A0A060WYR9_ONCMY Loading...

Kelch-like protein 25

AlphaFold DB , UniProt , Accession A0A060WYR9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene enc2, Length 627 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	35.3	Very low	30.7	Very low	249 Å²	249	156.5 Å²	156.5	100%	1.227	87%	0.868	S	S	*	*				0	96.9	0	-80.1	171.7	169.6	0	0	107.1
2	Q	29.8	Very low	30.4	Very low	199 Å²	199	151 Å²	151	93%	0.93	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-100	131.3	-173.1	-78.8	167.8	-33.9	0	0	109.2
3	T	31.3	Very low	29.9	Very low	136 Å²	136	148.2 Å²	148.2	83%	0.834	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-88.8	141.1	166.2	43.2	0	0	0	0	110
4	P	39	Very low	29.5	Very low	120 Å²	120	145.8 Å²	145.8	78%	0.779	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-91.9	164.3	-176.9	36.6	-33.7	0	0	0	113.4
5	P	40.2	Very low	29	Very low	131 Å²	131	151.3 Å²	151.3	85%	0.851	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-100.1	172.1	-174.8	38.3	-31.4	0	0	0	114.9
6	Q	29.4	Very low	28.7	Very low	197 Å²	197	148.9 Å²	148.9	92%	0.921	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-81.1	160.7	-164.4	-70.6	172.6	-40.4	0	0	116.6
7	I	30.1	Very low	28.5	Very low	153 Å²	153	145.3 Å²	145.3	79%	0.785	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-51.8	144.1	172.2	-62.2	156.6	0	0	0	114
8	L	25	Very low	28.2	Very low	165 Å²	165	144.9 Å²	144.9	86%	0.864	82%	0.816	S	S	*	*			trans	-159.6	126.1	144.6	-104.7	158.3	0	0	0	111.9
9	T	27.1	Very low	28	Very low	123 Å²	123	146.7 Å²	146.7	76%	0.755	81%	0.814	S	S	*	*			trans	-83.2	142	174	40.4	0	0	0	0	112
10	V	26.4	Very low	27.8	Very low	136 Å²	136	145.7 Å²	145.7	82%	0.824	82%	0.816	S	S	*	*			trans	-136.2	107	173.9	-178.6	0	0	0	0	106.7
11	S	24.3	Very low	27.6	Very low	112 Å²	112	148.8 Å²	148.8	78%	0.783	82%	0.815	S	S	*	*				58.7	108	78.4	-165	0	0	0	0	115.7
12	A	26.4	Very low	27.1	Very low	91 Å²	91	144.6 Å²	144.6	75%	0.752	80%	0.797	S	S	*	*			trans	-83.6	142.9	167.8	0	0	0	0	0	111.4
13	C	24	Very low	26.8	Very low	115 Å²	115	138.6 Å²	138.6	78%	0.777	79%	0.789	S	S	*	*			trans	-175.3	124	152.2	-110.6	0	0	0	0	113.9
14	T	24.8	Very low	26.4	Very low	114 Å²	114	141.3 Å²	141.3	70%	0.699	79%	0.792	S	S	*	*			trans	70.7	152.8	131.6	41.6	0	0	0	0	126.2
15	W	22	Very low	25.7	Very low	228 Å²	228	143.7 Å²	143.7	86%	0.864	80%	0.796	S	S	*	*			trans	107.3	104.5	163.4	-67.1	85.2	0	0	0	115.2
16	V	24.8	Very low	25	Very low	114 Å²	114	146.1 Å²	146.1	69%	0.691	80%	0.796	S	S	*	*			cis	87	115.5	48.6	-179.7	0	0	0	0	114.9
17	S	25.2	Very low	24.8	Very low	87 Å²	87	143.6 Å²	143.6	61%	0.608	79%	0.794	S	S	*	*			trans	64.7	129.2	148.5	68.9	0	0	0	0	122.4
18	N	23.1	Very low	24.5	Very low	138 Å²	138	141.2 Å²	141.2	74%	0.738	79%	0.791	S	S	*	*				169.2	124.6	107.1	-89.1	-32.4	0	0	0	112.7
19	F	23.2	Very low	24.5	Very low	180 Å²	180	140.6 Å²	140.6	79%	0.789	79%	0.789	S	S	*	*				155.5	111.3	115.9	-106.7	-83	0	0	0	112.8
20	C	23.6	Very low	24.4	Very low	126 Å²	126	139.6 Å²	139.6	85%	0.851	79%	0.787	S	S	*	*			trans	-101	142.5	147.6	-78.7	0	0	0	0	108.3
21	R	24.2	Very low	24.3	Very low	210 Å²	210	141.4 Å²	141.4	79%	0.792	79%	0.791	S	S	*	*			trans	-162.2	118.9	148.8	-107.4	-171.7	-171.5	-163.3	3	111.4
22	L	25.3	Very low	24.4	Very low	162 Å²	162	139.3 Å²	139.3	85%	0.848	79%	0.787	S	S	*	*			trans	59.1	137.3	136.5	-62.5	156.8	0	0	0	118.9
23	G	23.7	Very low	24.3	Very low	73 Å²	73	142.7 Å²	142.7	75%	0.753	79%	0.791	S	S	*	*			cis	-174.8	172.5	10.5	0	0	0	0	0	112.4
24	E	23.5	Very low	24.4	Very low	192 Å²	192	146 Å²	146	90%	0.897	80%	0.795	S	S	*	*			trans	-65.3	143.7	-176.9	-60.9	163	146.9	0	0	114
25	I	24.3	Very low	24.4	Very low	171 Å²	171	147.8 Å²	147.8	88%	0.877	80%	0.799	S	S	*	*			trans	-145.4	127.1	141.7	-61.7	-172.7	0	0	0	109
26	E	25	Very low	24.6	Very low	181 Å²	181	142.4 Å²	142.4	85%	0.846	80%	0.796	S	S	*	*			trans	-63.7	141.5	171.1	-61.6	170.4	134.1	0	0	112.6
27	T	25.1	Very low	24.7	Very low	145 Å²	145	145 Å²	145	89%	0.89	80%	0.801	S	S	*	*			trans	-154.5	139	139.2	44	0	0	0	0	112.4
