A0A3Q0KLS2_SCHMA Loading...

Eukaryotic release factor 3-related (Erfs) (Hbs1-like)

AlphaFold DB , UniProt , Accession A0A3Q0KLS2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 671 aa.

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(Predicted Aligned Error values between residue pairs)

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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	36.2	Very low	36.5	Very low	251 Å²	251	177 Å²	177	100%	1.236	84%	0.84	S	S	*	*				0	157.3	0	-74.3	179.6	174	0	0	109.1
2	S	31.3	Very low	36.8	Very low	113 Å²	113	172.9 Å²	172.9	79%	0.79	83%	0.827	S	S	*	*			trans	-73.7	147.3	-166.9	-28.6	0	0	0	0	115
3	R	36.9	Very low	37	Very low	250 Å²	250	170.1 Å²	170.1	94%	0.943	82%	0.819	S	S	*	*				178.3	144.6	119.5	-96.7	159.6	-179.5	-179	0.2	114.2
4	H	35.9	Very low	37.3	Very low	182 Å²	182	168.9 Å²	168.9	84%	0.843	82%	0.819	S	S	*	*			trans	-83.3	153.4	169.2	-70.4	-89.1	0	0	0	112.7
5	R	40.3	Very low	37.2	Very low	240 Å²	240	165.8 Å²	165.8	91%	0.906	81%	0.814	S	S	*	*				-179.4	128.8	123.3	-93	155.1	-178.2	-166.4	-1.1	107.4
6	N	37.1	Very low	37.4	Very low	149 Å²	149	165.3 Å²	165.3	80%	0.797	82%	0.816	S	S	*	*			cis	84.1	150.3	38.1	-163.3	16.4	0	0	0	113.7
7	V	37.5	Very low	37.4	Very low	115 Å²	115	161.1 Å²	161.1	70%	0.697	80%	0.802	S	S	*	*			trans	107.8	88	168.8	-171.9	0	0	0	0	117.7
8	R	34.6	Very low	37.6	Very low	232 Å²	232	164.6 Å²	164.6	88%	0.875	81%	0.806	S	S	*	*				61	125.9	124.8	-80.4	-176.9	163.7	138.5	-4.3	125
9	A	34.2	Very low	37.8	Very low	72 Å²	72	162.5 Å²	162.5	60%	0.595	80%	0.799	S	S	*	*				74	130	115.6	0	0	0	0	0	123.2
10	L	38.9	Very low	37.8	Very low	158 Å²	158	163.5 Å²	163.5	83%	0.827	80%	0.801	S	S	*	*				-158.7	136.2	115.5	-82.7	129.5	0	0	0	105.5
11	Y	39	Very low	37.8	Very low	185 Å²	185	159.3 Å²	159.3	73%	0.725	79%	0.793	S	S	*	*				57.4	125.2	70.5	-62.2	-62.4	0	0	0	111.7
12	D	40.1	Very low	37.8	Very low	128 Å²	128	157.2 Å²	157.2	68%	0.684	78%	0.777	S	S	*	*			cis	-143.4	-148.3	-6.8	-94.5	-43.5	0	0	0	108.9
13	D	39.5	Very low	38.1	Very low	136 Å²	136	155.6 Å²	155.6	73%	0.727	77%	0.771	S	S	*	*			cis	-161.7	171.8	16.3	-118.2	-40.8	0	0	0	113
14	D	40.4	Very low	38	Very low	154 Å²	154	149 Å²	149	82%	0.824	76%	0.764	S	S	*	*			trans	66.2	133.6	163	-69.4	-30.7	0	0	0	123.7
15	V	36.7	Very low	37.9	Very low	122 Å²	122	144.7 Å²	144.7	74%	0.739	75%	0.753	S	S	*	*			trans	-136.4	151.5	178.1	169	0	0	0	0	107.2
16	D	39.8	Very low	37.9	Very low	158 Å²	158	139.5 Å²	139.5	85%	0.845	75%	0.748	S	S	*	*			trans	-147.5	148.1	150.4	-122.4	-27.3	0	0	0	112.1
17	T	36.7	Very low	37.9	Very low	94 Å²	94	138.7 Å²	138.7	58%	0.577	74%	0.744	S	S	*	*			trans	-140.6	137	-169.3	-58.1	0	0	0	0	109.8
18	Y	41.1	Very low	38.1	Very low	223 Å²	223	140.5 Å²	140.5	88%	0.875	75%	0.75	S	S	*	*			trans	-144.2	133.4	165.7	-99.8	-67.8	0	0	0	114.3
19	D	41.3	Very low	38.3	Very low	125 Å²	125	135.7 Å²	135.7	67%	0.668	74%	0.741	S	S	*	*			trans	-84.1	166.1	-155.6	-67.9	-62	0	0	0	118.6
20	E	37.8	Very low	38.9	Very low	183 Å²	183	142.5 Å²	142.5	86%	0.855	75%	0.753	S	S	*	*			trans	73.2	123.8	136.3	-83.5	-175.9	175.6	0	0	124.9
21	A	38.2	Very low	38.9	Very low	76 Å²	76	141 Å²	141	63%	0.628	75%	0.75	S	S	*	*			trans	65.8	125.5	132.5	0	0	0	0	0	121.6
22	F	36.1	Very low	39.3	Very low	206 Å²	206	139 Å²	139	90%	0.904	75%	0.751	S	S	*	*				-175	158.8	89.9	-107.8	-80.1	0	0	0	114.2
23	A	37.3	Very low	39.3	Very low	79 Å²	79	136.3 Å²	136.3	65%	0.653	74%	0.742	S	S	*	*			trans	71	91.3	152.1	0	0	0	0	0	122.5
24	S	36.7	Very low	39.4	Very low	113 Å²	113	135 Å²	135	79%	0.79	74%	0.741	S	S	*	*				57.1	126.8	125.9	59.4	0	0	0	0	123.3
25	S	32.3	Very low	39.8	Very low	90 Å²	90	135.2 Å²	135.2	63%	0.629	74%	0.742	S	S	*	*			trans	-70	155.6	158.7	-169.1	0	0	0	0	112.6	D27	S25-D27 PolarHBondContact OG-OD2 3.43Å
26	V	41.5	Very low	40.4	Very low	131 Å²	131	132.1 Å²	132.1	79%	0.794	72%	0.724	S	S	*	*			trans	-135.7	114.6	149.9	-177.2	0	0	0	0	107.6
27	D	35.6	Very low	40.5	Very low	132 Å²	132	128.3 Å²	128.3	71%	0.706	71%	0.709	S	S	*	*			trans	-87.4	144	172.5	-59.1	-99.2	0	0	0	109.6	S25	S25-D27 PolarHBondContact OG-OD2 3.43Å
28	D	42.8	Very low	41.2	Very low	153 Å²	153	131.8 Å²	131.8	82%	0.818	72%	0.719	S	S	*	*			trans	-133.7	111.2	173.4	-112.6	-33.8	0	0	0	110.1
29	D	37.7	Very low	41.5	Very low	131 Å²	131	131.8 Å²	131.8	70%	0.701	72%	0.717	S	S	*	*			trans	-80.7	137.7	-172.9	-93.2	-57.6	0	0	0	113.6
30	Y	47	Very low	41.8	Very low	215 Å²	215	135.1 Å²	135.1	84%	0.843	72%	0.722	S	S	*	*			trans	-133.3	69.8	161.2	-81.2	-68.5	0	0	0	112.4
31	T	40.4	Very low	42.1	Very low	126 Å²	126	132.4 Å²	132.4	77%	0.773	71%	0.712	S	S	*	*			trans	-87.8	111.4	167.3	47.7	0	0	0	0	110.9
32	I	46	Very low	42.2	Very low	144 Å²	144	137.8 Å²	137.8	74%	0.738	72%	0.722	S	S	*	*			trans	-84.3	127.5	177.1	-63.5	175.1	0	0	0	109.5
33	S	39.7	Very low	42.6	Very low	71 Å²	71	132.5 Å²	132.5	50%	0.497	70%	0.703	S	S	.	*			trans	-76.6	151.5	-177	75.3	0	0	0	0	113	N35 T36	S33-N35 PolarHBondContact O-N 3.12Å; S33-T36 PolarHBondContact O-N 3.21Å
34	P	43.1	Very low	43	Very low	109 Å²	109	133.4 Å²	133.4	71%	0.708	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-60.7	-23.5	-171.9	-26.8	36.3	0	0	0	115.8	T36 S37	P34-T36 VanDerWaalsContact C-N 3.26Å; P34-T36 PolarHBondContact O-N 3.28Å; P34-S37 PolarHBondContact O-OG 2.91Å
35	N	47.9	Very low	43.5	Very low	158 Å²	158	134.9 Å²	134.9	85%	0.845	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-80.9	8.1	-173.3	-71.5	6.8	0	0	0	114.5	S33	S33-N35 PolarHBondContact O-N 3.12Å
36	T	50.1	Low	43.6	Very low	58 Å²	58	134.7 Å²	134.7	36%	0.356	70%	0.7	S	S	.	*	G	3₁₀ helix	trans	-109.9	-0	178.1	-39.9	0	0	0	0	113.6	S33 P34 E38 R39	S33-T36 PolarHBondContact O-N 3.21Å; P34-T36 VanDerWaalsContact C-N 3.26Å; P34-T36 PolarHBondContact O-N 3.28Å; T36-E38 PolarHBondContact O-N 3.37Å; T36-R39 PolarHBondContact O-N 3.08Å
37	S	41.9	Very low	43.4	Very low	77 Å²	77	135 Å²	135	54%	0.538	70%	0.702	S	S	.	*	G	3₁₀ helix	trans	-59.8	-39.6	-174.7	46.7	0	0	0	0	114.7	P34 R39 Y40	P34-S37 PolarHBondContact O-OG 2.91Å; S37-R39 PolarHBondContact O-N 3.24Å; S37-R39 VanDerWaalsContact O-N 3.07Å; S37-Y40 PolarHBondContact O-N 3.05Å
38	E	50.9	Low	43.2	Very low	168 Å²	168	137.7 Å²	137.7	79%	0.785	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-62.3	-18.9	-177	-62.8	-172.3	155.1	0	0	114.2	T36 Y40	T36-E38 PolarHBondContact O-N 3.37Å; E38-Y40 VanDerWaalsContact C-N 3.31Å; E38-Y40 PolarHBondContact O-N 3.4Å
39	R	48.1	Very low	42.6	Very low	222 Å²	222	138.5 Å²	138.5	84%	0.838	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-82	-5	177.2	-66.9	-173.7	178.8	179.1	0.5	114.4	T36 S37	T36-R39 PolarHBondContact O-N 3.08Å; S37-R39 PolarHBondContact O-N 3.24Å; S37-R39 VanDerWaalsContact O-N 3.07Å
40	Y	47	Very low	42.4	Very low	195 Å²	195	141.6 Å²	141.6	77%	0.765	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-115.1	11.3	179.8	-72.5	-82	0	0	0	113.5	S37 E38 F42	S37-Y40 PolarHBondContact O-N 3.05Å; E38-Y40 VanDerWaalsContact C-N 3.31Å; E38-Y40 PolarHBondContact O-N 3.4Å; Y40-F42 PolarHBondContact O-N 3.05Å; Y40-F42 VanDerWaalsContact O-N 3.14Å
41	I	43.5	Very low	41.6	Very low	127 Å²	127	138.7 Å²	138.7	65%	0.651	71%	0.713	S	S	*	*			trans	-75.3	103.1	174.4	-59.5	177.7	0	0	0	109	N43	I41-N43 PolarHBondContact O-N 3.38Å; I41-N43 VanDerWaalsContact O-N 3.15Å
42	F	40.1	Very low	41.3	Very low	188 Å²	188	140.9 Å²	140.9	83%	0.825	72%	0.718	S	S	*	*			trans	-67.3	107	178.2	-178.6	-92.7	0	0	0	111	Y40 P44	Y40-F42 PolarHBondContact O-N 3.05Å; Y40-F42 VanDerWaalsContact O-N 3.14Å; F42-P44 HydrophobicContact CE1-CB 4.37Å
43	N	45.5	Very low	40.4	Very low	95 Å²	95	139.5 Å²	139.5	51%	0.508	72%	0.721	S	S	.	*			trans	-99.5	116.5	174.9	-170.9	-3.1	0	0	0	109.7	I41 D45	I41-N43 PolarHBondContact O-N 3.38Å; I41-N43 VanDerWaalsContact O-N 3.15Å; N43-D45 VanDerWaalsContact C-N 3.26Å; N43-D45 PolarHBondContact O-N 2.81Å
44	P	46.2	Very low	39.9	Very low	99 Å²	99	141.8 Å²	141.8	64%	0.643	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-17.7	-171	26.5	-35.7	0	0	0	115	F42	F42-P44 HydrophobicContact CE1-CB 4.37Å
45	D	45.6	Very low	39.1	Very low	144 Å²	144	142 Å²	142	77%	0.77	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-2.8	-169.8	-64.5	-34.3	0	0	0	114.9	N43	N43-D45 VanDerWaalsContact C-N 3.26Å; N43-D45 PolarHBondContact O-N 2.81Å
46	S	35.6	Very low	38.2	Very low	85 Å²	85	141.4 Å²	141.4	59%	0.594	73%	0.733	S	S	*	*			trans	-115.7	40.3	-161.8	72.4	0	0	0	0	117
47	V	37	Very low	37.1	Very low	139 Å²	139	144.5 Å²	144.5	84%	0.842	75%	0.752	S	S	*	*			trans	-134.2	94.1	165.7	-172.7	0	0	0	0	111.5
48	F	30.8	Very low	36.4	Very low	188 Å²	188	147 Å²	147	83%	0.825	76%	0.759	S	S	*	*			trans	-115.7	118.1	171.7	-130.4	-91.4	0	0	0	109.8
49	K	30.4	Very low	35.6	Very low	169 Å²	169	144.6 Å²	144.6	74%	0.735	76%	0.755	S	S	*	*			trans	57.8	105.9	170.2	-62.1	170.9	179.5	177.3	0	118
50	Q	34.1	Very low	34.8	Very low	197 Å²	197	139.7 Å²	139.7	92%	0.921	74%	0.74	S	S	*	*				-155.6	126.2	126.2	-113.8	170.3	9.4	0	0	110.1
51	D	30.6	Very low	34.4	Very low	153 Å²	153	135.4 Å²	135.4	82%	0.818	74%	0.736	S	S	*	*			trans	-90.2	126.8	-169.5	-63.1	-85.1	0	0	0	113.1
52	I	32.7	Very low	34.2	Very low	172 Å²	172	130.4 Å²	130.4	88%	0.882	71%	0.711	S	S	*	*			trans	-129.2	117.2	153.6	-61.4	-177.6	0	0	0	107.3
53	S	27.4	Very low	34.2	Very low	115 Å²	115	125 Å²	125	80%	0.804	70%	0.696	S	S	*	*			trans	-97	104.8	-160.2	44.3	0	0	0	0	114.4
54	V	29.2	Very low	34.2	Very low	119 Å²	119	121.2 Å²	121.2	72%	0.721	68%	0.675	S	S	*	*			trans	-132.3	117.1	155	-177.7	0	0	0	0	108.7	L56	V54-L56 HydrophobicContact CG1-CD1 4.33Å; V54-L56 HydrophobicContact CG1-CG 4.46Å; V54-L56 PolarHBondContact O-N 2.99Å
55	S	26.3	Very low	33.8	Very low	115 Å²	115	118.3 Å²	118.3	80%	0.804	66%	0.656	S	S	*	*			trans	-78.7	87.7	-170.5	56.2	0	0	0	0	112.9
56	L	29.7	Very low	33.6	Very low	145 Å²	145	114.7 Å²	114.7	76%	0.759	65%	0.646	S	S	*	*			trans	-111.6	37	177	-82.2	167.2	0	0	0	113.5	V54	V54-L56 HydrophobicContact CG1-CD1 4.33Å; V54-L56 HydrophobicContact CG1-CG 4.46Å; V54-L56 PolarHBondContact O-N 2.99Å
57	T	26.5	Very low	33.9	Very low	123 Å²	123	117.5 Å²	117.5	76%	0.755	65%	0.65	S	S	*	*			trans	-119.9	56.7	-172.5	44.8	0	0	0	0	113.6
58	N	27.6	Very low	34.5	Very low	130 Å²	130	111.1 Å²	111.1	70%	0.695	61%	0.61	S	S	*	*			trans	-167.8	55.5	163	-113.1	-70.2	0	0	0	114.4	K60	N58-K60 VanDerWaalsContact C-N 3.28Å; N58-K60 PolarHBondContact O-N 2.73Å
59	V	33.9	Very low	35.6	Very low	116 Å²	116	102.5 Å²	102.5	70%	0.703	57%	0.573	S	S	*	*			trans	-75.8	81	171.5	-173.1	0	0	0	0	110
60	K	32.3	Very low	36.1	Very low	119 Å²	119	96.9 Å²	96.9	52%	0.517	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-65.4	138.7	171.3	-68.9	176.5	-177.2	173.1	0	109.5	N58 N603	N58-K60 VanDerWaalsContact C-N 3.28Å; N58-K60 PolarHBondContact O-N 2.73Å; K60-N603 PolarHBondContact NZ-OD1 2.96Å
61	P	37.8	Very low	36.4	Very low	105 Å²	105	88.8 Å²	88.8	68%	0.682	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-62.1	141.6	172.2	27.4	-33.9	0	0	0	109.9	S63	P61-S63 PolarHBondContact O-N 3.3Å
62	L	39.8	Very low	36.8	Very low	23 Å²	23	84.1 Å²	84.1	12%	0.12	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-55.9	122.5	170.6	-100.7	163.6	0	0	0	109.8	F64 L565 N618	L62-F64 HydrophobicContact CB-CD2 4.34Å; L62-F64 HydrophobicContact CB-CE2 4.46Å; L62-F64 PolarHBondContact O-N 3.15Å; L62-L565 HydrophobicContact CD1-CD1 3.82Å; L62-N618 HydrophobicContact CD1-CB 3.69Å; L62-N618 HydrophobicContact CG-CB 4.02Å
63	S	39	Very low	36.9	Very low	75 Å²	75	78.7 Å²	78.7	52%	0.524	47%	0.468	S	S	.	.			trans	-75.7	111.7	151.2	53.7	0	0	0	0	107.5	P61 R601	P61-S63 PolarHBondContact O-N 3.3Å; S63-R601 PolarHBondContact O-NH1 3.46Å
64	F	44.9	Very low	37.1	Very low	14 Å²	14	78.1 Å²	78.1	6%	0.061	46%	0.464	C	S	.	.			trans	-62.9	154.6	166.3	-65.2	-135.7	0	0	0	107	L62 S376 M377 N378 L565	L62-F64 HydrophobicContact CB-CD2 4.34Å; L62-F64 HydrophobicContact CB-CE2 4.46Å; L62-F64 PolarHBondContact O-N 3.15Å; F64-S376 WeakPolarHBondContact CD2-O 3.39Å; F64-M377 HydrophobicContact CE2-CG 4.24Å; F64-M377 HydrophobicContact CZ-CB 4.48Å; F64-M377 HydrophobicContact CZ-CG 4.12Å; F64-N378 HydrophobicContact CB-CB 4.27Å; F64-N378 PolarHBondContact O-ND2 3.28Å; F64-N378 PolarHBondContact O-OD1 3.5Å; F64-L565 HydrophobicContact CD1-CD2 3.95Å; F64-L565 HydrophobicContact CE1-CD2 3.65Å; F64-L565 HydrophobicContact CZ-CD2 4.07Å
65	T	39.3	Very low	37.1	Very low	39 Å²	39	80.7 Å²	80.7	24%	0.239	47%	0.468	C	S	.	.			trans	-118.5	160.6	164.7	60.8	0	0	0	0	110.7	E67 D68 R601	T65-E67 PolarHBondContact O-N 3.31Å; T65-E67 VanDerWaalsContact O-N 3.15Å; T65-D68 PolarHBondContact N-OD2 3.34Å; T65-D68 PolarHBondContact O-N 2.67Å; T65-D68 PolarHBondContact OG1-OD2 3.42Å; T65-R601 PolarHBondContact OG1-NH1 2.89Å; T65-R601 PolarHBondContact OG1-NH2 3.32Å; T65-R601 VanDerWaalsContact OG1-NH2 3.11Å
66	A	40.3	Very low	37	Very low	67 Å²	67	83 Å²	83	55%	0.554	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-21	171.7	0	0	0	0	0	112.2	D68 F69 P70	A66-D68 VanDerWaalsContact C-N 3.34Å; A66-F69 CarbonylContact O-C 3.56Å; A66-P70 WeakPolarHBondContact O-CA 3.39Å; A66-P70 VanDerWaalsContact O-CB 3.27Å; A66-P70 WeakPolarHBondContact O-CB 3.14Å; A66-P70 WeakPolarHBondContact O-CD 3.31Å
67	E	42.7	Very low	36.9	Very low	145 Å²	145	85.7 Å²	85.7	68%	0.678	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-12.9	176.3	-54	171.4	156.7	0	0	113.7	T65 K563	T65-E67 PolarHBondContact O-N 3.31Å; T65-E67 VanDerWaalsContact O-N 3.15Å; E67-K563 PolarHBondContact O-NZ 2.84Å
68	D	49.2	Very low	37	Very low	4 Å²	4	87.4 Å²	87.4	2%	0.021	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-46.9	175.5	-63.1	-43	0	0	0	111.9	T65 A66 K563 R601	T65-D68 PolarHBondContact N-OD2 3.34Å; T65-D68 PolarHBondContact O-N 2.67Å; T65-D68 PolarHBondContact OG1-OD2 3.42Å; A66-D68 VanDerWaalsContact C-N 3.34Å; D68-K563 WeakPolarHBondContact OD1-CE 3.44Å; D68-K563 IonicContact OD1-NZ 3.86Å; D68-K563 PolarHBondContact OD1-NZ 3.01Å; D68-R601 IonicContact OD1-NH2 2.65Å; D68-R601 IonicContact OD2-CZ 3.3Å; D68-R601 IonicContact OD2-NH1 3.48Å; D68-R601 PolarHBondContact OD2-NH1 2.84Å; D68-R601 IonicContact OD2-NH2 3.68Å; D68-R601 PolarHBondContact OD2-NH2 3.16Å
69	F	53	Low	37.1	Very low	8 Å²	8	87.2 Å²	87.2	4%	0.035	48%	0.481	C	S	.	.	S	Bend	trans	-141.1	85.3	173.7	-63.1	-89.6	0	0	0	108.9	A66 A71 R339 L340 L565 T658	A66-F69 CarbonylContact O-C 3.56Å; F69-A71 PolarHBondContact O-N 2.64Å; F69-R339 PolarHBondContact O-NH1 3.41Å; F69-R339 PolarHBondContact O-NH2 2.89Å; F69-L340 HydrophobicContact CD1-CD2 3.92Å; F69-L340 HydrophobicContact CD2-CD2 3.79Å; F69-L340 HydrophobicContact CE1-CD2 3.59Å; F69-L340 HydrophobicContact CE2-CD2 3.48Å; F69-L340 VanDerWaalsContact CE2-CD2 3.48Å; F69-L340 HydrophobicContact CG-CD2 4.03Å; F69-L340 HydrophobicContact CZ-CD2 3.38Å; F69-L565 HydrophobicContact CD2-CD2 4.43Å; F69-L565 HydrophobicContact CE2-CB 3.58Å; F69-L565 HydrophobicContact CE2-CD2 3.76Å; F69-L565 HydrophobicContact CE2-CG 4.28Å; F69-L565 HydrophobicContact CZ-CB 3.91Å; F69-T658 HydrophobicContact CD1-CG2 4.02Å; F69-T658 HydrophobicContact CE1-CG2 3.94Å
70	P	41.9	Very low	37.1	Very low	50 Å²	50	88.3 Å²	88.3	33%	0.325	48%	0.478	S	S	.	.			trans	-59.1	134.4	176.4	17.5	-22.9	0	0	0	108.6	A66 Y636	A66-P70 WeakPolarHBondContact O-CA 3.39Å; A66-P70 VanDerWaalsContact O-CB 3.27Å; A66-P70 WeakPolarHBondContact O-CB 3.14Å; A66-P70 WeakPolarHBondContact O-CD 3.31Å; P70-Y636 HydrophobicContact CG-CE1 3.92Å; P70-Y636 WeakPolarHBondContact CG-OH 3.39Å; P70-Y636 PolarHBondContact O-OH 2.84Å; P70-Y636 VanDerWaalsContact O-OH 3.06Å
71	A	39.5	Very low	37.1	Very low	28 Å²	28	90.4 Å²	90.4	23%	0.231	50%	0.495	C	S	.	.			trans	-68.1	173.9	173	0	0	0	0	0	109.5	F69 D73	F69-A71 PolarHBondContact O-N 2.64Å; A71-D73 WeakPolarHBondContact CB-OD2 3.24Å; A71-D73 PolarHBondContact O-N 2.96Å
72	N	40.2	Very low	36.8	Very low	54 Å²	54	90.9 Å²	90.9	29%	0.289	50%	0.5	S	S	.	.	S	Bend	trans	-75.9	-10.8	174.6	-76.8	7.9	0	0	0	112.4	S74 K640 R644	N72-S74 PolarHBondContact O-N 2.86Å; N72-K640 WeakPolarHBondContact OD1-CD 3.31Å; N72-R644 PolarHBondContact OD1-NH2 3.49Å
73	D	35.2	Very low	36.6	Very low	58 Å²	58	95.9 Å²	95.9	31%	0.31	54%	0.535	S	S	.	.			trans	-69.6	117.1	-174.4	-45.5	-76.8	0	0	0	112.4	A71 E75 R345	A71-D73 WeakPolarHBondContact CB-OD2 3.24Å; A71-D73 PolarHBondContact O-N 2.96Å; D73-E75 VanDerWaalsContact C-N 3.3Å; D73-E75 PolarHBondContact O-N 3.41Å; D73-R345 IonicContact OD1-CZ 3.65Å; D73-R345 IonicContact OD1-NE 3.49Å; D73-R345 PolarHBondContact OD1-NE 3.12Å; D73-R345 IonicContact OD1-NH2 2.69Å; D73-R345 PolarHBondContact OD1-NH2 3.07Å
74	S	30.7	Very low	36.4	Very low	103 Å²	103	96.1 Å²	96.1	72%	0.72	55%	0.549	S	S	*	.			trans	-91.6	34.6	-178.1	44.4	0	0	0	0	113.4	N72 N76	N72-S74 PolarHBondContact O-N 2.86Å; S74-N76 PolarHBondContact O-N 3.05Å
75	E	28.5	Very low	35.7	Very low	174 Å²	174	102.3 Å²	102.3	81%	0.813	59%	0.587	S	S	*	*			trans	-83.1	78.6	178.2	-72.7	-177	-171	0	0	111.7	D73	D73-E75 VanDerWaalsContact C-N 3.3Å; D73-E75 PolarHBondContact O-N 3.41Å
76	N	26.1	Very low	35.3	Very low	162 Å²	162	107.1 Å²	107.1	87%	0.866	62%	0.616	S	S	*	*			trans	-123.9	49.7	170.8	-136.2	-0	0	0	0	111	S74	S74-N76 PolarHBondContact O-N 3.05Å
77	F	27.2	Very low	34.9	Very low	203 Å²	203	109.4 Å²	109.4	89%	0.89	63%	0.628	S	S	*	*			trans	-107.3	113.6	169.7	-118.6	-88.2	0	0	0	109.3	P79	F77-P79 WeakPolarHBondContact O-CD 3.5Å
78	K	28.5	Very low	34.3	Very low	158 Å²	158	106.1 Å²	106.1	69%	0.687	63%	0.634	S	S	*	*			trans	-69.1	131.8	169.7	-78.3	179.4	158.6	-162.3	0	110	E80	K78-E80 HydrophobicContact CD-CG 4.49Å; K78-E80 WeakPolarHBondContact CD-OE1 3.44Å; K78-E80 WeakPolarHBondContact CE-OE1 3.41Å; K78-E80 IonicContact NZ-OE1 2.64Å; K78-E80 PolarHBondContact NZ-OE1 2.83Å
79	P	29.9	Very low	33.4	Very low	127 Å²	127	116.6 Å²	116.6	83%	0.825	67%	0.673	S	S	*	*			trans	-86	105.6	154.5	32.3	-26.1	0	0	0	108.7	F77	F77-P79 WeakPolarHBondContact O-CD 3.5Å
80	E	33.1	Very low	32.2	Very low	139 Å²	139	124 Å²	124	65%	0.65	71%	0.711	S	S	*	*			trans	-105.3	118.3	165.3	-80	-179.7	-168.9	0	0	109.7	K78	K78-E80 HydrophobicContact CD-CG 4.49Å; K78-E80 WeakPolarHBondContact CD-OE1 3.44Å; K78-E80 WeakPolarHBondContact CE-OE1 3.41Å; K78-E80 IonicContact NZ-OE1 2.64Å; K78-E80 PolarHBondContact NZ-OE1 2.83Å
81	D	32.5	Very low	31.8	Very low	163 Å²	163	125.4 Å²	125.4	87%	0.872	73%	0.734	S	S	*	*			trans	49.5	118.2	159.6	-59.3	-12	0	0	0	122
82	S	30.8	Very low	31.2	Very low	114 Å²	114	128.9 Å²	128.9	80%	0.797	76%	0.757	S	S	*	*			trans	-145.8	162.1	151.4	68.2	0	0	0	0	108.6
83	P	36.6	Very low	30.9	Very low	129 Å²	129	137.9 Å²	137.9	84%	0.838	79%	0.789	S	S	*	*			cis	-122.2	157.4	-0.9	39.1	-25.8	0	0	0	114.2
84	G	33.4	Very low	30.6	Very low	80 Å²	80	143 Å²	143	83%	0.825	81%	0.811	S	S	*	*			trans	-155.8	118.7	172	0	0	0	0	0	112.1
85	V	30.2	Very low	30.8	Very low	143 Å²	143	141.8 Å²	141.8	87%	0.867	82%	0.815	S	S	*	*			trans	-90.1	131.2	-179.3	177.3	0	0	0	0	110.3
86	V	32.6	Very low	31	Very low	140 Å²	140	141 Å²	141	85%	0.848	81%	0.809	S	S	*	*			trans	-178.6	142.6	135.6	143.6	0	0	0	0	112.4
87	S	30.2	Very low	31.1	Very low	116 Å²	116	139.5 Å²	139.5	81%	0.811	80%	0.801	S	S	*	*			trans	-45.6	145.8	177	-177.3	0	0	0	0	117.7
88	G	31.5	Very low	31.3	Very low	76 Å²	76	138.2 Å²	138.2	78%	0.784	80%	0.795	S	S	*	*			trans	-175.1	60.3	175.9	0	0	0	0	0	119.9
89	R	29.6	Very low	31.3	Very low	224 Å²	224	134.8 Å²	134.8	85%	0.845	79%	0.791	S	S	*	*			trans	5	129.6	161.3	-76.5	179.3	170.7	172.7	-3	122.2
90	I	28.9	Very low	31.3	Very low	163 Å²	163	135.2 Å²	135.2	84%	0.836	79%	0.791	S	S	*	*			trans	67.5	122.5	131	-56.1	167	0	0	0	119.5
91	G	32.1	Very low	31.2	Very low	79 Å²	79	133.9 Å²	133.9	81%	0.814	80%	0.795	S	S	*	*			trans	-179.9	112.3	160.8	0	0	0	0	0	112.5
92	S	28.4	Very low	31.2	Very low	102 Å²	102	137.6 Å²	137.6	71%	0.713	80%	0.796	S	S	*	*			trans	-115	143.9	-171.7	56.9	0	0	0	0	113.6
93	Y	33.9	Very low	31.2	Very low	243 Å²	243	139 Å²	139	95%	0.953	80%	0.795	S	S	*	*			trans	-141	149.2	154.6	-96.8	-79	0	0	0	111
94	Q	28.9	Very low	31.1	Very low	164 Å²	164	138.6 Å²	138.6	77%	0.766	79%	0.786	S	S	*	*			trans	-108.4	159.2	-169.5	-64.9	174.3	-62	0	0	112.9	F96	Q94-F96 HydrophobicContact CB-CE2 4.3Å
95	G	33.6	Very low	31.1	Very low	79 Å²	79	142.7 Å²	142.7	81%	0.814	78%	0.784	S	S	*	*			trans	-149.4	109.5	164.2	0	0	0	0	0	110.9
96	F	32	Very low	31.3	Very low	158 Å²	158	141.9 Å²	141.9	69%	0.693	78%	0.778	S	S	*	*			trans	-77.7	163.8	170.1	-60	-103.6	0	0	0	109.1	Q94	Q94-F96 HydrophobicContact CB-CE2 4.3Å
97	D	29.7	Very low	31.2	Very low	129 Å²	129	140.2 Å²	140.2	69%	0.69	77%	0.769	S	S	*	*			cis	-156.5	-164.8	-1	-129.5	-30.1	0	0	0	107.3
98	F	31.5	Very low	31.4	Very low	176 Å²	176	141.5 Å²	141.5	77%	0.772	77%	0.766	S	S	*	*			cis	-146.8	-170.8	9.4	-157.9	-101.6	0	0	0	109.5
99	S	26.9	Very low	31.4	Very low	86 Å²	86	145.3 Å²	145.3	60%	0.601	76%	0.764	S	S	*	*			trans	-137.7	148.4	-176.9	64.7	0	0	0	0	116.1
100	V	30.7	Very low	31.5	Very low	136 Å²	136	140.8 Å²	140.8	82%	0.824	76%	0.757	S	S	*	*			trans	-152.1	123.7	157.5	-174.3	0	0	0	0	111.6
101	P	30.9	Very low	31.7	Very low	111 Å²	111	140.3 Å²	140.3	72%	0.721	76%	0.756	S	S	*	*			trans	-131.3	163.8	152.4	37.8	-26.1	0	0	0	113.2
102	R	31.7	Very low	31.6	Very low	242 Å²	242	141.3 Å²	141.3	91%	0.913	75%	0.75	S	S	*	*			trans	-145.3	149.3	168.2	-77	-169.6	174	179.2	-2.1	111.6
103	N	31	Very low	32	Very low	144 Å²	144	143 Å²	143	77%	0.77	76%	0.756	S	S	*	*			trans	-115.8	-170.1	-175.7	-70.7	-6.8	0	0	0	112
104	N	35.7	Very low	31.8	Very low	120 Å²	120	140.3 Å²	140.3	64%	0.642	75%	0.751	S	S	*	*			trans	89.3	112.8	163.9	-62.1	60.4	0	0	0	114.7
105	E	33.3	Very low	31.9	Very low	166 Å²	166	136.2 Å²	136.2	78%	0.776	75%	0.754	S	S	*	*				87.8	149.5	79.5	-78.1	171.2	175.8	0	0	112.2
106	V	34.7	Very low	31.7	Very low	125 Å²	125	137.2 Å²	137.2	76%	0.758	75%	0.748	S	S	*	*			cis	-154.6	175.1	-0.5	105.2	0	0	0	0	112.5
107	T	30.3	Very low	31.9	Very low	105 Å²	105	136.3 Å²	136.3	64%	0.644	75%	0.751	S	S	*	*			trans	-39.6	154	-174.6	61.9	0	0	0	0	122.5
108	N	33.4	Very low	32	Very low	143 Å²	143	138 Å²	138	77%	0.765	75%	0.754	S	S	*	*				158.8	165.7	122.8	-79.7	-11.2	0	0	0	111
109	Q	32.4	Very low	32	Very low	156 Å²	156	134.1 Å²	134.1	73%	0.729	75%	0.745	S	S	*	*				178.5	135.1	-50.6	-122.6	-164.2	13.7	0	0	105.9
110	N	31.3	Very low	32.2	Very low	130 Å²	130	139.7 Å²	139.7	70%	0.695	76%	0.758	S	S	*	*			trans	65.2	157.2	162.6	-45.3	-7.7	0	0	0	116.1
111	D	33.7	Very low	32.3	Very low	153 Å²	153	136.4 Å²	136.4	82%	0.818	75%	0.752	S	S	*	*			cis	-152.1	-165.4	24.1	-122.1	-45.9	0	0	0	112.6
112	S	30.2	Very low	32.2	Very low	100 Å²	100	139 Å²	139	70%	0.699	76%	0.76	S	S	*	*			trans	-130.7	174.2	-164.5	63	0	0	0	0	116.2
113	V	35.6	Very low	32.3	Very low	136 Å²	136	131.8 Å²	131.8	82%	0.824	75%	0.747	S	S	*	*			trans	163.1	157.7	134.8	158	0	0	0	0	113.7
114	H	30.1	Very low	32.4	Very low	187 Å²	187	131.4 Å²	131.4	87%	0.866	75%	0.745	S	S	*	*			trans	-65.9	164.4	-173.1	-65.9	-80.8	0	0	0	119
115	G	31.2	Very low	32.2	Very low	79 Å²	79	131.7 Å²	131.7	81%	0.814	75%	0.746	S	S	*	*			trans	-153.7	145.9	144.7	0	0	0	0	0	110.3
116	S	29.9	Very low	32.2	Very low	99 Å²	99	132.2 Å²	132.2	69%	0.692	75%	0.745	S	S	*	*			trans	-138.6	-166.2	-174.9	56.2	0	0	0	0	112.3
117	D	35	Very low	31.9	Very low	140 Å²	140	132.7 Å²	132.7	75%	0.749	74%	0.744	S	S	*	*			trans	83	148.2	164.5	-46.3	-7	0	0	0	116.3
118	E	31.9	Very low	31.8	Very low	165 Å²	165	131.6 Å²	131.6	77%	0.771	74%	0.741	S	S	*	*			cis	-160.5	138.3	-23.9	-105.8	-146.1	143.9	0	0	112.1
119	V	31.5	Very low	31.6	Very low	93 Å²	93	130 Å²	130	56%	0.564	74%	0.736	S	S	*	*			trans	61.4	155.4	132.7	-165.6	0	0	0	0	123.2
120	F	31.8	Very low	31.5	Very low	203 Å²	203	130.8 Å²	130.8	89%	0.89	75%	0.745	S	S	*	*			trans	81.5	135.5	171.9	-56.7	-72.1	0	0	0	118.3
121	G	31.9	Very low	31.5	Very low	68 Å²	68	128.2 Å²	128.2	70%	0.701	75%	0.748	S	S	*	*			cis	-172.4	-179.4	-1.4	0	0	0	0	0	115.3
122	N	30.4	Very low	31.2	Very low	165 Å²	165	127.6 Å²	127.6	88%	0.882	75%	0.75	S	S	*	*			trans	-52.4	170	-173.2	-45.8	-21.1	0	0	0	115.2
123	S	33.3	Very low	31.3	Very low	90 Å²	90	127.5 Å²	127.5	63%	0.629	75%	0.747	S	S	*	*			cis	-174.4	155.6	37.5	57.6	0	0	0	0	115.2
124	D	32.5	Very low	30.9	Very low	137 Å²	137	129.4 Å²	129.4	73%	0.733	75%	0.747	S	S	*	*			trans	69	152.5	139.4	-61.7	1.3	0	0	0	120.6
125	L	32.4	Very low	30.9	Very low	126 Å²	126	124.9 Å²	124.9	66%	0.66	74%	0.741	S	S	*	*			cis	-164.1	153.8	-3.7	-137.4	62	0	0	0	112.2
126	F	32	Very low	30.8	Very low	176 Å²	176	132.6 Å²	132.6	77%	0.772	75%	0.746	S	S	*	*			trans	56.7	140.5	168.1	-70.7	-88.7	0	0	0	119.1
127	D	28.4	Very low	30.9	Very low	135 Å²	135	133.6 Å²	133.6	72%	0.722	75%	0.75	S	S	*	*			cis	77.2	136.2	29.2	-157.8	42.5	0	0	0	112.7
128	S	29.4	Very low	30.8	Very low	83 Å²	83	133.8 Å²	133.8	58%	0.58	76%	0.757	S	S	*	*			cis	-161.2	157.8	27.6	65.3	0	0	0	0	117.4
129	T	29.6	Very low	30.6	Very low	108 Å²	108	134.8 Å²	134.8	66%	0.663	76%	0.761	S	S	*	*			trans	60.1	123.5	141.3	54.2	0	0	0	0	126.6
130	L	29.8	Very low	30.4	Very low	174 Å²	174	139 Å²	139	91%	0.911	78%	0.775	S	S	*	*				65.4	137.4	123.7	-60.1	168.1	0	0	0	124
131	G	30.6	Very low	30.3	Very low	75 Å²	75	134.5 Å²	134.5	77%	0.773	76%	0.764	S	S	*	*			trans	150.4	96	148.7	0	0	0	0	0	119.5
132	V	27.5	Very low	30.4	Very low	140 Å²	140	138 Å²	138	85%	0.848	77%	0.766	S	S	*	*			trans	-146.3	144.4	171.7	-164.6	0	0	0	0	105.6
133	P	32.6	Very low	30.3	Very low	98 Å²	98	142.1 Å²	142.1	64%	0.636	77%	0.77	S	S	*	*				-160.7	-168	50.9	47.6	-25	0	0	0	119.8
134	Q	27.9	Very low	30.3	Very low	177 Å²	177	140.9 Å²	140.9	83%	0.827	76%	0.764	S	S	*	*			trans	67.8	123.4	153.2	-74.4	163.6	30.6	0	0	119.4
135	A	29.1	Very low	30.4	Very low	91 Å²	91	139.6 Å²	139.6	75%	0.752	76%	0.758	S	S	*	*				80.4	140.1	69.5	0	0	0	0	0	113.1
136	R	28.4	Very low	30.5	Very low	242 Å²	242	139.4 Å²	139.4	91%	0.913	76%	0.762	S	S	*	*			cis	-146.6	177	36.4	-91	-171.2	-176.3	-177.4	2.3	113.2
137	P	33.5	Very low	30.6	Very low	120 Å²	120	134.8 Å²	134.8	78%	0.779	75%	0.751	S	S	*	*			trans	-101.9	176.9	-166.3	40.9	-36.9	0	0	0	115.7
138	T	33	Very low	31.2	Very low	144 Å²	144	134.7 Å²	134.7	88%	0.883	75%	0.75	S	S	*	*			trans	-124.8	146.7	160.3	47.6	0	0	0	0	110.4
139	E	27.6	Very low	31.6	Very low	185 Å²	185	135 Å²	135	86%	0.864	75%	0.745	S	S	*	*			trans	-81.7	151.9	177.9	-58.8	161.8	125.8	0	0	110.9
140	E	26.8	Very low	31.9	Very low	181 Å²	181	134.8 Å²	134.8	85%	0.846	74%	0.74	S	S	*	*				178.9	156.7	119.5	-107.5	-172.3	179.9	0	0	115.5
141	V	30.4	Very low	32.2	Very low	109 Å²	109	132.5 Å²	132.5	66%	0.661	73%	0.728	S	S	*	*			trans	81.2	134.1	143	163	0	0	0	0	122.2
142	N	33.8	Very low	32.4	Very low	141 Å²	141	131 Å²	131	75%	0.754	71%	0.706	S	S	*	*			trans	72	109.3	161.3	-71.2	-9.6	0	0	0	123.2
143	R	27.8	Very low	32.8	Very low	253 Å²	253	127.7 Å²	127.7	96%	0.955	68%	0.683	S	S	*	*			trans	-77.9	112.1	154.1	-62.3	170.2	169.6	105.2	-4.2	109
144	A	34.1	Very low	32.9	Very low	63 Å²	63	127.1 Å²	127.1	52%	0.521	68%	0.681	S	S	.	*			trans	-147.7	-38.7	172	0	0	0	0	0	114.4	T146	A144-T146 PolarHBondContact O-N 2.61Å
145	D	33.4	Very low	33.1	Very low	110 Å²	110	125.8 Å²	125.8	59%	0.588	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-9.3	-158.2	-52.8	-49.9	0	0	0	116.7	S147 L149	D145-S147 PolarHBondContact O-N 3.11Å; D145-S147 VanDerWaalsContact O-N 3.16Å; D145-L149 HydrophobicContact CB-CD1 4.22Å; D145-L149 WeakPolarHBondContact O-CG 3.25Å; D145-L149 PolarHBondContact O-N 2.93Å
146	T	35	Very low	33.3	Very low	123 Å²	123	128.8 Å²	128.8	76%	0.755	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-11.9	-171.8	33.2	0	0	0	0	115.4	A144	A144-T146 PolarHBondContact O-N 2.61Å
147	S	34.6	Very low	33.5	Very low	78 Å²	78	124.4 Å²	124.4	55%	0.545	67%	0.665	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.6	-46.1	176.6	54.2	0	0	0	0	113	D145 L149 N150	D145-S147 PolarHBondContact O-N 3.11Å; D145-S147 VanDerWaalsContact O-N 3.16Å; S147-L149 VanDerWaalsContact C-N 3.33Å; S147-L149 PolarHBondContact O-N 2.59Å; S147-N150 PolarHBondContact O-N 3.44Å
148	L	40	Very low	33.2	Very low	133 Å²	133	123.4 Å²	123.4	70%	0.696	66%	0.656	S	S	*	*	H	α-helix	trans	-73	-24.4	-176.4	-63.7	176.1	0	0	0	113.3	N150 S152	L148-N150 VanDerWaalsContact C-N 3.27Å; L148-N150 PolarHBondContact O-N 3.22Å; L148-S152 PolarHBondContact O-N 3.25Å; L148-S152 PolarHBondContact O-OG 3.11Å
149	L	38.1	Very low	33	Very low	91 Å²	91	122.9 Å²	122.9	48%	0.476	65%	0.647	S	S	.	*	H	α-helix	trans	-65.2	-27.1	174	-73.7	171.3	0	0	0	113.2	D145 S147 S152 L153	D145-L149 HydrophobicContact CB-CD1 4.22Å; D145-L149 WeakPolarHBondContact O-CG 3.25Å; D145-L149 PolarHBondContact O-N 2.93Å; S147-L149 VanDerWaalsContact C-N 3.33Å; S147-L149 PolarHBondContact O-N 2.59Å; L149-S152 WeakPolarHBondContact CA-OG 3.43Å; L149-S152 PolarHBondContact O-N 2.92Å; L149-S152 PolarHBondContact O-OG 3.4Å; L149-L153 WeakPolarHBondContact O-CB 3.24Å; L149-L153 WeakPolarHBondContact O-CD1 3.09Å; L149-L153 PolarHBondContact O-N 2.74Å
150	N	36.2	Very low	33.2	Very low	103 Å²	103	118.3 Å²	118.3	55%	0.551	64%	0.635	S	S	*	*	H	α-helix	trans	-74.5	-32.6	-178.3	-71.7	-25.7	0	0	0	113.3	S147 L148 S154	S147-N150 PolarHBondContact O-N 3.44Å; L148-N150 VanDerWaalsContact C-N 3.27Å; L148-N150 PolarHBondContact O-N 3.22Å; N150-S154 PolarHBondContact O-N 2.88Å; N150-S154 PolarHBondContact O-OG 3.38Å
151	L	36	Very low	33.4	Very low	126 Å²	126	114.2 Å²	114.2	66%	0.66	63%	0.627	S	S	*	*	H	α-helix	trans	-73.1	-40.5	171.7	-89.7	72.6	0	0	0	111.4	S154 Q155	L151-S154 WeakPolarHBondContact O-CB 3.4Å; L151-S154 PolarHBondContact O-N 2.72Å; L151-S154 VanDerWaalsContact O-N 3.12Å; L151-Q155 PolarHBondContact O-N 2.91Å; L151-Q155 VanDerWaalsContact O-N 3.15Å
152	S	35.5	Very low	33.5	Very low	44 Å²	44	116 Å²	116	31%	0.308	63%	0.628	S	S	.	*	H	α-helix	trans	-72.4	-28.1	179.1	54.1	0	0	0	0	113.5	L148 L149 Q155 K156	L148-S152 PolarHBondContact O-N 3.25Å; L148-S152 PolarHBondContact O-OG 3.11Å; L149-S152 WeakPolarHBondContact CA-OG 3.43Å; L149-S152 PolarHBondContact O-N 2.92Å; L149-S152 PolarHBondContact O-OG 3.4Å; S152-Q155 PolarHBondContact O-N 3.33Å; S152-K156 VanDerWaalsContact O-CB 3.31Å; S152-K156 WeakPolarHBondContact O-CB 3.49Å; S152-K156 WeakPolarHBondContact O-CG 3.48Å; S152-K156 PolarHBondContact O-N 3.05Å
153	L	35.2	Very low	33.4	Very low	70 Å²	70	112.9 Å²	112.9	37%	0.366	62%	0.616	S	S	.	*	H	α-helix	trans	-66.4	-38.2	164.8	-100.9	71.7	0	0	0	111.9	L149 Q155 K156 L157	L149-L153 WeakPolarHBondContact O-CB 3.24Å; L149-L153 WeakPolarHBondContact O-CD1 3.09Å; L149-L153 PolarHBondContact O-N 2.74Å; L153-Q155 PolarHBondContact O-N 3.34Å; L153-K156 CarbonylContact O-C 3.6Å; L153-K156 PolarHBondContact O-N 3.38Å; L153-L157 WeakPolarHBondContact O-CB 3.3Å; L153-L157 WeakPolarHBondContact O-CG 3.5Å; L153-L157 PolarHBondContact O-N 3.33Å
154	S	34.8	Very low	33.7	Very low	85 Å²	85	106.7 Å²	106.7	59%	0.594	60%	0.602	S	S	*	*	H	α-helix	trans	-63.4	-25.8	177.1	-58.1	0	0	0	0	112.8	N150 L151 T158	N150-S154 PolarHBondContact O-N 2.88Å; N150-S154 PolarHBondContact O-OG 3.38Å; L151-S154 WeakPolarHBondContact O-CB 3.4Å; L151-S154 PolarHBondContact O-N 2.72Å; L151-S154 VanDerWaalsContact O-N 3.12Å; S154-T158 PolarHBondContact O-OG1 3.37Å
155	Q	31.9	Very low	33.6	Very low	149 Å²	149	110.7 Å²	110.7	70%	0.696	61%	0.61	S	S	*	*	H	α-helix	trans	-96.8	-21.5	174.8	-68.1	176.6	-24.4	0	0	113.8	L151 S152 L153 T158	L151-Q155 PolarHBondContact O-N 2.91Å; L151-Q155 VanDerWaalsContact O-N 3.15Å; S152-Q155 PolarHBondContact O-N 3.33Å; L153-Q155 PolarHBondContact O-N 3.34Å; Q155-T158 VanDerWaalsContact O-CB 3.31Å; Q155-T158 WeakPolarHBondContact O-CB 3.49Å; Q155-T158 PolarHBondContact O-N 2.91Å; Q155-T158 PolarHBondContact O-OG1 3.44Å
156	K	34	Very low	33.9	Very low	154 Å²	154	111.4 Å²	111.4	67%	0.67	61%	0.605	S	S	*	*	H	α-helix	trans	-89.4	-6.3	171.7	-75.1	-176.3	175	179.1	0	114.3	S152 L153 I159	S152-K156 VanDerWaalsContact O-CB 3.31Å; S152-K156 WeakPolarHBondContact O-CB 3.49Å; S152-K156 WeakPolarHBondContact O-CG 3.48Å; S152-K156 PolarHBondContact O-N 3.05Å; L153-K156 CarbonylContact O-C 3.6Å; L153-K156 PolarHBondContact O-N 3.38Å; K156-I159 WeakPolarHBondContact O-CD1 3.24Å; K156-I159 VanDerWaalsContact O-CG1 3.24Å; K156-I159 WeakPolarHBondContact O-CG1 3.36Å
157	L	31.2	Very low	33.9	Very low	151 Å²	151	109.4 Å²	109.4	79%	0.791	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-2.9	158.9	-74.3	166.3	0	0	0	112.2	L153 I159	L153-L157 WeakPolarHBondContact O-CB 3.3Å; L153-L157 WeakPolarHBondContact O-CG 3.5Å; L153-L157 PolarHBondContact O-N 3.33Å; L157-I159 PolarHBondContact O-N 3.46Å
158	T	27.3	Very low	33.8	Very low	98 Å²	98	111.2 Å²	111.2	60%	0.601	60%	0.6	S	S	*	*			trans	-89.7	39.2	170	-30.1	0	0	0	0	111.9	S154 Q155 S160	S154-T158 PolarHBondContact O-OG1 3.37Å; Q155-T158 VanDerWaalsContact O-CB 3.31Å; Q155-T158 WeakPolarHBondContact O-CB 3.49Å; Q155-T158 PolarHBondContact O-N 2.91Å; Q155-T158 PolarHBondContact O-OG1 3.44Å; T158-S160 PolarHBondContact O-N 3.09Å
159	I	30.3	Very low	33.5	Very low	134 Å²	134	113.3 Å²	113.3	69%	0.687	60%	0.603	S	S	*	*			trans	-72.8	128.7	179	-79.4	164.9	0	0	0	110.8	K156 L157	K156-I159 WeakPolarHBondContact O-CD1 3.24Å; K156-I159 VanDerWaalsContact O-CG1 3.24Å; K156-I159 WeakPolarHBondContact O-CG1 3.36Å; L157-I159 PolarHBondContact O-N 3.46Å
160	S	31.2	Very low	33.2	Very low	88 Å²	88	116.9 Å²	116.9	62%	0.615	62%	0.622	S	S	*	*			trans	58.5	71.6	175.7	59.1	0	0	0	0	116.5	T158 H162	T158-S160 PolarHBondContact O-N 3.09Å; S160-H162 PolarHBondContact O-N 3.32Å
161	S	30.4	Very low	32.9	Very low	96 Å²	96	122 Å²	122	67%	0.671	63%	0.634	S	S	*	*			trans	-67.5	60.9	150.7	58.7	0	0	0	0	111.6
162	H	32.3	Very low	32.6	Very low	147 Å²	147	122.4 Å²	122.4	68%	0.681	64%	0.641	S	S	*	*			trans	-92.3	20.5	165	-81	-65.5	0	0	0	111.3	S160 D164	S160-H162 PolarHBondContact O-N 3.32Å; H162-D164 VanDerWaalsContact C-N 3.31Å; H162-D164 PolarHBondContact O-N 2.98Å
163	S	32.6	Very low	32.5	Very low	74 Å²	74	126.3 Å²	126.3	52%	0.517	67%	0.666	S	S	.	*			trans	-65	-31.3	-179.4	40.5	0	0	0	0	113.6
164	D	32.7	Very low	32.3	Very low	123 Å²	123	125.9 Å²	125.9	66%	0.658	68%	0.678	S	S	*	*	S	Bend	trans	-87.2	-22.3	-155.2	-62.9	4.1	0	0	0	113.2	H162 S167	H162-D164 VanDerWaalsContact C-N 3.31Å; H162-D164 PolarHBondContact O-N 2.98Å; D164-S167 PolarHBondContact O-OG 3.29Å
165	E	32.7	Very low	31.9	Very low	148 Å²	148	129.6 Å²	129.6	69%	0.692	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-74.7	-26.4	175	-65.4	-164.3	130.4	0	0	113.4	S167 N168	E165-S167 PolarHBondContact O-N 3.25Å; E165-S167 VanDerWaalsContact O-N 3.14Å; E165-N168 PolarHBondContact O-N 3.11Å
166	R	39.3	Very low	31.8	Very low	124 Å²	124	129.5 Å²	129.5	47%	0.468	70%	0.695	S	S	.	*	G	3₁₀ helix	trans	-66.8	-15.3	-179.5	-78	-174.3	169.5	-171.8	-0.9	113.5	N168 Q539	R166-N168 PolarHBondContact O-N 2.98Å; R166-Q539 PolarHBondContact NH2-O 3.11Å
167	S	35.5	Very low	31.8	Very low	81 Å²	81	127.2 Å²	127.2	57%	0.566	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-59.2	-28.7	172.8	61.9	0	0	0	0	113.6	D164 E165	D164-S167 PolarHBondContact O-OG 3.29Å; E165-S167 PolarHBondContact O-N 3.25Å; E165-S167 VanDerWaalsContact O-N 3.14Å
168	N	32.5	Very low	32.1	Very low	117 Å²	117	123 Å²	123	63%	0.626	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-93.9	-4.7	-173.2	-77.3	-60	0	0	0	115.2	E165 R166	E165-N168 PolarHBondContact O-N 3.11Å; R166-N168 PolarHBondContact O-N 2.98Å
169	F	33	Very low	32.8	Very low	176 Å²	176	124 Å²	124	77%	0.772	69%	0.692	S	S	*	*			trans	-86.1	-1.4	-177.2	-90.2	-85.8	0	0	0	115.1	R171	F169-R171 PolarHBondContact O-N 2.88Å
170	L	32.7	Very low	33.5	Very low	166 Å²	166	120.5 Å²	120.5	87%	0.869	68%	0.678	S	S	*	*			trans	-76.2	47.8	166.6	-82.9	139.5	0	0	0	112.3
171	R	29.4	Very low	34.3	Very low	212 Å²	212	122.2 Å²	122.2	80%	0.8	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-92	130.5	164.9	-72.1	-171.9	176	-160.3	-1.3	109.2	F169 P173	F169-R171 PolarHBondContact O-N 2.88Å; R171-P173 WeakPolarHBondContact O-CD 3.46Å
172	T	29.7	Very low	35.7	Very low	134 Å²	134	125.9 Å²	125.9	82%	0.822	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-54.1	119.4	-172.7	50	0	0	0	0	112.9	G174	T172-G174 PolarHBondContact O-N 3.48Å
173	P	34.2	Very low	37.1	Very low	126 Å²	126	124 Å²	124	82%	0.818	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-66.8	124.4	162.9	28.2	-32	0	0	0	108.5	R171	R171-P173 WeakPolarHBondContact O-CD 3.46Å
174	G	29.7	Very low	38.8	Very low	61 Å²	61	123.3 Å²	123.3	63%	0.629	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-62.6	150.9	176.7	0	0	0	0	0	112	T172 N176	T172-G174 PolarHBondContact O-N 3.48Å; G174-N176 PolarHBondContact O-N 3.05Å
175	N	28.1	Very low	40.5	Very low	163 Å²	163	122.8 Å²	122.8	87%	0.872	68%	0.682	S	S	*	*	S	Bend	trans	-37.4	96	-175.8	-82.6	-17.3	0	0	0	114.4
176	N	29.6	Very low	42.5	Very low	146 Å²	146	118.1 Å²	118.1	78%	0.781	66%	0.658	S	S	*	*			trans	-148.9	34.9	170.2	-100.4	-34.9	0	0	0	111.4	G174 A178	G174-N176 PolarHBondContact O-N 3.05Å; N176-A178 PolarHBondContact O-N 3.36Å
177	S	34.5	Very low	44.2	Very low	106 Å²	106	119 Å²	119	74%	0.741	67%	0.667	S	S	*	*			trans	-72.2	54.7	168.3	63.7	0	0	0	0	111.4	T179	S177-T179 PolarHBondContact O-N 3.04Å
178	A	37.6	Very low	46.2	Very low	63 Å²	63	117 Å²	117	52%	0.521	65%	0.653	S	S	.	*			trans	-66.2	102.7	166.8	0	0	0	0	0	107.8	N176 R487	N176-A178 PolarHBondContact O-N 3.36Å; A178-R487 PolarHBondContact O-NH1 2.69Å; A178-R487 PolarHBondContact O-NH2 3.38Å
179	T	41.6	Very low	48.4	Very low	118 Å²	118	111.8 Å²	111.8	72%	0.724	63%	0.625	S	S	*	*			trans	-63.2	138.3	162	41.5	0	0	0	0	108.4	S177 S181	S177-T179 PolarHBondContact O-N 3.04Å; T179-S181 PolarHBondContact O-N 2.89Å
180	P	43.7	Very low	50.6	Low	61 Å²	61	105 Å²	105	40%	0.396	60%	0.598	S	S	.	*			trans	-60.3	126.1	172.7	24	-30.2	0	0	0	109	K182 D551	P180-K182 PolarHBondContact O-N 3.18Å; P180-K182 VanDerWaalsContact O-N 3.12Å; P180-D551 WeakPolarHBondContact CG-OD1 3.32Å
181	S	49.4	Very low	52.8	Low	125 Å²	125	99.5 Å²	99.5	87%	0.874	57%	0.573	S	S	*	*	S	Bend	trans	-73.9	-2	-170.4	54.9	0	0	0	0	114.5	T179	T179-S181 PolarHBondContact O-N 2.89Å
182	K	58.3	Low	55.1	Low	172 Å²	172	91.2 Å²	91.2	75%	0.748	54%	0.544	S	S	*	.	S	Bend	trans	-143.7	141.7	168.1	-63.5	-175.4	179.7	-178.5	0	108.1	P180	P180-K182 PolarHBondContact O-N 3.18Å; P180-K182 VanDerWaalsContact O-N 3.12Å
183	P	62.4	Low	57.4	Low	107 Å²	107	87.4 Å²	87.4	70%	0.695	52%	0.515	S	S	*	.			trans	-65.3	153.7	171.5	29.8	-35.3	0	0	0	111	D185 D551	P183-D185 PolarHBondContact O-N 3.28Å; P183-D551 WeakPolarHBondContact CA-OD2 3.36Å
184	I	68.8	Low	59.4	Low	60 Å²	60	83.5 Å²	83.5	31%	0.308	49%	0.49	S	S	.	.			trans	-65.8	123.2	176.3	-64.2	168.2	0	0	0	109.7	R186 P550 D551	I184-R186 PolarHBondContact O-N 3.29Å; I184-P550 HydrophobicContact CD1-CG 3.96Å; I184-D551 WeakPolarHBondContact CG1-OD2 3.46Å; I184-D551 PolarHBondContact N-OD2 3.48Å
185	D	68.5	Low	61.7	Low	112 Å²	112	85 Å²	85	60%	0.599	48%	0.479	S	S	*	.			trans	-75.7	93	178	179.5	16.8	0	0	0	112	P183 H187 S188	P183-D185 PolarHBondContact O-N 3.28Å; D185-H187 VanDerWaalsContact C-N 3.28Å; D185-H187 PolarHBondContact O-N 3.05Å; D185-H187 WeakPolarHBondContact OD1-CB 3.42Å; D185-H187 PolarHBondContact OD1-N 3.48Å; D185-S188 PolarHBondContact O-OG 3.28Å
186	R	73.6	Confident	64	Low	51 Å²	51	79.1 Å²	79.1	19%	0.192	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-10.6	174.8	-60.2	-172.3	-161.2	73.4	9.9	113.7	I184 S188 L189 V190 D549	I184-R186 PolarHBondContact O-N 3.29Å; R186-S188 PolarHBondContact O-N 2.94Å; R186-L189 PolarHBondContact O-N 3.4Å; R186-V190 WeakPolarHBondContact O-CG2 3.41Å; R186-V190 PolarHBondContact O-N 2.95Å; R186-D549 IonicContact CZ-OD2 2.83Å; R186-D549 VanDerWaalsContact CZ-OD2 3.28Å; R186-D549 IonicContact NE-OD2 3.02Å; R186-D549 PolarHBondContact NE-OD2 3.29Å; R186-D549 IonicContact NH2-OD2 2.74Å; R186-D549 PolarHBondContact NH2-OD2 2.92Å
187	H	74.7	Confident	65.9	Low	143 Å²	143	75.4 Å²	75.4	66%	0.662	43%	0.425	S	S	*	.	H	α-helix	trans	-61.1	-32.8	-177.7	-173.1	-90.2	0	0	0	111.7	D185 S191	D185-H187 VanDerWaalsContact C-N 3.28Å; D185-H187 PolarHBondContact O-N 3.05Å; D185-H187 WeakPolarHBondContact OD1-CB 3.42Å; D185-H187 PolarHBondContact OD1-N 3.48Å; H187-S191 WeakPolarHBondContact O-CB 3.46Å; H187-S191 PolarHBondContact O-N 3.42Å
188	S	78.2	Confident	67.4	Low	37 Å²	37	78.4 Å²	78.4	26%	0.259	43%	0.425	S	S	.	.	H	α-helix	trans	-55.6	-51.6	170.5	59.8	0	0	0	0	113	D185 R186 S191 E192	D185-S188 PolarHBondContact O-OG 3.28Å; R186-S188 PolarHBondContact O-N 2.94Å; S188-S191 PolarHBondContact O-N 2.93Å; S188-E192 PolarHBondContact O-N 3.45Å; S188-E192 VanDerWaalsContact O-N 3.07Å
189	L	78.9	Confident	68.6	Low	9 Å²	9	81.9 Å²	81.9	5%	0.047	43%	0.431	C	S	.	.	H	α-helix	trans	-69.8	-40.6	-179.6	-68.5	165.3	0	0	0	112.5	R186 S191 E192 Y193 A467 I474 F521	R186-L189 PolarHBondContact O-N 3.4Å; L189-S191 VanDerWaalsContact C-N 3.31Å; L189-S191 PolarHBondContact O-N 3.33Å; L189-E192 PolarHBondContact O-N 3.23Å; L189-Y193 WeakPolarHBondContact O-CB 3.31Å; L189-Y193 PolarHBondContact O-N 2.67Å; L189-A467 HydrophobicContact CB-CB 4.08Å; L189-A467 HydrophobicContact CD1-CB 4.18Å; L189-I474 HydrophobicContact CD2-CD1 3.83Å; L189-I474 HydrophobicContact CD2-CG2 4.31Å; L189-I474 HydrophobicContact CG-CD1 4.25Å; L189-I474 HydrophobicContact CG-CG2 4.42Å; L189-F521 HydrophobicContact CD2-CD1 3.88Å; L189-F521 HydrophobicContact CD2-CE1 4.36Å
