60	49.2 Å²	49.2	62%	0.619	26%	0.264	S	S	*	.			trans	112.3	159	179.5	0	0	0	0	0	113.6
425	Y	77.2	Confident	91.7	Very high	226 Å²	226	49.8 Å²	49.8	89%	0.886	27%	0.267	S	S	*	.	S	Bend	trans	-113.9	145	-179	-179.7	-93.6	0	0	0	111.1
426	G	81.8	Confident	92	Very high	40 Å²	40	47.7 Å²	47.7	41%	0.412	26%	0.256	S	S	.	.	S	Bend	trans	84.3	-176.1	177.9	0	0	0	0	0	114.1	R512	G426-R512 PolarHBondContact O-NH1 3.38Å
427	L	81.8	Confident	92.1	Very high	97 Å²	97	50.2 Å²	50.2	51%	0.508	27%	0.265	S	S	.	.	S	Bend	trans	-105	6.9	-172.7	-65.9	172.1	0	0	0	113.7	R512 N580 P582	L427-R512 WeakPolarHBondContact O-CD 3.07Å; L427-N580 HydrophobicContact CD2-CB 4.44Å; L427-P582 HydrophobicContact CB-CB 4.44Å
428	Q	87.2	Confident	92.2	Very high	132 Å²	132	49.8 Å²	49.8	62%	0.617	26%	0.263	S	S	*	.	S	Bend	trans	-102.5	-61.7	-178.3	-169.2	178.1	-4.9	0	0	111.7	E511 R512	Q428-E511 WeakPolarHBondContact O-CA 3.22Å; Q428-R512 PolarHBondContact O-N 2.97Å
429	T	92.5	Very high	92.1	Very high	72 Å²	72	51.3 Å²	51.3	44%	0.442	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	154.8	-176.4	55.6	0	0	0	0	112.1	F510 R512	T429-F510 CarbonylContact C-O 3.6Å; T429-F510 WeakPolarHBondContact CA-O 3.39Å; T429-R512 PolarHBondContact O-NH1 2.99Å
430	G	94.3	Very high	91.9	Very high	4 Å²	4	49.8 Å²	49.8	4%	0.041	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	175.5	176	0	0	0	0	0	111	A423 Q509 F510	A423-G430 CarbonylContact O-C 3.54Å; A423-G430 WeakPolarHBondContact O-CA 3.34Å; G430-Q509 CarbonylContact O-C 3.58Å; G430-Q509 WeakPolarHBondContact O-CA 3.37Å; G430-F510 VanDerWaalsContact C-CD1 3.48Å; G430-F510 PolarHBondContact N-O 3.08Å; G430-F510 WeakPolarHBondContact O-CD1 3.31Å; G430-F510 PolarHBondContact O-N 3.09Å
431	E	95.7	Very high	91.7	Very high	65 Å²	65	52.8 Å²	52.8	30%	0.304	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	138.7	-180	-47.8	-166.8	148.2	0	0	109.3	V422 A423 H433 Q509	V422-E431 CarbonylContact C-O 3.54Å; V422-E431 WeakPolarHBondContact CA-O 3.34Å; A423-E431 HydrophobicContact CB-CB 4.44Å; A423-E431 PolarHBondContact N-O 2.8Å; A423-E431 PolarHBondContact O-N 2.77Å; E431-H433 IonicContact OE2-NE2 3.6Å; E431-Q509 HydrophobicContact CG-CG 4.02Å; E431-Q509 PolarHBondContact OE1-NE2 3.39Å
432	I	96.1	Very high	91.5	Very high	5 Å²	5	56.6 Å²	56.6	3%	0.026	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.1	171.3	-63.6	170.6	0	0	0	107.2	R420 V453 L459 T507 M508 F510 L577	R420-I432 HydrophobicContact CG-CG2 4.3Å; I432-V453 HydrophobicContact CD1-CG1 4.41Å; I432-V453 HydrophobicContact CD1-CG2 4.27Å; I432-L459 HydrophobicContact CD1-CD2 4.14Å; I432-T507 WeakPolarHBondContact O-CA 3.38Å; I432-M508 PolarHBondContact N-O 2.99Å; I432-M508 PolarHBondContact O-N 2.95Å; I432-M508 VanDerWaalsContact O-N 3.09Å; I432-F510 HydrophobicContact CD1-CD1 4.04Å; I432-F510 HydrophobicContact CD1-CE1 4.33Å; I432-F510 HydrophobicContact CG1-CD1 3.66Å; I432-F510 HydrophobicContact CG1-CE1 3.66Å; I432-L577 HydrophobicContact CD1-CD1 4.4Å; I432-L577 HydrophobicContact CG1-CD1 4.22Å; I432-L577 HydrophobicContact CG2-CD1 4.02Å
433	H	96.8	Very high	91.4	Very high	20 Å²	20	60.8 Å²	60.8	9%	0.093	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	128.1	173.6	-64.5	-107.1	0	0	0	109	R420 Y421 E431 E505 T507	R420-H433 WeakPolarHBondContact CA-O 3.34Å; R420-H433 WeakPolarHBondContact CG-O 3.5Å; Y421-H433 HydrophobicContact CD1-CB 4.15Å; Y421-H433 HydrophobicContact CD2-CB 4.09Å; Y421-H433 HydrophobicContact CE1-CB 3.67Å; Y421-H433 HydrophobicContact CE2-CB 3.59Å; Y421-H433 AromaticContact CE2-CD2 3.63Å; Y421-H433 AromaticContact CE2-CG 3.55Å; Y421-H433 HydrophobicContact CG-CB 4.34Å; Y421-H433 AromaticContact CZ-CG 3.58Å; Y421-H433 PolarHBondContact N-O 2.8Å; Y421-H433 PolarHBondContact O-N 2.81Å; Y421-H433 PolarHBondContact OH-ND1 3.09Å; E431-H433 IonicContact OE2-NE2 3.6Å; H433-E505 IonicContact CE1-OE1 3.63Å; H433-E505 IonicContact CG-OE1 3.67Å; H433-E505 IonicContact ND1-OE1 2.77Å; H433-E505 PolarHBondContact ND1-OE1 3.37Å; H433-T507 VanDerWaalsContact ND1-CG2 3.33Å; H433-T507 WeakPolarHBondContact ND1-CG2 3.44Å
434	T	97.3	Very high	91.5	Very high	4 Å²	4	62.1 Å²	62.1	3%	0.025	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	115.7	171.6	-55.4	0	0	0	0	108.5	E419 L449 V506 T574	E419-T434 WeakPolarHBondContact O-CA 3.47Å; T434-L449 HydrophobicContact CG2-CD1 4.08Å; T434-V506 PolarHBondContact N-O 2.94Å; T434-V506 PolarHBondContact O-N 2.88Å; T434-T574 HydrophobicContact CG2-CG2 4.41Å
435	L	96.6	Very high	91.9	Very high	22 Å²	22	59.4 Å²	59.4	12%	0.115	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	129.7	178.9	-60.4	178.7	0	0	0	109.6	A418 E419 Y421 Y437 V503 E505	A418-L435 CarbonylContact C-O 3.59Å; A418-L435 WeakPolarHBondContact CA-O 3.45Å; E419-L435 HydrophobicContact CB-CB 4.46Å; E419-L435 PolarHBondContact N-O 3.05Å; E419-L435 PolarHBondContact O-N 3Å; Y421-L435 HydrophobicContact CE1-CD1 3.88Å; Y421-L435 HydrophobicContact CE1-CG 4.21Å; L435-Y437 HydrophobicContact CB-CE2 3.79Å; L435-Y437 WeakPolarHBondContact CD1-OH 3.13Å; L435-V503 HydrophobicContact CB-CG1 4.29Å; L435-V503 HydrophobicContact CD2-CG1 4.23Å; L435-E505 HydrophobicContact CD2-CB 3.59Å; L435-E505 HydrophobicContact CD2-CG 3.56Å
436	M	96.6	Very high	92.8	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	120.6	175.1	-65.7	173.4	-74.9	0	0	109.5	A418 V447 L449 L498 V503 T504 V506 V535	A418-M436 HydrophobicContact CB-CG 4.39Å; M436-V447 HydrophobicContact SD-CG1 4.02Å; M436-L449 HydrophobicContact SD-CD1 4.34Å; M436-L498 HydrophobicContact CB-CD1 4.04Å; M436-L498 HydrophobicContact CB-CD2 3.99Å; M436-L498 HydrophobicContact CE-CD2 4.38Å; M436-V503 WeakPolarHBondContact O-CA 3.33Å; M436-T504 HydrophobicContact CE-CG2 4.2Å; M436-T504 PolarHBondContact N-O 3.17Å; M436-T504 PolarHBondContact O-N 2.63Å; M436-V506 HydrophobicContact CE-CG2 3.65Å; M436-V535 HydrophobicContact CG-CG1 4.5Å; M436-V535 HydrophobicContact CG-CG2 4.48Å; M436-V535 HydrophobicContact SD-CG1 4.21Å; M436-V535 HydrophobicContact SD-CG2 4.47Å
437	Y	95.4	Very high	93.5	Very high	53 Å²	53	49.4 Å²	49.4	21%	0.208	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	125.2	-176.4	-59.1	-99.3	0	0	0	109.9	L416 H417 E419 L435 V503	L416-Y437 WeakPolarHBondContact CA-O 3.5Å; H417-Y437 HydrophobicContact CB-CD2 4.29Å; H417-Y437 AromaticContact CD2-CD2 3.57Å; H417-Y437 AromaticContact CD2-CE2 3.82Å; H417-Y437 PolarHBondContact N-O 2.91Å; H417-Y437 PolarHBondContact O-N 3.1Å; E419-Y437 HydrophobicContact CB-CE2 4.39Å; E419-Y437 HydrophobicContact CG-CE2 3.97Å; E419-Y437 WeakPolarHBondContact OE2-CE2 3.46Å; E419-Y437 PolarHBondContact OE2-OH 3.02Å; L435-Y437 HydrophobicContact CB-CE2 3.79Å; L435-Y437 WeakPolarHBondContact CD1-OH 3.13Å; Y437-V503 HydrophobicContact CD1-CB 4.24Å; Y437-V503 HydrophobicContact CD1-CG1 3.99Å; Y437-V503 HydrophobicContact CD1-CG2 3.38Å; Y437-V503 HydrophobicContact CE1-CB 4.33Å; Y437-V503 HydrophobicContact CE1-CG1 3.82Å; Y437-V503 HydrophobicContact CE1-CG2 3.52Å; Y437-V503 HydrophobicContact CG-CG1 4.43Å; Y437-V503 HydrophobicContact CG-CG2 4.35Å
438	N	95.3	Very high	94.3	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	106.5	166.9	175.1	5.5	0	0	0	108.7	H440 R443 F445 L498 P499 H501 S502	N438-H440 WeakPolarHBondContact OD1-CB 3.13Å; N438-H440 PolarHBondContact OD1-N 3.08Å; N438-R443 PolarHBondContact ND2-O 3.3Å; N438-R443 VanDerWaalsContact ND2-O 3.08Å; N438-F445 HydrophobicContact CB-CE1 4.34Å; N438-F445 HydrophobicContact CB-CZ 4.29Å; N438-F445 VanDerWaalsContact CG-CE1 3.43Å; N438-F445 WeakPolarHBondContact OD1-CE1 3.49Å; N438-L498 HydrophobicContact CB-CB 3.82Å; N438-L498 HydrophobicContact CB-CD1 4.27Å; N438-L498 PolarHBondContact ND2-O 2.88Å; N438-P499 WeakPolarHBondContact CB-O 3.34Å; N438-P499 PolarHBondContact ND2-O 2.75Å; N438-H501 CarbonylContact O-C 3.53Å; N438-H501 WeakPolarHBondContact O-CA 3.39Å; N438-H501 PolarHBondContact O-N 3.25Å; N438-H501 VanDerWaalsContact O-N 3.13Å; N438-S502 PolarHBondContact N-O 2.92Å; N438-S502 PolarHBondContact O-N 2.76Å
439	N	92.9	Very high	94.8	Very high	34 Å²	34	39.8 Å²	39.8	18%	0.182	20%	0.202	C	C	.	.			trans	-91.6	3.6	178.4	-67.6	-39.1	0	0	0	113	P414 L415	P414-N439 WeakPolarHBondContact O-CB 3.36Å; P414-N439 PolarHBondContact O-ND2 2.98Å; L415-N439 PolarHBondContact O-N 2.83Å
440	H	91.3	Very high	95	Very high	26 Å²	26	36.5 Å²	36.5	12%	0.12	18%	0.182	C	C	.	.			trans	-66	129.5	173.3	-170.1	-55.4	0	0	0	109.5	L415 N438 F442 R443 F445 H501	L415-H440 HydrophobicContact CD2-CB 4.31Å; N438-H440 WeakPolarHBondContact OD1-CB 3.13Å; N438-H440 PolarHBondContact OD1-N 3.08Å; H440-F442 PolarHBondContact ND1-N 3.45Å; H440-F442 VanDerWaalsContact ND1-N 3.15Å; H440-F442 PolarHBondContact O-N 2.91Å; H440-R443 PolarHBondContact CE1-N 3.04Å; H440-R443 PolarHBondContact ND1-N 3.16Å; H440-F445 HydrophobicContact CB-CE1 4.36Å; H440-H501 PolarHBondContact O-N 3.3Å
441	P	89.4	Confident	95.1	Very high	73 Å²	73	36.6 Å²	36.6	47%	0.474	18%	0.182	S	C	.	.	S	Bend	trans	-65.7	-37.3	-171.9	22.3	-34.1	0	0	0	114.1
442	F	91	Very high	95.1	Very high	178 Å²	178	34.4 Å²	34.4	78%	0.781	17%	0.173	S	C	*	.	S	Bend	trans	-126.3	-19.4	-171.2	-51.4	-65.8	0	0	0	116.9	H440	H440-F442 PolarHBondContact ND1-N 3.45Å; H440-F442 VanDerWaalsContact ND1-N 3.15Å; H440-F442 PolarHBondContact O-N 2.91Å
443	R	92.7	Very high	95.1	Very high	135 Å²	135	34.2 Å²	34.2	51%	0.509	17%	0.172	S	C	.	.			trans	-103.2	133	-175	-66.2	-171.8	179.2	-158.6	4.7	111.7	N438 H440 P540	N438-R443 PolarHBondContact ND2-O 3.3Å; N438-R443 VanDerWaalsContact ND2-O 3.08Å; H440-R443 PolarHBondContact CE1-N 3.04Å; H440-R443 PolarHBondContact ND1-N 3.16Å; R443-P540 HydrophobicContact CB-CG 4.16Å
444	S	94.2	Very high	95	Very high	58 Å²	58	34.4 Å²	34.4	41%	0.406	18%	0.175	S	C	.	.			trans	-86.9	149.4	160.9	61.3	0	0	0	0	109.5	Q497 L498	S444-Q497 PolarHBondContact OG-NE2 3.17Å; S444-L498 WeakPolarHBondContact CA-O 3.33Å; S444-L498 WeakPolarHBondContact CB-O 3.32Å
445	F	94.7	Very high	94.9	Very high	3 Å²	3	35.3 Å²	35.3	1%	0.013	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	149	172.4	54.2	-94.4	0	0	0	110.4	L416 N438 H440 V447 L498 A537 V539 P540	L416-F445 HydrophobicContact CB-CZ 4.47Å; L416-F445 HydrophobicContact CD1-CE2 4.19Å; L416-F445 HydrophobicContact CD1-CZ 4.31Å; N438-F445 HydrophobicContact CB-CE1 4.34Å; N438-F445 HydrophobicContact CB-CZ 4.29Å; N438-F445 VanDerWaalsContact CG-CE1 3.43Å; N438-F445 WeakPolarHBondContact OD1-CE1 3.49Å; H440-F445 HydrophobicContact CB-CE1 4.36Å; F445-V447 HydrophobicContact CD2-CG2 3.72Å; F445-V447 HydrophobicContact CE2-CG2 3.64Å; F445-L498 HydrophobicContact CE2-CD1 4.29Å; F445-L498 PolarHBondContact N-O 3.1Å; F445-L498 PolarHBondContact O-N 3.42Å; F445-A537 HydrophobicContact CD2-CB 4.22Å; F445-A537 HydrophobicContact CE2-CB 4.16Å; F445-V539 HydrophobicContact CD2-CG2 4.38Å; F445-V539 HydrophobicContact CE1-CG1 4.46Å; F445-V539 HydrophobicContact CE2-CG2 4.01Å; F445-V539 HydrophobicContact CZ-CG2 4.2Å; F445-P540 HydrophobicContact CB-CG 4.42Å; F445-P540 HydrophobicContact CD1-CG 4.4Å
446	P	95.6	Very high	94.8	Very high	55 Å²	55	35.5 Å²	35.5	36%	0.357	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	144.1	177.8	31.1	-34.3	0	0	0	110.7	L495	P446-L495 HydrophobicContact CB-CD1 4.11Å; P446-L495 HydrophobicContact CB-CG 4.35Å
447	V	96.6	Very high	94.8	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.006	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	133.3	178.5	175.8	0	0	0	0	109.4	M436 F445 L495 V496 L498 V535 A537	M436-V447 HydrophobicContact SD-CG1 4.02Å; F445-V447 HydrophobicContact CD2-CG2 3.72Å; F445-V447 HydrophobicContact CE2-CG2 3.64Å; V447-L495 WeakPolarHBondContact O-CA 3.41Å; V447-V496 PolarHBondContact N-O 2.75Å; V447-V496 PolarHBondContact O-N 3.35Å; V447-L498 HydrophobicContact CB-CD1 4.09Å; V447-L498 HydrophobicContact CB-CG 4.08Å; V447-L498 HydrophobicContact CG2-CD1 3.36Å; V447-L498 HydrophobicContact CG2-CG 3.61Å; V447-V535 HydrophobicContact CG1-CB 4.49Å; V447-V535 HydrophobicContact CG1-CG1 3.19Å; V447-A537 HydrophobicContact CG2-CB 3.76Å
448	L	97.4	Very high	94.8	Very high	25 Å²	25	37.4 Å²	37.4	13%	0.131	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	110.5	177.1	-176	59.4	0	0	0	109	A222 S223 M494 L495 S536	A222-L448 VanDerWaalsContact C-CD2 3.49Å; A222-L448 HydrophobicContact CB-CD1 4.18Å; A222-L448 HydrophobicContact CB-CD2 3.64Å; S223-L448 VanDerWaalsContact CA-CD2 3.49Å; L448-M494 WeakPolarHBondContact CA-O 3.49Å; L448-L495 HydrophobicContact CB-CD1 4.06Å; L448-L495 HydrophobicContact CD1-CB 4.45Å; L448-L495 HydrophobicContact CD1-CD1 4.39Å; L448-S536 PolarHBondContact N-O 3.36Å; L448-S536 PolarHBondContact O-N 3.18Å
449	L	97.5	Very high	94.8	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	129.3	175.3	-179.9	70.8	0	0	0	109	T434 M436 E493 M494 V506 S533 V535	T434-L449 HydrophobicContact CG2-CD1 4.08Å; M436-L449 HydrophobicContact SD-CD1 4.34Å; L449-E493 CarbonylContact O-C 3.55Å; L449-E493 VanDerWaalsContact O-CA 3.25Å; L449-E493 WeakPolarHBondContact O-CA 3.5Å; L449-M494 HydrophobicContact CB-CG 3.77Å; L449-M494 HydrophobicContact CD2-CE 4.17Å; L449-M494 HydrophobicContact CD2-CG 3.97Å; L449-M494 HydrophobicContact CD2-SD 3.87Å; L449-M494 HydrophobicContact CG-CG 4.36Å; L449-M494 PolarHBondContact N-O 3.13Å; L449-M494 PolarHBondContact O-N 2.9Å; L449-V506 HydrophobicContact CD2-CB 4.36Å; L449-V506 HydrophobicContact CD2-CG1 4.2Å; L449-V506 HydrophobicContact CD2-CG2 4.1Å; L449-S533 WeakPolarHBondContact CD1-OG 3.43Å; L449-V535 HydrophobicContact CD1-CG2 3.91Å
450	L	97.5	Very high	94.9	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	124.9	168.1	170.4	82.9	0	0	0	108.5	P220 F224 Y240 L491 L492 E493 S533 V534	P220-L450 HydrophobicContact CB-CD1 4.15Å; P220-L450 HydrophobicContact CG-CD1 4.29Å; P220-L450 HydrophobicContact CG-CD2 4.29Å; F224-L450 HydrophobicContact CD2-CD2 3.94Å; F224-L450 HydrophobicContact CE2-CD2 3.45Å; F224-L450 VanDerWaalsContact CE2-CD2 3.45Å; Y240-L450 HydrophobicContact CE1-CD2 4.48Å; L450-L491 HydrophobicContact CD1-CD1 3.28Å; L450-L492 CarbonylContact C-O 3.56Å; L450-L492 WeakPolarHBondContact CA-O 3.44Å; L450-E493 HydrophobicContact CB-CG 4.45Å; L450-E493 HydrophobicContact CD1-CG 3.39Å; L450-S533 WeakPolarHBondContact O-CA 3.43Å; L450-S533 PolarHBondContact O-OG 2.68Å; L450-V534 HydrophobicContact CB-CB 4.17Å; L450-V534 HydrophobicContact CD2-CB 4.18Å; L450-V534 HydrophobicContact CD2-CG2 4Å; L450-V534 PolarHBondContact N-O 2.85Å; L450-V534 PolarHBondContact O-N 3.43Å
451	D	95.9	Very high	95	Very high	7 Å²	7	41.7 Å²	41.7	4%	0.037	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	131.2	172.8	-161.4	2.4	0	0	0	110.4	R420 L492	R420-D451 IonicContact CZ-OD1 3.58Å; R420-D451 IonicContact CZ-OD2 3.78Å; R420-D451 IonicContact NE-OD2 3.26Å; R420-D451 IonicContact NH1-OD1 3.13Å; R420-D451 IonicContact NH2-OD1 3.83Å; R420-D451 PolarHBondContact NH2-OD1 3.09Å; R420-D451 IonicContact NH2-OD2 2.75Å; R420-D451 PolarHBondContact NH2-OD2 3.1Å; D451-L492 HydrophobicContact CB-CB 4.4Å; D451-L492 PolarHBondContact N-O 3.06Å; D451-L492 PolarHBondContact O-N 3Å