28	S	23.6	Very low	24.8	Very low	103 Å²	103	147.2 Å²	147.2	72%	0.72	81%	0.811	S	S	*	*			trans	-68.4	152.4	175.1	50.3	0	0	0	0	115.4
29	D	24.9	Very low	24.9	Very low	152 Å²	152	149.2 Å²	149.2	81%	0.813	82%	0.818	S	S	*	*			trans	59	120.6	145.9	-70.7	-18.8	0	0	0	123.3
30	S	24.9	Very low	25.1	Very low	101 Å²	101	145.9 Å²	145.9	71%	0.706	82%	0.817	S	S	*	*			trans	70.6	107.9	139.1	68.3	0	0	0	0	120
31	L	24.8	Very low	25.4	Very low	175 Å²	175	146.7 Å²	146.7	92%	0.916	82%	0.818	S	S	*	*				166.4	132.4	111.9	-98	134.8	0	0	0	108.9
32	G	25.6	Very low	26.1	Very low	67 Å²	67	142.2 Å²	142.2	69%	0.691	81%	0.814	S	S	*	*			trans	-73.7	166.3	-166.2	0	0	0	0	0	115.7
33	L	25.7	Very low	26.5	Very low	163 Å²	163	139.2 Å²	139.2	85%	0.853	80%	0.802	S	S	*	*			trans	-174.7	145.8	140.1	-101.9	145.4	0	0	0	109.8
34	E	25.5	Very low	27	Very low	183 Å²	183	145 Å²	145	86%	0.855	81%	0.809	S	S	*	*			trans	-54.8	135.1	-170.9	-66.2	158.1	138.7	0	0	113.7
35	I	24.9	Very low	27.6	Very low	152 Å²	152	144.3 Å²	144.3	78%	0.779	81%	0.806	S	S	*	*			trans	-99.4	113	168.2	-61.6	172.5	0	0	0	107	E37	I35-E37 HydrophobicContact CG2-CG 3.92Å
36	S	25.9	Very low	28	Very low	115 Å²	115	143.7 Å²	143.7	80%	0.804	80%	0.804	S	S	*	*			trans	-102.8	104	160	54.8	0	0	0	0	108.2	T38	S36-T38 PolarHBondContact O-N 3.24Å
37	E	27	Very low	28.5	Very low	169 Å²	169	146.8 Å²	146.8	79%	0.79	81%	0.808	S	S	*	*			trans	-77.1	116.5	170.7	-80.7	-179.8	151.6	0	0	109.1	I35	I35-E37 HydrophobicContact CG2-CG 3.92Å
38	T	27.4	Very low	29.6	Very low	134 Å²	134	149.6 Å²	149.6	82%	0.822	81%	0.808	S	S	*	*			trans	-103.9	107.5	159.4	34.7	0	0	0	0	107.7	S36 S40	S36-T38 PolarHBondContact O-N 3.24Å; T38-S40 PolarHBondContact O-N 3.02Å
39	M	25.6	Very low	30.1	Very low	180 Å²	180	149.9 Å²	149.9	89%	0.887	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-64.2	124.2	171.5	-83.1	-169.9	169.1	0	0	109.7
40	S	26.7	Very low	31.1	Very low	109 Å²	109	153.6 Å²	153.6	76%	0.762	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-95.6	130.2	173.1	47.8	0	0	0	0	109.5	T38	T38-S40 PolarHBondContact O-N 3.02Å
41	V	30.2	Very low	32	Very low	144 Å²	144	155 Å²	155	87%	0.873	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-101.4	121.8	167.6	-178.4	0	0	0	0	108.3
42	T	39.3	Very low	32.9	Very low	115 Å²	115	152.3 Å²	152.3	71%	0.706	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-76.9	158.6	176.8	43.8	0	0	0	0	109.6
43	V	34	Very low	34.2	Very low	99 Å²	99	156.5 Å²	156.5	60%	0.6	83%	0.826	S	S	*	*				179.2	139.7	69.1	170.3	0	0	0	0	107.4	E45	V43-E45 HydrophobicContact CG1-CG 3.98Å
44	H	34.1	Very low	35.3	Very low	194 Å²	194	151.6 Å²	151.6	90%	0.898	81%	0.814	S	S	*	*			trans	-132.7	116.8	141	-109.3	57.7	0	0	0	109.1	N46	H44-N46 PolarHBondContact O-N 3.25Å
45	E	34.5	Very low	36.7	Very low	178 Å²	178	148.1 Å²	148.1	83%	0.832	81%	0.81	S	S	*	*			trans	-61.6	122.8	179.9	-70.1	179	125.8	0	0	111.3	V43	V43-E45 HydrophobicContact CG1-CG 3.98Å
46	N	34.5	Very low	38.2	Very low	159 Å²	159	148.4 Å²	148.4	85%	0.85	81%	0.81	S	S	*	*			trans	-94.6	99.1	168	-101.7	-28.9	0	0	0	110.1	H44 K48	H44-N46 PolarHBondContact O-N 3.25Å; N46-K48 PolarHBondContact O-N 3.12Å
47	R	35	Very low	40.1	Very low	245 Å²	245	150.2 Å²	150.2	93%	0.925	81%	0.811	S	S	*	*			trans	-72.4	102.1	167.4	-150.2	176.2	-173.6	178	2.7	108.6
48	K	47	Very low	42.3	Very low	204 Å²	204	149 Å²	149	89%	0.887	81%	0.808	S	S	*	*			trans	-85.2	116.1	175	-87.4	-175.6	177.6	174.6	0	111.7	N46	N46-K48 PolarHBondContact O-N 3.12Å
49	S	34.6	Very low	44.6	Very low	109 Å²	109	147.9 Å²	147.9	76%	0.762	81%	0.806	S	S	*	*			trans	-178.3	137.8	147.2	55.1	0	0	0	0	109.6
50	R	46.3	Very low	47.1	Very low	230 Å²	230	147 Å²	147	87%	0.868	80%	0.804	S	S	*	*			cis	-164	158.1	-12.6	-134.2	173.2	169.9	176.9	-4.6	104.5
51	T	44.4	Very low	50	Low	132 Å²	132	150.5 Å²	150.5	81%	0.81	81%	0.806	S	S	*	*			trans	65.9	96.4	162.5	58.8	0	0	0	0	120.5
52	S	43.1	Very low	52.6	Low	118 Å²	118	150.5 Å²	150.5	83%	0.825	80%	0.796	S	S	*	*				-176.2	132.1	118.3	54.8	0	0	0	0	110.5	G54	S52-G54 PolarHBondContact O-N 3.43Å
53	T	52.1	Low	55	Low	155 Å²	155	150.6 Å²	150.6	95%	0.951	79%	0.786	S	S	*	*			trans	-54.9	112.4	175.4	35	0	0	0	0	112.7