190	V	79.7	Confident	69.5	Low	34 Å²	34	81.1 Å²	81.1	21%	0.206	43%	0.43	C	S	.	.	H	α-helix	trans	-67.2	-33.9	176.6	176.7	0	0	0	0	111.1	R186 S194 D438	R186-V190 WeakPolarHBondContact O-CG2 3.41Å; R186-V190 PolarHBondContact O-N 2.95Å; V190-S194 VanDerWaalsContact O-CB 3.31Å; V190-S194 WeakPolarHBondContact O-CB 3.1Å; V190-S194 PolarHBondContact O-N 2.73Å; V190-S194 PolarHBondContact O-OG 3.07Å; V190-D438 HydrophobicContact CG2-CB 4.29Å
191	S	77.7	Confident	70.6	Confident	49 Å²	49	81.8 Å²	81.8	34%	0.343	44%	0.441	S	S	.	.	H	α-helix	trans	-65.3	-45.6	171.3	-173.4	0	0	0	0	111.7	H187 S188 L189 S194 K195	H187-S191 WeakPolarHBondContact O-CB 3.46Å; H187-S191 PolarHBondContact O-N 3.42Å; S188-S191 PolarHBondContact O-N 2.93Å; L189-S191 VanDerWaalsContact C-N 3.31Å; L189-S191 PolarHBondContact O-N 3.33Å; S191-S194 WeakPolarHBondContact O-CB 3.43Å; S191-S194 PolarHBondContact O-N 2.85Å; S191-K195 WeakPolarHBondContact O-CG 3.34Å; S191-K195 PolarHBondContact O-N 3.24Å
192	E	78	Confident	71.7	Confident	38 Å²	38	79.1 Å²	79.1	18%	0.178	42%	0.415	C	S	.	.	H	α-helix	trans	-66.1	-43.4	179.6	-153.9	78.7	155.8	0	0	112.1	S188 L189 S194 K195 L196 I474 F521	S188-E192 PolarHBondContact O-N 3.45Å; S188-E192 VanDerWaalsContact O-N 3.07Å; L189-E192 PolarHBondContact O-N 3.23Å; E192-S194 VanDerWaalsContact C-N 3.26Å; E192-S194 PolarHBondContact O-N 3.02Å; E192-K195 WeakPolarHBondContact O-CB 3.42Å; E192-K195 PolarHBondContact O-N 3.29Å; E192-K195 WeakPolarHBondContact OE2-CD 3.46Å; E192-K195 WeakPolarHBondContact OE2-CE 3.38Å; E192-K195 IonicContact OE2-NZ 2.67Å; E192-K195 PolarHBondContact OE2-NZ 3.39Å; E192-L196 WeakPolarHBondContact O-CG 3.43Å; E192-L196 PolarHBondContact O-N 3.34Å; E192-L196 VanDerWaalsContact O-N 3.08Å; E192-I474 HydrophobicContact CB-CD1 4.46Å; E192-F521 HydrophobicContact CG-CD2 4.14Å; E192-F521 HydrophobicContact CG-CE2 3.66Å; E192-F521 HydrophobicContact CG-CZ 4.13Å
193	Y	78.5	Confident	72.9	Confident	55 Å²	55	74 Å²	74	22%	0.216	39%	0.393	C	S	.	.	H	α-helix	trans	-53.3	-44.2	169.4	-178.6	-104.1	0	0	0	112	L189 K195 H197 V437 F523	L189-Y193 WeakPolarHBondContact O-CB 3.31Å; L189-Y193 PolarHBondContact O-N 2.67Å; Y193-K195 VanDerWaalsContact C-N 3.29Å; Y193-K195 PolarHBondContact O-N 3.18Å; Y193-H197 AromaticContact CD2-CD2 3.62Å; Y193-H197 AromaticContact CD2-NE2 3.76Å; Y193-H197 AromaticContact CE1-CD2 3.82Å; Y193-H197 AromaticContact CE2-CD2 3.17Å; Y193-H197 WeakPolarHBondContact CE2-CD2 3.46Å; Y193-H197 AromaticContact CE2-NE2 3.06Å; Y193-H197 WeakPolarHBondContact CE2-NE2 3.19Å; Y193-H197 AromaticContact CZ-CD2 3.26Å; Y193-H197 AromaticContact CZ-NE2 3.47Å; Y193-H197 PolarHBondContact O-N 3.24Å; Y193-V437 HydrophobicContact CD1-CB 4.22Å; Y193-V437 HydrophobicContact CD1-CG1 4.14Å; Y193-V437 HydrophobicContact CD1-CG2 4.13Å; Y193-V437 HydrophobicContact CD2-CG1 4.15Å; Y193-V437 HydrophobicContact CD2-CG2 4.02Å; Y193-V437 HydrophobicContact CE1-CB 4.29Å; Y193-V437 HydrophobicContact CE1-CG2 3.81Å; Y193-V437 HydrophobicContact CE2-CG2 3.68Å; Y193-V437 HydrophobicContact CG-CB 4.39Å; Y193-V437 HydrophobicContact CG-CG1 3.88Å; Y193-V437 HydrophobicContact CG-CG2 4.23Å; Y193-F523 HydrophobicContact CD2-CB 3.95Å; Y193-F523 AromaticContact CD2-CD1 3.55Å; Y193-F523 HydrophobicContact CD2-CD1 3.55Å; Y193-F523 AromaticContact CD2-CD2 3.92Å; Y193-F523 HydrophobicContact CD2-CD2 3.92Å; Y193-F523 AromaticContact CD2-CE1 3.96Å; Y193-F523 HydrophobicContact CD2-CE1 3.96Å; Y193-F523 HydrophobicContact CD2-CE2 4.28Å; Y193-F523 AromaticContact CD2-CG 3.53Å; Y193-F523 HydrophobicContact CD2-CG 3.53Å; Y193-F523 HydrophobicContact CD2-CZ 4.29Å; Y193-F523 HydrophobicContact CE2-CB 4.02Å; Y193-F523 HydrophobicContact CE2-CD1 4.45Å; Y193-F523 HydrophobicContact CE2-CD2 4.47Å; Y193-F523 HydrophobicContact CE2-CG 4.09Å; Y193-F523 HydrophobicContact CG-CD1 4.14Å; Y193-F523 HydrophobicContact CG-CE1 4.29Å
194	S	76.3	Confident	73.9	Confident	44 Å²	44	72.8 Å²	72.8	31%	0.308	38%	0.378	S	S	.	.	H	α-helix	trans	-67.5	-25.5	178.7	-62.6	0	0	0	0	113.5	V190 S191 E192 K198	V190-S194 VanDerWaalsContact O-CB 3.31Å; V190-S194 WeakPolarHBondContact O-CB 3.1Å; V190-S194 PolarHBondContact O-N 2.73Å; V190-S194 PolarHBondContact O-OG 3.07Å; S191-S194 WeakPolarHBondContact O-CB 3.43Å; S191-S194 PolarHBondContact O-N 2.85Å; E192-S194 VanDerWaalsContact C-N 3.26Å; E192-S194 PolarHBondContact O-N 3.02Å; S194-K198 VanDerWaalsContact O-CB 3.25Å; S194-K198 WeakPolarHBondContact O-CB 3.48Å; S194-K198 VanDerWaalsContact O-CD 3.24Å; S194-K198 WeakPolarHBondContact O-CD 3.33Å; S194-K198 WeakPolarHBondContact O-CG 3.33Å; S194-K198 PolarHBondContact O-N 3.1Å
195	K	78.5	Confident	74.8	Confident	92 Å²	92	71.6 Å²	71.6	40%	0.4	37%	0.372	S	S	.	.	H	α-helix	trans	-75.1	-57.6	173	-65.8	169.5	-158.9	165.5	0	110.2	S191 E192 Y193 H197 K198 E199	S191-K195 WeakPolarHBondContact O-CG 3.34Å; S191-K195 PolarHBondContact O-N 3.24Å; E192-K195 WeakPolarHBondContact O-CB 3.42Å; E192-K195 PolarHBondContact O-N 3.29Å; E192-K195 WeakPolarHBondContact OE2-CD 3.46Å; E192-K195 WeakPolarHBondContact OE2-CE 3.38Å; E192-K195 IonicContact OE2-NZ 2.67Å; E192-K195 PolarHBondContact OE2-NZ 3.39Å; Y193-K195 VanDerWaalsContact C-N 3.29Å; Y193-K195 PolarHBondContact O-N 3.18Å; K195-H197 PolarHBondContact O-N 3.04Å; K195-H197 VanDerWaalsContact O-N 3.12Å; K195-K198 PolarHBondContact O-N 3.08Å; K195-E199 WeakPolarHBondContact O-CB 3.44Å; K195-E199 WeakPolarHBondContact O-CG 3.46Å; K195-E199 PolarHBondContact O-N 3.06Å
196	L	74.6	Confident	75.9	Confident	39 Å²	39	66.4 Å²	66.4	20%	0.204	34%	0.344	C	S	.	.	H	α-helix	trans	-52.1	-40.9	-175.2	-67.6	167.4	0	0	0	112.7	E192 E202 F523	E192-L196 WeakPolarHBondContact O-CG 3.43Å; E192-L196 PolarHBondContact O-N 3.34Å; E192-L196 VanDerWaalsContact O-N 3.08Å; L196-E202 HydrophobicContact CD2-CG 4.47Å; L196-F523 HydrophobicContact CD1-CE2 3.83Å; L196-F523 HydrophobicContact CD1-CZ 3.91Å
197	H	70.5	Confident	76.8	Confident	68 Å²	68	64 Å²	64	32%	0.315	33%	0.334	S	S	.	.	H	α-helix	trans	-84.1	-25.1	177	-71.4	-50.3	0	0	0	115.6	Y193 K195	Y193-H197 AromaticContact CD2-CD2 3.62Å; Y193-H197 AromaticContact CD2-NE2 3.76Å; Y193-H197 AromaticContact CE1-CD2 3.82Å; Y193-H197 AromaticContact CE2-CD2 3.17Å; Y193-H197 WeakPolarHBondContact CE2-CD2 3.46Å; Y193-H197 AromaticContact CE2-NE2 3.06Å; Y193-H197 WeakPolarHBondContact CE2-NE2 3.19Å; Y193-H197 AromaticContact CZ-CD2 3.26Å; Y193-H197 AromaticContact CZ-NE2 3.47Å; Y193-H197 PolarHBondContact O-N 3.24Å; K195-H197 PolarHBondContact O-N 3.04Å; K195-H197 VanDerWaalsContact O-N 3.12Å
198	K	65.8	Low	77.7	Confident	169 Å²	169	57.1 Å²	57.1	74%	0.735	30%	0.303	S	S	*	.	H	α-helix	trans	-76.9	-37.2	173.4	-76.4	176.5	-172.6	175.7	0	111.9	S194 K195 S200	S194-K198 VanDerWaalsContact O-CB 3.25Å; S194-K198 WeakPolarHBondContact O-CB 3.48Å; S194-K198 VanDerWaalsContact O-CD 3.24Å; S194-K198 WeakPolarHBondContact O-CD 3.33Å; S194-K198 WeakPolarHBondContact O-CG 3.33Å; S194-K198 PolarHBondContact O-N 3.1Å; K195-K198 PolarHBondContact O-N 3.08Å; K198-S200 PolarHBondContact O-N 2.89Å
199	E	63.4	Low	78.5	Confident	136 Å²	136	55.4 Å²	55.4	64%	0.636	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-7	177.5	-69	167.5	-159.6	0	0	112.3	K195 A201	K195-E199 WeakPolarHBondContact O-CB 3.44Å; K195-E199 WeakPolarHBondContact O-CG 3.46Å; K195-E199 PolarHBondContact O-N 3.06Å; E199-A201 PolarHBondContact O-N 2.75Å
200	S	60.7	Low	79.3	Confident	102 Å²	102	55 Å²	55	71%	0.713	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	18.1	178.6	-55.7	0	0	0	0	114.6	K198 E202	K198-S200 PolarHBondContact O-N 2.89Å; S200-E202 VanDerWaalsContact C-N 3.35Å
201	A	65.8	Low	80	Confident	76 Å²	76	53.4 Å²	53.4	63%	0.628	28%	0.279	S	S	*	.			trans	-73	-27.4	-178.2	0	0	0	0	0	112.7	E199	E199-A201 PolarHBondContact O-N 2.75Å
202	E	73	Confident	80.7	Confident	68 Å²	68	51.1 Å²	51.1	32%	0.318	26%	0.263	S	S	.	.	S	Bend	trans	-114.2	125.3	-178.1	-60.4	-159.6	125.9	0	0	112.6	L196 S200	L196-E202 HydrophobicContact CD2-CG 4.47Å; S200-E202 VanDerWaalsContact C-N 3.35Å
203	K	82.6	Confident	81.3	Confident	65 Å²	65	50.8 Å²	50.8	28%	0.283	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-64	141.1	173.8	-70.2	-178	179.9	176.5	0	111	E279 T280 R284	K203-E279 HydrophobicContact CD-CG 4.35Å; K203-E279 WeakPolarHBondContact CE-OE2 3.43Å; K203-E279 IonicContact NZ-OE2 2.74Å; K203-E279 PolarHBondContact NZ-OE2 3.49Å; K203-T280 PolarHBondContact NZ-O 3.16Å; K203-R284 HydrophobicContact CB-CG 4.24Å
204	Q	84.8	Confident	81.8	Confident	82 Å²	82	49.8 Å²	49.8	38%	0.383	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	137	179.1	-66.4	174.1	-14.1	0	0	111.5	K283 R284	Q204-K283 HydrophobicContact CB-CG 3.94Å; Q204-K283 CarbonylContact O-C 3.4Å; Q204-K283 WeakPolarHBondContact O-CA 3.45Å; Q204-K283 VanDerWaalsContact O-CB 3.29Å; Q204-K283 WeakPolarHBondContact O-CB 3.46Å; Q204-K283 WeakPolarHBondContact O-CG 3.48Å; Q204-R284 PolarHBondContact O-N 3.14Å
205	I	87.8	Confident	82.3	Confident	35 Å²	35	51.9 Å²	51.9	18%	0.179	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	125.7	-179	-65.6	162.4	0	0	0	110.7	R284 R435 D526	I205-R284 WeakPolarHBondContact CA-O 3.42Å; I205-R284 HydrophobicContact CG1-CB 3.89Å; I205-R435 PolarHBondContact O-NH2 2.7Å; I205-D526 VanDerWaalsContact CD1-OD1 3.31Å; I205-D526 WeakPolarHBondContact CD1-OD1 3.23Å
206	I	91.3	Very high	83	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.01	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130.9	173.1	-61.3	-173	0	0	0	109.7	K283 R284 V285 A286 D308 A309 I430	I206-K283 HydrophobicContact CD1-CD 3.79Å; I206-K283 HydrophobicContact CD1-CG 4.28Å; I206-K283 HydrophobicContact CG1-CG 4.5Å; I206-R284 PolarHBondContact N-O 2.85Å; I206-V285 WeakPolarHBondContact O-CA 3.38Å; I206-A286 PolarHBondContact O-N 2.83Å; I206-D308 HydrophobicContact CG2-CB 4.48Å; I206-A309 HydrophobicContact CG2-CB 4.37Å; I206-I430 HydrophobicContact CD1-CB 4.07Å; I206-I430 HydrophobicContact CD1-CG2 4.08Å
207	N	92.7	Very high	83.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	118.5	176.2	-60	-0.5	0	0	0	109.7	M288 Q306 D308 A309 R462 G525	N207-M288 HydrophobicContact CB-CE 3.96Å; N207-Q306 VanDerWaalsContact CB-O 3.26Å; N207-Q306 WeakPolarHBondContact CB-O 3.35Å; N207-Q306 PolarHBondContact ND2-O 2.83Å; N207-D308 PolarHBondContact N-OD2 2.7Å; N207-D308 VanDerWaalsContact N-OD2 3.12Å; N207-D308 PolarHBondContact O-N 2.73Å; N207-A309 PolarHBondContact O-N 3.02Å; N207-A309 VanDerWaalsContact O-N 3.12Å; N207-R462 PolarHBondContact ND2-NE 3.22Å; N207-R462 PolarHBondContact ND2-NH2 2.87Å; N207-G525 PolarHBondContact ND2-O 3.41Å; N207-G525 VanDerWaalsContact ND2-O 3.14Å
208	L	93.8	Very high	84.8	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	117.7	-174	-179.1	65.3	0	0	0	110.5	V285 A286 L287 M288 A309 L311 I427	L208-V285 HydrophobicContact CB-CG1 3.77Å; L208-V285 HydrophobicContact CD2-CG1 3.98Å; L208-A286 PolarHBondContact N-O 3.04Å; L208-L287 HydrophobicContact CD2-CD1 4.09Å; L208-L287 HydrophobicContact CG-CD1 4.29Å; L208-L287 WeakPolarHBondContact O-CA 3.36Å; L208-M288 PolarHBondContact O-N 3.45Å; L208-A309 WeakPolarHBondContact CA-O 3.31Å; L208-A309 HydrophobicContact CD1-CB 3.99Å; L208-L311 HydrophobicContact CD1-CB 4.21Å; L208-I427 HydrophobicContact CD2-CD1 3.8Å; L208-I427 HydrophobicContact CD2-CG1 3.99Å; L208-I427 HydrophobicContact CD2-CG2 4.13Å
209	I	94.8	Very high	86.1	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	138	171.8	-176	162.7	0	0	0	111.7	M211 M288 A290 G303 A304 A307 A309 A310 L311	I209-M211 HydrophobicContact CD1-CE 3.78Å; I209-M211 HydrophobicContact CG1-CE 4.18Å; I209-M211 HydrophobicContact CG1-CG 4.2Å; I209-M211 HydrophobicContact CG2-CE 3.87Å; I209-M288 CarbonylContact C-O 3.56Å; I209-M288 WeakPolarHBondContact CA-O 3.49Å; I209-M288 HydrophobicContact CB-CB 4.4Å; I209-M288 HydrophobicContact CB-CE 4.43Å; I209-M288 HydrophobicContact CG1-CB 4.41Å; I209-A290 HydrophobicContact CD1-CB 3.9Å; I209-A290 HydrophobicContact CG1-CB 3.98Å; I209-G303 VanDerWaalsContact CD1-C 3.46Å; I209-A304 HydrophobicContact CD1-CB 4.12Å; I209-A307 HydrophobicContact CB-CB 3.92Å; I209-A307 HydrophobicContact CG2-CB 3.49Å; I209-A307 VanDerWaalsContact CG2-CB 3.49Å; I209-A309 PolarHBondContact N-O 2.78Å; I209-A309 VanDerWaalsContact N-O 3.14Å; I209-A310 HydrophobicContact CG2-CB 3.69Å; I209-A310 CarbonylContact O-C 3.52Å; I209-A310 VanDerWaalsContact O-CA 3.26Å; I209-A310 WeakPolarHBondContact O-CA 3.39Å; I209-L311 PolarHBondContact O-N 3.16Å
210	V	95.3	Very high	87.5	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	129	175.9	-169.7	0	0	0	0	109.4	K218 M222 L287 M288 A290 L311 V313	V210-K218 HydrophobicContact CG1-CB 3.95Å; V210-K218 HydrophobicContact CG1-CG 4.28Å; V210-M222 HydrophobicContact CG1-CG 4.26Å; V210-M222 HydrophobicContact CG2-CG 3.8Å; V210-M222 HydrophobicContact CG2-SD 3.68Å; V210-L287 HydrophobicContact CG2-CD1 3.56Å; V210-L287 HydrophobicContact CG2-CG 4.42Å; V210-M288 PolarHBondContact N-O 2.79Å; V210-A290 WeakPolarHBondContact O-CB 3.06Å; V210-A290 PolarHBondContact O-N 3.35Å; V210-L311 WeakPolarHBondContact CA-O 3.39Å; V210-L311 HydrophobicContact CG1-CD2 4.43Å; V210-L311 HydrophobicContact CG2-CD2 4.45Å; V210-V313 HydrophobicContact CG1-CG2 3.62Å
211	M	94.2	Very high	89.1	Confident	2 Å²	2	26 Å²	26	1%	0.01	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	154.5	-174	-70.6	-171.2	177.1	0	0	111.1	I209 V300 A304 L311 L312 V313 H334 A338	I209-M211 HydrophobicContact CD1-CE 3.78Å; I209-M211 HydrophobicContact CG1-CE 4.18Å; I209-M211 HydrophobicContact CG1-CG 4.2Å; I209-M211 HydrophobicContact CG2-CE 3.87Å; M211-V300 HydrophobicContact CE-CG1 3.94Å; M211-A304 HydrophobicContact CE-CB 3.56Å; M211-L311 PolarHBondContact N-O 3.43Å; M211-L312 HydrophobicContact CB-CD1 4.12Å; M211-L312 CarbonylContact O-C 3.56Å; M211-L312 WeakPolarHBondContact O-CA 3.32Å; M211-V313 PolarHBondContact O-N 3.11Å; M211-H334 HydrophobicContact CB-CB 4.1Å; M211-H334 HydrophobicContact CG-CB 4.42Å; M211-H334 HydrophobicContact SD-CB 3.97Å; M211-A338 HydrophobicContact CE-CB 4.11Å; M211-A338 HydrophobicContact SD-CB 3.95Å
212	G	92.5	Very high	90.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.8	-173.3	175.4	0	0	0	0	0	112.4	V313 H334	G212-V313 WeakPolarHBondContact CA-O 3.43Å; G212-H334 PolarHBondContact O-CE1 3.11Å; G212-H334 VanDerWaalsContact O-CE1 3.22Å; G212-H334 PolarHBondContact O-ND1 2.94Å
213	H	91.3	Very high	91.3	Very high	32 Å²	32	19.1 Å²	19.1	15%	0.148	10%	0.102	C	C	.	.			trans	-62.9	170.2	171.4	-161.1	24.2	0	0	0	111.2	A216 K218 Q330	H213-A216 HydrophobicContact CB-CB 4.1Å; H213-K218 PolarHBondContact O-NZ 3.3Å; H213-Q330 PolarHBondContact CE1-OE1 3.25Å; H213-Q330 PolarHBondContact ND1-OE1 2.67Å
214	V	87.7	Confident	91.7	Very high	34 Å²	34	16.2 Å²	16.2	21%	0.206	9%	0.089	C	C	.	.	S	Bend	trans	-56.3	-63.6	170.2	175.6	0	0	0	0	109.6	A216 K218 V269 H293	V214-A216 PolarHBondContact O-N 3.44Å; V214-A216 VanDerWaalsContact O-N 3.09Å; V214-K218 PolarHBondContact O-NZ 2.88Å; V214-V269 HydrophobicContact CG1-CG2 4.39Å; V214-H293 HydrophobicContact CG2-CB 4.42Å
215	D	87.8	Confident	92	Very high	88 Å²	88	12.4 Å²	12.4	47%	0.471	7%	0.071	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	9.6	-173	-53.9	-72.9	0	0	0	114.9	G217 N315 K352	D215-G217 PolarHBondContact O-N 2.97Å; D215-N315 PolarHBondContact O-ND2 3.42Å; D215-K352 WeakPolarHBondContact O-CE 3.36Å; D215-K352 PolarHBondContact O-NZ 3.19Å; D215-K352 VanDerWaalsContact O-NZ 3.14Å
216	A	91.5	Very high	92.1	Very high	0 Å²	0	11 Å²	11	0%	0	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-9.8	173.3	0	0	0	0	0	113.3	H213 V214 V313 N351	H213-A216 HydrophobicContact CB-CB 4.1Å; V214-A216 PolarHBondContact O-N 3.44Å; V214-A216 VanDerWaalsContact O-N 3.09Å; A216-V313 HydrophobicContact CB-CB 4.36Å; A216-V313 HydrophobicContact CB-CG1 4.16Å; A216-V313 VanDerWaalsContact O-CG1 3.22Å; A216-V313 WeakPolarHBondContact O-CG1 3.35Å; A216-N351 PolarHBondContact O-ND2 3.03Å
217	G	91.1	Very high	92.1	Very high	18 Å²	18	12.1 Å²	12.1	19%	0.186	7%	0.072	C	C	.	.			trans	73.5	32.6	174.2	0	0	0	0	0	114.9	D215 T220 L221	D215-G217 PolarHBondContact O-N 2.97Å; G217-T220 PolarHBondContact O-N 3.48Å; G217-L221 WeakPolarHBondContact O-CB 3.45Å; G217-L221 PolarHBondContact O-N 3.3Å
218	K	93	Very high	91.8	Very high	8 Å²	8	15 Å²	15	4%	0.035	9%	0.087	C	C	.	.	H	α-helix	trans	-50	-62.2	-178.6	-57.6	177.1	-56.7	-56.9	0	112.6	V210 H213 V214 T220 L221 M222 A290 V313	V210-K218 HydrophobicContact CG1-CB 3.95Å; V210-K218 HydrophobicContact CG1-CG 4.28Å; H213-K218 PolarHBondContact O-NZ 3.3Å; V214-K218 PolarHBondContact O-NZ 2.88Å; K218-T220 VanDerWaalsContact C-N 3.31Å; K218-T220 PolarHBondContact O-N 3.32Å; K218-L221 WeakPolarHBondContact O-CB 3.44Å; K218-L221 PolarHBondContact O-N 3.43Å; K218-L221 VanDerWaalsContact O-N 3.16Å; K218-M222 WeakPolarHBondContact O-CG 3.19Å; K218-M222 PolarHBondContact O-N 2.89Å; K218-A290 WeakPolarHBondContact CE-O 3.38Å; K218-V313 HydrophobicContact CG-CB 4.17Å; K218-V313 HydrophobicContact CG-CG2 4.22Å
219	S	93.4	Very high	91.5	Very high	9 Å²	9	16.9 Å²	16.9	6%	0.063	10%	0.097	C	C	.	.	H	α-helix	trans	-64.4	-35.4	-176.8	-33	0	0	0	0	112	G223 T270 D289	S219-G223 PolarHBondContact O-N 3.2Å; S219-T270 PolarHBondContact OG-OG1 3.18Å; S219-D289 VanDerWaalsContact CA-OD2 3.27Å; S219-D289 WeakPolarHBondContact CA-OD2 3.17Å; S219-D289 WeakPolarHBondContact CB-OD2 3.26Å; S219-D289 PolarHBondContact OG-OD2 2.76Å
220	T	92.9	Very high	91	Very high	26 Å²	26	19.6 Å²	19.6	16%	0.16	13%	0.125	C	C	.	.	H	α-helix	trans	-64.4	-46.2	173.3	-52.4	0	0	0	0	112	G217 K218 M222 N224 Y254	G217-T220 PolarHBondContact O-N 3.48Å; K218-T220 VanDerWaalsContact C-N 3.31Å; K218-T220 PolarHBondContact O-N 3.32Å; T220-M222 VanDerWaalsContact C-N 3.34Å; T220-M222 PolarHBondContact O-N 3.29Å; T220-N224 WeakPolarHBondContact O-CB 3.33Å; T220-N224 PolarHBondContact O-N 3.35Å; T220-Y254 HydrophobicContact CG2-CD2 4.18Å
221	L	93.7	Very high	90.4	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.3	-42.4	177.4	-176.8	69.7	0	0	0	111.3	G217 K218 L225 V313 A349 V387 G389 L395 L423	G217-L221 WeakPolarHBondContact O-CB 3.45Å; G217-L221 PolarHBondContact O-N 3.3Å; K218-L221 WeakPolarHBondContact O-CB 3.44Å; K218-L221 PolarHBondContact O-N 3.43Å; K218-L221 VanDerWaalsContact O-N 3.16Å; L221-L225 WeakPolarHBondContact O-CB 3.47Å; L221-L225 PolarHBondContact O-N 3.42Å; L221-L225 VanDerWaalsContact O-N 3.1Å; L221-V313 HydrophobicContact CD2-CG1 3.98Å; L221-V313 HydrophobicContact CD2-CG2 3.88Å; L221-A349 HydrophobicContact CD2-CB 4.26Å; L221-V387 HydrophobicContact CD1-CB 4.23Å; L221-V387 HydrophobicContact CD1-CG2 3.76Å; L221-V387 HydrophobicContact CD2-CG2 4.3Å; L221-G389 VanDerWaalsContact CD1-CA 3.49Å; L221-L395 HydrophobicContact CD1-CD1 4.34Å; L221-L395 HydrophobicContact CD1-CD2 3.35Å; L221-L395 HydrophobicContact CG-CD2 4.48Å; L221-L423 HydrophobicContact CD2-CD2 4.35Å; L221-L423 HydrophobicContact CG-CD2 4.45Å
222	M	92.4	Very high	89.9	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-75.3	-42.7	-180	-66.2	-58.6	95.4	0	0	113.3	V210 K218 T220 N224 L225 L226 L258 L287 L311 L423	V210-M222 HydrophobicContact CG1-CG 4.26Å; V210-M222 HydrophobicContact CG2-CG 3.8Å; V210-M222 HydrophobicContact CG2-SD 3.68Å; K218-M222 WeakPolarHBondContact O-CG 3.19Å; K218-M222 PolarHBondContact O-N 2.89Å; T220-M222 VanDerWaalsContact C-N 3.34Å; T220-M222 PolarHBondContact O-N 3.29Å; M222-N224 VanDerWaalsContact C-N 3.31Å; M222-N224 PolarHBondContact O-N 3.36Å; M222-L225 HydrophobicContact CE-CD2 4.21Å; M222-L225 WeakPolarHBondContact O-CB 3.29Å; M222-L225 PolarHBondContact O-N 3.42Å; M222-L225 HydrophobicContact SD-CD2 4.44Å; M222-L226 WeakPolarHBondContact O-CG 3.43Å; M222-L226 PolarHBondContact O-N 2.93Å; M222-L258 HydrophobicContact CB-CD1 3.61Å; M222-L287 HydrophobicContact CB-CD2 4.05Å; M222-L287 HydrophobicContact CG-CD2 4.05Å; M222-L287 HydrophobicContact SD-CD1 3.79Å; M222-L287 HydrophobicContact SD-CD2 3.74Å; M222-L287 HydrophobicContact SD-CG 4.36Å; M222-L311 HydrophobicContact CE-CD2 3.54Å; M222-L311 HydrophobicContact SD-CD2 4.17Å; M222-L423 HydrophobicContact CE-CD2 4.25Å
223	G	91.6	Very high	89.7	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60	-40.9	174.5	0	0	0	0	0	112.3	S219 L226 C227 Y254 I257	S219-G223 PolarHBondContact O-N 3.2Å; G223-L226 PolarHBondContact O-N 2.84Å; G223-C227 PolarHBondContact O-N 3.4Å; G223-C227 PolarHBondContact O-SG 2.57Å; G223-C227 VanDerWaalsContact O-SG 3.41Å; G223-Y254 WeakPolarHBondContact CA-O 3.3Å; G223-I257 WeakPolarHBondContact O-CD1 3.38Å
224	N	92	Very high	89.4	Confident	5 Å²	5	29.6 Å²	29.6	3%	0.027	19%	0.189	C	C	.	.	H	α-helix	trans	-67.5	-40.4	174.3	-163.4	-7.7	0	0	0	111.9	T220 M222 L226 C227 L228 Y254 G389 G392 L395	T220-N224 WeakPolarHBondContact O-CB 3.33Å; T220-N224 PolarHBondContact O-N 3.35Å; M222-N224 VanDerWaalsContact C-N 3.31Å; M222-N224 PolarHBondContact O-N 3.36Å; N224-L226 VanDerWaalsContact C-N 3.35Å; N224-L226 PolarHBondContact O-N 2.81Å; N224-C227 WeakPolarHBondContact O-CB 3.33Å; N224-C227 PolarHBondContact O-N 3.46Å; N224-L228 WeakPolarHBondContact O-CG 3.13Å; N224-L228 PolarHBondContact O-N 2.89Å; N224-Y254 HydrophobicContact CB-CD1 3.98Å; N224-Y254 HydrophobicContact CB-CD2 4.37Å; N224-Y254 HydrophobicContact CB-CE1 4.16Å; N224-Y254 HydrophobicContact CB-CG 4.1Å; N224-G389 WeakPolarHBondContact CB-O 3.43Å; N224-G389 PolarHBondContact ND2-O 3.23Å; N224-G392 WeakPolarHBondContact ND2-CA 3.29Å; N224-G392 PolarHBondContact ND2-N 2.69Å; N224-L395 HydrophobicContact CB-CD1 4.12Å
225	L	91.4	Very high	89.5	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-58.1	-44.3	172.6	-179.5	62.3	0	0	0	112	L221 M222 C227 L228 L229 F278 L395 V396	L221-L225 WeakPolarHBondContact O-CB 3.47Å; L221-L225 PolarHBondContact O-N 3.42Å; L221-L225 VanDerWaalsContact O-N 3.1Å; M222-L225 HydrophobicContact CE-CD2 4.21Å; M222-L225 WeakPolarHBondContact O-CB 3.29Å; M222-L225 PolarHBondContact O-N 3.42Å; M222-L225 HydrophobicContact SD-CD2 4.44Å; L225-C227 VanDerWaalsContact C-N 3.35Å; L225-C227 PolarHBondContact O-N 2.82Å; L225-L228 PolarHBondContact O-N 2.92Å; L225-L229 HydrophobicContact CD1-CD1 4.15Å; L225-L229 HydrophobicContact CD1-CG 4.32Å; L225-L229 HydrophobicContact CG-CD1 4.06Å; L225-L229 WeakPolarHBondContact O-CB 3.09Å; L225-L229 VanDerWaalsContact O-CG 3.3Å; L225-L229 WeakPolarHBondContact O-CG 3.41Å; L225-L229 PolarHBondContact O-N 3.07Å; L225-F278 HydrophobicContact CD2-CE1 4.5Å; L225-F278 HydrophobicContact CD2-CZ 4.26Å; L225-L395 HydrophobicContact CD1-CB 4.31Å; L225-V396 HydrophobicContact CD1-CG2 3.71Å
226	L	90.4	Very high	89.5	Confident	7 Å²	7	35.1 Å²	35.1	4%	0.037	21%	0.207	C	C	.	.	H	α-helix	trans	-65.5	-34.1	176	-68.9	173.4	0	0	0	112.9	M222 G223 N224 G230 H231 V232 I257 L258 T276 F278	M222-L226 WeakPolarHBondContact O-CG 3.43Å; M222-L226 PolarHBondContact O-N 2.93Å; G223-L226 PolarHBondContact O-N 2.84Å; N224-L226 VanDerWaalsContact C-N 3.35Å; N224-L226 PolarHBondContact O-N 2.81Å; L226-G230 PolarHBondContact O-N 3.37Å; L226-H231 HydrophobicContact CD2-CB 4.42Å; L226-H231 PolarHBondContact O-N 3.22Å; L226-V232 HydrophobicContact CB-CG2 4.3Å; L226-I257 HydrophobicContact CD1-CG2 4.27Å; L226-L258 HydrophobicContact CD1-CD2 3.99Å; L226-T276 HydrophobicContact CD1-CG2 4.36Å; L226-F278 HydrophobicContact CD2-CB 4.13Å; L226-F278 HydrophobicContact CD2-CD1 4.21Å
227	C	89.6	Confident	89.4	Confident	25 Å²	25	36.3 Å²	36.3	17%	0.169	21%	0.213	C	C	.	.	H	α-helix	trans	-66.3	-45.5	170.6	-74.4	0	0	0	0	112.6	G223 N224 L225 L229 G230 I257	G223-C227 PolarHBondContact O-N 3.4Å; G223-C227 PolarHBondContact O-SG 2.57Å; G223-C227 VanDerWaalsContact O-SG 3.41Å; N224-C227 WeakPolarHBondContact O-CB 3.33Å; N224-C227 PolarHBondContact O-N 3.46Å; L225-C227 VanDerWaalsContact C-N 3.35Å; L225-C227 PolarHBondContact O-N 2.82Å; C227-L229 VanDerWaalsContact C-N 3.3Å; C227-L229 PolarHBondContact O-N 3.27Å; C227-G230 PolarHBondContact O-N 3.36Å; C227-I257 WeakPolarHBondContact SG-CD1 3.46Å
228	L	88.2	Confident	89.3	Confident	59 Å²	59	37.8 Å²	37.8	31%	0.309	22%	0.224	S	C	.	.	H	α-helix	trans	-67.7	-29.5	179.8	-68.8	173.1	0	0	0	112.8	N224 L225 G230 L395 V396	N224-L228 WeakPolarHBondContact O-CG 3.13Å; N224-L228 PolarHBondContact O-N 2.89Å; L225-L228 PolarHBondContact O-N 2.92Å; L228-G230 VanDerWaalsContact C-N 3.26Å; L228-L395 HydrophobicContact CD1-CB 3.92Å; L228-L395 HydrophobicContact CD1-CD1 3.94Å; L228-L395 HydrophobicContact CD1-CG 4.34Å; L228-V396 HydrophobicContact CB-CG2 3.78Å; L228-V396 HydrophobicContact CD1-CG2 4.12Å
229	L	86.8	Confident	89.2	Confident	40 Å²	40	43.7 Å²	43.7	21%	0.209	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-5.7	171.4	-68.8	172.6	0	0	0	113.5	L225 C227 H231 F278 L424	L225-L229 HydrophobicContact CD1-CD1 4.15Å; L225-L229 HydrophobicContact CD1-CG 4.32Å; L225-L229 HydrophobicContact CG-CD1 4.06Å; L225-L229 WeakPolarHBondContact O-CB 3.09Å; L225-L229 VanDerWaalsContact O-CG 3.3Å; L225-L229 WeakPolarHBondContact O-CG 3.41Å; L225-L229 PolarHBondContact O-N 3.07Å; C227-L229 VanDerWaalsContact C-N 3.3Å; C227-L229 PolarHBondContact O-N 3.27Å; L229-H231 VanDerWaalsContact C-N 3.31Å; L229-H231 PolarHBondContact O-N 3.25Å; L229-F278 HydrophobicContact CD1-CB 3.89Å; L229-F278 HydrophobicContact CD1-CD2 3.58Å; L229-F278 HydrophobicContact CD1-CE2 4.21Å; L229-F278 HydrophobicContact CD1-CG 3.81Å; L229-L424 HydrophobicContact CD1-CD1 4.28Å; L229-L424 HydrophobicContact CD2-CD1 4.12Å; L229-L424 HydrophobicContact CD2-CD2 3.82Å
230	G	84.5	Confident	89.1	Confident	58 Å²	58	46 Å²	46	60%	0.598	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	8	178.6	0	0	0	0	0	115.4	L226 C227 L228 V232	L226-G230 PolarHBondContact O-N 3.37Å; C227-G230 PolarHBondContact O-N 3.36Å; L228-G230 VanDerWaalsContact C-N 3.26Å; G230-V232 PolarHBondContact O-N 2.95Å
231	H	82.3	Confident	88.9	Confident	79 Å²	79	48.2 Å²	48.2	37%	0.366	27%	0.266	S	S	.	.	S	Bend	trans	-69.6	-18.7	177	-72.1	-64.3	0	0	0	113.3	L226 L229 F278	L226-H231 HydrophobicContact CD2-CB 4.42Å; L226-H231 PolarHBondContact O-N 3.22Å; L229-H231 VanDerWaalsContact C-N 3.31Å; L229-H231 PolarHBondContact O-N 3.25Å; H231-F278 WeakPolarHBondContact NE2-CA 3.44Å; H231-F278 VanDerWaalsContact NE2-CB 3.34Å; H231-F278 WeakPolarHBondContact NE2-CB 3.41Å
232	V	84.1	Confident	88.7	Confident	22 Å²	22	55.9 Å²	55.9	13%	0.133	30%	0.295	C	S	.	.	S	Bend	trans	-116.3	125.4	175.2	-178.6	0	0	0	0	109.3	L226 G230 Q236 I257	L226-V232 HydrophobicContact CB-CG2 4.3Å; G230-V232 PolarHBondContact O-N 2.95Å; V232-Q236 HydrophobicContact CG1-CB 4.07Å; V232-I257 HydrophobicContact CG1-CD1 4.37Å; V232-I257 HydrophobicContact CG1-CG1 4.48Å; V232-I257 HydrophobicContact CG2-CD1 4.25Å; V232-I257 HydrophobicContact CG2-CG1 4.48Å; V232-I257 HydrophobicContact CG2-CG2 3.67Å
233	S	87.5	Confident	88.6	Confident	41 Å²	41	57.8 Å²	57.8	29%	0.287	31%	0.305	S	S	.	.			trans	-69	146.1	178.2	70.6	0	0	0	0	111.7	K235 Q236 L237	S233-K235 PolarHBondContact O-N 3.02Å; S233-K235 VanDerWaalsContact O-N 3.14Å; S233-Q236 WeakPolarHBondContact O-CB 3.35Å; S233-Q236 PolarHBondContact O-N 3.36Å; S233-Q236 VanDerWaalsContact OG-CD 3.23Å; S233-Q236 WeakPolarHBondContact OG-CG 3.43Å; S233-Q236 PolarHBondContact OG-N 3.05Å; S233-Q236 PolarHBondContact OG-OE1 3.39Å; S233-L237 PolarHBondContact O-N 3.47Å
234	S	85.7	Confident	88.4	Confident	102 Å²	102	57.8 Å²	57.8	71%	0.713	31%	0.305	S	S	*	.	H	α-helix	trans	-56	-31.2	175.2	55	0	0	0	0	112.9	L237 A238	S234-L237 PolarHBondContact O-N 3.01Å; S234-A238 VanDerWaalsContact O-CB 3.32Å; S234-A238 WeakPolarHBondContact O-CB 3.47Å; S234-A238 PolarHBondContact O-N 3.41Å
235	K	90.3	Very high	88.3	Confident	171 Å²	171	62.6 Å²	62.6	74%	0.743	33%	0.327	S	S	*	.	H	α-helix	trans	-67.2	-38.9	174.6	-171.6	178.4	-179.2	-178.8	0	112.7	S233 K239	S233-K235 PolarHBondContact O-N 3.02Å; S233-K235 VanDerWaalsContact O-N 3.14Å; K235-K239 PolarHBondContact O-N 3.2Å
236	Q	87.6	Confident	88.2	Confident	67 Å²	67	69 Å²	69	31%	0.313	36%	0.355	S	S	.	.	H	α-helix	trans	-68.9	-45.6	173	-74.6	156.8	-42.5	0	0	110.8	V232 S233 A238 K239 Y240	V232-Q236 HydrophobicContact CG1-CB 4.07Å; S233-Q236 WeakPolarHBondContact O-CB 3.35Å; S233-Q236 PolarHBondContact O-N 3.36Å; S233-Q236 VanDerWaalsContact OG-CD 3.23Å; S233-Q236 WeakPolarHBondContact OG-CG 3.43Å; S233-Q236 PolarHBondContact OG-N 3.05Å; S233-Q236 PolarHBondContact OG-OE1 3.39Å; Q236-A238 PolarHBondContact O-N 2.69Å; Q236-K239 WeakPolarHBondContact O-CB 3.39Å; Q236-K239 PolarHBondContact O-N 3.47Å; Q236-K239 VanDerWaalsContact O-N 3.11Å; Q236-Y240 HydrophobicContact CB-CE2 4.11Å; Q236-Y240 WeakPolarHBondContact O-CD2 3.14Å; Q236-Y240 PolarHBondContact O-N 3.47Å
237	L	88.3	Confident	88.1	Confident	25 Å²	25	72.8 Å²	72.8	13%	0.131	38%	0.375	C	S	.	.	H	α-helix	trans	-58.4	-45.4	176.6	-179	63.2	0	0	0	112	S233 S234 K239 Y240 Q241 Y254 I257	S233-L237 PolarHBondContact O-N 3.47Å; S234-L237 PolarHBondContact O-N 3.01Å; L237-K239 VanDerWaalsContact C-N 3.3Å; L237-K239 PolarHBondContact O-N 3.21Å; L237-Y240 PolarHBondContact O-N 2.82Å; L237-Q241 WeakPolarHBondContact O-CG 3.36Å; L237-Q241 PolarHBondContact O-N 3.12Å; L237-Y254 HydrophobicContact CD1-CD1 3.97Å; L237-Y254 HydrophobicContact CD1-CE1 4.04Å; L237-Y254 HydrophobicContact CD2-CE1 4.1Å; L237-I257 HydrophobicContact CD1-CD1 4.39Å
238	A	89.8	Confident	87.8	Confident	48 Å²	48	75 Å²	75	40%	0.397	40%	0.402	S	S	.	.	H	α-helix	trans	-61.7	-35.8	176.1	0	0	0	0	0	112.6	S234 Q236 W242	S234-A238 VanDerWaalsContact O-CB 3.32Å; S234-A238 WeakPolarHBondContact O-CB 3.47Å; S234-A238 PolarHBondContact O-N 3.41Å; Q236-A238 PolarHBondContact O-N 2.69Å; A238-W242 WeakPolarHBondContact O-CB 3.36Å; A238-W242 PolarHBondContact O-N 2.85Å
239	K	91	Very high	87.6	Confident	132 Å²	132	74 Å²	74	57%	0.574	40%	0.395	S	S	*	.	H	α-helix	trans	-64.5	-47.6	172	-175.4	-172.5	173.5	-170.9	0	111.3	K235 Q236 L237 Q241 W242 D243	K235-K239 PolarHBondContact O-N 3.2Å; Q236-K239 WeakPolarHBondContact O-CB 3.39Å; Q236-K239 PolarHBondContact O-N 3.47Å; Q236-K239 VanDerWaalsContact O-N 3.11Å; L237-K239 VanDerWaalsContact C-N 3.3Å; L237-K239 PolarHBondContact O-N 3.21Å; K239-Q241 VanDerWaalsContact C-N 3.33Å; K239-Q241 PolarHBondContact O-N 3.43Å; K239-W242 PolarHBondContact O-N 2.96Å; K239-D243 VanDerWaalsContact CE-OD2 3.26Å; K239-D243 WeakPolarHBondContact CE-OD2 3.42Å; K239-D243 WeakPolarHBondContact CG-OD2 3.43Å; K239-D243 PolarHBondContact O-N 3.38Å
240	Y	90.6	Very high	87.2	Confident	59 Å²	59	74.6 Å²	74.6	23%	0.231	41%	0.406	C	S	.	.	H	α-helix	trans	-62.8	-38.7	177.9	-62.5	-51.6	0	0	0	112.1	Q236 L237 A244 W256 I257	Q236-Y240 HydrophobicContact CB-CE2 4.11Å; Q236-Y240 WeakPolarHBondContact O-CD2 3.14Å; Q236-Y240 PolarHBondContact O-N 3.47Å; L237-Y240 PolarHBondContact O-N 2.82Å; Y240-A244 WeakPolarHBondContact O-CB 3.49Å; Y240-A244 PolarHBondContact O-N 2.8Å; Y240-W256 HydrophobicContact CD1-CB 4.41Å; Y240-W256 HydrophobicContact CD1-CE3 4.46Å; Y240-W256 HydrophobicContact CG-CB 4.44Å; Y240-I257 HydrophobicContact CD2-CG1 4.19Å; Y240-I257 HydrophobicContact CE2-CG1 4.32Å
241	Q	89.3	Confident	87	Confident	72 Å²	72	75.4 Å²	75.4	34%	0.336	40%	0.402	S	S	.	.	H	α-helix	trans	-59.3	-47.1	172.4	-72.9	171.8	-8.3	0	0	111.8	L237 K239 Q245 A253	L237-Q241 WeakPolarHBondContact O-CG 3.36Å; L237-Q241 PolarHBondContact O-N 3.12Å; K239-Q241 VanDerWaalsContact C-N 3.33Å; K239-Q241 PolarHBondContact O-N 3.43Å; Q241-Q245 WeakPolarHBondContact O-CB 3.35Å; Q241-Q245 WeakPolarHBondContact O-CG 3.46Å; Q241-Q245 PolarHBondContact O-N 3.13Å; Q241-A253 HydrophobicContact CB-CB 4.21Å; Q241-A253 HydrophobicContact CG-CB 3.47Å; Q241-A253 VanDerWaalsContact CG-CB 3.47Å
242	W	90.1	Very high	87	Confident	161 Å²	161	75 Å²	75	61%	0.61	40%	0.399	S	S	*	.	H	α-helix	trans	-65.5	-44.3	178.8	-177.5	-106.8	0	0	0	112.9	A238 K239 Q245 K246	A238-W242 WeakPolarHBondContact O-CB 3.36Å; A238-W242 PolarHBondContact O-N 2.85Å; K239-W242 PolarHBondContact O-N 2.96Å; W242-Q245 PolarHBondContact O-N 3.43Å; W242-K246 VanDerWaalsContact CD1-CE 3.49Å; W242-K246 VanDerWaalsContact NE1-CE 3.33Å; W242-K246 WeakPolarHBondContact O-CG 3.22Å; W242-K246 PolarHBondContact O-N 2.98Å
243	D	89.3	Confident	87.2	Confident	40 Å²	40	74.2 Å²	74.2	21%	0.214	40%	0.395	C	S	.	.	H	α-helix	trans	-72.1	-32.8	179.4	-68.3	-27.8	0	0	0	111.7	K239 K246 W256	K239-D243 VanDerWaalsContact CE-OD2 3.26Å; K239-D243 WeakPolarHBondContact CE-OD2 3.42Å; K239-D243 WeakPolarHBondContact CG-OD2 3.43Å; K239-D243 PolarHBondContact O-N 3.38Å; D243-K246 PolarHBondContact O-N 2.98Å; D243-K246 WeakPolarHBondContact OD1-CE 3.06Å; D243-K246 IonicContact OD1-NZ 2.81Å; D243-K246 PolarHBondContact OD1-NZ 2.81Å; D243-W256 HydrophobicContact CB-CZ3 3.76Å; D243-W256 WeakPolarHBondContact O-CH2 3.42Å
244	A	88.6	Confident	87.3	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-69.9	-36	171.9	0	0	0	0	0	112.7	Y240 K246 L247 G248 K249 W256	Y240-A244 WeakPolarHBondContact O-CB 3.49Å; Y240-A244 PolarHBondContact O-N 2.8Å; A244-K246 VanDerWaalsContact C-N 3.33Å; A244-K246 PolarHBondContact O-N 3.26Å; A244-L247 PolarHBondContact O-N 3.05Å; A244-G248 PolarHBondContact O-N 2.81Å; A244-K249 CarbonylContact O-C 3.53Å; A244-K249 WeakPolarHBondContact O-CA 3.46Å; A244-K249 PolarHBondContact O-N 2.8Å; A244-W256 VanDerWaalsContact CA-CH2 3.44Å; A244-W256 HydrophobicContact CB-CD2 4.07Å; A244-W256 HydrophobicContact CB-CE3 4.16Å; A244-W256 HydrophobicContact CB-CH2 3.98Å; A244-W256 HydrophobicContact CB-CZ2 3.87Å; A244-W256 HydrophobicContact CB-CZ3 4.12Å
245	Q	89.7	Confident	87.6	Confident	105 Å²	105	69.8 Å²	69.8	49%	0.491	36%	0.357	S	S	.	.	H	α-helix	trans	-60.3	-40.3	172.3	-78.6	165.5	11.2	0	0	112	Q241 W242 L247 G248 A250	Q241-Q245 WeakPolarHBondContact O-CB 3.35Å; Q241-Q245 WeakPolarHBondContact O-CG 3.46Å; Q241-Q245 PolarHBondContact O-N 3.13Å; W242-Q245 PolarHBondContact O-N 3.43Å; Q245-L247 VanDerWaalsContact C-N 3.28Å; Q245-L247 PolarHBondContact O-N 3.48Å; Q245-G248 PolarHBondContact O-N 3.21Å; Q245-A250 HydrophobicContact CG-CB 3.62Å
246	K	89.3	Confident	87.6	Confident	135 Å²	135	62.2 Å²	62.2	59%	0.587	32%	0.324	S	S	*	.	H	α-helix	trans	-59.7	-35.1	176	-66.5	170	-169.5	165.7	0	113.4	W242 D243 A244 G248	W242-K246 VanDerWaalsContact CD1-CE 3.49Å; W242-K246 VanDerWaalsContact NE1-CE 3.33Å; W242-K246 WeakPolarHBondContact O-CG 3.22Å; W242-K246 PolarHBondContact O-N 2.98Å; D243-K246 PolarHBondContact O-N 2.98Å; D243-K246 WeakPolarHBondContact OD1-CE 3.06Å; D243-K246 IonicContact OD1-NZ 2.81Å; D243-K246 PolarHBondContact OD1-NZ 2.81Å; A244-K246 VanDerWaalsContact C-N 3.33Å; A244-K246 PolarHBondContact O-N 3.26Å; K246-G248 VanDerWaalsContact C-N 3.28Å; K246-G248 PolarHBondContact O-N 2.94Å
247	L	86.7	Confident	87.6	Confident	88 Å²	88	59.9 Å²	59.9	46%	0.461	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	13	177.6	-60.3	-170.6	0	0	0	113.2	A244 Q245 K249 W256	A244-L247 PolarHBondContact O-N 3.05Å; Q245-L247 VanDerWaalsContact C-N 3.28Å; Q245-L247 PolarHBondContact O-N 3.48Å; L247-K249 PolarHBondContact O-N 3.45Å; L247-W256 HydrophobicContact CD1-CH2 3.7Å; L247-W256 HydrophobicContact CD1-CZ2 3.95Å; L247-W256 HydrophobicContact CG-CH2 4.21Å
248	G	84.9	Confident	87.7	Confident	71 Å²	71	58.8 Å²	58.8	73%	0.732	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.5	13.4	-177.7	0	0	0	0	0	114.4	A244 Q245 K246	A244-G248 PolarHBondContact O-N 2.81Å; Q245-G248 PolarHBondContact O-N 3.21Å; K246-G248 VanDerWaalsContact C-N 3.28Å; K246-G248 PolarHBondContact O-N 2.94Å
249	K	83.9	Confident	87.7	Confident	39 Å²	39	56.7 Å²	56.7	17%	0.17	29%	0.29	C	S	.	.			trans	-115.5	34.5	-168.8	-79.8	-178.4	165.5	-176	0	113.3	A244 L247 S251 F252 R265 N266 R267 G268	A244-K249 CarbonylContact O-C 3.53Å; A244-K249 WeakPolarHBondContact O-CA 3.46Å; A244-K249 PolarHBondContact O-N 2.8Å; L247-K249 PolarHBondContact O-N 3.45Å; K249-S251 PolarHBondContact O-N 2.92Å; K249-F252 HydrophobicContact CB-CD2 3.85Å; K249-F252 HydrophobicContact CG-CD2 4.06Å; K249-F252 HydrophobicContact CG-CE2 4.36Å; K249-F252 PolarHBondContact O-N 2.75Å; K249-R265 PolarHBondContact NZ-O 3.42Å; K249-R265 VanDerWaalsContact NZ-O 3.1Å; K249-N266 VanDerWaalsContact NZ-C 3.29Å; K249-N266 PolarHBondContact NZ-O 2.89Å; K249-R267 PolarHBondContact NZ-O 3.5Å; K249-G268 VanDerWaalsContact NZ-N 3.14Å
250	A	78.1	Confident	87.4	Confident	52 Å²	52	56.9 Å²	56.9	43%	0.43	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-51.1	-31.4	-173.1	0	0	0	0	0	115.3	Q245 F252	Q245-A250 HydrophobicContact CG-CB 3.62Å; A250-F252 VanDerWaalsContact C-N 3.32Å; A250-F252 PolarHBondContact O-N 3.04Å
251	S	79.3	Confident	87.2	Confident	75 Å²	75	56.8 Å²	56.8	52%	0.524	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-69.8	-21	177.7	48.1	0	0	0	0	114.8	K249 A253	K249-S251 PolarHBondContact O-N 2.92Å; S251-A253 VanDerWaalsContact C-N 3.34Å; S251-A253 PolarHBondContact O-N 3.42Å
252	F	83.4	Confident	87.2	Confident	71 Å²	71	57.3 Å²	57.3	31%	0.311	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-89.2	6.5	-174.2	-65.2	-87.9	0	0	0	113.9	K249 A250 Y254 A255 W256	K249-F252 HydrophobicContact CB-CD2 3.85Å; K249-F252 HydrophobicContact CG-CD2 4.06Å; K249-F252 HydrophobicContact CG-CE2 4.36Å; K249-F252 PolarHBondContact O-N 2.75Å; A250-F252 VanDerWaalsContact C-N 3.32Å; A250-F252 PolarHBondContact O-N 3.04Å; F252-Y254 PolarHBondContact O-N 3.34Å; F252-Y254 VanDerWaalsContact O-N 3.1Å; F252-A255 WeakPolarHBondContact O-CB 3.21Å; F252-A255 PolarHBondContact O-N 3.14Å; F252-W256 VanDerWaalsContact O-CD1 3.27Å; F252-W256 PolarHBondContact O-N 3.49Å
253	A	87.7	Confident	87.2	Confident	5 Å²	5	54.7 Å²	54.7	4%	0.041	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-28.2	-172.7	0	0	0	0	0	115.1	Q241 S251	Q241-A253 HydrophobicContact CB-CB 4.21Å; Q241-A253 HydrophobicContact CG-CB 3.47Å; Q241-A253 VanDerWaalsContact CG-CB 3.47Å; S251-A253 VanDerWaalsContact C-N 3.34Å; S251-A253 PolarHBondContact O-N 3.42Å
254	Y	89.9	Confident	87.2	Confident	47 Å²	47	53.2 Å²	53.2	18%	0.184	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-36.7	172.4	-64.8	-63.5	0	0	0	112.7	T220 G223 N224 L237 F252 W256 I257 L390	T220-Y254 HydrophobicContact CG2-CD2 4.18Å; G223-Y254 WeakPolarHBondContact CA-O 3.3Å; N224-Y254 HydrophobicContact CB-CD1 3.98Å; N224-Y254 HydrophobicContact CB-CD2 4.37Å; N224-Y254 HydrophobicContact CB-CE1 4.16Å; N224-Y254 HydrophobicContact CB-CG 4.1Å; L237-Y254 HydrophobicContact CD1-CD1 3.97Å; L237-Y254 HydrophobicContact CD1-CE1 4.04Å; L237-Y254 HydrophobicContact CD2-CE1 4.1Å; F252-Y254 PolarHBondContact O-N 3.34Å; F252-Y254 VanDerWaalsContact O-N 3.1Å; Y254-W256 VanDerWaalsContact C-N 3.3Å; Y254-W256 PolarHBondContact O-N 2.99Å; Y254-I257 HydrophobicContact CD1-CD1 4.49Å; Y254-I257 WeakPolarHBondContact O-CB 3.49Å; Y254-I257 WeakPolarHBondContact O-CD1 3.15Å; Y254-I257 WeakPolarHBondContact O-CG1 3.13Å; Y254-I257 PolarHBondContact O-N 3Å; Y254-L390 HydrophobicContact CD2-CD1 4.49Å; Y254-L390 HydrophobicContact CE2-CD1 4.32Å
255	A	91.3	Very high	87.3	Confident	3 Å²	3	55.8 Å²	55.8	3%	0.025	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-65.4	-35	178.8	0	0	0	0	0	111.7	F252 I257 L258 D259	F252-A255 WeakPolarHBondContact O-CB 3.21Å; F252-A255 PolarHBondContact O-N 3.14Å; A255-I257 PolarHBondContact O-N 2.9Å; A255-L258 PolarHBondContact O-N 2.95Å; A255-D259 WeakPolarHBondContact CB-OD2 3.42Å; A255-D259 PolarHBondContact O-N 2.89Å
256	W	89.9	Confident	87.3	Confident	11 Å²	11	55.8 Å²	55.8	4%	0.042	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-61.5	-10.7	178.3	-76.8	32.3	0	0	0	115.9	Y240 D243 A244 L247 F252 Y254 L258 R265	Y240-W256 HydrophobicContact CD1-CB 4.41Å; Y240-W256 HydrophobicContact CD1-CE3 4.46Å; Y240-W256 HydrophobicContact CG-CB 4.44Å; D243-W256 HydrophobicContact CB-CZ3 3.76Å; D243-W256 WeakPolarHBondContact O-CH2 3.42Å; A244-W256 VanDerWaalsContact CA-CH2 3.44Å; A244-W256 HydrophobicContact CB-CD2 4.07Å; A244-W256 HydrophobicContact CB-CE3 4.16Å; A244-W256 HydrophobicContact CB-CH2 3.98Å; A244-W256 HydrophobicContact CB-CZ2 3.87Å; A244-W256 HydrophobicContact CB-CZ3 4.12Å; L247-W256 HydrophobicContact CD1-CH2 3.7Å; L247-W256 HydrophobicContact CD1-CZ2 3.95Å; L247-W256 HydrophobicContact CG-CH2 4.21Å; F252-W256 VanDerWaalsContact O-CD1 3.27Å; F252-W256 PolarHBondContact O-N 3.49Å; Y254-W256 VanDerWaalsContact C-N 3.3Å; Y254-W256 PolarHBondContact O-N 2.99Å; W256-L258 VanDerWaalsContact C-N 3.34Å; W256-R265 HydrophobicContact CD2-CB 4.48Å; W256-R265 HydrophobicContact CD2-CG 3.89Å; W256-R265 HydrophobicContact CE3-CG 4.42Å; W256-R265 HydrophobicContact CG-CG 4.1Å; W256-R265 HydrophobicContact CH2-CB 4.47Å; W256-R265 HydrophobicContact CZ2-CB 3.89Å; W256-R265 HydrophobicContact CZ2-CG 4.22Å; W256-R265 PolarHBondContact O-NH2 3.19Å
257	I	89.6	Confident	87.2	Confident	18 Å²	18	55.3 Å²	55.3	9%	0.092	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-69.2	-35.4	169.6	-63.6	167.2	0	0	0	110.6	G223 L226 C227 V232 L237 Y240 Y254 A255	G223-I257 WeakPolarHBondContact O-CD1 3.38Å; L226-I257 HydrophobicContact CD1-CG2 4.27Å; C227-I257 WeakPolarHBondContact SG-CD1 3.46Å; V232-I257 HydrophobicContact CG1-CD1 4.37Å; V232-I257 HydrophobicContact CG1-CG1 4.48Å; V232-I257 HydrophobicContact CG2-CD1 4.25Å; V232-I257 HydrophobicContact CG2-CG1 4.48Å; V232-I257 HydrophobicContact CG2-CG2 3.67Å; L237-I257 HydrophobicContact CD1-CD1 4.39Å; Y240-I257 HydrophobicContact CD2-CG1 4.19Å; Y240-I257 HydrophobicContact CE2-CG1 4.32Å; Y254-I257 HydrophobicContact CD1-CD1 4.49Å; Y254-I257 WeakPolarHBondContact O-CB 3.49Å; Y254-I257 WeakPolarHBondContact O-CD1 3.15Å; Y254-I257 WeakPolarHBondContact O-CG1 3.13Å; Y254-I257 PolarHBondContact O-N 3Å; A255-I257 PolarHBondContact O-N 2.9Å