452	S	95.6	Very high	95.2	Very high	18 Å²	18	46 Å²	46	13%	0.126	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	106	175.2	-174.2	0	0	0	0	108.4	H490	S452-H490 WeakPolarHBondContact CA-O 3.25Å
453	V	96.5	Very high	95.4	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.006	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	123.7	-174.9	-178.8	0	0	0	0	109.5	I432 L457 L459 P489 H490	I432-V453 HydrophobicContact CD1-CG1 4.41Å; I432-V453 HydrophobicContact CD1-CG2 4.27Å; V453-L457 HydrophobicContact CG1-CB 3.73Å; V453-L457 HydrophobicContact CG1-CD1 3.95Å; V453-L457 HydrophobicContact CG1-CG 4.35Å; V453-L459 HydrophobicContact CB-CD1 3.88Å; V453-L459 HydrophobicContact CB-CD2 4.49Å; V453-L459 HydrophobicContact CB-CG 4.37Å; V453-L459 HydrophobicContact CG1-CD1 4.26Å; V453-L459 HydrophobicContact CG1-CD2 4.03Å; V453-L459 HydrophobicContact CG1-CG 4.21Å; V453-L459 HydrophobicContact CG2-CD1 4Å; V453-P489 WeakPolarHBondContact O-CB 3.17Å; V453-H490 HydrophobicContact CB-CB 4.18Å; V453-H490 PolarHBondContact N-O 3.08Å; V453-H490 WeakPolarHBondContact O-CB 3.21Å; V453-H490 PolarHBondContact O-N 3.2Å
454	P	96	Very high	95.6	Very high	25 Å²	25	34.1 Å²	34.1	16%	0.162	17%	0.174	C	C	.	.			trans	-56.2	151.3	-179.5	-28.8	36.5	0	0	0	113.9	Y456 L457	P454-Y456 HydrophobicContact CB-CD1 3.65Å; P454-Y456 HydrophobicContact CB-CD2 4.27Å; P454-Y456 HydrophobicContact CB-CE1 3.22Å; P454-Y456 HydrophobicContact CB-CE2 3.89Å; P454-Y456 HydrophobicContact CB-CG 4.16Å; P454-Y456 HydrophobicContact CG-CE1 3.89Å; P454-Y456 HydrophobicContact CG-CE2 4.28Å; P454-Y456 WeakPolarHBondContact CG-OH 3.43Å; P454-Y456 PolarHBondContact O-N 2.81Å; P454-L457 PolarHBondContact O-N 2.97Å
455	W	95.2	Very high	95.7	Very high	22 Å²	22	34.4 Å²	34.4	8%	0.083	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-22.9	-177.3	63.8	-94.8	0	0	0	114.5	L457 D485 R486 L515	W455-L457 PolarHBondContact O-N 2.97Å; W455-D485 HydrophobicContact CE3-CB 4.07Å; W455-D485 HydrophobicContact CZ3-CB 4.44Å; W455-R486 HydrophobicContact CD2-CG 4.47Å; W455-R486 HydrophobicContact CH2-CG 3.6Å; W455-R486 HydrophobicContact CZ2-CB 4.42Å; W455-R486 HydrophobicContact CZ2-CG 3.5Å; W455-R486 HydrophobicContact CZ3-CG 4.13Å; W455-L515 HydrophobicContact CH2-CD2 3.38Å; W455-L515 HydrophobicContact CZ2-CD2 4.07Å; W455-L515 HydrophobicContact CZ3-CD2 3.95Å
456	Y	94.4	Very high	95.8	Very high	26 Å²	26	34.6 Å²	34.6	10%	0.102	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-7	178.6	57	-109.1	0	0	0	113.4	P454 A513 F528 Y529 L581	P454-Y456 HydrophobicContact CB-CD1 3.65Å; P454-Y456 HydrophobicContact CB-CD2 4.27Å; P454-Y456 HydrophobicContact CB-CE1 3.22Å; P454-Y456 HydrophobicContact CB-CE2 3.89Å; P454-Y456 HydrophobicContact CB-CG 4.16Å; P454-Y456 HydrophobicContact CG-CE1 3.89Å; P454-Y456 HydrophobicContact CG-CE2 4.28Å; P454-Y456 WeakPolarHBondContact CG-OH 3.43Å; P454-Y456 PolarHBondContact O-N 2.81Å; Y456-A513 WeakPolarHBondContact O-CB 3.32Å; Y456-A513 PolarHBondContact O-N 3.19Å; Y456-F528 HydrophobicContact CE1-CD1 4.36Å; Y456-F528 HydrophobicContact CE2-CB 4.11Å; Y456-Y529 PolarHBondContact OH-O 3.14Å; Y456-Y529 VanDerWaalsContact OH-O 3.09Å; Y456-L581 HydrophobicContact CD2-CD1 3.8Å; Y456-L581 HydrophobicContact CD2-CD2 4.29Å; Y456-L581 HydrophobicContact CE2-CD1 4.29Å; Y456-L581 HydrophobicContact CG-CD1 4.17Å
457	L	95.5	Very high	95.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	102.9	167	-54.4	-178.2	0	0	0	108.3	V453 P454 W455 L459 H490 F510 R512 V530 V579 L581	V453-L457 HydrophobicContact CG1-CB 3.73Å; V453-L457 HydrophobicContact CG1-CD1 3.95Å; V453-L457 HydrophobicContact CG1-CG 4.35Å; P454-L457 PolarHBondContact O-N 2.97Å; W455-L457 PolarHBondContact O-N 2.97Å; L457-L459 PolarHBondContact O-N 2.95Å; L457-H490 PolarHBondContact O-CD2 3.02Å; L457-H490 VanDerWaalsContact O-CD2 3.23Å; L457-H490 PolarHBondContact O-NE2 2.91Å; L457-F510 HydrophobicContact CB-CD2 4.12Å; L457-F510 HydrophobicContact CB-CG 4.49Å; L457-F510 HydrophobicContact CD2-CD2 3.85Å; L457-F510 HydrophobicContact CD2-CE2 3.76Å; L457-F510 HydrophobicContact CG-CD2 4.41Å; L457-R512 HydrophobicContact CD2-CG 4.34Å; L457-V530 HydrophobicContact CD1-CG2 3.51Å; L457-V579 HydrophobicContact CD1-CG2 4.12Å; L457-V579 HydrophobicContact CD2-CG1 3.92Å; L457-L581 HydrophobicContact CD2-CD2 4.05Å
458	R	95.1	Very high	95.8	Very high	95 Å²	95	34.2 Å²	34.2	36%	0.358	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	104	-177.3	-66.9	176.1	175.1	166	-2	109.4	D485 F510 E511	R458-D485 IonicContact CZ-OD2 3.24Å; R458-D485 IonicContact NE-OD1 2.85Å; R458-D485 IonicContact NH2-OD1 3.88Å; R458-D485 IonicContact NH2-OD2 2.74Å; R458-D485 PolarHBondContact NH2-OD2 2.64Å; R458-F510 CarbonylContact O-C 3.55Å; R458-F510 VanDerWaalsContact O-CA 3.22Å; R458-F510 WeakPolarHBondContact O-CA 3.12Å; R458-E511 HydrophobicContact CB-CB 4.35Å; R458-E511 PolarHBondContact N-O 3.2Å; R458-E511 PolarHBondContact O-N 2.98Å
459	L	95.7	Very high	95.4	Very high	14 Å²	14	39.2 Å²	39.2	7%	0.073	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	135.9	-177.6	-61.5	179.5	0	0	0	112.6	I432 V453 L457 Y480 H490 M508 F510	I432-L459 HydrophobicContact CD1-CD2 4.14Å; V453-L459 HydrophobicContact CB-CD1 3.88Å; V453-L459 HydrophobicContact CB-CD2 4.49Å; V453-L459 HydrophobicContact CB-CG 4.37Å; V453-L459 HydrophobicContact CG1-CD1 4.26Å; V453-L459 HydrophobicContact CG1-CD2 4.03Å; V453-L459 HydrophobicContact CG1-CG 4.21Å; V453-L459 HydrophobicContact CG2-CD1 4Å; L457-L459 PolarHBondContact O-N 2.95Å; L459-Y480 HydrophobicContact CD1-CE2 4.44Å; L459-H490 HydrophobicContact CD1-CB 3.65Å; L459-H490 HydrophobicContact CG-CB 4.46Å; L459-H490 PolarHBondContact N-NE2 3.18Å; L459-M508 HydrophobicContact CB-CE 4.39Å; L459-M508 HydrophobicContact CB-SD 4.11Å; L459-M508 HydrophobicContact CD1-CE 3.54Å; L459-M508 HydrophobicContact CD1-SD 4.26Å; L459-M508 HydrophobicContact CD2-CE 4.08Å; L459-M508 HydrophobicContact CG-CE 4.22Å; L459-F510 HydrophobicContact CD2-CB 3.77Å
460	Y	94.8	Very high	94.9	Very high	76 Å²	76	42.8 Å²	42.8	30%	0.298	23%	0.229	S	C	.	.			trans	-98.8	88.6	173.4	-66.8	-23.9	0	0	0	111.1	H462 T463 Q509 E511	Y460-H462 AromaticContact CG-CE1 3.92Å; Y460-H462 PolarHBondContact O-N 2.77Å; Y460-H462 VanDerWaalsContact O-N 3.1Å; Y460-T463 WeakPolarHBondContact O-CB 3.32Å; Y460-T463 PolarHBondContact O-N 2.88Å; Y460-T463 PolarHBondContact O-OG1 2.77Å; Y460-Q509 HydrophobicContact CD2-CB 4.34Å; Y460-Q509 PolarHBondContact N-O 2.89Å; Y460-E511 HydrophobicContact CE2-CB 4.48Å; Y460-E511 PolarHBondContact OH-OE2 3.45Å
461	V	93.4	Very high	94.7	Very high	59 Å²	59	50.3 Å²	50.3	36%	0.358	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-56.6	-31.4	-176.6	-173.1	0	0	0	0	113.5	T463 L464 Y480	V461-T463 PolarHBondContact O-N 2.99Å; V461-T463 VanDerWaalsContact O-N 3.13Å; V461-L464 WeakPolarHBondContact O-CB 3.37Å; V461-L464 PolarHBondContact O-N 3.42Å; V461-Y480 HydrophobicContact CG2-CD1 3.79Å; V461-Y480 HydrophobicContact CG2-CD2 4.33Å; V461-Y480 HydrophobicContact CG2-CE1 3.22Å; V461-Y480 HydrophobicContact CG2-CE2 3.83Å; V461-Y480 HydrophobicContact CG2-CG 4.28Å; V461-Y480 WeakPolarHBondContact CG2-OH 3.44Å
462	H	94	Very high	94.6	Very high	163 Å²	163	55.2 Å²	55.2	76%	0.755	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-65.5	-13.8	177.8	70.4	-88.4	0	0	0	113.5	Y460	Y460-H462 AromaticContact CG-CE1 3.92Å; Y460-H462 PolarHBondContact O-N 2.77Å; Y460-H462 VanDerWaalsContact O-N 3.1Å
463	T	95.6	Very high	94.6	Very high	25 Å²	25	55.6 Å²	55.6	15%	0.153	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-96.3	0.9	175.6	70.6	0	0	0	0	112.8	Y460 V461 T465 Q509	Y460-T463 WeakPolarHBondContact O-CB 3.32Å; Y460-T463 PolarHBondContact O-N 2.88Å; Y460-T463 PolarHBondContact O-OG1 2.77Å; V461-T463 PolarHBondContact O-N 2.99Å; V461-T463 VanDerWaalsContact O-N 3.13Å; T463-T465 PolarHBondContact O-N 3.11Å; T463-T465 VanDerWaalsContact O-N 3.13Å; T463-Q509 HydrophobicContact CG2-CB 4.1Å; T463-Q509 HydrophobicContact CG2-CG 4.06Å; T463-Q509 WeakPolarHBondContact OG1-CB 3.31Å; T463-Q509 PolarHBondContact OG1-N 3.24Å
464	L	96.3	Very high	94.5	Very high	40 Å²	40	63.1 Å²	63.1	21%	0.209	32%	0.322	C	S	.	.			trans	-60.9	116.9	178	176	63.8	0	0	0	109.6	V461 V466 M494 V506 T507	V461-L464 WeakPolarHBondContact O-CB 3.37Å; V461-L464 PolarHBondContact O-N 3.42Å; L464-V466 HydrophobicContact CD1-CG2 4.42Å; L464-M494 HydrophobicContact CD1-CE 4Å; L464-M494 HydrophobicContact CD2-CE 4.12Å; L464-V506 HydrophobicContact CD1-CG1 3.8Å; L464-T507 WeakPolarHBondContact CA-O 3.19Å
465	T	96.2	Very high	94.4	Very high	64 Å²	64	63.4 Å²	63.4	39%	0.393	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	140.2	170.9	75.7	0	0	0	0	110.3	T463 V506 T507	T463-T465 PolarHBondContact O-N 3.11Å; T463-T465 VanDerWaalsContact O-N 3.13Å; T465-V506 WeakPolarHBondContact O-CA 3.3Å; T465-T507 PolarHBondContact N-O 2.94Å; T465-T507 PolarHBondContact O-N 2.82Å; T465-T507 PolarHBondContact OG1-OG1 2.77Å
466	V	97.3	Very high	94.4	Very high	6 Å²	6	67.1 Å²	67.1	4%	0.036	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	111.5	177.4	-176.3	0	0	0	0	107	L464 N473 P475 M494 V496 T504 E505 V506	L464-V466 HydrophobicContact CD1-CG2 4.42Å; V466-N473 WeakPolarHBondContact CB-O 3.34Å; V466-N473 HydrophobicContact CG1-CB 4.26Å; V466-N473 VanDerWaalsContact CG1-O 3.24Å; V466-N473 WeakPolarHBondContact CG1-O 3.19Å; V466-N473 PolarHBondContact O-N 3.1Å; V466-P475 HydrophobicContact CG2-CG 3.98Å; V466-M494 HydrophobicContact CG2-SD 4.2Å; V466-V496 HydrophobicContact CG1-CG1 3.85Å; V466-V496 HydrophobicContact CG1-CG2 4.33Å; V466-T504 HydrophobicContact CG1-CG2 3.98Å; V466-E505 CarbonylContact C-O 3.5Å; V466-E505 WeakPolarHBondContact CA-O 3.5Å; V466-V506 HydrophobicContact CG1-CG2 4.1Å; V466-V506 HydrophobicContact CG2-CG1 4.33Å; V466-V506 HydrophobicContact CG2-CG2 4.14Å
467	T	96.8	Very high	94.5	Very high	41 Å²	41	70 Å²	70	25%	0.252	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	138.9	-176.3	72.2	0	0	0	0	111.1	K471 T504 E505	T467-K471 CarbonylContact C-O 3.51Å; T467-K471 VanDerWaalsContact CA-O 3.25Å; T467-K471 WeakPolarHBondContact CA-O 3.41Å; T467-T504 CarbonylContact O-C 3.53Å; T467-T504 VanDerWaalsContact O-CA 3.26Å; T467-T504 WeakPolarHBondContact O-CA 3.45Å; T467-E505 PolarHBondContact N-O 2.98Å; T467-E505 PolarHBondContact O-N 3.48Å
468	S	94.9	Very high	94.5	Very high	8 Å²	8	74.1 Å²	74.1	6%	0.056	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	126.3	174.2	-59.7	0	0	0	0	109.2	G470 K471 N473 T504	S468-G470 PolarHBondContact O-N 2.87Å; S468-K471 PolarHBondContact N-O 3.03Å; S468-K471 PolarHBondContact O-N 3.49Å; S468-N473 WeakPolarHBondContact OG-CB 3.47Å; S468-N473 PolarHBondContact OG-ND2 3.06Å; S468-T504 WeakPolarHBondContact OG-CB 3.37Å; S468-T504 VanDerWaalsContact OG-CG2 3.25Å; S468-T504 WeakPolarHBondContact OG-CG2 3.41Å; S468-T504 PolarHBondContact OG-OG1 3.46Å
469	K	88.8	Confident	94.6	Very high	130 Å²	130	72.8 Å²	72.8	57%	0.565	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	37.9	-175.7	-64.9	178.8	161.5	160.3	0	112.8	K471 P500 H501 S502 V503	K469-K471 VanDerWaalsContact C-N 3.26Å; K469-K471 PolarHBondContact O-N 3.02Å; K469-P500 PolarHBondContact NZ-O 3.06Å; K469-H501 VanDerWaalsContact CE-O 3.27Å; K469-H501 WeakPolarHBondContact CE-O 3.29Å; K469-H501 PolarHBondContact NZ-O 3.36Å; K469-S502 VanDerWaalsContact CE-CB 3.41Å; K469-V503 PolarHBondContact N-O 3.19Å
470	G	87.7	Confident	94.6	Very high	76 Å²	76	74.9 Å²	74.9	78%	0.784	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	12	-179.2	0	0	0	0	0	115.4	S468	S468-G470 PolarHBondContact O-N 2.87Å
471	K	93.1	Very high	94.7	Very high	161 Å²	161	73.7 Å²	73.7	70%	0.7	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	149.2	174.5	-63.9	-176.2	-179.6	-178.3	0	110.6	T467 S468 K469 N473	T467-K471 CarbonylContact C-O 3.51Å; T467-K471 VanDerWaalsContact CA-O 3.25Å; T467-K471 WeakPolarHBondContact CA-O 3.41Å; S468-K471 PolarHBondContact N-O 3.03Å; S468-K471 PolarHBondContact O-N 3.49Å; K469-K471 VanDerWaalsContact C-N 3.26Å; K469-K471 PolarHBondContact O-N 3.02Å; K471-N473 PolarHBondContact O-N 2.95Å
472	D	94.1	Very high	94.8	Very high	109 Å²	109	73.9 Å²	73.9	58%	0.583	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.8	127.8	173.4	-176.8	31.7	0	0	0	110.6	K474	D472-K474 WeakPolarHBondContact OD2-CE 3.47Å
473	N	94.5	Very high	94.9	Very high	26 Å²	26	67 Å²	67	14%	0.139	36%	0.36	C	S	.	.			trans	-121.1	93	179.4	-178.9	11	0	0	0	109.4	V466 S468 K471 P475 V496 Q497	V466-N473 WeakPolarHBondContact CB-O 3.34Å; V466-N473 HydrophobicContact CG1-CB 4.26Å; V466-N473 VanDerWaalsContact CG1-O 3.24Å; V466-N473 WeakPolarHBondContact CG1-O 3.19Å; V466-N473 PolarHBondContact O-N 3.1Å; S468-N473 WeakPolarHBondContact OG-CB 3.47Å; S468-N473 PolarHBondContact OG-ND2 3.06Å; K471-N473 PolarHBondContact O-N 2.95Å; N473-P475 WeakPolarHBondContact O-CD 3.33Å; N473-V496 WeakPolarHBondContact ND2-CG1 3.39Å; N473-Q497 PolarHBondContact ND2-O 3.17Å
474	K	94.3	Very high	94.9	Very high	160 Å²	160	70.9 Å²	70.9	70%	0.696	38%	0.375	S	S	*	.			trans	-68.9	122.6	-175	-65.8	-175.5	178.8	-178.4	0	110.9	D472	D472-K474 WeakPolarHBondContact OD2-CE 3.47Å
475	P	95.1	Very high	94.8	Very high	30 Å²	30	71.7 Å²	71.7	20%	0.195	38%	0.38	C	S	.	.			trans	-62.7	139.9	175.7	-21.1	32.6	0	0	0	111.6	V466 N473 Y477 I478 M494 L495 V496	V466-P475 HydrophobicContact CG2-CG 3.98Å; N473-P475 WeakPolarHBondContact O-CD 3.33Å; P475-Y477 VanDerWaalsContact C-N 3.28Å; P475-Y477 PolarHBondContact O-N 2.82Å; P475-I478 HydrophobicContact CB-CD1 3.99Å; P475-I478 HydrophobicContact CB-CG1 3.69Å; P475-I478 HydrophobicContact CG-CD1 3.86Å; P475-I478 HydrophobicContact CG-CG1 4.07Å; P475-M494 HydrophobicContact CB-CB 4.28Å; P475-M494 HydrophobicContact CG-SD 4.42Å; P475-L495 CarbonylContact C-O 3.58Å; P475-L495 VanDerWaalsContact CA-O 3.31Å; P475-L495 WeakPolarHBondContact CA-O 3.09Å; P475-L495 WeakPolarHBondContact CB-O 3.49Å; P475-V496 HydrophobicContact CB-CG2 4.13Å; P475-V496 HydrophobicContact CG-CG2 4.12Å
476	S	95.4	Very high	94.6	Very high	101 Å²	101	73 Å²	73	71%	0.706	38%	0.377	S	S	*	.	S	Bend	trans	-73.5	-23.8	177.3	-57.4	0	0	0	0	112.6	L495	S476-L495 PolarHBondContact N-O 2.86Å
477	Y	95.9	Very high	94.5	Very high	87 Å²	87	77.9 Å²	77.9	34%	0.341	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	137.7	179.6	168.4	-99.2	0	0	0	108.6	S221 A222 P475 H479 E493 M494 L495	S221-Y477 PolarHBondContact OG-OH 2.88Å; A222-Y477 HydrophobicContact CB-CE1 4.19Å; P475-Y477 VanDerWaalsContact C-N 3.28Å; P475-Y477 PolarHBondContact O-N 2.82Å; Y477-H479 HydrophobicContact CE1-CB 3.9Å; Y477-H479 HydrophobicContact CE2-CB 4.36Å; Y477-H479 WeakPolarHBondContact OH-CB 3.39Å; Y477-E493 HydrophobicContact CE1-CB 4.18Å; Y477-M494 CarbonylContact O-C 3.56Å; Y477-M494 WeakPolarHBondContact O-CA 3.48Å; Y477-L495 PolarHBondContact O-N 3.43Å