54	G	49.1	Very low	57.4	Low	59 Å²	59	150.4 Å²	150.4	61%	0.608	79%	0.787	S	S	*	*			trans	-177.8	103.2	166.9	0	0	0	0	0	105.6	S52 M56	S52-G54 PolarHBondContact O-N 3.43Å; G54-M56 PolarHBondContact O-N 2.94Å
55	S	54.3	Low	60.1	Low	111 Å²	111	144 Å²	144	78%	0.776	76%	0.764	S	S	*	*			trans	-65.3	88.4	176.3	-170.1	0	0	0	0	107.8	N57	S55-N57 VanDerWaalsContact C-N 3.34Å; S55-N57 PolarHBondContact O-N 3.18Å
56	M	58.3	Low	62.7	Low	158 Å²	158	140.9 Å²	140.9	78%	0.778	75%	0.75	S	S	*	*			trans	-66.1	103.3	165.2	-76.7	-169.2	-122.5	0	0	105.9	G54 I58	G54-M56 PolarHBondContact O-N 2.94Å; M56-I58 HydrophobicContact CB-CD1 4.05Å; M56-I58 HydrophobicContact CB-CG1 3.77Å; M56-I58 PolarHBondContact O-N 3.12Å
57	N	64.2	Low	65.1	Low	152 Å²	152	136.8 Å²	136.8	81%	0.813	73%	0.731	S	S	*	*			trans	-64.5	83.7	165.5	-82.6	-19.3	0	0	0	107.7	S55 S59	S55-N57 VanDerWaalsContact C-N 3.34Å; S55-N57 PolarHBondContact O-N 3.18Å; N57-S59 PolarHBondContact O-N 2.61Å
58	I	74.2	Confident	67.6	Low	143 Å²	143	129.9 Å²	129.9	73%	0.733	71%	0.713	S	S	*	*			trans	-89.5	102.5	175	-56	172.2	0	0	0	106.5	M56	M56-I58 HydrophobicContact CB-CD1 4.05Å; M56-I58 HydrophobicContact CB-CG1 3.77Å; M56-I58 PolarHBondContact O-N 3.12Å
59	S	75.6	Confident	69.6	Low	111 Å²	111	123.8 Å²	123.8	78%	0.776	70%	0.696	S	S	*	*			trans	-95.5	120.5	167.8	49.9	0	0	0	0	109.5	N57 F61	N57-S59 PolarHBondContact O-N 2.61Å; S59-F61 PolarHBondContact O-N 2.77Å
60	L	78.4	Confident	72.2	Confident	162 Å²	162	121.5 Å²	121.5	85%	0.848	68%	0.677	S	S	*	*			trans	-81.8	112.7	172.6	-172.3	87.3	0	0	0	108.7
61	F	86.5	Confident	74.3	Confident	182 Å²	182	112.6 Å²	112.6	80%	0.798	65%	0.647	S	S	*	*			trans	-89.2	112.8	171.7	178.6	-100.1	0	0	0	109.8	S59 K63	S59-F61 PolarHBondContact O-N 2.77Å; F61-K63 HydrophobicContact CE1-CB 3.95Å; F61-K63 HydrophobicContact CZ-CB 4.12Å
62	H	84.9	Confident	76.4	Confident	145 Å²	145	110.5 Å²	110.5	67%	0.671	63%	0.634	S	S	*	*			trans	-118.2	113.4	176.5	179.9	-98.6	0	0	0	109.8	P64	H62-P64 WeakPolarHBondContact O-CD 3.41Å
63	K	89.9	Confident	78.6	Confident	116 Å²	116	110.5 Å²	110.5	50%	0.504	62%	0.62	S	S	.	*			trans	-102.7	102.8	175.4	-176.4	178.8	177.8	-177.8	0	109.4	F61 S65 H66	F61-K63 HydrophobicContact CE1-CB 3.95Å; F61-K63 HydrophobicContact CZ-CB 4.12Å; K63-S65 WeakPolarHBondContact CE-OG 3.32Å; K63-S65 PolarHBondContact O-N 3.09Å; K63-H66 HydrophobicContact CB-CB 4.35Å; K63-H66 HydrophobicContact CG-CB 4.45Å; K63-H66 WeakPolarHBondContact O-CB 3.44Å; K63-H66 PolarHBondContact O-N 2.79Å; K63-H66 VanDerWaalsContact O-N 3.1Å
64	P	85.6	Confident	80.4	Confident	95 Å²	95	105.3 Å²	105.3	62%	0.617	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-21.2	-173.9	23.8	-32.7	0	0	0	114.1	H62 H66 P67	H62-P64 WeakPolarHBondContact O-CD 3.41Å; P64-H66 VanDerWaalsContact C-N 3.34Å; P64-P67 WeakPolarHBondContact O-CD 3.2Å
65	S	89	Confident	82.4	Confident	59 Å²	59	103.7 Å²	103.7	41%	0.413	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.1	-2.3	176.7	55.6	0	0	0	0	114.6	K63 S69	K63-S65 WeakPolarHBondContact CE-OG 3.32Å; K63-S65 PolarHBondContact O-N 3.09Å; S65-S69 WeakPolarHBondContact O-CB 3.31Å; S65-S69 PolarHBondContact O-N 2.94Å
66	H	89.3	Confident	84.1	Confident	114 Å²	114	101.3 Å²	101.3	53%	0.528	55%	0.545	S	S	.	.	H	α-helix	trans	-66.3	-45.9	179.9	-176.7	51.8	0	0	0	113.2	K63 P64 D68 S69 V70	K63-H66 HydrophobicContact CB-CB 4.35Å; K63-H66 HydrophobicContact CG-CB 4.45Å; K63-H66 WeakPolarHBondContact O-CB 3.44Å; K63-H66 PolarHBondContact O-N 2.79Å; K63-H66 VanDerWaalsContact O-N 3.1Å; P64-H66 VanDerWaalsContact C-N 3.34Å; H66-D68 PolarHBondContact O-N 3.46Å; H66-S69 PolarHBondContact O-N 3.46Å; H66-V70 WeakPolarHBondContact O-CG2 3.42Å; H66-V70 PolarHBondContact O-N 2.62Å
67	P	86.5	Confident	85.6	Confident	72 Å²	72	95.2 Å²	95.2	47%	0.468	52%	0.515	S	S	.	.	H	α-helix	trans	-58.4	-45.6	177.1	-24	35.5	0	0	0	113.1	P64 S69 V70 L71	P64-P67 WeakPolarHBondContact O-CD 3.2Å; P67-S69 VanDerWaalsContact C-N 3.32Å; P67-S69 PolarHBondContact O-N 2.98Å; P67-V70 PolarHBondContact O-N 2.94Å; P67-V70 VanDerWaalsContact O-N 3.15Å; P67-L71 PolarHBondContact O-N 3.15Å