258	L	89	Confident	87.2	Confident	3 Å²	3	52 Å²	52	2%	0.016	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-44.5	-177.8	-64.4	172.2	0	0	0	111.5	M222 L226 A255 W256 Q260 A274 T276 D289	M222-L258 HydrophobicContact CB-CD1 3.61Å; L226-L258 HydrophobicContact CD1-CD2 3.99Å; A255-L258 PolarHBondContact O-N 2.95Å; W256-L258 VanDerWaalsContact C-N 3.34Å; L258-Q260 PolarHBondContact O-N 3.44Å; L258-A274 HydrophobicContact CB-CB 3.95Å; L258-A274 HydrophobicContact CD2-CB 4.22Å; L258-T276 HydrophobicContact CD2-CG2 3.5Å; L258-D289 HydrophobicContact CD1-CB 4.11Å
259	D	89.9	Confident	87.4	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.016	27%	0.268	C	S	.	.			trans	-66.6	93.4	172.2	-61.3	-31.1	0	0	0	108.8	A255 E264 R265 T270	A255-D259 WeakPolarHBondContact CB-OD2 3.42Å; A255-D259 PolarHBondContact O-N 2.89Å; D259-E264 HydrophobicContact CB-CB 3.87Å; D259-R265 HydrophobicContact CB-CG 4.39Å; D259-R265 PolarHBondContact O-NE 3.12Å; D259-R265 PolarHBondContact O-NH2 3.1Å; D259-T270 WeakPolarHBondContact OD1-CA 3.4Å; D259-T270 WeakPolarHBondContact OD1-CB 3.1Å; D259-T270 PolarHBondContact OD1-OG1 2.82Å
260	Q	84	Confident	87.7	Confident	137 Å²	137	49 Å²	49	64%	0.64	26%	0.262	S	S	*	.			trans	-89	-29.9	-176.1	-71.2	-173.1	32.4	0	0	113	L258 E264 R265	L258-Q260 PolarHBondContact O-N 3.44Å; Q260-E264 PolarHBondContact N-OE2 2.97Å; Q260-R265 PolarHBondContact O-NH1 2.91Å
261	T	88	Confident	88.3	Confident	56 Å²	56	47.8 Å²	47.8	34%	0.344	25%	0.248	S	C	.	.	S	Bend	trans	-75	159.2	-175.6	70.5	0	0	0	0	112.3	E264 R265	T261-E264 WeakPolarHBondContact CB-OE2 3.33Å; T261-E264 WeakPolarHBondContact CG2-OE2 3.34Å; T261-E264 PolarHBondContact N-OE2 3.47Å; T261-E264 VanDerWaalsContact N-OE2 3.16Å; T261-E264 WeakPolarHBondContact OG1-CB 3.32Å; T261-E264 WeakPolarHBondContact OG1-CG 3.45Å; T261-E264 PolarHBondContact OG1-N 3.29Å; T261-E264 VanDerWaalsContact OG1-N 3.11Å; T261-E264 PolarHBondContact OG1-OE2 3.18Å; T261-R265 WeakPolarHBondContact O-CG 3.49Å; T261-R265 PolarHBondContact O-N 3.06Å
262	S	88.2	Confident	88.7	Confident	84 Å²	84	48 Å²	48	59%	0.587	24%	0.243	S	C	*	.	H	α-helix	trans	-67.8	-35.4	171.2	45.1	0	0	0	0	112.1	N266	S262-N266 WeakPolarHBondContact O-CB 3.31Å; S262-N266 PolarHBondContact O-N 3.41Å; S262-N266 PolarHBondContact O-ND2 3.05Å
263	E	89.7	Confident	89	Confident	106 Å²	106	46.6 Å²	46.6	50%	0.495	24%	0.238	S	C	.	.	H	α-helix	trans	-67.9	-44.2	-179.4	-65.6	-161.7	-160.7	0	0	112.5	R265 N266 R267	E263-R265 PolarHBondContact O-N 2.99Å; E263-N266 PolarHBondContact O-N 3.42Å; E263-R267 WeakPolarHBondContact O-CB 3.41Å; E263-R267 WeakPolarHBondContact O-CG 3.21Å; E263-R267 PolarHBondContact O-N 3.41Å; E263-R267 IonicContact OE2-CZ 3.96Å; E263-R267 IonicContact OE2-NH1 3.68Å
264	E	90.6	Very high	89	Confident	8 Å²	8	47 Å²	47	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-60.8	-44.2	176.9	-71.3	165.3	137.7	0	0	111.7	D259 Q260 T261 G268 V269 M271 D272	D259-E264 HydrophobicContact CB-CB 3.87Å; Q260-E264 PolarHBondContact N-OE2 2.97Å; T261-E264 WeakPolarHBondContact CB-OE2 3.33Å; T261-E264 WeakPolarHBondContact CG2-OE2 3.34Å; T261-E264 PolarHBondContact N-OE2 3.47Å; T261-E264 VanDerWaalsContact N-OE2 3.16Å; T261-E264 WeakPolarHBondContact OG1-CB 3.32Å; T261-E264 WeakPolarHBondContact OG1-CG 3.45Å; T261-E264 PolarHBondContact OG1-N 3.29Å; T261-E264 VanDerWaalsContact OG1-N 3.11Å; T261-E264 PolarHBondContact OG1-OE2 3.18Å; E264-G268 VanDerWaalsContact O-CA 3.3Å; E264-G268 WeakPolarHBondContact O-CA 3.48Å; E264-G268 PolarHBondContact O-N 2.85Å; E264-V269 PolarHBondContact O-N 2.96Å; E264-M271 HydrophobicContact CG-CB 3.7Å; E264-M271 HydrophobicContact CG-CG 3.5Å; E264-M271 PolarHBondContact OE1-N 2.75Å; E264-D272 PolarHBondContact OE1-N 3.12Å
265	R	89.4	Confident	88.9	Confident	54 Å²	54	47.5 Å²	47.5	20%	0.204	25%	0.246	C	C	.	.	H	α-helix	trans	-66.2	-44.7	177.1	-67.2	175.9	178.6	147	-0.6	111.6	K249 W256 D259 Q260 T261 E263 G268	K249-R265 PolarHBondContact NZ-O 3.42Å; K249-R265 VanDerWaalsContact NZ-O 3.1Å; W256-R265 HydrophobicContact CD2-CB 4.48Å; W256-R265 HydrophobicContact CD2-CG 3.89Å; W256-R265 HydrophobicContact CE3-CG 4.42Å; W256-R265 HydrophobicContact CG-CG 4.1Å; W256-R265 HydrophobicContact CH2-CB 4.47Å; W256-R265 HydrophobicContact CZ2-CB 3.89Å; W256-R265 HydrophobicContact CZ2-CG 4.22Å; W256-R265 PolarHBondContact O-NH2 3.19Å; D259-R265 HydrophobicContact CB-CG 4.39Å; D259-R265 PolarHBondContact O-NE 3.12Å; D259-R265 PolarHBondContact O-NH2 3.1Å; Q260-R265 PolarHBondContact O-NH1 2.91Å; T261-R265 WeakPolarHBondContact O-CG 3.49Å; T261-R265 PolarHBondContact O-N 3.06Å; E263-R265 PolarHBondContact O-N 2.99Å; R265-G268 PolarHBondContact O-N 3.39Å
266	N	90.1	Very high	88.7	Confident	106 Å²	106	48.5 Å²	48.5	57%	0.567	25%	0.252	S	S	*	.	H	α-helix	trans	-66.3	-36.5	179.3	-74.2	-10.6	0	0	0	112.5	K249 S262 E263	K249-N266 VanDerWaalsContact NZ-C 3.29Å; K249-N266 PolarHBondContact NZ-O 2.89Å; S262-N266 WeakPolarHBondContact O-CB 3.31Å; S262-N266 PolarHBondContact O-N 3.41Å; S262-N266 PolarHBondContact O-ND2 3.05Å; E263-N266 PolarHBondContact O-N 3.42Å
267	R	88.6	Confident	88.6	Confident	124 Å²	124	48.3 Å²	48.3	47%	0.468	25%	0.252	S	S	.	.	H	α-helix	trans	-79.5	-40.9	173.8	-70.5	-179.1	173.3	155.8	4	112.3	K249 E263 M271	K249-R267 PolarHBondContact NZ-O 3.5Å; E263-R267 WeakPolarHBondContact O-CB 3.41Å; E263-R267 WeakPolarHBondContact O-CG 3.21Å; E263-R267 PolarHBondContact O-N 3.41Å; E263-R267 IonicContact OE2-CZ 3.96Å; E263-R267 IonicContact OE2-NH1 3.68Å; R267-M271 PolarHBondContact NH1-SD 3.02Å
268	G	86.8	Confident	88.6	Confident	18 Å²	18	47.5 Å²	47.5	19%	0.186	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.4	26.1	-172.4	0	0	0	0	0	112.5	K249 E264 R265	K249-G268 VanDerWaalsContact NZ-N 3.14Å; E264-G268 VanDerWaalsContact O-CA 3.3Å; E264-G268 WeakPolarHBondContact O-CA 3.48Å; E264-G268 PolarHBondContact O-N 2.85Å; R265-G268 PolarHBondContact O-N 3.39Å
269	V	88.6	Confident	88.5	Confident	41 Å²	41	49.1 Å²	49.1	25%	0.248	26%	0.255	C	S	.	.	S	Bend	trans	-143.2	122.4	-175.8	-177.9	0	0	0	0	107.5	V214 E264	V214-V269 HydrophobicContact CG1-CG2 4.39Å; E264-V269 PolarHBondContact O-N 2.96Å
270	T	90.2	Very high	88.3	Confident	7 Å²	7	49.5 Å²	49.5	4%	0.043	26%	0.257	C	S	.	.			trans	-57.7	132.8	170.9	-43.5	0	0	0	0	110.2	S219 D259 D272 P291	S219-T270 PolarHBondContact OG-OG1 3.18Å; D259-T270 WeakPolarHBondContact OD1-CA 3.4Å; D259-T270 WeakPolarHBondContact OD1-CB 3.1Å; D259-T270 PolarHBondContact OD1-OG1 2.82Å; T270-D272 WeakPolarHBondContact CG2-O 3.24Å; T270-P291 WeakPolarHBondContact O-CB 3.33Å
271	M	89.2	Confident	88.4	Confident	26 Å²	26	50 Å²	50	13%	0.128	26%	0.257	C	S	.	.			trans	-109.3	-47.8	-171.9	-66.5	-78.9	-55.9	0	0	110.2	E264 R267 F296	E264-M271 HydrophobicContact CG-CB 3.7Å; E264-M271 HydrophobicContact CG-CG 3.5Å; E264-M271 PolarHBondContact OE1-N 2.75Å; R267-M271 PolarHBondContact NH1-SD 3.02Å; M271-F296 HydrophobicContact CE-CD1 4.38Å; M271-F296 HydrophobicContact CE-CE1 3.53Å; M271-F296 HydrophobicContact CE-CE2 4.01Å; M271-F296 HydrophobicContact CE-CZ 3.34Å; M271-F296 HydrophobicContact SD-CD2 4.31Å; M271-F296 HydrophobicContact SD-CE1 4.17Å; M271-F296 HydrophobicContact SD-CE2 3.48Å; M271-F296 WeakPolarHBondContact SD-CE2 3.42Å; M271-F296 HydrophobicContact SD-CZ 3.42Å; M271-F296 WeakPolarHBondContact SD-CZ 3.3Å
272	D	88.9	Confident	88.3	Confident	79 Å²	79	49.7 Å²	49.7	42%	0.422	26%	0.258	S	S	.	.	S	Bend	trans	-112.4	175.3	-178.3	-70.8	-50.6	0	0	0	111.3	E264 T270 A274 Q299	E264-D272 PolarHBondContact OE1-N 3.12Å; T270-D272 WeakPolarHBondContact CG2-O 3.24Å; D272-A274 PolarHBondContact O-N 2.71Å; D272-Q299 PolarHBondContact OD1-NE2 3.16Å
273	I	89.9	Confident	88.3	Confident	43 Å²	43	46.4 Å²	46.4	22%	0.221	23%	0.233	C	C	.	.			trans	-87.2	108.7	-179.3	-70.2	161.7	0	0	0	110.6	Q275 M288 D289 Q299 G303	I273-Q275 HydrophobicContact CG2-CG 4.34Å; I273-Q275 PolarHBondContact O-N 3.12Å; I273-M288 HydrophobicContact CG2-CB 3.78Å; I273-M288 HydrophobicContact CG2-CG 4.05Å; I273-D289 WeakPolarHBondContact CA-O 3.46Å; I273-Q299 HydrophobicContact CD1-CB 4.34Å; I273-Q299 WeakPolarHBondContact CD1-O 3.47Å; I273-Q299 HydrophobicContact CG1-CB 4.48Å; I273-G303 VanDerWaalsContact CD1-CA 3.44Å; I273-G303 VanDerWaalsContact CD1-N 3.34Å
274	A	87.7	Confident	88.3	Confident	14 Å²	14	43 Å²	43	12%	0.116	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	112.9	168.2	0	0	0	0	0	110.1	L258 D272 D289	L258-A274 HydrophobicContact CB-CB 3.95Å; L258-A274 HydrophobicContact CD2-CB 4.22Å; D272-A274 PolarHBondContact O-N 2.71Å; A274-D289 PolarHBondContact O-N 2.83Å; A274-D289 VanDerWaalsContact O-N 3.13Å
275	Q	86.9	Confident	88.3	Confident	57 Å²	57	42.7 Å²	42.7	27%	0.266	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	126.6	169.9	-64.1	-164.8	-6.4	0	0	110.6	I273 L287 M288	I273-Q275 HydrophobicContact CG2-CG 4.34Å; I273-Q275 PolarHBondContact O-N 3.12Å; Q275-L287 WeakPolarHBondContact CA-O 3.35Å; Q275-M288 HydrophobicContact CG-CG 4.26Å
276	T	88	Confident	88.4	Confident	24 Å²	24	40.5 Å²	40.5	15%	0.147	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	170.8	171.8	50	0	0	0	0	110.3	L226 L258 L287	L226-T276 HydrophobicContact CD1-CG2 4.36Å; L258-T276 HydrophobicContact CD2-CG2 3.5Å; T276-L287 PolarHBondContact N-O 2.9Å; T276-L287 PolarHBondContact O-N 2.85Å
277	S	88.2	Confident	88.5	Confident	6 Å²	6	35.5 Å²	35.5	4%	0.042	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	149.1	174.9	44.6	0	0	0	0	111.7	V285 L496 C497 T499	S277-V285 WeakPolarHBondContact CA-O 3.41Å; S277-L496 PolarHBondContact OG-O 3.36Å; S277-C497 WeakPolarHBondContact CB-O 3.33Å; S277-C497 PolarHBondContact OG-O 2.79Å; S277-T499 WeakPolarHBondContact O-CG2 3.41Å
278	F	88.9	Confident	88.7	Confident	1 Å²	1	29.7 Å²	29.7	0%	0.004	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	159.1	172.2	65.5	-93.3	0	0	0	110.9	L225 L226 L229 H231 T280 V285 L287 L424 I427	L225-F278 HydrophobicContact CD2-CE1 4.5Å; L225-F278 HydrophobicContact CD2-CZ 4.26Å; L226-F278 HydrophobicContact CD2-CB 4.13Å; L226-F278 HydrophobicContact CD2-CD1 4.21Å; L229-F278 HydrophobicContact CD1-CB 3.89Å; L229-F278 HydrophobicContact CD1-CD2 3.58Å; L229-F278 HydrophobicContact CD1-CE2 4.21Å; L229-F278 HydrophobicContact CD1-CG 3.81Å; H231-F278 WeakPolarHBondContact NE2-CA 3.44Å; H231-F278 VanDerWaalsContact NE2-CB 3.34Å; H231-F278 WeakPolarHBondContact NE2-CB 3.41Å; F278-T280 HydrophobicContact CD2-CG2 4.39Å; F278-T280 HydrophobicContact CE2-CG2 3.99Å; F278-V285 HydrophobicContact CD1-CB 4.23Å; F278-V285 HydrophobicContact CD1-CG1 4.45Å; F278-V285 HydrophobicContact CD2-CB 4.16Å; F278-V285 HydrophobicContact CD2-CG2 4.39Å; F278-V285 HydrophobicContact CE1-CB 3.86Å; F278-V285 HydrophobicContact CE1-CG1 3.7Å; F278-V285 HydrophobicContact CE2-CB 3.78Å; F278-V285 HydrophobicContact CE2-CG1 4.24Å; F278-V285 HydrophobicContact CE2-CG2 3.81Å; F278-V285 HydrophobicContact CG-CB 4.38Å; F278-V285 HydrophobicContact CZ-CB 3.63Å; F278-V285 HydrophobicContact CZ-CG1 3.58Å; F278-V285 HydrophobicContact CZ-CG2 3.99Å; F278-V285 PolarHBondContact N-O 2.84Å; F278-V285 VanDerWaalsContact N-O 3.12Å; F278-V285 PolarHBondContact O-N 3.02Å; F278-L287 HydrophobicContact CD1-CB 4.37Å; F278-L287 HydrophobicContact CD1-CD2 4.5Å; F278-L287 HydrophobicContact CE1-CB 4.15Å; F278-L287 HydrophobicContact CE1-CD1 4.36Å; F278-L287 HydrophobicContact CE1-CD2 4.18Å; F278-L287 HydrophobicContact CE1-CG 4.48Å; F278-L424 HydrophobicContact CD2-CD1 4.4Å; F278-L424 HydrophobicContact CE2-CD1 3.88Å; F278-I427 HydrophobicContact CZ-CD1 4.35Å; F278-I427 HydrophobicContact CZ-CG2 4.35Å
279	E	86.7	Confident	89	Confident	38 Å²	38	28.9 Å²	28.9	18%	0.178	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	134.7	176.6	-75.3	-164.4	177.1	0	0	112	K203 R284	K203-E279 HydrophobicContact CD-CG 4.35Å; K203-E279 WeakPolarHBondContact CE-OE2 3.43Å; K203-E279 IonicContact NZ-OE2 2.74Å; K203-E279 PolarHBondContact NZ-OE2 3.49Å; E279-R284 HydrophobicContact CG-CG 3.75Å; E279-R284 IonicContact OE1-CZ 3.28Å; E279-R284 VanDerWaalsContact OE1-CZ 3.28Å; E279-R284 IonicContact OE1-NE 2.75Å; E279-R284 PolarHBondContact OE1-NE 3.45Å; E279-R284 IonicContact OE1-NH2 2.89Å; E279-R284 PolarHBondContact OE1-NH2 2.82Å
280	T	86	Confident	89.2	Confident	10 Å²	10	27 Å²	27	6%	0.061	14%	0.139	C	C	.	.			trans	-94.1	-169.2	165.4	70.6	0	0	0	0	109.8	K203 F278 S282 K283 V285 L424 D428	K203-T280 PolarHBondContact NZ-O 3.16Å; F278-T280 HydrophobicContact CD2-CG2 4.39Å; F278-T280 HydrophobicContact CE2-CG2 3.99Å; T280-S282 PolarHBondContact OG1-N 2.9Å; T280-K283 PolarHBondContact N-O 3.42Å; T280-K283 WeakPolarHBondContact OG1-CA 3.46Å; T280-K283 WeakPolarHBondContact OG1-CB 3.47Å; T280-K283 PolarHBondContact OG1-N 2.82Å; T280-K283 PolarHBondContact OG1-O 3.03Å; T280-V285 HydrophobicContact CG2-CG2 3.9Å; T280-L424 HydrophobicContact CG2-CD1 3.99Å; T280-D428 VanDerWaalsContact CB-OD1 3.3Å; T280-D428 WeakPolarHBondContact CB-OD1 3.44Å; T280-D428 HydrophobicContact CG2-CB 4.27Å; T280-D428 PolarHBondContact OG1-OD1 2.98Å
281	K	86.1	Confident	89.3	Confident	147 Å²	147	26.7 Å²	26.7	64%	0.639	14%	0.137	S	C	*	.	S	Bend	trans	-65.3	-45.1	173.6	-59.5	167.6	-174.6	163.2	0	110.7	D428	K281-D428 WeakPolarHBondContact CB-OD2 3.47Å
282	S	86.5	Confident	89.2	Confident	51 Å²	51	25.5 Å²	25.5	36%	0.357	13%	0.131	S	C	.	.	S	Bend	trans	-103.3	-21.4	-175.1	76.2	0	0	0	0	115.9	T280 D428	T280-S282 PolarHBondContact OG1-N 2.9Å; S282-D428 WeakPolarHBondContact CB-OD1 3.16Å; S282-D428 PolarHBondContact N-OD1 3.49Å; S282-D428 PolarHBondContact OG-OD1 2.89Å
283	K	87.5	Confident	89.2	Confident	15 Å²	15	25.2 Å²	25.2	7%	0.065	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	159.5	-165.1	-74.6	139.7	-166.6	175.4	0	113.9	Q204 I206 T280 D428 I430	Q204-K283 HydrophobicContact CB-CG 3.94Å; Q204-K283 CarbonylContact O-C 3.4Å; Q204-K283 WeakPolarHBondContact O-CA 3.45Å; Q204-K283 VanDerWaalsContact O-CB 3.29Å; Q204-K283 WeakPolarHBondContact O-CB 3.46Å; Q204-K283 WeakPolarHBondContact O-CG 3.48Å; I206-K283 HydrophobicContact CD1-CD 3.79Å; I206-K283 HydrophobicContact CD1-CG 4.28Å; I206-K283 HydrophobicContact CG1-CG 4.5Å; T280-K283 PolarHBondContact N-O 3.42Å; T280-K283 WeakPolarHBondContact OG1-CA 3.46Å; T280-K283 WeakPolarHBondContact OG1-CB 3.47Å; T280-K283 PolarHBondContact OG1-N 2.82Å; T280-K283 PolarHBondContact OG1-O 3.03Å; K283-D428 PolarHBondContact NZ-O 3.42Å; K283-I430 PolarHBondContact NZ-O 3.27Å
284	R	88.6	Confident	89	Confident	35 Å²	35	26.8 Å²	26.8	13%	0.132	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	127.5	159.5	-83.4	168.6	-179.1	154.7	7.8	107.8	K203 Q204 I205 I206 E279	K203-R284 HydrophobicContact CB-CG 4.24Å; Q204-R284 PolarHBondContact O-N 3.14Å; I205-R284 WeakPolarHBondContact CA-O 3.42Å; I205-R284 HydrophobicContact CG1-CB 3.89Å; I206-R284 PolarHBondContact N-O 2.85Å; E279-R284 HydrophobicContact CG-CG 3.75Å; E279-R284 IonicContact OE1-CZ 3.28Å; E279-R284 VanDerWaalsContact OE1-CZ 3.28Å; E279-R284 IonicContact OE1-NE 2.75Å; E279-R284 PolarHBondContact OE1-NE 3.45Å; E279-R284 IonicContact OE1-NH2 2.89Å; E279-R284 PolarHBondContact OE1-NH2 2.82Å
285	V	91.1	Very high	89.1	Confident	1 Å²	1	31 Å²	31	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	113.8	179.6	-176.6	0	0	0	0	108.3	I206 L208 S277 F278 T280 L287 I427	I206-V285 WeakPolarHBondContact O-CA 3.38Å; L208-V285 HydrophobicContact CB-CG1 3.77Å; L208-V285 HydrophobicContact CD2-CG1 3.98Å; S277-V285 WeakPolarHBondContact CA-O 3.41Å; F278-V285 HydrophobicContact CD1-CB 4.23Å; F278-V285 HydrophobicContact CD1-CG1 4.45Å; F278-V285 HydrophobicContact CD2-CB 4.16Å; F278-V285 HydrophobicContact CD2-CG2 4.39Å; F278-V285 HydrophobicContact CE1-CB 3.86Å; F278-V285 HydrophobicContact CE1-CG1 3.7Å; F278-V285 HydrophobicContact CE2-CB 3.78Å; F278-V285 HydrophobicContact CE2-CG1 4.24Å; F278-V285 HydrophobicContact CE2-CG2 3.81Å; F278-V285 HydrophobicContact CG-CB 4.38Å; F278-V285 HydrophobicContact CZ-CB 3.63Å; F278-V285 HydrophobicContact CZ-CG1 3.58Å; F278-V285 HydrophobicContact CZ-CG2 3.99Å; F278-V285 PolarHBondContact N-O 2.84Å; F278-V285 VanDerWaalsContact N-O 3.12Å; F278-V285 PolarHBondContact O-N 3.02Å; T280-V285 HydrophobicContact CG2-CG2 3.9Å; V285-L287 PolarHBondContact O-N 2.92Å; V285-I427 HydrophobicContact CG1-CG2 4.22Å; V285-I427 HydrophobicContact CG2-CG2 3.69Å
286	A	91.2	Very high	89.3	Confident	7 Å²	7	30.5 Å²	30.5	6%	0.058	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	107.1	169.9	0	0	0	0	0	107.9	I206 L208	I206-A286 PolarHBondContact O-N 2.83Å; L208-A286 PolarHBondContact N-O 3.04Å
287	L	92.5	Very high	89.4	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	128.7	-174.2	-173.9	68.6	0	0	0	110.5	L208 V210 M222 Q275 T276 F278 V285	L208-L287 HydrophobicContact CD2-CD1 4.09Å; L208-L287 HydrophobicContact CG-CD1 4.29Å; L208-L287 WeakPolarHBondContact O-CA 3.36Å; V210-L287 HydrophobicContact CG2-CD1 3.56Å; V210-L287 HydrophobicContact CG2-CG 4.42Å; M222-L287 HydrophobicContact CB-CD2 4.05Å; M222-L287 HydrophobicContact CG-CD2 4.05Å; M222-L287 HydrophobicContact SD-CD1 3.79Å; M222-L287 HydrophobicContact SD-CD2 3.74Å; M222-L287 HydrophobicContact SD-CG 4.36Å; Q275-L287 WeakPolarHBondContact CA-O 3.35Å; T276-L287 PolarHBondContact N-O 2.9Å; T276-L287 PolarHBondContact O-N 2.85Å; F278-L287 HydrophobicContact CD1-CB 4.37Å; F278-L287 HydrophobicContact CD1-CD2 4.5Å; F278-L287 HydrophobicContact CE1-CB 4.15Å; F278-L287 HydrophobicContact CE1-CD1 4.36Å; F278-L287 HydrophobicContact CE1-CD2 4.18Å; F278-L287 HydrophobicContact CE1-CG 4.48Å; V285-L287 PolarHBondContact O-N 2.92Å
288	M	92.3	Very high	89.5	Confident	3 Å²	3	30.8 Å²	30.8	2%	0.015	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	106	173.9	-69.4	167.8	-71.6	0	0	108.4	N207 L208 I209 V210 I273 Q275 Q306 A307	N207-M288 HydrophobicContact CB-CE 3.96Å; L208-M288 PolarHBondContact O-N 3.45Å; I209-M288 CarbonylContact C-O 3.56Å; I209-M288 WeakPolarHBondContact CA-O 3.49Å; I209-M288 HydrophobicContact CB-CB 4.4Å; I209-M288 HydrophobicContact CB-CE 4.43Å; I209-M288 HydrophobicContact CG1-CB 4.41Å; V210-M288 PolarHBondContact N-O 2.79Å; I273-M288 HydrophobicContact CG2-CB 3.78Å; I273-M288 HydrophobicContact CG2-CG 4.05Å; Q275-M288 HydrophobicContact CG-CG 4.26Å; M288-Q306 HydrophobicContact CE-CB 4.29Å; M288-Q306 HydrophobicContact SD-CB 3.75Å; M288-A307 HydrophobicContact CE-CB 3.97Å
289	D	93.6	Very high	89.6	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	130.7	169.5	-166.8	31	0	0	0	109.1	S219 L258 I273 A274	S219-D289 VanDerWaalsContact CA-OD2 3.27Å; S219-D289 WeakPolarHBondContact CA-OD2 3.17Å; S219-D289 WeakPolarHBondContact CB-OD2 3.26Å; S219-D289 PolarHBondContact OG-OD2 2.76Å; L258-D289 HydrophobicContact CD1-CB 4.11Å; I273-D289 WeakPolarHBondContact CA-O 3.46Å; A274-D289 PolarHBondContact O-N 2.83Å; A274-D289 VanDerWaalsContact O-N 3.13Å
290	A	92.4	Very high	89.8	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.008	16%	0.162	C	C	.	.			trans	-113.7	143.4	-174.5	0	0	0	0	0	111.4	I209 V210 K218 V300	I209-A290 HydrophobicContact CD1-CB 3.9Å; I209-A290 HydrophobicContact CG1-CB 3.98Å; V210-A290 WeakPolarHBondContact O-CB 3.06Å; V210-A290 PolarHBondContact O-N 3.35Å; K218-A290 WeakPolarHBondContact CE-O 3.38Å; A290-V300 HydrophobicContact CB-CG1 4.37Å; A290-V300 HydrophobicContact CB-CG2 4.19Å
291	P	92.8	Very high	90.2	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.006	16%	0.16	C	C	.	.			trans	-64.2	151.1	-175.4	27.9	-36.9	0	0	0	111.9	T270 F296 Q299 V300	T270-P291 WeakPolarHBondContact O-CB 3.33Å; P291-F296 HydrophobicContact CB-CB 3.68Å; P291-F296 HydrophobicContact CB-CD2 4.26Å; P291-F296 HydrophobicContact CB-CG 4.37Å; P291-F296 HydrophobicContact CG-CB 3.53Å; P291-Q299 HydrophobicContact CG-CB 4.04Å; P291-V300 HydrophobicContact CG-CG2 3.9Å; P291-V300 WeakPolarHBondContact O-CG2 3.27Å
292	G	87.8	Confident	90.4	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.01	13%	0.134	C	C	.	.			trans	-88.2	-25.4	-177.2	0	0	0	0	0	115	Q330	G292-Q330 PolarHBondContact O-NE2 3.38Å; G292-Q330 PolarHBondContact O-OE1 2.76Å
293	H	88.8	Confident	90.6	Very high	73 Å²	73	23.5 Å²	23.5	34%	0.338	12%	0.117	S	C	.	.	S	Bend	trans	-79.6	151.7	-166	-152.8	-110.1	0	0	0	113.3	V214 D295 F296	V214-H293 HydrophobicContact CG2-CB 4.42Å; H293-D295 IonicContact CE1-OD2 3.03Å; H293-D295 PolarHBondContact CE1-OD2 2.94Å; H293-D295 IonicContact ND1-OD2 2.73Å; H293-D295 PolarHBondContact ND1-OD2 3.3Å; H293-D295 PolarHBondContact O-N 2.82Å; H293-F296 HydrophobicContact CB-CD2 3.59Å; H293-F296 HydrophobicContact CB-CE2 3.81Å; H293-F296 PolarHBondContact O-N 2.87Å
294	K	86.4	Confident	90.8	Very high	76 Å²	76	22.8 Å²	22.8	33%	0.33	11%	0.114	S	C	.	.	G	3₁₀ helix	trans	-58.7	-32.5	-178.2	-169.2	-178.1	-177.4	-177.5	0	112.5	V297 E652	K294-V297 VanDerWaalsContact O-CG2 3.24Å; K294-V297 WeakPolarHBondContact O-CG2 3.43Å; K294-E652 IonicContact NZ-OE1 2.69Å; K294-E652 PolarHBondContact NZ-OE1 3.43Å
295	D	89.2	Confident	90.9	Very high	102 Å²	102	22.3 Å²	22.3	55%	0.545	12%	0.115	S	C	.	.	G	3₁₀ helix	trans	-76.6	-24.6	-175.8	-45.7	-41	0	0	0	112.9	H293 P298	H293-D295 IonicContact CE1-OD2 3.03Å; H293-D295 PolarHBondContact CE1-OD2 2.94Å; H293-D295 IonicContact ND1-OD2 2.73Å; H293-D295 PolarHBondContact ND1-OD2 3.3Å; H293-D295 PolarHBondContact O-N 2.82Å; D295-P298 VanDerWaalsContact O-CD 3.25Å; D295-P298 WeakPolarHBondContact O-CD 3.45Å
296	F	90.1	Very high	90.8	Very high	47 Å²	47	22.8 Å²	22.8	21%	0.206	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-99.1	7.8	-177.5	-47.8	-48	0	0	0	113.2	M271 P291 H293 Q299 V300	M271-F296 HydrophobicContact CE-CD1 4.38Å; M271-F296 HydrophobicContact CE-CE1 3.53Å; M271-F296 HydrophobicContact CE-CE2 4.01Å; M271-F296 HydrophobicContact CE-CZ 3.34Å; M271-F296 HydrophobicContact SD-CD2 4.31Å; M271-F296 HydrophobicContact SD-CE1 4.17Å; M271-F296 HydrophobicContact SD-CE2 3.48Å; M271-F296 WeakPolarHBondContact SD-CE2 3.42Å; M271-F296 HydrophobicContact SD-CZ 3.42Å; M271-F296 WeakPolarHBondContact SD-CZ 3.3Å; P291-F296 HydrophobicContact CB-CB 3.68Å; P291-F296 HydrophobicContact CB-CD2 4.26Å; P291-F296 HydrophobicContact CB-CG 4.37Å; P291-F296 HydrophobicContact CG-CB 3.53Å; H293-F296 HydrophobicContact CB-CD2 3.59Å; H293-F296 HydrophobicContact CB-CE2 3.81Å; H293-F296 PolarHBondContact O-N 2.87Å; F296-Q299 WeakPolarHBondContact O-CA 3.22Å; F296-Q299 WeakPolarHBondContact O-CB 3.37Å; F296-Q299 PolarHBondContact O-N 3.22Å; F296-V300 PolarHBondContact O-N 2.89Å
297	V	90.2	Very high	90.8	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-56.3	-28.2	170.7	-172.3	0	0	0	0	113.7	K294 Q299 V300 I301 L337	K294-V297 VanDerWaalsContact O-CG2 3.24Å; K294-V297 WeakPolarHBondContact O-CG2 3.43Å; V297-Q299 VanDerWaalsContact C-N 3.3Å; V297-Q299 PolarHBondContact O-N 3.46Å; V297-V300 HydrophobicContact CG1-CB 4.44Å; V297-V300 WeakPolarHBondContact O-CB 3.23Å; V297-V300 PolarHBondContact O-N 3.41Å; V297-I301 WeakPolarHBondContact O-CG1 3.2Å; V297-I301 PolarHBondContact O-N 3.12Å; V297-L337 HydrophobicContact CG1-CD1 3.29Å
298	P	90.6	Very high	90.7	Very high	37 Å²	37	23.8 Å²	23.8	24%	0.24	12%	0.123	C	C	.	.	H	α-helix	trans	-48.2	-45.4	162.2	-34.4	41.2	0	0	0	114.7	D295 I301 G302 Y582	D295-P298 VanDerWaalsContact O-CD 3.25Å; D295-P298 WeakPolarHBondContact O-CD 3.45Å; P298-I301 PolarHBondContact O-N 3.43Å; P298-G302 PolarHBondContact O-N 3.41Å; P298-Y582 HydrophobicContact CB-CE1 3.86Å; P298-Y582 HydrophobicContact CG-CE1 4.09Å
299	Q	90.7	Very high	90.8	Very high	80 Å²	80	23.8 Å²	23.8	37%	0.374	12%	0.123	S	C	.	.	H	α-helix	trans	-68.7	-44.1	176.2	-53.8	-58.8	51.9	0	0	110.3	D272 I273 P291 F296 V297 I301 G302 G303	D272-Q299 PolarHBondContact OD1-NE2 3.16Å; I273-Q299 HydrophobicContact CD1-CB 4.34Å; I273-Q299 WeakPolarHBondContact CD1-O 3.47Å; I273-Q299 HydrophobicContact CG1-CB 4.48Å; P291-Q299 HydrophobicContact CG-CB 4.04Å; F296-Q299 WeakPolarHBondContact O-CA 3.22Å; F296-Q299 WeakPolarHBondContact O-CB 3.37Å; F296-Q299 PolarHBondContact O-N 3.22Å; V297-Q299 VanDerWaalsContact C-N 3.3Å; V297-Q299 PolarHBondContact O-N 3.46Å; Q299-I301 PolarHBondContact O-N 3.02Å; Q299-I301 VanDerWaalsContact O-N 3.14Å; Q299-G302 WeakPolarHBondContact O-CA 3.09Å; Q299-G302 PolarHBondContact O-N 3.03Å; Q299-G303 PolarHBondContact O-N 2.71Å
300	V	92.6	Very high	90.8	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.006	12%	0.123	C	C	.	.	H	α-helix	trans	-53.3	-37.2	175.9	-174.6	0	0	0	0	111.9	M211 A290 P291 F296 V297 A304	M211-V300 HydrophobicContact CE-CG1 3.94Å; A290-V300 HydrophobicContact CB-CG1 4.37Å; A290-V300 HydrophobicContact CB-CG2 4.19Å; P291-V300 HydrophobicContact CG-CG2 3.9Å; P291-V300 WeakPolarHBondContact O-CG2 3.27Å; F296-V300 PolarHBondContact O-N 2.89Å; V297-V300 HydrophobicContact CG1-CB 4.44Å; V297-V300 WeakPolarHBondContact O-CB 3.23Å; V297-V300 PolarHBondContact O-N 3.41Å; V300-A304 WeakPolarHBondContact O-CB 3.43Å; V300-A304 PolarHBondContact O-N 3.03Å
301	I	92.6	Very high	91	Very high	3 Å²	3	23.7 Å²	23.7	2%	0.015	12%	0.123	C	C	.	.	H	α-helix	trans	-63.9	-47.1	173.5	-68.6	164.7	0	0	0	111.3	V297 P298 Q299 G303 A304 T305 L337 L341 Y582 M646	V297-I301 WeakPolarHBondContact O-CG1 3.2Å; V297-I301 PolarHBondContact O-N 3.12Å; P298-I301 PolarHBondContact O-N 3.43Å; Q299-I301 PolarHBondContact O-N 3.02Å; Q299-I301 VanDerWaalsContact O-N 3.14Å; I301-G303 VanDerWaalsContact C-N 3.33Å; I301-G303 PolarHBondContact O-N 3.15Å; I301-A304 PolarHBondContact O-N 3.3Å; I301-T305 PolarHBondContact O-N 3.2Å; I301-T305 VanDerWaalsContact O-N 3.12Å; I301-T305 PolarHBondContact O-OG1 3.24Å; I301-L337 HydrophobicContact CD1-CD2 4.34Å; I301-L337 HydrophobicContact CG1-CD1 4.21Å; I301-L337 HydrophobicContact CG1-CD2 4.08Å; I301-L341 HydrophobicContact CB-CD1 4.27Å; I301-L341 HydrophobicContact CG1-CD1 4.34Å; I301-L341 HydrophobicContact CG2-CD1 3.97Å; I301-L341 HydrophobicContact CG2-CD2 4.43Å; I301-Y582 HydrophobicContact CD1-CD1 4.26Å; I301-Y582 HydrophobicContact CD1-CG 4.18Å; I301-M646 HydrophobicContact CD1-CB 4.33Å
302	G	90.4	Very high	91.1	Very high	9 Å²	9	23.7 Å²	23.7	9%	0.093	12%	0.123	C	C	.	.	H	α-helix	trans	-63.7	-31	178.9	0	0	0	0	0	114.6	P298 Q299 T305 Q306	P298-G302 PolarHBondContact O-N 3.41Å; Q299-G302 WeakPolarHBondContact O-CA 3.09Å; Q299-G302 PolarHBondContact O-N 3.03Å; G302-T305 PolarHBondContact O-OG1 3.05Å; G302-T305 VanDerWaalsContact O-OG1 3.06Å; G302-Q306 WeakPolarHBondContact O-CG 3.38Å; G302-Q306 PolarHBondContact O-NE2 3.2Å
303	G	90.8	Very high	91.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-78.1	-36.8	170.6	0	0	0	0	0	113.1	I209 I273 Q299 I301 T305 Q306 A307	I209-G303 VanDerWaalsContact CD1-C 3.46Å; I273-G303 VanDerWaalsContact CD1-CA 3.44Å; I273-G303 VanDerWaalsContact CD1-N 3.34Å; Q299-G303 PolarHBondContact O-N 2.71Å; I301-G303 VanDerWaalsContact C-N 3.33Å; I301-G303 PolarHBondContact O-N 3.15Å; G303-T305 VanDerWaalsContact C-N 3.34Å; G303-T305 PolarHBondContact O-N 2.77Å; G303-Q306 WeakPolarHBondContact O-CB 3.37Å; G303-Q306 PolarHBondContact O-N 3.35Å; G303-A307 PolarHBondContact O-N 2.62Å
304	A	92.3	Very high	91.7	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.008	11%	0.107	C	C	.	.	H	α-helix	trans	-72.4	-24.4	-176.3	0	0	0	0	0	113.8	I209 M211 V300 I301 Q306 L341	I209-A304 HydrophobicContact CD1-CB 4.12Å; M211-A304 HydrophobicContact CE-CB 3.56Å; V300-A304 WeakPolarHBondContact O-CB 3.43Å; V300-A304 PolarHBondContact O-N 3.03Å; I301-A304 PolarHBondContact O-N 3.3Å; A304-Q306 VanDerWaalsContact C-N 3.32Å; A304-L341 HydrophobicContact CB-CB 4.41Å; A304-L341 HydrophobicContact CB-CD1 3.48Å; A304-L341 VanDerWaalsContact CB-CD1 3.48Å
305	T	90.7	Very high	92.1	Very high	24 Å²	24	17 Å²	17	15%	0.147	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-25.2	167.7	51.2	0	0	0	0	112.9	I301 G302 G303 L341 R462 N584	I301-T305 PolarHBondContact O-N 3.2Å; I301-T305 VanDerWaalsContact O-N 3.12Å; I301-T305 PolarHBondContact O-OG1 3.24Å; G302-T305 PolarHBondContact O-OG1 3.05Å; G302-T305 VanDerWaalsContact O-OG1 3.06Å; G303-T305 VanDerWaalsContact C-N 3.34Å; G303-T305 PolarHBondContact O-N 2.77Å; T305-L341 HydrophobicContact CG2-CB 4.46Å; T305-L341 HydrophobicContact CG2-CD1 4.35Å; T305-L341 HydrophobicContact CG2-CD2 3.83Å; T305-L341 HydrophobicContact CG2-CG 4.42Å; T305-R462 PolarHBondContact O-NH1 3.34Å; T305-N584 WeakPolarHBondContact CG2-O 3.42Å; T305-N584 PolarHBondContact OG1-O 3.32Å
306	Q	88.5	Confident	92.4	Very high	12 Å²	12	12.1 Å²	12.1	6%	0.056	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-12.6	177.4	-68.7	178.2	67.2	0	0	113.7	N207 M288 G302 G303 A304 R462 C585	N207-Q306 VanDerWaalsContact CB-O 3.26Å; N207-Q306 WeakPolarHBondContact CB-O 3.35Å; N207-Q306 PolarHBondContact ND2-O 2.83Å; M288-Q306 HydrophobicContact CE-CB 4.29Å; M288-Q306 HydrophobicContact SD-CB 3.75Å; G302-Q306 WeakPolarHBondContact O-CG 3.38Å; G302-Q306 PolarHBondContact O-NE2 3.2Å; G303-Q306 WeakPolarHBondContact O-CB 3.37Å; G303-Q306 PolarHBondContact O-N 3.35Å; A304-Q306 VanDerWaalsContact C-N 3.32Å; Q306-R462 VanDerWaalsContact C-NH1 3.31Å; Q306-R462 PolarHBondContact O-NE 2.81Å; Q306-R462 PolarHBondContact O-NH1 2.81Å; Q306-C585 PolarHBondContact NE2-SG 3.34Å; Q306-C585 VanDerWaalsContact NE2-SG 3.39Å
307	A	91.9	Very high	92.6	Very high	9 Å²	9	11.4 Å²	11.4	7%	0.074	7%	0.066	C	C	.	.			trans	-83.6	163.1	-178.9	0	0	0	0	0	113.9	I209 M288 G303 V343 R462	I209-A307 HydrophobicContact CB-CB 3.92Å; I209-A307 HydrophobicContact CG2-CB 3.49Å; I209-A307 VanDerWaalsContact CG2-CB 3.49Å; M288-A307 HydrophobicContact CE-CB 3.97Å; G303-A307 PolarHBondContact O-N 2.62Å; A307-V343 HydrophobicContact CB-CG2 4.24Å; A307-R462 PolarHBondContact O-NH1 3.12Å
308	D	90.6	Very high	92.7	Very high	20 Å²	20	20.5 Å²	20.5	11%	0.107	10%	0.1	C	C	.	.	S	Bend	trans	-114.9	-40.9	166.4	-60.3	-58.8	0	0	0	110.6	I206 N207 S344 P433 R435 R462	I206-D308 HydrophobicContact CG2-CB 4.48Å; N207-D308 PolarHBondContact N-OD2 2.7Å; N207-D308 VanDerWaalsContact N-OD2 3.12Å; N207-D308 PolarHBondContact O-N 2.73Å; D308-S344 PolarHBondContact O-N 3.09Å; D308-P433 HydrophobicContact CB-CB 4.49Å; D308-P433 HydrophobicContact CB-CG 4Å; D308-R435 VanDerWaalsContact CG-NH1 3.32Å; D308-R435 IonicContact OD1-CZ 3.73Å; D308-R435 IonicContact OD1-NH1 3.26Å; D308-R435 PolarHBondContact OD1-NH1 3.22Å; D308-R435 IonicContact OD1-NH2 3.18Å; D308-R435 IonicContact OD2-CZ 3.81Å; D308-R435 IonicContact OD2-NH1 2.8Å; D308-R435 PolarHBondContact OD2-NH1 2.94Å; D308-R435 IonicContact OD2-NH2 2.81Å; D308-R435 PolarHBondContact OD2-NH2 3.46Å; D308-R462 IonicContact OD1-CZ 2.68Å; D308-R462 IonicContact OD1-NH1 2.66Å; D308-R462 IonicContact OD1-NH2 3.34Å; D308-R462 PolarHBondContact OD1-NH2 3.18Å; D308-R462 IonicContact OD2-NH2 3.34Å; D308-R462 PolarHBondContact OD2-NH2 3.3Å
309	A	93.1	Very high	92.6	Very high	2 Å²	2	20.7 Å²	20.7	2%	0.017	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	159.7	177.2	0	0	0	0	0	110.8	I206 N207 L208 I209 R345 I430	I206-A309 HydrophobicContact CG2-CB 4.37Å; N207-A309 PolarHBondContact O-N 3.02Å; N207-A309 VanDerWaalsContact O-N 3.12Å; L208-A309 WeakPolarHBondContact CA-O 3.31Å; L208-A309 HydrophobicContact CD1-CB 3.99Å; I209-A309 PolarHBondContact N-O 2.78Å; I209-A309 VanDerWaalsContact N-O 3.14Å; A309-R345 WeakPolarHBondContact CA-O 3.04Å; A309-I430 HydrophobicContact CB-CD1 3.83Å; A309-I430 HydrophobicContact CB-CG2 4.14Å
310	A	94.6	Very high	92.6	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	146.7	173.7	0	0	0	0	0	112.8	I209 V343 R345 L346 I347	I209-A310 HydrophobicContact CG2-CB 3.69Å; I209-A310 CarbonylContact O-C 3.52Å; I209-A310 VanDerWaalsContact O-CA 3.26Å; I209-A310 WeakPolarHBondContact O-CA 3.39Å; A310-V343 HydrophobicContact CB-CG1 3.8Å; A310-V343 HydrophobicContact CB-CG2 4.46Å; A310-R345 PolarHBondContact N-O 3.3Å; A310-L346 HydrophobicContact CB-CD1 3.79Å; A310-L346 WeakPolarHBondContact O-CA 3.4Å; A310-I347 PolarHBondContact O-N 2.73Å
311	L	95.4	Very high	92.6	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	105.2	171.4	179.6	62	0	0	0	109	L208 I209 V210 M211 M222 V313 I347 A349 L423	L208-L311 HydrophobicContact CD1-CB 4.21Å; I209-L311 PolarHBondContact O-N 3.16Å; V210-L311 WeakPolarHBondContact CA-O 3.39Å; V210-L311 HydrophobicContact CG1-CD2 4.43Å; V210-L311 HydrophobicContact CG2-CD2 4.45Å; M211-L311 PolarHBondContact N-O 3.43Å; M222-L311 HydrophobicContact CE-CD2 3.54Å; M222-L311 HydrophobicContact SD-CD2 4.17Å; L311-V313 HydrophobicContact CG-CG2 4.26Å; L311-V313 PolarHBondContact O-N 3.2Å; L311-I347 CarbonylContact C-O 3.53Å; L311-I347 HydrophobicContact CD1-CB 3.89Å; L311-I347 HydrophobicContact CD1-CG2 3.71Å; L311-A349 HydrophobicContact CD1-CB 3.81Å; L311-L423 HydrophobicContact CD1-CD1 3.77Å; L311-L423 HydrophobicContact CD2-CD1 4.3Å; L311-L423 HydrophobicContact CD2-CD2 4.38Å
312	L	95.2	Very high	92.6	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.005	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	104.3	175.3	-171.8	64.1	0	0	0	109.6	M211 I314 T331 A335 L346 I347 V348 A349	M211-L312 HydrophobicContact CB-CD1 4.12Å; M211-L312 CarbonylContact O-C 3.56Å; M211-L312 WeakPolarHBondContact O-CA 3.32Å; L312-I314 HydrophobicContact CD2-CD1 4.04Å; L312-I314 HydrophobicContact CD2-CG1 4.4Å; L312-I314 HydrophobicContact CG-CD1 4.22Å; L312-I314 HydrophobicContact CG-CG1 4.04Å; L312-T331 HydrophobicContact CD1-CG2 3.88Å; L312-T331 HydrophobicContact CD2-CG2 4.2Å; L312-T331 HydrophobicContact CG-CG2 4.18Å; L312-A335 HydrophobicContact CD2-CB 4.19Å; L312-L346 HydrophobicContact CB-CD1 4.05Å; L312-L346 HydrophobicContact CD2-CD2 4.49Å; L312-I347 PolarHBondContact N-O 2.98Å; L312-V348 HydrophobicContact CB-CG2 4.46Å; L312-V348 WeakPolarHBondContact O-CA 3.27Å; L312-A349 PolarHBondContact O-N 2.91Å
313	V	95.7	Very high	92.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	121.5	175.2	-166.7	0	0	0	0	109.1	V210 M211 G212 A216 K218 L221 L311 A349 N351	V210-V313 HydrophobicContact CG1-CG2 3.62Å; M211-V313 PolarHBondContact O-N 3.11Å; G212-V313 WeakPolarHBondContact CA-O 3.43Å; A216-V313 HydrophobicContact CB-CB 4.36Å; A216-V313 HydrophobicContact CB-CG1 4.16Å; A216-V313 VanDerWaalsContact O-CG1 3.22Å; A216-V313 WeakPolarHBondContact O-CG1 3.35Å; K218-V313 HydrophobicContact CG-CB 4.17Å; K218-V313 HydrophobicContact CG-CG2 4.22Å; L221-V313 HydrophobicContact CD2-CG1 3.98Å; L221-V313 HydrophobicContact CD2-CG2 3.88Å; L311-V313 HydrophobicContact CG-CG2 4.26Å; L311-V313 PolarHBondContact O-N 3.2Å; V313-A349 WeakPolarHBondContact CA-O 3.16Å; V313-N351 HydrophobicContact CG1-CB 3.73Å
314	I	95.1	Very high	92.3	Very high	5 Å²	5	26.5 Å²	26.5	3%	0.026	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	140.9	-176.6	-58.7	-167.6	0	0	0	108	L312 F321 T331 V348 A349 V350 N351 I366 I370	L312-I314 HydrophobicContact CD2-CD1 4.04Å; L312-I314 HydrophobicContact CD2-CG1 4.4Å; L312-I314 HydrophobicContact CG-CD1 4.22Å; L312-I314 HydrophobicContact CG-CG1 4.04Å; I314-F321 HydrophobicContact CG2-CD2 3.68Å; I314-F321 HydrophobicContact CG2-CE2 3.72Å; I314-T331 HydrophobicContact CD1-CG2 4.36Å; I314-T331 HydrophobicContact CG1-CG2 4.17Å; I314-V348 HydrophobicContact CD1-CG1 3.56Å; I314-V348 HydrophobicContact CG1-CG1 4.05Å; I314-A349 PolarHBondContact N-O 2.8Å; I314-V350 CarbonylContact O-C 3.55Å; I314-V350 WeakPolarHBondContact O-CA 3.16Å; I314-N351 PolarHBondContact O-N 3.36Å; I314-I366 HydrophobicContact CG2-CG2 4.29Å; I314-I370 HydrophobicContact CD1-CB 4.39Å; I314-I370 HydrophobicContact CD1-CD1 3.53Å; I314-I370 HydrophobicContact CD1-CG1 3.59Å; I314-I370 HydrophobicContact CD1-CG2 3.99Å
315	N	94.8	Very high	92.1	Very high	4 Å²	4	27.8 Å²	27.8	2%	0.021	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	136.2	-178.8	-165	-20.1	0	0	0	111	D215 T317 E320 F321 K352	D215-N315 PolarHBondContact O-ND2 3.42Å; N315-T317 PolarHBondContact OD1-N 3.25Å; N315-T317 VanDerWaalsContact OD1-N 3.12Å; N315-T317 PolarHBondContact OD1-OG1 3.44Å; N315-E320 HydrophobicContact CB-CB 4.26Å; N315-E320 WeakPolarHBondContact ND2-CB 3.47Å; N315-E320 PolarHBondContact ND2-OE1 2.85Å; N315-E320 PolarHBondContact ND2-OE2 3.15Å; N315-E320 PolarHBondContact OD1-OE2 3.38Å; N315-F321 WeakPolarHBondContact O-CB 3.23Å; N315-F321 WeakPolarHBondContact O-CD2 3.26Å; N315-K352 WeakPolarHBondContact ND2-CE 3.44Å; N315-K352 PolarHBondContact ND2-NZ 2.86Å; N315-K352 WeakPolarHBondContact OD1-CD 3.06Å
316	A	95	Very high	91.7	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.153	C	C	.	.			trans	-81.8	-28.8	177.9	0	0	0	0	0	114.1	V350 N351 M353 V356 R362 I366	A316-V350 HydrophobicContact CB-CG1 4Å; A316-N351 VanDerWaalsContact CB-O 3.23Å; A316-N351 WeakPolarHBondContact CB-O 3.44Å; A316-N351 PolarHBondContact N-O 3.1Å; A316-M353 HydrophobicContact CB-CG 4.38Å; A316-M353 HydrophobicContact CB-SD 3.71Å; A316-V356 HydrophobicContact CB-CG2 3.89Å; A316-R362 PolarHBondContact O-NE 3.22Å; A316-R362 PolarHBondContact O-NH2 3.25Å; A316-I366 HydrophobicContact CB-CD1 4.23Å
317	T	93.8	Very high	91	Very high	31 Å²	31	32.6 Å²	32.6	19%	0.19	19%	0.194	C	C	.	.	S	Bend	trans	-56.6	143.4	-173.6	-42.1	0	0	0	0	111.3	N315 E320 F321 T355 R362	N315-T317 PolarHBondContact OD1-N 3.25Å; N315-T317 VanDerWaalsContact OD1-N 3.12Å; N315-T317 PolarHBondContact OD1-OG1 3.44Å; T317-E320 WeakPolarHBondContact CB-OE2 3.33Å; T317-E320 HydrophobicContact CG2-CG 4.3Å; T317-E320 PolarHBondContact OG1-OE2 3.24Å; T317-F321 WeakPolarHBondContact O-CB 3.21Å; T317-F321 PolarHBondContact O-N 2.9Å; T317-F321 VanDerWaalsContact O-N 3.16Å; T317-T355 PolarHBondContact OG1-OG1 3.23Å; T317-T355 VanDerWaalsContact OG1-OG1 3.05Å; T317-R362 PolarHBondContact O-NH2 3.14Å
318	R	91.5	Very high	90.4	Very high	191 Å²	191	36 Å²	36	72%	0.721	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	138.3	172	-63.1	179.4	-179.3	172.9	1.6	110.1	E320	R318-E320 VanDerWaalsContact C-N 3.34Å; R318-E320 PolarHBondContact O-N 2.8Å
319	G	89.6	Confident	90.1	Very high	42 Å²	42	35.4 Å²	35.4	43%	0.433	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.5	-62.3	-168.7	0	0	0	0	0	111.8	F321 E322 T323	G319-F321 VanDerWaalsContact C-N 3.26Å; G319-F321 PolarHBondContact O-N 3.18Å; G319-E322 WeakPolarHBondContact CA-OE2 3.36Å; G319-E322 PolarHBondContact N-OE2 3.38Å; G319-E322 PolarHBondContact O-N 3.17Å; G319-T323 PolarHBondContact O-N 2.85Å; G319-T323 PolarHBondContact O-OG1 3.42Å
320	E	90.6	Very high	89.8	Confident	53 Å²	53	36.6 Å²	36.6	25%	0.248	23%	0.233	C	C	.	.	H	α-helix	trans	-65.5	-25.5	-175.9	-52.2	-172.8	98.1	0	0	113.9	N315 T317 R318 T323 K352	N315-E320 HydrophobicContact CB-CB 4.26Å; N315-E320 WeakPolarHBondContact ND2-CB 3.47Å; N315-E320 PolarHBondContact ND2-OE1 2.85Å; N315-E320 PolarHBondContact ND2-OE2 3.15Å; N315-E320 PolarHBondContact OD1-OE2 3.38Å; T317-E320 WeakPolarHBondContact CB-OE2 3.33Å; T317-E320 HydrophobicContact CG2-CG 4.3Å; T317-E320 PolarHBondContact OG1-OE2 3.24Å; R318-E320 VanDerWaalsContact C-N 3.34Å; R318-E320 PolarHBondContact O-N 2.8Å; E320-T323 PolarHBondContact O-OG1 3.45Å; E320-K352 IonicContact OE1-NZ 2.71Å; E320-K352 PolarHBondContact OE1-NZ 2.9Å; E320-K352 IonicContact OE2-NZ 3.72Å; E320-K352 PolarHBondContact OE2-NZ 2.82Å
321	F	92.4	Very high	89.6	Confident	3 Å²	3	36.9 Å²	36.9	1%	0.013	24%	0.235	C	C	.	.	H	α-helix	trans	-74.1	-48.5	172.9	174.8	-112.9	0	0	0	111.4	I314 N315 T317 G319 G324 I325 R362 I366 Q369 I370	I314-F321 HydrophobicContact CG2-CD2 3.68Å; I314-F321 HydrophobicContact CG2-CE2 3.72Å; N315-F321 WeakPolarHBondContact O-CB 3.23Å; N315-F321 WeakPolarHBondContact O-CD2 3.26Å; T317-F321 WeakPolarHBondContact O-CB 3.21Å; T317-F321 PolarHBondContact O-N 2.9Å; T317-F321 VanDerWaalsContact O-N 3.16Å; G319-F321 VanDerWaalsContact C-N 3.26Å; G319-F321 PolarHBondContact O-N 3.18Å; F321-G324 PolarHBondContact O-N 3.42Å; F321-I325 HydrophobicContact CD1-CD1 4.48Å; F321-I325 HydrophobicContact CD2-CD1 4.02Å; F321-I325 HydrophobicContact CE1-CD1 3.84Å; F321-I325 HydrophobicContact CE2-CD1 3.27Å; F321-I325 HydrophobicContact CE2-CG1 4.35Å; F321-I325 HydrophobicContact CZ-CD1 3.17Å; F321-I325 HydrophobicContact CZ-CG1 4.49Å; F321-I325 PolarHBondContact O-N 3.01Å; F321-R362 VanDerWaalsContact CB-NH2 3.33Å; F321-I366 HydrophobicContact CD1-CG1 4.2Å; F321-I366 HydrophobicContact CD2-CD1 4.41Å; F321-I366 HydrophobicContact CD2-CG1 3.94Å; F321-I366 HydrophobicContact CD2-CG2 4.37Å; F321-I366 HydrophobicContact CE1-CG1 3.93Å; F321-I366 HydrophobicContact CE2-CB 3.97Å; F321-I366 HydrophobicContact CE2-CG1 3.64Å; F321-I366 HydrophobicContact CE2-CG2 3.62Å; F321-I366 HydrophobicContact CG-CG1 4.21Å; F321-I366 HydrophobicContact CZ-CB 3.93Å; F321-I366 HydrophobicContact CZ-CG1 3.63Å; F321-I366 HydrophobicContact CZ-CG2 4.03Å; F321-Q369 HydrophobicContact CZ-CB 4.25Å; F321-I370 HydrophobicContact CE2-CG1 4.23Å; F321-I370 HydrophobicContact CZ-CG1 4.45Å