478	I	95.8	Very high	94.4	Very high	86 Å²	86	79 Å²	79	44%	0.441	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	124.9	172.7	-55.5	178.5	0	0	0	107.6	P475 L492 E493 M494	P475-I478 HydrophobicContact CB-CD1 3.99Å; P475-I478 HydrophobicContact CB-CG1 3.69Å; P475-I478 HydrophobicContact CG-CD1 3.86Å; P475-I478 HydrophobicContact CG-CG1 4.07Å; I478-L492 HydrophobicContact CG2-CD1 4.12Å; I478-E493 CarbonylContact C-O 3.5Å; I478-E493 WeakPolarHBondContact CA-O 3.46Å; I478-M494 HydrophobicContact CG1-CB 4.31Å
479	H	96.3	Very high	94.5	Very high	67 Å²	67	78.7 Å²	78.7	31%	0.31	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	121.6	167.6	176.1	74.1	0	0	0	108.6	Y477 E493	Y477-H479 HydrophobicContact CE1-CB 3.9Å; Y477-H479 HydrophobicContact CE2-CB 4.36Å; Y477-H479 WeakPolarHBondContact OH-CB 3.39Å; H479-E493 HydrophobicContact CB-CB 4.25Å; H479-E493 IonicContact CD2-OE2 3.14Å; H479-E493 PolarHBondContact N-O 2.87Å; H479-E493 PolarHBondContact O-N 3.44Å
480	Y	96.4	Very high	94.9	Very high	57 Å²	57	73 Å²	73	22%	0.224	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	127	-179	176.3	-102.6	0	0	0	110.6	L459 V461 P482 H490 L491 L492	L459-Y480 HydrophobicContact CD1-CE2 4.44Å; V461-Y480 HydrophobicContact CG2-CD1 3.79Å; V461-Y480 HydrophobicContact CG2-CD2 4.33Å; V461-Y480 HydrophobicContact CG2-CE1 3.22Å; V461-Y480 HydrophobicContact CG2-CE2 3.83Å; V461-Y480 HydrophobicContact CG2-CG 4.28Å; V461-Y480 WeakPolarHBondContact CG2-OH 3.44Å; Y480-P482 HydrophobicContact CE1-CB 3.81Å; Y480-P482 HydrophobicContact CE1-CG 4.45Å; Y480-H490 HydrophobicContact CE2-CB 4.38Å; Y480-H490 AromaticContact CE2-ND1 3.95Å; Y480-H490 AromaticContact CZ-ND1 3.57Å; Y480-H490 PolarHBondContact OH-CE1 2.79Å; Y480-H490 PolarHBondContact OH-ND1 3.4Å; Y480-L491 CarbonylContact C-O 3.5Å; Y480-L491 VanDerWaalsContact CA-O 3.32Å; Y480-L491 WeakPolarHBondContact CA-O 3.3Å; Y480-L491 WeakPolarHBondContact CD2-O 3.36Å; Y480-L492 HydrophobicContact CD2-CB 4.16Å; Y480-L492 HydrophobicContact CD2-CD1 4.01Å
481	Q	96	Very high	95.3	Very high	52 Å²	52	69.4 Å²	69.4	24%	0.243	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	117.8	171.3	-158.4	-176	46.8	0	0	108.6	R488 H490 L491	Q481-R488 VanDerWaalsContact CD-NH1 3.33Å; Q481-R488 VanDerWaalsContact NE2-NH1 3.11Å; Q481-H490 WeakPolarHBondContact O-CA 3.26Å; Q481-L491 HydrophobicContact CB-CB 3.9Å; Q481-L491 HydrophobicContact CB-CD2 4.5Å; Q481-L491 PolarHBondContact N-O 3.36Å; Q481-L491 PolarHBondContact O-N 3.23Å
482	P	96.2	Very high	95.5	Very high	62 Å²	62	62 Å²	62	40%	0.403	31%	0.305	S	S	.	.			trans	-71.8	143.7	178.7	27.2	-32.9	0	0	0	111.3	Y480 R488	Y480-P482 HydrophobicContact CE1-CB 3.81Å; Y480-P482 HydrophobicContact CE1-CG 4.45Å; P482-R488 PolarHBondContact O-NE 3.35Å; P482-R488 PolarHBondContact O-NH2 2.89Å
483	S	96.4	Very high	95.7	Very high	20 Å²	20	56.8 Å²	56.8	14%	0.14	28%	0.277	C	S	.	.			trans	-61.7	163	172.2	70.7	0	0	0	0	112	R488 P489 H490	S483-R488 WeakPolarHBondContact CA-O 3.49Å; S483-R488 VanDerWaalsContact CB-O 3.3Å; S483-R488 WeakPolarHBondContact CB-O 3.35Å; S483-P489 WeakPolarHBondContact CA-O 3.41Å; S483-H490 WeakPolarHBondContact CB-CD2 3.33Å; S483-H490 WeakPolarHBondContact CB-NE2 3.43Å; S483-H490 PolarHBondContact N-CE1 2.92Å; S483-H490 PolarHBondContact N-ND1 3.19Å; S483-H490 PolarHBondContact OG-CD2 3.42Å; S483-H490 VanDerWaalsContact OG-CD2 3.25Å; S483-H490 PolarHBondContact OG-CE1 2.82Å; S483-H490 PolarHBondContact OG-NE2 3.24Å
484	K	95.7	Very high	95.8	Very high	105 Å²	105	55.6 Å²	55.6	46%	0.457	27%	0.27	S	S	.	.	B	Isolated β-bridge	trans	-133.1	128.6	165.1	-64.9	179.5	177.8	-179.8	0	107.3	R486 M487 R488	K484-R486 PolarHBondContact O-N 3.25Å; K484-M487 HydrophobicContact CB-CB 3.93Å; K484-M487 HydrophobicContact CB-CE 3.71Å; K484-M487 HydrophobicContact CD-CE 4.06Å; K484-M487 HydrophobicContact CD-SD 4.37Å; K484-M487 HydrophobicContact CG-CE 4.46Å; K484-M487 PolarHBondContact O-N 2.86Å; K484-R488 HydrophobicContact CB-CG 4.12Å; K484-R488 HydrophobicContact CG-CG 4.29Å; K484-R488 PolarHBondContact N-O 2.59Å; K484-R488 PolarHBondContact O-N 3.05Å; K484-R488 VanDerWaalsContact O-N 3.14Å
485	D	93.4	Very high	95.9	Very high	58 Å²	58	50.6 Å²	50.6	31%	0.31	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.5	122.3	-177.7	-70.1	15.7	0	0	0	111.2	W455 R458 M487	W455-D485 HydrophobicContact CE3-CB 4.07Å; W455-D485 HydrophobicContact CZ3-CB 4.44Å; R458-D485 IonicContact CZ-OD2 3.24Å; R458-D485 IonicContact NE-OD1 2.85Å; R458-D485 IonicContact NH2-OD1 3.88Å; R458-D485 IonicContact NH2-OD2 2.74Å; R458-D485 PolarHBondContact NH2-OD2 2.64Å; D485-M487 PolarHBondContact O-N 3.11Å; D485-M487 VanDerWaalsContact O-N 3.08Å
486	R	92.7	Very high	96	Very high	92 Å²	92	49.2 Å²	49.2	35%	0.347	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	14.1	178.9	-56	166.3	-178.8	73.5	13.8	115.7	T215 W455 K484 E519	T215-R486 WeakPolarHBondContact CG2-O 3.3Å; W455-R486 HydrophobicContact CD2-CG 4.47Å; W455-R486 HydrophobicContact CH2-CG 3.6Å; W455-R486 HydrophobicContact CZ2-CB 4.42Å; W455-R486 HydrophobicContact CZ2-CG 3.5Å; W455-R486 HydrophobicContact CZ3-CG 4.13Å; K484-R486 PolarHBondContact O-N 3.25Å; R486-E519 IonicContact CZ-OE1 3.29Å; R486-E519 VanDerWaalsContact CZ-OE1 3.29Å; R486-E519 IonicContact CZ-OE2 3.76Å; R486-E519 IonicContact NE-OE1 2.68Å; R486-E519 PolarHBondContact NE-OE1 3.19Å; R486-E519 IonicContact NE-OE2 3.83Å; R486-E519 IonicContact NH2-OE1 3.02Å; R486-E519 PolarHBondContact NH2-OE1 2.98Å; R486-E519 IonicContact NH2-OE2 2.89Å; R486-E519 PolarHBondContact NH2-OE2 3.38Å
487	M	94.5	Very high	96	Very high	107 Å²	107	47.5 Å²	47.5	53%	0.527	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.6	-48.3	-179.6	-78	-176.1	-85.5	0	0	112.3	S214 T215 K484 D485	S214-M487 CarbonylContact C-O 3.51Å; S214-M487 WeakPolarHBondContact CB-O 3.44Å; S214-M487 PolarHBondContact OG-O 3.28Å; T215-M487 PolarHBondContact N-O 3Å; K484-M487 HydrophobicContact CB-CB 3.93Å; K484-M487 HydrophobicContact CB-CE 3.71Å; K484-M487 HydrophobicContact CD-CE 4.06Å; K484-M487 HydrophobicContact CD-SD 4.37Å; K484-M487 HydrophobicContact CG-CE 4.46Å; K484-M487 PolarHBondContact O-N 2.86Å; D485-M487 PolarHBondContact O-N 3.11Å; D485-M487 VanDerWaalsContact O-N 3.08Å
488	R	95.1	Very high	96	Very high	64 Å²	64	43.4 Å²	43.4	24%	0.242	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-156	152.3	-177.2	70.3	177.2	-171.9	176.9	2.3	112.4	S214 Q481 P482 S483 K484	S214-R488 WeakPolarHBondContact O-CA 3.45Å; Q481-R488 VanDerWaalsContact CD-NH1 3.33Å; Q481-R488 VanDerWaalsContact NE2-NH1 3.11Å; P482-R488 PolarHBondContact O-NE 3.35Å; P482-R488 PolarHBondContact O-NH2 2.89Å; S483-R488 WeakPolarHBondContact CA-O 3.49Å; S483-R488 VanDerWaalsContact CB-O 3.3Å; S483-R488 WeakPolarHBondContact CB-O 3.35Å; K484-R488 HydrophobicContact CB-CG 4.12Å; K484-R488 HydrophobicContact CG-CG 4.29Å; K484-R488 PolarHBondContact N-O 2.59Å; K484-R488 PolarHBondContact O-N 3.05Å; K484-R488 VanDerWaalsContact O-N 3.14Å
489	P	97.1	Very high	96	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.019	20%	0.196	C	C	.	.			trans	-79.9	174.1	177.2	35.8	-34.5	0	0	0	111.5	T215 T217 V218 V453 S483	T215-P489 VanDerWaalsContact O-CD 3.24Å; T215-P489 WeakPolarHBondContact O-CD 3.34Å; T217-P489 WeakPolarHBondContact O-CD 3.49Å; V218-P489 HydrophobicContact CG1-CG 3.4Å; V453-P489 WeakPolarHBondContact O-CB 3.17Å; S483-P489 WeakPolarHBondContact CA-O 3.41Å
490	H	97.1	Very high	95.9	Very high	9 Å²	9	39.4 Å²	39.4	4%	0.042	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	139.1	164.8	-66.6	-84.5	0	0	0	109.4	S452 V453 L457 L459 Y480 Q481 S483	S452-H490 WeakPolarHBondContact CA-O 3.25Å; V453-H490 HydrophobicContact CB-CB 4.18Å; V453-H490 PolarHBondContact N-O 3.08Å; V453-H490 WeakPolarHBondContact O-CB 3.21Å; V453-H490 PolarHBondContact O-N 3.2Å; L457-H490 PolarHBondContact O-CD2 3.02Å; L457-H490 VanDerWaalsContact O-CD2 3.23Å; L457-H490 PolarHBondContact O-NE2 2.91Å; L459-H490 HydrophobicContact CD1-CB 3.65Å; L459-H490 HydrophobicContact CG-CB 4.46Å; L459-H490 PolarHBondContact N-NE2 3.18Å; Y480-H490 HydrophobicContact CE2-CB 4.38Å; Y480-H490 AromaticContact CE2-ND1 3.95Å; Y480-H490 AromaticContact CZ-ND1 3.57Å; Y480-H490 PolarHBondContact OH-CE1 2.79Å; Y480-H490 PolarHBondContact OH-ND1 3.4Å; Q481-H490 WeakPolarHBondContact O-CA 3.26Å; S483-H490 WeakPolarHBondContact CB-CD2 3.33Å; S483-H490 WeakPolarHBondContact CB-NE2 3.43Å; S483-H490 PolarHBondContact N-CE1 2.92Å; S483-H490 PolarHBondContact N-ND1 3.19Å; S483-H490 PolarHBondContact OG-CD2 3.42Å; S483-H490 VanDerWaalsContact OG-CD2 3.25Å; S483-H490 PolarHBondContact OG-CE1 2.82Å; S483-H490 PolarHBondContact OG-NE2 3.24Å
491	L	97.1	Very high	95.8	Very high	1 Å²	1	43 Å²	43	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	125.2	171.5	172.7	67.4	0	0	0	108.2	V218 L450 Y480 Q481 E493	V218-L491 HydrophobicContact CB-CD1 4.13Å; V218-L491 HydrophobicContact CB-CD2 4.46Å; V218-L491 HydrophobicContact CG1-CB 4.21Å; V218-L491 HydrophobicContact CG1-CD1 4.36Å; V218-L491 HydrophobicContact CG2-CD1 4.22Å; L450-L491 HydrophobicContact CD1-CD1 3.28Å; Y480-L491 CarbonylContact C-O 3.5Å; Y480-L491 VanDerWaalsContact CA-O 3.32Å; Y480-L491 WeakPolarHBondContact CA-O 3.3Å; Y480-L491 WeakPolarHBondContact CD2-O 3.36Å; Q481-L491 HydrophobicContact CB-CB 3.9Å; Q481-L491 HydrophobicContact CB-CD2 4.5Å; Q481-L491 PolarHBondContact N-O 3.36Å; Q481-L491 PolarHBondContact O-N 3.23Å; L491-E493 HydrophobicContact CD1-CG 4.42Å
492	L	96.8	Very high	95.7	Very high	6 Å²	6	40.9 Å²	40.9	3%	0.031	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	119.6	174.5	178.7	60.2	0	0	0	109.2	L450 D451 I478 Y480 M494 M508	L450-L492 CarbonylContact C-O 3.56Å; L450-L492 WeakPolarHBondContact CA-O 3.44Å; D451-L492 HydrophobicContact CB-CB 4.4Å; D451-L492 PolarHBondContact N-O 3.06Å; D451-L492 PolarHBondContact O-N 3Å; I478-L492 HydrophobicContact CG2-CD1 4.12Å; Y480-L492 HydrophobicContact CD2-CB 4.16Å; Y480-L492 HydrophobicContact CD2-CD1 4.01Å; L492-M494 HydrophobicContact CD1-CE 3.83Å; L492-M494 HydrophobicContact CD2-CE 3.36Å; L492-M494 HydrophobicContact CG-CE 3.61Å; L492-M508 HydrophobicContact CD2-CE 3.66Å
493	E	97.3	Very high	95.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	130.2	170	-70.2	-178.4	113.2	0	0	109	S221 A222 S223 L449 L450 Y477 I478 H479 L491	S221-E493 WeakPolarHBondContact CA-OE2 3.35Å; S221-E493 WeakPolarHBondContact CB-OE2 3.24Å; S221-E493 PolarHBondContact N-OE1 2.86Å; S221-E493 PolarHBondContact N-OE2 2.97Å; S221-E493 PolarHBondContact OG-OE2 2.94Å; A222-E493 PolarHBondContact N-OE1 2.95Å; A222-E493 PolarHBondContact N-OE2 2.57Å; S223-E493 PolarHBondContact N-OE1 3.37Å; L449-E493 CarbonylContact O-C 3.55Å; L449-E493 VanDerWaalsContact O-CA 3.25Å; L449-E493 WeakPolarHBondContact O-CA 3.5Å; L450-E493 HydrophobicContact CB-CG 4.45Å; L450-E493 HydrophobicContact CD1-CG 3.39Å; Y477-E493 HydrophobicContact CE1-CB 4.18Å; I478-E493 CarbonylContact C-O 3.5Å; I478-E493 WeakPolarHBondContact CA-O 3.46Å; H479-E493 HydrophobicContact CB-CB 4.25Å; H479-E493 IonicContact CD2-OE2 3.14Å; H479-E493 PolarHBondContact N-O 2.87Å; H479-E493 PolarHBondContact O-N 3.44Å; L491-E493 HydrophobicContact CD1-CG 4.42Å
494	M	96.6	Very high	95.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	140.4	175.1	64.3	176.9	77.7	0	0	112.6	L448 L449 L464 V466 P475 Y477 I478 L492 V496 V506	L448-M494 WeakPolarHBondContact CA-O 3.49Å; L449-M494 HydrophobicContact CB-CG 3.77Å; L449-M494 HydrophobicContact CD2-CE 4.17Å; L449-M494 HydrophobicContact CD2-CG 3.97Å; L449-M494 HydrophobicContact CD2-SD 3.87Å; L449-M494 HydrophobicContact CG-CG 4.36Å; L449-M494 PolarHBondContact N-O 3.13Å; L449-M494 PolarHBondContact O-N 2.9Å; L464-M494 HydrophobicContact CD1-CE 4Å; L464-M494 HydrophobicContact CD2-CE 4.12Å; V466-M494 HydrophobicContact CG2-SD 4.2Å; P475-M494 HydrophobicContact CB-CB 4.28Å; P475-M494 HydrophobicContact CG-SD 4.42Å; Y477-M494 CarbonylContact O-C 3.56Å; Y477-M494 WeakPolarHBondContact O-CA 3.48Å; I478-M494 HydrophobicContact CG1-CB 4.31Å; L492-M494 HydrophobicContact CD1-CE 3.83Å; L492-M494 HydrophobicContact CD2-CE 3.36Å; L492-M494 HydrophobicContact CG-CE 3.61Å; M494-V496 HydrophobicContact CB-CG2 4.37Å; M494-V496 HydrophobicContact CG-CG2 3.82Å; M494-V496 HydrophobicContact SD-CG2 3.77Å; M494-V506 HydrophobicContact CE-CG1 3.98Å; M494-V506 HydrophobicContact SD-CG1 4.07Å; M494-V506 HydrophobicContact SD-CG2 4.13Å
495	L	97.4	Very high	95.8	Very high	56 Å²	56	37.4 Å²	37.4	29%	0.293	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	112	174.5	-169.2	70.7	0	0	0	109.3	P446 V447 L448 P475 S476 Y477	P446-L495 HydrophobicContact CB-CD1 4.11Å; P446-L495 HydrophobicContact CB-CG 4.35Å; V447-L495 WeakPolarHBondContact O-CA 3.41Å; L448-L495 HydrophobicContact CB-CD1 4.06Å; L448-L495 HydrophobicContact CD1-CB 4.45Å; L448-L495 HydrophobicContact CD1-CD1 4.39Å; P475-L495 CarbonylContact C-O 3.58Å; P475-L495 VanDerWaalsContact CA-O 3.31Å; P475-L495 WeakPolarHBondContact CA-O 3.09Å; P475-L495 WeakPolarHBondContact CB-O 3.49Å; S476-L495 PolarHBondContact N-O 2.86Å; Y477-L495 PolarHBondContact O-N 3.43Å
496	V	96.4	Very high	96	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	132	-175.1	-174.2	0	0	0	0	109.5	V447 V466 N473 P475 M494 T504	V447-V496 PolarHBondContact N-O 2.75Å; V447-V496 PolarHBondContact O-N 3.35Å; V466-V496 HydrophobicContact CG1-CG1 3.85Å; V466-V496 HydrophobicContact CG1-CG2 4.33Å; N473-V496 WeakPolarHBondContact ND2-CG1 3.39Å; P475-V496 HydrophobicContact CB-CG2 4.13Å; P475-V496 HydrophobicContact CG-CG2 4.12Å; M494-V496 HydrophobicContact CB-CG2 4.37Å; M494-V496 HydrophobicContact CG-CG2 3.82Å; M494-V496 HydrophobicContact SD-CG2 3.77Å; V496-T504 HydrophobicContact CG1-CG2 3.85Å
497	Q	95.8	Very high	96.2	Very high	66 Å²	66	31.6 Å²	31.6	31%	0.308	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	125.7	174.2	-170.1	69.7	10.4	0	0	109.4	S444 N473 P499	S444-Q497 PolarHBondContact OG-NE2 3.17Å; N473-Q497 PolarHBondContact ND2-O 3.17Å; Q497-P499 WeakPolarHBondContact O-CD 3.48Å
498	L	96.3	Very high	96.3	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	112.8	173.7	-58.9	-171.5	0	0	0	110.6	L416 M436 N438 S444 F445 V447 T504	L416-L498 HydrophobicContact CD1-CD1 3.78Å; M436-L498 HydrophobicContact CB-CD1 4.04Å; M436-L498 HydrophobicContact CB-CD2 3.99Å; M436-L498 HydrophobicContact CE-CD2 4.38Å; N438-L498 HydrophobicContact CB-CB 3.82Å; N438-L498 HydrophobicContact CB-CD1 4.27Å; N438-L498 PolarHBondContact ND2-O 2.88Å; S444-L498 WeakPolarHBondContact CA-O 3.33Å; S444-L498 WeakPolarHBondContact CB-O 3.32Å; F445-L498 HydrophobicContact CE2-CD1 4.29Å; F445-L498 PolarHBondContact N-O 3.1Å; F445-L498 PolarHBondContact O-N 3.42Å; V447-L498 HydrophobicContact CB-CD1 4.09Å; V447-L498 HydrophobicContact CB-CG 4.08Å; V447-L498 HydrophobicContact CG2-CD1 3.36Å; V447-L498 HydrophobicContact CG2-CG 3.61Å; L498-T504 VanDerWaalsContact CD2-CB 3.48Å; L498-T504 HydrophobicContact CD2-CG2 4.05Å; L498-T504 WeakPolarHBondContact CD2-OG1 3.24Å
499	P	95.7	Very high	96.3	Very high	34 Å²	34	27.6 Å²	27.6	22%	0.221	14%	0.144	C	C	.	.			trans	-61	155.7	175.7	-21.4	32.9	0	0	0	112.5	N438 Q497 S502	N438-P499 WeakPolarHBondContact CB-O 3.34Å; N438-P499 PolarHBondContact ND2-O 2.75Å; Q497-P499 WeakPolarHBondContact O-CD 3.48Å; P499-S502 WeakPolarHBondContact CB-OG 3.3Å; P499-S502 VanDerWaalsContact CD-OG 3.31Å; P499-S502 WeakPolarHBondContact CD-OG 3.38Å; P499-S502 WeakPolarHBondContact O-CB 3.46Å; P499-S502 PolarHBondContact O-OG 3.06Å