68	D	86.4	Confident	86.8	Confident	101 Å²	101	89 Å²	89	54%	0.54	48%	0.48	S	S	.	.	H	α-helix	trans	-60.7	-42	178	-62.8	-26.3	0	0	0	111.8	H66 V70 L71 T72	H66-D68 PolarHBondContact O-N 3.46Å; D68-V70 VanDerWaalsContact C-N 3.33Å; D68-V70 PolarHBondContact O-N 2.94Å; D68-L71 PolarHBondContact O-N 3.25Å; D68-T72 VanDerWaalsContact O-CB 3.31Å; D68-T72 WeakPolarHBondContact O-CB 3.44Å; D68-T72 PolarHBondContact O-N 2.83Å; D68-T72 PolarHBondContact O-OG1 2.91Å
69	S	87.9	Confident	87.4	Confident	75 Å²	75	89.4 Å²	89.4	52%	0.524	48%	0.477	S	S	.	.	H	α-helix	trans	-65.2	-36.7	177.4	-175.1	0	0	0	0	112.2	S65 H66 P67 H73	S65-S69 WeakPolarHBondContact O-CB 3.31Å; S65-S69 PolarHBondContact O-N 2.94Å; H66-S69 PolarHBondContact O-N 3.46Å; P67-S69 VanDerWaalsContact C-N 3.32Å; P67-S69 PolarHBondContact O-N 2.98Å; S69-H73 WeakPolarHBondContact O-CB 3.39Å; S69-H73 PolarHBondContact O-N 3.39Å; S69-H73 VanDerWaalsContact O-N 3.13Å
70	V	90.1	Very high	88.1	Confident	61 Å²	61	90.1 Å²	90.1	37%	0.37	47%	0.468	S	S	.	.	H	α-helix	trans	-69.1	-49	177.4	171.1	0	0	0	0	110.2	H66 P67 D68 T72 H73 L74	H66-V70 WeakPolarHBondContact O-CG2 3.42Å; H66-V70 PolarHBondContact O-N 2.62Å; P67-V70 PolarHBondContact O-N 2.94Å; P67-V70 VanDerWaalsContact O-N 3.15Å; D68-V70 VanDerWaalsContact C-N 3.33Å; D68-V70 PolarHBondContact O-N 2.94Å; V70-T72 VanDerWaalsContact C-N 3.34Å; V70-T72 PolarHBondContact O-N 2.73Å; V70-H73 PolarHBondContact O-N 3.37Å; V70-H73 VanDerWaalsContact O-N 3.15Å; V70-L74 HydrophobicContact CG1-CD1 3.92Å; V70-L74 HydrophobicContact CG1-CG 4.39Å; V70-L74 WeakPolarHBondContact O-CG 3.42Å; V70-L74 PolarHBondContact O-N 2.87Å
71	L	89.6	Confident	88.5	Confident	43 Å²	43	86 Å²	86	23%	0.225	45%	0.452	C	S	.	.	H	α-helix	trans	-59.8	-43.7	177.7	-74.4	172	0	0	0	111.8	P67 D68 H73 L74 N75	P67-L71 PolarHBondContact O-N 3.15Å; D68-L71 PolarHBondContact O-N 3.25Å; L71-H73 VanDerWaalsContact C-N 3.29Å; L71-H73 PolarHBondContact O-N 3.23Å; L71-L74 PolarHBondContact O-N 2.81Å; L71-N75 PolarHBondContact O-N 3.34Å
72	T	89.2	Confident	88.3	Confident	89 Å²	89	81.5 Å²	81.5	55%	0.546	44%	0.435	S	S	.	.	H	α-helix	trans	-60.2	-40.7	176.2	-55	0	0	0	0	111.7	D68 V70 N75 T76	D68-T72 VanDerWaalsContact O-CB 3.31Å; D68-T72 WeakPolarHBondContact O-CB 3.44Å; D68-T72 PolarHBondContact O-N 2.83Å; D68-T72 PolarHBondContact O-OG1 2.91Å; V70-T72 VanDerWaalsContact C-N 3.34Å; V70-T72 PolarHBondContact O-N 2.73Å; T72-N75 PolarHBondContact O-N 2.87Å; T72-T76 PolarHBondContact O-N 3.47Å; T72-T76 VanDerWaalsContact O-N 3.09Å; T72-T76 PolarHBondContact O-OG1 2.99Å
73	H	90.3	Very high	88.4	Confident	117 Å²	117	82.1 Å²	82.1	54%	0.542	44%	0.436	S	S	.	.	H	α-helix	trans	-69.3	-43.1	177.6	-163.1	69.2	0	0	0	111.9	S69 V70 L71 N75 T76 L77	S69-H73 WeakPolarHBondContact O-CB 3.39Å; S69-H73 PolarHBondContact O-N 3.39Å; S69-H73 VanDerWaalsContact O-N 3.13Å; V70-H73 PolarHBondContact O-N 3.37Å; V70-H73 VanDerWaalsContact O-N 3.15Å; L71-H73 VanDerWaalsContact C-N 3.29Å; L71-H73 PolarHBondContact O-N 3.23Å; H73-N75 VanDerWaalsContact C-N 3.3Å; H73-N75 PolarHBondContact O-N 3.35Å; H73-T76 WeakPolarHBondContact O-CB 3.19Å; H73-T76 PolarHBondContact O-N 3.42Å; H73-T76 VanDerWaalsContact O-N 3.07Å; H73-L77 WeakPolarHBondContact O-CG 3.33Å; H73-L77 PolarHBondContact O-N 2.96Å
74	L	90.2	Very high	88.2	Confident	47 Å²	47	78.5 Å²	78.5	25%	0.246	42%	0.423	C	S	.	.	H	α-helix	trans	-60	-39	174.4	-71.9	170.8	0	0	0	112	V70 L71 T76 L77 R78 V101 Y144	V70-L74 HydrophobicContact CG1-CD1 3.92Å; V70-L74 HydrophobicContact CG1-CG 4.39Å; V70-L74 WeakPolarHBondContact O-CG 3.42Å; V70-L74 PolarHBondContact O-N 2.87Å; L71-L74 PolarHBondContact O-N 2.81Å; L74-T76 VanDerWaalsContact C-N 3.31Å; L74-T76 PolarHBondContact O-N 2.94Å; L74-L77 HydrophobicContact CD2-CD1 4.48Å; L74-L77 PolarHBondContact O-N 3.01Å; L74-R78 PolarHBondContact O-N 3.34Å; L74-V101 HydrophobicContact CD1-CG2 4.14Å; L74-Y144 HydrophobicContact CB-CD1 4.01Å; L74-Y144 HydrophobicContact CB-CE1 4.21Å