322	E	91.6	Very high	89.3	Confident	73 Å²	73	41.2 Å²	41.2	34%	0.341	25%	0.252	S	S	.	.	H	α-helix	trans	-66.9	-37.2	-174.9	-68.1	75.6	-167.2	0	0	111.8	G319 G324 I325 G326 R362	G319-E322 WeakPolarHBondContact CA-OE2 3.36Å; G319-E322 PolarHBondContact N-OE2 3.38Å; G319-E322 PolarHBondContact O-N 3.17Å; E322-G324 PolarHBondContact O-N 3.48Å; E322-I325 PolarHBondContact O-N 3.39Å; E322-G326 PolarHBondContact O-N 3.16Å; E322-R362 IonicContact OE1-CZ 2.82Å; E322-R362 VanDerWaalsContact OE1-CZ 3.26Å; E322-R362 IonicContact OE1-NH1 2.7Å; E322-R362 PolarHBondContact OE1-NH1 2.99Å; E322-R362 IonicContact OE1-NH2 2.75Å; E322-R362 PolarHBondContact OE1-NH2 2.83Å; E322-R362 IonicContact OE2-NH2 3.79Å; E322-R362 PolarHBondContact OE2-NH2 2.74Å
323	T	89.5	Confident	88.9	Confident	82 Å²	82	42.7 Å²	42.7	50%	0.503	26%	0.258	S	S	.	.	H	α-helix	trans	-62.5	-40.4	171.7	54	0	0	0	0	112.2	G319 E320 I325 G326	G319-T323 PolarHBondContact O-N 2.85Å; G319-T323 PolarHBondContact O-OG1 3.42Å; E320-T323 PolarHBondContact O-OG1 3.45Å; T323-I325 VanDerWaalsContact C-N 3.25Å; T323-I325 PolarHBondContact O-N 3.09Å; T323-G326 PolarHBondContact O-N 3.36Å
324	G	86.1	Confident	88.7	Confident	3 Å²	3	42.7 Å²	42.7	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-64.6	-25.9	177.3	0	0	0	0	0	114.2	F321 E322 G329 T331	F321-G324 PolarHBondContact O-N 3.42Å; E322-G324 PolarHBondContact O-N 3.48Å; G324-G329 CarbonylContact O-C 3.55Å; G324-G329 WeakPolarHBondContact O-CA 3.41Å; G324-T331 WeakPolarHBondContact O-CB 3.16Å
325	I	87.7	Confident	88.5	Confident	29 Å²	29	42.5 Å²	42.5	15%	0.149	26%	0.258	C	S	.	.	H	α-helix	trans	-102.9	-8.1	179.9	-64.3	179.8	0	0	0	112.9	F321 E322 T323 R332 I370	F321-I325 HydrophobicContact CD1-CD1 4.48Å; F321-I325 HydrophobicContact CD2-CD1 4.02Å; F321-I325 HydrophobicContact CE1-CD1 3.84Å; F321-I325 HydrophobicContact CE2-CD1 3.27Å; F321-I325 HydrophobicContact CE2-CG1 4.35Å; F321-I325 HydrophobicContact CZ-CD1 3.17Å; F321-I325 HydrophobicContact CZ-CG1 4.49Å; F321-I325 PolarHBondContact O-N 3.01Å; E322-I325 PolarHBondContact O-N 3.39Å; T323-I325 VanDerWaalsContact C-N 3.25Å; T323-I325 PolarHBondContact O-N 3.09Å; I325-R332 WeakPolarHBondContact O-CD 3.34Å; I325-R332 PolarHBondContact O-NH1 3.01Å; I325-I370 HydrophobicContact CD1-CD1 3.44Å; I325-I370 VanDerWaalsContact CD1-CD1 3.44Å; I325-I370 HydrophobicContact CD1-CG1 3.92Å; I325-I370 HydrophobicContact CG1-CD1 4Å
326	G	83.7	Confident	88.2	Confident	28 Å²	28	44.5 Å²	44.5	29%	0.289	27%	0.265	S	S	.	.	S	Bend	trans	-53.6	165.9	174.8	0	0	0	0	0	114.2	E322 T323 G328 G329 R332	E322-G326 PolarHBondContact O-N 3.16Å; T323-G326 PolarHBondContact O-N 3.36Å; G326-G328 PolarHBondContact O-N 3.29Å; G326-G329 PolarHBondContact O-N 3.02Å; G326-R332 PolarHBondContact O-NH1 2.8Å
327	A	73.7	Confident	88	Confident	109 Å²	109	44.6 Å²	44.6	90%	0.901	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	109.9	170.1	0	0	0	0	0	108.9
328	G	78.6	Confident	87.9	Confident	79 Å²	79	43.1 Å²	43.1	81%	0.814	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	98	1.2	-171.3	0	0	0	0	0	115.4	G326	G326-G328 PolarHBondContact O-N 3.29Å
329	G	84.2	Confident	87.9	Confident	9 Å²	9	34.8 Å²	34.8	9%	0.093	23%	0.225	C	C	.	.			trans	-64	131.3	178.4	0	0	0	0	0	113.4	G324 G326 T331 R332 E333	G324-G329 CarbonylContact O-C 3.55Å; G324-G329 WeakPolarHBondContact O-CA 3.41Å; G326-G329 PolarHBondContact O-N 3.02Å; G329-T331 VanDerWaalsContact C-N 3.31Å; G329-T331 PolarHBondContact O-N 3.18Å; G329-R332 WeakPolarHBondContact O-CB 3.41Å; G329-R332 PolarHBondContact O-N 3.06Å; G329-E333 PolarHBondContact O-N 3.15Å
330	Q	87.7	Confident	87.9	Confident	26 Å²	26	33 Å²	33	12%	0.121	21%	0.205	C	C	.	.	H	α-helix	trans	-55.8	-39.9	-174.6	-71.8	161.3	-6.6	0	0	113.2	H213 G292 R332 E333 H334	H213-Q330 PolarHBondContact CE1-OE1 3.25Å; H213-Q330 PolarHBondContact ND1-OE1 2.67Å; G292-Q330 PolarHBondContact O-NE2 3.38Å; G292-Q330 PolarHBondContact O-OE1 2.76Å; Q330-R332 PolarHBondContact O-N 3.04Å; Q330-R332 VanDerWaalsContact O-N 3.16Å; Q330-E333 PolarHBondContact O-N 3.09Å; Q330-H334 VanDerWaalsContact O-CG 3.3Å; Q330-H334 PolarHBondContact O-N 3.04Å
331	T	89.5	Confident	87.8	Confident	7 Å²	7	30.8 Å²	30.8	4%	0.043	20%	0.195	C	C	.	.	H	α-helix	trans	-55.9	-33.2	176.2	-47.2	0	0	0	0	112	L312 I314 G324 G329 A335	L312-T331 HydrophobicContact CD1-CG2 3.88Å; L312-T331 HydrophobicContact CD2-CG2 4.2Å; L312-T331 HydrophobicContact CG-CG2 4.18Å; I314-T331 HydrophobicContact CD1-CG2 4.36Å; I314-T331 HydrophobicContact CG1-CG2 4.17Å; G324-T331 WeakPolarHBondContact O-CB 3.16Å; G329-T331 VanDerWaalsContact C-N 3.31Å; G329-T331 PolarHBondContact O-N 3.18Å; T331-A335 WeakPolarHBondContact O-CB 3.13Å; T331-A335 PolarHBondContact O-N 3.42Å; T331-A335 VanDerWaalsContact O-N 3.14Å
332	R	88.2	Confident	87.4	Confident	90 Å²	90	31.1 Å²	31.1	34%	0.34	20%	0.2	S	C	.	.	H	α-helix	trans	-80.9	-30.3	178.1	-63.1	-177.5	65	-171.8	2	113.3	I325 G326 G329 Q330 R336 F373	I325-R332 WeakPolarHBondContact O-CD 3.34Å; I325-R332 PolarHBondContact O-NH1 3.01Å; G326-R332 PolarHBondContact O-NH1 2.8Å; G329-R332 WeakPolarHBondContact O-CB 3.41Å; G329-R332 PolarHBondContact O-N 3.06Å; Q330-R332 PolarHBondContact O-N 3.04Å; Q330-R332 VanDerWaalsContact O-N 3.16Å; R332-R336 WeakPolarHBondContact O-CB 3.35Å; R332-R336 PolarHBondContact O-N 3.45Å; R332-F373 HydrophobicContact CB-CE1 4Å; R332-F373 HydrophobicContact CB-CE2 4.11Å; R332-F373 HydrophobicContact CB-CZ 3.44Å; R332-F373 VanDerWaalsContact CB-CZ 3.44Å; R332-F373 HydrophobicContact CG-CD1 4.34Å; R332-F373 HydrophobicContact CG-CE1 3.7Å; R332-F373 HydrophobicContact CG-CE2 3.99Å; R332-F373 HydrophobicContact CG-CZ 3.49Å; R332-F373 VanDerWaalsContact CG-CZ 3.49Å; R332-F373 VanDerWaalsContact NE-CE2 3.25Å
333	E	88.9	Confident	87.1	Confident	32 Å²	32	27.8 Å²	27.8	15%	0.15	18%	0.184	C	C	.	.	H	α-helix	trans	-69.5	-48.9	169.4	-175.9	166.6	-173.9	0	0	110.5	G329 Q330 A335 R336 L337 R648 S653	G329-E333 PolarHBondContact O-N 3.15Å; Q330-E333 PolarHBondContact O-N 3.09Å; E333-A335 PolarHBondContact O-N 2.86Å; E333-R336 WeakPolarHBondContact O-CA 3.36Å; E333-R336 VanDerWaalsContact O-CB 3.26Å; E333-R336 WeakPolarHBondContact O-CB 3.44Å; E333-R336 PolarHBondContact O-N 3.38Å; E333-L337 HydrophobicContact CG-CD1 3.98Å; E333-L337 HydrophobicContact CG-CG 4.26Å; E333-L337 WeakPolarHBondContact O-CG 3.34Å; E333-L337 PolarHBondContact O-N 3.18Å; E333-R648 IonicContact OE1-CZ 2.7Å; E333-R648 IonicContact OE1-NH1 2.67Å; E333-R648 PolarHBondContact OE1-NH1 2.88Å; E333-R648 IonicContact OE1-NH2 2.69Å; E333-R648 PolarHBondContact OE1-NH2 3.25Å; E333-R648 IonicContact OE2-NH2 3.28Å; E333-S653 WeakPolarHBondContact OE1-CB 3.46Å; E333-S653 PolarHBondContact OE1-OG 2.77Å
334	H	90.9	Very high	86.7	Confident	1 Å²	1	25 Å²	25	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-59.8	-45.6	-178.8	-64.2	166.4	0	0	0	112.8	M211 G212 Q330 R336 L337 A338	M211-H334 HydrophobicContact CB-CB 4.1Å; M211-H334 HydrophobicContact CG-CB 4.42Å; M211-H334 HydrophobicContact SD-CB 3.97Å; G212-H334 PolarHBondContact O-CE1 3.11Å; G212-H334 VanDerWaalsContact O-CE1 3.22Å; G212-H334 PolarHBondContact O-ND1 2.94Å; Q330-H334 VanDerWaalsContact O-CG 3.3Å; Q330-H334 PolarHBondContact O-N 3.04Å; H334-R336 VanDerWaalsContact C-N 3.27Å; H334-R336 PolarHBondContact O-N 3.03Å; H334-L337 PolarHBondContact O-N 3.47Å; H334-A338 PolarHBondContact O-N 3.08Å
335	A	91	Very high	86.8	Confident	1 Å²	1	28 Å²	28	1%	0.008	18%	0.178	C	C	.	.	H	α-helix	trans	-59.7	-35.5	173.4	0	0	0	0	0	112.9	L312 T331 E333 R339 F373 L374 M377 F379	L312-A335 HydrophobicContact CD2-CB 4.19Å; T331-A335 WeakPolarHBondContact O-CB 3.13Å; T331-A335 PolarHBondContact O-N 3.42Å; T331-A335 VanDerWaalsContact O-N 3.14Å; E333-A335 PolarHBondContact O-N 2.86Å; A335-R339 PolarHBondContact O-N 3.05Å; A335-F373 HydrophobicContact CB-CE1 3.93Å; A335-L374 HydrophobicContact CB-CD2 4.09Å; A335-M377 HydrophobicContact CB-SD 4.09Å; A335-F379 WeakPolarHBondContact O-CE2 3.15Å; A335-F379 WeakPolarHBondContact O-CZ 3.41Å
336	R	88.9	Confident	87	Confident	46 Å²	46	26.9 Å²	26.9	17%	0.174	17%	0.172	C	C	.	.	H	α-helix	trans	-66.7	-45.5	175.8	-160.4	173.5	-163.3	143.5	9.2	111.5	R332 E333 H334 R339 L340 M377 F567	R332-R336 WeakPolarHBondContact O-CB 3.35Å; R332-R336 PolarHBondContact O-N 3.45Å; E333-R336 WeakPolarHBondContact O-CA 3.36Å; E333-R336 VanDerWaalsContact O-CB 3.26Å; E333-R336 WeakPolarHBondContact O-CB 3.44Å; E333-R336 PolarHBondContact O-N 3.38Å; H334-R336 VanDerWaalsContact C-N 3.27Å; H334-R336 PolarHBondContact O-N 3.03Å; R336-R339 PolarHBondContact O-N 2.89Å; R336-L340 HydrophobicContact CG-CD1 3.86Å; R336-L340 WeakPolarHBondContact O-CD1 3.49Å; R336-L340 VanDerWaalsContact O-CG 3.25Å; R336-L340 WeakPolarHBondContact O-CG 3.45Å; R336-L340 PolarHBondContact O-N 3.37Å; R336-M377 HydrophobicContact CB-CE 3.54Å; R336-M377 HydrophobicContact CB-SD 4.48Å; R336-M377 HydrophobicContact CG-CE 3.8Å; R336-F567 HydrophobicContact CG-CE2 4.36Å; R336-F567 HydrophobicContact CG-CZ 4.32Å; R336-F567 VanDerWaalsContact NE-CD1 3.31Å
337	L	90.8	Very high	87.5	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-62.2	-47.8	179.5	-66.6	172	0	0	0	111.3	V297 I301 E333 H334 R339 L340 L341 M646	V297-L337 HydrophobicContact CG1-CD1 3.29Å; I301-L337 HydrophobicContact CD1-CD2 4.34Å; I301-L337 HydrophobicContact CG1-CD1 4.21Å; I301-L337 HydrophobicContact CG1-CD2 4.08Å; E333-L337 HydrophobicContact CG-CD1 3.98Å; E333-L337 HydrophobicContact CG-CG 4.26Å; E333-L337 WeakPolarHBondContact O-CG 3.34Å; E333-L337 PolarHBondContact O-N 3.18Å; H334-L337 PolarHBondContact O-N 3.47Å; L337-R339 VanDerWaalsContact C-N 3.27Å; L337-R339 PolarHBondContact O-N 3.45Å; L337-L340 PolarHBondContact O-N 3.26Å; L337-L340 VanDerWaalsContact O-N 3.16Å; L337-L341 HydrophobicContact CB-CD1 4.45Å; L337-L341 WeakPolarHBondContact O-CB 3.41Å; L337-L341 WeakPolarHBondContact O-CG 3.26Å; L337-L341 PolarHBondContact O-N 2.83Å; L337-M646 HydrophobicContact CD2-CE 3.47Å; L337-M646 VanDerWaalsContact CD2-CE 3.47Å; L337-M646 HydrophobicContact CD2-CG 4.06Å; L337-M646 HydrophobicContact CD2-SD 3.91Å
338	A	91.7	Very high	88.5	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-52.2	-45.5	175	0	0	0	0	0	111.9	M211 H334 L340 G342 V343 F379	M211-A338 HydrophobicContact CE-CB 4.11Å; M211-A338 HydrophobicContact SD-CB 3.95Å; H334-A338 PolarHBondContact O-N 3.08Å; A338-L340 PolarHBondContact O-N 2.76Å; A338-G342 PolarHBondContact O-N 2.95Å; A338-V343 HydrophobicContact CB-CB 4.21Å; A338-V343 HydrophobicContact CB-CG2 4.16Å; A338-V343 WeakPolarHBondContact O-CB 3.48Å; A338-V343 PolarHBondContact O-N 3.27Å; A338-F379 HydrophobicContact CB-CZ 4.29Å
339	R	90	Very high	89.4	Confident	16 Å²	16	16.7 Å²	16.7	6%	0.06	8%	0.078	C	C	.	.	H	α-helix	trans	-67.4	-32.9	-178.4	-169.7	59.9	-172.5	76.7	-1.3	114.4	F69 A335 R336 L337 G342 M377 N378 F379	F69-R339 PolarHBondContact O-NH1 3.41Å; F69-R339 PolarHBondContact O-NH2 2.89Å; A335-R339 PolarHBondContact O-N 3.05Å; R336-R339 PolarHBondContact O-N 2.89Å; L337-R339 VanDerWaalsContact C-N 3.27Å; L337-R339 PolarHBondContact O-N 3.45Å; R339-G342 WeakPolarHBondContact O-CA 3.39Å; R339-M377 WeakPolarHBondContact CG-O 3.43Å; R339-M377 PolarHBondContact NE-O 3Å; R339-N378 PolarHBondContact NE-O 3.33Å; R339-F379 HydrophobicContact CB-CE1 4.21Å; R339-F379 HydrophobicContact CB-CE2 3.79Å; R339-F379 HydrophobicContact CB-CZ 3.54Å; R339-F379 HydrophobicContact CG-CE2 4.29Å; R339-F379 HydrophobicContact CG-CZ 4.22Å
340	L	89.4	Confident	89.9	Confident	4 Å²	4	16.3 Å²	16.3	2%	0.021	7%	0.073	C	C	.	.	H	α-helix	trans	-87.1	-41.5	-173.5	-68.4	166.4	0	0	0	112.4	F69 R336 L337 A338 G342 L565 F567 R644 M646	F69-L340 HydrophobicContact CD1-CD2 3.92Å; F69-L340 HydrophobicContact CD2-CD2 3.79Å; F69-L340 HydrophobicContact CE1-CD2 3.59Å; F69-L340 HydrophobicContact CE2-CD2 3.48Å; F69-L340 VanDerWaalsContact CE2-CD2 3.48Å; F69-L340 HydrophobicContact CG-CD2 4.03Å; F69-L340 HydrophobicContact CZ-CD2 3.38Å; R336-L340 HydrophobicContact CG-CD1 3.86Å; R336-L340 WeakPolarHBondContact O-CD1 3.49Å; R336-L340 VanDerWaalsContact O-CG 3.25Å; R336-L340 WeakPolarHBondContact O-CG 3.45Å; R336-L340 PolarHBondContact O-N 3.37Å; L337-L340 PolarHBondContact O-N 3.26Å; L337-L340 VanDerWaalsContact O-N 3.16Å; A338-L340 PolarHBondContact O-N 2.76Å; L340-G342 PolarHBondContact O-N 3.14Å; L340-L565 HydrophobicContact CD2-CD2 4.38Å; L340-F567 HydrophobicContact CD1-CE1 3.88Å; L340-F567 HydrophobicContact CD1-CE2 4.3Å; L340-F567 HydrophobicContact CD1-CZ 3.32Å; L340-R644 WeakPolarHBondContact O-CD 3.2Å; L340-M646 HydrophobicContact CB-SD 4.03Å; L340-M646 HydrophobicContact CD1-CE 4.29Å; L340-M646 HydrophobicContact CD1-SD 3.74Å
341	L	88.7	Confident	90.3	Very high	8 Å²	8	15.3 Å²	15.3	4%	0.042	7%	0.069	C	C	.	.	H	α-helix	trans	-69.3	-14.8	166.5	-55.9	172.9	0	0	0	110.5	I301 A304 T305 L337 R644 M646	I301-L341 HydrophobicContact CB-CD1 4.27Å; I301-L341 HydrophobicContact CG1-CD1 4.34Å; I301-L341 HydrophobicContact CG2-CD1 3.97Å; I301-L341 HydrophobicContact CG2-CD2 4.43Å; A304-L341 HydrophobicContact CB-CB 4.41Å; A304-L341 HydrophobicContact CB-CD1 3.48Å; A304-L341 VanDerWaalsContact CB-CD1 3.48Å; T305-L341 HydrophobicContact CG2-CB 4.46Å; T305-L341 HydrophobicContact CG2-CD1 4.35Å; T305-L341 HydrophobicContact CG2-CD2 3.83Å; T305-L341 HydrophobicContact CG2-CG 4.42Å; L337-L341 HydrophobicContact CB-CD1 4.45Å; L337-L341 WeakPolarHBondContact O-CB 3.41Å; L337-L341 WeakPolarHBondContact O-CG 3.26Å; L337-L341 PolarHBondContact O-N 2.83Å; L341-R644 WeakPolarHBondContact O-CD 3.36Å; L341-R644 PolarHBondContact O-NH1 3.34Å; L341-M646 HydrophobicContact CD2-CG 3.91Å; L341-M646 HydrophobicContact CG-CG 4.43Å
342	G	84	Confident	90.4	Very high	10 Å²	10	17.4 Å²	17.4	10%	0.103	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	39.4	155.9	0	0	0	0	0	113.6	A338 R339 L340 S344 R644	A338-G342 PolarHBondContact O-N 2.95Å; R339-G342 WeakPolarHBondContact O-CA 3.39Å; L340-G342 PolarHBondContact O-N 3.14Å; G342-S344 PolarHBondContact O-N 3.26Å; G342-R644 VanDerWaalsContact CA-NH1 3.34Å; G342-R644 PolarHBondContact O-NH1 3.35Å; G342-R644 VanDerWaalsContact O-NH1 3.14Å
343	V	86.6	Confident	90.6	Very high	3 Å²	3	13.1 Å²	13.1	2%	0.018	6%	0.061	C	C	.	.			trans	-52.5	124.1	151.9	176.2	0	0	0	0	108	A307 A310 A338 R345	A307-V343 HydrophobicContact CB-CG2 4.24Å; A310-V343 HydrophobicContact CB-CG1 3.8Å; A310-V343 HydrophobicContact CB-CG2 4.46Å; A338-V343 HydrophobicContact CB-CB 4.21Å; A338-V343 HydrophobicContact CB-CG2 4.16Å; A338-V343 WeakPolarHBondContact O-CB 3.48Å; A338-V343 PolarHBondContact O-N 3.27Å; V343-R345 VanDerWaalsContact CG1-O 3.3Å; V343-R345 WeakPolarHBondContact CG1-O 3.43Å
344	S	79.7	Confident	90.6	Very high	22 Å²	22	13.9 Å²	13.9	15%	0.154	7%	0.066	C	C	.	.			trans	-87.6	-36.7	-178.7	54.6	0	0	0	0	112.6	D308 G342	D308-S344 PolarHBondContact O-N 3.09Å; G342-S344 PolarHBondContact O-N 3.26Å
345	R	88.5	Confident	90.6	Very high	67 Å²	67	17.3 Å²	17.3	25%	0.253	9%	0.087	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	131.2	-174.2	-55.1	-58	170.6	131.9	-6.3	111.4	D73 A309 A310 V343 I430 P431	D73-R345 IonicContact OD1-CZ 3.65Å; D73-R345 IonicContact OD1-NE 3.49Å; D73-R345 PolarHBondContact OD1-NE 3.12Å; D73-R345 IonicContact OD1-NH2 2.69Å; D73-R345 PolarHBondContact OD1-NH2 3.07Å; A309-R345 WeakPolarHBondContact CA-O 3.04Å; A310-R345 PolarHBondContact N-O 3.3Å; V343-R345 VanDerWaalsContact CG1-O 3.3Å; V343-R345 WeakPolarHBondContact CG1-O 3.43Å; R345-I430 HydrophobicContact CB-CG2 4.25Å; R345-I430 HydrophobicContact CG-CG2 4.44Å; R345-P431 HydrophobicContact CG-CG 4.47Å
346	L	92.8	Very high	90.6	Very high	5 Å²	5	18.3 Å²	18.3	3%	0.026	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	122.9	-174.9	-172.7	70.6	0	0	0	109.9	A310 L312 L374 F379	A310-L346 HydrophobicContact CB-CD1 3.79Å; A310-L346 WeakPolarHBondContact O-CA 3.4Å; L312-L346 HydrophobicContact CB-CD1 4.05Å; L312-L346 HydrophobicContact CD2-CD2 4.49Å; L346-L374 HydrophobicContact CD2-CD1 3.85Å; L346-L374 HydrophobicContact CD2-CD2 3.69Å; L346-L374 HydrophobicContact CD2-CG 4.4Å; L346-F379 HydrophobicContact CB-CD1 3.92Å; L346-F379 HydrophobicContact CB-CE1 4.01Å; L346-F379 HydrophobicContact CD2-CD1 4.06Å; L346-F379 HydrophobicContact CD2-CD2 4.02Å; L346-F379 HydrophobicContact CD2-CE1 3.99Å; L346-F379 HydrophobicContact CD2-CE2 3.94Å; L346-F379 HydrophobicContact CD2-CG 4.06Å; L346-F379 HydrophobicContact CD2-CZ 3.91Å; L346-F379 HydrophobicContact CG-CE1 4.46Å
347	I	94.4	Very high	90.6	Very high	3 Å²	3	24 Å²	24	2%	0.015	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	135.9	171.1	-58.8	174.3	0	0	0	107.8	A310 L311 L312 M383 L423 L426 I427 I430	A310-I347 PolarHBondContact O-N 2.73Å; L311-I347 CarbonylContact C-O 3.53Å; L311-I347 HydrophobicContact CD1-CB 3.89Å; L311-I347 HydrophobicContact CD1-CG2 3.71Å; L312-I347 PolarHBondContact N-O 2.98Å; I347-M383 HydrophobicContact CD1-CE 4.12Å; I347-M383 HydrophobicContact CG1-CE 3.94Å; I347-L423 HydrophobicContact CG2-CD1 4.35Å; I347-L426 HydrophobicContact CD1-CB 4.15Å; I347-L426 VanDerWaalsContact CD1-O 3.31Å; I347-L426 WeakPolarHBondContact CD1-O 3.03Å; I347-I427 HydrophobicContact CD1-CG1 4.03Å; I347-I430 HydrophobicContact CD1-CD1 3.77Å; I347-I430 HydrophobicContact CD1-CG1 3.94Å
348	V	95.2	Very high	90.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	112.6	174.9	175.2	0	0	0	0	109.3	L312 I314 V350 I370 L374 V382 M383 Y384 C385	L312-V348 HydrophobicContact CB-CG2 4.46Å; L312-V348 WeakPolarHBondContact O-CA 3.27Å; I314-V348 HydrophobicContact CD1-CG1 3.56Å; I314-V348 HydrophobicContact CG1-CG1 4.05Å; V348-V350 HydrophobicContact CG1-CG2 4.27Å; V348-I370 HydrophobicContact CG1-CG2 4.47Å; V348-I370 HydrophobicContact CG2-CG2 4.25Å; V348-L374 HydrophobicContact CG2-CD1 3.88Å; V348-V382 HydrophobicContact CB-CG1 4.49Å; V348-V382 HydrophobicContact CG2-CG1 3.63Å; V348-M383 PolarHBondContact N-O 3.05Å; V348-Y384 HydrophobicContact CB-CD1 3.69Å; V348-Y384 HydrophobicContact CB-CE1 3.86Å; V348-Y384 HydrophobicContact CB-CG 4.36Å; V348-Y384 HydrophobicContact CG1-CD1 3.69Å; V348-Y384 HydrophobicContact CG1-CE1 3.85Å; V348-Y384 HydrophobicContact CG2-CD1 4.31Å; V348-Y384 HydrophobicContact CG2-CE1 3.98Å; V348-Y384 WeakPolarHBondContact O-CA 3.28Å; V348-C385 PolarHBondContact O-N 2.85Å
349	A	95.7	Very high	90.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	113.3	172.4	0	0	0	0	0	109.8	L221 L311 L312 V313 I314 N351 C385 V387	L221-A349 HydrophobicContact CD2-CB 4.26Å; L311-A349 HydrophobicContact CD1-CB 3.81Å; L312-A349 PolarHBondContact O-N 2.91Å; V313-A349 WeakPolarHBondContact CA-O 3.16Å; I314-A349 PolarHBondContact N-O 2.8Å; A349-N351 PolarHBondContact O-N 3.43Å; A349-C385 CarbonylContact C-O 3.38Å; A349-C385 WeakPolarHBondContact CA-O 3.38Å; A349-V387 HydrophobicContact CB-CG2 4.04Å
350	V	95.6	Very high	90.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	100	174.2	-174.8	0	0	0	0	107.6	I314 A316 V348 M353 F363 I366 C385 V387	I314-V350 CarbonylContact O-C 3.55Å; I314-V350 WeakPolarHBondContact O-CA 3.16Å; A316-V350 HydrophobicContact CB-CG1 4Å; V348-V350 HydrophobicContact CG1-CG2 4.27Å; V350-M353 HydrophobicContact CB-SD 4.48Å; V350-M353 HydrophobicContact CG1-CG 4.29Å; V350-M353 HydrophobicContact CG1-SD 3.68Å; V350-M353 WeakPolarHBondContact O-CG 3.42Å; V350-F363 HydrophobicContact CB-CD2 4.06Å; V350-F363 HydrophobicContact CB-CE2 4Å; V350-F363 HydrophobicContact CG1-CD2 4.27Å; V350-F363 HydrophobicContact CG2-CD2 4.03Å; V350-F363 HydrophobicContact CG2-CE2 3.74Å; V350-I366 HydrophobicContact CG1-CD1 3.84Å; V350-I366 HydrophobicContact CG1-CG2 4.12Å; V350-I366 HydrophobicContact CG2-CG2 3.76Å; V350-C385 PolarHBondContact N-O 2.79Å; V350-V387 PolarHBondContact O-N 2.8Å
351	N	95.2	Very high	90.7	Very high	6 Å²	6	34 Å²	34	3%	0.032	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	167.2	-174.5	-166.3	19.4	0	0	0	112	A216 V313 I314 A316 A349 M353 V387 G389	A216-N351 PolarHBondContact O-ND2 3.03Å; V313-N351 HydrophobicContact CG1-CB 3.73Å; I314-N351 PolarHBondContact O-N 3.36Å; A316-N351 VanDerWaalsContact CB-O 3.23Å; A316-N351 WeakPolarHBondContact CB-O 3.44Å; A316-N351 PolarHBondContact N-O 3.1Å; A349-N351 PolarHBondContact O-N 3.43Å; N351-M353 VanDerWaalsContact C-N 3.26Å; N351-M353 PolarHBondContact O-N 3.37Å; N351-V387 WeakPolarHBondContact CA-O 3.47Å; N351-V387 HydrophobicContact CB-CG2 4Å; N351-G389 PolarHBondContact OD1-N 3.22Å
352	K	92.9	Very high	91	Very high	50 Å²	50	34 Å²	34	22%	0.217	18%	0.183	C	C	.	.			trans	59.9	27.8	-170.6	-50.9	-163	-161.5	177	0	113.8	D215 N315 E320 D354 T355	D215-K352 WeakPolarHBondContact O-CE 3.36Å; D215-K352 PolarHBondContact O-NZ 3.19Å; D215-K352 VanDerWaalsContact O-NZ 3.14Å; N315-K352 WeakPolarHBondContact ND2-CE 3.44Å; N315-K352 PolarHBondContact ND2-NZ 2.86Å; N315-K352 WeakPolarHBondContact OD1-CD 3.06Å; E320-K352 IonicContact OE1-NZ 2.71Å; E320-K352 PolarHBondContact OE1-NZ 2.9Å; E320-K352 IonicContact OE2-NZ 3.72Å; E320-K352 PolarHBondContact OE2-NZ 2.82Å; K352-D354 VanDerWaalsContact C-OD1 3.31Å; K352-D354 WeakPolarHBondContact CA-OD1 3.24Å; K352-D354 PolarHBondContact O-N 3.47Å; K352-T355 HydrophobicContact CB-CG2 3.99Å; K352-T355 HydrophobicContact CD-CG2 4.4Å; K352-T355 PolarHBondContact O-N 3.22Å; K352-T355 PolarHBondContact O-OG1 3.31Å
353	M	92.3	Very high	91.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-60.8	-19	178.8	-75.7	-65	-54.6	0	0	113.8	A316 V350 N351 V356 E357 W358 F363 P386 V387 W417	A316-M353 HydrophobicContact CB-CG 4.38Å; A316-M353 HydrophobicContact CB-SD 3.71Å; V350-M353 HydrophobicContact CB-SD 4.48Å; V350-M353 HydrophobicContact CG1-CG 4.29Å; V350-M353 HydrophobicContact CG1-SD 3.68Å; V350-M353 WeakPolarHBondContact O-CG 3.42Å; N351-M353 VanDerWaalsContact C-N 3.26Å; N351-M353 PolarHBondContact O-N 3.37Å; M353-V356 HydrophobicContact CE-CG2 3.98Å; M353-V356 CarbonylContact O-C 3.51Å; M353-V356 WeakPolarHBondContact O-CG2 2.97Å; M353-V356 PolarHBondContact O-N 3.39Å; M353-V356 HydrophobicContact SD-CG2 4.07Å; M353-E357 PolarHBondContact O-N 2.91Å; M353-W358 HydrophobicContact CB-CD2 3.93Å; M353-W358 HydrophobicContact CB-CE3 3.4Å; M353-W358 HydrophobicContact CB-CH2 3.84Å; M353-W358 HydrophobicContact CB-CZ2 4.3Å; M353-W358 HydrophobicContact CB-CZ3 3.36Å; M353-W358 HydrophobicContact CG-CE3 4.21Å; M353-W358 HydrophobicContact CG-CZ3 4.06Å; M353-W358 PolarHBondContact O-N 3.48Å; M353-F363 HydrophobicContact CE-CB 4.12Å; M353-F363 HydrophobicContact SD-CD2 4.35Å; M353-P386 HydrophobicContact CG-CB 3.97Å; M353-V387 PolarHBondContact N-O 3.08Å; M353-W417 HydrophobicContact CE-CZ2 4.34Å
354	D	89.5	Confident	91.8	Very high	49 Å²	49	36.9 Å²	36.9	26%	0.262	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-61.3	-34.7	168	49.4	-71.4	0	0	0	113.8	K352 V356 E357 S388 V391	K352-D354 VanDerWaalsContact C-OD1 3.31Å; K352-D354 WeakPolarHBondContact CA-OD1 3.24Å; K352-D354 PolarHBondContact O-N 3.47Å; D354-V356 PolarHBondContact O-N 3.46Å; D354-E357 PolarHBondContact O-N 2.99Å; D354-S388 WeakPolarHBondContact OD1-CB 3.4Å; D354-S388 PolarHBondContact OD1-OG 2.87Å; D354-V391 HydrophobicContact CB-CG2 4.24Å
355	T	90.9	Very high	92.6	Very high	72 Å²	72	39.4 Å²	39.4	44%	0.442	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-72.3	-11.7	178.2	70.1	0	0	0	0	113.4	T317 K352	T317-T355 PolarHBondContact OG1-OG1 3.23Å; T317-T355 VanDerWaalsContact OG1-OG1 3.05Å; K352-T355 HydrophobicContact CB-CG2 3.99Å; K352-T355 HydrophobicContact CD-CG2 4.4Å; K352-T355 PolarHBondContact O-N 3.22Å; K352-T355 PolarHBondContact O-OG1 3.31Å
356	V	90.3	Very high	92.9	Very high	23 Å²	23	36.2 Å²	36.2	14%	0.139	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-120.7	24.2	177	-61	0	0	0	0	111.8	A316 M353 D354 W358 C359 R362	A316-V356 HydrophobicContact CB-CG2 3.89Å; M353-V356 HydrophobicContact CE-CG2 3.98Å; M353-V356 CarbonylContact O-C 3.51Å; M353-V356 WeakPolarHBondContact O-CG2 2.97Å; M353-V356 PolarHBondContact O-N 3.39Å; M353-V356 HydrophobicContact SD-CG2 4.07Å; D354-V356 PolarHBondContact O-N 3.46Å; V356-W358 PolarHBondContact O-N 3.32Å; V356-C359 WeakPolarHBondContact O-CB 3.35Å; V356-C359 PolarHBondContact O-N 3.06Å; V356-R362 HydrophobicContact CG1-CG 4.4Å; V356-R362 HydrophobicContact CG2-CG 4.47Å
357	E	88.4	Confident	92.9	Very high	164 Å²	164	39 Å²	39	77%	0.766	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	31.4	173.8	-58.7	-178.3	166.9	0	0	114.3	M353 D354 C359	M353-E357 PolarHBondContact O-N 2.91Å; D354-E357 PolarHBondContact O-N 2.99Å; E357-C359 PolarHBondContact O-N 3.14Å
358	W	88.5	Confident	92.9	Very high	7 Å²	7	43.4 Å²	43.4	3%	0.027	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	27	-175	-57.9	92.9	0	0	0	114.7	M353 V356 Q360 P386 A393 T410 N413 L414 W417	M353-W358 HydrophobicContact CB-CD2 3.93Å; M353-W358 HydrophobicContact CB-CE3 3.4Å; M353-W358 HydrophobicContact CB-CH2 3.84Å; M353-W358 HydrophobicContact CB-CZ2 4.3Å; M353-W358 HydrophobicContact CB-CZ3 3.36Å; M353-W358 HydrophobicContact CG-CE3 4.21Å; M353-W358 HydrophobicContact CG-CZ3 4.06Å; M353-W358 PolarHBondContact O-N 3.48Å; V356-W358 PolarHBondContact O-N 3.32Å; W358-Q360 PolarHBondContact O-N 2.9Å; W358-P386 HydrophobicContact CZ3-CB 4.4Å; W358-A393 HydrophobicContact CH2-CB 3.54Å; W358-A393 HydrophobicContact CZ2-CB 3.59Å; W358-T410 PolarHBondContact NE1-O 3.47Å; W358-N413 HydrophobicContact CB-CB 4.24Å; W358-L414 HydrophobicContact CD2-CB 4.07Å; W358-L414 HydrophobicContact CE3-CB 3.82Å; W358-L414 HydrophobicContact CE3-CD1 3.76Å; W358-L414 HydrophobicContact CE3-CD2 4.05Å; W358-L414 HydrophobicContact CE3-CG 4.06Å; W358-L414 HydrophobicContact CG-CB 4.4Å; W358-L414 HydrophobicContact CH2-CD2 4.32Å; W358-L414 HydrophobicContact CZ3-CB 4.36Å; W358-L414 HydrophobicContact CZ3-CD1 4.05Å; W358-L414 HydrophobicContact CZ3-CD2 3.73Å; W358-L414 HydrophobicContact CZ3-CG 4.25Å; W358-W417 PolarHBondContact O-NE1 2.59Å
359	C	90.3	Very high	92.7	Very high	52 Å²	52	46.6 Å²	46.6	35%	0.351	25%	0.248	S	C	.	.			trans	-63.6	112.9	-175.9	-169.6	0	0	0	0	113.4	V356 E357 S361 R362 F363	V356-C359 WeakPolarHBondContact O-CB 3.35Å; V356-C359 PolarHBondContact O-N 3.06Å; E357-C359 PolarHBondContact O-N 3.14Å; C359-S361 VanDerWaalsContact C-N 3.3Å; C359-S361 PolarHBondContact O-N 2.8Å; C359-S361 PolarHBondContact SG-OG 3.42Å; C359-R362 PolarHBondContact O-N 3.46Å; C359-F363 PolarHBondContact O-N 2.95Å
360	Q	92.1	Very high	92.6	Very high	90 Å²	90	46.6 Å²	46.6	42%	0.421	25%	0.248	S	C	.	.	H	α-helix	trans	-57.3	-37.1	-179.3	-173.4	-178.1	27.9	0	0	113.5	W358 R362 F363 N364 W417	W358-Q360 PolarHBondContact O-N 2.9Å; Q360-R362 PolarHBondContact O-N 3.34Å; Q360-F363 PolarHBondContact O-N 3.24Å; Q360-N364 VanDerWaalsContact O-CG 3.27Å; Q360-N364 PolarHBondContact O-N 3.3Å; Q360-N364 PolarHBondContact O-OD1 3.31Å; Q360-W417 HydrophobicContact CB-CD2 3.75Å; Q360-W417 HydrophobicContact CB-CE3 4.2Å; Q360-W417 HydrophobicContact CB-CG 3.94Å; Q360-W417 HydrophobicContact CB-CZ2 4.36Å; Q360-W417 HydrophobicContact CG-CB 4.42Å; Q360-W417 HydrophobicContact CG-CD2 3.69Å; Q360-W417 HydrophobicContact CG-CE3 3.66Å; Q360-W417 HydrophobicContact CG-CG 4.04Å; Q360-W417 HydrophobicContact CG-CZ3 4.17Å
361	S	93.8	Very high	92.4	Very high	83 Å²	83	47.9 Å²	47.9	58%	0.58	26%	0.257	S	S	*	.	H	α-helix	trans	-66.1	-37.8	-177.3	62.1	0	0	0	0	112.2	C359 N364 E365	C359-S361 VanDerWaalsContact C-N 3.3Å; C359-S361 PolarHBondContact O-N 2.8Å; C359-S361 PolarHBondContact SG-OG 3.42Å; S361-N364 PolarHBondContact O-N 3.29Å; S361-E365 WeakPolarHBondContact O-CB 3.36Å; S361-E365 PolarHBondContact O-N 3.14Å
362	R	93.6	Very high	92.2	Very high	8 Å²	8	51.4 Å²	51.4	3%	0.03	28%	0.282	C	S	.	.	H	α-helix	trans	-67.5	-39.4	173.3	-179.4	53.8	168.8	-172.2	-1.3	111.6	A316 T317 F321 E322 V356 C359 Q360 E365 I366	A316-R362 PolarHBondContact O-NE 3.22Å; A316-R362 PolarHBondContact O-NH2 3.25Å; T317-R362 PolarHBondContact O-NH2 3.14Å; F321-R362 VanDerWaalsContact CB-NH2 3.33Å; E322-R362 IonicContact OE1-CZ 2.82Å; E322-R362 VanDerWaalsContact OE1-CZ 3.26Å; E322-R362 IonicContact OE1-NH1 2.7Å; E322-R362 PolarHBondContact OE1-NH1 2.99Å; E322-R362 IonicContact OE1-NH2 2.75Å; E322-R362 PolarHBondContact OE1-NH2 2.83Å; E322-R362 IonicContact OE2-NH2 3.79Å; E322-R362 PolarHBondContact OE2-NH2 2.74Å; V356-R362 HydrophobicContact CG1-CG 4.4Å; V356-R362 HydrophobicContact CG2-CG 4.47Å; C359-R362 PolarHBondContact O-N 3.46Å; Q360-R362 PolarHBondContact O-N 3.34Å; R362-E365 WeakPolarHBondContact CD-OE2 3.25Å; R362-E365 IonicContact CZ-OE2 3.42Å; R362-E365 IonicContact NE-OE2 2.81Å; R362-E365 VanDerWaalsContact NH1-CD 3.33Å; R362-E365 IonicContact NH1-OE1 3.42Å; R362-E365 PolarHBondContact NH1-OE1 3.25Å; R362-E365 IonicContact NH1-OE2 3.46Å; R362-E365 PolarHBondContact NH1-OE2 3.09Å; R362-E365 WeakPolarHBondContact O-CB 3.39Å; R362-E365 PolarHBondContact O-N 3.42Å; R362-I366 HydrophobicContact CG-CD1 3.89Å; R362-I366 WeakPolarHBondContact O-CB 3.39Å; R362-I366 WeakPolarHBondContact O-CD1 3.01Å; R362-I366 WeakPolarHBondContact O-CG1 3.19Å; R362-I366 PolarHBondContact O-N 3.2Å
363	F	94.5	Very high	92	Very high	7 Å²	7	50.1 Å²	50.1	3%	0.031	28%	0.276	C	S	.	.	H	α-helix	trans	-61.3	-45.4	173.5	-179.2	-95.8	0	0	0	111.9	V350 M353 C359 Q360 E365 I366 Q367 P386 W417	V350-F363 HydrophobicContact CB-CD2 4.06Å; V350-F363 HydrophobicContact CB-CE2 4Å; V350-F363 HydrophobicContact CG1-CD2 4.27Å; V350-F363 HydrophobicContact CG2-CD2 4.03Å; V350-F363 HydrophobicContact CG2-CE2 3.74Å; M353-F363 HydrophobicContact CE-CB 4.12Å; M353-F363 HydrophobicContact SD-CD2 4.35Å; C359-F363 PolarHBondContact O-N 2.95Å; Q360-F363 PolarHBondContact O-N 3.24Å; F363-E365 PolarHBondContact O-N 3.21Å; F363-I366 PolarHBondContact O-N 3.34Å; F363-Q367 WeakPolarHBondContact O-CB 3.39Å; F363-Q367 PolarHBondContact O-N 3.23Å; F363-P386 HydrophobicContact CD2-CB 3.83Å; F363-P386 HydrophobicContact CD2-CG 4.47Å; F363-P386 HydrophobicContact CE2-CB 3.73Å; F363-P386 HydrophobicContact CE2-CG 4.07Å; F363-P386 HydrophobicContact CZ-CG 4.39Å; F363-W417 HydrophobicContact CB-CH2 3.72Å; F363-W417 HydrophobicContact CB-CZ2 4.38Å; F363-W417 HydrophobicContact CB-CZ3 4.42Å; F363-W417 AromaticContact CD1-CH2 3.71Å; F363-W417 HydrophobicContact CD1-CH2 3.71Å; F363-W417 AromaticContact CD1-CZ3 3.7Å; F363-W417 HydrophobicContact CD1-CZ3 3.7Å; F363-W417 HydrophobicContact CD2-CH2 4.18Å; F363-W417 HydrophobicContact CE1-CH2 4.36Å; F363-W417 HydrophobicContact CE1-CZ3 4.16Å; F363-W417 AromaticContact CG-CH2 3.59Å; F363-W417 HydrophobicContact CG-CH2 3.59Å; F363-W417 HydrophobicContact CG-CZ3 4.09Å
364	N	94.7	Very high	91.9	Very high	66 Å²	66	50.2 Å²	50.2	35%	0.353	28%	0.277	S	S	.	.	H	α-helix	trans	-65.6	-37	178.3	-68.1	-8	0	0	0	112.4	Q360 S361 T368	Q360-N364 VanDerWaalsContact O-CG 3.27Å; Q360-N364 PolarHBondContact O-N 3.3Å; Q360-N364 PolarHBondContact O-OD1 3.31Å; S361-N364 PolarHBondContact O-N 3.29Å; N364-T368 WeakPolarHBondContact O-CB 3.44Å; N364-T368 PolarHBondContact O-N 3.01Å; N364-T368 PolarHBondContact O-OG1 3.38Å
365	E	94.6	Very high	91.8	Very high	75 Å²	75	55.2 Å²	55.2	35%	0.35	30%	0.296	S	S	.	.	H	α-helix	trans	-59.6	-53.7	171.9	-172.6	-155.1	167.3	0	0	110.8	S361 R362 F363 Q367 T368 Q369	S361-E365 WeakPolarHBondContact O-CB 3.36Å; S361-E365 PolarHBondContact O-N 3.14Å; R362-E365 WeakPolarHBondContact CD-OE2 3.25Å; R362-E365 IonicContact CZ-OE2 3.42Å; R362-E365 IonicContact NE-OE2 2.81Å; R362-E365 VanDerWaalsContact NH1-CD 3.33Å; R362-E365 IonicContact NH1-OE1 3.42Å; R362-E365 PolarHBondContact NH1-OE1 3.25Å; R362-E365 IonicContact NH1-OE2 3.46Å; R362-E365 PolarHBondContact NH1-OE2 3.09Å; R362-E365 WeakPolarHBondContact O-CB 3.39Å; R362-E365 PolarHBondContact O-N 3.42Å; F363-E365 PolarHBondContact O-N 3.21Å; E365-Q367 PolarHBondContact O-N 3.25Å; E365-T368 PolarHBondContact O-N 2.79Å; E365-T368 VanDerWaalsContact O-N 3.12Å; E365-Q369 PolarHBondContact O-N 3.16Å; E365-Q369 PolarHBondContact OE1-NE2 2.93Å
366	I	94.7	Very high	91.4	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-56.1	-49.6	178.2	-72.1	166.6	0	0	0	110.7	I314 A316 F321 V350 R362 F363 T368 Q369 I370	I314-I366 HydrophobicContact CG2-CG2 4.29Å; A316-I366 HydrophobicContact CB-CD1 4.23Å; F321-I366 HydrophobicContact CD1-CG1 4.2Å; F321-I366 HydrophobicContact CD2-CD1 4.41Å; F321-I366 HydrophobicContact CD2-CG1 3.94Å; F321-I366 HydrophobicContact CD2-CG2 4.37Å; F321-I366 HydrophobicContact CE1-CG1 3.93Å; F321-I366 HydrophobicContact CE2-CB 3.97Å; F321-I366 HydrophobicContact CE2-CG1 3.64Å; F321-I366 HydrophobicContact CE2-CG2 3.62Å; F321-I366 HydrophobicContact CG-CG1 4.21Å; F321-I366 HydrophobicContact CZ-CB 3.93Å; F321-I366 HydrophobicContact CZ-CG1 3.63Å; F321-I366 HydrophobicContact CZ-CG2 4.03Å; V350-I366 HydrophobicContact CG1-CD1 3.84Å; V350-I366 HydrophobicContact CG1-CG2 4.12Å; V350-I366 HydrophobicContact CG2-CG2 3.76Å; R362-I366 HydrophobicContact CG-CD1 3.89Å; R362-I366 WeakPolarHBondContact O-CB 3.39Å; R362-I366 WeakPolarHBondContact O-CD1 3.01Å; R362-I366 WeakPolarHBondContact O-CG1 3.19Å; R362-I366 PolarHBondContact O-N 3.2Å; F363-I366 PolarHBondContact O-N 3.34Å; I366-T368 VanDerWaalsContact C-N 3.29Å; I366-T368 PolarHBondContact O-N 2.73Å; I366-Q369 PolarHBondContact O-N 2.77Å; I366-I370 WeakPolarHBondContact O-CB 2.96Å; I366-I370 WeakPolarHBondContact O-CG1 3.21Å; I366-I370 PolarHBondContact O-N 3.23Å
367	Q	93.8	Very high	91	Very high	63 Å²	63	52.3 Å²	52.3	29%	0.294	28%	0.28	S	S	.	.	H	α-helix	trans	-59.7	-39.7	178.1	-175.3	178.7	24.6	0	0	111.6	F363 E365 S371 Y384	F363-Q367 WeakPolarHBondContact O-CB 3.39Å; F363-Q367 PolarHBondContact O-N 3.23Å; E365-Q367 PolarHBondContact O-N 3.25Å; Q367-S371 WeakPolarHBondContact O-CA 3.47Å; Q367-S371 WeakPolarHBondContact O-CB 3.45Å; Q367-S371 PolarHBondContact O-N 3.18Å; Q367-S371 PolarHBondContact O-OG 3.33Å; Q367-Y384 HydrophobicContact CB-CD1 4.31Å; Q367-Y384 HydrophobicContact CB-CE1 4.45Å; Q367-Y384 HydrophobicContact CG-CD1 3.85Å; Q367-Y384 HydrophobicContact CG-CD2 4.06Å; Q367-Y384 HydrophobicContact CG-CE1 3.95Å; Q367-Y384 HydrophobicContact CG-CE2 4.15Å; Q367-Y384 HydrophobicContact CG-CG 3.91Å
368	T	93.9	Very high	90.8	Very high	97 Å²	97	47 Å²	47	60%	0.595	26%	0.256	S	S	*	.	H	α-helix	trans	-68.2	-49	-180	-60.7	0	0	0	0	111.6	N364 E365 I366 S371 S372	N364-T368 WeakPolarHBondContact O-CB 3.44Å; N364-T368 PolarHBondContact O-N 3.01Å; N364-T368 PolarHBondContact O-OG1 3.38Å; E365-T368 PolarHBondContact O-N 2.79Å; E365-T368 VanDerWaalsContact O-N 3.12Å; I366-T368 VanDerWaalsContact C-N 3.29Å; I366-T368 PolarHBondContact O-N 2.73Å; T368-S371 PolarHBondContact O-N 3.04Å; T368-S372 PolarHBondContact O-N 3.28Å
369	Q	92.3	Very high	90.4	Very high	66 Å²	66	47.4 Å²	47.4	31%	0.308	26%	0.258	S	S	.	.	H	α-helix	trans	-61	-50	178.1	-66.2	-168.1	36.7	0	0	111.1	F321 E365 I366 S371 S372 F373	F321-Q369 HydrophobicContact CZ-CB 4.25Å; E365-Q369 PolarHBondContact O-N 3.16Å; E365-Q369 PolarHBondContact OE1-NE2 2.93Å; I366-Q369 PolarHBondContact O-N 2.77Å; Q369-S371 PolarHBondContact O-N 2.92Å; Q369-S372 PolarHBondContact O-N 3.35Å; Q369-S372 PolarHBondContact O-OG 3.29Å; Q369-F373 PolarHBondContact O-N 3.44Å
370	I	92.9	Very high	89.7	Confident	1 Å²	1	48 Å²	48	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-66.4	-36.7	179.1	-69.8	-67.9	0	0	0	112	I314 F321 I325 V348 I366 S372 F373 L374 Y384	I314-I370 HydrophobicContact CD1-CB 4.39Å; I314-I370 HydrophobicContact CD1-CD1 3.53Å; I314-I370 HydrophobicContact CD1-CG1 3.59Å; I314-I370 HydrophobicContact CD1-CG2 3.99Å; F321-I370 HydrophobicContact CE2-CG1 4.23Å; F321-I370 HydrophobicContact CZ-CG1 4.45Å; I325-I370 HydrophobicContact CD1-CD1 3.44Å; I325-I370 VanDerWaalsContact CD1-CD1 3.44Å; I325-I370 HydrophobicContact CD1-CG1 3.92Å; I325-I370 HydrophobicContact CG1-CD1 4Å; V348-I370 HydrophobicContact CG1-CG2 4.47Å; V348-I370 HydrophobicContact CG2-CG2 4.25Å; I366-I370 WeakPolarHBondContact O-CB 2.96Å; I366-I370 WeakPolarHBondContact O-CG1 3.21Å; I366-I370 PolarHBondContact O-N 3.23Å; I370-S372 VanDerWaalsContact C-N 3.32Å; I370-S372 PolarHBondContact O-N 2.84Å; I370-F373 PolarHBondContact O-N 3.32Å; I370-L374 HydrophobicContact CG2-CD1 3.46Å; I370-L374 VanDerWaalsContact CG2-CD1 3.46Å; I370-L374 HydrophobicContact CG2-CG 3.94Å; I370-L374 WeakPolarHBondContact O-CB 3.49Å; I370-L374 WeakPolarHBondContact O-CG 3.47Å; I370-L374 PolarHBondContact O-N 3.5Å; I370-Y384 HydrophobicContact CB-CE1 4.35Å; I370-Y384 HydrophobicContact CG2-CE1 3.84Å
371	S	92	Very high	89.1	Confident	26 Å²	26	46.7 Å²	46.7	18%	0.182	27%	0.273	C	S	.	.	H	α-helix	trans	-59.8	-41.8	172.7	-71.2	0	0	0	0	112.1	Q367 T368 Q369 F373 K375 Y384	Q367-S371 WeakPolarHBondContact O-CA 3.47Å; Q367-S371 WeakPolarHBondContact O-CB 3.45Å; Q367-S371 PolarHBondContact O-N 3.18Å; Q367-S371 PolarHBondContact O-OG 3.33Å; T368-S371 PolarHBondContact O-N 3.04Å; Q369-S371 PolarHBondContact O-N 2.92Å; S371-F373 VanDerWaalsContact C-N 3.31Å; S371-F373 PolarHBondContact O-N 3.22Å; S371-K375 VanDerWaalsContact O-CB 3.22Å; S371-K375 WeakPolarHBondContact O-CB 3.15Å; S371-K375 WeakPolarHBondContact O-CD 3.41Å; S371-K375 WeakPolarHBondContact O-CG 3.48Å; S371-K375 PolarHBondContact O-N 2.81Å; S371-Y384 WeakPolarHBondContact CA-OH 3.26Å; S371-Y384 PolarHBondContact N-OH 2.91Å; S371-Y384 PolarHBondContact OG-OH 2.87Å
372	S	90	Very high	88.9	Confident	81 Å²	81	44.1 Å²	44.1	57%	0.566	25%	0.254	S	S	*	.	H	α-helix	trans	-63.2	-40	177.5	79.8	0	0	0	0	111.8	T368 Q369 I370 S376	T368-S372 PolarHBondContact O-N 3.28Å; Q369-S372 PolarHBondContact O-N 3.35Å; Q369-S372 PolarHBondContact O-OG 3.29Å; I370-S372 VanDerWaalsContact C-N 3.32Å; I370-S372 PolarHBondContact O-N 2.84Å; S372-S376 PolarHBondContact O-N 2.93Å
373	F	88.8	Confident	88.7	Confident	22 Å²	22	46.7 Å²	46.7	10%	0.096	27%	0.267	C	S	.	.	H	α-helix	trans	-71.5	-47.8	-179.8	175.4	-116.4	0	0	0	112.5	R332 A335 Q369 I370 S371 K375 S376 M377	R332-F373 HydrophobicContact CB-CE1 4Å; R332-F373 HydrophobicContact CB-CE2 4.11Å; R332-F373 HydrophobicContact CB-CZ 3.44Å; R332-F373 VanDerWaalsContact CB-CZ 3.44Å; R332-F373 HydrophobicContact CG-CD1 4.34Å; R332-F373 HydrophobicContact CG-CE1 3.7Å; R332-F373 HydrophobicContact CG-CE2 3.99Å; R332-F373 HydrophobicContact CG-CZ 3.49Å; R332-F373 VanDerWaalsContact CG-CZ 3.49Å; R332-F373 VanDerWaalsContact NE-CE2 3.25Å; A335-F373 HydrophobicContact CB-CE1 3.93Å; Q369-F373 PolarHBondContact O-N 3.44Å; I370-F373 PolarHBondContact O-N 3.32Å; S371-F373 VanDerWaalsContact C-N 3.31Å; S371-F373 PolarHBondContact O-N 3.22Å; F373-K375 VanDerWaalsContact C-N 3.35Å; F373-K375 PolarHBondContact O-N 3.48Å; F373-S376 WeakPolarHBondContact O-CB 3.24Å; F373-S376 PolarHBondContact O-N 2.67Å; F373-S376 VanDerWaalsContact O-N 3.09Å; F373-S376 PolarHBondContact O-OG 2.7Å; F373-M377 HydrophobicContact CE1-CE 4.11Å; F373-M377 HydrophobicContact CE1-SD 3.97Å; F373-M377 HydrophobicContact CE2-CE 3.56Å; F373-M377 HydrophobicContact CE2-SD 4.17Å; F373-M377 HydrophobicContact CZ-CE 3.21Å; F373-M377 HydrophobicContact CZ-SD 3.67Å; F373-M377 PolarHBondContact O-N 3.02Å
374	L	89.9	Confident	88.7	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-69.8	-30.6	179.7	-64.4	176.8	0	0	0	112.6	A335 L346 V348 I370 S376 M377 N378 F379 V382	A335-L374 HydrophobicContact CB-CD2 4.09Å; L346-L374 HydrophobicContact CD2-CD1 3.85Å; L346-L374 HydrophobicContact CD2-CD2 3.69Å; L346-L374 HydrophobicContact CD2-CG 4.4Å; V348-L374 HydrophobicContact CG2-CD1 3.88Å; I370-L374 HydrophobicContact CG2-CD1 3.46Å; I370-L374 VanDerWaalsContact CG2-CD1 3.46Å; I370-L374 HydrophobicContact CG2-CG 3.94Å; I370-L374 WeakPolarHBondContact O-CB 3.49Å; I370-L374 WeakPolarHBondContact O-CG 3.47Å; I370-L374 PolarHBondContact O-N 3.5Å; L374-S376 VanDerWaalsContact C-N 3.33Å; L374-M377 PolarHBondContact O-N 2.9Å; L374-N378 PolarHBondContact O-N 3.15Å; L374-F379 HydrophobicContact CB-CB 4.37Å; L374-F379 HydrophobicContact CB-CD2 4.3Å; L374-F379 HydrophobicContact CD2-CD2 3.7Å; L374-F379 HydrophobicContact CD2-CE2 3.96Å; L374-F379 PolarHBondContact O-N 2.76Å; L374-F379 VanDerWaalsContact O-N 3.16Å; L374-V382 HydrophobicContact CB-CG2 4.43Å; L374-V382 HydrophobicContact CD1-CG1 3.8Å; L374-V382 HydrophobicContact CD1-CG2 4.11Å
375	K	87.3	Confident	88.6	Confident	154 Å²	154	44.4 Å²	44.4	67%	0.67	25%	0.254	S	S	*	.	H	α-helix	trans	-61.9	-38	167.9	-77.6	171.6	-177.4	178.8	0	112.1	S371 F373 M377 N378	S371-K375 VanDerWaalsContact O-CB 3.22Å; S371-K375 WeakPolarHBondContact O-CB 3.15Å; S371-K375 WeakPolarHBondContact O-CD 3.41Å; S371-K375 WeakPolarHBondContact O-CG 3.48Å; S371-K375 PolarHBondContact O-N 2.81Å; F373-K375 VanDerWaalsContact C-N 3.35Å; F373-K375 PolarHBondContact O-N 3.48Å; K375-M377 PolarHBondContact O-N 3.23Å; K375-N378 PolarHBondContact O-N 3.39Å
376	S	83.7	Confident	88.6	Confident	29 Å²	29	40.9 Å²	40.9	20%	0.203	24%	0.237	C	C	.	.	H	α-helix	trans	-62.8	-31.9	175.2	79.9	0	0	0	0	112.4	F64 S372 F373 L374	F64-S376 WeakPolarHBondContact CD2-O 3.39Å; S372-S376 PolarHBondContact O-N 2.93Å; F373-S376 WeakPolarHBondContact O-CB 3.24Å; F373-S376 PolarHBondContact O-N 2.67Å; F373-S376 VanDerWaalsContact O-N 3.09Å; F373-S376 PolarHBondContact O-OG 2.7Å; L374-S376 VanDerWaalsContact C-N 3.33Å