500	P	94.8	Very high	96.3	Very high	36 Å²	36	27.5 Å²	27.5	23%	0.234	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	144.4	177.8	28	-35.7	0	0	0	111.5	K469 S502	K469-P500 PolarHBondContact NZ-O 3.06Å; P500-S502 VanDerWaalsContact C-N 3.33Å; P500-S502 PolarHBondContact O-N 2.64Å
501	H	93.5	Very high	96.2	Very high	131 Å²	131	29.3 Å²	29.3	61%	0.606	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	43	58.9	-179.9	-164.8	-72.4	0	0	0	111.6	N438 H440 K469	N438-H501 CarbonylContact O-C 3.53Å; N438-H501 WeakPolarHBondContact O-CA 3.39Å; N438-H501 PolarHBondContact O-N 3.25Å; N438-H501 VanDerWaalsContact O-N 3.13Å; H440-H501 PolarHBondContact O-N 3.3Å; K469-H501 VanDerWaalsContact CE-O 3.27Å; K469-H501 WeakPolarHBondContact CE-O 3.29Å; K469-H501 PolarHBondContact NZ-O 3.36Å
502	S	94.9	Very high	96	Very high	8 Å²	8	30.4 Å²	30.4	6%	0.056	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	162.5	-172.1	83.4	0	0	0	0	113.2	N438 K469 P499 P500	N438-S502 PolarHBondContact N-O 2.92Å; N438-S502 PolarHBondContact O-N 2.76Å; K469-S502 VanDerWaalsContact CE-CB 3.41Å; P499-S502 WeakPolarHBondContact CB-OG 3.3Å; P499-S502 VanDerWaalsContact CD-OG 3.31Å; P499-S502 WeakPolarHBondContact CD-OG 3.38Å; P499-S502 WeakPolarHBondContact O-CB 3.46Å; P499-S502 PolarHBondContact O-OG 3.06Å; P500-S502 VanDerWaalsContact C-N 3.33Å; P500-S502 PolarHBondContact O-N 2.64Å
503	V	95.8	Very high	95.7	Very high	59 Å²	59	30.3 Å²	30.3	36%	0.358	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	130.3	169.4	-168.8	0	0	0	0	107.6	L435 M436 Y437 K469	L435-V503 HydrophobicContact CB-CG1 4.29Å; L435-V503 HydrophobicContact CD2-CG1 4.23Å; M436-V503 WeakPolarHBondContact O-CA 3.33Å; Y437-V503 HydrophobicContact CD1-CB 4.24Å; Y437-V503 HydrophobicContact CD1-CG1 3.99Å; Y437-V503 HydrophobicContact CD1-CG2 3.38Å; Y437-V503 HydrophobicContact CE1-CB 4.33Å; Y437-V503 HydrophobicContact CE1-CG1 3.82Å; Y437-V503 HydrophobicContact CE1-CG2 3.52Å; Y437-V503 HydrophobicContact CG-CG1 4.43Å; Y437-V503 HydrophobicContact CG-CG2 4.35Å; K469-V503 PolarHBondContact N-O 3.19Å
504	T	97.3	Very high	95.4	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	124.2	170.9	-59.6	0	0	0	0	108.4	M436 V466 T467 S468 V496 L498	M436-T504 HydrophobicContact CE-CG2 4.2Å; M436-T504 PolarHBondContact N-O 3.17Å; M436-T504 PolarHBondContact O-N 2.63Å; V466-T504 HydrophobicContact CG1-CG2 3.98Å; T467-T504 CarbonylContact O-C 3.53Å; T467-T504 VanDerWaalsContact O-CA 3.26Å; T467-T504 WeakPolarHBondContact O-CA 3.45Å; S468-T504 WeakPolarHBondContact OG-CB 3.37Å; S468-T504 VanDerWaalsContact OG-CG2 3.25Å; S468-T504 WeakPolarHBondContact OG-CG2 3.41Å; S468-T504 PolarHBondContact OG-OG1 3.46Å; V496-T504 HydrophobicContact CG1-CG2 3.85Å; L498-T504 VanDerWaalsContact CD2-CB 3.48Å; L498-T504 HydrophobicContact CD2-CG2 4.05Å; L498-T504 WeakPolarHBondContact CD2-OG1 3.24Å
505	E	97.2	Very high	95.1	Very high	55 Å²	55	38 Å²	38	26%	0.257	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	127.1	-180	179.6	176.6	-158.2	0	0	109.5	H433 L435 V466 T467 T507	H433-E505 IonicContact CE1-OE1 3.63Å; H433-E505 IonicContact CG-OE1 3.67Å; H433-E505 IonicContact ND1-OE1 2.77Å; H433-E505 PolarHBondContact ND1-OE1 3.37Å; L435-E505 HydrophobicContact CD2-CB 3.59Å; L435-E505 HydrophobicContact CD2-CG 3.56Å; V466-E505 CarbonylContact C-O 3.5Å; V466-E505 WeakPolarHBondContact CA-O 3.5Å; T467-E505 PolarHBondContact N-O 2.98Å; T467-E505 PolarHBondContact O-N 3.48Å; E505-T507 HydrophobicContact CG-CG2 3.57Å; E505-T507 WeakPolarHBondContact OE1-CG2 3.26Å
506	V	97.2	Very high	94.8	Very high	7 Å²	7	41 Å²	41	4%	0.042	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	119.9	171.1	179.4	0	0	0	0	107.5	T434 M436 L449 L464 T465 V466 M494	T434-V506 PolarHBondContact N-O 2.94Å; T434-V506 PolarHBondContact O-N 2.88Å; M436-V506 HydrophobicContact CE-CG2 3.65Å; L449-V506 HydrophobicContact CD2-CB 4.36Å; L449-V506 HydrophobicContact CD2-CG1 4.2Å; L449-V506 HydrophobicContact CD2-CG2 4.1Å; L464-V506 HydrophobicContact CD1-CG1 3.8Å; T465-V506 WeakPolarHBondContact O-CA 3.3Å; V466-V506 HydrophobicContact CG1-CG2 4.1Å; V466-V506 HydrophobicContact CG2-CG1 4.33Å; V466-V506 HydrophobicContact CG2-CG2 4.14Å; M494-V506 HydrophobicContact CE-CG1 3.98Å; M494-V506 HydrophobicContact SD-CG1 4.07Å; M494-V506 HydrophobicContact SD-CG2 4.13Å
507	T	96.6	Very high	94.2	Very high	22 Å²	22	49.2 Å²	49.2	14%	0.135	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	144.3	179.3	69.9	0	0	0	0	111.4	I432 H433 L464 T465 E505	I432-T507 WeakPolarHBondContact O-CA 3.38Å; H433-T507 VanDerWaalsContact ND1-CG2 3.33Å; H433-T507 WeakPolarHBondContact ND1-CG2 3.44Å; L464-T507 WeakPolarHBondContact CA-O 3.19Å; T465-T507 PolarHBondContact N-O 2.94Å; T465-T507 PolarHBondContact O-N 2.82Å; T465-T507 PolarHBondContact OG1-OG1 2.77Å; E505-T507 HydrophobicContact CG-CG2 3.57Å; E505-T507 WeakPolarHBondContact OE1-CG2 3.26Å
508	M	95.9	Very high	93.8	Very high	8 Å²	8	50.4 Å²	50.4	4%	0.039	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	132.6	174.9	-174.3	160.3	46.4	0	0	110.7	I432 L459 L492	I432-M508 PolarHBondContact N-O 2.99Å; I432-M508 PolarHBondContact O-N 2.95Å; I432-M508 VanDerWaalsContact O-N 3.09Å; L459-M508 HydrophobicContact CB-CE 4.39Å; L459-M508 HydrophobicContact CB-SD 4.11Å; L459-M508 HydrophobicContact CD1-CE 3.54Å; L459-M508 HydrophobicContact CD1-SD 4.26Å; L459-M508 HydrophobicContact CD2-CE 4.08Å; L459-M508 HydrophobicContact CG-CE 4.22Å; L492-M508 HydrophobicContact CD2-CE 3.66Å
509	Q	96.4	Very high	93.4	Very high	79 Å²	79	52.9 Å²	52.9	37%	0.369	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	150.4	176.5	-57.1	-170.2	-25.4	0	0	111.2	G430 E431 Y460 T463	G430-Q509 CarbonylContact O-C 3.58Å; G430-Q509 WeakPolarHBondContact O-CA 3.37Å; E431-Q509 HydrophobicContact CG-CG 4.02Å; E431-Q509 PolarHBondContact OE1-NE2 3.39Å; Y460-Q509 HydrophobicContact CD2-CB 4.34Å; Y460-Q509 PolarHBondContact N-O 2.89Å; T463-Q509 HydrophobicContact CG2-CB 4.1Å; T463-Q509 HydrophobicContact CG2-CG 4.06Å; T463-Q509 WeakPolarHBondContact OG1-CB 3.31Å; T463-Q509 PolarHBondContact OG1-N 3.24Å
510	F	95.8	Very high	93.1	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	157.3	175.5	71	-91.2	0	0	0	112.5	V422 T429 G430 I432 L457 R458 L459 R512 V579	V422-F510 HydrophobicContact CG1-CE1 3.99Å; V422-F510 HydrophobicContact CG1-CZ 3.81Å; T429-F510 CarbonylContact C-O 3.6Å; T429-F510 WeakPolarHBondContact CA-O 3.39Å; G430-F510 VanDerWaalsContact C-CD1 3.48Å; G430-F510 PolarHBondContact N-O 3.08Å; G430-F510 WeakPolarHBondContact O-CD1 3.31Å; G430-F510 PolarHBondContact O-N 3.09Å; I432-F510 HydrophobicContact CD1-CD1 4.04Å; I432-F510 HydrophobicContact CD1-CE1 4.33Å; I432-F510 HydrophobicContact CG1-CD1 3.66Å; I432-F510 HydrophobicContact CG1-CE1 3.66Å; L457-F510 HydrophobicContact CB-CD2 4.12Å; L457-F510 HydrophobicContact CB-CG 4.49Å; L457-F510 HydrophobicContact CD2-CD2 3.85Å; L457-F510 HydrophobicContact CD2-CE2 3.76Å; L457-F510 HydrophobicContact CG-CD2 4.41Å; R458-F510 CarbonylContact O-C 3.55Å; R458-F510 VanDerWaalsContact O-CA 3.22Å; R458-F510 WeakPolarHBondContact O-CA 3.12Å; L459-F510 HydrophobicContact CD2-CB 3.77Å; F510-R512 HydrophobicContact CD2-CG 4.35Å; F510-R512 HydrophobicContact CE2-CG 3.88Å; F510-V579 HydrophobicContact CE2-CG1 4.23Å; F510-V579 HydrophobicContact CZ-CG1 4.31Å
511	E	94.8	Very high	92.7	Very high	47 Å²	47	51.3 Å²	51.3	22%	0.22	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	141.1	170.9	-177.4	-176.6	-166.6	0	0	110.2	Q428 R458 Y460	Q428-E511 WeakPolarHBondContact O-CA 3.22Å; R458-E511 HydrophobicContact CB-CB 4.35Å; R458-E511 PolarHBondContact N-O 3.2Å; R458-E511 PolarHBondContact O-N 2.98Å; Y460-E511 HydrophobicContact CE2-CB 4.48Å; Y460-E511 PolarHBondContact OH-OE2 3.45Å
512	R	93.5	Very high	92.3	Very high	25 Å²	25	51.8 Å²	51.8	9%	0.094	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	124.9	177.9	-64	178.1	-175.2	82.4	-3.8	110.2	G426 L427 Q428 T429 L457 F510 N580 L581	G426-R512 PolarHBondContact O-NH1 3.38Å; L427-R512 WeakPolarHBondContact O-CD 3.07Å; Q428-R512 PolarHBondContact O-N 2.97Å; T429-R512 PolarHBondContact O-NH1 2.99Å; L457-R512 HydrophobicContact CD2-CG 4.34Å; F510-R512 HydrophobicContact CD2-CG 4.35Å; F510-R512 HydrophobicContact CE2-CG 3.88Å; R512-N580 WeakPolarHBondContact CD-O 3.36Å; R512-N580 PolarHBondContact NE-O 3.02Å; R512-L581 HydrophobicContact CB-CD2 3.83Å; R512-L581 HydrophobicContact CG-CD2 3.93Å
513	A	91.7	Very high	91.9	Very high	3 Å²	3	55.3 Å²	55.3	3%	0.025	28%	0.281	C	S	.	.			trans	-74.3	148.8	175.8	0	0	0	0	0	111.7	Y456 L515	Y456-A513 WeakPolarHBondContact O-CB 3.32Å; Y456-A513 PolarHBondContact O-N 3.19Å; A513-L515 PolarHBondContact O-N 2.75Å
514	L	89.5	Confident	91.5	Very high	142 Å²	142	53.4 Å²	53.4	74%	0.743	27%	0.269	S	S	*	.			trans	-79.2	113.9	168.5	-68.6	169.3	0	0	0	109.4	P582	L514-P582 HydrophobicContact CD2-CB 4.25Å; L514-P582 HydrophobicContact CD2-CG 3.72Å
515	L	91.3	Very high	91	Very high	20 Å²	20	59.4 Å²	59.4	11%	0.105	30%	0.302	C	S	.	.			trans	-84.3	154.7	176.3	-63.9	-174.5	0	0	0	111.6	W455 A513 E519 Y520 F528 L581	W455-L515 HydrophobicContact CH2-CD2 3.38Å; W455-L515 HydrophobicContact CZ2-CD2 4.07Å; W455-L515 HydrophobicContact CZ3-CD2 3.95Å; A513-L515 PolarHBondContact O-N 2.75Å; L515-E519 WeakPolarHBondContact CA-OE2 3.45Å; L515-E519 HydrophobicContact CB-CB 4.15Å; L515-E519 HydrophobicContact CD1-CB 4.46Å; L515-Y520 HydrophobicContact CB-CD2 4.21Å; L515-Y520 HydrophobicContact CB-CE2 3.54Å; L515-Y520 HydrophobicContact CD1-CE1 4.42Å; L515-Y520 HydrophobicContact CD1-CE2 4.46Å; L515-F528 HydrophobicContact CD1-CE1 3.63Å; L515-F528 HydrophobicContact CD1-CE2 4.08Å; L515-F528 HydrophobicContact CD1-CZ 3.36Å; L515-L581 HydrophobicContact CD1-CD1 3.37Å; L515-L581 HydrophobicContact CG-CD1 3.95Å
516	K	89.8	Confident	90.6	Very high	119 Å²	119	60.3 Å²	60.3	52%	0.517	31%	0.306	S	S	.	.			trans	-72.6	153.2	167.3	-60.2	178.6	-174.8	173.8	0	109.5	T518 E519 Y520	K516-T518 PolarHBondContact O-N 2.87Å; K516-T518 VanDerWaalsContact O-N 3.13Å; K516-E519 HydrophobicContact CB-CG 4.04Å; K516-E519 WeakPolarHBondContact CD-OE1 3.13Å; K516-E519 PolarHBondContact N-OE2 3.1Å; K516-E519 WeakPolarHBondContact O-CB 3.28Å; K516-E519 PolarHBondContact O-N 2.79Å; K516-Y520 WeakPolarHBondContact O-CD2 3.39Å
517	W	83.9	Confident	90.3	Very high	172 Å²	172	60 Å²	60	65%	0.652	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-57.2	-32.5	-180	76.3	-92	0	0	0	113.1	E519 Y520	W517-E519 VanDerWaalsContact C-N 3.29Å; W517-E519 PolarHBondContact O-N 2.9Å; W517-Y520 PolarHBondContact O-N 3.19Å
518	T	87.3	Confident	90	Very high	92 Å²	92	59.8 Å²	59.8	56%	0.564	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-74.4	-14.2	176.8	57.1	0	0	0	0	114.3	K516	K516-T518 PolarHBondContact O-N 2.87Å; K516-T518 VanDerWaalsContact O-N 3.13Å
519	E	89.5	Confident	89.9	Confident	51 Å²	51	62.8 Å²	62.8	24%	0.238	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-89.4	-11	179.9	-66	164.9	-178.7	0	0	111.4	R486 L515 K516 W517	R486-E519 IonicContact CZ-OE1 3.29Å; R486-E519 VanDerWaalsContact CZ-OE1 3.29Å; R486-E519 IonicContact CZ-OE2 3.76Å; R486-E519 IonicContact NE-OE1 2.68Å; R486-E519 PolarHBondContact NE-OE1 3.19Å; R486-E519 IonicContact NE-OE2 3.83Å; R486-E519 IonicContact NH2-OE1 3.02Å; R486-E519 PolarHBondContact NH2-OE1 2.98Å; R486-E519 IonicContact NH2-OE2 2.89Å; R486-E519 PolarHBondContact NH2-OE2 3.38Å; L515-E519 WeakPolarHBondContact CA-OE2 3.45Å; L515-E519 HydrophobicContact CB-CB 4.15Å; L515-E519 HydrophobicContact CD1-CB 4.46Å; K516-E519 HydrophobicContact CB-CG 4.04Å; K516-E519 WeakPolarHBondContact CD-OE1 3.13Å; K516-E519 PolarHBondContact N-OE2 3.1Å; K516-E519 WeakPolarHBondContact O-CB 3.28Å; K516-E519 PolarHBondContact O-N 2.79Å; W517-E519 VanDerWaalsContact C-N 3.29Å; W517-E519 PolarHBondContact O-N 2.9Å
520	Y	89.2	Confident	89.8	Confident	21 Å²	21	59 Å²	59	8%	0.082	30%	0.295	C	S	.	.	S	Bend	trans	-73.9	145.5	172.8	-76.7	-86.9	0	0	0	111.4	L515 K516 W517 P524 F528 L581 P582 T583 P584 F586	L515-Y520 HydrophobicContact CB-CD2 4.21Å; L515-Y520 HydrophobicContact CB-CE2 3.54Å; L515-Y520 HydrophobicContact CD1-CE1 4.42Å; L515-Y520 HydrophobicContact CD1-CE2 4.46Å; K516-Y520 WeakPolarHBondContact O-CD2 3.39Å; W517-Y520 PolarHBondContact O-N 3.19Å; Y520-P524 HydrophobicContact CD1-CB 3.76Å; Y520-P524 HydrophobicContact CD1-CG 4.43Å; Y520-P524 HydrophobicContact CG-CB 4.35Å; Y520-F528 AromaticContact CD1-CE2 3.67Å; Y520-F528 HydrophobicContact CD1-CE2 3.67Å; Y520-F528 AromaticContact CD1-CZ 3.67Å; Y520-F528 HydrophobicContact CD1-CZ 3.67Å; Y520-F528 AromaticContact CE1-CE2 3.69Å; Y520-F528 HydrophobicContact CE1-CE2 3.69Å; Y520-F528 AromaticContact CE1-CZ 3.96Å; Y520-F528 HydrophobicContact CE1-CZ 3.96Å; Y520-F528 HydrophobicContact CG-CZ 4.33Å; Y520-L581 HydrophobicContact CE1-CB 4.4Å; Y520-P582 PolarHBondContact OH-O 2.68Å; Y520-T583 HydrophobicContact CE1-CG2 4.39Å; Y520-P584 HydrophobicContact CD2-CG 3.94Å; Y520-P584 HydrophobicContact CE2-CG 3.77Å; Y520-P584 VanDerWaalsContact CZ-CD 3.41Å; Y520-F586 HydrophobicContact CG-CZ 4.27Å
521	T	86.6	Confident	89.8	Confident	17 Å²	17	59.4 Å²	59.4	10%	0.104	30%	0.299	C	S	.	.			trans	-73.6	159	171.9	98.4	0	0	0	0	109.8	R245 D523 P524 F528	R245-T521 VanDerWaalsContact NH1-CB 3.29Å; R245-T521 VanDerWaalsContact NH2-CB 3.34Å; R245-T521 PolarHBondContact NH2-OG1 3.49Å; T521-D523 CarbonylContact O-C 3.08Å; T521-D523 PolarHBondContact O-N 3.14Å; T521-D523 PolarHBondContact OG1-O 3Å; T521-P524 WeakPolarHBondContact O-CD 3.33Å; T521-P524 WeakPolarHBondContact O-CG 3.47Å; T521-F528 HydrophobicContact CG2-CE1 4.07Å; T521-F528 HydrophobicContact CG2-CZ 4.29Å
522	P	84.4	Confident	89.8	Confident	140 Å²	140	57.6 Å²	57.6	91%	0.909	29%	0.291	S	S	*	.	S	Bend	trans	-53.9	-28.1	-177.2	-28.3	35.6	0	0	0	114.8	P524	P522-P524 WeakPolarHBondContact O-CD 3.4Å
523	D	87.1	Confident	89.9	Confident	83 Å²	83	56.4 Å²	56.4	44%	0.444	29%	0.287	S	S	.	.			trans	-111.4	95.7	165	-173.7	-2.6	0	0	0	110.2	T521 N525 H526	T521-D523 CarbonylContact O-C 3.08Å; T521-D523 PolarHBondContact O-N 3.14Å; T521-D523 PolarHBondContact OG1-O 3Å; D523-N525 VanDerWaalsContact C-N 3.3Å; D523-N525 PolarHBondContact O-N 3.14Å; D523-N525 PolarHBondContact OD1-N 3.14Å; D523-H526 HydrophobicContact CB-CB 4.3Å; D523-H526 PolarHBondContact OD1-N 3.22Å
524	P	85.8	Confident	90.2	Very high	18 Å²	18	56.3 Å²	56.3	12%	0.117	29%	0.286	C	S	.	.	S	Bend	trans	-67.9	-27.3	177.7	-22.3	34.8	0	0	0	113.5	Y520 T521 P522 H526 G527 T583 F586	Y520-P524 HydrophobicContact CD1-CB 3.76Å; Y520-P524 HydrophobicContact CD1-CG 4.43Å; Y520-P524 HydrophobicContact CG-CB 4.35Å; T521-P524 WeakPolarHBondContact O-CD 3.33Å; T521-P524 WeakPolarHBondContact O-CG 3.47Å; P522-P524 WeakPolarHBondContact O-CD 3.4Å; P524-H526 VanDerWaalsContact C-N 3.33Å; P524-G527 PolarHBondContact O-N 3.05Å; P524-T583 HydrophobicContact CB-CG2 3.81Å; P524-F586 HydrophobicContact CB-CE2 3.73Å; P524-F586 HydrophobicContact CB-CZ 3.95Å; P524-F586 HydrophobicContact CG-CD2 4.31Å; P524-F586 HydrophobicContact CG-CE1 4.28Å; P524-F586 HydrophobicContact CG-CE2 3.33Å; P524-F586 HydrophobicContact CG-CZ 3.29Å