75	N	89.4	Confident	88.3	Confident	24 Å²	24	77.5 Å²	77.5	13%	0.128	41%	0.413	C	S	.	.	H	α-helix	trans	-64.7	-37.8	174.4	-159.7	7.4	0	0	0	111.8	L71 T72 H73 R78 K79 Y144	L71-N75 PolarHBondContact O-N 3.34Å; T72-N75 PolarHBondContact O-N 2.87Å; H73-N75 VanDerWaalsContact C-N 3.3Å; H73-N75 PolarHBondContact O-N 3.35Å; N75-R78 WeakPolarHBondContact O-CB 3.36Å; N75-R78 PolarHBondContact O-N 2.67Å; N75-R78 PolarHBondContact OD1-NE 3.12Å; N75-R78 PolarHBondContact OD1-NH2 3.24Å; N75-K79 WeakPolarHBondContact O-CG 3.36Å; N75-K79 PolarHBondContact O-N 3.49Å; N75-Y144 HydrophobicContact CB-CD1 4.48Å; N75-Y144 HydrophobicContact CB-CG 4.49Å
76	T	90.3	Very high	88.3	Confident	61 Å²	61	74.8 Å²	74.8	37%	0.374	39%	0.394	S	S	.	.	H	α-helix	trans	-64.7	-43.2	176.2	-54.4	0	0	0	0	111	T72 H73 L74 K79 Q80	T72-T76 PolarHBondContact O-N 3.47Å; T72-T76 VanDerWaalsContact O-N 3.09Å; T72-T76 PolarHBondContact O-OG1 2.99Å; H73-T76 WeakPolarHBondContact O-CB 3.19Å; H73-T76 PolarHBondContact O-N 3.42Å; H73-T76 VanDerWaalsContact O-N 3.07Å; L74-T76 VanDerWaalsContact C-N 3.31Å; L74-T76 PolarHBondContact O-N 2.94Å; T76-K79 PolarHBondContact O-N 3.21Å; T76-Q80 WeakPolarHBondContact O-CG 3.35Å; T76-Q80 PolarHBondContact O-N 3.17Å; T76-Q80 VanDerWaalsContact O-N 3.12Å
77	L	90.3	Very high	88.3	Confident	30 Å²	30	71.1 Å²	71.1	16%	0.157	38%	0.379	C	S	.	.	H	α-helix	trans	-62.3	-42.4	175.3	-67.2	172.9	0	0	0	111.7	H73 L74 K79 Q80 C81 M82 F83	H73-L77 WeakPolarHBondContact O-CG 3.33Å; H73-L77 PolarHBondContact O-N 2.96Å; L74-L77 HydrophobicContact CD2-CD1 4.48Å; L74-L77 PolarHBondContact O-N 3.01Å; L77-K79 PolarHBondContact O-N 3.28Å; L77-Q80 CarbonylContact O-C 3.54Å; L77-Q80 PolarHBondContact O-N 3.21Å; L77-C81 PolarHBondContact O-N 3.28Å; L77-C81 VanDerWaalsContact O-N 3.13Å; L77-M82 HydrophobicContact CB-CB 4.45Å; L77-M82 HydrophobicContact CD2-CB 4Å; L77-M82 PolarHBondContact O-N 3.02Å; L77-F83 HydrophobicContact CD1-CD2 4.45Å; L77-F83 HydrophobicContact CD2-CD2 4.34Å; L77-F83 HydrophobicContact CD2-CE2 4.43Å
78	R	89.2	Confident	88.5	Confident	21 Å²	21	67.7 Å²	67.7	8%	0.079	36%	0.357	C	S	.	.	H	α-helix	trans	-57	-50.2	174.3	-174.4	-173.1	64.5	134.8	-4	111.5	L74 N75 Q80 C81 P96 D141 Y144	L74-R78 PolarHBondContact O-N 3.34Å; N75-R78 WeakPolarHBondContact O-CB 3.36Å; N75-R78 PolarHBondContact O-N 2.67Å; N75-R78 PolarHBondContact OD1-NE 3.12Å; N75-R78 PolarHBondContact OD1-NH2 3.24Å; R78-Q80 PolarHBondContact O-N 3.39Å; R78-C81 PolarHBondContact O-N 3.27Å; R78-P96 WeakPolarHBondContact CG-O 3.07Å; R78-D141 IonicContact CZ-OD1 2.67Å; R78-D141 IonicContact NH1-OD1 3.73Å; R78-D141 IonicContact NH2-OD1 3.79Å; R78-D141 PolarHBondContact NH2-OD1 3.25Å; R78-Y144 HydrophobicContact CB-CE1 4.38Å
79	K	87.7	Confident	88.5	Confident	152 Å²	152	66.2 Å²	66.2	66%	0.661	34%	0.344	S	S	*	.	H	α-helix	trans	-64.1	-24.7	-179.8	-72.1	-178.1	180	-172.6	0	113.5	N75 T76 L77	N75-K79 WeakPolarHBondContact O-CG 3.36Å; N75-K79 PolarHBondContact O-N 3.49Å; T76-K79 PolarHBondContact O-N 3.21Å; L77-K79 PolarHBondContact O-N 3.28Å
80	Q	89.8	Confident	88.5	Confident	126 Å²	126	62.7 Å²	62.7	59%	0.589	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	1.5	174.7	-67.7	178.8	-7.3	0	0	113.2	T76 L77 R78 M82	T76-Q80 WeakPolarHBondContact O-CG 3.35Å; T76-Q80 PolarHBondContact O-N 3.17Å; T76-Q80 VanDerWaalsContact O-N 3.12Å; L77-Q80 CarbonylContact O-C 3.54Å; L77-Q80 PolarHBondContact O-N 3.21Å; R78-Q80 PolarHBondContact O-N 3.39Å; Q80-M82 HydrophobicContact CB-CG 3.82Å; Q80-M82 PolarHBondContact O-N 2.95Å
81	C	86.4	Confident	88.1	Confident	77 Å²	77	61 Å²	61	52%	0.52	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	55	35.1	-174.3	-55	0	0	0	0	113.2	L77 R78	L77-C81 PolarHBondContact O-N 3.28Å; L77-C81 VanDerWaalsContact O-N 3.13Å; R78-C81 PolarHBondContact O-N 3.27Å
82	M	82.9	Confident	87.8	Confident	86 Å²	86	66.9 Å²	66.9	42%	0.424	35%	0.346	S	S	.	.			trans	-97.9	127.3	-178.9	-68.8	-67	-66.2	0	0	109.9	L77 Q80 T84 H98	L77-M82 HydrophobicContact CB-CB 4.45Å; L77-M82 HydrophobicContact CD2-CB 4Å; L77-M82 PolarHBondContact O-N 3.02Å; Q80-M82 HydrophobicContact CB-CG 3.82Å; Q80-M82 PolarHBondContact O-N 2.95Å; M82-T84 PolarHBondContact O-N 3.21Å; M82-H98 PolarHBondContact O-NE2 3.29Å