377	M	81.6	Confident	88.5	Confident	6 Å²	6	40.9 Å²	40.9	3%	0.03	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	3.1	179.2	-66.8	-173.7	157.8	0	0	114.6	F64 A335 R336 R339 F373 L374 K375 F379	F64-M377 HydrophobicContact CE2-CG 4.24Å; F64-M377 HydrophobicContact CZ-CB 4.48Å; F64-M377 HydrophobicContact CZ-CG 4.12Å; A335-M377 HydrophobicContact CB-SD 4.09Å; R336-M377 HydrophobicContact CB-CE 3.54Å; R336-M377 HydrophobicContact CB-SD 4.48Å; R336-M377 HydrophobicContact CG-CE 3.8Å; R339-M377 WeakPolarHBondContact CG-O 3.43Å; R339-M377 PolarHBondContact NE-O 3Å; F373-M377 HydrophobicContact CE1-CE 4.11Å; F373-M377 HydrophobicContact CE1-SD 3.97Å; F373-M377 HydrophobicContact CE2-CE 3.56Å; F373-M377 HydrophobicContact CE2-SD 4.17Å; F373-M377 HydrophobicContact CZ-CE 3.21Å; F373-M377 HydrophobicContact CZ-SD 3.67Å; F373-M377 PolarHBondContact O-N 3.02Å; L374-M377 PolarHBondContact O-N 2.9Å; K375-M377 PolarHBondContact O-N 3.23Å; M377-F379 HydrophobicContact CB-CD2 3.92Å; M377-F379 HydrophobicContact CB-CE2 4.14Å; M377-F379 PolarHBondContact O-N 3.48Å; M377-F379 HydrophobicContact SD-CE2 4.32Å
378	N	82.9	Confident	88.5	Confident	52 Å²	52	37.9 Å²	37.9	28%	0.278	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	49.4	-173.2	-63.2	18.3	0	0	0	113.6	F64 R339 L374 K375	F64-N378 HydrophobicContact CB-CB 4.27Å; F64-N378 PolarHBondContact O-ND2 3.28Å; F64-N378 PolarHBondContact O-OD1 3.5Å; R339-N378 PolarHBondContact NE-O 3.33Å; L374-N378 PolarHBondContact O-N 3.15Å; K375-N378 PolarHBondContact O-N 3.39Å
379	F	80.4	Confident	88.2	Confident	16 Å²	16	33.3 Å²	33.3	7%	0.07	20%	0.195	C	C	.	.			trans	-85.5	123.6	157.1	-75.2	-77.1	0	0	0	109.9	A335 A338 R339 L346 L374 M377 V382	A335-F379 WeakPolarHBondContact O-CE2 3.15Å; A335-F379 WeakPolarHBondContact O-CZ 3.41Å; A338-F379 HydrophobicContact CB-CZ 4.29Å; R339-F379 HydrophobicContact CB-CE1 4.21Å; R339-F379 HydrophobicContact CB-CE2 3.79Å; R339-F379 HydrophobicContact CB-CZ 3.54Å; R339-F379 HydrophobicContact CG-CE2 4.29Å; R339-F379 HydrophobicContact CG-CZ 4.22Å; L346-F379 HydrophobicContact CB-CD1 3.92Å; L346-F379 HydrophobicContact CB-CE1 4.01Å; L346-F379 HydrophobicContact CD2-CD1 4.06Å; L346-F379 HydrophobicContact CD2-CD2 4.02Å; L346-F379 HydrophobicContact CD2-CE1 3.99Å; L346-F379 HydrophobicContact CD2-CE2 3.94Å; L346-F379 HydrophobicContact CD2-CG 4.06Å; L346-F379 HydrophobicContact CD2-CZ 3.91Å; L346-F379 HydrophobicContact CG-CE1 4.46Å; L374-F379 HydrophobicContact CB-CB 4.37Å; L374-F379 HydrophobicContact CB-CD2 4.3Å; L374-F379 HydrophobicContact CD2-CD2 3.7Å; L374-F379 HydrophobicContact CD2-CE2 3.96Å; L374-F379 PolarHBondContact O-N 2.76Å; L374-F379 VanDerWaalsContact O-N 3.16Å; M377-F379 HydrophobicContact CB-CD2 3.92Å; M377-F379 HydrophobicContact CB-CE2 4.14Å; M377-F379 PolarHBondContact O-N 3.48Å; M377-F379 HydrophobicContact SD-CE2 4.32Å; F379-V382 HydrophobicContact CB-CG2 3.64Å
380	S	76	Confident	88	Confident	65 Å²	65	34.9 Å²	34.9	46%	0.455	21%	0.205	S	C	.	.			trans	-93.5	151.7	170.2	44.7	0	0	0	0	110.5	V382	S380-V382 VanDerWaalsContact C-N 3.33Å; S380-V382 PolarHBondContact O-N 2.93Å
381	G	80.5	Confident	87.7	Confident	61 Å²	61	37.2 Å²	37.2	63%	0.629	22%	0.219	S	C	*	.	S	Bend	trans	61.5	29.2	169.5	0	0	0	0	0	116.6	M383	G381-M383 PolarHBondContact O-N 3.28Å
382	V	88.3	Confident	87.4	Confident	30 Å²	30	36.8 Å²	36.8	18%	0.182	22%	0.219	C	C	.	.			trans	-64.7	125.8	178.8	-177.2	0	0	0	0	110.8	V348 L374 F379 S380 Y384	V348-V382 HydrophobicContact CB-CG1 4.49Å; V348-V382 HydrophobicContact CG2-CG1 3.63Å; L374-V382 HydrophobicContact CB-CG2 4.43Å; L374-V382 HydrophobicContact CD1-CG1 3.8Å; L374-V382 HydrophobicContact CD1-CG2 4.11Å; F379-V382 HydrophobicContact CB-CG2 3.64Å; S380-V382 VanDerWaalsContact C-N 3.33Å; S380-V382 PolarHBondContact O-N 2.93Å; V382-Y384 HydrophobicContact CB-CE2 4.13Å; V382-Y384 HydrophobicContact CG1-CD2 4.36Å; V382-Y384 HydrophobicContact CG1-CE2 3.73Å
383	M	90.5	Very high	87.2	Confident	61 Å²	61	33.4 Å²	33.4	30%	0.3	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	145.1	177.7	-56.9	-171.3	-66.5	0	0	111	I347 V348 G381 L426	I347-M383 HydrophobicContact CD1-CE 4.12Å; I347-M383 HydrophobicContact CG1-CE 3.94Å; V348-M383 PolarHBondContact N-O 3.05Å; G381-M383 PolarHBondContact O-N 3.28Å; M383-L426 HydrophobicContact CB-CD2 3.95Å; M383-L426 HydrophobicContact CE-CB 4.35Å; M383-L426 HydrophobicContact CE-CD2 3.89Å; M383-L426 WeakPolarHBondContact CE-O 3.09Å; M383-L426 HydrophobicContact CG-CD2 4.35Å; M383-L426 HydrophobicContact SD-CD2 3.6Å
384	Y	93.6	Very high	87.2	Confident	26 Å²	26	33 Å²	33	10%	0.102	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	131.9	-174.9	-67.4	-95.8	0	0	0	111.9	V348 Q367 I370 S371 V382 Y418	V348-Y384 HydrophobicContact CB-CD1 3.69Å; V348-Y384 HydrophobicContact CB-CE1 3.86Å; V348-Y384 HydrophobicContact CB-CG 4.36Å; V348-Y384 HydrophobicContact CG1-CD1 3.69Å; V348-Y384 HydrophobicContact CG1-CE1 3.85Å; V348-Y384 HydrophobicContact CG2-CD1 4.31Å; V348-Y384 HydrophobicContact CG2-CE1 3.98Å; V348-Y384 WeakPolarHBondContact O-CA 3.28Å; Q367-Y384 HydrophobicContact CB-CD1 4.31Å; Q367-Y384 HydrophobicContact CB-CE1 4.45Å; Q367-Y384 HydrophobicContact CG-CD1 3.85Å; Q367-Y384 HydrophobicContact CG-CD2 4.06Å; Q367-Y384 HydrophobicContact CG-CE1 3.95Å; Q367-Y384 HydrophobicContact CG-CE2 4.15Å; Q367-Y384 HydrophobicContact CG-CG 3.91Å; I370-Y384 HydrophobicContact CB-CE1 4.35Å; I370-Y384 HydrophobicContact CG2-CE1 3.84Å; S371-Y384 WeakPolarHBondContact CA-OH 3.26Å; S371-Y384 PolarHBondContact N-OH 2.91Å; S371-Y384 PolarHBondContact OG-OH 2.87Å; V382-Y384 HydrophobicContact CB-CE2 4.13Å; V382-Y384 HydrophobicContact CG1-CD2 4.36Å; V382-Y384 HydrophobicContact CG1-CE2 3.73Å; Y384-Y418 PolarHBondContact O-OH 2.66Å
385	C	93.1	Very high	87.1	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	118.5	-176.1	-167.1	0	0	0	0	111.5	V348 A349 V350 V387 N394 L426	V348-C385 PolarHBondContact O-N 2.85Å; A349-C385 CarbonylContact C-O 3.38Å; A349-C385 WeakPolarHBondContact CA-O 3.38Å; V350-C385 PolarHBondContact N-O 2.79Å; C385-V387 HydrophobicContact CB-CG1 4.4Å; C385-V387 VanDerWaalsContact SG-CG1 3.58Å; C385-N394 PolarHBondContact SG-ND2 2.69Å; C385-L426 HydrophobicContact CB-CD1 3.51Å
386	P	94.2	Very high	87.1	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	129	167.1	31.2	-30.9	0	0	0	109.5	M353 W358 F363 N394 L414 W417 Y418	M353-P386 HydrophobicContact CG-CB 3.97Å; W358-P386 HydrophobicContact CZ3-CB 4.4Å; F363-P386 HydrophobicContact CD2-CB 3.83Å; F363-P386 HydrophobicContact CD2-CG 4.47Å; F363-P386 HydrophobicContact CE2-CB 3.73Å; F363-P386 HydrophobicContact CE2-CG 4.07Å; F363-P386 HydrophobicContact CZ-CG 4.39Å; P386-N394 WeakPolarHBondContact O-CB 3.5Å; P386-N394 PolarHBondContact O-ND2 3.38Å; P386-L414 HydrophobicContact CB-CD1 4.1Å; P386-L414 HydrophobicContact CG-CD1 3.61Å; P386-W417 HydrophobicContact CB-CH2 4.2Å; P386-W417 HydrophobicContact CG-CH2 4.04Å; P386-Y418 HydrophobicContact CG-CD1 4.06Å; P386-Y418 HydrophobicContact CG-CD2 3.57Å; P386-Y418 HydrophobicContact CG-CE1 4.23Å; P386-Y418 HydrophobicContact CG-CE2 3.78Å; P386-Y418 HydrophobicContact CG-CG 3.72Å
387	V	93.3	Very high	86.7	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	16%	0.16	C	C	.	.			trans	-141.3	163.2	-177.1	-61.5	0	0	0	0	111.8	L221 A349 V350 N351 M353 C385 N394 L395 L423	L221-V387 HydrophobicContact CD1-CB 4.23Å; L221-V387 HydrophobicContact CD1-CG2 3.76Å; L221-V387 HydrophobicContact CD2-CG2 4.3Å; A349-V387 HydrophobicContact CB-CG2 4.04Å; V350-V387 PolarHBondContact O-N 2.8Å; N351-V387 WeakPolarHBondContact CA-O 3.47Å; N351-V387 HydrophobicContact CB-CG2 4Å; M353-V387 PolarHBondContact N-O 3.08Å; C385-V387 HydrophobicContact CB-CG1 4.4Å; C385-V387 VanDerWaalsContact SG-CG1 3.58Å; V387-N394 HydrophobicContact CG1-CB 4.44Å; V387-L395 HydrophobicContact CB-CD2 3.86Å; V387-L395 HydrophobicContact CG1-CD2 4.02Å; V387-L423 HydrophobicContact CG1-CB 4.31Å; V387-L423 HydrophobicContact CG1-CD2 4.49Å
388	S	92.9	Very high	85.9	Confident	1 Å²	1	31 Å²	31	1%	0.007	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-132.7	110.1	161.6	177.5	0	0	0	0	110	D354 L390 V391 G392 A393	D354-S388 WeakPolarHBondContact OD1-CB 3.4Å; D354-S388 PolarHBondContact OD1-OG 2.87Å; S388-L390 PolarHBondContact O-N 2.96Å; S388-V391 WeakPolarHBondContact OG-CG2 3.35Å; S388-V391 PolarHBondContact OG-N 3.41Å; S388-G392 WeakPolarHBondContact O-CA 3.48Å; S388-G392 PolarHBondContact O-N 3.32Å; S388-A393 PolarHBondContact N-O 2.8Å; S388-A393 PolarHBondContact O-N 2.87Å
389	G	89.2	Confident	84.5	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-17.1	178.4	0	0	0	0	0	114.5	L221 N224 N351	L221-G389 VanDerWaalsContact CD1-CA 3.49Å; N224-G389 WeakPolarHBondContact CB-O 3.43Å; N224-G389 PolarHBondContact ND2-O 3.23Å; N351-G389 PolarHBondContact OD1-N 3.22Å
390	L	87.3	Confident	83.5	Confident	99 Å²	99	38.1 Å²	38.1	52%	0.518	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-44.5	175.1	-173	63.8	0	0	0	111.8	Y254 S388	Y254-L390 HydrophobicContact CD2-CD1 4.49Å; Y254-L390 HydrophobicContact CE2-CD1 4.32Å; S388-L390 PolarHBondContact O-N 2.96Å
391	V	86.4	Confident	82.6	Confident	50 Å²	50	37.7 Å²	37.7	30%	0.303	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-22.9	-179.5	-178.1	0	0	0	0	112.2	D354 S388 A393	D354-V391 HydrophobicContact CB-CG2 4.24Å; S388-V391 WeakPolarHBondContact OG-CG2 3.35Å; S388-V391 PolarHBondContact OG-N 3.41Å; V391-A393 VanDerWaalsContact C-N 3.35Å; V391-A393 HydrophobicContact CG1-CB 4.35Å
392	G	85.1	Confident	80.8	Confident	18 Å²	18	39.8 Å²	39.8	19%	0.186	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.9	10.5	-174.2	0	0	0	0	0	113.9	N224 S388	N224-G392 WeakPolarHBondContact ND2-CA 3.29Å; N224-G392 PolarHBondContact ND2-N 2.69Å; S388-G392 WeakPolarHBondContact O-CA 3.48Å; S388-G392 PolarHBondContact O-N 3.32Å
393	A	87.2	Confident	78.7	Confident	10 Å²	10	43.3 Å²	43.3	8%	0.083	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-74.2	133.5	-175.2	0	0	0	0	0	112.3	W358 S388 V391 L395	W358-A393 HydrophobicContact CH2-CB 3.54Å; W358-A393 HydrophobicContact CZ2-CB 3.59Å; S388-A393 PolarHBondContact N-O 2.8Å; S388-A393 PolarHBondContact O-N 2.87Å; V391-A393 VanDerWaalsContact C-N 3.35Å; V391-A393 HydrophobicContact CG1-CB 4.35Å; A393-L395 PolarHBondContact O-N 3.28Å
394	N	88.2	Confident	76.4	Confident	14 Å²	14	43.1 Å²	43.1	8%	0.075	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	16.3	179.8	-155.6	29.4	0	0	0	116.4	C385 P386 V387 L414 Y418 S422 L423	C385-N394 PolarHBondContact SG-ND2 2.69Å; P386-N394 WeakPolarHBondContact O-CB 3.5Å; P386-N394 PolarHBondContact O-ND2 3.38Å; V387-N394 HydrophobicContact CG1-CB 4.44Å; N394-L414 HydrophobicContact CB-CD2 3.86Å; N394-Y418 WeakPolarHBondContact ND2-CE1 3.49Å; N394-S422 WeakPolarHBondContact OD1-CA 3.35Å; N394-L423 PolarHBondContact O-N 2.99Å
395	L	88	Confident	73.8	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.292	C	S	.	.	S	Bend	trans	-77	-44.2	177.9	-53.7	-168.4	0	0	0	111.9	L221 N224 L225 L228 V387 A393 L423 L424	L221-L395 HydrophobicContact CD1-CD1 4.34Å; L221-L395 HydrophobicContact CD1-CD2 3.35Å; L221-L395 HydrophobicContact CG-CD2 4.48Å; N224-L395 HydrophobicContact CB-CD1 4.12Å; L225-L395 HydrophobicContact CD1-CB 4.31Å; L228-L395 HydrophobicContact CD1-CB 3.92Å; L228-L395 HydrophobicContact CD1-CD1 3.94Å; L228-L395 HydrophobicContact CD1-CG 4.34Å; V387-L395 HydrophobicContact CB-CD2 3.86Å; V387-L395 HydrophobicContact CG1-CD2 4.02Å; A393-L395 PolarHBondContact O-N 3.28Å; L395-L423 HydrophobicContact CD2-CD2 4.21Å; L395-L424 WeakPolarHBondContact O-CB 3.48Å; L395-L424 PolarHBondContact O-N 2.92Å
396	V	86.4	Confident	71.3	Confident	12 Å²	12	57.8 Å²	57.8	7%	0.073	33%	0.329	C	S	.	.	S	Bend	trans	-128.6	148.8	-174.3	178.5	0	0	0	0	108.2	L225 L228 L400 L424	L225-V396 HydrophobicContact CD1-CG2 3.71Å; L228-V396 HydrophobicContact CB-CG2 3.78Å; L228-V396 HydrophobicContact CD1-CG2 4.12Å; V396-L400 HydrophobicContact CG1-CB 3.58Å; V396-L400 HydrophobicContact CG1-CD2 3.96Å; V396-L400 HydrophobicContact CG1-CG 4.41Å; V396-L424 HydrophobicContact CG1-CD2 4.18Å; V396-L424 HydrophobicContact CG2-CD2 4.44Å
397	P	76.5	Confident	68.9	Low	11 Å²	11	58.6 Å²	58.6	7%	0.071	34%	0.335	C	S	.	.			trans	-55.8	146	179.7	-28.8	37.7	0	0	0	113.6	N399 L400 S401 S422 E425	P397-N399 VanDerWaalsContact CB-OD1 3.31Å; P397-N399 WeakPolarHBondContact CB-OD1 3.3Å; P397-N399 PolarHBondContact O-N 3.32Å; P397-L400 PolarHBondContact O-N 3.01Å; P397-S401 PolarHBondContact O-N 2.95Å; P397-S422 WeakPolarHBondContact CD-OG 3.18Å; P397-S422 WeakPolarHBondContact CG-OG 3.29Å; P397-E425 VanDerWaalsContact CG-CD 3.41Å; P397-E425 HydrophobicContact CG-CG 3.78Å; P397-E425 WeakPolarHBondContact CG-OE1 3.09Å
398	Q	64.2	Low	66.6	Low	126 Å²	126	61.8 Å²	61.8	59%	0.589	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-29.5	-173.8	-68.5	-178.8	-8.4	0	0	114.2	L400 S401 F415	Q398-L400 PolarHBondContact O-N 3.29Å; Q398-S401 PolarHBondContact O-N 2.87Å; Q398-S401 PolarHBondContact O-OG 2.93Å; Q398-S401 VanDerWaalsContact O-OG 3.05Å; Q398-F415 HydrophobicContact CG-CE1 4.49Å; Q398-F415 HydrophobicContact CG-CE2 4.41Å; Q398-F415 HydrophobicContact CG-CZ 4.02Å; Q398-F415 VanDerWaalsContact NE2-CE1 3.31Å
399	N	54.4	Low	64.4	Low	128 Å²	128	67.7 Å²	67.7	68%	0.684	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-12.8	178.6	65	-26.3	0	0	0	114	P397	P397-N399 VanDerWaalsContact CB-OD1 3.31Å; P397-N399 WeakPolarHBondContact CB-OD1 3.3Å; P397-N399 PolarHBondContact O-N 3.32Å
400	L	58.5	Low	62.6	Low	89 Å²	89	70.7 Å²	70.7	47%	0.466	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-14.4	172.8	-87.2	72.2	0	0	0	112.7	V396 P397 Q398 S402	V396-L400 HydrophobicContact CG1-CB 3.58Å; V396-L400 HydrophobicContact CG1-CD2 3.96Å; V396-L400 HydrophobicContact CG1-CG 4.41Å; P397-L400 PolarHBondContact O-N 3.01Å; Q398-L400 PolarHBondContact O-N 3.29Å; L400-S402 PolarHBondContact O-N 3.13Å
401	S	55.9	Low	61.2	Low	56 Å²	56	67.2 Å²	67.2	39%	0.392	39%	0.392	S	S	.	.			trans	-79.3	32.9	-175.5	66.9	0	0	0	0	114.5	P397 Q398 S403	P397-S401 PolarHBondContact O-N 2.95Å; Q398-S401 PolarHBondContact O-N 2.87Å; Q398-S401 PolarHBondContact O-OG 2.93Å; Q398-S401 VanDerWaalsContact O-OG 3.05Å; S401-S403 PolarHBondContact O-N 2.88Å; S401-S403 VanDerWaalsContact O-N 3.11Å
402	S	43.3	Very low	59.9	Low	104 Å²	104	67.6 Å²	67.6	73%	0.727	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-12.9	-172.4	55.3	0	0	0	0	115	L400	L400-S402 PolarHBondContact O-N 3.13Å
403	S	44.4	Very low	59.1	Low	105 Å²	105	70.9 Å²	70.9	73%	0.734	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-18	-176.8	-54.9	0	0	0	0	115.1	S401	S401-S403 PolarHBondContact O-N 2.88Å; S401-S403 VanDerWaalsContact O-N 3.11Å
404	S	41.9	Very low	58.3	Low	57 Å²	57	70.4 Å²	70.4	40%	0.399	41%	0.406	S	S	.	.			trans	-107.4	78.8	-169.3	-160.2	0	0	0	0	114.1	N406 A407	S404-N406 PolarHBondContact O-N 3Å; S404-N406 VanDerWaalsContact O-N 3.11Å; S404-A407 PolarHBondContact O-N 3.2Å; S404-A407 VanDerWaalsContact OG-CB 3.24Å; S404-A407 WeakPolarHBondContact OG-CB 3.4Å; S404-A407 PolarHBondContact OG-N 2.86Å
405	K	39.8	Very low	57.6	Low	189 Å²	189	73.3 Å²	73.3	82%	0.822	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-7.1	170.8	-70.8	-173.6	176.4	-178.5	0	114.5
406	N	39.5	Very low	57.1	Low	145 Å²	145	78.8 Å²	78.8	78%	0.775	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	-6.3	179.4	-62.6	9.9	0	0	0	113	S404	S404-N406 PolarHBondContact O-N 3Å; S404-N406 VanDerWaalsContact O-N 3.11Å
407	A	44	Very low	57.1	Low	17 Å²	17	80.4 Å²	80.4	14%	0.14	46%	0.457	C	S	.	.	S	Bend	trans	-89.2	-6.7	179.1	0	0	0	0	0	113.9	S404 D409 S411	S404-A407 PolarHBondContact O-N 3.2Å; S404-A407 VanDerWaalsContact OG-CB 3.24Å; S404-A407 WeakPolarHBondContact OG-CB 3.4Å; S404-A407 PolarHBondContact OG-N 2.86Å; A407-D409 VanDerWaalsContact C-N 3.28Å; A407-D409 PolarHBondContact O-N 2.93Å; A407-S411 WeakPolarHBondContact O-CB 3.41Å; A407-S411 PolarHBondContact O-N 3.27Å; A407-S411 PolarHBondContact O-OG 3.46Å
408	S	45.2	Very low	57.6	Low	67 Å²	67	81.2 Å²	81.2	47%	0.469	46%	0.458	S	S	.	.	H	α-helix	trans	-49.8	-49.9	179.9	44.6	0	0	0	0	112.1	S412	S408-S412 PolarHBondContact O-N 3.23Å
409	D	47.4	Very low	58.5	Low	124 Å²	124	82.1 Å²	82.1	66%	0.663	47%	0.472	S	S	*	.	H	α-helix	trans	-77.6	-47.8	-167.8	-58.2	18	0	0	0	109.8	A407 S412	A407-D409 VanDerWaalsContact C-N 3.28Å; A407-D409 PolarHBondContact O-N 2.93Å; D409-S412 PolarHBondContact O-OG 2.88Å
410	T	50.9	Low	60	Low	63 Å²	63	77.4 Å²	77.4	39%	0.387	46%	0.455	S	S	.	.	H	α-helix	trans	-69.9	-34.4	-179.6	-52.2	0	0	0	0	113.6	W358	W358-T410 PolarHBondContact NE1-O 3.47Å
411	S	57.9	Low	61.5	Low	27 Å²	27	76.1 Å²	76.1	19%	0.189	45%	0.452	C	S	.	.	H	α-helix	trans	-78.4	-19.5	-178.6	72.1	0	0	0	0	113.8	A407 N413 L414 F415	A407-S411 WeakPolarHBondContact O-CB 3.41Å; A407-S411 PolarHBondContact O-N 3.27Å; A407-S411 PolarHBondContact O-OG 3.46Å; S411-N413 VanDerWaalsContact C-N 3.34Å; S411-N413 PolarHBondContact O-N 3.42Å; S411-L414 PolarHBondContact O-N 2.84Å; S411-L414 VanDerWaalsContact O-N 3.15Å; S411-F415 VanDerWaalsContact O-CD2 3.24Å; S411-F415 WeakPolarHBondContact O-CD2 3.48Å; S411-F415 PolarHBondContact O-N 2.74Å
412	S	58.7	Low	63.1	Low	58 Å²	58	73.7 Å²	73.7	41%	0.406	44%	0.435	S	S	.	.	H	α-helix	trans	-54	-47.4	-179	67	0	0	0	0	112.8	S408 D409 L414 F415 T416	S408-S412 PolarHBondContact O-N 3.23Å; D409-S412 PolarHBondContact O-OG 2.88Å; S412-L414 VanDerWaalsContact C-N 3.3Å; S412-L414 PolarHBondContact O-N 3.25Å; S412-F415 PolarHBondContact O-N 2.79Å; S412-T416 PolarHBondContact O-N 3.34Å; S412-T416 PolarHBondContact O-OG1 2.85Å; S412-T416 VanDerWaalsContact O-OG1 3.08Å
413	N	68	Low	65.5	Low	87 Å²	87	68.8 Å²	68.8	47%	0.465	40%	0.4	S	S	.	.	H	α-helix	trans	-62.9	-29.1	-179.5	-73.6	-10.1	0	0	0	113.9	W358 S411 W417	W358-N413 HydrophobicContact CB-CB 4.24Å; S411-N413 VanDerWaalsContact C-N 3.34Å; S411-N413 PolarHBondContact O-N 3.42Å; N413-W417 PolarHBondContact O-NE1 2.68Å
414	L	72.4	Confident	67.8	Low	0 Å²	0	64.5 Å²	64.5	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-69.3	-51.4	176.6	170.3	63.4	0	0	0	110.5	W358 P386 N394 S411 S412 T416 W417 Y418	W358-L414 HydrophobicContact CD2-CB 4.07Å; W358-L414 HydrophobicContact CE3-CB 3.82Å; W358-L414 HydrophobicContact CE3-CD1 3.76Å; W358-L414 HydrophobicContact CE3-CD2 4.05Å; W358-L414 HydrophobicContact CE3-CG 4.06Å; W358-L414 HydrophobicContact CG-CB 4.4Å; W358-L414 HydrophobicContact CH2-CD2 4.32Å; W358-L414 HydrophobicContact CZ3-CB 4.36Å; W358-L414 HydrophobicContact CZ3-CD1 4.05Å; W358-L414 HydrophobicContact CZ3-CD2 3.73Å; W358-L414 HydrophobicContact CZ3-CG 4.25Å; P386-L414 HydrophobicContact CB-CD1 4.1Å; P386-L414 HydrophobicContact CG-CD1 3.61Å; N394-L414 HydrophobicContact CB-CD2 3.86Å; S411-L414 PolarHBondContact O-N 2.84Å; S411-L414 VanDerWaalsContact O-N 3.15Å; S412-L414 VanDerWaalsContact C-N 3.3Å; S412-L414 PolarHBondContact O-N 3.25Å; L414-T416 PolarHBondContact O-N 3.07Å; L414-W417 HydrophobicContact CD1-CH2 4.38Å; L414-W417 HydrophobicContact CD1-CZ2 3.99Å; L414-W417 PolarHBondContact O-N 3.39Å; L414-W417 VanDerWaalsContact O-N 3.12Å; L414-Y418 VanDerWaalsContact CD1-CB 3.49Å; L414-Y418 HydrophobicContact CD1-CD1 4.46Å; L414-Y418 HydrophobicContact CD1-CG 4.09Å; L414-Y418 PolarHBondContact O-N 3.41Å
415	F	71.8	Confident	70.2	Confident	75 Å²	75	64.9 Å²	64.9	33%	0.329	36%	0.364	S	S	.	.	H	α-helix	trans	-72.8	-9.3	-174.9	-60	-60.7	0	0	0	113.2	Q398 S411 S412 W417	Q398-F415 HydrophobicContact CG-CE1 4.49Å; Q398-F415 HydrophobicContact CG-CE2 4.41Å; Q398-F415 HydrophobicContact CG-CZ 4.02Å; Q398-F415 VanDerWaalsContact NE2-CE1 3.31Å; S411-F415 VanDerWaalsContact O-CD2 3.24Å; S411-F415 WeakPolarHBondContact O-CD2 3.48Å; S411-F415 PolarHBondContact O-N 2.74Å; S412-F415 PolarHBondContact O-N 2.79Å; F415-W417 VanDerWaalsContact C-N 3.25Å; F415-W417 PolarHBondContact O-N 3.06Å
416	T	78.8	Confident	72.7	Confident	115 Å²	115	56.2 Å²	56.2	71%	0.706	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-31	166.7	-51.5	0	0	0	0	112.9	S412 L414	S412-T416 PolarHBondContact O-N 3.34Å; S412-T416 PolarHBondContact O-OG1 2.85Å; S412-T416 VanDerWaalsContact O-OG1 3.08Å; L414-T416 PolarHBondContact O-N 3.07Å
417	W	86.8	Confident	75.2	Confident	46 Å²	46	49.5 Å²	49.5	17%	0.174	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.1	-22.2	-174	66.3	-98	0	0	0	115.3	M353 W358 Q360 F363 P386 N413 L414 F415	M353-W417 HydrophobicContact CE-CZ2 4.34Å; W358-W417 PolarHBondContact O-NE1 2.59Å; Q360-W417 HydrophobicContact CB-CD2 3.75Å; Q360-W417 HydrophobicContact CB-CE3 4.2Å; Q360-W417 HydrophobicContact CB-CG 3.94Å; Q360-W417 HydrophobicContact CB-CZ2 4.36Å; Q360-W417 HydrophobicContact CG-CB 4.42Å; Q360-W417 HydrophobicContact CG-CD2 3.69Å; Q360-W417 HydrophobicContact CG-CE3 3.66Å; Q360-W417 HydrophobicContact CG-CG 4.04Å; Q360-W417 HydrophobicContact CG-CZ3 4.17Å; F363-W417 HydrophobicContact CB-CH2 3.72Å; F363-W417 HydrophobicContact CB-CZ2 4.38Å; F363-W417 HydrophobicContact CB-CZ3 4.42Å; F363-W417 AromaticContact CD1-CH2 3.71Å; F363-W417 HydrophobicContact CD1-CH2 3.71Å; F363-W417 AromaticContact CD1-CZ3 3.7Å; F363-W417 HydrophobicContact CD1-CZ3 3.7Å; F363-W417 HydrophobicContact CD2-CH2 4.18Å; F363-W417 HydrophobicContact CE1-CH2 4.36Å; F363-W417 HydrophobicContact CE1-CZ3 4.16Å; F363-W417 AromaticContact CG-CH2 3.59Å; F363-W417 HydrophobicContact CG-CH2 3.59Å; F363-W417 HydrophobicContact CG-CZ3 4.09Å; P386-W417 HydrophobicContact CB-CH2 4.2Å; P386-W417 HydrophobicContact CG-CH2 4.04Å; N413-W417 PolarHBondContact O-NE1 2.68Å; L414-W417 HydrophobicContact CD1-CH2 4.38Å; L414-W417 HydrophobicContact CD1-CZ2 3.99Å; L414-W417 PolarHBondContact O-N 3.39Å; L414-W417 VanDerWaalsContact O-N 3.12Å; F415-W417 VanDerWaalsContact C-N 3.25Å; F415-W417 PolarHBondContact O-N 3.06Å
418	Y	86.4	Confident	77.5	Confident	27 Å²	27	50 Å²	50	11%	0.106	29%	0.292	C	S	.	.			trans	-96.2	109	178	-169.5	-101.7	0	0	0	111.6	Y384 P386 N394 L414 G420	Y384-Y418 PolarHBondContact O-OH 2.66Å; P386-Y418 HydrophobicContact CG-CD1 4.06Å; P386-Y418 HydrophobicContact CG-CD2 3.57Å; P386-Y418 HydrophobicContact CG-CE1 4.23Å; P386-Y418 HydrophobicContact CG-CE2 3.78Å; P386-Y418 HydrophobicContact CG-CG 3.72Å; N394-Y418 WeakPolarHBondContact ND2-CE1 3.49Å; L414-Y418 VanDerWaalsContact CD1-CB 3.49Å; L414-Y418 HydrophobicContact CD1-CD1 4.46Å; L414-Y418 HydrophobicContact CD1-CG 4.09Å; L414-Y418 PolarHBondContact O-N 3.41Å; Y418-G420 VanDerWaalsContact CE1-C 3.46Å; Y418-G420 VanDerWaalsContact CE1-CA 3.43Å; Y418-G420 VanDerWaalsContact CE1-O 3.31Å; Y418-G420 WeakPolarHBondContact CE1-O 3.48Å
419	T	83	Confident	79.7	Confident	145 Å²	145	49.9 Å²	49.9	89%	0.89	29%	0.291	S	S	*	.			trans	-102.5	13.9	176.4	53.2	0	0	0	0	113.2
420	G	85	Confident	81.7	Confident	30 Å²	30	44.3 Å²	44.3	31%	0.309	26%	0.261	S	S	.	.	S	Bend	trans	-83.2	164.8	-179.8	0	0	0	0	0	113.9	Y418	Y418-G420 VanDerWaalsContact CE1-C 3.46Å; Y418-G420 VanDerWaalsContact CE1-CA 3.43Å; Y418-G420 VanDerWaalsContact CE1-O 3.31Å; Y418-G420 WeakPolarHBondContact CE1-O 3.48Å
421	P	89.8	Confident	83.4	Confident	62 Å²	62	44.3 Å²	44.3	40%	0.403	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-65.8	158.9	174.4	28.6	-36.3	0	0	0	112.8	E425 L426	P421-E425 HydrophobicContact CB-CB 3.85Å; P421-L426 HydrophobicContact CB-CG 4.41Å; P421-L426 HydrophobicContact CG-CD2 3.57Å; P421-L426 HydrophobicContact CG-CG 3.81Å
422	S	91	Very high	84.7	Confident	5 Å²	5	46 Å²	46	4%	0.035	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-69.1	165	175.2	64.9	0	0	0	0	112.9	N394 P397 L424 E425 L426	N394-S422 WeakPolarHBondContact OD1-CA 3.35Å; P397-S422 WeakPolarHBondContact CD-OG 3.18Å; P397-S422 WeakPolarHBondContact CG-OG 3.29Å; S422-L424 VanDerWaalsContact C-N 3.3Å; S422-L424 PolarHBondContact O-N 3.24Å; S422-E425 PolarHBondContact N-OE2 3.37Å; S422-E425 PolarHBondContact O-N 3.14Å; S422-E425 VanDerWaalsContact O-N 3.09Å; S422-E425 WeakPolarHBondContact OG-CG 3.43Å; S422-E425 PolarHBondContact OG-N 2.89Å; S422-E425 PolarHBondContact OG-OE2 3.28Å; S422-L426 WeakPolarHBondContact O-CG 3.35Å; S422-L426 PolarHBondContact O-N 2.74Å
423	L	93	Very high	85.9	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-55.9	-42.6	176.6	-179.9	60.2	0	0	0	112.5	L221 M222 L311 I347 V387 N394 L395 E425 L426 I427	L221-L423 HydrophobicContact CD2-CD2 4.35Å; L221-L423 HydrophobicContact CG-CD2 4.45Å; M222-L423 HydrophobicContact CE-CD2 4.25Å; L311-L423 HydrophobicContact CD1-CD1 3.77Å; L311-L423 HydrophobicContact CD2-CD1 4.3Å; L311-L423 HydrophobicContact CD2-CD2 4.38Å; I347-L423 HydrophobicContact CG2-CD1 4.35Å; V387-L423 HydrophobicContact CG1-CB 4.31Å; V387-L423 HydrophobicContact CG1-CD2 4.49Å; N394-L423 PolarHBondContact O-N 2.99Å; L395-L423 HydrophobicContact CD2-CD2 4.21Å; L423-E425 VanDerWaalsContact C-N 3.34Å; L423-E425 PolarHBondContact O-N 3.06Å; L423-L426 PolarHBondContact O-N 3.37Å; L423-I427 HydrophobicContact CD1-CD1 4.25Å; L423-I427 HydrophobicContact CG-CD1 4.14Å; L423-I427 WeakPolarHBondContact O-CG1 3.42Å; L423-I427 PolarHBondContact O-N 3.44Å
424	L	92.7	Very high	86.8	Confident	16 Å²	16	47.5 Å²	47.5	8%	0.084	27%	0.272	C	S	.	.	H	α-helix	trans	-61.7	-39.4	176.2	-174.7	68.2	0	0	0	112.4	L229 F278 T280 L395 V396 S422 I427 D428	L229-L424 HydrophobicContact CD1-CD1 4.28Å; L229-L424 HydrophobicContact CD2-CD1 4.12Å; L229-L424 HydrophobicContact CD2-CD2 3.82Å; F278-L424 HydrophobicContact CD2-CD1 4.4Å; F278-L424 HydrophobicContact CE2-CD1 3.88Å; T280-L424 HydrophobicContact CG2-CD1 3.99Å; L395-L424 WeakPolarHBondContact O-CB 3.48Å; L395-L424 PolarHBondContact O-N 2.92Å; V396-L424 HydrophobicContact CG1-CD2 4.18Å; V396-L424 HydrophobicContact CG2-CD2 4.44Å; S422-L424 VanDerWaalsContact C-N 3.3Å; S422-L424 PolarHBondContact O-N 3.24Å; L424-I427 PolarHBondContact O-N 3.12Å; L424-D428 WeakPolarHBondContact O-CB 3.48Å; L424-D428 PolarHBondContact O-N 3.21Å
425	E	92	Very high	87.4	Confident	64 Å²	64	49.8 Å²	49.8	30%	0.299	28%	0.281	S	S	.	.	H	α-helix	trans	-73.6	-32.1	178.2	-73.3	165.8	145.8	0	0	112.6	P397 P421 S422 L423 I427 D428 S429	P397-E425 VanDerWaalsContact CG-CD 3.41Å; P397-E425 HydrophobicContact CG-CG 3.78Å; P397-E425 WeakPolarHBondContact CG-OE1 3.09Å; P421-E425 HydrophobicContact CB-CB 3.85Å; S422-E425 PolarHBondContact N-OE2 3.37Å; S422-E425 PolarHBondContact O-N 3.14Å; S422-E425 VanDerWaalsContact O-N 3.09Å; S422-E425 WeakPolarHBondContact OG-CG 3.43Å; S422-E425 PolarHBondContact OG-N 2.89Å; S422-E425 PolarHBondContact OG-OE2 3.28Å; L423-E425 VanDerWaalsContact C-N 3.34Å; L423-E425 PolarHBondContact O-N 3.06Å; E425-I427 VanDerWaalsContact C-N 3.29Å; E425-D428 PolarHBondContact O-N 2.97Å; E425-S429 VanDerWaalsContact O-CB 3.32Å; E425-S429 WeakPolarHBondContact O-CB 3.46Å; E425-S429 PolarHBondContact O-N 3.11Å; E425-S429 PolarHBondContact O-OG 3.34Å
426	L	92.4	Very high	88.1	Confident	8 Å²	8	49.6 Å²	49.6	4%	0.042	29%	0.286	C	S	.	.	H	α-helix	trans	-66.8	-30.6	170.3	-72.6	169.7	0	0	0	112.5	I347 M383 C385 P421 S422 L423 S429 I430	I347-L426 HydrophobicContact CD1-CB 4.15Å; I347-L426 VanDerWaalsContact CD1-O 3.31Å; I347-L426 WeakPolarHBondContact CD1-O 3.03Å; M383-L426 HydrophobicContact CB-CD2 3.95Å; M383-L426 HydrophobicContact CE-CB 4.35Å; M383-L426 HydrophobicContact CE-CD2 3.89Å; M383-L426 WeakPolarHBondContact CE-O 3.09Å; M383-L426 HydrophobicContact CG-CD2 4.35Å; M383-L426 HydrophobicContact SD-CD2 3.6Å; C385-L426 HydrophobicContact CB-CD1 3.51Å; P421-L426 HydrophobicContact CB-CG 4.41Å; P421-L426 HydrophobicContact CG-CD2 3.57Å; P421-L426 HydrophobicContact CG-CG 3.81Å; S422-L426 WeakPolarHBondContact O-CG 3.35Å; S422-L426 PolarHBondContact O-N 2.74Å; L423-L426 PolarHBondContact O-N 3.37Å; L426-S429 PolarHBondContact O-OG 2.9Å; L426-S429 VanDerWaalsContact O-OG 3.11Å; L426-I430 WeakPolarHBondContact O-CG1 3.39Å
427	I	93	Very high	88.4	Confident	3 Å²	3	44.5 Å²	44.5	2%	0.015	25%	0.254	C	S	.	.	H	α-helix	trans	-76	-41.2	172.8	-66.6	164.9	0	0	0	110.5	L208 F278 V285 I347 L423 L424 E425 S429 I430	L208-I427 HydrophobicContact CD2-CD1 3.8Å; L208-I427 HydrophobicContact CD2-CG1 3.99Å; L208-I427 HydrophobicContact CD2-CG2 4.13Å; F278-I427 HydrophobicContact CZ-CD1 4.35Å; F278-I427 HydrophobicContact CZ-CG2 4.35Å; V285-I427 HydrophobicContact CG1-CG2 4.22Å; V285-I427 HydrophobicContact CG2-CG2 3.69Å; I347-I427 HydrophobicContact CD1-CG1 4.03Å; L423-I427 HydrophobicContact CD1-CD1 4.25Å; L423-I427 HydrophobicContact CG-CD1 4.14Å; L423-I427 WeakPolarHBondContact O-CG1 3.42Å; L423-I427 PolarHBondContact O-N 3.44Å; L424-I427 PolarHBondContact O-N 3.12Å; E425-I427 VanDerWaalsContact C-N 3.29Å; I427-S429 VanDerWaalsContact C-N 3.26Å; I427-S429 PolarHBondContact O-N 2.94Å; I427-I430 HydrophobicContact CG2-CD1 4.39Å; I427-I430 WeakPolarHBondContact O-CG1 3.35Å; I427-I430 PolarHBondContact O-N 2.94Å
428	D	92	Very high	88.3	Confident	29 Å²	29	48.2 Å²	48.2	16%	0.155	28%	0.278	C	S	.	.	H	α-helix	trans	-68	-23.8	176.4	-156.2	28.3	0	0	0	112.6	T280 K281 S282 K283 L424 E425	T280-D428 VanDerWaalsContact CB-OD1 3.3Å; T280-D428 WeakPolarHBondContact CB-OD1 3.44Å; T280-D428 HydrophobicContact CG2-CB 4.27Å; T280-D428 PolarHBondContact OG1-OD1 2.98Å; K281-D428 WeakPolarHBondContact CB-OD2 3.47Å; S282-D428 WeakPolarHBondContact CB-OD1 3.16Å; S282-D428 PolarHBondContact N-OD1 3.49Å; S282-D428 PolarHBondContact OG-OD1 2.89Å; K283-D428 PolarHBondContact NZ-O 3.42Å; L424-D428 WeakPolarHBondContact O-CB 3.48Å; L424-D428 PolarHBondContact O-N 3.21Å; E425-D428 PolarHBondContact O-N 2.97Å
429	S	91.1	Very high	88.3	Confident	64 Å²	64	47.8 Å²	47.8	45%	0.448	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-10.8	176.8	75.1	0	0	0	0	114.9	E425 L426 I427	E425-S429 VanDerWaalsContact O-CB 3.32Å; E425-S429 WeakPolarHBondContact O-CB 3.46Å; E425-S429 PolarHBondContact O-N 3.11Å; E425-S429 PolarHBondContact O-OG 3.34Å; L426-S429 PolarHBondContact O-OG 2.9Å; L426-S429 VanDerWaalsContact O-OG 3.11Å; I427-S429 VanDerWaalsContact C-N 3.26Å; I427-S429 PolarHBondContact O-N 2.94Å
430	I	90	Very high	88.6	Confident	6 Å²	6	42 Å²	42	3%	0.031	25%	0.247	C	C	.	.	S	Bend	trans	-58.2	123.9	176.3	-56.5	171.8	0	0	0	108.9	I206 K283 A309 R345 I347 L426 I427	I206-I430 HydrophobicContact CD1-CB 4.07Å; I206-I430 HydrophobicContact CD1-CG2 4.08Å; K283-I430 PolarHBondContact NZ-O 3.27Å; A309-I430 HydrophobicContact CB-CD1 3.83Å; A309-I430 HydrophobicContact CB-CG2 4.14Å; R345-I430 HydrophobicContact CB-CG2 4.25Å; R345-I430 HydrophobicContact CG-CG2 4.44Å; I347-I430 HydrophobicContact CD1-CD1 3.77Å; I347-I430 HydrophobicContact CD1-CG1 3.94Å; L426-I430 WeakPolarHBondContact O-CG1 3.39Å; I427-I430 HydrophobicContact CG2-CD1 4.39Å; I427-I430 WeakPolarHBondContact O-CG1 3.35Å; I427-I430 PolarHBondContact O-N 2.94Å
431	P	86.8	Confident	89	Confident	64 Å²	64	40.7 Å²	40.7	42%	0.416	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-64.8	138.8	176	26.8	-33.8	0	0	0	110.2	R345	R345-P431 HydrophobicContact CG-CG 4.47Å
432	P	83.2	Confident	89.2	Confident	61 Å²	61	38.4 Å²	38.4	40%	0.396	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-61.8	139	176.4	29.6	-37.2	0	0	0	110
433	P	85.8	Confident	89.4	Confident	27 Å²	27	38.2 Å²	38.2	18%	0.175	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-71.6	150.3	174.1	32.7	-38.2	0	0	0	111.1	D308 R435	D308-P433 HydrophobicContact CB-CB 4.49Å; D308-P433 HydrophobicContact CB-CG 4Å; P433-R435 VanDerWaalsContact CG-NH1 3.28Å; P433-R435 PolarHBondContact O-N 3.16Å
434	E	85	Confident	89.4	Confident	150 Å²	150	38.6 Å²	38.6	70%	0.701	22%	0.217	S	C	*	.	P	Polyproline II helix	trans	-59.9	124	171.9	-172.7	179	-162.7	0	0	110.7
435	R	86.1	Confident	89.5	Confident	48 Å²	48	37.8 Å²	37.8	18%	0.181	21%	0.213	C	C	.	.			trans	-105	130.4	-179.8	-59.6	-51.2	-160.5	-166	-4.3	110.3	I205 D308 P433 V437 S524 G525	I205-R435 PolarHBondContact O-NH2 2.7Å; D308-R435 VanDerWaalsContact CG-NH1 3.32Å; D308-R435 IonicContact OD1-CZ 3.73Å; D308-R435 IonicContact OD1-NH1 3.26Å; D308-R435 PolarHBondContact OD1-NH1 3.22Å; D308-R435 IonicContact OD1-NH2 3.18Å; D308-R435 IonicContact OD2-CZ 3.81Å; D308-R435 IonicContact OD2-NH1 2.8Å; D308-R435 PolarHBondContact OD2-NH1 2.94Å; D308-R435 IonicContact OD2-NH2 2.81Å; D308-R435 PolarHBondContact OD2-NH2 3.46Å; P433-R435 VanDerWaalsContact CG-NH1 3.28Å; P433-R435 PolarHBondContact O-N 3.16Å; R435-V437 HydrophobicContact CB-CG2 4.19Å; R435-V437 PolarHBondContact O-N 2.92Å; R435-S524 WeakPolarHBondContact CB-O 3.49Å; R435-S524 WeakPolarHBondContact CD-O 3.49Å; R435-S524 VanDerWaalsContact CG-O 3.24Å; R435-S524 WeakPolarHBondContact CG-O 3.39Å; R435-S524 PolarHBondContact NE-O 2.77Å; R435-G525 VanDerWaalsContact CZ-CA 3.42Å
436	T	85.9	Confident	89.4	Confident	72 Å²	72	35.8 Å²	35.8	44%	0.442	21%	0.205	S	C	.	.			trans	-99	66.2	-172.8	49.9	0	0	0	0	111.7	G439 S465 G466 S524	T436-G439 PolarHBondContact O-N 2.91Å; T436-S465 WeakPolarHBondContact OG1-CB 3.38Å; T436-G466 PolarHBondContact O-N 2.92Å; T436-S524 PolarHBondContact N-OG 3.09Å; T436-S524 VanDerWaalsContact N-OG 3.08Å
437	V	85.4	Confident	89.3	Confident	7 Å²	7	39.1 Å²	39.1	4%	0.042	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-29.7	-172.4	-175.3	0	0	0	0	113.6	Y193 R435 G439 G466 A467 F523	Y193-V437 HydrophobicContact CD1-CB 4.22Å; Y193-V437 HydrophobicContact CD1-CG1 4.14Å; Y193-V437 HydrophobicContact CD1-CG2 4.13Å; Y193-V437 HydrophobicContact CD2-CG1 4.15Å; Y193-V437 HydrophobicContact CD2-CG2 4.02Å; Y193-V437 HydrophobicContact CE1-CB 4.29Å; Y193-V437 HydrophobicContact CE1-CG2 3.81Å; Y193-V437 HydrophobicContact CE2-CG2 3.68Å; Y193-V437 HydrophobicContact CG-CB 4.39Å; Y193-V437 HydrophobicContact CG-CG1 3.88Å; Y193-V437 HydrophobicContact CG-CG2 4.23Å; R435-V437 HydrophobicContact CB-CG2 4.19Å; R435-V437 PolarHBondContact O-N 2.92Å; V437-G439 PolarHBondContact O-N 2.93Å; V437-G466 WeakPolarHBondContact O-CA 3.28Å; V437-A467 HydrophobicContact CG1-CB 4.15Å; V437-F523 HydrophobicContact CG1-CD1 3.97Å; V437-F523 HydrophobicContact CG2-CB 4.35Å
438	D	85.7	Confident	89.3	Confident	124 Å²	124	39.8 Å²	39.8	66%	0.663	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-12	172.5	-169.9	49.1	0	0	0	112.9	V190	V190-D438 HydrophobicContact CG2-CB 4.29Å
439	G	85.8	Confident	89.1	Confident	18 Å²	18	40.6 Å²	40.6	19%	0.186	23%	0.229	C	C	.	.	S	Bend	trans	-66.8	165.5	176.2	0	0	0	0	0	113.3	T436 V437 G466	T436-G439 PolarHBondContact O-N 2.91Å; V437-G439 PolarHBondContact O-N 2.93Å; G439-G466 WeakPolarHBondContact O-CA 3.24Å
440	P	89.8	Confident	89	Confident	25 Å²	25	43.2 Å²	43.2	16%	0.162	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-61.2	146.4	171	29.4	-35.8	0	0	0	110.3	R442 S465 N552	P440-R442 PolarHBondContact O-N 2.87Å; P440-S465 CarbonylContact O-C 3.57Å; P440-S465 PolarHBondContact O-OG 3.32Å; P440-N552 HydrophobicContact CB-CB 4.28Å; P440-N552 WeakPolarHBondContact CB-ND2 3.38Å
441	F	93.1	Very high	88.7	Confident	1 Å²	1	43.5 Å²	43.5	0%	0.004	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-62.9	127.7	177.2	-179.1	-112.9	0	0	0	110.6	F443 V463 S465 I468 V479 L547 T548 D549	F441-F443 HydrophobicContact CE1-CB 3.8Å; F441-F443 HydrophobicContact CE2-CB 3.96Å; F441-F443 HydrophobicContact CZ-CB 3.32Å; F441-F443 HydrophobicContact CZ-CD2 4.46Å; F441-F443 HydrophobicContact CZ-CG 4.14Å; F441-V463 HydrophobicContact CD2-CG1 4.15Å; F441-V463 HydrophobicContact CE2-CG1 3.82Å; F441-V463 HydrophobicContact CE2-CG2 4.16Å; F441-S465 WeakPolarHBondContact CA-O 3.47Å; F441-I468 HydrophobicContact CD1-CG2 3.94Å; F441-I468 HydrophobicContact CD2-CG2 3.64Å; F441-I468 HydrophobicContact CE1-CG2 3.78Å; F441-I468 HydrophobicContact CE2-CB 4.21Å; F441-I468 HydrophobicContact CE2-CD1 4.01Å; F441-I468 HydrophobicContact CE2-CG1 3.83Å; F441-I468 HydrophobicContact CE2-CG2 3.44Å; F441-I468 VanDerWaalsContact CE2-CG2 3.44Å; F441-I468 HydrophobicContact CG-CG2 3.86Å; F441-I468 HydrophobicContact CZ-CB 4.45Å; F441-I468 HydrophobicContact CZ-CD1 3.86Å; F441-I468 HydrophobicContact CZ-CG1 4.15Å; F441-I468 HydrophobicContact CZ-CG2 3.51Å; F441-V479 HydrophobicContact CD1-CG1 3.87Å; F441-V479 HydrophobicContact CE1-CG1 3.74Å; F441-L547 HydrophobicContact CE1-CB 4.22Å; F441-T548 VanDerWaalsContact O-CA 3.3Å; F441-T548 WeakPolarHBondContact O-CA 3.13Å; F441-D549 WeakPolarHBondContact CB-OD2 3.12Å; F441-D549 PolarHBondContact N-OD2 2.86Å; F441-D549 PolarHBondContact O-N 3.06Å
442	R	93.3	Very high	88.3	Confident	15 Å²	15	44 Å²	44	6%	0.057	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	118.9	172.2	-57.2	-178.4	-169.1	103.1	-21.5	108.3	P440 I464 S465 T548 I554 E634 K638	P440-R442 PolarHBondContact O-N 2.87Å; R442-I464 HydrophobicContact CB-CB 4.41Å; R442-I464 WeakPolarHBondContact O-CB 2.92Å; R442-I464 PolarHBondContact O-N 3.25Å; R442-S465 WeakPolarHBondContact CB-OG 3.26Å; R442-S465 WeakPolarHBondContact CG-OG 3.47Å; R442-S465 PolarHBondContact N-O 3.13Å; R442-S465 PolarHBondContact NH1-OG 2.71Å; R442-S465 PolarHBondContact O-N 2.9Å; R442-T548 HydrophobicContact CG-CG2 4.48Å; R442-I554 HydrophobicContact CG-CD1 4.46Å; R442-E634 IonicContact CZ-OE1 2.75Å; R442-E634 IonicContact CZ-OE2 2.84Å; R442-E634 VanDerWaalsContact NE-CD 3.28Å; R442-E634 IonicContact NE-OE1 3.75Å; R442-E634 PolarHBondContact NE-OE1 3.09Å; R442-E634 IonicContact NE-OE2 3.47Å; R442-E634 PolarHBondContact NE-OE2 3.48Å; R442-E634 VanDerWaalsContact NH2-CD 3.35Å; R442-E634 IonicContact NH2-OE1 3.21Å; R442-E634 PolarHBondContact NH2-OE1 2.95Å; R442-E634 IonicContact NH2-OE2 3.44Å; R442-E634 PolarHBondContact NH2-OE2 2.83Å; R442-K638 PolarHBondContact NH2-O 2.89Å
443	F	94.6	Very high	88	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	131.2	177.2	168.7	-83.5	0	0	0	109.9	F441 V445 V459 G461 R462 V463 V528 L530 L546 L547	F441-F443 HydrophobicContact CE1-CB 3.8Å; F441-F443 HydrophobicContact CE2-CB 3.96Å; F441-F443 HydrophobicContact CZ-CB 3.32Å; F441-F443 HydrophobicContact CZ-CD2 4.46Å; F441-F443 HydrophobicContact CZ-CG 4.14Å; F443-V445 HydrophobicContact CE1-CG2 4.25Å; F443-V459 HydrophobicContact CE1-CG1 4.09Å; F443-G461 VanDerWaalsContact CE2-O 3.29Å; F443-G461 WeakPolarHBondContact CE2-O 3.46Å; F443-R462 VanDerWaalsContact CA-O 3.29Å; F443-R462 WeakPolarHBondContact CA-O 3.43Å; F443-V463 HydrophobicContact CD2-CG2 3.98Å; F443-V528 HydrophobicContact CD2-CG2 4.39Å; F443-V528 HydrophobicContact CE2-CG2 3.74Å; F443-L530 HydrophobicContact CD1-CD1 4.17Å; F443-L530 HydrophobicContact CD2-CD1 4.09Å; F443-L530 HydrophobicContact CE1-CD1 3.91Å; F443-L530 HydrophobicContact CE2-CD1 3.83Å; F443-L530 HydrophobicContact CE2-CG 4.1Å; F443-L530 HydrophobicContact CG-CD1 4.24Å; F443-L530 HydrophobicContact CZ-CD1 3.71Å; F443-L530 HydrophobicContact CZ-CG 3.94Å; F443-L546 WeakPolarHBondContact O-CA 3.49Å; F443-L547 HydrophobicContact CB-CB 4.27Å; F443-L547 HydrophobicContact CD1-CB 4.13Å; F443-L547 HydrophobicContact CD1-CD1 3.67Å; F443-L547 HydrophobicContact CD1-CG 3.85Å; F443-L547 HydrophobicContact CE1-CD1 3.91Å; F443-L547 HydrophobicContact CE1-CG 4.42Å; F443-L547 PolarHBondContact N-O 3.2Å; F443-L547 PolarHBondContact O-N 3.01Å
444	V	94.5	Very high	87.6	Confident	8 Å²	8	45.8 Å²	45.8	5%	0.048	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	120	178.5	168.9	0	0	0	0	108.2	S446 G461 R462 I464 L546 N584 L642	V444-S446 PolarHBondContact O-N 3.06Å; V444-G461 CarbonylContact O-C 3.5Å; V444-G461 WeakPolarHBondContact O-CA 3.41Å; V444-R462 PolarHBondContact N-O 3.15Å; V444-R462 PolarHBondContact O-N 3.14Å; V444-I464 HydrophobicContact CB-CG1 4.39Å; V444-I464 HydrophobicContact CG2-CD1 4.07Å; V444-I464 HydrophobicContact CG2-CG1 3.61Å; V444-L546 HydrophobicContact CB-CD2 4.35Å; V444-L546 HydrophobicContact CG2-CD2 3.6Å; V444-N584 HydrophobicContact CG1-CB 3.78Å; V444-L642 HydrophobicContact CG2-CD2 3.76Å
445	V	94.1	Very high	87.4	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	127.4	171.1	-178.3	0	0	0	0	108.9	F443 I448 V459 G544 D545 L547	F443-V445 HydrophobicContact CE1-CG2 4.25Å; V445-I448 HydrophobicContact CG1-CD1 4.43Å; V445-I448 HydrophobicContact CG1-CG1 4.06Å; V445-V459 HydrophobicContact CB-CG1 4.19Å; V445-V459 HydrophobicContact CG1-CG1 3.65Å; V445-V459 HydrophobicContact CG2-CG1 3.64Å; V445-G544 WeakPolarHBondContact O-CA 3.26Å; V445-G544 PolarHBondContact O-N 3.35Å; V445-D545 PolarHBondContact N-O 2.96Å; V445-L547 HydrophobicContact CG2-CG 4.45Å
446	S	91	Very high	87.4	Confident	21 Å²	21	44 Å²	44	15%	0.147	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	-37.6	172.4	64.9	0	0	0	0	112.3	V444 A460 G461 P543	V444-S446 PolarHBondContact O-N 3.06Å; S446-A460 PolarHBondContact N-O 3.04Å; S446-A460 PolarHBondContact OG-O 2.78Å; S446-G461 WeakPolarHBondContact OG-CA 3.48Å; S446-G461 PolarHBondContact OG-N 3.02Å; S446-P543 WeakPolarHBondContact O-CB 3.38Å
447	D	89.9	Confident	87.6	Confident	79 Å²	79	41.3 Å²	41.3	42%	0.422	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	162.2	-176.9	-175.9	34.5	0	0	0	111.7	A460	D447-A460 HydrophobicContact CB-CB 4.32Å; D447-A460 PolarHBondContact N-O 2.66Å; D447-A460 PolarHBondContact O-N 3.07Å
448	I	91.5	Very high	87.9	Confident	16 Å²	16	41 Å²	41	8%	0.082	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	112.6	178.9	-53	177.4	0	0	0	109	V445 M458 P537 F538 L541	V445-I448 HydrophobicContact CG1-CD1 4.43Å; V445-I448 HydrophobicContact CG1-CG1 4.06Å; I448-M458 WeakPolarHBondContact CA-O 3.39Å; I448-P537 HydrophobicContact CD1-CB 4.36Å; I448-P537 HydrophobicContact CG2-CB 3.66Å; I448-F538 HydrophobicContact CB-CE1 4.47Å; I448-F538 HydrophobicContact CB-CZ 4.48Å; I448-F538 HydrophobicContact CG2-CD1 4.31Å; I448-F538 HydrophobicContact CG2-CD2 3.97Å; I448-F538 HydrophobicContact CG2-CE1 4.14Å; I448-F538 HydrophobicContact CG2-CE2 3.78Å; I448-F538 HydrophobicContact CG2-CG 4.23Å; I448-F538 HydrophobicContact CG2-CZ 3.89Å; I448-F538 WeakPolarHBondContact O-CE1 3.47Å; I448-F538 WeakPolarHBondContact O-CZ 3.39Å; I448-L541 HydrophobicContact CD1-CB 3.66Å; I448-L541 WeakPolarHBondContact CD1-O 3.46Å