525	N	87	Confident	90.5	Very high	126 Å²	126	49.6 Å²	49.6	67%	0.674	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-21.3	-174.2	-67.3	-38.8	0	0	0	112.4	D523 G527	D523-N525 VanDerWaalsContact C-N 3.3Å; D523-N525 PolarHBondContact O-N 3.14Å; D523-N525 PolarHBondContact OD1-N 3.14Å; N525-G527 PolarHBondContact O-N 2.68Å
526	H	89.6	Confident	90.7	Very high	74 Å²	74	48.9 Å²	48.9	34%	0.343	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-31.7	172.7	-175.6	79.9	0	0	0	112.9	D523 P524 Y529 L578	D523-H526 HydrophobicContact CB-CB 4.3Å; D523-H526 PolarHBondContact OD1-N 3.22Å; P524-H526 VanDerWaalsContact C-N 3.33Å; H526-Y529 AromaticContact CD2-CE2 3.7Å; H526-Y529 AromaticContact NE2-CE2 3.16Å; H526-Y529 WeakPolarHBondContact NE2-CE2 3.3Å; H526-Y529 AromaticContact NE2-CZ 3.36Å; H526-Y529 PolarHBondContact NE2-OH 3.43Å; H526-L578 WeakPolarHBondContact O-CD1 3.47Å
527	G	90.2	Very high	90.9	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.01	23%	0.225	C	C	.	.			trans	91.4	178	-175	0	0	0	0	0	113.8	P524 N525	P524-G527 PolarHBondContact O-N 3.05Å; N525-G527 PolarHBondContact O-N 2.68Å
528	F	92.1	Very high	91.4	Very high	17 Å²	17	39.6 Å²	39.6	8%	0.075	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	133.7	-174.2	-73.9	-105	0	0	0	110.9	Y456 L515 Y520 T521 V579 L581	Y456-F528 HydrophobicContact CE1-CD1 4.36Å; Y456-F528 HydrophobicContact CE2-CB 4.11Å; L515-F528 HydrophobicContact CD1-CE1 3.63Å; L515-F528 HydrophobicContact CD1-CE2 4.08Å; L515-F528 HydrophobicContact CD1-CZ 3.36Å; Y520-F528 AromaticContact CD1-CE2 3.67Å; Y520-F528 HydrophobicContact CD1-CE2 3.67Å; Y520-F528 AromaticContact CD1-CZ 3.67Å; Y520-F528 HydrophobicContact CD1-CZ 3.67Å; Y520-F528 AromaticContact CE1-CE2 3.69Å; Y520-F528 HydrophobicContact CE1-CE2 3.69Å; Y520-F528 AromaticContact CE1-CZ 3.96Å; Y520-F528 HydrophobicContact CE1-CZ 3.96Å; Y520-F528 HydrophobicContact CG-CZ 4.33Å; T521-F528 HydrophobicContact CG2-CE1 4.07Å; T521-F528 HydrophobicContact CG2-CZ 4.29Å; F528-V579 PolarHBondContact N-O 2.89Å; F528-V579 PolarHBondContact O-N 2.83Å; F528-L581 HydrophobicContact CB-CD1 4.32Å; F528-L581 HydrophobicContact CD1-CD1 4.02Å; F528-L581 HydrophobicContact CD2-CB 3.95Å; F528-L581 HydrophobicContact CD2-CD1 3.43Å; F528-L581 VanDerWaalsContact CD2-CD1 3.43Å; F528-L581 HydrophobicContact CD2-CG 3.65Å; F528-L581 HydrophobicContact CE1-CD1 4.16Å; F528-L581 HydrophobicContact CE2-CB 3.97Å; F528-L581 HydrophobicContact CE2-CD1 3.61Å; F528-L581 HydrophobicContact CE2-CG 4.06Å; F528-L581 HydrophobicContact CG-CD1 3.65Å; F528-L581 HydrophobicContact CG-CG 4.15Å; F528-L581 HydrophobicContact CZ-CD1 3.96Å
529	Y	93.1	Very high	91.6	Very high	72 Å²	72	35.2 Å²	35.2	28%	0.282	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	132.4	175.7	-72.3	-87.3	0	0	0	111.8	R245 Y456 H526 L577 L578	R245-Y529 HydrophobicContact CG-CD2 3.44Å; R245-Y529 VanDerWaalsContact CG-CD2 3.44Å; R245-Y529 HydrophobicContact CG-CE2 4.2Å; R245-Y529 HydrophobicContact CG-CG 4.03Å; Y456-Y529 PolarHBondContact OH-O 3.14Å; Y456-Y529 VanDerWaalsContact OH-O 3.09Å; H526-Y529 AromaticContact CD2-CE2 3.7Å; H526-Y529 AromaticContact NE2-CE2 3.16Å; H526-Y529 WeakPolarHBondContact NE2-CE2 3.3Å; H526-Y529 AromaticContact NE2-CZ 3.36Å; H526-Y529 PolarHBondContact NE2-OH 3.43Å; Y529-L577 CarbonylContact C-O 3.59Å; Y529-L577 VanDerWaalsContact CA-O 3.28Å; Y529-L577 WeakPolarHBondContact CA-O 3.42Å; Y529-L578 HydrophobicContact CD1-CD1 4.14Å; Y529-L578 HydrophobicContact CD2-CD1 4.09Å; Y529-L578 HydrophobicContact CE1-CD1 4.01Å; Y529-L578 HydrophobicContact CE2-CD1 4.02Å; Y529-L578 HydrophobicContact CG-CD1 4.2Å
530	V	94.9	Very high	91.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	133.6	166.7	-178.6	0	0	0	0	107.9	L457 P576 L577 V579	L457-V530 HydrophobicContact CD1-CG2 3.51Å; V530-P576 WeakPolarHBondContact O-CA 3.34Å; V530-L577 HydrophobicContact CB-CB 4.03Å; V530-L577 HydrophobicContact CG2-CB 4.42Å; V530-L577 PolarHBondContact N-O 2.91Å; V530-L577 PolarHBondContact O-N 3.13Å; V530-V579 HydrophobicContact CG2-CG2 3.98Å
531	G	93.9	Very high	91.5	Very high	7 Å²	7	33.3 Å²	33.3	7%	0.072	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-58.9	154.7	179.8	0	0	0	0	0	112.7	R420	R420-G531 PolarHBondContact NH1-O 2.9Å
532	S	95.4	Very high	91.3	Very high	10 Å²	10	37.3 Å²	37.3	7%	0.07	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-61.3	141.3	175.6	-64.3	0	0	0	0	111.8	P175 T574	P175-S532 VanDerWaalsContact CD-OG 3.28Å; P175-S532 WeakPolarHBondContact CD-OG 3.38Å; P175-S532 WeakPolarHBondContact CG-OG 3.42Å; S532-T574 WeakPolarHBondContact CB-O 3.33Å; S532-T574 PolarHBondContact OG-O 2.93Å
533	S	96	Very high	91.3	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-75.9	143	166.2	180	0	0	0	0	110.3	L449 L450 T574	L449-S533 WeakPolarHBondContact CD1-OG 3.43Å; L450-S533 WeakPolarHBondContact O-CA 3.43Å; L450-S533 PolarHBondContact O-OG 2.68Å; S533-T574 WeakPolarHBondContact CA-OG1 3.3Å; S533-T574 WeakPolarHBondContact CB-OG1 3.49Å; S533-T574 PolarHBondContact N-OG1 3.39Å; S533-T574 PolarHBondContact O-N 3.41Å; S533-T574 PolarHBondContact O-OG1 3.44Å
534	V	97.1	Very high	91.2	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.006	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	125.2	-177.2	-170.1	0	0	0	0	109.5	F224 L450 R571 Y573	F224-V534 HydrophobicContact CE2-CG1 4.42Å; F224-V534 HydrophobicContact CE2-CG2 4.4Å; F224-V534 HydrophobicContact CZ-CG1 4.37Å; F224-V534 HydrophobicContact CZ-CG2 4.44Å; L450-V534 HydrophobicContact CB-CB 4.17Å; L450-V534 HydrophobicContact CD2-CB 4.18Å; L450-V534 HydrophobicContact CD2-CG2 4Å; L450-V534 PolarHBondContact N-O 2.85Å; L450-V534 PolarHBondContact O-N 3.43Å; V534-R571 VanDerWaalsContact CG1-CD 3.49Å; V534-R571 HydrophobicContact CG1-CG 3.6Å; V534-Y573 HydrophobicContact CB-CD1 4.38Å; V534-Y573 HydrophobicContact CB-CE1 4.27Å; V534-Y573 HydrophobicContact CG1-CD1 4.31Å; V534-Y573 HydrophobicContact CG1-CE1 3.92Å; V534-Y573 HydrophobicContact CG2-CD1 3.78Å; V534-Y573 HydrophobicContact CG2-CE1 3.56Å
535	V	96.9	Very high	90.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	108.2	-179.5	-177.3	0	0	0	0	107.9	L416 A418 M436 V447 L449 R571 V572 T574	L416-V535 HydrophobicContact CD2-CG1 4.26Å; A418-V535 HydrophobicContact CB-CB 4.49Å; A418-V535 HydrophobicContact CB-CG2 3.84Å; M436-V535 HydrophobicContact CG-CG1 4.5Å; M436-V535 HydrophobicContact CG-CG2 4.48Å; M436-V535 HydrophobicContact SD-CG1 4.21Å; M436-V535 HydrophobicContact SD-CG2 4.47Å; V447-V535 HydrophobicContact CG1-CB 4.49Å; V447-V535 HydrophobicContact CG1-CG1 3.19Å; L449-V535 HydrophobicContact CD1-CG2 3.91Å; V535-R571 CarbonylContact O-C 3.54Å; V535-R571 WeakPolarHBondContact O-CA 3.31Å; V535-V572 HydrophobicContact CB-CB 4.37Å; V535-V572 PolarHBondContact N-O 2.89Å; V535-V572 PolarHBondContact O-N 3.2Å; V535-T574 HydrophobicContact CG2-CG2 4.46Å
536	S	95.6	Very high	90.3	Very high	6 Å²	6	29.4 Å²	29.4	4%	0.042	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	133.4	-179.5	-60.7	0	0	0	0	110.6	L448 I570 R571	L448-S536 PolarHBondContact N-O 3.36Å; L448-S536 PolarHBondContact O-N 3.18Å; S536-I570 WeakPolarHBondContact CA-O 3.4Å; S536-R571 PolarHBondContact OG-NE 2.62Å
537	A	94.5	Very high	89.5	Confident	4 Å²	4	28 Å²	28	3%	0.033	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	150.3	-176.2	0	0	0	0	0	112.4	L416 F445 V447 V539 F569 I570	L416-A537 HydrophobicContact CD2-CB 3.9Å; F445-A537 HydrophobicContact CD2-CB 4.22Å; F445-A537 HydrophobicContact CE2-CB 4.16Å; V447-A537 HydrophobicContact CG2-CB 3.76Å; A537-V539 HydrophobicContact CB-CG2 4.08Å; A537-F569 WeakPolarHBondContact O-CA 3.35Å; A537-I570 HydrophobicContact CB-CG2 4.01Å; A537-I570 PolarHBondContact N-O 3.36Å; A537-I570 PolarHBondContact O-N 3.49Å
538	L	92.9	Very high	88.6	Confident	91 Å²	91	33.1 Å²	33.1	48%	0.476	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	102.2	161.9	-68.5	175.3	0	0	0	107.3	Y568 F569	L538-Y568 CarbonylContact C-O 3.58Å; L538-Y568 WeakPolarHBondContact CA-O 3.41Å; L538-F569 HydrophobicContact CD2-CB 4.01Å; L538-F569 HydrophobicContact CD2-CD2 4.15Å
539	V	91.8	Very high	87.1	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	137	-175.7	180	0	0	0	0	109.1	L415 F445 A537 S541 S567 Y568 I570	L415-V539 HydrophobicContact CD1-CG1 4.15Å; F445-V539 HydrophobicContact CD2-CG2 4.38Å; F445-V539 HydrophobicContact CE1-CG1 4.46Å; F445-V539 HydrophobicContact CE2-CG2 4.01Å; F445-V539 HydrophobicContact CZ-CG2 4.2Å; A537-V539 HydrophobicContact CB-CG2 4.08Å; V539-S541 PolarHBondContact O-N 2.81Å; V539-S567 CarbonylContact O-C 3.59Å; V539-S567 VanDerWaalsContact O-CA 3.23Å; V539-S567 WeakPolarHBondContact O-CA 3.49Å; V539-Y568 HydrophobicContact CB-CD1 4.44Å; V539-Y568 HydrophobicContact CB-CE1 3.84Å; V539-Y568 HydrophobicContact CB-CE2 4.23Å; V539-Y568 HydrophobicContact CG1-CE1 3.87Å; V539-Y568 PolarHBondContact N-O 2.79Å; V539-Y568 WeakPolarHBondContact O-CD1 3.26Å; V539-Y568 PolarHBondContact O-N 2.59Å; V539-I570 HydrophobicContact CG2-CG2 3.51Å
540	P	89.9	Confident	85.5	Confident	16 Å²	16	36.6 Å²	36.6	10%	0.104	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	130.3	173.7	-24	34	0	0	0	111.4	R443 F445	R443-P540 HydrophobicContact CB-CG 4.16Å; F445-P540 HydrophobicContact CB-CG 4.42Å; F445-P540 HydrophobicContact CD1-CG 4.4Å
541	S	87.5	Confident	83.7	Confident	16 Å²	16	43 Å²	43	11%	0.112	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-84.4	143.7	177.5	-163.7	0	0	0	0	111.2	G376 V539 V543 M545 S566	G376-S541 WeakPolarHBondContact CA-OG 3.42Å; G376-S541 PolarHBondContact O-OG 2.88Å; V539-S541 PolarHBondContact O-N 2.81Å; S541-V543 VanDerWaalsContact CB-O 3.25Å; S541-V543 WeakPolarHBondContact CB-O 3.22Å; S541-V543 PolarHBondContact OG-O 3.38Å; S541-M545 WeakPolarHBondContact OG-CE 3.33Å; S541-S566 PolarHBondContact N-O 3.41Å
542	T	81.8	Confident	82.3	Confident	101 Å²	101	51.3 Å²	51.3	62%	0.62	28%	0.283	S	S	*	.	S	Bend	trans	-82.4	-28.3	172.3	64	0	0	0	0	111.3	G376 D377	G376-T542 PolarHBondContact O-N 2.76Å; G376-T542 PolarHBondContact O-OG1 3.38Å; D377-T542 PolarHBondContact OD1-OG1 3.47Å; D377-T542 VanDerWaalsContact OD1-OG1 3.1Å
543	V	84.8	Confident	81.6	Confident	51 Å²	51	53 Å²	53	31%	0.309	29%	0.29	S	S	.	.	S	Bend	trans	-117.9	146.3	178	-177	0	0	0	0	109.8	V373 G376 R378 S541 M545	V373-V543 HydrophobicContact CG2-CG1 4.12Å; G376-V543 PolarHBondContact O-N 3.36Å; R378-V543 HydrophobicContact CB-CG2 4.24Å; S541-V543 VanDerWaalsContact CB-O 3.25Å; S541-V543 WeakPolarHBondContact CB-O 3.22Å; S541-V543 PolarHBondContact OG-O 3.38Å; V543-M545 PolarHBondContact O-N 3.07Å
544	A	83.6	Confident	81.3	Confident	66 Å²	66	53.4 Å²	53.4	55%	0.545	29%	0.293	S	S	.	.			trans	-58	124.1	174.3	0	0	0	0	0	110.6	E565	A544-E565 CarbonylContact C-O 3.58Å; A544-E565 WeakPolarHBondContact CA-O 3.4Å; A544-E565 HydrophobicContact CB-CB 4.44Å
545	M	81.2	Confident	80.9	Confident	15 Å²	15	53.6 Å²	53.6	7%	0.074	29%	0.293	C	S	.	.			trans	-70.7	147	172.5	-69.9	-66.7	162.2	0	0	110.4	V373 S541 V543 T547 T562 E565 Y568	V373-M545 HydrophobicContact CG1-CE 3.74Å; V373-M545 HydrophobicContact CG1-SD 3.53Å; V373-M545 VanDerWaalsContact CG1-SD 3.53Å; S541-M545 WeakPolarHBondContact OG-CE 3.33Å; V543-M545 PolarHBondContact O-N 3.07Å; M545-T547 PolarHBondContact O-N 3.05Å; M545-T562 HydrophobicContact CB-CG2 3.6Å; M545-T562 HydrophobicContact CG-CG2 3.97Å; M545-E565 PolarHBondContact N-O 2.88Å; M545-Y568 HydrophobicContact CE-CD1 3.66Å; M545-Y568 HydrophobicContact CE-CG 3.79Å
546	N	72.8	Confident	80.6	Confident	69 Å²	69	53.9 Å²	53.9	37%	0.369	30%	0.295	S	S	.	.			trans	-82.4	114.4	168.5	-170	6	0	0	0	109.2	N548 Q553	N546-N548 VanDerWaalsContact C-N 3.32Å; N546-N548 PolarHBondContact ND2-O 3.14Å; N546-N548 VanDerWaalsContact ND2-O 3.09Å; N546-N548 PolarHBondContact OD1-N 3.14Å; N546-N548 PolarHBondContact OD1-O 2.94Å; N546-Q553 PolarHBondContact ND2-NE2 2.92Å
547	T	74.2	Confident	80.1	Confident	46 Å²	46	55 Å²	55	28%	0.282	30%	0.303	S	S	.	.			trans	-80	-17.5	175.3	53.6	0	0	0	0	112.5	M545 E565	M545-T547 PolarHBondContact O-N 3.05Å; T547-E565 HydrophobicContact CG2-CG 3.74Å
548	N	69.8	Low	79.6	Confident	108 Å²	108	55.4 Å²	55.4	58%	0.578	30%	0.304	S	S	*	.	S	Bend	trans	-91.4	108.4	179.2	-64	-10.9	0	0	0	108.9	N546 T550	N546-N548 VanDerWaalsContact C-N 3.32Å; N546-N548 PolarHBondContact ND2-O 3.14Å; N546-N548 VanDerWaalsContact ND2-O 3.09Å; N546-N548 PolarHBondContact OD1-N 3.14Å; N546-N548 PolarHBondContact OD1-O 2.94Å; N548-T550 PolarHBondContact O-N 3.47Å
549	I	60.6	Low	79.3	Confident	102 Å²	102	51.5 Å²	51.5	52%	0.523	28%	0.284	S	S	.	.			trans	-74.3	82	174.8	-55.9	172.7	0	0	0	107.7
550	T	60.2	Low	79	Confident	60 Å²	60	52.9 Å²	52.9	37%	0.368	29%	0.29	S	S	.	.			trans	-74.4	148.2	170.8	58.8	0	0	0	0	109.6	N548 E552 Q553	N548-T550 PolarHBondContact O-N 3.47Å; T550-E552 PolarHBondContact O-N 3.08Å; T550-Q553 PolarHBondContact O-N 3.2Å
551	K	58.2	Low	78.5	Confident	134 Å²	134	54.6 Å²	54.6	58%	0.583	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-15.6	178	-73.1	-169.3	175.2	-162.4	0	114.1	E95	E95-K551 IonicContact OE2-NZ 2.75Å; E95-K551 PolarHBondContact OE2-NZ 2.82Å
552	E	64.6	Low	78.2	Confident	182 Å²	182	55.6 Å²	55.6	85%	0.85	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-5.9	-174	-62	-173.6	167.7	0	0	114.6	T550	T550-E552 PolarHBondContact O-N 3.08Å
553	Q	79.8	Confident	78	Confident	45 Å²	45	59.8 Å²	59.8	21%	0.21	32%	0.316	C	S	.	.	S	Bend	trans	-75.6	145.6	178.6	-69	-172.5	-40.3	0	0	112.4	N546 T550 T558	N546-Q553 PolarHBondContact ND2-NE2 2.92Å; T550-Q553 PolarHBondContact O-N 3.2Å; Q553-T558 HydrophobicContact CB-CG2 3.57Å; Q553-T558 HydrophobicContact CG-CG2 4.36Å
554	P	88.8	Confident	77.8	Confident	9 Å²	9	62.2 Å²	62.2	6%	0.058	32%	0.324	C	S	.	.			trans	-63.6	142.9	174.8	25	-30	0	0	0	110.3	Y348 A372 F556 S557	Y348-P554 HydrophobicContact CE2-CB 4.49Å; A372-P554 HydrophobicContact CB-CG 3.64Å; P554-F556 HydrophobicContact CB-CD1 3.94Å; P554-F556 HydrophobicContact CB-CE1 3.42Å; P554-F556 VanDerWaalsContact CB-CE1 3.42Å; P554-F556 HydrophobicContact CB-CE2 4.06Å; P554-F556 HydrophobicContact CB-CG 4.46Å; P554-F556 HydrophobicContact CB-CZ 3.49Å; P554-F556 VanDerWaalsContact CB-CZ 3.49Å; P554-F556 HydrophobicContact CG-CE1 4.22Å; P554-F556 HydrophobicContact CG-CE2 4.02Å; P554-F556 HydrophobicContact CG-CZ 3.76Å; P554-F556 PolarHBondContact O-N 3.38Å; P554-S557 PolarHBondContact O-N 2.85Å; P554-S557 VanDerWaalsContact O-N 3.12Å; P554-S557 PolarHBondContact O-OG 3.01Å