83	F	85.7	Confident	87.8	Confident	159 Å²	159	67.2 Å²	67.2	70%	0.697	34%	0.338	S	S	*	.	S	Bend	trans	61.7	15	180	-48.8	-70.4	0	0	0	115.9	L77 H98	L77-F83 HydrophobicContact CD1-CD2 4.45Å; L77-F83 HydrophobicContact CD2-CD2 4.34Å; L77-F83 HydrophobicContact CD2-CE2 4.43Å; F83-H98 PolarHBondContact O-CD2 3.3Å; F83-H98 VanDerWaalsContact O-CD2 3.25Å
84	T	85.6	Confident	87.8	Confident	40 Å²	40	64.6 Å²	64.6	25%	0.245	33%	0.332	C	S	.	.			trans	-71.8	128	173.8	53.9	0	0	0	0	110.3	M82 P96 C97	M82-T84 PolarHBondContact O-N 3.21Å; T84-P96 HydrophobicContact CG2-CB 4.09Å; T84-C97 WeakPolarHBondContact CA-O 3.34Å; T84-C97 WeakPolarHBondContact CB-O 3.48Å
85	D	88.2	Confident	87.8	Confident	73 Å²	73	63 Å²	63	39%	0.39	32%	0.323	S	S	.	.			trans	-113.3	-4	-173.4	58.7	-12.6	0	0	0	113.1	C97 H98 R99	D85-C97 PolarHBondContact N-O 3.49Å; D85-C97 VanDerWaalsContact N-O 3.15Å; D85-H98 WeakPolarHBondContact OD1-CA 3.49Å; D85-R99 WeakPolarHBondContact OD1-CG 3.38Å; D85-R99 PolarHBondContact OD1-N 3.46Å; D85-R99 WeakPolarHBondContact OD2-CB 3.46Å; D85-R99 WeakPolarHBondContact OD2-CD 3.4Å; D85-R99 WeakPolarHBondContact OD2-CG 3.14Å
86	V	88.6	Confident	87.9	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.012	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	145	175.1	65.3	0	0	0	0	111.3	L88 C97 R99 L102 F113 N123 V125	V86-L88 HydrophobicContact CG2-CD2 4.23Å; V86-C97 HydrophobicContact CG1-CB 4.07Å; V86-C97 PolarHBondContact N-O 3.35Å; V86-C97 PolarHBondContact O-N 3.48Å; V86-R99 HydrophobicContact CB-CG 3.74Å; V86-R99 HydrophobicContact CG1-CG 3.61Å; V86-L102 HydrophobicContact CG1-CD1 4.11Å; V86-F113 HydrophobicContact CG1-CZ 4.37Å; V86-F113 HydrophobicContact CG2-CE1 4.4Å; V86-F113 HydrophobicContact CG2-CZ 4.3Å; V86-N123 WeakPolarHBondContact CA-O 3.46Å; V86-V125 HydrophobicContact CG2-CG2 4.15Å
87	T	90.3	Very high	87.9	Confident	37 Å²	37	60.6 Å²	60.6	23%	0.227	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	121.3	172	-56	0	0	0	0	109.6	N123 E124 V125	T87-N123 PolarHBondContact N-O 3.01Å; T87-E124 WeakPolarHBondContact O-CA 3.18Å; T87-V125 PolarHBondContact O-N 3.08Å
88	L	89.6	Confident	88	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	134.9	173.7	-53.9	-177.2	0	0	0	109.8	V86 S94 F95 L102 F109 V125 F127 L136 L140	V86-L88 HydrophobicContact CG2-CD2 4.23Å; L88-S94 CarbonylContact O-C 3.58Å; L88-S94 WeakPolarHBondContact O-CA 3.45Å; L88-F95 HydrophobicContact CB-CB 4.44Å; L88-F95 PolarHBondContact N-O 2.77Å; L88-F95 PolarHBondContact O-N 3.47Å; L88-L102 HydrophobicContact CD1-CD1 4.03Å; L88-L102 HydrophobicContact CG-CD1 4.5Å; L88-F109 HydrophobicContact CD1-CE1 4.37Å; L88-F109 HydrophobicContact CD1-CZ 4.06Å; L88-F109 HydrophobicContact CD2-CE1 4.26Å; L88-V125 CarbonylContact C-O 3.54Å; L88-V125 WeakPolarHBondContact CA-O 3.39Å; L88-V125 HydrophobicContact CD2-CB 3.75Å; L88-V125 HydrophobicContact CD2-CG1 4.34Å; L88-V125 HydrophobicContact CD2-CG2 4.22Å; L88-F127 HydrophobicContact CB-CE2 4.3Å; L88-F127 HydrophobicContact CD1-CE2 4.33Å; L88-F127 HydrophobicContact CD2-CE2 4.13Å; L88-F127 HydrophobicContact CG-CE2 4.49Å; L88-L136 HydrophobicContact CB-CD2 4.28Å; L88-L136 HydrophobicContact CD1-CD1 4.44Å; L88-L140 HydrophobicContact CD1-CD1 4.48Å; L88-L140 HydrophobicContact CD1-CD2 4.04Å
89	W	88.3	Confident	88	Confident	71 Å²	71	61.6 Å²	61.6	27%	0.269	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	129.2	176.4	-67.7	89.3	0	0	0	110	R93 V125 N126 F127	W89-R93 WeakPolarHBondContact CA-O 3.14Å; W89-V125 PolarHBondContact N-O 3.41Å; W89-N126 HydrophobicContact CB-CB 3.99Å; W89-F127 PolarHBondContact O-N 2.9Å
90	A	86.6	Confident	88	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	116.1	168.9	0	0	0	0	0	107.9	D92 R93 F95 P133 L136	A90-D92 PolarHBondContact O-N 2.83Å; A90-D92 VanDerWaalsContact O-N 3.16Å; A90-R93 PolarHBondContact N-O 2.77Å; A90-R93 PolarHBondContact O-N 2.78Å; A90-F95 HydrophobicContact CB-CE2 4.5Å; A90-P133 HydrophobicContact CB-CB 4.33Å; A90-P133 HydrophobicContact CB-CG 4.19Å; A90-P133 WeakPolarHBondContact O-CG 3.3Å; A90-L136 HydrophobicContact CB-CD2 3.7Å