449	F	89.3	Confident	88.2	Confident	47 Å²	47	35 Å²	35	21%	0.206	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	163	-176.3	61.8	-109.7	0	0	0	113.1	P451 P457 M458 A460 L515 A529	F449-P451 HydrophobicContact CD2-CB 4.33Å; F449-P451 HydrophobicContact CD2-CG 4.48Å; F449-P451 HydrophobicContact CE2-CB 4.11Å; F449-P451 HydrophobicContact CE2-CG 4.28Å; F449-P457 WeakPolarHBondContact O-CA 3.35Å; F449-M458 HydrophobicContact CE2-CB 4.11Å; F449-M458 PolarHBondContact N-O 3.36Å; F449-M458 PolarHBondContact O-N 3.11Å; F449-A460 HydrophobicContact CD1-CB 4.4Å; F449-A460 HydrophobicContact CE1-CB 3.8Å; F449-L515 HydrophobicContact CE2-CD1 3.66Å; F449-L515 HydrophobicContact CE2-CD2 4.31Å; F449-L515 HydrophobicContact CZ-CD1 3.91Å; F449-L515 HydrophobicContact CZ-CD2 3.76Å; F449-A529 HydrophobicContact CZ-CB 4Å
450	K	88.5	Confident	88.5	Confident	118 Å²	118	34.4 Å²	34.4	51%	0.513	23%	0.225	S	C	.	.			trans	-106.9	107.4	170.3	-58.8	-168.3	-178.9	-176.1	0	108.9	A452 P457 F538	K450-A452 PolarHBondContact O-N 2.78Å; K450-P457 HydrophobicContact CG-CB 4.11Å; K450-F538 HydrophobicContact CD-CE2 4.14Å; K450-F538 HydrophobicContact CG-CE2 3.62Å; K450-F538 HydrophobicContact CG-CZ 4.18Å
451	P	82.9	Confident	88.6	Confident	12 Å²	12	33.2 Å²	33.2	8%	0.078	22%	0.218	C	C	.	.			trans	-69.4	133.6	-176.4	23.3	-27.4	0	0	0	111.1	F449 G453 S454 M458 L515	F449-P451 HydrophobicContact CD2-CB 4.33Å; F449-P451 HydrophobicContact CD2-CG 4.48Å; F449-P451 HydrophobicContact CE2-CB 4.11Å; F449-P451 HydrophobicContact CE2-CG 4.28Å; P451-G453 PolarHBondContact O-N 3.49Å; P451-G453 VanDerWaalsContact O-N 3.14Å; P451-S454 WeakPolarHBondContact O-CB 3.28Å; P451-S454 PolarHBondContact O-N 3.05Å; P451-M458 HydrophobicContact CG-CG 4.08Å; P451-M458 HydrophobicContact CG-SD 3.97Å; P451-L515 HydrophobicContact CB-CD1 3.92Å
452	A	78.7	Confident	88.6	Confident	75 Å²	75	33.8 Å²	33.8	62%	0.62	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	117.9	-174.5	0	0	0	0	0	112.3	K450 K513	K450-A452 PolarHBondContact O-N 2.78Å; A452-K513 PolarHBondContact O-NZ 2.83Å
453	G	76.8	Confident	88.6	Confident	93 Å²	93	33 Å²	33	96%	0.959	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	104.2	-7	-172.2	0	0	0	0	0	114.9	P451	P451-G453 PolarHBondContact O-N 3.49Å; P451-G453 VanDerWaalsContact O-N 3.14Å
454	S	78.7	Confident	88.5	Confident	33 Å²	33	33.9 Å²	33.9	23%	0.231	22%	0.221	C	C	.	.			trans	-115.6	130.1	172.9	179.9	0	0	0	0	110.7	P451 V456	P451-S454 WeakPolarHBondContact O-CB 3.28Å; P451-S454 PolarHBondContact O-N 3.05Å; S454-V456 VanDerWaalsContact C-N 3.3Å; S454-V456 PolarHBondContact OG-N 2.83Å; S454-V456 VanDerWaalsContact OG-N 3.1Å; S454-V456 PolarHBondContact OG-O 3.36Å
455	S	81	Confident	88.3	Confident	108 Å²	108	33.5 Å²	33.5	76%	0.755	22%	0.219	S	C	*	.	S	Bend	trans	-73.8	-25.1	166	53.3	0	0	0	0	112.5
456	V	85.5	Confident	88.1	Confident	52 Å²	52	33.5 Å²	33.5	32%	0.315	22%	0.219	S	C	.	.	S	Bend	trans	-79.3	125.7	-178.2	-172.9	0	0	0	0	109.7	S454 M531	S454-V456 VanDerWaalsContact C-N 3.3Å; S454-V456 PolarHBondContact OG-N 2.83Å; S454-V456 VanDerWaalsContact OG-N 3.1Å; S454-V456 PolarHBondContact OG-O 3.36Å; V456-M531 HydrophobicContact CB-CE 4Å; V456-M531 HydrophobicContact CB-SD 4.3Å; V456-M531 HydrophobicContact CG1-CE 4.06Å; V456-M531 HydrophobicContact CG1-CG 3.73Å; V456-M531 HydrophobicContact CG1-SD 3.91Å
457	P	90.1	Very high	88.1	Confident	15 Å²	15	32.8 Å²	32.8	10%	0.097	21%	0.214	C	C	.	.			trans	-69.5	158.1	175.1	31.6	-37.7	0	0	0	112.4	F449 K450 P537 F538	F449-P457 WeakPolarHBondContact O-CA 3.35Å; K450-P457 HydrophobicContact CG-CB 4.11Å; P457-P537 HydrophobicContact CB-CG 4.37Å; P457-P537 HydrophobicContact CG-CG 3.93Å; P457-F538 HydrophobicContact CB-CD2 3.82Å; P457-F538 HydrophobicContact CB-CE2 3.64Å; P457-F538 HydrophobicContact CG-CD2 4.45Å
458	M	90.7	Very high	88.2	Confident	0 Å²	0	29 Å²	29	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	145.9	176	-67.3	-162.7	74	0	0	110.9	I448 F449 P451 R494 A529 L530 M531	I448-M458 WeakPolarHBondContact CA-O 3.39Å; F449-M458 HydrophobicContact CE2-CB 4.11Å; F449-M458 PolarHBondContact N-O 3.36Å; F449-M458 PolarHBondContact O-N 3.11Å; P451-M458 HydrophobicContact CG-CG 4.08Å; P451-M458 HydrophobicContact CG-SD 3.97Å; M458-R494 HydrophobicContact CE-CB 4.39Å; M458-R494 HydrophobicContact CE-CG 4.07Å; M458-R494 VanDerWaalsContact SD-CD 3.57Å; M458-A529 HydrophobicContact CB-CB 4.42Å; M458-A529 VanDerWaalsContact CE-C 3.46Å; M458-A529 HydrophobicContact CE-CB 3.81Å; M458-A529 WeakPolarHBondContact CE-O 3.42Å; M458-A529 HydrophobicContact SD-CB 4.48Å; M458-L530 WeakPolarHBondContact CA-O 3.41Å; M458-M531 HydrophobicContact CE-CB 3.99Å; M458-M531 HydrophobicContact CG-CB 4.4Å; M458-M531 HydrophobicContact CG-CE 4.28Å; M458-M531 HydrophobicContact SD-CE 4.3Å
459	V	93.3	Very high	88	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	108.4	-178.6	-175.3	0	0	0	0	108.1	F443 V445 A529 L530 L532 P537 L541	F443-V459 HydrophobicContact CE1-CG1 4.09Å; V445-V459 HydrophobicContact CB-CG1 4.19Å; V445-V459 HydrophobicContact CG1-CG1 3.65Å; V445-V459 HydrophobicContact CG2-CG1 3.64Å; V459-A529 WeakPolarHBondContact O-CA 3.42Å; V459-L530 PolarHBondContact N-O 2.81Å; V459-L530 PolarHBondContact O-N 2.76Å; V459-L532 HydrophobicContact CB-CD1 4.38Å; V459-L532 HydrophobicContact CG2-CD1 3.76Å; V459-L532 HydrophobicContact CG2-CG 4.41Å; V459-P537 HydrophobicContact CG2-CB 3.64Å; V459-P537 HydrophobicContact CG2-CG 3.69Å; V459-L541 HydrophobicContact CG1-CD1 4.3Å; V459-L541 HydrophobicContact CG2-CD1 3.98Å
460	A	91.9	Very high	87.9	Confident	4 Å²	4	26.7 Å²	26.7	3%	0.033	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	148	175.2	0	0	0	0	0	110.7	S446 D447 F449 L496	S446-A460 PolarHBondContact N-O 3.04Å; S446-A460 PolarHBondContact OG-O 2.78Å; D447-A460 HydrophobicContact CB-CB 4.32Å; D447-A460 PolarHBondContact N-O 2.66Å; D447-A460 PolarHBondContact O-N 3.07Å; F449-A460 HydrophobicContact CD1-CB 4.4Å; F449-A460 HydrophobicContact CE1-CB 3.8Å; A460-L496 HydrophobicContact CB-CD1 4.21Å
461	G	92.2	Very high	87.4	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.3	-175.5	-179.5	0	0	0	0	0	114.2	F443 V444 S446 Q527 V528	F443-G461 VanDerWaalsContact CE2-O 3.29Å; F443-G461 WeakPolarHBondContact CE2-O 3.46Å; V444-G461 CarbonylContact O-C 3.5Å; V444-G461 WeakPolarHBondContact O-CA 3.41Å; S446-G461 WeakPolarHBondContact OG-CA 3.48Å; S446-G461 PolarHBondContact OG-N 3.02Å; G461-Q527 PolarHBondContact O-OE1 2.86Å; G461-V528 PolarHBondContact N-O 2.75Å; G461-V528 VanDerWaalsContact N-O 3.08Å; G461-V528 PolarHBondContact O-N 2.61Å
462	R	92.5	Very high	86.9	Confident	13 Å²	13	25 Å²	25	5%	0.049	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	129.6	-173.7	-163.7	178.9	-179.4	-166.2	8.6	111.8	N207 T305 Q306 A307 D308 F443 V444 I464 G525 D526 Q527	N207-R462 PolarHBondContact ND2-NE 3.22Å; N207-R462 PolarHBondContact ND2-NH2 2.87Å; T305-R462 PolarHBondContact O-NH1 3.34Å; Q306-R462 VanDerWaalsContact C-NH1 3.31Å; Q306-R462 PolarHBondContact O-NE 2.81Å; Q306-R462 PolarHBondContact O-NH1 2.81Å; A307-R462 PolarHBondContact O-NH1 3.12Å; D308-R462 IonicContact OD1-CZ 2.68Å; D308-R462 IonicContact OD1-NH1 2.66Å; D308-R462 IonicContact OD1-NH2 3.34Å; D308-R462 PolarHBondContact OD1-NH2 3.18Å; D308-R462 IonicContact OD2-NH2 3.34Å; D308-R462 PolarHBondContact OD2-NH2 3.3Å; F443-R462 VanDerWaalsContact CA-O 3.29Å; F443-R462 WeakPolarHBondContact CA-O 3.43Å; V444-R462 PolarHBondContact N-O 3.15Å; V444-R462 PolarHBondContact O-N 3.14Å; R462-I464 HydrophobicContact CB-CD1 4.26Å; R462-I464 HydrophobicContact CG-CD1 4.17Å; R462-I464 PolarHBondContact O-N 3.24Å; R462-G525 PolarHBondContact NE-O 2.93Å; R462-D526 WeakPolarHBondContact CA-O 3.3Å; R462-Q527 VanDerWaalsContact CA-OE1 3.3Å
463	V	93.6	Very high	86.3	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	111.4	165.2	-173.1	0	0	0	0	108.4	F441 F443 A522 F523 G525 D526 V528	F441-V463 HydrophobicContact CD2-CG1 4.15Å; F441-V463 HydrophobicContact CE2-CG1 3.82Å; F441-V463 HydrophobicContact CE2-CG2 4.16Å; F443-V463 HydrophobicContact CD2-CG2 3.98Å; V463-A522 HydrophobicContact CG2-CB 4.19Å; V463-F523 WeakPolarHBondContact CB-O 3.39Å; V463-G525 PolarHBondContact O-N 2.98Å; V463-D526 PolarHBondContact N-O 3.07Å; V463-V528 HydrophobicContact CG2-CG2 4.19Å
464	I	91.9	Very high	86.4	Confident	18 Å²	18	24.3 Å²	24.3	9%	0.092	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	-46.5	178.9	-58.9	-58.3	0	0	0	110.4	R442 V444 R462 S524 P641	R442-I464 HydrophobicContact CB-CB 4.41Å; R442-I464 WeakPolarHBondContact O-CB 2.92Å; R442-I464 PolarHBondContact O-N 3.25Å; V444-I464 HydrophobicContact CB-CG1 4.39Å; V444-I464 HydrophobicContact CG2-CD1 4.07Å; V444-I464 HydrophobicContact CG2-CG1 3.61Å; R462-I464 HydrophobicContact CB-CD1 4.26Å; R462-I464 HydrophobicContact CG-CD1 4.17Å; R462-I464 PolarHBondContact O-N 3.24Å; I464-S524 PolarHBondContact O-OG 3.17Å; I464-P641 HydrophobicContact CG2-CB 4.07Å; I464-P641 HydrophobicContact CG2-CG 3.89Å
465	S	91.3	Very high	86.4	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	162.3	178.8	62.3	0	0	0	0	111.2	T436 P440 F441 R442	T436-S465 WeakPolarHBondContact OG1-CB 3.38Å; P440-S465 CarbonylContact O-C 3.57Å; P440-S465 PolarHBondContact O-OG 3.32Å; F441-S465 WeakPolarHBondContact CA-O 3.47Å; R442-S465 WeakPolarHBondContact CB-OG 3.26Å; R442-S465 WeakPolarHBondContact CG-OG 3.47Å; R442-S465 PolarHBondContact N-O 3.13Å; R442-S465 PolarHBondContact NH1-OG 2.71Å; R442-S465 PolarHBondContact O-N 2.9Å
466	G	89.7	Confident	86.5	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.16	C	C	.	.	S	Bend	trans	75.2	-158.3	-177.3	0	0	0	0	0	113.5	T436 V437 G439 S524	T436-G466 PolarHBondContact O-N 2.92Å; V437-G466 WeakPolarHBondContact O-CA 3.28Å; G439-G466 WeakPolarHBondContact O-CA 3.24Å; G466-S524 PolarHBondContact O-N 2.89Å
467	A	90.2	Very high	86.6	Confident	5 Å²	5	24.2 Å²	24.2	4%	0.041	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	162.8	178.8	0	0	0	0	0	111.1	L189 V437 A522 F523	L189-A467 HydrophobicContact CB-CB 4.08Å; L189-A467 HydrophobicContact CD1-CB 4.18Å; V437-A467 HydrophobicContact CG1-CB 4.15Å; A467-A522 CarbonylContact C-O 3.55Å; A467-A522 WeakPolarHBondContact CA-O 3.22Å; A467-A522 WeakPolarHBondContact CB-O 3.16Å; A467-F523 HydrophobicContact CB-CD1 3.66Å; A467-F523 HydrophobicContact CB-CE1 4.18Å
468	I	91.1	Very high	86.6	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	154.8	176.1	42.4	167.3	0	0	0	111.8	F441 S477 V479 I493 F521 A522 L530	F441-I468 HydrophobicContact CD1-CG2 3.94Å; F441-I468 HydrophobicContact CD2-CG2 3.64Å; F441-I468 HydrophobicContact CE1-CG2 3.78Å; F441-I468 HydrophobicContact CE2-CB 4.21Å; F441-I468 HydrophobicContact CE2-CD1 4.01Å; F441-I468 HydrophobicContact CE2-CG1 3.83Å; F441-I468 HydrophobicContact CE2-CG2 3.44Å; F441-I468 VanDerWaalsContact CE2-CG2 3.44Å; F441-I468 HydrophobicContact CG-CG2 3.86Å; F441-I468 HydrophobicContact CZ-CB 4.45Å; F441-I468 HydrophobicContact CZ-CD1 3.86Å; F441-I468 HydrophobicContact CZ-CG1 4.15Å; F441-I468 HydrophobicContact CZ-CG2 3.51Å; I468-S477 WeakPolarHBondContact CA-OG 3.44Å; I468-V479 HydrophobicContact CG2-CG1 4.38Å; I468-I493 HydrophobicContact CB-CD1 4.46Å; I468-I493 HydrophobicContact CD1-CD1 3.92Å; I468-I493 HydrophobicContact CD1-CG1 4.3Å; I468-I493 HydrophobicContact CG1-CD1 3.98Å; I468-F521 VanDerWaalsContact O-CA 3.23Å; I468-F521 WeakPolarHBondContact O-CA 3.31Å; I468-A522 HydrophobicContact CD1-CB 4.32Å; I468-A522 HydrophobicContact CG1-CB 4.05Å; I468-A522 PolarHBondContact N-O 2.82Å; I468-A522 PolarHBondContact O-N 3.24Å; I468-A522 VanDerWaalsContact O-N 3.09Å; I468-L530 HydrophobicContact CD1-CD1 4.03Å; I468-L530 HydrophobicContact CD1-CD2 3.54Å; I468-L530 HydrophobicContact CD1-CG 4.46Å
469	S	89.1	Confident	86.7	Confident	0 Å²	0	30 Å²	30	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	145.3	168.9	-174	0	0	0	0	112.2	G471 S477 K520 F521	S469-G471 VanDerWaalsContact C-N 3.27Å; S469-G471 PolarHBondContact O-N 3.01Å; S469-G471 PolarHBondContact OG-N 2.87Å; S469-G471 VanDerWaalsContact OG-N 3.15Å; S469-S477 PolarHBondContact N-OG 3.06Å; S469-S477 PolarHBondContact O-N 3.48Å; S469-K520 WeakPolarHBondContact CA-O 3.48Å; S469-K520 PolarHBondContact OG-O 2.84Å; S469-F521 VanDerWaalsContact OG-CE1 3.32Å; S469-F521 WeakPolarHBondContact OG-CE1 3.38Å
470	S	86.6	Confident	86.7	Confident	15 Å²	15	30.1 Å²	30.1	11%	0.105	18%	0.175	C	C	.	.			trans	-75.8	-7.3	169.9	48.5	0	0	0	0	114.4	T476 V519 K520	S470-T476 PolarHBondContact O-OG1 3.23Å; S470-V519 PolarHBondContact OG-O 3.39Å; S470-K520 PolarHBondContact N-O 3.05Å; S470-K520 VanDerWaalsContact N-O 3.16Å; S470-K520 PolarHBondContact OG-O 2.94Å
471	G	78.1	Confident	86.8	Confident	34 Å²	34	29.9 Å²	29.9	35%	0.351	17%	0.174	S	C	.	.	S	Bend	trans	110.3	7.4	-178.6	0	0	0	0	0	115.4	S469 I474 T476	S469-G471 VanDerWaalsContact C-N 3.27Å; S469-G471 PolarHBondContact O-N 3.01Å; S469-G471 PolarHBondContact OG-N 2.87Å; S469-G471 VanDerWaalsContact OG-N 3.15Å; G471-I474 CarbonylContact C-O 3.58Å; G471-I474 WeakPolarHBondContact CA-O 3.28Å; G471-T476 VanDerWaalsContact CA-OG1 3.24Å; G471-T476 WeakPolarHBondContact CA-OG1 3.2Å
472	V	71.2	Confident	86.8	Confident	60 Å²	60	30.1 Å²	30.1	36%	0.364	18%	0.175	S	C	.	.	S	Bend	trans	-92.8	120.3	178.6	-173.7	0	0	0	0	109.2	I474 K520	V472-I474 PolarHBondContact O-N 2.92Å; V472-K520 HydrophobicContact CB-CB 4.29Å; V472-K520 HydrophobicContact CB-CD 4.25Å; V472-K520 HydrophobicContact CB-CG 4.01Å; V472-K520 HydrophobicContact CG1-CD 3.8Å; V472-K520 HydrophobicContact CG1-CG 4.02Å; V472-K520 HydrophobicContact CG2-CG 4.43Å
473	N	65.8	Low	86.6	Confident	133 Å²	133	31.7 Å²	31.7	71%	0.711	19%	0.187	S	C	*	.	S	Bend	trans	62.9	-33.5	-173.4	-59.3	-2.6	0	0	0	115.8
474	I	79.1	Confident	86.3	Confident	21 Å²	21	34 Å²	34	11%	0.108	20%	0.203	C	C	.	.	S	Bend	trans	-113.7	143.4	176.2	-60.5	179.3	0	0	0	107.9	L189 E192 G471 V472 F521	L189-I474 HydrophobicContact CD2-CD1 3.83Å; L189-I474 HydrophobicContact CD2-CG2 4.31Å; L189-I474 HydrophobicContact CG-CD1 4.25Å; L189-I474 HydrophobicContact CG-CG2 4.42Å; E192-I474 HydrophobicContact CB-CD1 4.46Å; G471-I474 CarbonylContact C-O 3.58Å; G471-I474 WeakPolarHBondContact CA-O 3.28Å; V472-I474 PolarHBondContact O-N 2.92Å; I474-F521 HydrophobicContact CB-CE1 4.12Å; I474-F521 HydrophobicContact CD1-CD1 4.49Å; I474-F521 HydrophobicContact CD1-CE1 3.72Å; I474-F521 HydrophobicContact CD1-CZ 4.08Å; I474-F521 HydrophobicContact CG1-CE1 4.02Å; I474-F521 HydrophobicContact CG1-CZ 4.33Å
475	P	80.2	Confident	86.2	Confident	114 Å²	114	38.1 Å²	38.1	74%	0.74	23%	0.225	S	C	*	.	P	Polyproline II helix	trans	-55	143.6	177.7	-26.9	35.6	0	0	0	113.4	S477	P475-S477 PolarHBondContact O-N 3.07Å
476	T	83.4	Confident	86.2	Confident	59 Å²	59	40.7 Å²	40.7	36%	0.362	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-55.2	128.2	179.4	-57.6	0	0	0	0	111.7	S470 G471 K478 C489 V490	S470-T476 PolarHBondContact O-OG1 3.23Å; G471-T476 VanDerWaalsContact CA-OG1 3.24Å; G471-T476 WeakPolarHBondContact CA-OG1 3.2Å; T476-K478 PolarHBondContact O-N 2.65Å; T476-C489 HydrophobicContact CG2-CB 4.13Å; T476-V490 WeakPolarHBondContact CG2-O 3.3Å
477	S	87	Confident	86.4	Confident	17 Å²	17	47 Å²	47	12%	0.119	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-65.8	127.9	176.7	-63.6	0	0	0	0	111.4	I468 S469 P475 V490	I468-S477 WeakPolarHBondContact CA-OG 3.44Å; S469-S477 PolarHBondContact N-OG 3.06Å; S469-S477 PolarHBondContact O-N 3.48Å; P475-S477 PolarHBondContact O-N 3.07Å; S477-V490 PolarHBondContact O-N 3.49Å; S477-V490 VanDerWaalsContact O-N 3.13Å
478	K	90.4	Very high	86.5	Confident	134 Å²	134	46.9 Å²	46.9	58%	0.583	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	132.3	168.3	-59.2	-172.4	178.3	-177.5	0	108.3	T476 P550	T476-K478 PolarHBondContact O-N 2.65Å; K478-P550 VanDerWaalsContact O-CD 3.23Å; K478-P550 WeakPolarHBondContact O-CD 3.43Å
479	V	92.7	Very high	86.5	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.012	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	162.3	-179	-57.2	0	0	0	0	110.3	F441 I468 T488 V490 L532 T548	F441-V479 HydrophobicContact CD1-CG1 3.87Å; F441-V479 HydrophobicContact CE1-CG1 3.74Å; I468-V479 HydrophobicContact CG2-CG1 4.38Å; V479-T488 HydrophobicContact CG2-CG2 3.61Å; V479-T488 PolarHBondContact N-O 2.91Å; V479-T488 PolarHBondContact O-N 2.67Å; V479-T488 VanDerWaalsContact O-O 3.09Å; V479-V490 HydrophobicContact CG1-CG2 4.23Å; V479-V490 HydrophobicContact CG2-CG2 4.35Å; V479-L532 HydrophobicContact CG2-CD2 4.42Å; V479-T548 CarbonylContact C-O 3.58Å; V479-T548 VanDerWaalsContact CA-O 3.3Å; V479-T548 WeakPolarHBondContact CA-O 3.24Å
480	I	93.6	Very high	86.6	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.015	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	131.7	176.7	-163.6	165.9	0	0	0	110.4	L482 D485 V486 R487 L547 T548 P553	I480-L482 HydrophobicContact CG1-CD2 4.49Å; I480-L482 HydrophobicContact CG2-CD1 4.37Å; I480-L482 HydrophobicContact CG2-CD2 4.42Å; I480-L482 HydrophobicContact CG2-CG 4.27Å; I480-D485 WeakPolarHBondContact CD1-OD1 3.49Å; I480-V486 WeakPolarHBondContact CA-O 3.23Å; I480-R487 HydrophobicContact CD1-CG 3.88Å; I480-R487 HydrophobicContact CG1-CG 4.04Å; I480-L547 WeakPolarHBondContact O-CA 3.42Å; I480-T548 WeakPolarHBondContact CG2-OG1 3.34Å; I480-T548 PolarHBondContact N-O 3.1Å; I480-T548 PolarHBondContact O-N 2.92Å; I480-P553 HydrophobicContact CG2-CB 4.29Å
481	C	93.3	Very high	86.7	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	119.6	179.6	-63.8	0	0	0	0	110	S484 D485 V486 L541 L547	C481-S484 CarbonylContact O-C 3.52Å; C481-S484 PolarHBondContact O-N 3.45Å; C481-D485 WeakPolarHBondContact O-CA 3.3Å; C481-D485 PolarHBondContact O-N 3.28Å; C481-V486 HydrophobicContact CB-CB 4.36Å; C481-V486 WeakPolarHBondContact CB-O 3.23Å; C481-V486 PolarHBondContact N-O 3.5Å; C481-V486 PolarHBondContact O-N 3.43Å; C481-L541 HydrophobicContact CB-CD2 3.85Å; C481-L547 HydrophobicContact CB-CD2 4.11Å; C481-L547 WeakPolarHBondContact SG-CD2 3.47Å
482	L	91.8	Very high	87.2	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	130.3	-176.6	-60.5	173.3	0	0	0	109.5	I480 D545 L546 T548 P553 I554 C632	I480-L482 HydrophobicContact CG1-CD2 4.49Å; I480-L482 HydrophobicContact CG2-CD1 4.37Å; I480-L482 HydrophobicContact CG2-CD2 4.42Å; I480-L482 HydrophobicContact CG2-CG 4.27Å; L482-D545 WeakPolarHBondContact O-CB 3.17Å; L482-L546 PolarHBondContact N-O 3.27Å; L482-L546 PolarHBondContact O-N 2.98Å; L482-T548 HydrophobicContact CD1-CG2 3.96Å; L482-T548 WeakPolarHBondContact CD1-OG1 3.27Å; L482-P553 HydrophobicContact CD1-CB 4.2Å; L482-P553 HydrophobicContact CD2-CB 4.47Å; L482-I554 HydrophobicContact CD1-CB 4.04Å; L482-C632 HydrophobicContact CB-CB 4.44Å
483	P	88.6	Confident	88.1	Confident	47 Å²	47	50.7 Å²	50.7	31%	0.305	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	cis	-87.6	-3.1	21.4	34.2	-37.1	0	0	0	116.8	D485 D545 P556	P483-D485 VanDerWaalsContact C-N 3.27Å; P483-D485 PolarHBondContact O-N 3.23Å; P483-D545 WeakPolarHBondContact CD-OD1 3.39Å; P483-P556 HydrophobicContact CB-CB 4.42Å
484	S	88	Confident	89.1	Confident	49 Å²	49	46.6 Å²	46.6	34%	0.343	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-9.9	-169.1	-50	0	0	0	0	116.2	C481 V486 T540	C481-S484 CarbonylContact O-C 3.52Å; C481-S484 PolarHBondContact O-N 3.45Å; S484-V486 WeakPolarHBondContact O-CG2 3.5Å; S484-V486 PolarHBondContact O-N 3.16Å; S484-V486 VanDerWaalsContact O-N 3.16Å; S484-T540 PolarHBondContact OG-O 2.84Å
485	D	89.8	Confident	89.3	Confident	104 Å²	104	46.1 Å²	46.1	56%	0.556	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	56	19.3	-176.3	-151.9	43.5	0	0	0	115.6	I480 C481 P483	I480-D485 WeakPolarHBondContact CD1-OD1 3.49Å; C481-D485 WeakPolarHBondContact O-CA 3.3Å; C481-D485 PolarHBondContact O-N 3.28Å; P483-D485 VanDerWaalsContact C-N 3.27Å; P483-D485 PolarHBondContact O-N 3.23Å
486	V	91.5	Very high	89.1	Confident	53 Å²	53	41.3 Å²	41.3	32%	0.321	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	127.6	-177.9	-170.3	0	0	0	0	110.7	I480 C481 S484 I535 T540	I480-V486 WeakPolarHBondContact CA-O 3.23Å; C481-V486 HydrophobicContact CB-CB 4.36Å; C481-V486 WeakPolarHBondContact CB-O 3.23Å; C481-V486 PolarHBondContact N-O 3.5Å; C481-V486 PolarHBondContact O-N 3.43Å; S484-V486 WeakPolarHBondContact O-CG2 3.5Å; S484-V486 PolarHBondContact O-N 3.16Å; S484-V486 VanDerWaalsContact O-N 3.16Å; V486-I535 HydrophobicContact CG1-CG2 3.47Å; V486-I535 VanDerWaalsContact CG1-CG2 3.47Å; V486-T540 HydrophobicContact CB-CG2 4.11Å; V486-T540 HydrophobicContact CG2-CG2 3.87Å
487	R	92.5	Very high	88	Confident	132 Å²	132	38.7 Å²	38.7	50%	0.498	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	137.8	177.8	-61.1	178.4	-177.6	-171	-2	110.7	A178 I480	A178-R487 PolarHBondContact O-NH1 2.69Å; A178-R487 PolarHBondContact O-NH2 3.38Å; I480-R487 HydrophobicContact CD1-CG 3.88Å; I480-R487 HydrophobicContact CG1-CG 4.04Å
488	T	91.9	Very high	86.6	Confident	3 Å²	3	39.3 Å²	39.3	2%	0.018	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	166.1	-177.9	178.3	0	0	0	0	111.4	V479 L532 T533 I535	V479-T488 HydrophobicContact CG2-CG2 3.61Å; V479-T488 PolarHBondContact N-O 2.91Å; V479-T488 PolarHBondContact O-N 2.67Å; V479-T488 VanDerWaalsContact O-O 3.09Å; T488-L532 HydrophobicContact CG2-CB 4.47Å; T488-L532 HydrophobicContact CG2-CD1 4.3Å; T488-L532 HydrophobicContact CG2-CD2 4.23Å; T488-T533 WeakPolarHBondContact CB-O 3.19Å; T488-T533 PolarHBondContact OG1-N 3.43Å; T488-T533 PolarHBondContact OG1-O 2.77Å; T488-I535 HydrophobicContact CG2-CD1 4.16Å
489	C	91.4	Very high	84.5	Confident	35 Å²	35	34 Å²	34	24%	0.236	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	147.8	175.8	-52.6	0	0	0	0	111.4	T476 K491 L532 T533	T476-C489 HydrophobicContact CG2-CB 4.13Å; C489-K491 PolarHBondContact O-N 2.83Å; C489-L532 WeakPolarHBondContact O-CA 3.12Å; C489-T533 WeakPolarHBondContact CB-OG1 3.37Å; C489-T533 PolarHBondContact N-OG1 3.45Å; C489-T533 PolarHBondContact O-N 2.97Å; C489-T533 PolarHBondContact O-OG1 3.34Å
490	V	91.8	Very high	81.9	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	99.7	-180	-177.3	0	0	0	0	110.8	T476 S477 V479 I493 L530 L532	T476-V490 WeakPolarHBondContact CG2-O 3.3Å; S477-V490 PolarHBondContact O-N 3.49Å; S477-V490 VanDerWaalsContact O-N 3.13Å; V479-V490 HydrophobicContact CG1-CG2 4.23Å; V479-V490 HydrophobicContact CG2-CG2 4.35Å; V490-I493 HydrophobicContact CG1-CD1 4.33Å; V490-I493 HydrophobicContact CG1-CG1 3.68Å; V490-L530 HydrophobicContact CG1-CD2 4.19Å; V490-L532 HydrophobicContact CG2-CD2 4.13Å
491	K	89.5	Confident	79.1	Confident	135 Å²	135	45.4 Å²	45.4	59%	0.587	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	-37.3	-179.1	-176.7	172.7	177.9	-179.9	0	113.6	C489 M531 T533	C489-K491 PolarHBondContact O-N 2.83Å; K491-M531 HydrophobicContact CB-CB 4.46Å; K491-M531 HydrophobicContact CB-CG 4.25Å; K491-M531 HydrophobicContact CD-SD 3.98Å; K491-M531 HydrophobicContact CG-SD 4.4Å; K491-M531 PolarHBondContact N-O 3.43Å; K491-T533 HydrophobicContact CB-CG2 3.81Å; K491-T533 HydrophobicContact CD-CG2 4.41Å
492	S	87.9	Confident	76.1	Confident	19 Å²	19	50.8 Å²	50.8	13%	0.133	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	152.4	175	62.5	0	0	0	0	111.2	M531	S492-M531 PolarHBondContact O-N 3.33Å; S492-M531 VanDerWaalsContact OG-CB 3.3Å; S492-M531 WeakPolarHBondContact OG-CB 3.49Å
493	I	89.8	Confident	73.2	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	132.2	177.2	-57.9	170.2	0	0	0	106.5	I468 V490 V518 V519 A522 V528 L530	I468-I493 HydrophobicContact CB-CD1 4.46Å; I468-I493 HydrophobicContact CD1-CD1 3.92Å; I468-I493 HydrophobicContact CD1-CG1 4.3Å; I468-I493 HydrophobicContact CG1-CD1 3.98Å; V490-I493 HydrophobicContact CG1-CD1 4.33Å; V490-I493 HydrophobicContact CG1-CG1 3.68Å; I493-V518 CarbonylContact O-C 3.58Å; I493-V518 WeakPolarHBondContact O-CA 3.1Å; I493-V518 WeakPolarHBondContact O-CG1 3.44Å; I493-V519 PolarHBondContact O-N 2.87Å; I493-A522 HydrophobicContact CD1-CB 4.45Å; I493-A522 HydrophobicContact CG2-CB 4.01Å; I493-V528 HydrophobicContact CG2-CB 3.98Å; I493-V528 HydrophobicContact CG2-CG1 3.96Å; I493-V528 HydrophobicContact CG2-CG2 4.35Å; I493-L530 HydrophobicContact CB-CD2 4.36Å; I493-L530 HydrophobicContact CG1-CD2 3.89Å; I493-L530 HydrophobicContact CG2-CD2 4.18Å
494	R	87.7	Confident	70.3	Confident	47 Å²	47	64.2 Å²	64.2	18%	0.177	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	132.9	171.1	-67.2	169.5	-177.7	-115.6	6.3	108.7	M458 L515 V518 V528 A529	M458-R494 HydrophobicContact CE-CB 4.39Å; M458-R494 HydrophobicContact CE-CG 4.07Å; M458-R494 VanDerWaalsContact SD-CD 3.57Å; R494-L515 WeakPolarHBondContact CD-O 3.41Å; R494-L515 PolarHBondContact NH1-O 2.9Å; R494-V518 HydrophobicContact CG-CG2 4.19Å; R494-V528 CarbonylContact O-C 3.59Å; R494-V528 VanDerWaalsContact O-CA 3.28Å; R494-V528 WeakPolarHBondContact O-CA 3.46Å; R494-V528 WeakPolarHBondContact O-CB 3.47Å; R494-A529 HydrophobicContact CB-CB 4.41Å; R494-A529 PolarHBondContact N-O 2.81Å; R494-A529 PolarHBondContact O-N 3.5Å
495	S	82.5	Confident	67.8	Low	11 Å²	11	67.7 Å²	67.7	8%	0.077	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	136.3	175.4	177	0	0	0	0	110.5	C497 N498 Q517	S495-C497 PolarHBondContact OG-N 3.06Å; S495-N498 VanDerWaalsContact CB-CG 3.49Å; S495-N498 WeakPolarHBondContact CB-OD1 3.34Å; S495-N498 VanDerWaalsContact OG-CG 3.24Å; S495-N498 PolarHBondContact OG-N 3.24Å; S495-N498 PolarHBondContact OG-OD1 2.9Å; S495-Q517 PolarHBondContact N-O 3.14Å
496	L	75.5	Confident	65.1	Low	13 Å²	13	67.4 Å²	67.4	7%	0.068	36%	0.358	C	S	.	.	S	Bend	trans	-88.2	-9.5	168.8	-63.4	166.1	0	0	0	111.7	S277 A460 L515 Q527	S277-L496 PolarHBondContact OG-O 3.36Å; A460-L496 HydrophobicContact CB-CD1 4.21Å; L496-L515 HydrophobicContact CD2-CD2 3.56Å; L496-Q527 HydrophobicContact CB-CB 4.15Å; L496-Q527 HydrophobicContact CD1-CB 4.21Å; L496-Q527 PolarHBondContact N-O 2.82Å
497	C	60.7	Low	62.1	Low	4 Å²	4	74.6 Å²	74.6	3%	0.027	39%	0.389	C	S	.	.	S	Bend	trans	-104.5	-4.9	-172.1	-56.8	0	0	0	0	114.5	S277 S495 T499	S277-C497 WeakPolarHBondContact CB-O 3.33Å; S277-C497 PolarHBondContact OG-O 2.79Å; S495-C497 PolarHBondContact OG-N 3.06Å; C497-T499 PolarHBondContact O-N 3.48Å
498	N	57	Low	59	Low	30 Å²	30	72.2 Å²	72.2	16%	0.16	41%	0.405	C	S	.	.			trans	-94.1	97.5	-172.7	-71.4	22	0	0	0	111.4	S495 Q517	S495-N498 VanDerWaalsContact CB-CG 3.49Å; S495-N498 WeakPolarHBondContact CB-OD1 3.34Å; S495-N498 VanDerWaalsContact OG-CG 3.24Å; S495-N498 PolarHBondContact OG-N 3.24Å; S495-N498 PolarHBondContact OG-OD1 2.9Å; N498-Q517 VanDerWaalsContact CB-OE1 3.27Å; N498-Q517 PolarHBondContact ND2-OE1 3.25Å
499	T	47.8	Very low	56.1	Low	24 Å²	24	78.9 Å²	78.9	15%	0.147	44%	0.441	C	S	.	.			trans	-65.3	135.1	164.3	55.9	0	0	0	0	110.1	S277 C497 T501	S277-T499 WeakPolarHBondContact O-CG2 3.41Å; C497-T499 PolarHBondContact O-N 3.48Å; T499-T501 PolarHBondContact O-N 3.46Å; T499-T501 VanDerWaalsContact O-N 3.13Å
500	R	37.3	Very low	53.3	Low	140 Å²	140	84 Å²	84	53%	0.528	47%	0.465	S	S	.	.			trans	-58.4	118.4	176.8	-68.5	-167.1	-172.4	-167.1	9.7	110.5	S502 D505 D516	R500-S502 PolarHBondContact O-N 3.31Å; R500-S502 VanDerWaalsContact O-N 3.1Å; R500-D505 IonicContact CZ-OD2 3.23Å; R500-D505 IonicContact NH1-OD2 2.88Å; R500-D505 PolarHBondContact NH1-OD2 2.71Å; R500-D516 IonicContact NH2-OD2 3.87Å; R500-D516 PolarHBondContact NH2-OD2 3.1Å
501	T	34	Very low	50.2	Low	103 Å²	103	86.7 Å²	86.7	63%	0.632	49%	0.492	S	S	*	.			trans	-74.9	92.3	165.9	49.9	0	0	0	0	108.8	T499 Q503	T499-T501 PolarHBondContact O-N 3.46Å; T499-T501 VanDerWaalsContact O-N 3.13Å; T501-Q503 PolarHBondContact O-N 2.71Å
502	S	30.7	Very low	47.4	Very low	113 Å²	113	82.7 Å²	82.7	79%	0.79	49%	0.489	S	S	*	.			trans	-63.8	101.7	-174	-57.8	0	0	0	0	113.2	R500	R500-S502 PolarHBondContact O-N 3.31Å; R500-S502 VanDerWaalsContact O-N 3.1Å
503	Q	30.3	Very low	45.3	Very low	181 Å²	181	86.5 Å²	86.5	85%	0.846	50%	0.504	S	S	*	.	S	Bend	trans	-138.8	-31	159.7	-72.3	-163.3	-11.6	0	0	114.6	T501	T501-Q503 PolarHBondContact O-N 2.71Å
504	N	28	Very low	43.2	Very low	152 Å²	152	90.4 Å²	90.4	81%	0.813	52%	0.524	S	S	*	.	S	Bend	trans	-114.2	-15.5	-165.1	-69.8	2.2	0	0	0	117.2
505	D	35.5	Very low	41.4	Very low	122 Å²	122	89.5 Å²	89.5	65%	0.652	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-91.2	117.5	-178.8	-67.6	-20.2	0	0	0	110.8	R500	R500-D505 IonicContact CZ-OD2 3.23Å; R500-D505 IonicContact NH1-OD2 2.88Å; R500-D505 PolarHBondContact NH1-OD2 2.71Å
506	A	33.5	Very low	39.9	Very low	98 Å²	98	92.4 Å²	92.4	81%	0.81	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-73.4	170.7	176.9	0	0	0	0	0	113.2
507	E	28.9	Very low	39.5	Very low	205 Å²	205	96.7 Å²	96.7	96%	0.958	56%	0.557	S	S	*	*	S	Bend	trans	-52.9	133.5	179.2	-54.7	174.8	116.5	0	0	112.2
508	G	27.9	Very low	40.3	Very low	82 Å²	82	100.3 Å²	100.3	85%	0.845	58%	0.579	S	S	*	*	S	Bend	trans	-172.3	-61.8	-179.8	0	0	0	0	0	117.3
509	D	31.4	Very low	41.6	Very low	143 Å²	143	100.8 Å²	100.8	77%	0.765	58%	0.582	S	S	*	*			trans	-145.2	114.9	-178.3	-172.1	0.4	0	0	0	112.1	G511	D509-G511 VanDerWaalsContact C-N 3.32Å; D509-G511 PolarHBondContact O-N 2.89Å; D509-G511 PolarHBondContact OD1-N 3.44Å; D509-G511 VanDerWaalsContact OD1-N 3.15Å
510	L	30.7	Very low	43.3	Very low	142 Å²	142	104.5 Å²	104.5	74%	0.743	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	21.4	-175	-142.7	77.4	0	0	0	113.7
511	G	26.7	Very low	45.7	Very low	56 Å²	56	98.6 Å²	98.6	58%	0.577	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	17.3	163.8	0	0	0	0	0	114.3	D509 K513	D509-G511 VanDerWaalsContact C-N 3.32Å; D509-G511 PolarHBondContact O-N 2.89Å; D509-G511 PolarHBondContact OD1-N 3.44Å; D509-G511 VanDerWaalsContact OD1-N 3.15Å; G511-K513 PolarHBondContact O-N 3.01Å
512	G	31.2	Very low	48.3	Very low	51 Å²	51	93.7 Å²	93.7	53%	0.526	55%	0.545	S	S	.	.			trans	-45.4	119	-167.1	0	0	0	0	0	115.3
513	K	43.7	Very low	51.1	Low	100 Å²	100	88.9 Å²	88.9	44%	0.435	51%	0.51	S	S	.	.			trans	-76.2	142.7	-172	-59.7	160.4	-169.4	167.1	0	110.3	A452 G511 L515 D516	A452-K513 PolarHBondContact O-NZ 2.83Å; G511-K513 PolarHBondContact O-N 3.01Å; K513-L515 HydrophobicContact CB-CB 4.42Å; K513-L515 PolarHBondContact O-N 3.31Å; K513-D516 PolarHBondContact O-N 3.4Å
514	L	45.9	Very low	54	Low	81 Å²	81	80.6 Å²	80.6	42%	0.424	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	1.9	170.4	-158	85.8	0	0	0	113.7
515	L	49.5	Very low	56.9	Low	28 Å²	28	73.4 Å²	73.4	15%	0.147	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.3	-5.4	-166	-59.7	175.6	0	0	0	113.1	F449 P451 R494 L496 K513 Q517	F449-L515 HydrophobicContact CE2-CD1 3.66Å; F449-L515 HydrophobicContact CE2-CD2 4.31Å; F449-L515 HydrophobicContact CZ-CD1 3.91Å; F449-L515 HydrophobicContact CZ-CD2 3.76Å; P451-L515 HydrophobicContact CB-CD1 3.92Å; R494-L515 WeakPolarHBondContact CD-O 3.41Å; R494-L515 PolarHBondContact NH1-O 2.9Å; L496-L515 HydrophobicContact CD2-CD2 3.56Å; K513-L515 HydrophobicContact CB-CB 4.42Å; K513-L515 PolarHBondContact O-N 3.31Å; L515-Q517 PolarHBondContact O-N 2.97Å
516	D	52	Low	59.4	Low	72 Å²	72	68.8 Å²	68.8	39%	0.385	41%	0.409	S	S	.	.			trans	-78.3	-17.6	-165.4	-67.5	-28.3	0	0	0	114.7	R500 K513 V518	R500-D516 IonicContact NH2-OD2 3.87Å; R500-D516 PolarHBondContact NH2-OD2 3.1Å; K513-D516 PolarHBondContact O-N 3.4Å; D516-V518 PolarHBondContact O-N 3.19Å
517	Q	66.6	Low	62.1	Low	103 Å²	103	64.3 Å²	64.3	48%	0.481	37%	0.371	S	S	.	.			trans	-86.4	106.1	177	-160.6	174.8	44.9	0	0	112.4	S495 N498 L515	S495-Q517 PolarHBondContact N-O 3.14Å; N498-Q517 VanDerWaalsContact CB-OE1 3.27Å; N498-Q517 PolarHBondContact ND2-OE1 3.25Å; L515-Q517 PolarHBondContact O-N 2.97Å
518	V	78.6	Confident	65.1	Low	81 Å²	81	54.7 Å²	54.7	49%	0.491	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	134.9	168.8	-179.6	0	0	0	0	109.7	I493 R494 D516	I493-V518 CarbonylContact O-C 3.58Å; I493-V518 WeakPolarHBondContact O-CA 3.1Å; I493-V518 WeakPolarHBondContact O-CG1 3.44Å; R494-V518 HydrophobicContact CG-CG2 4.19Å; D516-V518 PolarHBondContact O-N 3.19Å
519	V	83.7	Confident	68.2	Low	39 Å²	39	50.8 Å²	50.8	24%	0.236	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	149.8	-179.6	-166.1	0	0	0	0	110	S470 I493 F521	S470-V519 PolarHBondContact OG-O 3.39Å; I493-V519 PolarHBondContact O-N 2.87Å; V519-F521 VanDerWaalsContact CG1-O 3.26Å; V519-F521 WeakPolarHBondContact CG1-O 3.36Å
520	K	84.2	Confident	71.1	Confident	103 Å²	103	44 Å²	44	45%	0.448	25%	0.25	S	S	.	.	S	Bend	trans	-75.4	-32.4	-178.7	-61	-179.7	-176.7	177.8	0	112.8	S469 S470 V472	S469-K520 WeakPolarHBondContact CA-O 3.48Å; S469-K520 PolarHBondContact OG-O 2.84Å; S470-K520 PolarHBondContact N-O 3.05Å; S470-K520 VanDerWaalsContact N-O 3.16Å; S470-K520 PolarHBondContact OG-O 2.94Å; V472-K520 HydrophobicContact CB-CB 4.29Å; V472-K520 HydrophobicContact CB-CD 4.25Å; V472-K520 HydrophobicContact CB-CG 4.01Å; V472-K520 HydrophobicContact CG1-CD 3.8Å; V472-K520 HydrophobicContact CG1-CG 4.02Å; V472-K520 HydrophobicContact CG2-CG 4.43Å
521	F	86.4	Confident	74	Confident	15 Å²	15	38 Å²	38	7%	0.066	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	163.6	-172.7	-47.6	-64	0	0	0	110.6	L189 E192 I468 S469 I474 V519 F523	L189-F521 HydrophobicContact CD2-CD1 3.88Å; L189-F521 HydrophobicContact CD2-CE1 4.36Å; E192-F521 HydrophobicContact CG-CD2 4.14Å; E192-F521 HydrophobicContact CG-CE2 3.66Å; E192-F521 HydrophobicContact CG-CZ 4.13Å; I468-F521 VanDerWaalsContact O-CA 3.23Å; I468-F521 WeakPolarHBondContact O-CA 3.31Å; S469-F521 VanDerWaalsContact OG-CE1 3.32Å; S469-F521 WeakPolarHBondContact OG-CE1 3.38Å; I474-F521 HydrophobicContact CB-CE1 4.12Å; I474-F521 HydrophobicContact CD1-CD1 4.49Å; I474-F521 HydrophobicContact CD1-CE1 3.72Å; I474-F521 HydrophobicContact CD1-CZ 4.08Å; I474-F521 HydrophobicContact CG1-CE1 4.02Å; I474-F521 HydrophobicContact CG1-CZ 4.33Å; V519-F521 VanDerWaalsContact CG1-O 3.26Å; V519-F521 WeakPolarHBondContact CG1-O 3.36Å; F521-F523 HydrophobicContact CB-CE1 4.26Å; F521-F523 HydrophobicContact CB-CE2 4.01Å; F521-F523 HydrophobicContact CB-CZ 3.68Å; F521-F523 HydrophobicContact CD2-CZ 4.49Å; F521-F523 HydrophobicContact CG-CZ 4.29Å
522	A	88.3	Confident	77.1	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	147.5	162.7	0	0	0	0	0	109.8	V463 A467 I468 I493 V528	V463-A522 HydrophobicContact CG2-CB 4.19Å; A467-A522 CarbonylContact C-O 3.55Å; A467-A522 WeakPolarHBondContact CA-O 3.22Å; A467-A522 WeakPolarHBondContact CB-O 3.16Å; I468-A522 HydrophobicContact CD1-CB 4.32Å; I468-A522 HydrophobicContact CG1-CB 4.05Å; I468-A522 PolarHBondContact N-O 2.82Å; I468-A522 PolarHBondContact O-N 3.24Å; I468-A522 VanDerWaalsContact O-N 3.09Å; I493-A522 HydrophobicContact CD1-CB 4.45Å; I493-A522 HydrophobicContact CG2-CB 4.01Å; A522-V528 HydrophobicContact CB-CG1 3.83Å; A522-V528 HydrophobicContact CB-CG2 4.21Å
523	F	89.8	Confident	79.9	Confident	13 Å²	13	35 Å²	35	6%	0.057	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	163.7	-169.5	-52.8	-75.4	0	0	0	111.9	Y193 L196 V437 V463 A467 F521 G525 D526	Y193-F523 HydrophobicContact CD2-CB 3.95Å; Y193-F523 AromaticContact CD2-CD1 3.55Å; Y193-F523 HydrophobicContact CD2-CD1 3.55Å; Y193-F523 AromaticContact CD2-CD2 3.92Å; Y193-F523 HydrophobicContact CD2-CD2 3.92Å; Y193-F523 AromaticContact CD2-CE1 3.96Å; Y193-F523 HydrophobicContact CD2-CE1 3.96Å; Y193-F523 HydrophobicContact CD2-CE2 4.28Å; Y193-F523 AromaticContact CD2-CG 3.53Å; Y193-F523 HydrophobicContact CD2-CG 3.53Å; Y193-F523 HydrophobicContact CD2-CZ 4.29Å; Y193-F523 HydrophobicContact CE2-CB 4.02Å; Y193-F523 HydrophobicContact CE2-CD1 4.45Å; Y193-F523 HydrophobicContact CE2-CD2 4.47Å; Y193-F523 HydrophobicContact CE2-CG 4.09Å; Y193-F523 HydrophobicContact CG-CD1 4.14Å; Y193-F523 HydrophobicContact CG-CE1 4.29Å; L196-F523 HydrophobicContact CD1-CE2 3.83Å; L196-F523 HydrophobicContact CD1-CZ 3.91Å; V437-F523 HydrophobicContact CG1-CD1 3.97Å; V437-F523 HydrophobicContact CG2-CB 4.35Å; V463-F523 WeakPolarHBondContact CB-O 3.39Å; A467-F523 HydrophobicContact CB-CD1 3.66Å; A467-F523 HydrophobicContact CB-CE1 4.18Å; F521-F523 HydrophobicContact CB-CE1 4.26Å; F521-F523 HydrophobicContact CB-CE2 4.01Å; F521-F523 HydrophobicContact CB-CZ 3.68Å; F521-F523 HydrophobicContact CD2-CZ 4.49Å; F521-F523 HydrophobicContact CG-CZ 4.29Å; F523-G525 PolarHBondContact O-N 3.17Å; F523-G525 VanDerWaalsContact O-N 3.15Å; F523-D526 PolarHBondContact N-OD2 2.93Å; F523-D526 WeakPolarHBondContact O-CB 3.5Å; F523-D526 VanDerWaalsContact O-CG 3.22Å; F523-D526 PolarHBondContact O-N 3.18Å; F523-D526 VanDerWaalsContact O-N 3.09Å
524	S	91	Very high	81.9	Confident	6 Å²	6	37 Å²	37	4%	0.042	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.3	119.2	174.5	176.6	0	0	0	0	111.9	R435 T436 I464 G466	R435-S524 WeakPolarHBondContact CB-O 3.49Å; R435-S524 WeakPolarHBondContact CD-O 3.49Å; R435-S524 VanDerWaalsContact CG-O 3.24Å; R435-S524 WeakPolarHBondContact CG-O 3.39Å; R435-S524 PolarHBondContact NE-O 2.77Å; T436-S524 PolarHBondContact N-OG 3.09Å; T436-S524 VanDerWaalsContact N-OG 3.08Å; I464-S524 PolarHBondContact O-OG 3.17Å; G466-S524 PolarHBondContact O-N 2.89Å
525	G	88.5	Confident	84	Confident	2 Å²	2	34.6 Å²	34.6	2%	0.021	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	120.8	-42.2	-175	0	0	0	0	0	113.3	N207 R435 R462 V463 F523	N207-G525 PolarHBondContact ND2-O 3.41Å; N207-G525 VanDerWaalsContact ND2-O 3.14Å; R435-G525 VanDerWaalsContact CZ-CA 3.42Å; R462-G525 PolarHBondContact NE-O 2.93Å; V463-G525 PolarHBondContact O-N 2.98Å; F523-G525 PolarHBondContact O-N 3.17Å; F523-G525 VanDerWaalsContact O-N 3.15Å
526	D	89.4	Confident	85.9	Confident	25 Å²	25	35.7 Å²	35.7	13%	0.134	19%	0.187	C	C	.	.			trans	-67.3	143.9	-163	-59	-15.8	0	0	0	113.6	I205 R462 V463 F523 V528	I205-D526 VanDerWaalsContact CD1-OD1 3.31Å; I205-D526 WeakPolarHBondContact CD1-OD1 3.23Å; R462-D526 WeakPolarHBondContact CA-O 3.3Å; V463-D526 PolarHBondContact N-O 3.07Å; F523-D526 PolarHBondContact N-OD2 2.93Å; F523-D526 WeakPolarHBondContact O-CB 3.5Å; F523-D526 VanDerWaalsContact O-CG 3.22Å; F523-D526 PolarHBondContact O-N 3.18Å; F523-D526 VanDerWaalsContact O-N 3.09Å; D526-V528 HydrophobicContact CB-CG1 4.12Å
527	Q	90.2	Very high	87.6	Confident	3 Å²	3	32.4 Å²	32.4	1%	0.014	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	116.5	168.2	-59.6	-78.9	41.4	0	0	109	G461 R462 L496	G461-Q527 PolarHBondContact O-OE1 2.86Å; R462-Q527 VanDerWaalsContact CA-OE1 3.3Å; L496-Q527 HydrophobicContact CB-CB 4.15Å; L496-Q527 HydrophobicContact CD1-CB 4.21Å; L496-Q527 PolarHBondContact N-O 2.82Å
528	V	91.7	Very high	88.6	Confident	4 Å²	4	32.2 Å²	32.2	2%	0.024	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	148.5	-174.4	-62.9	0	0	0	0	112.3	F443 G461 V463 I493 R494 A522 D526 L530	F443-V528 HydrophobicContact CD2-CG2 4.39Å; F443-V528 HydrophobicContact CE2-CG2 3.74Å; G461-V528 PolarHBondContact N-O 2.75Å; G461-V528 VanDerWaalsContact N-O 3.08Å; G461-V528 PolarHBondContact O-N 2.61Å; V463-V528 HydrophobicContact CG2-CG2 4.19Å; I493-V528 HydrophobicContact CG2-CB 3.98Å; I493-V528 HydrophobicContact CG2-CG1 3.96Å; I493-V528 HydrophobicContact CG2-CG2 4.35Å; R494-V528 CarbonylContact O-C 3.59Å; R494-V528 VanDerWaalsContact O-CA 3.28Å; R494-V528 WeakPolarHBondContact O-CA 3.46Å; R494-V528 WeakPolarHBondContact O-CB 3.47Å; A522-V528 HydrophobicContact CB-CG1 3.83Å; A522-V528 HydrophobicContact CB-CG2 4.21Å; D526-V528 HydrophobicContact CB-CG1 4.12Å; V528-L530 HydrophobicContact CB-CD2 4.46Å; V528-L530 HydrophobicContact CG2-CD2 3.72Å; V528-L530 HydrophobicContact CG2-CG 4.24Å
529	A	92.2	Very high	89.1	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	123.8	166.4	0	0	0	0	0	109.4	F449 M458 V459 R494	F449-A529 HydrophobicContact CZ-CB 4Å; M458-A529 HydrophobicContact CB-CB 4.42Å; M458-A529 VanDerWaalsContact CE-C 3.46Å; M458-A529 HydrophobicContact CE-CB 3.81Å; M458-A529 WeakPolarHBondContact CE-O 3.42Å; M458-A529 HydrophobicContact SD-CB 4.48Å; V459-A529 WeakPolarHBondContact O-CA 3.42Å; R494-A529 HydrophobicContact CB-CB 4.41Å; R494-A529 PolarHBondContact N-O 2.81Å; R494-A529 PolarHBondContact O-N 3.5Å
530	L	92.6	Very high	89.3	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	130.6	-179.3	-55.8	-177.4	0	0	0	110.6	F443 M458 V459 I468 V490 I493 V528 L532 L547	F443-L530 HydrophobicContact CD1-CD1 4.17Å; F443-L530 HydrophobicContact CD2-CD1 4.09Å; F443-L530 HydrophobicContact CE1-CD1 3.91Å; F443-L530 HydrophobicContact CE2-CD1 3.83Å; F443-L530 HydrophobicContact CE2-CG 4.1Å; F443-L530 HydrophobicContact CG-CD1 4.24Å; F443-L530 HydrophobicContact CZ-CD1 3.71Å; F443-L530 HydrophobicContact CZ-CG 3.94Å; M458-L530 WeakPolarHBondContact CA-O 3.41Å; V459-L530 PolarHBondContact N-O 2.81Å; V459-L530 PolarHBondContact O-N 2.76Å; I468-L530 HydrophobicContact CD1-CD1 4.03Å; I468-L530 HydrophobicContact CD1-CD2 3.54Å; I468-L530 HydrophobicContact CD1-CG 4.46Å; V490-L530 HydrophobicContact CG1-CD2 4.19Å; I493-L530 HydrophobicContact CB-CD2 4.36Å; I493-L530 HydrophobicContact CG1-CD2 3.89Å; I493-L530 HydrophobicContact CG2-CD2 4.18Å; V528-L530 HydrophobicContact CB-CD2 4.46Å; V528-L530 HydrophobicContact CG2-CD2 3.72Å; V528-L530 HydrophobicContact CG2-CG 4.24Å; L530-L532 HydrophobicContact CB-CD2 4.19Å; L530-L547 HydrophobicContact CD1-CD1 3.96Å