555	L	90.3	Very high	77.9	Confident	5 Å²	5	64.6 Å²	64.6	3%	0.026	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-73.3	-31.2	-166.6	-49	158.7	0	0	0	113.1	Q97 E99 Q115 R117 R306 S557 T558	Q97-L555 HydrophobicContact CB-CD1 4.07Å; E99-L555 VanDerWaalsContact CD-N 3.26Å; E99-L555 HydrophobicContact CG-CB 4.29Å; E99-L555 HydrophobicContact CG-CD1 3.83Å; E99-L555 HydrophobicContact CG-CG 4.33Å; E99-L555 VanDerWaalsContact OE1-C 3.31Å; E99-L555 VanDerWaalsContact OE1-CA 3.24Å; E99-L555 WeakPolarHBondContact OE1-CA 3.42Å; E99-L555 WeakPolarHBondContact OE1-CB 3.5Å; E99-L555 PolarHBondContact OE1-N 3.37Å; E99-L555 WeakPolarHBondContact OE2-CB 3.29Å; E99-L555 WeakPolarHBondContact OE2-CG 3.28Å; E99-L555 PolarHBondContact OE2-N 3.31Å; Q115-L555 HydrophobicContact CB-CB 4.28Å; R117-L555 HydrophobicContact CB-CD1 4.15Å; R117-L555 HydrophobicContact CB-CD2 4.26Å; R306-L555 VanDerWaalsContact NH1-CD1 3.3Å; R306-L555 VanDerWaalsContact NH2-CD2 3.29Å; L555-S557 PolarHBondContact O-N 3.37Å; L555-S557 VanDerWaalsContact O-N 3.08Å; L555-T558 PolarHBondContact O-N 3.22Å; L555-T558 PolarHBondContact O-OG1 3.07Å
556	F	89.1	Confident	78.2	Confident	5 Å²	5	67.3 Å²	67.3	2%	0.022	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-61.9	-12.1	173.3	61	-105.5	0	0	0	113.2	E99 V101 Q115 Y170 Y348 V374 F381 P554	E99-F556 WeakPolarHBondContact OE1-CD1 3.37Å; E99-F556 PolarHBondContact OE1-N 2.94Å; V101-F556 HydrophobicContact CB-CD1 3.75Å; V101-F556 HydrophobicContact CB-CE1 3.83Å; V101-F556 HydrophobicContact CB-CG 4.38Å; V101-F556 HydrophobicContact CG1-CB 4.13Å; V101-F556 HydrophobicContact CG1-CD1 3.73Å; V101-F556 HydrophobicContact CG1-CE1 4.3Å; V101-F556 HydrophobicContact CG1-CG 3.96Å; V101-F556 HydrophobicContact CG2-CD1 4.31Å; V101-F556 HydrophobicContact CG2-CE1 4.06Å; V101-F556 HydrophobicContact CG2-CZ 4.28Å; Q115-F556 HydrophobicContact CG-CB 4.18Å; Y170-F556 HydrophobicContact CD1-CD2 4.08Å; Y170-F556 HydrophobicContact CD2-CB 4.24Å; Y170-F556 HydrophobicContact CE1-CD2 4.06Å; Y170-F556 HydrophobicContact CG-CB 4.07Å; Y170-F556 HydrophobicContact CG-CD2 4.43Å; Y348-F556 HydrophobicContact CD1-CE1 4.47Å; Y348-F556 AromaticContact CD2-CE1 3.74Å; Y348-F556 HydrophobicContact CD2-CE1 3.74Å; Y348-F556 HydrophobicContact CE2-CE1 4.23Å; Y348-F556 AromaticContact CG-CE1 3.87Å; Y348-F556 HydrophobicContact CG-CE1 3.87Å; Y348-F556 HydrophobicContact CG-CZ 4.41Å; V374-F556 HydrophobicContact CG2-CD2 4.35Å; V374-F556 HydrophobicContact CG2-CE2 3.83Å; F381-F556 HydrophobicContact CD1-CZ 4.47Å; F381-F556 HydrophobicContact CD2-CZ 4.35Å; F381-F556 HydrophobicContact CE1-CE2 4.33Å; F381-F556 HydrophobicContact CE1-CZ 4.08Å; F381-F556 HydrophobicContact CE2-CE2 4.05Å; F381-F556 AromaticContact CE2-CZ 3.95Å; F381-F556 HydrophobicContact CE2-CZ 3.95Å; F381-F556 AromaticContact CZ-CE2 3.75Å; F381-F556 HydrophobicContact CZ-CE2 3.75Å; F381-F556 AromaticContact CZ-CZ 3.81Å; F381-F556 HydrophobicContact CZ-CZ 3.81Å; P554-F556 HydrophobicContact CB-CD1 3.94Å; P554-F556 HydrophobicContact CB-CE1 3.42Å; P554-F556 VanDerWaalsContact CB-CE1 3.42Å; P554-F556 HydrophobicContact CB-CE2 4.06Å; P554-F556 HydrophobicContact CB-CG 4.46Å; P554-F556 HydrophobicContact CB-CZ 3.49Å; P554-F556 VanDerWaalsContact CB-CZ 3.49Å; P554-F556 HydrophobicContact CG-CE1 4.22Å; P554-F556 HydrophobicContact CG-CE2 4.02Å; P554-F556 HydrophobicContact CG-CZ 3.76Å; P554-F556 PolarHBondContact O-N 3.38Å
557	S	85.9	Confident	79	Confident	31 Å²	31	64.7 Å²	64.7	22%	0.217	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-101.3	-12.9	178.9	72.3	0	0	0	0	114.7	P554 L555	P554-S557 PolarHBondContact O-N 2.85Å; P554-S557 VanDerWaalsContact O-N 3.12Å; P554-S557 PolarHBondContact O-OG 3.01Å; L555-S557 PolarHBondContact O-N 3.37Å; L555-S557 VanDerWaalsContact O-N 3.08Å
558	T	84.4	Confident	79.8	Confident	11 Å²	11	63.1 Å²	63.1	7%	0.067	32%	0.321	C	S	.	.	S	Bend	trans	-119.6	15.8	-164.3	51.2	0	0	0	0	115	Q553 L555	Q553-T558 HydrophobicContact CB-CG2 3.57Å; Q553-T558 HydrophobicContact CG-CG2 4.36Å; L555-T558 PolarHBondContact O-N 3.22Å; L555-T558 PolarHBondContact O-OG1 3.07Å
559	F	86.1	Confident	80.9	Confident	10 Å²	10	60.1 Å²	60.1	4%	0.044	30%	0.302	C	S	.	.	S	Bend	trans	-74.7	-41.1	-179.2	-170.3	-103.5	0	0	0	113.2	H153 L171 L227 H288 R290 R306	H153-F559 AromaticContact CE1-CZ 4Å; H153-F559 AromaticContact ND1-CZ 3.93Å; L171-F559 HydrophobicContact CD2-CB 3.55Å; L171-F559 HydrophobicContact CD2-CD1 3.31Å; L171-F559 HydrophobicContact CD2-CD2 4.39Å; L171-F559 HydrophobicContact CD2-CE1 4.08Å; L171-F559 HydrophobicContact CD2-CG 3.49Å; L171-F559 VanDerWaalsContact CD2-CG 3.49Å; L227-F559 HydrophobicContact CD1-CD1 4.24Å; L227-F559 HydrophobicContact CD1-CE1 3.45Å; L227-F559 VanDerWaalsContact CD1-CE1 3.45Å; L227-F559 HydrophobicContact CD1-CZ 3.83Å; H288-F559 HydrophobicContact CB-CE2 3.67Å; H288-F559 HydrophobicContact CB-CZ 3.64Å; H288-F559 AromaticContact CD2-CE2 3.67Å; H288-F559 AromaticContact CD2-CZ 3.46Å; H288-F559 VanDerWaalsContact CD2-CZ 3.46Å; H288-F559 WeakPolarHBondContact CD2-CZ 3.34Å; H288-F559 AromaticContact CG-CE2 3.79Å; H288-F559 AromaticContact CG-CZ 3.42Å; H288-F559 VanDerWaalsContact CG-CZ 3.42Å; H288-F559 AromaticContact ND1-CZ 4Å; R290-F559 PolarHBondContact NH1-O 2.74Å; R306-F559 HydrophobicContact CB-CE2 4.28Å; R306-F559 HydrophobicContact CG-CD2 3.96Å; R306-F559 HydrophobicContact CG-CE2 3.9Å
560	F	85.9	Confident	82.4	Confident	28 Å²	28	55.6 Å²	55.6	12%	0.123	28%	0.279	C	S	.	.	S	Bend	trans	-90.2	132.5	176.9	-66	-74.1	0	0	0	110.7	L171 P172 L227 T562 F569	L171-F560 HydrophobicContact CD2-CE2 4.12Å; P172-F560 HydrophobicContact CG-CZ 4.37Å; L227-F560 HydrophobicContact CD1-CD1 4.45Å; L227-F560 HydrophobicContact CD1-CE1 4.25Å; L227-F560 HydrophobicContact CD2-CD1 3.7Å; L227-F560 HydrophobicContact CD2-CE1 4.11Å; F560-T562 PolarHBondContact O-N 3.19Å; F560-F569 HydrophobicContact CB-CB 4.24Å; F560-F569 HydrophobicContact CB-CD1 4.01Å; F560-F569 AromaticContact CD1-CD1 3.36Å; F560-F569 HydrophobicContact CD1-CD1 3.36Å; F560-F569 AromaticContact CD1-CE1 3.57Å; F560-F569 HydrophobicContact CD1-CE1 3.57Å; F560-F569 HydrophobicContact CD1-CG 4.45Å; F560-F569 HydrophobicContact CD2-CD1 4.18Å; F560-F569 AromaticContact CE1-CD1 3.81Å; F560-F569 HydrophobicContact CE1-CD1 3.81Å; F560-F569 AromaticContact CE1-CE1 3.55Å; F560-F569 HydrophobicContact CE1-CE1 3.55Å; F560-F569 AromaticContact CG-CD1 3.58Å; F560-F569 HydrophobicContact CG-CD1 3.58Å; F560-F569 HydrophobicContact CG-CE1 4.21Å; F560-F569 HydrophobicContact CZ-CD1 4.38Å; F560-F569 HydrophobicContact CZ-CE1 4.16Å
561	P	79.9	Confident	84	Confident	53 Å²	53	53.2 Å²	53.2	34%	0.344	26%	0.263	S	S	.	.			trans	-67	126.6	-179.6	26.9	-32.9	0	0	0	110.1	L227	L227-P561 HydrophobicContact CD2-CG 4.47Å
562	T	80.3	Confident	85.7	Confident	37 Å²	37	47 Å²	47	23%	0.227	24%	0.237	C	C	.	.			trans	-102.8	113.7	178.5	-55.8	0	0	0	0	109.4	M545 F560 E564	M545-T562 HydrophobicContact CB-CG2 3.6Å; M545-T562 HydrophobicContact CG-CG2 3.97Å; F560-T562 PolarHBondContact O-N 3.19Å; T562-E564 WeakPolarHBondContact CG2-O 3.35Å
563	K	78	Confident	87.2	Confident	189 Å²	189	39.6 Å²	39.6	82%	0.822	20%	0.201	S	C	*	.			trans	-97.2	-24.3	-176.9	-63.9	-173.5	179.5	-173.9	0	113.5
564	E	81.3	Confident	88	Confident	102 Å²	102	37.6 Å²	37.6	48%	0.477	19%	0.192	S	C	.	.			trans	-124.3	140.7	-175.8	-66.8	177.9	-177.4	0	0	109.4	T562 S566 S567	T562-E564 WeakPolarHBondContact CG2-O 3.35Å; E564-S566 VanDerWaalsContact C-N 3.25Å; E564-S566 PolarHBondContact O-N 3.01Å; E564-S567 VanDerWaalsContact O-O 3.1Å; E564-S567 PolarHBondContact OE2-OG 3.45Å
565	E	84.1	Confident	88.2	Confident	116 Å²	116	39.5 Å²	39.5	54%	0.542	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-25.9	176.2	-62.4	-176.3	174	0	0	112.1	A544 M545 T547	A544-E565 CarbonylContact C-O 3.58Å; A544-E565 WeakPolarHBondContact CA-O 3.4Å; A544-E565 HydrophobicContact CB-CB 4.44Å; M545-E565 PolarHBondContact N-O 2.88Å; T547-E565 HydrophobicContact CG2-CG 3.74Å
566	S	88.1	Confident	88.3	Confident	72 Å²	72	40.8 Å²	40.8	50%	0.503	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-5.1	-170.9	75.9	0	0	0	0	114.9	S541 E564	S541-S566 PolarHBondContact N-O 3.41Å; E564-S566 VanDerWaalsContact C-N 3.25Å; E564-S566 PolarHBondContact O-N 3.01Å
567	S	90.3	Very high	88.6	Confident	14 Å²	14	40.9 Å²	40.9	10%	0.098	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	155.4	-175.3	69.5	0	0	0	0	111.3	V539 E564	V539-S567 CarbonylContact O-C 3.59Å; V539-S567 VanDerWaalsContact O-CA 3.23Å; V539-S567 WeakPolarHBondContact O-CA 3.49Å; E564-S567 VanDerWaalsContact O-O 3.1Å; E564-S567 PolarHBondContact OE2-OG 3.45Å
568	Y	91	Very high	88.9	Confident	13 Å²	13	43.2 Å²	43.2	5%	0.051	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	149.4	174.5	66.4	-82.5	0	0	0	110.7	L375 G376 L415 L538 V539 M545 I570	L375-Y568 VanDerWaalsContact C-CE2 3.47Å; L375-Y568 VanDerWaalsContact C-CZ 3.4Å; L375-Y568 HydrophobicContact CB-CD2 4.31Å; L375-Y568 HydrophobicContact CB-CE2 3.89Å; L375-Y568 HydrophobicContact CD2-CD2 4.14Å; L375-Y568 HydrophobicContact CD2-CE2 4.15Å; L375-Y568 WeakPolarHBondContact O-CE1 3.36Å; L375-Y568 WeakPolarHBondContact O-CE2 3.32Å; L375-Y568 PolarHBondContact O-OH 3.3Å; L375-Y568 VanDerWaalsContact O-OH 3.06Å; G376-Y568 VanDerWaalsContact CA-CE1 3.45Å; L415-Y568 WeakPolarHBondContact CD1-OH 3.26Å; L538-Y568 CarbonylContact C-O 3.58Å; L538-Y568 WeakPolarHBondContact CA-O 3.41Å; V539-Y568 HydrophobicContact CB-CD1 4.44Å; V539-Y568 HydrophobicContact CB-CE1 3.84Å; V539-Y568 HydrophobicContact CB-CE2 4.23Å; V539-Y568 HydrophobicContact CG1-CE1 3.87Å; V539-Y568 PolarHBondContact N-O 2.79Å; V539-Y568 WeakPolarHBondContact O-CD1 3.26Å; V539-Y568 PolarHBondContact O-N 2.59Å; M545-Y568 HydrophobicContact CE-CD1 3.66Å; M545-Y568 HydrophobicContact CE-CG 3.79Å; Y568-I570 HydrophobicContact CE2-CB 4.28Å; Y568-I570 HydrophobicContact CE2-CD1 4.35Å
569	F	91.9	Very high	89.3	Confident	44 Å²	44	42.8 Å²	42.8	19%	0.193	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	135.5	177.9	-178.3	-95	0	0	0	110.7	A537 L538 F560 R571	A537-F569 WeakPolarHBondContact O-CA 3.35Å; L538-F569 HydrophobicContact CD2-CB 4.01Å; L538-F569 HydrophobicContact CD2-CD2 4.15Å; F560-F569 HydrophobicContact CB-CB 4.24Å; F560-F569 HydrophobicContact CB-CD1 4.01Å; F560-F569 AromaticContact CD1-CD1 3.36Å; F560-F569 HydrophobicContact CD1-CD1 3.36Å; F560-F569 AromaticContact CD1-CE1 3.57Å; F560-F569 HydrophobicContact CD1-CE1 3.57Å; F560-F569 HydrophobicContact CD1-CG 4.45Å; F560-F569 HydrophobicContact CD2-CD1 4.18Å; F560-F569 AromaticContact CE1-CD1 3.81Å; F560-F569 HydrophobicContact CE1-CD1 3.81Å; F560-F569 AromaticContact CE1-CE1 3.55Å; F560-F569 HydrophobicContact CE1-CE1 3.55Å; F560-F569 AromaticContact CG-CD1 3.58Å; F560-F569 HydrophobicContact CG-CD1 3.58Å; F560-F569 HydrophobicContact CG-CE1 4.21Å; F560-F569 HydrophobicContact CZ-CD1 4.38Å; F560-F569 HydrophobicContact CZ-CE1 4.16Å; F569-R571 HydrophobicContact CE1-CB 3.95Å; F569-R571 HydrophobicContact CZ-CB 4.26Å
570	I	92	Very high	89.5	Confident	7 Å²	7	46.6 Å²	46.6	4%	0.036	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	145.3	170.8	-161.2	167.9	0	0	0	110.1	Q168 L416 S536 A537 V539 Y568 V572	Q168-I570 HydrophobicContact CB-CD1 4.12Å; Q168-I570 HydrophobicContact CG-CD1 3.54Å; Q168-I570 VanDerWaalsContact OE1-CD1 3.26Å; L416-I570 HydrophobicContact CD2-CG2 3.79Å; S536-I570 WeakPolarHBondContact CA-O 3.4Å; A537-I570 HydrophobicContact CB-CG2 4.01Å; A537-I570 PolarHBondContact N-O 3.36Å; A537-I570 PolarHBondContact O-N 3.49Å; V539-I570 HydrophobicContact CG2-CG2 3.51Å; Y568-I570 HydrophobicContact CE2-CB 4.28Å; Y568-I570 HydrophobicContact CE2-CD1 4.35Å; I570-V572 HydrophobicContact CG1-CG2 4.48Å
571	R	94.1	Very high	89.7	Confident	10 Å²	10	45.5 Å²	45.5	4%	0.038	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.8	170.7	-178.9	176.1	-69.7	165.2	-4.5	109.3	P172 S223 V534 V535 S536 F569 Y573	P172-R571 WeakPolarHBondContact CB-O 3.22Å; P172-R571 HydrophobicContact CG-CB 3.94Å; P172-R571 HydrophobicContact CG-CG 4.46Å; P172-R571 WeakPolarHBondContact CG-O 3.46Å; S223-R571 PolarHBondContact O-NH2 3.11Å; V534-R571 VanDerWaalsContact CG1-CD 3.49Å; V534-R571 HydrophobicContact CG1-CG 3.6Å; V535-R571 CarbonylContact O-C 3.54Å; V535-R571 WeakPolarHBondContact O-CA 3.31Å; S536-R571 PolarHBondContact OG-NE 2.62Å; F569-R571 HydrophobicContact CE1-CB 3.95Å; F569-R571 HydrophobicContact CZ-CB 4.26Å; R571-Y573 VanDerWaalsContact CD-OH 3.26Å; R571-Y573 WeakPolarHBondContact CD-OH 3.1Å; R571-Y573 HydrophobicContact CG-CE2 3.95Å
572	V	94.6	Very high	90.1	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.024	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	138	177.1	-179.2	0	0	0	0	107.8	L416 A418 V535 I570	L416-V572 HydrophobicContact CD2-CG2 4.09Å; L416-V572 HydrophobicContact CG-CG2 4.3Å; A418-V572 HydrophobicContact CB-CG1 4.27Å; V535-V572 HydrophobicContact CB-CB 4.37Å; V535-V572 PolarHBondContact N-O 2.89Å; V535-V572 PolarHBondContact O-N 3.2Å; I570-V572 HydrophobicContact CG1-CG2 4.48Å
573	Y	95.8	Very high	90.3	Very high	27 Å²	27	45.3 Å²	45.3	11%	0.106	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	133.6	172.7	-64	-89.2	0	0	0	108.4	P172 P174 E178 V534 R571	P172-Y573 HydrophobicContact CB-CD2 3.89Å; P172-Y573 HydrophobicContact CB-CE2 3.81Å; P172-Y573 HydrophobicContact CG-CE2 4.14Å; P174-Y573 HydrophobicContact CB-CD1 3.56Å; P174-Y573 HydrophobicContact CB-CE1 3.97Å; P174-Y573 HydrophobicContact CB-CG 3.85Å; P174-Y573 HydrophobicContact CG-CD1 3.97Å; P174-Y573 HydrophobicContact CG-CE1 3.83Å; P174-Y573 HydrophobicContact CG-CG 4.45Å; E178-Y573 WeakPolarHBondContact OE1-CE1 3.47Å; E178-Y573 PolarHBondContact OE1-OH 3.41Å; E178-Y573 PolarHBondContact OE2-OH 3.35Å; V534-Y573 HydrophobicContact CB-CD1 4.38Å; V534-Y573 HydrophobicContact CB-CE1 4.27Å; V534-Y573 HydrophobicContact CG1-CD1 4.31Å; V534-Y573 HydrophobicContact CG1-CE1 3.92Å; V534-Y573 HydrophobicContact CG2-CD1 3.78Å; V534-Y573 HydrophobicContact CG2-CE1 3.56Å; R571-Y573 VanDerWaalsContact CD-OH 3.26Å; R571-Y573 WeakPolarHBondContact CD-OH 3.1Å; R571-Y573 HydrophobicContact CG-CE2 3.95Å
574	T	95.3	Very high	90.5	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.018	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-76.4	173.4	174.2	50.9	0	0	0	0	111.3	A418 R420 T434 S532 S533 V535	A418-T574 HydrophobicContact CB-CG2 3.67Å; R420-T574 HydrophobicContact CB-CG2 4.15Å; T434-T574 HydrophobicContact CG2-CG2 4.41Å; S532-T574 WeakPolarHBondContact CB-O 3.33Å; S532-T574 PolarHBondContact OG-O 2.93Å; S533-T574 WeakPolarHBondContact CA-OG1 3.3Å; S533-T574 WeakPolarHBondContact CB-OG1 3.49Å; S533-T574 PolarHBondContact N-OG1 3.39Å; S533-T574 PolarHBondContact O-N 3.41Å; S533-T574 PolarHBondContact O-OG1 3.44Å; V535-T574 HydrophobicContact CG2-CG2 4.46Å
575	E	92.9	Very high	90.6	Very high	49 Å²	49	39 Å²	39	23%	0.229	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-64	146.9	171.1	-57.1	83.8	179.3	0	0	111.5	Y160 E419 R420	Y160-E575 HydrophobicContact CD2-CG 4.23Å; Y160-E575 HydrophobicContact CE2-CG 4.47Å; E419-E575 VanDerWaalsContact CA-OE2 3.27Å; E419-E575 WeakPolarHBondContact CA-OE2 3.48Å; R420-E575 PolarHBondContact N-OE2 3.48Å
576	P	93.9	Very high	90.4	Very high	32 Å²	32	37.4 Å²	37.4	21%	0.208	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-74.2	141.7	171.7	33.3	-26.6	0	0	0	108.2	P175 V530	P175-P576 HydrophobicContact CB-CG 4.19Å; P175-P576 HydrophobicContact CG-CB 3.99Å; P175-P576 HydrophobicContact CG-CG 3.58Å; V530-P576 WeakPolarHBondContact O-CA 3.34Å