91	G	82.9	Confident	88	Confident	27 Å²	27	52.8 Å²	52.8	28%	0.278	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	-118.8	-165.9	0	0	0	0	0	111.6	R128	G91-R128 PolarHBondContact N-O 2.75Å
92	D	83.1	Confident	88.1	Confident	166 Å²	166	49.1 Å²	49.1	89%	0.888	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	1.4	-178.5	-61.9	-30.4	0	0	0	114.3	A90	A90-D92 PolarHBondContact O-N 2.83Å; A90-D92 VanDerWaalsContact O-N 3.16Å
93	R	88.5	Confident	88.5	Confident	96 Å²	96	46.2 Å²	46.2	36%	0.362	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	132.6	-178.7	-67.6	-175.6	65.7	-161.7	-0.1	111.5	W89 A90 F95 P133 E137	W89-R93 WeakPolarHBondContact CA-O 3.14Å; A90-R93 PolarHBondContact N-O 2.77Å; A90-R93 PolarHBondContact O-N 2.78Å; R93-F95 HydrophobicContact CB-CE2 3.78Å; R93-F95 HydrophobicContact CB-CZ 3.96Å; R93-P133 HydrophobicContact CB-CB 4.13Å; R93-P133 HydrophobicContact CG-CB 4.19Å; R93-E137 IonicContact CZ-OE2 3.02Å; R93-E137 VanDerWaalsContact CZ-OE2 3.25Å; R93-E137 IonicContact NH1-OE2 2.64Å; R93-E137 PolarHBondContact NH1-OE2 2.77Å; R93-E137 VanDerWaalsContact NH2-CD 3.3Å; R93-E137 IonicContact NH2-OE1 3.62Å; R93-E137 PolarHBondContact NH2-OE1 2.91Å; R93-E137 IonicContact NH2-OE2 2.65Å; R93-E137 PolarHBondContact NH2-OE2 3.22Å
94	S	90.1	Very high	88.6	Confident	61 Å²	61	42.7 Å²	42.7	43%	0.427	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	135.9	176.4	64.5	0	0	0	0	112.2	L88	L88-S94 CarbonylContact O-C 3.58Å; L88-S94 WeakPolarHBondContact O-CA 3.45Å
95	F	90.4	Very high	88.8	Confident	14 Å²	14	43.3 Å²	43.3	6%	0.061	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	101.8	-178.6	-59.3	-84.8	0	0	0	111.2	L88 A90 R93 C97 P133 L136 E137 L140	L88-F95 HydrophobicContact CB-CB 4.44Å; L88-F95 PolarHBondContact N-O 2.77Å; L88-F95 PolarHBondContact O-N 3.47Å; A90-F95 HydrophobicContact CB-CE2 4.5Å; R93-F95 HydrophobicContact CB-CE2 3.78Å; R93-F95 HydrophobicContact CB-CZ 3.96Å; F95-C97 PolarHBondContact O-SG 2.58Å; F95-P133 HydrophobicContact CZ-CB 4.48Å; F95-P133 WeakPolarHBondContact CZ-O 3.41Å; F95-L136 HydrophobicContact CD2-CD2 3.91Å; F95-L136 HydrophobicContact CD2-CG 4.5Å; F95-L136 HydrophobicContact CE2-CD2 4.14Å; F95-E137 HydrophobicContact CE1-CB 3.82Å; F95-E137 HydrophobicContact CE1-CG 4.1Å; F95-E137 HydrophobicContact CZ-CB 4.12Å; F95-L140 HydrophobicContact CB-CD1 3.57Å; F95-L140 HydrophobicContact CD1-CD1 4.1Å; F95-L140 HydrophobicContact CG-CD1 3.86Å
96	P	91.4	Very high	88.9	Confident	35 Å²	35	40 Å²	40	23%	0.227	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	131.1	176	29.7	-32.8	0	0	0	110.6	R78 T84	R78-P96 WeakPolarHBondContact CG-O 3.07Å; T84-P96 HydrophobicContact CG2-CB 4.09Å
97	C	91.5	Very high	88.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	169.8	-171.5	-64.7	0	0	0	0	112.1	T84 D85 V86 F95 L102	T84-C97 WeakPolarHBondContact CA-O 3.34Å; T84-C97 WeakPolarHBondContact CB-O 3.48Å; D85-C97 PolarHBondContact N-O 3.49Å; D85-C97 VanDerWaalsContact N-O 3.15Å; V86-C97 HydrophobicContact CG1-CB 4.07Å; V86-C97 PolarHBondContact N-O 3.35Å; V86-C97 PolarHBondContact O-N 3.48Å; F95-C97 PolarHBondContact O-SG 2.58Å; C97-L102 HydrophobicContact CB-CD1 3.85Å; C97-L102 HydrophobicContact CB-CG 4.39Å
98	H	91.6	Very high	88.9	Confident	18 Å²	18	48.9 Å²	48.9	8%	0.083	27%	0.271	C	S	.	.			trans	-101.5	123.5	172	-50.1	90	0	0	0	110.5	M82 F83 D85 A100 V101 L102 Y144	M82-H98 PolarHBondContact O-NE2 3.29Å; F83-H98 PolarHBondContact O-CD2 3.3Å; F83-H98 VanDerWaalsContact O-CD2 3.25Å; D85-H98 WeakPolarHBondContact OD1-CA 3.49Å; H98-A100 VanDerWaalsContact C-N 3.25Å; H98-A100 PolarHBondContact O-N 3.13Å; H98-V101 HydrophobicContact CB-CB 4.36Å; H98-V101 HydrophobicContact CB-CG2 4.02Å; H98-V101 PolarHBondContact O-N 3.25Å; H98-L102 PolarHBondContact O-N 3.4Å; H98-Y144 WeakPolarHBondContact CB-OH 3.4Å; H98-Y144 PolarHBondContact N-OH 3.26Å; H98-Y144 AromaticContact ND1-CE1 3.52Å; H98-Y144 AromaticContact ND1-CZ 3.65Å; H98-Y144 PolarHBondContact ND1-OH 3.41Å