531	M	92	Very high	89.6	Confident	17 Å²	17	29.9 Å²	29.9	8%	0.084	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	116.7	164.9	-174.8	174.3	-72.3	0	0	108.3	V456 M458 K491 S492	V456-M531 HydrophobicContact CB-CE 4Å; V456-M531 HydrophobicContact CB-SD 4.3Å; V456-M531 HydrophobicContact CG1-CE 4.06Å; V456-M531 HydrophobicContact CG1-CG 3.73Å; V456-M531 HydrophobicContact CG1-SD 3.91Å; M458-M531 HydrophobicContact CE-CB 3.99Å; M458-M531 HydrophobicContact CG-CB 4.4Å; M458-M531 HydrophobicContact CG-CE 4.28Å; M458-M531 HydrophobicContact SD-CE 4.3Å; K491-M531 HydrophobicContact CB-CB 4.46Å; K491-M531 HydrophobicContact CB-CG 4.25Å; K491-M531 HydrophobicContact CD-SD 3.98Å; K491-M531 HydrophobicContact CG-SD 4.4Å; K491-M531 PolarHBondContact N-O 3.43Å; S492-M531 PolarHBondContact O-N 3.33Å; S492-M531 VanDerWaalsContact OG-CB 3.3Å; S492-M531 WeakPolarHBondContact OG-CB 3.49Å
532	L	91.7	Very high	89.8	Confident	9 Å²	9	32.1 Å²	32.1	5%	0.047	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	151.5	-177.8	-59.3	178.3	0	0	0	110.4	V459 V479 T488 C489 V490 L530 I535 L541 L547	V459-L532 HydrophobicContact CB-CD1 4.38Å; V459-L532 HydrophobicContact CG2-CD1 3.76Å; V459-L532 HydrophobicContact CG2-CG 4.41Å; V479-L532 HydrophobicContact CG2-CD2 4.42Å; T488-L532 HydrophobicContact CG2-CB 4.47Å; T488-L532 HydrophobicContact CG2-CD1 4.3Å; T488-L532 HydrophobicContact CG2-CD2 4.23Å; C489-L532 WeakPolarHBondContact O-CA 3.12Å; V490-L532 HydrophobicContact CG2-CD2 4.13Å; L530-L532 HydrophobicContact CB-CD2 4.19Å; L532-I535 HydrophobicContact CB-CD1 4.16Å; L532-I535 HydrophobicContact CB-CG1 4.18Å; L532-I535 HydrophobicContact CD1-CD1 3.87Å; L532-L541 HydrophobicContact CD1-CD1 4.19Å; L532-L547 HydrophobicContact CD1-CD1 4.04Å; L532-L547 HydrophobicContact CD2-CD1 4.43Å
533	T	90.2	Very high	89.9	Confident	34 Å²	34	34.4 Å²	34.4	21%	0.209	18%	0.179	C	C	.	.	S	Bend	trans	-97.8	162.7	174.6	61.7	0	0	0	0	111.7	T488 C489 K491 I535	T488-T533 WeakPolarHBondContact CB-O 3.19Å; T488-T533 PolarHBondContact OG1-N 3.43Å; T488-T533 PolarHBondContact OG1-O 2.77Å; C489-T533 WeakPolarHBondContact CB-OG1 3.37Å; C489-T533 PolarHBondContact N-OG1 3.45Å; C489-T533 PolarHBondContact O-N 2.97Å; C489-T533 PolarHBondContact O-OG1 3.34Å; K491-T533 HydrophobicContact CB-CG2 3.81Å; K491-T533 HydrophobicContact CD-CG2 4.41Å; T533-I535 PolarHBondContact O-N 2.89Å
534	D	86.2	Confident	89.9	Confident	141 Å²	141	33.9 Å²	33.9	75%	0.754	18%	0.177	S	C	*	.	S	Bend	trans	63.9	6	162.7	-38.2	-51.6	0	0	0	116.5
535	I	88.9	Confident	90	Very high	31 Å²	31	34.4 Å²	34.4	16%	0.159	18%	0.179	C	C	.	.	S	Bend	trans	-137.3	157.6	178.4	68.2	170.6	0	0	0	111	V486 T488 L532 T533 P537 T540 L541	V486-I535 HydrophobicContact CG1-CG2 3.47Å; V486-I535 VanDerWaalsContact CG1-CG2 3.47Å; T488-I535 HydrophobicContact CG2-CD1 4.16Å; L532-I535 HydrophobicContact CB-CD1 4.16Å; L532-I535 HydrophobicContact CB-CG1 4.18Å; L532-I535 HydrophobicContact CD1-CD1 3.87Å; T533-I535 PolarHBondContact O-N 2.89Å; I535-P537 HydrophobicContact CG1-CG 4.47Å; I535-P537 WeakPolarHBondContact O-CD 3.48Å; I535-T540 HydrophobicContact CD1-CG2 4.43Å; I535-L541 HydrophobicContact CD1-CD1 4.46Å
536	D	89.8	Confident	90.2	Very high	52 Å²	52	34.4 Å²	34.4	28%	0.278	18%	0.178	S	C	.	.			trans	-99.9	107.4	156.8	-176.4	3.3	0	0	0	109.4	F538 Q539 T540	D536-F538 PolarHBondContact O-N 2.85Å; D536-F538 PolarHBondContact OD1-N 2.95Å; D536-Q539 HydrophobicContact CB-CB 4.48Å; D536-Q539 HydrophobicContact CB-CG 4.43Å; D536-Q539 PolarHBondContact O-N 2.85Å; D536-Q539 VanDerWaalsContact O-N 3.09Å; D536-T540 VanDerWaalsContact O-CB 3.29Å; D536-T540 WeakPolarHBondContact O-CB 3.35Å; D536-T540 PolarHBondContact O-N 3.06Å; D536-T540 PolarHBondContact O-OG1 3.07Å
537	P	86.9	Confident	90.5	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.019	17%	0.172	C	C	.	.	H	α-helix	trans	-47	-39.5	172.1	-31.7	37.6	0	0	0	114.8	I448 P457 V459 I535 Q539 T540 L541	I448-P537 HydrophobicContact CD1-CB 4.36Å; I448-P537 HydrophobicContact CG2-CB 3.66Å; P457-P537 HydrophobicContact CB-CG 4.37Å; P457-P537 HydrophobicContact CG-CG 3.93Å; V459-P537 HydrophobicContact CG2-CB 3.64Å; V459-P537 HydrophobicContact CG2-CG 3.69Å; I535-P537 HydrophobicContact CG1-CG 4.47Å; I535-P537 WeakPolarHBondContact O-CD 3.48Å; P537-Q539 PolarHBondContact O-N 3.03Å; P537-T540 PolarHBondContact O-N 3.5Å; P537-L541 HydrophobicContact CB-CD1 4.43Å; P537-L541 PolarHBondContact O-N 2.88Å
538	F	89	Confident	90.6	Very high	99 Å²	99	33.1 Å²	33.1	43%	0.434	17%	0.172	S	C	.	.	H	α-helix	trans	-66	-24.7	-177.7	-80.6	-81.1	0	0	0	113.5	I448 K450 P457 D536	I448-F538 HydrophobicContact CB-CE1 4.47Å; I448-F538 HydrophobicContact CB-CZ 4.48Å; I448-F538 HydrophobicContact CG2-CD1 4.31Å; I448-F538 HydrophobicContact CG2-CD2 3.97Å; I448-F538 HydrophobicContact CG2-CE1 4.14Å; I448-F538 HydrophobicContact CG2-CE2 3.78Å; I448-F538 HydrophobicContact CG2-CG 4.23Å; I448-F538 HydrophobicContact CG2-CZ 3.89Å; I448-F538 WeakPolarHBondContact O-CE1 3.47Å; I448-F538 WeakPolarHBondContact O-CZ 3.39Å; K450-F538 HydrophobicContact CD-CE2 4.14Å; K450-F538 HydrophobicContact CG-CE2 3.62Å; K450-F538 HydrophobicContact CG-CZ 4.18Å; P457-F538 HydrophobicContact CB-CD2 3.82Å; P457-F538 HydrophobicContact CB-CE2 3.64Å; P457-F538 HydrophobicContact CG-CD2 4.45Å; D536-F538 PolarHBondContact O-N 2.85Å; D536-F538 PolarHBondContact OD1-N 2.95Å
539	Q	88.3	Confident	90.6	Very high	147 Å²	147	33.2 Å²	33.2	69%	0.687	17%	0.172	S	C	*	.	H	α-helix	trans	-97.3	-24	175.5	-60.8	-174.3	7.3	0	0	112.7	R166 D536 P537	R166-Q539 PolarHBondContact NH2-O 3.11Å; D536-Q539 HydrophobicContact CB-CB 4.48Å; D536-Q539 HydrophobicContact CB-CG 4.43Å; D536-Q539 PolarHBondContact O-N 2.85Å; D536-Q539 VanDerWaalsContact O-N 3.09Å; P537-Q539 PolarHBondContact O-N 3.03Å
540	T	88.1	Confident	90.4	Very high	22 Å²	22	34.4 Å²	34.4	14%	0.135	18%	0.18	C	C	.	.	H	α-helix	trans	-100.5	-29.8	-167.2	-49.4	0	0	0	0	113.9	S484 V486 I535 D536 P537	S484-T540 PolarHBondContact OG-O 2.84Å; V486-T540 HydrophobicContact CB-CG2 4.11Å; V486-T540 HydrophobicContact CG2-CG2 3.87Å; I535-T540 HydrophobicContact CD1-CG2 4.43Å; D536-T540 VanDerWaalsContact O-CB 3.29Å; D536-T540 WeakPolarHBondContact O-CB 3.35Å; D536-T540 PolarHBondContact O-N 3.06Å; D536-T540 PolarHBondContact O-OG1 3.07Å; P537-T540 PolarHBondContact O-N 3.5Å
541	L	90.8	Very high	90.1	Very high	5 Å²	5	36.8 Å²	36.8	3%	0.026	19%	0.192	C	C	.	.			trans	-129.5	155	-169.2	-69.9	167.8	0	0	0	111.6	I448 V459 C481 L532 I535 P537 D545 L547	I448-L541 HydrophobicContact CD1-CB 3.66Å; I448-L541 WeakPolarHBondContact CD1-O 3.46Å; V459-L541 HydrophobicContact CG1-CD1 4.3Å; V459-L541 HydrophobicContact CG2-CD1 3.98Å; C481-L541 HydrophobicContact CB-CD2 3.85Å; L532-L541 HydrophobicContact CD1-CD1 4.19Å; I535-L541 HydrophobicContact CD1-CD1 4.46Å; P537-L541 HydrophobicContact CB-CD1 4.43Å; P537-L541 PolarHBondContact O-N 2.88Å; L541-D545 HydrophobicContact CD2-CB 4.05Å; L541-L547 HydrophobicContact CD1-CD2 4.17Å; L541-L547 HydrophobicContact CD2-CD2 4.07Å
542	I	90.9	Very high	89.9	Confident	62 Å²	62	39 Å²	39	32%	0.318	20%	0.204	S	C	.	.			trans	-131.7	147.7	173	-59.1	-179.8	0	0	0	108	G544 D545	I542-G544 PolarHBondContact O-N 3.39Å; I542-D545 PolarHBondContact N-OD2 3.36Å; I542-D545 WeakPolarHBondContact O-CB 3.46Å; I542-D545 PolarHBondContact O-N 3.21Å
543	P	90.1	Very high	89.7	Confident	48 Å²	48	40.5 Å²	40.5	31%	0.312	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-43.3	132.6	165.4	-33.3	38.5	0	0	0	113.1	S446 A586	S446-P543 WeakPolarHBondContact O-CB 3.38Å; P543-A586 WeakPolarHBondContact O-CB 3.38Å
544	G	89.2	Confident	89.7	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.01	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.4	-9.4	-174.3	0	0	0	0	0	116.4	V445 I542 N584	V445-G544 WeakPolarHBondContact O-CA 3.26Å; V445-G544 PolarHBondContact O-N 3.35Å; I542-G544 PolarHBondContact O-N 3.39Å; G544-N584 PolarHBondContact O-ND2 2.83Å
545	D	93.1	Very high	89.8	Confident	17 Å²	17	38.5 Å²	38.5	9%	0.091	20%	0.199	C	C	.	.			trans	-64.9	165.4	167.2	-73.6	-18.2	0	0	0	111.6	V445 L482 P483 L541 I542	V445-D545 PolarHBondContact N-O 2.96Å; L482-D545 WeakPolarHBondContact O-CB 3.17Å; P483-D545 WeakPolarHBondContact CD-OD1 3.39Å; L541-D545 HydrophobicContact CD2-CB 4.05Å; I542-D545 PolarHBondContact N-OD2 3.36Å; I542-D545 WeakPolarHBondContact O-CB 3.46Å; I542-D545 PolarHBondContact O-N 3.21Å
546	L	93.9	Very high	89.9	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137.5	-172.8	-61.3	-176.3	0	0	0	112.1	F443 V444 L482 I554 C632 L642	F443-L546 WeakPolarHBondContact O-CA 3.49Å; V444-L546 HydrophobicContact CB-CD2 4.35Å; V444-L546 HydrophobicContact CG2-CD2 3.6Å; L482-L546 PolarHBondContact N-O 3.27Å; L482-L546 PolarHBondContact O-N 2.98Å; L546-I554 HydrophobicContact CD1-CD1 3.57Å; L546-C632 HydrophobicContact CD1-CB 3.92Å; L546-C632 WeakPolarHBondContact CD1-O 3.3Å; L546-C632 HydrophobicContact CG-CB 4.46Å; L546-L642 HydrophobicContact CD1-CD1 4.1Å; L546-L642 HydrophobicContact CD1-CD2 4.33Å; L546-L642 HydrophobicContact CD2-CD2 3.89Å
547	L	94.1	Very high	89.9	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	130.8	161.8	-50.9	-177.8	0	0	0	108.6	F441 F443 V445 I480 C481 L530 L532 L541	F441-L547 HydrophobicContact CE1-CB 4.22Å; F443-L547 HydrophobicContact CB-CB 4.27Å; F443-L547 HydrophobicContact CD1-CB 4.13Å; F443-L547 HydrophobicContact CD1-CD1 3.67Å; F443-L547 HydrophobicContact CD1-CG 3.85Å; F443-L547 HydrophobicContact CE1-CD1 3.91Å; F443-L547 HydrophobicContact CE1-CG 4.42Å; F443-L547 PolarHBondContact N-O 3.2Å; F443-L547 PolarHBondContact O-N 3.01Å; V445-L547 HydrophobicContact CG2-CG 4.45Å; I480-L547 WeakPolarHBondContact O-CA 3.42Å; C481-L547 HydrophobicContact CB-CD2 4.11Å; C481-L547 WeakPolarHBondContact SG-CD2 3.47Å; L530-L547 HydrophobicContact CD1-CD1 3.96Å; L532-L547 HydrophobicContact CD1-CD1 4.04Å; L532-L547 HydrophobicContact CD2-CD1 4.43Å; L541-L547 HydrophobicContact CD1-CD2 4.17Å; L541-L547 HydrophobicContact CD2-CD2 4.07Å
548	T	93.3	Very high	90.2	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	170.3	178.9	66.7	0	0	0	0	112.6	F441 R442 V479 I480 L482 I554	F441-T548 VanDerWaalsContact O-CA 3.3Å; F441-T548 WeakPolarHBondContact O-CA 3.13Å; R442-T548 HydrophobicContact CG-CG2 4.48Å; V479-T548 CarbonylContact C-O 3.58Å; V479-T548 VanDerWaalsContact CA-O 3.3Å; V479-T548 WeakPolarHBondContact CA-O 3.24Å; I480-T548 WeakPolarHBondContact CG2-OG1 3.34Å; I480-T548 PolarHBondContact N-O 3.1Å; I480-T548 PolarHBondContact O-N 2.92Å; L482-T548 HydrophobicContact CD1-CG2 3.96Å; L482-T548 WeakPolarHBondContact CD1-OG1 3.27Å; T548-I554 HydrophobicContact CG2-CD1 3.77Å; T548-I554 HydrophobicContact CG2-CG1 4.09Å
549	D	90.6	Very high	90.5	Very high	7 Å²	7	35.6 Å²	35.6	4%	0.037	19%	0.194	C	C	.	.			trans	-61.2	140.2	165	-73.3	-45.1	0	0	0	111	R186 F441 D551 N552	R186-D549 IonicContact CZ-OD2 2.83Å; R186-D549 VanDerWaalsContact CZ-OD2 3.28Å; R186-D549 IonicContact NE-OD2 3.02Å; R186-D549 PolarHBondContact NE-OD2 3.29Å; R186-D549 IonicContact NH2-OD2 2.74Å; R186-D549 PolarHBondContact NH2-OD2 2.92Å; F441-D549 WeakPolarHBondContact CB-OD2 3.12Å; F441-D549 PolarHBondContact N-OD2 2.86Å; F441-D549 PolarHBondContact O-N 3.06Å; D549-D551 PolarHBondContact O-N 3.14Å; D549-N552 CarbonylContact O-C 3.51Å; D549-N552 PolarHBondContact O-N 2.61Å
550	P	89.4	Confident	90.8	Very high	24 Å²	24	28.6 Å²	28.6	16%	0.156	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-15.6	175.6	29	-36.7	0	0	0	113.5	I184 K478	I184-P550 HydrophobicContact CD1-CG 3.96Å; K478-P550 VanDerWaalsContact O-CD 3.23Å; K478-P550 WeakPolarHBondContact O-CD 3.43Å
551	D	86.7	Confident	91.2	Very high	50 Å²	50	28 Å²	28	27%	0.267	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-23.7	176.5	-58.9	-5.7	0	0	0	112.9	P180 P183 I184 D549	P180-D551 WeakPolarHBondContact CG-OD1 3.32Å; P183-D551 WeakPolarHBondContact CA-OD2 3.36Å; I184-D551 WeakPolarHBondContact CG1-OD2 3.46Å; I184-D551 PolarHBondContact N-OD2 3.48Å; D549-D551 PolarHBondContact O-N 3.14Å
552	N	86.2	Confident	91.4	Very high	63 Å²	63	27.8 Å²	27.8	34%	0.337	16%	0.157	S	C	.	.	S	Bend	trans	-140.2	56	-171.5	-164.4	-10.9	0	0	0	111.5	P440 D549 I554 K638	P440-N552 HydrophobicContact CB-CB 4.28Å; P440-N552 WeakPolarHBondContact CB-ND2 3.38Å; D549-N552 CarbonylContact O-C 3.51Å; D549-N552 PolarHBondContact O-N 2.61Å; N552-I554 PolarHBondContact O-N 2.91Å; N552-K638 PolarHBondContact OD1-NZ 2.61Å
553	P	87.6	Confident	91.6	Very high	41 Å²	41	27 Å²	27	27%	0.266	15%	0.152	S	C	.	.	P	Polyproline II helix	trans	-68.4	130.8	-177.7	28.9	-35.1	0	0	0	111.6	I480 L482 Q555	I480-P553 HydrophobicContact CG2-CB 4.29Å; L482-P553 HydrophobicContact CD1-CB 4.2Å; L482-P553 HydrophobicContact CD2-CB 4.47Å; P553-Q555 PolarHBondContact O-N 2.93Å; P553-Q555 PolarHBondContact O-NE2 2.82Å
554	I	91.1	Very high	91.8	Very high	7 Å²	7	24.8 Å²	24.8	4%	0.036	14%	0.137	C	C	.	.	P	Polyproline II helix	trans	-68	122	175	-65.5	167.9	0	0	0	108.7	R442 L482 L546 T548 N552 C632 E634 L642	R442-I554 HydrophobicContact CG-CD1 4.46Å; L482-I554 HydrophobicContact CD1-CB 4.04Å; L546-I554 HydrophobicContact CD1-CD1 3.57Å; T548-I554 HydrophobicContact CG2-CD1 3.77Å; T548-I554 HydrophobicContact CG2-CG1 4.09Å; N552-I554 PolarHBondContact O-N 2.91Å; I554-C632 HydrophobicContact CB-CB 4.48Å; I554-C632 HydrophobicContact CG2-CB 3.88Å; I554-E634 HydrophobicContact CD1-CG 3.86Å; I554-E634 HydrophobicContact CG1-CG 3.94Å; I554-E634 WeakPolarHBondContact CG1-OE1 3.45Å; I554-E634 HydrophobicContact CG2-CG 4.29Å; I554-L642 HydrophobicContact CD1-CD1 3.89Å
555	Q	87.6	Confident	91.9	Very high	126 Å²	126	24.8 Å²	24.8	59%	0.589	14%	0.137	S	C	*	.	P	Polyproline II helix	trans	-71.8	125.6	-177.8	-62.5	-60.8	-69.2	0	0	110.7	P553	P553-Q555 PolarHBondContact O-N 2.93Å; P553-Q555 PolarHBondContact O-NE2 2.82Å
556	P	90.9	Very high	91.9	Very high	59 Å²	59	24 Å²	24	38%	0.383	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	141.7	174.9	26.8	-33.4	0	0	0	110.5	P483 P630	P483-P556 HydrophobicContact CB-CB 4.42Å; P556-P630 HydrophobicContact CB-CB 4.43Å
557	S	90.7	Very high	91.7	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.014	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	144.9	-177.4	69.2	0	0	0	0	112.2	I631	S557-I631 PolarHBondContact N-O 3.44Å; S557-I631 PolarHBondContact O-N 2.85Å
558	T	92.7	Very high	91.2	Very high	44 Å²	44	28.5 Å²	28.5	27%	0.27	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-4.5	172.6	53.8	0	0	0	0	112.6	T626 F627 P630	T558-T626 CarbonylContact O-C 3.15Å; T558-T626 VanDerWaalsContact O-CA 3.3Å; T558-T626 WeakPolarHBondContact O-CA 3.39Å; T558-T626 WeakPolarHBondContact O-CG2 3.46Å; T558-F627 PolarHBondContact O-N 3.36Å; T558-P630 HydrophobicContact CG2-CB 3.9Å
559	C	94.4	Very high	90.7	Very high	19 Å²	19	30 Å²	30	13%	0.128	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	134.4	-176.1	-168.3	0	0	0	0	111.3	L625 I663	C559-L625 WeakPolarHBondContact CA-O 3.41Å; C559-L625 PolarHBondContact SG-O 3.03Å; C559-I663 HydrophobicContact CB-CB 4.15Å; C559-I663 HydrophobicContact CB-CG2 4.43Å; C559-I663 WeakPolarHBondContact O-CB 3.44Å; C559-I663 PolarHBondContact O-N 3.45Å
560	I	95.4	Very high	90.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	154.9	177.4	61.5	164.9	0	0	0	111.3	A562 Y581 E624 L625 F627 V659	I560-A562 HydrophobicContact CD1-CB 4.43Å; I560-Y581 HydrophobicContact CD1-CE2 4.14Å; I560-E624 CarbonylContact O-C 3.58Å; I560-E624 VanDerWaalsContact O-CA 3.24Å; I560-E624 WeakPolarHBondContact O-CA 3.33Å; I560-L625 HydrophobicContact CD1-CD1 4.17Å; I560-L625 HydrophobicContact CG1-CB 3.94Å; I560-L625 HydrophobicContact CG1-CD1 4.4Å; I560-L625 PolarHBondContact N-O 3.47Å; I560-L625 PolarHBondContact O-N 3.48Å; I560-F627 HydrophobicContact CD1-CE2 4.25Å; I560-F627 HydrophobicContact CD1-CZ 3.68Å; I560-F627 HydrophobicContact CG1-CE2 3.97Å; I560-F627 HydrophobicContact CG1-CZ 3.73Å; I560-F627 HydrophobicContact CG2-CE2 4.02Å; I560-V659 HydrophobicContact CB-CG1 4.33Å; I560-V659 HydrophobicContact CD1-CG1 4.29Å; I560-V659 HydrophobicContact CD1-CG2 3.76Å; I560-V659 HydrophobicContact CG2-CG1 4.37Å
561	S	95.8	Very high	90.4	Very high	10 Å²	10	43.2 Å²	43.2	7%	0.07	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	135.8	160.9	-165.7	0	0	0	0	109.2	K596 V623 T660 K661	S561-K596 PolarHBondContact OG-NZ 3.32Å; S561-V623 WeakPolarHBondContact CA-O 3.21Å; S561-V623 PolarHBondContact OG-O 2.81Å; S561-T660 PolarHBondContact O-N 2.86Å; S561-T660 PolarHBondContact O-OG1 3.15Å; S561-K661 PolarHBondContact N-O 3.38Å; S561-K661 PolarHBondContact O-N 3.14Å; S561-K661 VanDerWaalsContact O-N 3.09Å
562	A	96	Very high	90.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	154.9	-177.9	0	0	0	0	0	112.5	I560 N622 V623 F645 T658	I560-A562 HydrophobicContact CD1-CB 4.43Å; A562-N622 WeakPolarHBondContact O-CA 3.41Å; A562-V623 PolarHBondContact N-O 3.05Å; A562-V623 PolarHBondContact O-N 2.93Å; A562-F645 HydrophobicContact CB-CE1 3.62Å; A562-F645 HydrophobicContact CB-CZ 3.52Å; A562-T658 CarbonylContact C-O 3.45Å; A562-T658 VanDerWaalsContact CA-O 3.27Å; A562-T658 WeakPolarHBondContact CA-O 3.33Å; A562-T658 WeakPolarHBondContact CB-O 3.44Å
563	K	94.9	Very high	91	Very high	47 Å²	47	40.7 Å²	40.7	20%	0.204	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	118.6	165.4	179.5	177.1	174.3	176.1	0	107.7	E67 D68 G657 T658 T660	E67-K563 PolarHBondContact O-NZ 2.84Å; D68-K563 WeakPolarHBondContact OD1-CE 3.44Å; D68-K563 IonicContact OD1-NZ 3.86Å; D68-K563 PolarHBondContact OD1-NZ 3.01Å; K563-G657 CarbonylContact O-C 3.48Å; K563-G657 WeakPolarHBondContact O-CA 3.41Å; K563-T658 PolarHBondContact N-O 3.2Å; K563-T658 PolarHBondContact O-N 3.49Å; K563-T660 HydrophobicContact CB-CG2 4.04Å
564	L	94.3	Very high	91.4	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	149.9	172.7	-62	-175	0	0	0	110.9	T620 A621 V623 F645 L647 A655 G656	L564-T620 CarbonylContact O-C 3.55Å; L564-T620 VanDerWaalsContact O-CA 3.22Å; L564-T620 WeakPolarHBondContact O-CA 3.33Å; L564-A621 PolarHBondContact N-O 3.22Å; L564-A621 PolarHBondContact O-N 3.34Å; L564-V623 HydrophobicContact CD1-CG1 3.95Å; L564-V623 HydrophobicContact CD1-CG2 3.73Å; L564-V623 HydrophobicContact CG-CG1 4.41Å; L564-V623 HydrophobicContact CG-CG2 3.82Å; L564-F645 HydrophobicContact CD2-CE2 3.53Å; L564-F645 HydrophobicContact CD2-CZ 3.51Å; L564-L647 HydrophobicContact CD1-CD1 3.88Å; L564-L647 HydrophobicContact CD2-CD1 3.91Å; L564-A655 HydrophobicContact CB-CB 4.47Å; L564-A655 HydrophobicContact CD1-CB 4.46Å; L564-G656 WeakPolarHBondContact CA-O 3.36Å
565	L	92.3	Very high	91.5	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	111.6	155.9	176.1	71.8	0	0	0	107.9	L62 F64 F69 L340 F567 T620 A655 G656	L62-L565 HydrophobicContact CD1-CD1 3.82Å; F64-L565 HydrophobicContact CD1-CD2 3.95Å; F64-L565 HydrophobicContact CE1-CD2 3.65Å; F64-L565 HydrophobicContact CZ-CD2 4.07Å; F69-L565 HydrophobicContact CD2-CD2 4.43Å; F69-L565 HydrophobicContact CE2-CB 3.58Å; F69-L565 HydrophobicContact CE2-CD2 3.76Å; F69-L565 HydrophobicContact CE2-CG 4.28Å; F69-L565 HydrophobicContact CZ-CB 3.91Å; L340-L565 HydrophobicContact CD2-CD2 4.38Å; L565-F567 HydrophobicContact CD2-CE1 4.42Å; L565-F567 HydrophobicContact CG-CD1 4.5Å; L565-F567 HydrophobicContact CG-CE1 4.38Å; L565-F567 VanDerWaalsContact O-CD1 3.31Å; L565-F567 WeakPolarHBondContact O-CD1 3.48Å; L565-F567 WeakPolarHBondContact O-CE1 3.5Å; L565-T620 HydrophobicContact CB-CG2 4.32Å; L565-T620 HydrophobicContact CD1-CG2 3.47Å; L565-T620 VanDerWaalsContact CD1-CG2 3.47Å; L565-A655 WeakPolarHBondContact O-CA 3.48Å; L565-A655 VanDerWaalsContact O-CB 3.28Å; L565-A655 WeakPolarHBondContact O-CB 3.23Å; L565-G656 PolarHBondContact N-O 3.29Å; L565-G656 PolarHBondContact O-N 3.02Å
566	V	92.3	Very high	91.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	135.5	-179.9	-174.1	0	0	0	0	109.6	I569 I573 L615 N618 C619	V566-I569 HydrophobicContact CG1-CD1 3.52Å; V566-I569 HydrophobicContact CG1-CG1 4.21Å; V566-I573 HydrophobicContact CG1-CD1 3.85Å; V566-I573 HydrophobicContact CG2-CD1 3.98Å; V566-L615 HydrophobicContact CG2-CB 4.28Å; V566-L615 HydrophobicContact CG2-CD1 3.91Å; V566-N618 VanDerWaalsContact O-CA 3.23Å; V566-N618 WeakPolarHBondContact O-CA 3.3Å; V566-N618 PolarHBondContact O-N 3.11Å; V566-N618 VanDerWaalsContact O-N 3.11Å; V566-C619 PolarHBondContact N-O 2.8Å
567	F	88.7	Confident	92	Very high	8 Å²	8	43.4 Å²	43.4	4%	0.035	24%	0.236	C	C	.	.			trans	-89.5	-173	-175	-56.1	-9.4	0	0	0	111.4	R336 L340 L565 I569 G617 N618 M646 S653 I654 A655 G656	R336-F567 HydrophobicContact CG-CE2 4.36Å; R336-F567 HydrophobicContact CG-CZ 4.32Å; R336-F567 VanDerWaalsContact NE-CD1 3.31Å; L340-F567 HydrophobicContact CD1-CE1 3.88Å; L340-F567 HydrophobicContact CD1-CE2 4.3Å; L340-F567 HydrophobicContact CD1-CZ 3.32Å; L565-F567 HydrophobicContact CD2-CE1 4.42Å; L565-F567 HydrophobicContact CG-CD1 4.5Å; L565-F567 HydrophobicContact CG-CE1 4.38Å; L565-F567 VanDerWaalsContact O-CD1 3.31Å; L565-F567 WeakPolarHBondContact O-CD1 3.48Å; L565-F567 WeakPolarHBondContact O-CE1 3.5Å; F567-I569 VanDerWaalsContact C-N 3.27Å; F567-I569 PolarHBondContact O-N 2.93Å; F567-G617 CarbonylContact O-C 3.59Å; F567-G617 WeakPolarHBondContact O-CA 2.95Å; F567-N618 PolarHBondContact O-N 3.37Å; F567-M646 HydrophobicContact CE2-CE 3.86Å; F567-M646 HydrophobicContact CZ-CE 3.86Å; F567-S653 WeakPolarHBondContact CD2-O 3.48Å; F567-I654 WeakPolarHBondContact CB-O 3.36Å; F567-I654 WeakPolarHBondContact CG-O 3.44Å; F567-I654 PolarHBondContact N-O 2.92Å; F567-A655 VanDerWaalsContact CZ-C 3.49Å; F567-G656 VanDerWaalsContact CE1-N 3.35Å
568	S	84.2	Confident	92.2	Very high	88 Å²	88	47.2 Å²	47.2	62%	0.615	26%	0.261	S	S	*	.	S	Bend	trans	-78.2	77.9	175.5	-169.3	0	0	0	0	110.2	N618	S568-N618 PolarHBondContact N-OD1 3.06Å
569	I	83.9	Confident	92.4	Very high	32 Å²	32	45.4 Å²	45.4	16%	0.164	25%	0.25	C	S	.	.			trans	-90.6	146.8	-177.3	59.6	-177.7	0	0	0	111.9	V566 F567 Q571 I573 I654	V566-I569 HydrophobicContact CG1-CD1 3.52Å; V566-I569 HydrophobicContact CG1-CG1 4.21Å; F567-I569 VanDerWaalsContact C-N 3.27Å; F567-I569 PolarHBondContact O-N 2.93Å; I569-Q571 WeakPolarHBondContact CD1-O 3.5Å; I569-Q571 VanDerWaalsContact CG1-O 3.3Å; I569-Q571 WeakPolarHBondContact CG1-O 3.2Å; I569-I573 HydrophobicContact CD1-CD1 4.1Å; I569-I573 HydrophobicContact CD1-CG1 3.63Å; I569-I654 HydrophobicContact CD1-CG2 4.39Å; I569-I654 HydrophobicContact CG2-CB 4.2Å; I569-I654 HydrophobicContact CG2-CG1 4Å; I569-I654 HydrophobicContact CG2-CG2 4.2Å
570	Q	84	Confident	92.4	Very high	182 Å²	182	47.6 Å²	47.6	85%	0.85	26%	0.26	S	S	*	.	S	Bend	trans	-74.1	-40.5	178.2	-57.8	-176.6	16.1	0	0	112.3
571	Q	88.9	Confident	92.4	Very high	127 Å²	127	47.6 Å²	47.6	59%	0.593	26%	0.26	S	S	*	.	S	Bend	trans	-100.6	131.6	179	-62.8	-179.8	-0.7	0	0	110.1	I569	I569-Q571 WeakPolarHBondContact CD1-O 3.5Å; I569-Q571 VanDerWaalsContact CG1-O 3.3Å; I569-Q571 WeakPolarHBondContact CG1-O 3.2Å
572	P	92.3	Very high	92.3	Very high	61 Å²	61	48.2 Å²	48.2	40%	0.396	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-75.8	139.8	178.5	31.3	-34.9	0	0	0	111.8	T574 C614 L615 L616	P572-T574 PolarHBondContact O-N 3.32Å; P572-C614 HydrophobicContact CB-CB 4.28Å; P572-L615 WeakPolarHBondContact CA-O 3.4Å; P572-L616 HydrophobicContact CB-CD2 4.24Å
573	I	93.9	Very high	92.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	123.8	-179.6	-53.6	174.1	0	0	0	109.6	V566 I569 Y577 I592 C614 L615 I654	V566-I573 HydrophobicContact CG1-CD1 3.85Å; V566-I573 HydrophobicContact CG2-CD1 3.98Å; I569-I573 HydrophobicContact CD1-CD1 4.1Å; I569-I573 HydrophobicContact CD1-CG1 3.63Å; I573-Y577 HydrophobicContact CG2-CD1 4.1Å; I573-Y577 HydrophobicContact CG2-CG 4.16Å; I573-I592 HydrophobicContact CG2-CD1 3.51Å; I573-C614 CarbonylContact O-C 3.56Å; I573-C614 WeakPolarHBondContact O-CA 3.48Å; I573-C614 VanDerWaalsContact O-CB 3.32Å; I573-C614 WeakPolarHBondContact O-CB 3.45Å; I573-L615 HydrophobicContact CB-CB 4.12Å; I573-L615 HydrophobicContact CB-CD1 4.48Å; I573-L615 HydrophobicContact CB-CG 4.44Å; I573-L615 HydrophobicContact CD1-CD1 4.33Å; I573-L615 PolarHBondContact N-O 3.26Å; I573-L615 PolarHBondContact O-N 3.43Å; I573-I654 HydrophobicContact CD1-CG2 3.61Å; I573-I654 HydrophobicContact CG1-CG2 4.14Å
574	T	94.6	Very high	91.8	Very high	64 Å²	64	46.8 Å²	46.8	39%	0.393	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	168.9	175.1	55	0	0	0	0	112	P572 G576 Y577 C614	P572-T574 PolarHBondContact O-N 3.32Å; T574-G576 PolarHBondContact O-N 2.73Å; T574-Y577 VanDerWaalsContact O-CB 3.27Å; T574-Y577 WeakPolarHBondContact O-CB 3.44Å; T574-Y577 PolarHBondContact O-N 2.83Å; T574-C614 HydrophobicContact CG2-CB 4.34Å
575	K	94.8	Very high	91.5	Very high	151 Å²	151	48.3 Å²	48.3	66%	0.657	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	126.5	167.5	-174.9	-149.1	170	-160.8	0	108.9	T593	K575-T593 WeakPolarHBondContact CE-O 3.45Å; K575-T593 VanDerWaalsContact CG-O 3.29Å; K575-T593 WeakPolarHBondContact CG-O 3.45Å
576	G	93.6	Very high	91.4	Very high	43 Å²	43	49 Å²	49	44%	0.443	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	6.7	-174.7	0	0	0	0	0	113.9	T574 I592	T574-G576 PolarHBondContact O-N 2.73Å; G576-I592 PolarHBondContact N-O 3.43Å
577	Y	94.4	Very high	91.5	Very high	31 Å²	31	52.9 Å²	52.9	12%	0.122	29%	0.292	C	S	.	.			trans	-67.1	125.3	177.4	-168.1	-101.3	0	0	0	110.9	I573 T574 V579 I592 V649 I654	I573-Y577 HydrophobicContact CG2-CD1 4.1Å; I573-Y577 HydrophobicContact CG2-CG 4.16Å; T574-Y577 VanDerWaalsContact O-CB 3.27Å; T574-Y577 WeakPolarHBondContact O-CB 3.44Å; T574-Y577 PolarHBondContact O-N 2.83Å; Y577-V579 HydrophobicContact CD1-CG1 3.68Å; Y577-V579 HydrophobicContact CE1-CG1 3.96Å; Y577-I592 PolarHBondContact O-N 2.95Å; Y577-V649 HydrophobicContact CE1-CG2 3.96Å; Y577-I654 HydrophobicContact CE1-CD1 3.86Å
578	P	95.7	Very high	91.8	Very high	83 Å²	83	52.6 Å²	52.6	54%	0.539	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	142.4	177.3	32.3	-34.2	0	0	0	110.5	V649	P578-V649 VanDerWaalsContact O-CG2 3.31Å; P578-V649 WeakPolarHBondContact O-CG2 3.45Å
579	V	95.5	Very high	92.3	Very high	5 Å²	5	50.1 Å²	50.1	3%	0.03	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	148.7	-179.4	-65	0	0	0	0	110.8	Y577 A590 I592 L625 L647 V649	Y577-V579 HydrophobicContact CD1-CG1 3.68Å; Y577-V579 HydrophobicContact CE1-CG1 3.96Å; V579-A590 HydrophobicContact CG2-CB 4.1Å; V579-A590 PolarHBondContact N-O 3.05Å; V579-A590 PolarHBondContact O-N 2.73Å; V579-I592 HydrophobicContact CG1-CD1 3.88Å; V579-I592 HydrophobicContact CG1-CG1 4.43Å; V579-I592 HydrophobicContact CG2-CD1 4.45Å; V579-I592 HydrophobicContact CG2-CG1 4.23Å; V579-L625 HydrophobicContact CG2-CD2 4.12Å; V579-L647 HydrophobicContact CB-CB 4.46Å; V579-L647 HydrophobicContact CB-CD2 4.39Å; V579-L647 HydrophobicContact CG2-CD1 4.29Å; V579-L647 HydrophobicContact CG2-CD2 3.85Å; V579-V649 HydrophobicContact CB-CG2 4.35Å; V579-V649 HydrophobicContact CG1-CG2 4.08Å
580	I	95.5	Very high	92.9	Very high	65 Å²	65	48.7 Å²	48.7	33%	0.333	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	118.7	166.2	-52.8	176.2	0	0	0	107.5	Y582 N587 L647 R648	I580-Y582 HydrophobicContact CB-CD2 4.41Å; I580-Y582 HydrophobicContact CB-CE2 3.72Å; I580-Y582 HydrophobicContact CG2-CD2 3.95Å; I580-Y582 HydrophobicContact CG2-CE2 3.32Å; I580-Y582 WeakPolarHBondContact O-CD2 3.47Å; I580-N587 HydrophobicContact CG2-CB 3.85Å; I580-L647 WeakPolarHBondContact O-CA 3.24Å; I580-R648 PolarHBondContact N-O 3.25Å; I580-R648 PolarHBondContact O-N 3.34Å
581	Y	95.4	Very high	93.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	114.3	179.5	179.3	-89.1	0	0	0	109.7	I560 Y583 N587 V588 L625 F627 I631 I633 F645 L647	I560-Y581 HydrophobicContact CD1-CE2 4.14Å; Y581-Y583 AromaticContact CD1-CD1 3.56Å; Y581-Y583 HydrophobicContact CD1-CD1 3.56Å; Y581-Y583 HydrophobicContact CD1-CE1 4.32Å; Y581-Y583 HydrophobicContact CD1-CG 4.25Å; Y581-Y583 AromaticContact CE1-CD1 3.6Å; Y581-Y583 HydrophobicContact CE1-CD1 3.6Å; Y581-Y583 AromaticContact CE1-CG 3.81Å; Y581-Y583 HydrophobicContact CE1-CG 3.81Å; Y581-N587 CarbonylContact O-C 3.58Å; Y581-N587 VanDerWaalsContact O-CA 3.29Å; Y581-N587 WeakPolarHBondContact O-CA 3.32Å; Y581-V588 WeakPolarHBondContact CB-O 3.48Å; Y581-V588 PolarHBondContact N-O 2.89Å; Y581-V588 PolarHBondContact O-N 3.07Å; Y581-L625 HydrophobicContact CD2-CD1 4.04Å; Y581-L625 HydrophobicContact CE2-CD1 3.97Å; Y581-F627 HydrophobicContact CD1-CD1 4.44Å; Y581-F627 AromaticContact CD1-CE1 3.69Å; Y581-F627 HydrophobicContact CD1-CE1 3.69Å; Y581-F627 HydrophobicContact CD1-CZ 4.21Å; Y581-F627 AromaticContact CD2-CE1 3.64Å; Y581-F627 HydrophobicContact CD2-CE1 3.64Å; Y581-F627 HydrophobicContact CD2-CZ 4.17Å; Y581-F627 AromaticContact CE1-CE1 3.93Å; Y581-F627 HydrophobicContact CE1-CE1 3.93Å; Y581-F627 AromaticContact CE1-CZ 3.96Å; Y581-F627 HydrophobicContact CE1-CZ 3.96Å; Y581-F627 AromaticContact CE2-CE1 3.85Å; Y581-F627 HydrophobicContact CE2-CE1 3.85Å; Y581-F627 AromaticContact CE2-CZ 3.89Å; Y581-F627 HydrophobicContact CE2-CZ 3.89Å; Y581-F627 HydrophobicContact CG-CD1 4.37Å; Y581-F627 AromaticContact CG-CE1 3.57Å; Y581-F627 HydrophobicContact CG-CE1 3.57Å; Y581-F627 HydrophobicContact CG-CZ 4.34Å; Y581-F627 AromaticContact CZ-CZ 3.81Å; Y581-I631 HydrophobicContact CD1-CD1 4Å; Y581-I631 HydrophobicContact CE1-CD1 3.8Å; Y581-I633 HydrophobicContact CE1-CD1 3.89Å; Y581-I633 VanDerWaalsContact OH-CD1 3.3Å; Y581-I633 WeakPolarHBondContact OH-CD1 3.45Å; Y581-F645 HydrophobicContact CD2-CB 4.44Å; Y581-F645 AromaticContact CD2-CD2 3.65Å; Y581-F645 HydrophobicContact CD2-CD2 3.65Å; Y581-F645 HydrophobicContact CD2-CE2 4.07Å; Y581-F645 HydrophobicContact CD2-CG 4.13Å; Y581-F645 HydrophobicContact CE1-CB 4.27Å; Y581-F645 HydrophobicContact CE2-CB 3.69Å; Y581-F645 AromaticContact CE2-CD1 3.79Å; Y581-F645 HydrophobicContact CE2-CD1 3.79Å; Y581-F645 AromaticContact CE2-CD2 3.2Å; Y581-F645 HydrophobicContact CE2-CD2 3.2Å; Y581-F645 HydrophobicContact CE2-CE1 4.17Å; Y581-F645 AromaticContact CE2-CE2 3.65Å; Y581-F645 HydrophobicContact CE2-CE2 3.65Å; Y581-F645 AromaticContact CE2-CG 3.28Å; Y581-F645 HydrophobicContact CE2-CG 3.28Å; Y581-F645 HydrophobicContact CE2-CZ 4.1Å; Y581-F645 AromaticContact CZ-CG 3.6Å; Y581-F645 WeakPolarHBondContact OH-CB 3.07Å; Y581-F645 WeakPolarHBondContact OH-CD1 3.39Å; Y581-F645 WeakPolarHBondContact OH-CG 3.16Å; Y581-L647 HydrophobicContact CD2-CD2 3.68Å; Y581-L647 HydrophobicContact CG-CD2 4.36Å
582	Y	94.3	Very high	93.8	Very high	23 Å²	23	36.2 Å²	36.2	9%	0.09	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	129.7	178.6	-68.8	-99.5	0	0	0	110.6	P298 I301 I580 A586 N587 F645 M646 R648	P298-Y582 HydrophobicContact CB-CE1 3.86Å; P298-Y582 HydrophobicContact CG-CE1 4.09Å; I301-Y582 HydrophobicContact CD1-CD1 4.26Å; I301-Y582 HydrophobicContact CD1-CG 4.18Å; I580-Y582 HydrophobicContact CB-CD2 4.41Å; I580-Y582 HydrophobicContact CB-CE2 3.72Å; I580-Y582 HydrophobicContact CG2-CD2 3.95Å; I580-Y582 HydrophobicContact CG2-CE2 3.32Å; I580-Y582 WeakPolarHBondContact O-CD2 3.47Å; Y582-A586 WeakPolarHBondContact CA-O 3.1Å; Y582-N587 HydrophobicContact CD1-CB 3.76Å; Y582-N587 HydrophobicContact CE1-CB 3.73Å; Y582-N587 HydrophobicContact CG-CB 4.21Å; Y582-F645 WeakPolarHBondContact O-CA 3.29Å; Y582-F645 WeakPolarHBondContact O-CB 3.27Å; Y582-M646 PolarHBondContact N-O 3.47Å; Y582-M646 PolarHBondContact O-N 3.12Å; Y582-R648 HydrophobicContact CD2-CB 4.35Å; Y582-R648 HydrophobicContact CD2-CG 3.86Å; Y582-R648 HydrophobicContact CE2-CB 3.77Å; Y582-R648 VanDerWaalsContact CE2-CD 3.47Å; Y582-R648 HydrophobicContact CE2-CG 3.57Å
583	Y	92.2	Very high	93.9	Very high	9 Å²	9	35 Å²	35	4%	0.035	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	148	-178.1	65.5	-75.2	0	0	0	109.1	Y581 C585 A586 V588 I631	Y581-Y583 AromaticContact CD1-CD1 3.56Å; Y581-Y583 HydrophobicContact CD1-CD1 3.56Å; Y581-Y583 HydrophobicContact CD1-CE1 4.32Å; Y581-Y583 HydrophobicContact CD1-CG 4.25Å; Y581-Y583 AromaticContact CE1-CD1 3.6Å; Y581-Y583 HydrophobicContact CE1-CD1 3.6Å; Y581-Y583 AromaticContact CE1-CG 3.81Å; Y581-Y583 HydrophobicContact CE1-CG 3.81Å; Y583-C585 PolarHBondContact O-N 2.94Å; Y583-A586 HydrophobicContact CD1-CB 4.41Å; Y583-A586 HydrophobicContact CE1-CB 3.79Å; Y583-A586 HydrophobicContact CE2-CB 4Å; Y583-A586 PolarHBondContact N-O 2.82Å; Y583-A586 VanDerWaalsContact N-O 3.07Å; Y583-A586 PolarHBondContact O-N 3.02Å; Y583-A586 VanDerWaalsContact O-O 3.08Å; Y583-V588 HydrophobicContact CE1-CB 4.31Å; Y583-V588 HydrophobicContact CE1-CG2 3.96Å; Y583-I631 HydrophobicContact CD1-CD1 4.32Å; Y583-I631 HydrophobicContact CE1-CD1 4.04Å; Y583-I631 HydrophobicContact CE1-CG2 4.43Å; Y583-I631 WeakPolarHBondContact OH-CG2 3.21Å
584	N	87.7	Confident	93.9	Very high	9 Å²	9	40.2 Å²	40.2	5%	0.048	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	-112.9	-179.4	-61.2	-15.9	0	0	0	111.8	T305 V444 G544 L642	T305-N584 WeakPolarHBondContact CG2-O 3.42Å; T305-N584 PolarHBondContact OG1-O 3.32Å; V444-N584 HydrophobicContact CG1-CB 3.78Å; G544-N584 PolarHBondContact O-ND2 2.83Å; N584-L642 WeakPolarHBondContact OD1-CD2 3.24Å
585	C	87.2	Confident	94	Very high	33 Å²	33	37.9 Å²	37.9	22%	0.223	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	21.3	174.2	-56.2	0	0	0	0	112.4	Q306 Y583	Q306-C585 PolarHBondContact NE2-SG 3.34Å; Q306-C585 VanDerWaalsContact NE2-SG 3.39Å; Y583-C585 PolarHBondContact O-N 2.94Å
586	A	91.5	Very high	93.9	Very high	14 Å²	14	34.5 Å²	34.5	12%	0.116	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	167.9	-170.8	0	0	0	0	0	113.6	P543 Y582 Y583	P543-A586 WeakPolarHBondContact O-CB 3.38Å; Y582-A586 WeakPolarHBondContact CA-O 3.1Å; Y583-A586 HydrophobicContact CD1-CB 4.41Å; Y583-A586 HydrophobicContact CE1-CB 3.79Å; Y583-A586 HydrophobicContact CE2-CB 4Å; Y583-A586 PolarHBondContact N-O 2.82Å; Y583-A586 VanDerWaalsContact N-O 3.07Å; Y583-A586 PolarHBondContact O-N 3.02Å; Y583-A586 VanDerWaalsContact O-O 3.08Å
587	N	93.5	Very high	93.8	Very high	82 Å²	82	33.3 Å²	33.3	44%	0.439	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	151.8	168.5	64.2	73.4	0	0	0	112.5	I580 Y581 Y582 R629	I580-N587 HydrophobicContact CG2-CB 3.85Å; Y581-N587 CarbonylContact O-C 3.58Å; Y581-N587 VanDerWaalsContact O-CA 3.29Å; Y581-N587 WeakPolarHBondContact O-CA 3.32Å; Y582-N587 HydrophobicContact CD1-CB 3.76Å; Y582-N587 HydrophobicContact CE1-CB 3.73Å; Y582-N587 HydrophobicContact CG-CB 4.21Å; N587-R629 PolarHBondContact O-NH2 3.33Å
588	V	94.3	Very high	93.7	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.012	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	138.1	176.7	162.3	0	0	0	0	108.9	Y581 Y583 F627 R629 I631	Y581-V588 WeakPolarHBondContact CB-O 3.48Å; Y581-V588 PolarHBondContact N-O 2.89Å; Y581-V588 PolarHBondContact O-N 3.07Å; Y583-V588 HydrophobicContact CE1-CB 4.31Å; Y583-V588 HydrophobicContact CE1-CG2 3.96Å; V588-F627 HydrophobicContact CG1-CB 3.99Å; V588-F627 HydrophobicContact CG1-CD1 4.2Å; V588-F627 HydrophobicContact CG1-CG 4.43Å; V588-R629 HydrophobicContact CG1-CB 4.39Å; V588-R629 HydrophobicContact CG2-CB 4.31Å; V588-I631 HydrophobicContact CG2-CG2 3.8Å
589	A	96	Very high	93.4	Very high	37 Å²	37	30 Å²	30	31%	0.306	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	134.9	170.2	0	0	0	0	0	110.8	E628	A589-E628 VanDerWaalsContact CB-CD 3.47Å; A589-E628 HydrophobicContact CB-CG 4.41Å; A589-E628 WeakPolarHBondContact CB-OE1 3.2Å; A589-E628 WeakPolarHBondContact CB-OE2 3.14Å; A589-E628 PolarHBondContact O-N 3.03Å; A589-E628 VanDerWaalsContact O-N 3.16Å
590	A	96	Very high	92.8	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.008	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	157.5	-170.7	0	0	0	0	0	111.3	V579 T626 F627	V579-A590 HydrophobicContact CG2-CB 4.1Å; V579-A590 PolarHBondContact N-O 3.05Å; V579-A590 PolarHBondContact O-N 2.73Å; A590-T626 CarbonylContact C-O 3.56Å; A590-T626 VanDerWaalsContact CA-O 3.27Å; A590-T626 WeakPolarHBondContact CA-O 3.15Å; A590-F627 HydrophobicContact CB-CD1 3.68Å; A590-F627 HydrophobicContact CB-CE1 4.09Å
591	T	96.6	Very high	91.8	Very high	47 Å²	47	31.8 Å²	31.8	29%	0.288	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	137.2	176.5	-65	0	0	0	0	110.8	T593 L625 T626	T591-T593 HydrophobicContact CG2-CG2 4.03Å; T591-T593 PolarHBondContact O-N 2.88Å; T591-T593 VanDerWaalsContact O-N 3.09Å; T591-L625 WeakPolarHBondContact O-CA 3.28Å; T591-T626 PolarHBondContact N-O 3.03Å; T591-T626 PolarHBondContact O-N 2.97Å
592	I	95.8	Very high	90.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	88.1	175	-62.6	171.4	0	0	0	108.8	I573 G576 Y577 V579 L595 V623 E624 L625 L647	I573-I592 HydrophobicContact CG2-CD1 3.51Å; G576-I592 PolarHBondContact N-O 3.43Å; Y577-I592 PolarHBondContact O-N 2.95Å; V579-I592 HydrophobicContact CG1-CD1 3.88Å; V579-I592 HydrophobicContact CG1-CG1 4.43Å; V579-I592 HydrophobicContact CG2-CD1 4.45Å; V579-I592 HydrophobicContact CG2-CG1 4.23Å; I592-L595 HydrophobicContact CG2-CD2 3.59Å; I592-V623 HydrophobicContact CG2-CB 4.24Å; I592-V623 HydrophobicContact CG2-CG1 4.31Å; I592-E624 CarbonylContact C-O 3.55Å; I592-L625 HydrophobicContact CG1-CD2 3.6Å; I592-L647 HydrophobicContact CD1-CD1 4.23Å
593	T	94.3	Very high	89	Confident	37 Å²	37	39.6 Å²	39.6	23%	0.227	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	-27.4	-167.5	56.6	0	0	0	0	114.4	K575 T591 E624 T626	K575-T593 WeakPolarHBondContact CE-O 3.45Å; K575-T593 VanDerWaalsContact CG-O 3.29Å; K575-T593 WeakPolarHBondContact CG-O 3.45Å; T591-T593 HydrophobicContact CG2-CG2 4.03Å; T591-T593 PolarHBondContact O-N 2.88Å; T591-T593 VanDerWaalsContact O-N 3.09Å; T593-E624 PolarHBondContact N-O 2.79Å; T593-T626 VanDerWaalsContact CG2-OG1 3.24Å; T593-T626 WeakPolarHBondContact CG2-OG1 3.32Å; T593-T626 PolarHBondContact OG1-OG1 2.92Å; T593-T626 VanDerWaalsContact OG1-OG1 3.09Å
594	K	94.2	Very high	87.7	Confident	109 Å²	109	49.3 Å²	49.3	47%	0.474	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	137.1	173.7	-52.2	-167	-163.5	69.3	0	112.7	V623 E624	K594-V623 CarbonylContact O-C 3.59Å; K594-V623 VanDerWaalsContact O-CA 3.28Å; K594-V623 WeakPolarHBondContact O-CA 3.43Å; K594-E624 HydrophobicContact CB-CB 4.18Å; K594-E624 WeakPolarHBondContact CD-OE2 3.17Å; K594-E624 WeakPolarHBondContact CE-OE2 2.93Å; K594-E624 PolarHBondContact N-O 2.84Å; K594-E624 IonicContact NZ-OE2 2.61Å; K594-E624 PolarHBondContact NZ-OE2 2.81Å; K594-E624 PolarHBondContact O-N 3.21Å
595	L	95	Very high	87	Confident	15 Å²	15	54.2 Å²	54.2	8%	0.079	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	112.8	167.4	-53.1	-179.4	0	0	0	108.7	I592 P612 L615 V623	I592-L595 HydrophobicContact CG2-CD2 3.59Å; L595-P612 HydrophobicContact CB-CG 3.95Å; L595-P612 HydrophobicContact CD1-CG 4.36Å; L595-L615 HydrophobicContact CD1-CD2 4.23Å; L595-L615 HydrophobicContact CD1-CG 4.14Å; L595-L615 HydrophobicContact CD2-CD1 3.94Å; L595-L615 HydrophobicContact CD2-CD2 4.31Å; L595-L615 HydrophobicContact CD2-CG 3.98Å; L595-V623 HydrophobicContact CD2-CG1 3.75Å
596	K	93	Very high	86.7	Confident	79 Å²	79	57 Å²	57	34%	0.343	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-52	-177.2	-69.1	173.9	166.9	162.2	0	111.7	S561 K611 N622 E624	S561-K596 PolarHBondContact OG-NZ 3.32Å; K596-K611 PolarHBondContact O-N 3.24Å; K596-N622 WeakPolarHBondContact CA-O 3.36Å; K596-N622 HydrophobicContact CB-CB 4.13Å; K596-N622 WeakPolarHBondContact CB-O 3.24Å; K596-N622 PolarHBondContact N-O 3.2Å; K596-E624 HydrophobicContact CD-CG 4.4Å; K596-E624 VanDerWaalsContact CE-CD 3.47Å; K596-E624 WeakPolarHBondContact CE-OE1 3.29Å; K596-E624 VanDerWaalsContact NZ-CG 3.34Å; K596-E624 IonicContact NZ-OE1 2.68Å; K596-E624 PolarHBondContact NZ-OE1 3.36Å
597	S	92.7	Very high	86.3	Confident	18 Å²	18	61.1 Å²	61.1	13%	0.126	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	150.9	178.4	60.8	0	0	0	0	111	V609 A621 N622	S597-V609 CarbonylContact C-O 3.52Å; S597-V609 WeakPolarHBondContact CA-O 3.37Å; S597-A621 CarbonylContact O-C 3.44Å; S597-A621 VanDerWaalsContact O-CA 3.23Å; S597-A621 WeakPolarHBondContact O-CA 3.25Å; S597-N622 PolarHBondContact N-O 3.02Å; S597-N622 PolarHBondContact O-N 3.09Å; S597-N622 PolarHBondContact OG-ND2 3.25Å
598	M	92.2	Very high	86	Confident	23 Å²	23	61.4 Å²	61.4	11%	0.113	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	133.7	168.2	175.2	-179.5	74.3	0	0	108.5	V608 V609 P612 L615 C619 T620	M598-V608 CarbonylContact O-C 3.6Å; M598-V608 WeakPolarHBondContact O-CA 3.42Å; M598-V609 HydrophobicContact CE-CB 4.47Å; M598-V609 HydrophobicContact CE-CG2 4.28Å; M598-V609 PolarHBondContact N-O 3.01Å; M598-V609 PolarHBondContact O-N 2.91Å; M598-P612 HydrophobicContact CB-CB 4.13Å; M598-P612 HydrophobicContact CB-CG 3.86Å; M598-L615 HydrophobicContact CB-CD2 3.91Å; M598-L615 HydrophobicContact CG-CD2 4.2Å; M598-L615 HydrophobicContact SD-CD2 4.16Å; M598-C619 HydrophobicContact CG-CB 3.75Å; M598-C619 HydrophobicContact SD-CB 3.96Å; M598-T620 CarbonylContact C-O 3.56Å; M598-T620 WeakPolarHBondContact CA-O 3.49Å