577	L	94.5	Very high	90.1	Very high	6 Å²	6	36.6 Å²	36.6	3%	0.031	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	142.5	-179.8	-50.3	171.1	0	0	0	110.3	R420 V422 I432 Y529 V530 V579	R420-L577 HydrophobicContact CB-CD2 4.04Å; R420-L577 HydrophobicContact CG-CD1 4.17Å; R420-L577 HydrophobicContact CG-CD2 3.7Å; R420-L577 HydrophobicContact CG-CG 4.22Å; R420-L577 VanDerWaalsContact NE-CD1 3.29Å; V422-L577 HydrophobicContact CG2-CB 3.84Å; V422-L577 HydrophobicContact CG2-CD1 3.63Å; V422-L577 HydrophobicContact CG2-CD2 3.99Å; V422-L577 HydrophobicContact CG2-CG 4.03Å; I432-L577 HydrophobicContact CD1-CD1 4.4Å; I432-L577 HydrophobicContact CG1-CD1 4.22Å; I432-L577 HydrophobicContact CG2-CD1 4.02Å; Y529-L577 CarbonylContact C-O 3.59Å; Y529-L577 VanDerWaalsContact CA-O 3.28Å; Y529-L577 WeakPolarHBondContact CA-O 3.42Å; V530-L577 HydrophobicContact CB-CB 4.03Å; V530-L577 HydrophobicContact CG2-CB 4.42Å; V530-L577 PolarHBondContact N-O 2.91Å; V530-L577 PolarHBondContact O-N 3.13Å; L577-V579 HydrophobicContact CB-CG2 4.39Å
578	L	93	Very high	89.9	Confident	81 Å²	81	42.5 Å²	42.5	42%	0.424	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	115.7	169.5	-171.4	64.2	0	0	0	108.7	H526 Y529	H526-L578 WeakPolarHBondContact O-CD1 3.47Å; Y529-L578 HydrophobicContact CD1-CD1 4.14Å; Y529-L578 HydrophobicContact CD2-CD1 4.09Å; Y529-L578 HydrophobicContact CE1-CD1 4.01Å; Y529-L578 HydrophobicContact CE2-CD1 4.02Å; Y529-L578 HydrophobicContact CG-CD1 4.2Å
579	V	92.3	Very high	89.5	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	123.6	-175.9	-174.3	0	0	0	0	110.1	V422 L457 F510 F528 V530 L577	V422-V579 HydrophobicContact CG2-CG2 4.01Å; L457-V579 HydrophobicContact CD1-CG2 4.12Å; L457-V579 HydrophobicContact CD2-CG1 3.92Å; F510-V579 HydrophobicContact CE2-CG1 4.23Å; F510-V579 HydrophobicContact CZ-CG1 4.31Å; F528-V579 PolarHBondContact N-O 2.89Å; F528-V579 PolarHBondContact O-N 2.83Å; V530-V579 HydrophobicContact CG2-CG2 3.98Å; L577-V579 HydrophobicContact CB-CG2 4.39Å
580	N	89.8	Confident	89.1	Confident	89 Å²	89	49.4 Å²	49.4	48%	0.476	26%	0.257	S	S	.	.			trans	-77.5	127	171.8	-66.3	-12.9	0	0	0	109.5	L427 R512	L427-N580 HydrophobicContact CD2-CB 4.44Å; R512-N580 WeakPolarHBondContact CD-O 3.36Å; R512-N580 PolarHBondContact NE-O 3.02Å
581	L	89.8	Confident	89	Confident	5 Å²	5	53.7 Å²	53.7	3%	0.026	28%	0.28	C	S	.	.			trans	-100.5	156.4	171.9	-67.4	-176.6	0	0	0	109.7	Y456 L457 R512 L515 Y520 F528 T583	Y456-L581 HydrophobicContact CD2-CD1 3.8Å; Y456-L581 HydrophobicContact CD2-CD2 4.29Å; Y456-L581 HydrophobicContact CE2-CD1 4.29Å; Y456-L581 HydrophobicContact CG-CD1 4.17Å; L457-L581 HydrophobicContact CD2-CD2 4.05Å; R512-L581 HydrophobicContact CB-CD2 3.83Å; R512-L581 HydrophobicContact CG-CD2 3.93Å; L515-L581 HydrophobicContact CD1-CD1 3.37Å; L515-L581 HydrophobicContact CG-CD1 3.95Å; Y520-L581 HydrophobicContact CE1-CB 4.4Å; F528-L581 HydrophobicContact CB-CD1 4.32Å; F528-L581 HydrophobicContact CD1-CD1 4.02Å; F528-L581 HydrophobicContact CD2-CB 3.95Å; F528-L581 HydrophobicContact CD2-CD1 3.43Å; F528-L581 VanDerWaalsContact CD2-CD1 3.43Å; F528-L581 HydrophobicContact CD2-CG 3.65Å; F528-L581 HydrophobicContact CE1-CD1 4.16Å; F528-L581 HydrophobicContact CE2-CB 3.97Å; F528-L581 HydrophobicContact CE2-CD1 3.61Å; F528-L581 HydrophobicContact CE2-CG 4.06Å; F528-L581 HydrophobicContact CG-CD1 3.65Å; F528-L581 HydrophobicContact CG-CG 4.15Å; F528-L581 HydrophobicContact CZ-CD1 3.96Å; L581-T583 PolarHBondContact O-N 2.98Å
582	P	88.4	Confident	88.9	Confident	27 Å²	27	57 Å²	57	18%	0.175	30%	0.301	C	S	.	.			trans	-64.2	94	179.3	26	-35.9	0	0	0	111.8	L427 L514 Y520	L427-P582 HydrophobicContact CB-CB 4.44Å; L514-P582 HydrophobicContact CD2-CB 4.25Å; L514-P582 HydrophobicContact CD2-CG 3.72Å; Y520-P582 PolarHBondContact OH-O 2.68Å
583	T	86.2	Confident	88.7	Confident	60 Å²	60	61.5 Å²	61.5	37%	0.368	33%	0.325	S	S	.	.			trans	-62.1	128.8	-178.2	52.6	0	0	0	0	111.3	Y520 P524 L581	Y520-T583 HydrophobicContact CE1-CG2 4.39Å; P524-T583 HydrophobicContact CB-CG2 3.81Å; L581-T583 PolarHBondContact O-N 2.98Å
584	P	82.3	Confident	88.5	Confident	45 Å²	45	62.5 Å²	62.5	29%	0.292	34%	0.335	S	S	.	.			trans	-70.5	160.1	176.5	31.3	-35.9	0	0	0	110.6	Y520 F586	Y520-P584 HydrophobicContact CD2-CG 3.94Å; Y520-P584 HydrophobicContact CE2-CG 3.77Å; Y520-P584 VanDerWaalsContact CZ-CD 3.41Å; P584-F586 HydrophobicContact CG-CE1 4.08Å; P584-F586 HydrophobicContact CG-CE2 3.87Å; P584-F586 HydrophobicContact CG-CZ 3.6Å; P584-F586 WeakPolarHBondContact O-CD2 3.45Å; P584-F586 WeakPolarHBondContact O-CE2 3.19Å; P584-F586 PolarHBondContact O-N 3.25Å; P584-F586 VanDerWaalsContact O-N 3.14Å
585	D	82.6	Confident	88.5	Confident	112 Å²	112	67.9 Å²	67.9	60%	0.599	36%	0.363	S	S	*	.			trans	-72.5	104	171.7	-175.7	-0.2	0	0	0	110.3	S587 P589	D585-S587 PolarHBondContact O-N 3.29Å; D585-S587 WeakPolarHBondContact OD1-CB 3.47Å; D585-S587 PolarHBondContact OD1-N 3.42Å; D585-S587 PolarHBondContact OD1-OG 2.85Å; D585-S587 PolarHBondContact OD2-OG 3.21Å; D585-S587 VanDerWaalsContact OD2-OG 3.11Å; D585-P589 WeakPolarHBondContact O-CD 3.47Å
586	F	78.9	Confident	88.7	Confident	84 Å²	84	68.7 Å²	68.7	37%	0.368	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-9.5	178.2	-68.1	-78.9	0	0	0	113.6	Y520 P524 P584 M588 P589 Y590	Y520-F586 HydrophobicContact CG-CZ 4.27Å; P524-F586 HydrophobicContact CB-CE2 3.73Å; P524-F586 HydrophobicContact CB-CZ 3.95Å; P524-F586 HydrophobicContact CG-CD2 4.31Å; P524-F586 HydrophobicContact CG-CE1 4.28Å; P524-F586 HydrophobicContact CG-CE2 3.33Å; P524-F586 HydrophobicContact CG-CZ 3.29Å; P584-F586 HydrophobicContact CG-CE1 4.08Å; P584-F586 HydrophobicContact CG-CE2 3.87Å; P584-F586 HydrophobicContact CG-CZ 3.6Å; P584-F586 WeakPolarHBondContact O-CD2 3.45Å; P584-F586 WeakPolarHBondContact O-CE2 3.19Å; P584-F586 PolarHBondContact O-N 3.25Å; P584-F586 VanDerWaalsContact O-N 3.14Å; F586-M588 VanDerWaalsContact C-N 3.34Å; F586-P589 WeakPolarHBondContact O-CD 3.38Å; F586-Y590 WeakPolarHBondContact O-CB 3.29Å; F586-Y590 PolarHBondContact O-N 2.91Å
587	S	83.4	Confident	88.7	Confident	55 Å²	55	70.7 Å²	70.7	39%	0.385	39%	0.385	S	S	.	.	H	α-helix	trans	-69.2	-33.5	178.9	74.6	0	0	0	0	112.2	D585 Y590 N591	D585-S587 PolarHBondContact O-N 3.29Å; D585-S587 WeakPolarHBondContact OD1-CB 3.47Å; D585-S587 PolarHBondContact OD1-N 3.42Å; D585-S587 PolarHBondContact OD1-OG 2.85Å; D585-S587 PolarHBondContact OD2-OG 3.21Å; D585-S587 VanDerWaalsContact OD2-OG 3.11Å; S587-Y590 PolarHBondContact O-N 3.12Å; S587-N591 WeakPolarHBondContact O-CB 3.43Å; S587-N591 PolarHBondContact O-N 3.37Å; S587-N591 PolarHBondContact O-ND2 3.38Å
588	M	85	Confident	88.8	Confident	137 Å²	137	74.4 Å²	74.4	68%	0.675	41%	0.408	S	S	*	.	H	α-helix	trans	-66.1	-51.8	-178.5	177.9	-170.8	179.3	0	0	112.2	F586 Y590 N591 V592	F586-M588 VanDerWaalsContact C-N 3.34Å; M588-Y590 VanDerWaalsContact C-N 3.31Å; M588-Y590 PolarHBondContact O-N 3.35Å; M588-N591 PolarHBondContact O-N 3.28Å; M588-V592 WeakPolarHBondContact O-CG2 3.36Å; M588-V592 PolarHBondContact O-N 3.49Å; M588-V592 VanDerWaalsContact O-N 3.11Å
589	P	82.6	Confident	89	Confident	47 Å²	47	75 Å²	75	31%	0.305	42%	0.415	S	S	.	.	H	α-helix	trans	-58.5	-41.5	173.4	-23.8	32.8	0	0	0	112.9	D585 F586 N591 V592 I593	D585-P589 WeakPolarHBondContact O-CD 3.47Å; F586-P589 WeakPolarHBondContact O-CD 3.38Å; P589-N591 PolarHBondContact O-N 3.11Å; P589-V592 PolarHBondContact O-N 3.35Å; P589-I593 VanDerWaalsContact O-CG1 3.29Å; P589-I593 WeakPolarHBondContact O-CG1 3.45Å; P589-I593 PolarHBondContact O-N 3.29Å
590	Y	84.8	Confident	89.2	Confident	155 Å²	155	79.6 Å²	79.6	61%	0.608	44%	0.443	S	S	*	.	H	α-helix	trans	-59.2	-48.6	178.1	178.5	-96.2	0	0	0	111.5	F586 S587 M588 V592 I593 C594	F586-Y590 WeakPolarHBondContact O-CB 3.29Å; F586-Y590 PolarHBondContact O-N 2.91Å; S587-Y590 PolarHBondContact O-N 3.12Å; M588-Y590 VanDerWaalsContact C-N 3.31Å; M588-Y590 PolarHBondContact O-N 3.35Å; Y590-V592 VanDerWaalsContact C-N 3.3Å; Y590-V592 PolarHBondContact O-N 3.47Å; Y590-I593 PolarHBondContact O-N 3.3Å; Y590-C594 VanDerWaalsContact CE1-SG 3.53Å; Y590-C594 WeakPolarHBondContact O-CB 3.38Å; Y590-C594 PolarHBondContact O-N 3Å; Y590-C594 PolarHBondContact O-SG 3.39Å; Y590-C594 VanDerWaalsContact O-SG 3.38Å
591	N	89.8	Confident	89.5	Confident	97 Å²	97	78.3 Å²	78.3	52%	0.519	45%	0.445	S	S	.	.	H	α-helix	trans	-60.8	-39.8	178.7	-70.4	-20.5	0	0	0	112	S587 M588 P589 L595	S587-N591 WeakPolarHBondContact O-CB 3.43Å; S587-N591 PolarHBondContact O-N 3.37Å; S587-N591 PolarHBondContact O-ND2 3.38Å; M588-N591 PolarHBondContact O-N 3.28Å; P589-N591 PolarHBondContact O-N 3.11Å; N591-L595 WeakPolarHBondContact O-CB 3.34Å; N591-L595 PolarHBondContact O-N 2.58Å
592	V	91.1	Very high	89.8	Confident	79 Å²	79	82.8 Å²	82.8	48%	0.479	47%	0.472	S	S	.	.	H	α-helix	trans	-66.1	-45.6	176.6	173.9	0	0	0	0	111	M588 P589 Y590 L595 T596	M588-V592 WeakPolarHBondContact O-CG2 3.36Å; M588-V592 PolarHBondContact O-N 3.49Å; M588-V592 VanDerWaalsContact O-N 3.11Å; P589-V592 PolarHBondContact O-N 3.35Å; Y590-V592 VanDerWaalsContact C-N 3.3Å; Y590-V592 PolarHBondContact O-N 3.47Å; V592-L595 PolarHBondContact O-N 2.95Å; V592-T596 HydrophobicContact CG1-CG2 4.32Å; V592-T596 WeakPolarHBondContact O-CG2 3.21Å; V592-T596 PolarHBondContact O-N 2.9Å; V592-T596 PolarHBondContact O-OG1 2.97Å; V592-T596 VanDerWaalsContact O-OG1 3.12Å
593	I	89.9	Confident	90.1	Very high	100 Å²	100	83.2 Å²	83.2	51%	0.513	48%	0.481	S	S	.	.	H	α-helix	trans	-62.4	-46.2	178	-68.4	166.1	0	0	0	110.5	P589 Y590 L595 T596 C597	P589-I593 VanDerWaalsContact O-CG1 3.29Å; P589-I593 WeakPolarHBondContact O-CG1 3.45Å; P589-I593 PolarHBondContact O-N 3.29Å; Y590-I593 PolarHBondContact O-N 3.3Å; I593-L595 VanDerWaalsContact C-N 3.32Å; I593-L595 PolarHBondContact O-N 3.39Å; I593-T596 PolarHBondContact O-N 3.36Å; I593-T596 PolarHBondContact O-OG1 3.12Å; I593-T596 VanDerWaalsContact O-OG1 3.06Å; I593-C597 VanDerWaalsContact O-CB 3.24Å; I593-C597 WeakPolarHBondContact O-CB 3.24Å; I593-C597 PolarHBondContact O-N 3.29Å; I593-C597 PolarHBondContact O-SG 3.48Å
594	C	92.4	Very high	90.6	Very high	47 Å²	47	87.6 Å²	87.6	32%	0.318	49%	0.492	S	S	.	.	H	α-helix	trans	-57.6	-46.7	176.1	-73.7	0	0	0	0	111	Y590 T598	Y590-C594 VanDerWaalsContact CE1-SG 3.53Å; Y590-C594 WeakPolarHBondContact O-CB 3.38Å; Y590-C594 PolarHBondContact O-N 3Å; Y590-C594 PolarHBondContact O-SG 3.39Å; Y590-C594 VanDerWaalsContact O-SG 3.38Å; C594-T598 WeakPolarHBondContact O-CB 3.29Å; C594-T598 PolarHBondContact O-N 3.28Å; C594-T598 PolarHBondContact O-OG1 3.5Å
595	L	95.4	Very high	91.1	Very high	116 Å²	116	87 Å²	87	61%	0.607	49%	0.494	S	S	*	.	H	α-helix	trans	-63.4	-47.4	179.1	-174.7	144.2	0	0	0	112	N591 V592 I593 T598 V599	N591-L595 WeakPolarHBondContact O-CB 3.34Å; N591-L595 PolarHBondContact O-N 2.58Å; V592-L595 PolarHBondContact O-N 2.95Å; I593-L595 VanDerWaalsContact C-N 3.32Å; I593-L595 PolarHBondContact O-N 3.39Å; L595-T598 PolarHBondContact O-N 3.44Å; L595-V599 HydrophobicContact CD2-CG2 4.32Å; L595-V599 WeakPolarHBondContact O-CG2 3.36Å; L595-V599 PolarHBondContact O-N 2.82Å
596	T	95.9	Very high	91.6	Very high	67 Å²	67	84.8 Å²	84.8	41%	0.411	49%	0.488	S	S	.	.	H	α-helix	trans	-66	-44	-179.4	56.2	0	0	0	0	111.7	V592 I593 T598 V599 V600	V592-T596 HydrophobicContact CG1-CG2 4.32Å; V592-T596 WeakPolarHBondContact O-CG2 3.21Å; V592-T596 PolarHBondContact O-N 2.9Å; V592-T596 PolarHBondContact O-OG1 2.97Å; V592-T596 VanDerWaalsContact O-OG1 3.12Å; I593-T596 PolarHBondContact O-N 3.36Å; I593-T596 PolarHBondContact O-OG1 3.12Å; I593-T596 VanDerWaalsContact O-OG1 3.06Å; T596-T598 VanDerWaalsContact C-N 3.29Å; T596-T598 PolarHBondContact O-N 2.94Å; T596-V599 PolarHBondContact O-N 2.87Å; T596-V600 WeakPolarHBondContact O-CB 3.38Å; T596-V600 VanDerWaalsContact O-CG2 3.29Å; T596-V600 WeakPolarHBondContact O-CG2 3.46Å; T596-V600 PolarHBondContact O-N 3.37Å
597	C	95.6	Very high	92.3	Very high	73 Å²	73	85.6 Å²	85.6	49%	0.493	50%	0.495	S	S	.	.	H	α-helix	trans	-59.7	-40.1	174.3	-72.7	0	0	0	0	111.6	I593 V600 A601	I593-C597 VanDerWaalsContact O-CB 3.24Å; I593-C597 WeakPolarHBondContact O-CB 3.24Å; I593-C597 PolarHBondContact O-N 3.29Å; I593-C597 PolarHBondContact O-SG 3.48Å; C597-V600 PolarHBondContact O-N 2.86Å; C597-A601 WeakPolarHBondContact O-CB 3.35Å; C597-A601 PolarHBondContact O-N 3.06Å
598	T	95.8	Very high	92.7	Very high	85 Å²	85	88.9 Å²	88.9	52%	0.521	50%	0.5	S	S	.	.	H	α-helix	trans	-65.1	-45.3	177.4	-48.2	0	0	0	0	111.2	C594 L595 T596 V600 A601 V602	C594-T598 WeakPolarHBondContact O-CB 3.29Å; C594-T598 PolarHBondContact O-N 3.28Å; C594-T598 PolarHBondContact O-OG1 3.5Å; L595-T598 PolarHBondContact O-N 3.44Å; T596-T598 VanDerWaalsContact C-N 3.29Å; T596-T598 PolarHBondContact O-N 2.94Å; T598-V600 PolarHBondContact O-N 3.49Å; T598-A601 PolarHBondContact O-N 2.83Å; T598-V602 WeakPolarHBondContact O-CB 3.46Å; T598-V602 VanDerWaalsContact O-CG2 3.29Å; T598-V602 WeakPolarHBondContact O-CG2 3.19Å; T598-V602 PolarHBondContact O-N 3.27Å
599	V	96.4	Very high	92.9	Very high	94 Å²	94	86.1 Å²	86.1	57%	0.57	49%	0.488	S	S	*	.	H	α-helix	trans	-61.6	-44.7	176.8	171.2	0	0	0	0	111	L595 T596 G603	L595-V599 HydrophobicContact CD2-CG2 4.32Å; L595-V599 WeakPolarHBondContact O-CG2 3.36Å; L595-V599 PolarHBondContact O-N 2.82Å; T596-V599 PolarHBondContact O-N 2.87Å; V599-G603 PolarHBondContact O-N 3.37Å
600	V	96.6	Very high	93.2	Very high	98 Å²	98	90.1 Å²	90.1	59%	0.594	51%	0.506	S	S	*	.	H	α-helix	trans	-64.9	-43.8	177.6	171.7	0	0	0	0	111.1	T596 C597 T598 G603 Y604	T596-V600 WeakPolarHBondContact O-CB 3.38Å; T596-V600 VanDerWaalsContact O-CG2 3.29Å; T596-V600 WeakPolarHBondContact O-CG2 3.46Å; T596-V600 PolarHBondContact O-N 3.37Å; C597-V600 PolarHBondContact O-N 2.86Å; T598-V600 PolarHBondContact O-N 3.49Å; V600-G603 PolarHBondContact O-N 2.78Å; V600-Y604 WeakPolarHBondContact O-CB 3.47Å; V600-Y604 PolarHBondContact O-N 2.88Å
601	A	96.1	Very high	93.5	Very high	62 Å²	62	89.2 Å²	89.2	51%	0.512	51%	0.511	S	S	.	.	H	α-helix	trans	-63.7	-43	179	0	0	0	0	0	112	C597 T598 G605	C597-A601 WeakPolarHBondContact O-CB 3.35Å; C597-A601 PolarHBondContact O-N 3.06Å; T598-A601 PolarHBondContact O-N 2.83Å; A601-G605 WeakPolarHBondContact O-CA 3.18Å; A601-G605 PolarHBondContact O-N 3.25Å
602	V	95.8	Very high	93.5	Very high	99 Å²	99	88.1 Å²	88.1	60%	0.6	51%	0.508	S	S	*	.	H	α-helix	trans	-66.6	-45.4	175.7	172.4	0	0	0	0	110.7	T598 G605 S606	T598-V602 WeakPolarHBondContact O-CB 3.46Å; T598-V602 VanDerWaalsContact O-CG2 3.29Å; T598-V602 WeakPolarHBondContact O-CG2 3.19Å; T598-V602 PolarHBondContact O-N 3.27Å; V602-G605 PolarHBondContact O-N 2.67Å; V602-S606 VanDerWaalsContact O-CB 3.28Å; V602-S606 WeakPolarHBondContact O-CB 3.4Å; V602-S606 PolarHBondContact O-N 3.23Å; V602-S606 PolarHBondContact O-OG 3.36Å
603	G	96.1	Very high	93.1	Very high	35 Å²	35	91.4 Å²	91.4	36%	0.361	51%	0.512	S	S	.	.	H	α-helix	trans	-60.2	-53.9	178	0	0	0	0	0	111.8	V599 V600 S606 L607	V599-G603 PolarHBondContact O-N 3.37Å; V600-G603 PolarHBondContact O-N 2.78Å; G603-S606 PolarHBondContact O-N 2.76Å; G603-S606 PolarHBondContact O-OG 2.89Å; G603-L607 WeakPolarHBondContact O-CB 3.29Å; G603-L607 PolarHBondContact O-N 3.38Å