599	T	88.9	Confident	85.8	Confident	21 Å²	21	64.4 Å²	64.4	13%	0.129	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	119.8	168.7	-58.4	0	0	0	0	108	E606 K607 V608 T620	T599-E606 HydrophobicContact CG2-CB 3.97Å; T599-E606 HydrophobicContact CG2-CG 4.41Å; T599-K607 WeakPolarHBondContact CA-O 3.29Å; T599-V608 HydrophobicContact CG2-CG2 4.21Å; T599-T620 PolarHBondContact N-O 2.71Å; T599-T620 PolarHBondContact O-N 3.38Å; T599-T620 PolarHBondContact O-OG1 3Å
600	H	83.3	Confident	85.6	Confident	60 Å²	60	73 Å²	73	28%	0.278	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	126.8	173.2	-173.5	-97.9	0	0	0	109.4	K607	H600-K607 PolarHBondContact N-O 2.81Å; H600-K607 PolarHBondContact O-N 3.13Å
601	R	74.9	Confident	85.3	Confident	49 Å²	49	81.6 Å²	81.6	19%	0.185	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	106.7	176.8	-75.1	-168.7	175.5	125.7	14.4	110	S63 T65 D68 E606	S63-R601 PolarHBondContact O-NH1 3.46Å; T65-R601 PolarHBondContact OG1-NH1 2.89Å; T65-R601 PolarHBondContact OG1-NH2 3.32Å; T65-R601 VanDerWaalsContact OG1-NH2 3.11Å; D68-R601 IonicContact OD1-NH2 2.65Å; D68-R601 IonicContact OD2-CZ 3.3Å; D68-R601 IonicContact OD2-NH1 3.48Å; D68-R601 PolarHBondContact OD2-NH1 2.84Å; D68-R601 IonicContact OD2-NH2 3.68Å; D68-R601 PolarHBondContact OD2-NH2 3.16Å; R601-E606 HydrophobicContact CG-CG 4.27Å; R601-E606 IonicContact CZ-OE1 2.78Å; R601-E606 IonicContact NE-OE1 3.04Å; R601-E606 PolarHBondContact NE-OE1 2.68Å; R601-E606 IonicContact NH2-OE1 3.26Å; R601-E606 PolarHBondContact NH2-OE1 2.92Å
602	E	67.6	Low	85.1	Confident	80 Å²	80	80.1 Å²	80.1	37%	0.374	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	117.7	179.4	-165.3	-178.5	175.7	0	0	109.6	K604 I605 K607	E602-K604 VanDerWaalsContact C-N 3.29Å; E602-K604 PolarHBondContact O-N 2.69Å; E602-I605 PolarHBondContact N-O 2.88Å; E602-I605 WeakPolarHBondContact O-CB 3.46Å; E602-I605 PolarHBondContact O-N 3.39Å; E602-K607 WeakPolarHBondContact OE2-CE 3.43Å; E602-K607 IonicContact OE2-NZ 3.2Å; E602-K607 PolarHBondContact OE2-NZ 3.38Å
603	N	62.3	Low	84.9	Confident	106 Å²	106	91.5 Å²	91.5	57%	0.567	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	44.5	179.9	-61	-41.8	0	0	0	114	K60 I605	K60-N603 PolarHBondContact NZ-OD1 2.96Å; N603-I605 PolarHBondContact O-N 3.03Å
604	K	65.7	Low	84.8	Confident	213 Å²	213	91.7 Å²	91.7	93%	0.926	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	-0.6	-173.6	-55	-176.5	177.8	-177.3	0	116.2	E602	E602-K604 VanDerWaalsContact C-N 3.29Å; E602-K604 PolarHBondContact O-N 2.69Å
605	I	72.8	Confident	84.7	Confident	112 Å²	112	86.5 Å²	86.5	57%	0.574	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	125.6	174.2	-56.9	176.2	0	0	0	108.9	E602 N603 K607	E602-I605 PolarHBondContact N-O 2.88Å; E602-I605 WeakPolarHBondContact O-CB 3.46Å; E602-I605 PolarHBondContact O-N 3.39Å; N603-I605 PolarHBondContact O-N 3.03Å; I605-K607 HydrophobicContact CG2-CG 4.47Å
606	E	79.7	Confident	84.4	Confident	92 Å²	92	90.5 Å²	90.5	43%	0.43	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	109.4	173.6	-60	-145.2	150.6	0	0	110.8	T599 R601	T599-E606 HydrophobicContact CG2-CB 3.97Å; T599-E606 HydrophobicContact CG2-CG 4.41Å; R601-E606 HydrophobicContact CG-CG 4.27Å; R601-E606 IonicContact CZ-OE1 2.78Å; R601-E606 IonicContact NE-OE1 3.04Å; R601-E606 PolarHBondContact NE-OE1 2.68Å; R601-E606 IonicContact NH2-OE1 3.26Å; R601-E606 PolarHBondContact NH2-OE1 2.92Å
607	K	82.8	Confident	84.2	Confident	101 Å²	101	87.9 Å²	87.9	44%	0.439	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	103	175.4	-67	178.1	-179.2	174.5	0	109.5	T599 H600 E602 I605	T599-K607 WeakPolarHBondContact CA-O 3.29Å; H600-K607 PolarHBondContact N-O 2.81Å; H600-K607 PolarHBondContact O-N 3.13Å; E602-K607 WeakPolarHBondContact OE2-CE 3.43Å; E602-K607 IonicContact OE2-NZ 3.2Å; E602-K607 PolarHBondContact OE2-NZ 3.38Å; I605-K607 HydrophobicContact CG2-CG 4.47Å
608	V	87.1	Confident	83.9	Confident	88 Å²	88	88.5 Å²	88.5	53%	0.533	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	105.6	179.2	-173	0	0	0	0	111	M598 T599	M598-V608 CarbonylContact O-C 3.6Å; M598-V608 WeakPolarHBondContact O-CA 3.42Å; T599-V608 HydrophobicContact CG2-CG2 4.21Å
609	V	90.6	Very high	83.8	Confident	64 Å²	64	87.5 Å²	87.5	39%	0.388	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	117.7	175.7	-178	0	0	0	0	109.7	S597 M598 P612	S597-V609 CarbonylContact C-O 3.52Å; S597-V609 WeakPolarHBondContact CA-O 3.37Å; M598-V609 HydrophobicContact CE-CB 4.47Å; M598-V609 HydrophobicContact CE-CG2 4.28Å; M598-V609 PolarHBondContact N-O 3.01Å; M598-V609 PolarHBondContact O-N 2.91Å; V609-P612 HydrophobicContact CG1-CB 4.18Å
610	R	91.5	Very high	83.9	Confident	219 Å²	219	87 Å²	87	83%	0.826	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	136.2	172	-64.3	-179.5	178.2	-177.7	-0.9	109.9
611	K	90.8	Very high	84.5	Confident	181 Å²	181	84.4 Å²	84.4	79%	0.787	40%	0.398	S	S	*	.	S	Bend	trans	48.4	61.1	-178.4	-60.9	-179.7	-179.8	177.3	0	113.8	K596	K596-K611 PolarHBondContact O-N 3.24Å
612	P	92.3	Very high	85.4	Confident	15 Å²	15	84.8 Å²	84.8	10%	0.097	40%	0.404	C	S	.	.			trans	-63.6	150.9	177.1	32.1	-38.6	0	0	0	111.6	L595 M598 V609 L615	L595-P612 HydrophobicContact CB-CG 3.95Å; L595-P612 HydrophobicContact CD1-CG 4.36Å; M598-P612 HydrophobicContact CB-CB 4.13Å; M598-P612 HydrophobicContact CB-CG 3.86Å; V609-P612 HydrophobicContact CG1-CB 4.18Å; P612-L615 HydrophobicContact CG-CD2 3.83Å
613	R	91.9	Very high	86.8	Confident	240 Å²	240	81 Å²	81	91%	0.906	39%	0.386	S	S	*	.	S	Bend	trans	-71.5	-38.2	176.9	-67.4	-169.4	-69.3	-179.7	-1.6	112.5
614	C	92.1	Very high	88.4	Confident	41 Å²	41	77.1 Å²	77.1	28%	0.277	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	162.5	174.3	56.7	0	0	0	0	109.4	P572 I573 T574	P572-C614 HydrophobicContact CB-CB 4.28Å; I573-C614 CarbonylContact O-C 3.56Å; I573-C614 WeakPolarHBondContact O-CA 3.48Å; I573-C614 VanDerWaalsContact O-CB 3.32Å; I573-C614 WeakPolarHBondContact O-CB 3.45Å; T574-C614 HydrophobicContact CG2-CB 4.34Å
615	L	92.1	Very high	89.8	Confident	0 Å²	0	67 Å²	67	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	125.6	167.2	-49.2	180	0	0	0	108.5	V566 P572 I573 L595 M598 P612 A621 V623	V566-L615 HydrophobicContact CG2-CB 4.28Å; V566-L615 HydrophobicContact CG2-CD1 3.91Å; P572-L615 WeakPolarHBondContact CA-O 3.4Å; I573-L615 HydrophobicContact CB-CB 4.12Å; I573-L615 HydrophobicContact CB-CD1 4.48Å; I573-L615 HydrophobicContact CB-CG 4.44Å; I573-L615 HydrophobicContact CD1-CD1 4.33Å; I573-L615 PolarHBondContact N-O 3.26Å; I573-L615 PolarHBondContact O-N 3.43Å; L595-L615 HydrophobicContact CD1-CD2 4.23Å; L595-L615 HydrophobicContact CD1-CG 4.14Å; L595-L615 HydrophobicContact CD2-CD1 3.94Å; L595-L615 HydrophobicContact CD2-CD2 4.31Å; L595-L615 HydrophobicContact CD2-CG 3.98Å; M598-L615 HydrophobicContact CB-CD2 3.91Å; M598-L615 HydrophobicContact CG-CD2 4.2Å; M598-L615 HydrophobicContact SD-CD2 4.16Å; P612-L615 HydrophobicContact CG-CD2 3.83Å; L615-A621 HydrophobicContact CD1-CB 3.48Å; L615-A621 VanDerWaalsContact CD1-CB 3.48Å; L615-A621 HydrophobicContact CD2-CB 3.64Å; L615-A621 HydrophobicContact CG-CB 4.2Å; L615-V623 HydrophobicContact CD1-CG1 4.13Å
616	L	89	Confident	90.9	Very high	99 Å²	99	63.8 Å²	63.8	52%	0.518	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-81.6	167	170.2	-61.4	179	0	0	0	110	P572 C619	P572-L616 HydrophobicContact CB-CD2 4.24Å; L616-C619 PolarHBondContact O-SG 3.16Å
617	G	87	Confident	91.7	Very high	23 Å²	23	60 Å²	60	24%	0.237	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	155.5	173.1	0	0	0	0	0	112.9	F567 C619	F567-G617 CarbonylContact O-C 3.59Å; F567-G617 WeakPolarHBondContact O-CA 2.95Å; G617-C619 VanDerWaalsContact C-N 3.34Å; G617-C619 PolarHBondContact O-N 3Å
618	N	86.4	Confident	92.1	Very high	32 Å²	32	62.1 Å²	62.1	17%	0.171	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.7	29.9	176.9	-57.7	-41	0	0	0	115.9	L62 V566 F567 S568	L62-N618 HydrophobicContact CD1-CB 3.69Å; L62-N618 HydrophobicContact CG-CB 4.02Å; V566-N618 VanDerWaalsContact O-CA 3.23Å; V566-N618 WeakPolarHBondContact O-CA 3.3Å; V566-N618 PolarHBondContact O-N 3.11Å; V566-N618 VanDerWaalsContact O-N 3.11Å; F567-N618 PolarHBondContact O-N 3.37Å; S568-N618 PolarHBondContact N-OD1 3.06Å
619	C	90.3	Very high	92.3	Very high	1 Å²	1	63 Å²	63	1%	0.007	29%	0.294	C	S	.	.			trans	-110	161.1	171.4	71.9	0	0	0	0	112.5	V566 M598 L616 G617	V566-C619 PolarHBondContact N-O 2.8Å; M598-C619 HydrophobicContact CG-CB 3.75Å; M598-C619 HydrophobicContact SD-CB 3.96Å; L616-C619 PolarHBondContact O-SG 3.16Å; G617-C619 VanDerWaalsContact C-N 3.34Å; G617-C619 PolarHBondContact O-N 3Å
620	T	92.7	Very high	92.3	Very high	12 Å²	12	63.4 Å²	63.4	7%	0.074	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	146.5	161.8	51.6	0	0	0	0	109.9	L564 L565 M598 T599	L564-T620 CarbonylContact O-C 3.55Å; L564-T620 VanDerWaalsContact O-CA 3.22Å; L564-T620 WeakPolarHBondContact O-CA 3.33Å; L565-T620 HydrophobicContact CB-CG2 4.32Å; L565-T620 HydrophobicContact CD1-CG2 3.47Å; L565-T620 VanDerWaalsContact CD1-CG2 3.47Å; M598-T620 CarbonylContact C-O 3.56Å; M598-T620 WeakPolarHBondContact CA-O 3.49Å; T599-T620 PolarHBondContact N-O 2.71Å; T599-T620 PolarHBondContact O-N 3.38Å; T599-T620 PolarHBondContact O-OG1 3Å
621	A	94.5	Very high	92.3	Very high	4 Å²	4	53.2 Å²	53.2	3%	0.033	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	139	-175.1	0	0	0	0	0	113	L564 S597 L615 V623	L564-A621 PolarHBondContact N-O 3.22Å; L564-A621 PolarHBondContact O-N 3.34Å; S597-A621 CarbonylContact O-C 3.44Å; S597-A621 VanDerWaalsContact O-CA 3.23Å; S597-A621 WeakPolarHBondContact O-CA 3.25Å; L615-A621 HydrophobicContact CD1-CB 3.48Å; L615-A621 VanDerWaalsContact CD1-CB 3.48Å; L615-A621 HydrophobicContact CD2-CB 3.64Å; L615-A621 HydrophobicContact CG-CB 4.2Å; A621-V623 HydrophobicContact CB-CG1 4.29Å
622	N	95.3	Very high	92.4	Very high	58 Å²	58	45 Å²	45	31%	0.31	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	123.9	167.9	-66	-47.1	0	0	0	108.7	A562 K596 S597	A562-N622 WeakPolarHBondContact O-CA 3.41Å; K596-N622 WeakPolarHBondContact CA-O 3.36Å; K596-N622 HydrophobicContact CB-CB 4.13Å; K596-N622 WeakPolarHBondContact CB-O 3.24Å; K596-N622 PolarHBondContact N-O 3.2Å; S597-N622 PolarHBondContact N-O 3.02Å; S597-N622 PolarHBondContact O-N 3.09Å; S597-N622 PolarHBondContact OG-ND2 3.25Å
623	V	95.7	Very high	92.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	167.7	-177.8	-54.1	0	0	0	0	111.6	S561 A562 L564 I592 K594 L595 L615 A621 L625	S561-V623 WeakPolarHBondContact CA-O 3.21Å; S561-V623 PolarHBondContact OG-O 2.81Å; A562-V623 PolarHBondContact N-O 3.05Å; A562-V623 PolarHBondContact O-N 2.93Å; L564-V623 HydrophobicContact CD1-CG1 3.95Å; L564-V623 HydrophobicContact CD1-CG2 3.73Å; L564-V623 HydrophobicContact CG-CG1 4.41Å; L564-V623 HydrophobicContact CG-CG2 3.82Å; I592-V623 HydrophobicContact CG2-CB 4.24Å; I592-V623 HydrophobicContact CG2-CG1 4.31Å; K594-V623 CarbonylContact O-C 3.59Å; K594-V623 VanDerWaalsContact O-CA 3.28Å; K594-V623 WeakPolarHBondContact O-CA 3.43Å; L595-V623 HydrophobicContact CD2-CG1 3.75Å; L615-V623 HydrophobicContact CD1-CG1 4.13Å; A621-V623 HydrophobicContact CB-CG1 4.29Å; V623-L625 HydrophobicContact CG2-CG 4.26Å
624	E	96.2	Very high	92.4	Very high	24 Å²	24	33.2 Å²	33.2	11%	0.112	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	132.9	157.7	-65.8	178.7	169.1	0	0	109.6	I560 I592 T593 K594 K596 I663	I560-E624 CarbonylContact O-C 3.58Å; I560-E624 VanDerWaalsContact O-CA 3.24Å; I560-E624 WeakPolarHBondContact O-CA 3.33Å; I592-E624 CarbonylContact C-O 3.55Å; T593-E624 PolarHBondContact N-O 2.79Å; K594-E624 HydrophobicContact CB-CB 4.18Å; K594-E624 WeakPolarHBondContact CD-OE2 3.17Å; K594-E624 WeakPolarHBondContact CE-OE2 2.93Å; K594-E624 PolarHBondContact N-O 2.84Å; K594-E624 IonicContact NZ-OE2 2.61Å; K594-E624 PolarHBondContact NZ-OE2 2.81Å; K594-E624 PolarHBondContact O-N 3.21Å; K596-E624 HydrophobicContact CD-CG 4.4Å; K596-E624 VanDerWaalsContact CE-CD 3.47Å; K596-E624 WeakPolarHBondContact CE-OE1 3.29Å; K596-E624 VanDerWaalsContact NZ-CG 3.34Å; K596-E624 IonicContact NZ-OE1 2.68Å; K596-E624 PolarHBondContact NZ-OE1 3.36Å; E624-I663 HydrophobicContact CG-CD1 3.9Å; E624-I663 WeakPolarHBondContact OE1-CD1 3.34Å
625	L	95.7	Very high	92.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	144.5	173.8	-75	159	0	0	0	108.4	C559 I560 V579 Y581 T591 I592 V623 F627 F645 L647	C559-L625 WeakPolarHBondContact CA-O 3.41Å; C559-L625 PolarHBondContact SG-O 3.03Å; I560-L625 HydrophobicContact CD1-CD1 4.17Å; I560-L625 HydrophobicContact CG1-CB 3.94Å; I560-L625 HydrophobicContact CG1-CD1 4.4Å; I560-L625 PolarHBondContact N-O 3.47Å; I560-L625 PolarHBondContact O-N 3.48Å; V579-L625 HydrophobicContact CG2-CD2 4.12Å; Y581-L625 HydrophobicContact CD2-CD1 4.04Å; Y581-L625 HydrophobicContact CE2-CD1 3.97Å; T591-L625 WeakPolarHBondContact O-CA 3.28Å; I592-L625 HydrophobicContact CG1-CD2 3.6Å; V623-L625 HydrophobicContact CG2-CG 4.26Å; L625-F627 HydrophobicContact CB-CE1 4.4Å; L625-F645 HydrophobicContact CD1-CE2 3.83Å; L625-F645 HydrophobicContact CD1-CZ 3.79Å; L625-L647 HydrophobicContact CD2-CD1 4.5Å; L625-L647 HydrophobicContact CD2-CD2 4.48Å
626	T	95.9	Very high	92.5	Very high	46 Å²	46	34 Å²	34	28%	0.282	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	132.7	172.4	-54.8	0	0	0	0	109	T558 A590 T591 T593	T558-T626 CarbonylContact O-C 3.15Å; T558-T626 VanDerWaalsContact O-CA 3.3Å; T558-T626 WeakPolarHBondContact O-CA 3.39Å; T558-T626 WeakPolarHBondContact O-CG2 3.46Å; A590-T626 CarbonylContact C-O 3.56Å; A590-T626 VanDerWaalsContact CA-O 3.27Å; A590-T626 WeakPolarHBondContact CA-O 3.15Å; T591-T626 PolarHBondContact N-O 3.03Å; T591-T626 PolarHBondContact O-N 2.97Å; T593-T626 VanDerWaalsContact CG2-OG1 3.24Å; T593-T626 WeakPolarHBondContact CG2-OG1 3.32Å; T593-T626 PolarHBondContact OG1-OG1 2.92Å; T593-T626 VanDerWaalsContact OG1-OG1 3.09Å
627	F	95.2	Very high	92.7	Very high	11 Å²	11	37.5 Å²	37.5	5%	0.048	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	145.7	-174.2	-53.8	-57	0	0	0	111	T558 I560 Y581 V588 A590 L625 R629 I631 I633	T558-F627 PolarHBondContact O-N 3.36Å; I560-F627 HydrophobicContact CD1-CE2 4.25Å; I560-F627 HydrophobicContact CD1-CZ 3.68Å; I560-F627 HydrophobicContact CG1-CE2 3.97Å; I560-F627 HydrophobicContact CG1-CZ 3.73Å; I560-F627 HydrophobicContact CG2-CE2 4.02Å; Y581-F627 HydrophobicContact CD1-CD1 4.44Å; Y581-F627 AromaticContact CD1-CE1 3.69Å; Y581-F627 HydrophobicContact CD1-CE1 3.69Å; Y581-F627 HydrophobicContact CD1-CZ 4.21Å; Y581-F627 AromaticContact CD2-CE1 3.64Å; Y581-F627 HydrophobicContact CD2-CE1 3.64Å; Y581-F627 HydrophobicContact CD2-CZ 4.17Å; Y581-F627 AromaticContact CE1-CE1 3.93Å; Y581-F627 HydrophobicContact CE1-CE1 3.93Å; Y581-F627 AromaticContact CE1-CZ 3.96Å; Y581-F627 HydrophobicContact CE1-CZ 3.96Å; Y581-F627 AromaticContact CE2-CE1 3.85Å; Y581-F627 HydrophobicContact CE2-CE1 3.85Å; Y581-F627 AromaticContact CE2-CZ 3.89Å; Y581-F627 HydrophobicContact CE2-CZ 3.89Å; Y581-F627 HydrophobicContact CG-CD1 4.37Å; Y581-F627 AromaticContact CG-CE1 3.57Å; Y581-F627 HydrophobicContact CG-CE1 3.57Å; Y581-F627 HydrophobicContact CG-CZ 4.34Å; Y581-F627 AromaticContact CZ-CZ 3.81Å; V588-F627 HydrophobicContact CG1-CB 3.99Å; V588-F627 HydrophobicContact CG1-CD1 4.2Å; V588-F627 HydrophobicContact CG1-CG 4.43Å; A590-F627 HydrophobicContact CB-CD1 3.68Å; A590-F627 HydrophobicContact CB-CE1 4.09Å; L625-F627 HydrophobicContact CB-CE1 4.4Å; F627-R629 VanDerWaalsContact C-N 3.35Å; F627-R629 WeakPolarHBondContact CB-O 3.46Å; F627-I631 HydrophobicContact CD1-CD1 3.97Å; F627-I631 HydrophobicContact CD2-CD1 3.74Å; F627-I631 HydrophobicContact CD2-CG1 3.63Å; F627-I631 HydrophobicContact CE1-CD1 3.94Å; F627-I631 HydrophobicContact CE2-CD1 3.68Å; F627-I631 HydrophobicContact CE2-CG1 3.79Å; F627-I631 HydrophobicContact CG-CD1 3.89Å; F627-I631 HydrophobicContact CG-CG1 4.13Å; F627-I631 HydrophobicContact CZ-CD1 3.79Å; F627-I631 HydrophobicContact CZ-CG1 4.41Å; F627-I633 HydrophobicContact CE2-CD1 4.02Å; F627-I633 HydrophobicContact CZ-CD1 4.06Å
628	E	92.3	Very high	92.8	Very high	147 Å²	147	41.4 Å²	41.4	69%	0.687	20%	0.203	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	-34.2	170.7	-68.7	172.2	-164	0	0	112	A589	A589-E628 VanDerWaalsContact CB-CD 3.47Å; A589-E628 HydrophobicContact CB-CG 4.41Å; A589-E628 WeakPolarHBondContact CB-OE1 3.2Å; A589-E628 WeakPolarHBondContact CB-OE2 3.14Å; A589-E628 PolarHBondContact O-N 3.03Å; A589-E628 VanDerWaalsContact O-N 3.16Å
629	R	90.8	Very high	93	Very high	107 Å²	107	40.3 Å²	40.3	40%	0.404	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	139.7	178	-54.4	-163.6	-71.2	134.1	-4.8	110.3	N587 V588 F627 I631	N587-R629 PolarHBondContact O-NH2 3.33Å; V588-R629 HydrophobicContact CG1-CB 4.39Å; V588-R629 HydrophobicContact CG2-CB 4.31Å; F627-R629 VanDerWaalsContact C-N 3.35Å; F627-R629 WeakPolarHBondContact CB-O 3.46Å; R629-I631 PolarHBondContact O-N 3.16Å
630	P	90.9	Very high	93	Very high	72 Å²	72	44 Å²	44	47%	0.468	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	131.1	170.3	28.7	-33.4	0	0	0	110	P556 T558	P556-P630 HydrophobicContact CB-CB 4.43Å; T558-P630 HydrophobicContact CG2-CB 3.9Å
631	I	92.1	Very high	92.9	Very high	5 Å²	5	45.4 Å²	45.4	3%	0.026	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	151	-178.2	56.2	178.8	0	0	0	113	S557 Y581 Y583 V588 F627 R629 I633	S557-I631 PolarHBondContact N-O 3.44Å; S557-I631 PolarHBondContact O-N 2.85Å; Y581-I631 HydrophobicContact CD1-CD1 4Å; Y581-I631 HydrophobicContact CE1-CD1 3.8Å; Y583-I631 HydrophobicContact CD1-CD1 4.32Å; Y583-I631 HydrophobicContact CE1-CD1 4.04Å; Y583-I631 HydrophobicContact CE1-CG2 4.43Å; Y583-I631 WeakPolarHBondContact OH-CG2 3.21Å; V588-I631 HydrophobicContact CG2-CG2 3.8Å; F627-I631 HydrophobicContact CD1-CD1 3.97Å; F627-I631 HydrophobicContact CD2-CD1 3.74Å; F627-I631 HydrophobicContact CD2-CG1 3.63Å; F627-I631 HydrophobicContact CE1-CD1 3.94Å; F627-I631 HydrophobicContact CE2-CD1 3.68Å; F627-I631 HydrophobicContact CE2-CG1 3.79Å; F627-I631 HydrophobicContact CG-CD1 3.89Å; F627-I631 HydrophobicContact CG-CG1 4.13Å; F627-I631 HydrophobicContact CZ-CD1 3.79Å; F627-I631 HydrophobicContact CZ-CG1 4.41Å; R629-I631 PolarHBondContact O-N 3.16Å; I631-I633 HydrophobicContact CD1-CD1 3.55Å; I631-I633 HydrophobicContact CD1-CG1 4.32Å; I631-I633 HydrophobicContact CG1-CD1 3.74Å; I631-I633 HydrophobicContact CG1-CG1 4.26Å
632	C	91.7	Very high	92.7	Very high	8 Å²	8	45.4 Å²	45.4	5%	0.054	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	111.4	-176.4	-59.5	0	0	0	0	110	L482 L546 I554	L482-C632 HydrophobicContact CB-CB 4.44Å; L546-C632 HydrophobicContact CD1-CB 3.92Å; L546-C632 WeakPolarHBondContact CD1-O 3.3Å; L546-C632 HydrophobicContact CG-CB 4.46Å; I554-C632 HydrophobicContact CB-CB 4.48Å; I554-C632 HydrophobicContact CG2-CB 3.88Å
633	I	91.8	Very high	92.6	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.01	21%	0.208	C	C	.	.			trans	-138.1	152.1	-178	-57.7	160.4	0	0	0	108.3	Y581 F627 I631 L642 V659 I662	Y581-I633 HydrophobicContact CE1-CD1 3.89Å; Y581-I633 VanDerWaalsContact OH-CD1 3.3Å; Y581-I633 WeakPolarHBondContact OH-CD1 3.45Å; F627-I633 HydrophobicContact CE2-CD1 4.02Å; F627-I633 HydrophobicContact CZ-CD1 4.06Å; I631-I633 HydrophobicContact CD1-CD1 3.55Å; I631-I633 HydrophobicContact CD1-CG1 4.32Å; I631-I633 HydrophobicContact CG1-CD1 3.74Å; I631-I633 HydrophobicContact CG1-CG1 4.26Å; I633-L642 WeakPolarHBondContact CG2-O 3.3Å; I633-V659 HydrophobicContact CG2-CB 4.41Å; I633-V659 HydrophobicContact CG2-CG1 4.5Å; I633-V659 HydrophobicContact CG2-CG2 3.79Å; I633-I662 VanDerWaalsContact O-CD1 3.23Å; I633-I662 WeakPolarHBondContact O-CD1 3.31Å
634	E	92.3	Very high	92.5	Very high	5 Å²	5	43.3 Å²	43.3	2%	0.023	21%	0.211	C	C	.	.			trans	-108.6	159.6	169.2	-70.8	-156.9	175	0	0	112.9	R442 I554 K638 C639 L642 G643	R442-E634 IonicContact CZ-OE1 2.75Å; R442-E634 IonicContact CZ-OE2 2.84Å; R442-E634 VanDerWaalsContact NE-CD 3.28Å; R442-E634 IonicContact NE-OE1 3.75Å; R442-E634 PolarHBondContact NE-OE1 3.09Å; R442-E634 IonicContact NE-OE2 3.47Å; R442-E634 PolarHBondContact NE-OE2 3.48Å; R442-E634 VanDerWaalsContact NH2-CD 3.35Å; R442-E634 IonicContact NH2-OE1 3.21Å; R442-E634 PolarHBondContact NH2-OE1 2.95Å; R442-E634 IonicContact NH2-OE2 3.44Å; R442-E634 PolarHBondContact NH2-OE2 2.83Å; I554-E634 HydrophobicContact CD1-CG 3.86Å; I554-E634 HydrophobicContact CG1-CG 3.94Å; I554-E634 WeakPolarHBondContact CG1-OE1 3.45Å; I554-E634 HydrophobicContact CG2-CG 4.29Å; E634-K638 WeakPolarHBondContact OE1-CE 3.35Å; E634-K638 IonicContact OE1-NZ 2.73Å; E634-K638 PolarHBondContact OE1-NZ 3.46Å; E634-K638 WeakPolarHBondContact OE2-CD 3.2Å; E634-K638 VanDerWaalsContact OE2-CG 3.28Å; E634-K638 WeakPolarHBondContact OE2-CG 3.2Å; E634-K638 IonicContact OE2-NZ 3.85Å; E634-C639 HydrophobicContact CB-CB 4.04Å; E634-C639 VanDerWaalsContact OE2-CB 3.24Å; E634-C639 WeakPolarHBondContact OE2-CB 3.44Å; E634-L642 HydrophobicContact CB-CB 4.4Å; E634-L642 HydrophobicContact CG-CD1 4.27Å; E634-G643 WeakPolarHBondContact O-CA 3.5Å
635	V	94.2	Very high	92.4	Very high	34 Å²	34	42.2 Å²	42.2	21%	0.206	21%	0.206	C	C	.	.			trans	-63.8	136.2	167.3	178.3	0	0	0	0	109	E637 K638 C639 I662	V635-E637 HydrophobicContact CG1-CB 4.26Å; V635-E637 PolarHBondContact O-N 2.82Å; V635-E637 VanDerWaalsContact O-N 3.11Å; V635-K638 PolarHBondContact O-N 2.88Å; V635-C639 PolarHBondContact O-N 2.97Å; V635-C639 VanDerWaalsContact O-N 3.14Å; V635-I662 HydrophobicContact CG2-CD1 4.37Å; V635-I662 HydrophobicContact CG2-CG1 4.16Å
636	Y	93	Very high	92.4	Very high	24 Å²	24	42.2 Å²	42.2	9%	0.094	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-33.4	-175.8	173.3	-98	0	0	0	114	P70 C639 K640 R644 T658 V659	P70-Y636 HydrophobicContact CG-CE1 3.92Å; P70-Y636 WeakPolarHBondContact CG-OH 3.39Å; P70-Y636 PolarHBondContact O-OH 2.84Å; P70-Y636 VanDerWaalsContact O-OH 3.06Å; Y636-C639 CarbonylContact O-C 3.52Å; Y636-K640 HydrophobicContact CD2-CB 4.47Å; Y636-K640 WeakPolarHBondContact CD2-O 3.29Å; Y636-K640 HydrophobicContact CE2-CB 4.06Å; Y636-K640 HydrophobicContact CE2-CG 4.32Å; Y636-K640 WeakPolarHBondContact O-CA 3.45Å; Y636-K640 PolarHBondContact O-N 2.83Å; Y636-R644 HydrophobicContact CD2-CG 4.04Å; Y636-R644 HydrophobicContact CE2-CG 3.89Å; Y636-T658 HydrophobicContact CD1-CG2 4.33Å; Y636-T658 HydrophobicContact CD2-CG2 3.63Å; Y636-T658 HydrophobicContact CE2-CG2 3.84Å; Y636-T658 HydrophobicContact CG-CG2 3.89Å; Y636-V659 WeakPolarHBondContact CB-O 3.45Å; Y636-V659 PolarHBondContact N-O 3.44Å
637	E	91.7	Very high	92.3	Very high	172 Å²	172	40 Å²	40	80%	0.804	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-31.5	176	-63.3	168.6	-175.1	0	0	113.2	V635	V635-E637 HydrophobicContact CG1-CB 4.26Å; V635-E637 PolarHBondContact O-N 2.82Å; V635-E637 VanDerWaalsContact O-N 3.11Å
638	K	90.5	Very high	92.2	Very high	105 Å²	105	39.7 Å²	39.7	46%	0.457	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-30.3	178.5	-168.3	-168.6	167.5	-147.3	0	112.4	R442 N552 E634 V635	R442-K638 PolarHBondContact NH2-O 2.89Å; N552-K638 PolarHBondContact OD1-NZ 2.61Å; E634-K638 WeakPolarHBondContact OE1-CE 3.35Å; E634-K638 IonicContact OE1-NZ 2.73Å; E634-K638 PolarHBondContact OE1-NZ 3.46Å; E634-K638 WeakPolarHBondContact OE2-CD 3.2Å; E634-K638 VanDerWaalsContact OE2-CG 3.28Å; E634-K638 WeakPolarHBondContact OE2-CG 3.2Å; E634-K638 IonicContact OE2-NZ 3.85Å; V635-K638 PolarHBondContact O-N 2.88Å
639	C	90	Very high	92.2	Very high	10 Å²	10	35 Å²	35	7%	0.068	17%	0.172	C	C	.	.			trans	-154.5	97.8	177.6	-170	0	0	0	0	110.9	E634 V635 Y636 L642 G643	E634-C639 HydrophobicContact CB-CB 4.04Å; E634-C639 VanDerWaalsContact OE2-CB 3.24Å; E634-C639 WeakPolarHBondContact OE2-CB 3.44Å; V635-C639 PolarHBondContact O-N 2.97Å; V635-C639 VanDerWaalsContact O-N 3.14Å; Y636-C639 CarbonylContact O-C 3.52Å; C639-L642 HydrophobicContact CB-CB 4.28Å; C639-L642 HydrophobicContact CB-CD1 4.42Å; C639-L642 PolarHBondContact O-N 3.09Å; C639-G643 PolarHBondContact O-N 3.44Å
640	K	90.2	Very high	92	Very high	78 Å²	78	33.5 Å²	33.5	34%	0.339	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-42.1	-175.7	-62.9	-178.8	-175.4	177.2	0	113.7	N72 Y636 R644	N72-K640 WeakPolarHBondContact OD1-CD 3.31Å; Y636-K640 HydrophobicContact CD2-CB 4.47Å; Y636-K640 WeakPolarHBondContact CD2-O 3.29Å; Y636-K640 HydrophobicContact CE2-CB 4.06Å; Y636-K640 HydrophobicContact CE2-CG 4.32Å; Y636-K640 WeakPolarHBondContact O-CA 3.45Å; Y636-K640 PolarHBondContact O-N 2.83Å; K640-R644 WeakPolarHBondContact O-CD 3.31Å; K640-R644 VanDerWaalsContact O-CG 3.28Å; K640-R644 WeakPolarHBondContact O-CG 3.4Å; K640-R644 PolarHBondContact O-NE 2.74Å
641	P	90.1	Very high	91.7	Very high	42 Å²	42	31.9 Å²	31.9	27%	0.273	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-49	-179.9	-23.7	37.6	0	0	0	113.4	I464 G643 R644	I464-P641 HydrophobicContact CG2-CB 4.07Å; I464-P641 HydrophobicContact CG2-CG 3.89Å; P641-G643 VanDerWaalsContact C-N 3.28Å; P641-G643 PolarHBondContact O-N 3.38Å; P641-R644 PolarHBondContact O-N 3.03Å
642	L	92.1	Very high	91.4	Very high	4 Å²	4	35.7 Å²	35.7	2%	0.021	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-29.1	-178.2	-64.8	-178.5	0	0	0	112.9	V444 L546 I554 N584 I633 E634 C639 R644	V444-L642 HydrophobicContact CG2-CD2 3.76Å; L546-L642 HydrophobicContact CD1-CD1 4.1Å; L546-L642 HydrophobicContact CD1-CD2 4.33Å; L546-L642 HydrophobicContact CD2-CD2 3.89Å; I554-L642 HydrophobicContact CD1-CD1 3.89Å; N584-L642 WeakPolarHBondContact OD1-CD2 3.24Å; I633-L642 WeakPolarHBondContact CG2-O 3.3Å; E634-L642 HydrophobicContact CB-CB 4.4Å; E634-L642 HydrophobicContact CG-CD1 4.27Å; C639-L642 HydrophobicContact CB-CB 4.28Å; C639-L642 HydrophobicContact CB-CD1 4.42Å; C639-L642 PolarHBondContact O-N 3.09Å; L642-R644 VanDerWaalsContact C-N 3.29Å; L642-R644 PolarHBondContact O-N 3.29Å
643	G	92.3	Very high	91.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	2.4	178.9	0	0	0	0	0	115.3	E634 C639 P641 T658 V659	E634-G643 WeakPolarHBondContact O-CA 3.5Å; C639-G643 PolarHBondContact O-N 3.44Å; P641-G643 VanDerWaalsContact C-N 3.28Å; P641-G643 PolarHBondContact O-N 3.38Å; G643-T658 CarbonylContact O-C 3.56Å; G643-T658 VanDerWaalsContact O-CA 3.26Å; G643-T658 WeakPolarHBondContact O-CA 3.27Å; G643-V659 PolarHBondContact O-N 2.85Å
644	R	93.8	Very high	91.4	Very high	14 Å²	14	36.6 Å²	36.6	5%	0.053	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	139.5	176.5	-70.5	166	-176.2	159.9	5.5	110.7	N72 L340 L341 G342 Y636 K640 P641 L642	N72-R644 PolarHBondContact OD1-NH2 3.49Å; L340-R644 WeakPolarHBondContact O-CD 3.2Å; L341-R644 WeakPolarHBondContact O-CD 3.36Å; L341-R644 PolarHBondContact O-NH1 3.34Å; G342-R644 VanDerWaalsContact CA-NH1 3.34Å; G342-R644 PolarHBondContact O-NH1 3.35Å; G342-R644 VanDerWaalsContact O-NH1 3.14Å; Y636-R644 HydrophobicContact CD2-CG 4.04Å; Y636-R644 HydrophobicContact CE2-CG 3.89Å; K640-R644 WeakPolarHBondContact O-CD 3.31Å; K640-R644 VanDerWaalsContact O-CG 3.28Å; K640-R644 WeakPolarHBondContact O-CG 3.4Å; K640-R644 PolarHBondContact O-NE 2.74Å; P641-R644 PolarHBondContact O-N 3.03Å; L642-R644 VanDerWaalsContact C-N 3.29Å; L642-R644 PolarHBondContact O-N 3.29Å
645	F	94.4	Very high	91.4	Very high	1 Å²	1	36.3 Å²	36.3	0%	0.004	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	167.1	178.1	68.1	-93	0	0	0	113	A562 L564 Y581 Y582 L625 L647 G657 V659	A562-F645 HydrophobicContact CB-CE1 3.62Å; A562-F645 HydrophobicContact CB-CZ 3.52Å; L564-F645 HydrophobicContact CD2-CE2 3.53Å; L564-F645 HydrophobicContact CD2-CZ 3.51Å; Y581-F645 HydrophobicContact CD2-CB 4.44Å; Y581-F645 AromaticContact CD2-CD2 3.65Å; Y581-F645 HydrophobicContact CD2-CD2 3.65Å; Y581-F645 HydrophobicContact CD2-CE2 4.07Å; Y581-F645 HydrophobicContact CD2-CG 4.13Å; Y581-F645 HydrophobicContact CE1-CB 4.27Å; Y581-F645 HydrophobicContact CE2-CB 3.69Å; Y581-F645 AromaticContact CE2-CD1 3.79Å; Y581-F645 HydrophobicContact CE2-CD1 3.79Å; Y581-F645 AromaticContact CE2-CD2 3.2Å; Y581-F645 HydrophobicContact CE2-CD2 3.2Å; Y581-F645 HydrophobicContact CE2-CE1 4.17Å; Y581-F645 AromaticContact CE2-CE2 3.65Å; Y581-F645 HydrophobicContact CE2-CE2 3.65Å; Y581-F645 AromaticContact CE2-CG 3.28Å; Y581-F645 HydrophobicContact CE2-CG 3.28Å; Y581-F645 HydrophobicContact CE2-CZ 4.1Å; Y581-F645 AromaticContact CZ-CG 3.6Å; Y581-F645 WeakPolarHBondContact OH-CB 3.07Å; Y581-F645 WeakPolarHBondContact OH-CD1 3.39Å; Y581-F645 WeakPolarHBondContact OH-CG 3.16Å; Y582-F645 WeakPolarHBondContact O-CA 3.29Å; Y582-F645 WeakPolarHBondContact O-CB 3.27Å; L625-F645 HydrophobicContact CD1-CE2 3.83Å; L625-F645 HydrophobicContact CD1-CZ 3.79Å; F645-L647 HydrophobicContact CD2-CD2 4.04Å; F645-L647 HydrophobicContact CD2-CG 4.3Å; F645-L647 HydrophobicContact CE2-CD1 4.43Å; F645-L647 HydrophobicContact CE2-CD2 3.94Å; F645-L647 HydrophobicContact CE2-CG 4.01Å; F645-G657 WeakPolarHBondContact CD1-O 3.45Å; F645-G657 VanDerWaalsContact CE1-C 3.48Å; F645-G657 PolarHBondContact N-O 2.86Å; F645-G657 PolarHBondContact O-N 2.84Å; F645-V659 HydrophobicContact CD1-CG2 3.82Å; F645-V659 HydrophobicContact CE1-CG2 3.88Å
646	M	94.3	Very high	91.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	147.5	177.8	-72.6	-63.9	-51.3	0	0	111.4	I301 L337 L340 L341 F567 Y582 A655 G656	I301-M646 HydrophobicContact CD1-CB 4.33Å; L337-M646 HydrophobicContact CD2-CE 3.47Å; L337-M646 VanDerWaalsContact CD2-CE 3.47Å; L337-M646 HydrophobicContact CD2-CG 4.06Å; L337-M646 HydrophobicContact CD2-SD 3.91Å; L340-M646 HydrophobicContact CB-SD 4.03Å; L340-M646 HydrophobicContact CD1-CE 4.29Å; L340-M646 HydrophobicContact CD1-SD 3.74Å; L341-M646 HydrophobicContact CD2-CG 3.91Å; L341-M646 HydrophobicContact CG-CG 4.43Å; F567-M646 HydrophobicContact CE2-CE 3.86Å; F567-M646 HydrophobicContact CZ-CE 3.86Å; Y582-M646 PolarHBondContact N-O 3.47Å; Y582-M646 PolarHBondContact O-N 3.12Å; M646-A655 WeakPolarHBondContact CE-O 3.44Å; M646-G656 VanDerWaalsContact SD-CA 3.59Å
647	L	95	Very high	91.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	127.9	173.4	-58	-175.6	0	0	0	110.1	L564 V579 I580 Y581 I592 L625 F645 I654 A655	L564-L647 HydrophobicContact CD1-CD1 3.88Å; L564-L647 HydrophobicContact CD2-CD1 3.91Å; V579-L647 HydrophobicContact CB-CB 4.46Å; V579-L647 HydrophobicContact CB-CD2 4.39Å; V579-L647 HydrophobicContact CG2-CD1 4.29Å; V579-L647 HydrophobicContact CG2-CD2 3.85Å; I580-L647 WeakPolarHBondContact O-CA 3.24Å; Y581-L647 HydrophobicContact CD2-CD2 3.68Å; Y581-L647 HydrophobicContact CG-CD2 4.36Å; I592-L647 HydrophobicContact CD1-CD1 4.23Å; L625-L647 HydrophobicContact CD2-CD1 4.5Å; L625-L647 HydrophobicContact CD2-CD2 4.48Å; F645-L647 HydrophobicContact CD2-CD2 4.04Å; F645-L647 HydrophobicContact CD2-CG 4.3Å; F645-L647 HydrophobicContact CE2-CD1 4.43Å; F645-L647 HydrophobicContact CE2-CD2 3.94Å; F645-L647 HydrophobicContact CE2-CG 4.01Å; L647-I654 PolarHBondContact O-N 3.21Å; L647-A655 HydrophobicContact CB-CB 4.39Å; L647-A655 HydrophobicContact CD1-CB 4.28Å; L647-A655 PolarHBondContact N-O 3.44Å; L647-A655 PolarHBondContact O-N 3.23Å
648	R	93.1	Very high	91.5	Very high	4 Å²	4	25.8 Å²	25.8	2%	0.015	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	153.8	171.8	-48.8	-179.5	78	87.1	2.4	112	E333 I580 Y582 G651 E652 S653	E333-R648 IonicContact OE1-CZ 2.7Å; E333-R648 IonicContact OE1-NH1 2.67Å; E333-R648 PolarHBondContact OE1-NH1 2.88Å; E333-R648 IonicContact OE1-NH2 2.69Å; E333-R648 PolarHBondContact OE1-NH2 3.25Å; E333-R648 IonicContact OE2-NH2 3.28Å; I580-R648 PolarHBondContact N-O 3.25Å; I580-R648 PolarHBondContact O-N 3.34Å; Y582-R648 HydrophobicContact CD2-CB 4.35Å; Y582-R648 HydrophobicContact CD2-CG 3.86Å; Y582-R648 HydrophobicContact CE2-CB 3.77Å; Y582-R648 VanDerWaalsContact CE2-CD 3.47Å; Y582-R648 HydrophobicContact CE2-CG 3.57Å; R648-G651 PolarHBondContact NH2-O 3.48Å; R648-E652 WeakPolarHBondContact CA-O 3.17Å; R648-E652 VanDerWaalsContact CB-O 3.29Å; R648-E652 WeakPolarHBondContact CB-O 3.31Å; R648-S653 PolarHBondContact NH1-OG 3.34Å
649	V	92.7	Very high	91.8	Very high	48 Å²	48	20.8 Å²	20.8	29%	0.291	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	146.1	163.3	176.3	0	0	0	0	107.7	Y577 P578 V579 G651 E652 I654	Y577-V649 HydrophobicContact CE1-CG2 3.96Å; P578-V649 VanDerWaalsContact O-CG2 3.31Å; P578-V649 WeakPolarHBondContact O-CG2 3.45Å; V579-V649 HydrophobicContact CB-CG2 4.35Å; V579-V649 HydrophobicContact CG1-CG2 4.08Å; V649-G651 PolarHBondContact O-N 3.16Å; V649-G651 VanDerWaalsContact O-N 3.13Å; V649-E652 PolarHBondContact N-O 2.81Å; V649-E652 VanDerWaalsContact N-O 3.16Å; V649-E652 PolarHBondContact O-N 3.27Å; V649-I654 HydrophobicContact CB-CD1 3.68Å; V649-I654 HydrophobicContact CG2-CD1 3.76Å
650	G	86.2	Confident	92	Very high	75 Å²	75	23 Å²	23	77%	0.773	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	28.9	172.8	0	0	0	0	0	114.8	E652	G650-E652 VanDerWaalsContact C-N 3.28Å; G650-E652 PolarHBondContact O-N 3.36Å
651	G	84.2	Confident	92.2	Very high	39 Å²	39	25.7 Å²	25.7	40%	0.402	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	77	2	-174.8	0	0	0	0	0	115.2	R648 V649	R648-G651 PolarHBondContact NH2-O 3.48Å; V649-G651 PolarHBondContact O-N 3.16Å; V649-G651 VanDerWaalsContact O-N 3.13Å
652	E	86.9	Confident	92.3	Very high	84 Å²	84	26 Å²	26	39%	0.393	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	142	-177.8	-51	-143.8	130.4	0	0	112.9	K294 R648 V649 G650 I654	K294-E652 IonicContact NZ-OE1 2.69Å; K294-E652 PolarHBondContact NZ-OE1 3.43Å; R648-E652 WeakPolarHBondContact CA-O 3.17Å; R648-E652 VanDerWaalsContact CB-O 3.29Å; R648-E652 WeakPolarHBondContact CB-O 3.31Å; V649-E652 PolarHBondContact N-O 2.81Å; V649-E652 VanDerWaalsContact N-O 3.16Å; V649-E652 PolarHBondContact O-N 3.27Å; G650-E652 VanDerWaalsContact C-N 3.28Å; G650-E652 PolarHBondContact O-N 3.36Å; E652-I654 PolarHBondContact O-N 3.34Å
653	S	89.7	Confident	92.2	Very high	17 Å²	17	27.8 Å²	27.8	12%	0.119	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	120.1	171	-68	0	0	0	0	111.6	E333 F567 R648	E333-S653 WeakPolarHBondContact OE1-CB 3.46Å; E333-S653 PolarHBondContact OE1-OG 2.77Å; F567-S653 WeakPolarHBondContact CD2-O 3.48Å; R648-S653 PolarHBondContact NH1-OG 3.34Å
654	I	92	Very high	91.5	Very high	12 Å²	12	32.5 Å²	32.5	6%	0.062	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-42.9	-178.9	-77.6	179.8	0	0	0	112.2	F567 I569 I573 Y577 L647 V649 E652	F567-I654 WeakPolarHBondContact CB-O 3.36Å; F567-I654 WeakPolarHBondContact CG-O 3.44Å; F567-I654 PolarHBondContact N-O 2.92Å; I569-I654 HydrophobicContact CD1-CG2 4.39Å; I569-I654 HydrophobicContact CG2-CB 4.2Å; I569-I654 HydrophobicContact CG2-CG1 4Å; I569-I654 HydrophobicContact CG2-CG2 4.2Å; I573-I654 HydrophobicContact CD1-CG2 3.61Å; I573-I654 HydrophobicContact CG1-CG2 4.14Å; Y577-I654 HydrophobicContact CE1-CD1 3.86Å; L647-I654 PolarHBondContact O-N 3.21Å; V649-I654 HydrophobicContact CB-CD1 3.68Å; V649-I654 HydrophobicContact CG2-CD1 3.76Å; E652-I654 PolarHBondContact O-N 3.34Å
655	A	93.2	Very high	90.2	Very high	0 Å²	0	35 Å²	35	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	153.2	-178	0	0	0	0	0	111.7	L564 L565 F567 M646 L647	L564-A655 HydrophobicContact CB-CB 4.47Å; L564-A655 HydrophobicContact CD1-CB 4.46Å; L565-A655 WeakPolarHBondContact O-CA 3.48Å; L565-A655 VanDerWaalsContact O-CB 3.28Å; L565-A655 WeakPolarHBondContact O-CB 3.23Å; F567-A655 VanDerWaalsContact CZ-C 3.49Å; M646-A655 WeakPolarHBondContact CE-O 3.44Å; L647-A655 HydrophobicContact CB-CB 4.39Å; L647-A655 HydrophobicContact CD1-CB 4.28Å; L647-A655 PolarHBondContact N-O 3.44Å; L647-A655 PolarHBondContact O-N 3.23Å
656	G	93.5	Very high	88.3	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	156.6	160.8	0	0	0	0	0	109.5	L564 L565 F567 M646	L564-G656 WeakPolarHBondContact CA-O 3.36Å; L565-G656 PolarHBondContact N-O 3.29Å; L565-G656 PolarHBondContact O-N 3.02Å; F567-G656 VanDerWaalsContact CE1-N 3.35Å; M646-G656 VanDerWaalsContact SD-CA 3.59Å
657	G	93.5	Very high	86	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.01	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	165.5	-177.7	0	0	0	0	0	115.9	K563 F645	K563-G657 CarbonylContact O-C 3.48Å; K563-G657 WeakPolarHBondContact O-CA 3.41Å; F645-G657 WeakPolarHBondContact CD1-O 3.45Å; F645-G657 VanDerWaalsContact CE1-C 3.48Å; F645-G657 PolarHBondContact N-O 2.86Å; F645-G657 PolarHBondContact O-N 2.84Å
658	T	95	Very high	83	Confident	8 Å²	8	62 Å²	62	5%	0.049	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	135.2	173.9	51.3	0	0	0	0	110.9	F69 A562 K563 Y636 G643 T660	F69-T658 HydrophobicContact CD1-CG2 4.02Å; F69-T658 HydrophobicContact CE1-CG2 3.94Å; A562-T658 CarbonylContact C-O 3.45Å; A562-T658 VanDerWaalsContact CA-O 3.27Å; A562-T658 WeakPolarHBondContact CA-O 3.33Å; A562-T658 WeakPolarHBondContact CB-O 3.44Å; K563-T658 PolarHBondContact N-O 3.2Å; K563-T658 PolarHBondContact O-N 3.49Å; Y636-T658 HydrophobicContact CD1-CG2 4.33Å; Y636-T658 HydrophobicContact CD2-CG2 3.63Å; Y636-T658 HydrophobicContact CE2-CG2 3.84Å; Y636-T658 HydrophobicContact CG-CG2 3.89Å; G643-T658 CarbonylContact O-C 3.56Å; G643-T658 VanDerWaalsContact O-CA 3.26Å; G643-T658 WeakPolarHBondContact O-CA 3.27Å; T658-T660 PolarHBondContact O-N 3.44Å
659	V	95.5	Very high	80.1	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	117.9	179.3	-177.2	0	0	0	0	109.7	I560 I633 Y636 G643 F645	I560-V659 HydrophobicContact CB-CG1 4.33Å; I560-V659 HydrophobicContact CD1-CG1 4.29Å; I560-V659 HydrophobicContact CD1-CG2 3.76Å; I560-V659 HydrophobicContact CG2-CG1 4.37Å; I633-V659 HydrophobicContact CG2-CB 4.41Å; I633-V659 HydrophobicContact CG2-CG1 4.5Å; I633-V659 HydrophobicContact CG2-CG2 3.79Å; Y636-V659 WeakPolarHBondContact CB-O 3.45Å; Y636-V659 PolarHBondContact N-O 3.44Å; G643-V659 PolarHBondContact O-N 2.85Å; F645-V659 HydrophobicContact CD1-CG2 3.82Å; F645-V659 HydrophobicContact CE1-CG2 3.88Å
660	T	95	Very high	77.4	Confident	57 Å²	57	69.7 Å²	69.7	35%	0.35	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-28.6	-176.8	55.3	0	0	0	0	113	S561 K563 T658	S561-T660 PolarHBondContact O-N 2.86Å; S561-T660 PolarHBondContact O-OG1 3.15Å; K563-T660 HydrophobicContact CB-CG2 4.04Å; T658-T660 PolarHBondContact O-N 3.44Å
661	K	94.1	Very high	74.7	Confident	134 Å²	134	75.3 Å²	75.3	58%	0.583	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-156.5	127.4	173	176.7	165.4	-178.3	168.4	0	111.7	S561	S561-K661 PolarHBondContact N-O 3.38Å; S561-K661 PolarHBondContact O-N 3.14Å; S561-K661 VanDerWaalsContact O-N 3.09Å
662	I	92.3	Very high	74.2	Confident	49 Å²	49	77.1 Å²	77.1	25%	0.251	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	133.4	166.9	-57	165.3	0	0	0	108.3	I633 V635	I633-I662 VanDerWaalsContact O-CD1 3.23Å; I633-I662 WeakPolarHBondContact O-CD1 3.31Å; V635-I662 HydrophobicContact CG2-CD1 4.37Å; V635-I662 HydrophobicContact CG2-CG1 4.16Å
663	I	88.9	Confident	73.5	Confident	40 Å²	40	76.7 Å²	76.7	21%	0.205	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	112.2	176.1	-59.9	172.9	0	0	0	106.6	C559 E624 S665	C559-I663 HydrophobicContact CB-CB 4.15Å; C559-I663 HydrophobicContact CB-CG2 4.43Å; C559-I663 WeakPolarHBondContact O-CB 3.44Å; C559-I663 PolarHBondContact O-N 3.45Å; E624-I663 HydrophobicContact CG-CD1 3.9Å; E624-I663 WeakPolarHBondContact OE1-CD1 3.34Å; I663-S665 PolarHBondContact O-N 2.99Å
664	P	78.5	Confident	72.7	Confident	99 Å²	99	80.1 Å²	80.1	64%	0.643	44%	0.444	S	S	*	.			trans	-59.7	136.7	175.7	26.3	-33.5	0	0	0	108.8	K666	P664-K666 PolarHBondContact O-N 3.38Å
665	S	66.4	Low	71.5	Confident	68 Å²	68	84.1 Å²	84.1	48%	0.476	47%	0.467	S	S	.	.			trans	-56.4	133.1	167.4	45.8	0	0	0	0	108.1	I663 K667	I663-S665 PolarHBondContact O-N 2.99Å; S665-K667 VanDerWaalsContact C-N 3.34Å; S665-K667 PolarHBondContact O-N 3.14Å
666	K	54.5	Low	70.2	Confident	204 Å²	204	89.3 Å²	89.3	89%	0.887	50%	0.496	S	S	*	.			trans	-65.6	102	167.2	-76.8	-170.4	173.4	-168.6	0	106.7	P664 E668	P664-K666 PolarHBondContact O-N 3.38Å; K666-E668 PolarHBondContact O-N 3.21Å
667	K	45.8	Very low	68.6	Low	186 Å²	186	95.3 Å²	95.3	81%	0.809	53%	0.529	S	S	*	.			trans	-52.5	135.4	153.3	-71.9	-172.2	174.8	-175.1	0	106.6	S665 S669	S665-K667 VanDerWaalsContact C-N 3.34Å; S665-K667 PolarHBondContact O-N 3.14Å; K667-S669 VanDerWaalsContact C-N 3.29Å; K667-S669 PolarHBondContact O-N 2.72Å
668	E	32.8	Very low	66.8	Low	176 Å²	176	102 Å²	102	82%	0.822	57%	0.566	S	S	*	*			trans	-69.3	90.5	-177.6	-67.9	-178.6	134.2	0	0	109.1	K666 S670	K666-E668 PolarHBondContact O-N 3.21Å; E668-S670 PolarHBondContact O-N 2.89Å
669	S	30.7	Very low	64.7	Low	128 Å²	128	109.2 Å²	109.2	90%	0.895	61%	0.605	S	S	*	*			trans	-80.1	57.1	169.8	64.6	0	0	0	0	109.3	K667	K667-S669 VanDerWaalsContact C-N 3.29Å; K667-S669 PolarHBondContact O-N 2.72Å
670	S	35.9	Very low	62.1	Low	87 Å²	87	118.3 Å²	118.3	61%	0.608	66%	0.656	S	S	*	*			trans	-111.4	124.7	169	45.3	0	0	0	0	107.8	E668	E668-S670 PolarHBondContact O-N 2.89Å
671	S	30.2	Very low	59.1	Low	192 Å²	192	123.9 Å²	123.9	100%	1.343	68%	0.684	S	S	*	*			trans	-38.5	0	170.1	54.1	0	0	0	0	114.8

Retrieved 671 of 671 residues in 205.9 ms (Link to these results)

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