604	Y	95.8	Very high	92.4	Very high	152 Å²	152	91.4 Å²	91.4	60%	0.596	52%	0.521	S	S	*	.	H	α-helix	trans	-60.6	-47.5	176.9	-179.7	-94.3	0	0	0	111.8	V600 S606 L607 Y608	V600-Y604 WeakPolarHBondContact O-CB 3.47Å; V600-Y604 PolarHBondContact O-N 2.88Å; Y604-S606 VanDerWaalsContact C-N 3.31Å; Y604-S606 PolarHBondContact O-N 3.21Å; Y604-L607 PolarHBondContact O-N 3Å; Y604-Y608 HydrophobicContact CE1-CD2 4.42Å; Y604-Y608 HydrophobicContact CE1-CG 4.37Å; Y604-Y608 WeakPolarHBondContact O-CB 3.28Å; Y604-Y608 PolarHBondContact O-N 3.47Å
605	G	94.1	Very high	91.4	Very high	34 Å²	34	96.9 Å²	96.9	35%	0.351	54%	0.539	S	S	.	.	H	α-helix	trans	-60.1	-41.3	179.2	0	0	0	0	0	112.3	A601 V602 N609	A601-G605 WeakPolarHBondContact O-CA 3.18Å; A601-G605 PolarHBondContact O-N 3.25Å; V602-G605 PolarHBondContact O-N 2.67Å; G605-N609 WeakPolarHBondContact O-CB 3.47Å; G605-N609 PolarHBondContact O-N 3.01Å
606	S	91.6	Very high	90.2	Very high	65 Å²	65	100 Å²	100	46%	0.455	55%	0.551	S	S	.	*	H	α-helix	trans	-65.3	-44.2	176	72.6	0	0	0	0	112.3	V602 G603 Y604 L610	V602-S606 VanDerWaalsContact O-CB 3.28Å; V602-S606 WeakPolarHBondContact O-CB 3.4Å; V602-S606 PolarHBondContact O-N 3.23Å; V602-S606 PolarHBondContact O-OG 3.36Å; G603-S606 PolarHBondContact O-N 2.76Å; G603-S606 PolarHBondContact O-OG 2.89Å; Y604-S606 VanDerWaalsContact C-N 3.31Å; Y604-S606 PolarHBondContact O-N 3.21Å; S606-L610 WeakPolarHBondContact O-CB 3.49Å; S606-L610 PolarHBondContact O-N 3.15Å
607	L	93.4	Very high	88.8	Confident	100 Å²	100	103 Å²	103	52%	0.524	57%	0.569	S	S	.	*	H	α-helix	trans	-67.7	-45.6	179.5	-175.2	68.3	0	0	0	111.5	G603 Y604 N609 L610 L611	G603-L607 WeakPolarHBondContact O-CB 3.29Å; G603-L607 PolarHBondContact O-N 3.38Å; Y604-L607 PolarHBondContact O-N 3Å; L607-N609 VanDerWaalsContact C-N 3.35Å; L607-N609 PolarHBondContact O-N 2.78Å; L607-L610 WeakPolarHBondContact O-CB 3.22Å; L607-L610 PolarHBondContact O-N 3.26Å; L607-L611 HydrophobicContact CD1-CD1 4.3Å; L607-L611 HydrophobicContact CG-CD1 4Å; L607-L611 WeakPolarHBondContact O-CG 3.36Å; L607-L611 PolarHBondContact O-N 3.02Å
608	Y	93	Very high	87.1	Confident	125 Å²	125	108.4 Å²	108.4	49%	0.49	59%	0.587	S	S	.	*	H	α-helix	trans	-60.7	-44.8	177.7	-177.7	-95.9	0	0	0	111.1	Y604 L610 L611 T612	Y604-Y608 HydrophobicContact CE1-CD2 4.42Å; Y604-Y608 HydrophobicContact CE1-CG 4.37Å; Y604-Y608 WeakPolarHBondContact O-CB 3.28Å; Y604-Y608 PolarHBondContact O-N 3.47Å; Y608-L610 PolarHBondContact O-N 3.49Å; Y608-L611 PolarHBondContact O-N 3.26Å; Y608-T612 HydrophobicContact CD1-CG2 4.41Å; Y608-T612 HydrophobicContact CD2-CG2 4.03Å; Y608-T612 HydrophobicContact CE1-CG2 4.09Å; Y608-T612 HydrophobicContact CE2-CG2 3.67Å; Y608-T612 HydrophobicContact CG-CG2 4.39Å; Y608-T612 WeakPolarHBondContact O-CB 2.95Å; Y608-T612 WeakPolarHBondContact O-CG2 3.46Å; Y608-T612 PolarHBondContact O-N 3.44Å; Y608-T612 PolarHBondContact O-OG1 2.98Å
609	N	89.3	Confident	85.3	Confident	79 Å²	79	112.5 Å²	112.5	42%	0.422	60%	0.6	S	S	.	*	H	α-helix	trans	-63.1	-41.9	176.9	-162.8	1	0	0	0	111.4	G605 L607 L611 R613	G605-N609 WeakPolarHBondContact O-CB 3.47Å; G605-N609 PolarHBondContact O-N 3.01Å; L607-N609 VanDerWaalsContact C-N 3.35Å; L607-N609 PolarHBondContact O-N 2.78Å; N609-L611 VanDerWaalsContact C-N 3.34Å; N609-L611 PolarHBondContact O-N 3.25Å; N609-R613 WeakPolarHBondContact O-CB 3.33Å; N609-R613 PolarHBondContact O-N 3.23Å; N609-R613 WeakPolarHBondContact OD1-CD 3.48Å
610	L	88.6	Confident	83.5	Confident	130 Å²	130	113.8 Å²	113.8	68%	0.681	61%	0.61	S	S	*	*	H	α-helix	trans	-60.7	-40.2	174.3	-94.9	157.8	0	0	0	113.2	S606 L607 Y608	S606-L610 WeakPolarHBondContact O-CB 3.49Å; S606-L610 PolarHBondContact O-N 3.15Å; L607-L610 WeakPolarHBondContact O-CB 3.22Å; L607-L610 PolarHBondContact O-N 3.26Å; Y608-L610 PolarHBondContact O-N 3.49Å
611	L	91.1	Very high	81.7	Confident	137 Å²	137	115.6 Å²	115.6	72%	0.717	62%	0.617	S	S	*	*	H	α-helix	trans	-80.6	-31.2	-176.4	-69.3	172.3	0	0	0	113.4	L607 Y608 N609	L607-L611 HydrophobicContact CD1-CD1 4.3Å; L607-L611 HydrophobicContact CG-CD1 4Å; L607-L611 WeakPolarHBondContact O-CG 3.36Å; L607-L611 PolarHBondContact O-N 3.02Å; Y608-L611 PolarHBondContact O-N 3.26Å; N609-L611 VanDerWaalsContact C-N 3.34Å; N609-L611 PolarHBondContact O-N 3.25Å
612	T	88.7	Confident	79.9	Confident	74 Å²	74	116.2 Å²	116.2	45%	0.454	62%	0.615	S	S	.	*	H	α-helix	trans	-104.3	-20.4	-172.1	59.5	0	0	0	0	114.1	Y608 S614	Y608-T612 HydrophobicContact CD1-CG2 4.41Å; Y608-T612 HydrophobicContact CD2-CG2 4.03Å; Y608-T612 HydrophobicContact CE1-CG2 4.09Å; Y608-T612 HydrophobicContact CE2-CG2 3.67Å; Y608-T612 HydrophobicContact CG-CG2 4.39Å; Y608-T612 WeakPolarHBondContact O-CB 2.95Å; Y608-T612 WeakPolarHBondContact O-CG2 3.46Å; Y608-T612 PolarHBondContact O-N 3.44Å; Y608-T612 PolarHBondContact O-OG1 2.98Å; T612-S614 PolarHBondContact O-N 2.91Å; T612-S614 VanDerWaalsContact O-N 3.15Å
613	R	82.7	Confident	78.5	Confident	148 Å²	148	113.8 Å²	113.8	56%	0.558	61%	0.61	S	S	*	*			trans	-74.7	109.4	-179.3	-169.6	174.7	-175.1	169.7	2	110.3	N609	N609-R613 WeakPolarHBondContact O-CB 3.33Å; N609-R613 PolarHBondContact O-N 3.23Å; N609-R613 WeakPolarHBondContact OD1-CD 3.48Å
614	S	76.5	Confident	76.8	Confident	100 Å²	100	118.6 Å²	118.6	70%	0.699	63%	0.627	S	S	*	*			trans	-79.1	118.8	166.6	55.6	0	0	0	0	109.5	T612 Q616	T612-S614 PolarHBondContact O-N 2.91Å; T612-S614 VanDerWaalsContact O-N 3.15Å; S614-Q616 PolarHBondContact O-N 2.97Å
615	F	72.1	Confident	75.3	Confident	161 Å²	161	115.1 Å²	115.1	71%	0.706	63%	0.63	S	S	*	*			trans	-78.2	101.8	170.9	-65.8	-83.3	0	0	0	108.2	V617	F615-V617 PolarHBondContact O-N 2.9Å
616	Q	69.4	Low	74	Confident	182 Å²	182	118.8 Å²	118.8	85%	0.85	64%	0.636	S	S	*	*			trans	-77.2	117.3	165.4	-77.2	-173.8	-12.7	0	0	108.5	S614 E618	S614-Q616 PolarHBondContact O-N 2.97Å; Q616-E618 PolarHBondContact O-N 2.86Å
617	V	66.8	Low	72.9	Confident	131 Å²	131	123.7 Å²	123.7	79%	0.794	64%	0.644	S	S	*	*			trans	-68.2	113.1	170.2	178.9	0	0	0	0	106.9	F615 E619	F615-V617 PolarHBondContact O-N 2.9Å; V617-E619 PolarHBondContact O-N 3.09Å; V617-E619 VanDerWaalsContact O-N 3.14Å
618	E	58.5	Low	71.8	Confident	185 Å²	185	123.3 Å²	123.3	86%	0.864	64%	0.642	S	S	*	*			trans	-64.8	111.2	171.2	-153.7	173.4	-165.7	0	0	107.4	Q616	Q616-E618 PolarHBondContact O-N 2.86Å
619	E	59.1	Low	70.7	Confident	171 Å²	171	118.8 Å²	118.8	80%	0.799	63%	0.631	S	S	*	*			trans	-58.2	129.6	178.4	-75.9	-170.4	168.7	0	0	109.2	V617 N621	V617-E619 PolarHBondContact O-N 3.09Å; V617-E619 VanDerWaalsContact O-N 3.14Å; E619-N621 PolarHBondContact O-N 3.14Å; E619-N621 VanDerWaalsContact O-N 3.09Å
620	P	59	Low	69.9	Low	121 Å²	121	116.9 Å²	116.9	79%	0.786	62%	0.621	S	S	*	*			trans	-61.1	121.5	177.4	24.2	-31.3	0	0	0	108.6
621	N	58.8	Low	69.4	Low	137 Å²	137	114.7 Å²	114.7	73%	0.733	61%	0.612	S	S	*	*			trans	-15.2	120.8	173.7	-119.5	-25.1	0	0	0	112.8	E619 G623	E619-N621 PolarHBondContact O-N 3.14Å; E619-N621 VanDerWaalsContact O-N 3.09Å; N621-G623 PolarHBondContact O-N 3.21Å
622	P	58.7	Low	68.6	Low	74 Å²	74	112.3 Å²	112.3	48%	0.481	60%	0.6	S	S	.	*			trans	-55.7	111.6	-173.4	22	-32.2	0	0	0	109.3	K626	P622-K626 HydrophobicContact CB-CB 4.24Å; P622-K626 HydrophobicContact CB-CD 3.97Å
623	G	64.4	Low	67.9	Low	48 Å²	48	113.4 Å²	113.4	50%	0.495	60%	0.595	S	S	.	*			trans	-52.2	153.1	-170.7	0	0	0	0	0	112.1	N621 A625 K626	N621-G623 PolarHBondContact O-N 3.21Å; G623-A625 CarbonylContact O-C 3.58Å; G623-A625 PolarHBondContact O-N 3.45Å; G623-K626 PolarHBondContact O-N 3.3Å
624	L	61.8	Low	67.7	Low	137 Å²	137	116.2 Å²	116.2	72%	0.717	61%	0.606	S	S	*	*	H	α-helix	trans	-37.5	-32.7	177.6	-104.7	141.9	0	0	0	114.2	K626 R627 I628	L624-K626 PolarHBondContact O-N 3.5Å; L624-R627 PolarHBondContact O-N 3.04Å; L624-I628 HydrophobicContact CD2-CD1 4.17Å; L624-I628 VanDerWaalsContact O-CG1 3.3Å; L624-I628 WeakPolarHBondContact O-CG1 3.46Å; L624-I628 PolarHBondContact O-N 3.14Å
625	A	63.8	Low	67.6	Low	78 Å²	78	119.3 Å²	119.3	65%	0.645	61%	0.611	S	S	*	*	H	α-helix	trans	-55.9	-43.9	173.2	0	0	0	0	0	114.7	G623 A629	G623-A625 CarbonylContact O-C 3.58Å; G623-A625 PolarHBondContact O-N 3.45Å; A625-A629 WeakPolarHBondContact O-CB 3.34Å; A625-A629 PolarHBondContact O-N 3.49Å
626	K	67.1	Low	67.6	Low	112 Å²	112	121.4 Å²	121.4	49%	0.487	61%	0.614	S	S	.	*	H	α-helix	trans	-69	-35.1	177.4	-109.2	-177.7	177.5	-177.2	0	111.7	P622 G623 L624 N630	P622-K626 HydrophobicContact CB-CB 4.24Å; P622-K626 HydrophobicContact CB-CD 3.97Å; G623-K626 PolarHBondContact O-N 3.3Å; L624-K626 PolarHBondContact O-N 3.5Å; K626-N630 WeakPolarHBondContact O-CB 3.37Å; K626-N630 VanDerWaalsContact O-CG 3.3Å; K626-N630 PolarHBondContact O-N 3.3Å
627	R	68.7	Low	67.5	Low	167 Å²	167	116.2 Å²	116.2	63%	0.63	61%	0.61	S	S	*	*	H	α-helix	trans	-69	-43.8	174.8	-72	-175.3	179	-179.5	0.7	112	L624 N630 V631	L624-R627 PolarHBondContact O-N 3.04Å; R627-N630 PolarHBondContact O-N 3.43Å; R627-V631 WeakPolarHBondContact O-CG2 3.19Å; R627-V631 PolarHBondContact O-N 3.2Å
628	I	70.9	Confident	67.6	Low	92 Å²	92	113.5 Å²	113.5	47%	0.472	59%	0.593	S	S	.	*	H	α-helix	trans	-67.2	-42	176.7	-65.6	166.4	0	0	0	110.6	L624 N630 V631 I632	L624-I628 HydrophobicContact CD2-CD1 4.17Å; L624-I628 VanDerWaalsContact O-CG1 3.3Å; L624-I628 WeakPolarHBondContact O-CG1 3.46Å; L624-I628 PolarHBondContact O-N 3.14Å; I628-N630 VanDerWaalsContact C-N 3.29Å; I628-N630 PolarHBondContact O-N 3.11Å; I628-V631 PolarHBondContact O-N 3.03Å; I628-I632 HydrophobicContact CG2-CD1 3.81Å; I628-I632 HydrophobicContact CG2-CG1 4.38Å; I628-I632 WeakPolarHBondContact O-CG1 3.42Å; I628-I632 PolarHBondContact O-N 3.37Å
629	A	69.7	Low	67.5	Low	31 Å²	31	109.4 Å²	109.4	26%	0.256	58%	0.583	S	S	.	*	H	α-helix	trans	-59.7	-39.6	175.4	0	0	0	0	0	112	A625 R633 L641	A625-A629 WeakPolarHBondContact O-CB 3.34Å; A625-A629 PolarHBondContact O-N 3.49Å; A629-R633 WeakPolarHBondContact O-CB 3.3Å; A629-R633 WeakPolarHBondContact O-CG 3.32Å; A629-R633 PolarHBondContact O-N 3.35Å; A629-L641 HydrophobicContact CB-CD1 4.39Å
630	N	72.3	Confident	67.6	Low	39 Å²	39	104.9 Å²	104.9	21%	0.209	57%	0.569	C	S	.	*	H	α-helix	trans	-72.9	-29.9	177.4	-75.9	-6.1	0	0	0	113.2	K626 R627 I628 R634 P640 L641	K626-N630 WeakPolarHBondContact O-CB 3.37Å; K626-N630 VanDerWaalsContact O-CG 3.3Å; K626-N630 PolarHBondContact O-N 3.3Å; R627-N630 PolarHBondContact O-N 3.43Å; I628-N630 VanDerWaalsContact C-N 3.29Å; I628-N630 PolarHBondContact O-N 3.11Å; N630-R634 WeakPolarHBondContact O-CB 3.44Å; N630-R634 PolarHBondContact O-N 3.13Å; N630-P640 HydrophobicContact CB-CB 3.87Å; N630-P640 WeakPolarHBondContact OD1-CA 3.38Å; N630-P640 WeakPolarHBondContact OD1-CB 3.35Å; N630-L641 PolarHBondContact ND2-O 2.9Å; N630-L641 PolarHBondContact OD1-N 2.95Å
631	V	76.8	Confident	67.6	Low	84 Å²	84	105.5 Å²	105.5	51%	0.509	56%	0.564	S	S	.	*	H	α-helix	trans	-70.4	-44.1	171.9	172	0	0	0	0	111.6	R627 I628 R633 R634 M635	R627-V631 WeakPolarHBondContact O-CG2 3.19Å; R627-V631 PolarHBondContact O-N 3.2Å; I628-V631 PolarHBondContact O-N 3.03Å; V631-R633 PolarHBondContact O-N 3.04Å; V631-R634 PolarHBondContact O-N 2.97Å; V631-M635 PolarHBondContact O-N 2.88Å
632	I	74.2	Confident	68.1	Low	87 Å²	87	103.9 Å²	103.9	45%	0.446	56%	0.556	S	S	.	*	H	α-helix	trans	-65	-40.1	177.3	-65.9	170	0	0	0	110.9	I628 M635 R636	I628-I632 HydrophobicContact CG2-CD1 3.81Å; I628-I632 HydrophobicContact CG2-CG1 4.38Å; I628-I632 WeakPolarHBondContact O-CG1 3.42Å; I628-I632 PolarHBondContact O-N 3.37Å; I632-M635 PolarHBondContact O-N 3.41Å; I632-R636 PolarHBondContact O-N 3.49Å; I632-R636 VanDerWaalsContact O-N 3.11Å
633	R	75.3	Confident	68.6	Low	97 Å²	97	105.5 Å²	105.5	37%	0.366	56%	0.56	S	S	.	*	H	α-helix	trans	-65.5	-38.8	175.2	-77.8	-177.7	175.8	-159.8	2.9	112.5	A629 V631 M635 R636 G637 V638	A629-R633 WeakPolarHBondContact O-CB 3.3Å; A629-R633 WeakPolarHBondContact O-CG 3.32Å; A629-R633 PolarHBondContact O-N 3.35Å; V631-R633 PolarHBondContact O-N 3.04Å; R633-M635 PolarHBondContact O-N 3.28Å; R633-R636 CarbonylContact O-C 3.48Å; R633-R636 PolarHBondContact O-N 2.8Å; R633-R636 VanDerWaalsContact O-N 3.14Å; R633-G637 PolarHBondContact O-N 2.78Å; R633-G637 VanDerWaalsContact O-N 3.13Å; R633-V638 CarbonylContact C-O 3.38Å; R633-V638 PolarHBondContact O-N 3.36Å; R633-V638 VanDerWaalsContact O-O 3.11Å
634	R	77.1	Confident	68.8	Low	206 Å²	206	108.7 Å²	108.7	78%	0.777	56%	0.563	S	S	*	*	H	α-helix	trans	-61	-41.2	172.6	-113.6	179.2	178.1	175	0	112.8	N630 V631 R636 G637	N630-R634 WeakPolarHBondContact O-CB 3.44Å; N630-R634 PolarHBondContact O-N 3.13Å; V631-R634 PolarHBondContact O-N 2.97Å; R634-R636 VanDerWaalsContact C-N 3.27Å; R634-R636 PolarHBondContact O-N 2.79Å; R634-G637 PolarHBondContact O-N 2.99Å
635	M	74.7	Confident	69.2	Low	166 Å²	166	107 Å²	107	82%	0.818	55%	0.554	S	S	*	*	H	α-helix	trans	-68.2	-26.8	175.3	-75.4	-163.5	-172.7	0	0	113.2	V631 I632 R633	V631-M635 PolarHBondContact O-N 2.88Å; I632-M635 PolarHBondContact O-N 3.41Å; R633-M635 PolarHBondContact O-N 3.28Å
636	R	73.3	Confident	69.6	Low	204 Å²	204	108.8 Å²	108.8	77%	0.77	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	5.7	176.2	-72.2	-175.8	174.1	-178.2	-1.2	114.1	I632 R633 R634 V638	I632-R636 PolarHBondContact O-N 3.49Å; I632-R636 VanDerWaalsContact O-N 3.11Å; R633-R636 CarbonylContact O-C 3.48Å; R633-R636 PolarHBondContact O-N 2.8Å; R633-R636 VanDerWaalsContact O-N 3.14Å; R634-R636 VanDerWaalsContact C-N 3.27Å; R634-R636 PolarHBondContact O-N 2.79Å; R636-V638 VanDerWaalsContact C-N 3.3Å; R636-V638 HydrophobicContact CB-CG2 4.49Å; R636-V638 PolarHBondContact O-N 3.03Å
637	G	65.8	Low	69.7	Low	73 Å²	73	108.6 Å²	108.6	75%	0.753	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.5	21.6	178.4	0	0	0	0	0	114.9	R633 R634	R633-G637 PolarHBondContact O-N 2.78Å; R633-G637 VanDerWaalsContact O-N 3.13Å; R634-G637 PolarHBondContact O-N 2.99Å
638	V	69.1	Low	69.8	Low	74 Å²	74	104.4 Å²	104.4	45%	0.448	55%	0.547	S	S	.	.			trans	-108.8	141.4	179.5	-173.2	0	0	0	0	109.7	R633 R636	R633-V638 CarbonylContact C-O 3.38Å; R633-V638 PolarHBondContact O-N 3.36Å; R633-V638 VanDerWaalsContact O-O 3.11Å; R636-V638 VanDerWaalsContact C-N 3.3Å; R636-V638 HydrophobicContact CB-CG2 4.49Å; R636-V638 PolarHBondContact O-N 3.03Å
639	P	57.5	Low	69.7	Low	99 Å²	99	105.4 Å²	105.4	64%	0.643	55%	0.553	S	S	*	*			trans	-60.1	147.6	178.3	20.1	-31.2	0	0	0	113.5
640	P	61.7	Low	69.7	Low	77 Å²	77	111.6 Å²	111.6	50%	0.5	58%	0.578	S	S	.	*			trans	-69.2	153.5	-178	27.8	-32.9	0	0	0	112.8	N630	N630-P640 HydrophobicContact CB-CB 3.87Å; N630-P640 WeakPolarHBondContact OD1-CA 3.38Å; N630-P640 WeakPolarHBondContact OD1-CB 3.35Å
641	L	59.1	Low	69.5	Low	133 Å²	133	118.2 Å²	118.2	70%	0.696	61%	0.611	S	S	*	*			trans	-67	0	169.2	-74.5	166.6	0	0	0	112.3	A629 N630	A629-L641 HydrophobicContact CB-CD1 4.39Å; N630-L641 PolarHBondContact ND2-O 2.9Å; N630-L641 PolarHBondContact OD1-N 2.95Å

Retrieved 641 of 641 residues in 880.8 ms (Link to these results)

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