99	R	88.9	Confident	88.8	Confident	53 Å²	53	49 Å²	49	20%	0.2	27%	0.271	C	S	.	.	H	α-helix	trans	-57.3	-39.6	179	-66.5	174	76.3	170.1	3.1	112	D85 V86 V101 L102 A103 F113 S120	D85-R99 WeakPolarHBondContact OD1-CG 3.38Å; D85-R99 PolarHBondContact OD1-N 3.46Å; D85-R99 WeakPolarHBondContact OD2-CB 3.46Å; D85-R99 WeakPolarHBondContact OD2-CD 3.4Å; D85-R99 WeakPolarHBondContact OD2-CG 3.14Å; V86-R99 HydrophobicContact CB-CG 3.74Å; V86-R99 HydrophobicContact CG1-CG 3.61Å; R99-V101 VanDerWaalsContact C-N 3.34Å; R99-V101 PolarHBondContact O-N 3.44Å; R99-L102 PolarHBondContact O-N 2.94Å; R99-A103 VanDerWaalsContact O-CB 3.3Å; R99-A103 WeakPolarHBondContact O-CB 3.36Å; R99-A103 PolarHBondContact O-N 2.97Å; R99-F113 HydrophobicContact CB-CD2 3.84Å; R99-F113 HydrophobicContact CB-CE2 3.87Å; R99-F113 HydrophobicContact CB-CG 4.4Å; R99-F113 HydrophobicContact CB-CZ 4.43Å; R99-F113 HydrophobicContact CG-CD1 4.45Å; R99-F113 HydrophobicContact CG-CD2 4.13Å; R99-F113 HydrophobicContact CG-CE1 4.22Å; R99-F113 HydrophobicContact CG-CE2 3.9Å; R99-F113 HydrophobicContact CG-CG 4.41Å; R99-F113 HydrophobicContact CG-CZ 3.95Å; R99-F113 VanDerWaalsContact NH2-CD1 3.31Å; R99-S120 PolarHBondContact NH1-O 3.16Å; R99-S120 VanDerWaalsContact NH1-O 3.09Å; R99-S120 PolarHBondContact NH2-O 3.05Å
100	A	87.3	Confident	88.8	Confident	77 Å²	77	49.1 Å²	49.1	64%	0.636	28%	0.275	S	S	*	.	H	α-helix	trans	-62	-38.7	-179.9	0	0	0	0	0	112.9	H98 A104	H98-A100 VanDerWaalsContact C-N 3.25Å; H98-A100 PolarHBondContact O-N 3.13Å; A100-A104 WeakPolarHBondContact O-CB 3.46Å; A100-A104 PolarHBondContact O-N 3.12Å; A100-A104 VanDerWaalsContact O-N 3.12Å
101	V	89.8	Confident	88.8	Confident	17 Å²	17	52 Å²	52	10%	0.103	30%	0.298	C	S	.	.	H	α-helix	trans	-71.8	-44.5	178.3	178.4	0	0	0	0	110.1	L74 H98 R99 A103 A104 C105 A143 Y144	L74-V101 HydrophobicContact CD1-CG2 4.14Å; H98-V101 HydrophobicContact CB-CB 4.36Å; H98-V101 HydrophobicContact CB-CG2 4.02Å; H98-V101 PolarHBondContact O-N 3.25Å; R99-V101 VanDerWaalsContact C-N 3.34Å; R99-V101 PolarHBondContact O-N 3.44Å; V101-A103 PolarHBondContact O-N 2.94Å; V101-A104 PolarHBondContact O-N 3.34Å; V101-C105 PolarHBondContact O-N 3.02Å; V101-C105 VanDerWaalsContact O-N 3.11Å; V101-C105 PolarHBondContact O-SG 3.38Å; V101-C105 VanDerWaalsContact O-SG 3.4Å; V101-A143 HydrophobicContact CG1-CB 4.41Å; V101-Y144 HydrophobicContact CB-CE1 4Å; V101-Y144 HydrophobicContact CG1-CD1 4.14Å; V101-Y144 HydrophobicContact CG1-CD2 4.42Å; V101-Y144 HydrophobicContact CG1-CE1 3.76Å; V101-Y144 HydrophobicContact CG1-CE2 4.02Å; V101-Y144 HydrophobicContact CG1-CG 4.45Å; V101-Y144 HydrophobicContact CG2-CE1 3.81Å
102	L	89.8	Confident	88.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.4	-44.5	178.4	-66.1	177.8	0	0	0	112.4	V86 L88 C97 H98 R99 A104 C105 S106 F109 F113 L140	V86-L102 HydrophobicContact CG1-CD1 4.11Å; L88-L102 HydrophobicContact CD1-CD1 4.03Å; L88-L102 HydrophobicContact CG-CD1 4.5Å; C97-L102 HydrophobicContact CB-CD1 3.85Å; C97-L102 HydrophobicContact CB-CG 4.39Å; H98-L102 PolarHBondContact O-N 3.4Å; R99-L102 PolarHBondContact O-N 2.94Å; L102-A104 VanDerWaalsContact C-N 3.3Å; L102-A104 PolarHBondContact O-N 3.11Å; L102-C105 PolarHBondContact O-N 3.34Å; L102-S106 PolarHBondContact O-N 3.48Å; L102-F109 HydrophobicContact CB-CB 3.95Å; L102-F109 HydrophobicContact CB-CD2 3.95Å; L102-F109 HydrophobicContact CB-CG 3.93Å; L102-F109 HydrophobicContact CD2-CD2 4.33Å; L102-F109 HydrophobicContact CD2-CE2 4.27Å; L102-F113 HydrophobicContact CB-CE2 4.13Å; L102-F113 HydrophobicContact CD1-CE2 4.34Å; L102-F113 HydrophobicContact CD1-CZ 4.45Å; L102-L140 HydrophobicContact CD2-CD2 3.54Å
103	A	89.6	Confident	88.9	Confident	25 Å²	25	45.2 Å²	45.2	21%	0.207	25%	0.254	C	S	.	.	H	α-helix	trans	-65.6	-31.8	176.7	0	0	0	0	0	112.8	R99 V101 E110 F113	R99-A103 VanDerWaalsContact O-CB 3.3Å; R99-A103 WeakPolarHBondContact O-CB 3.36Å; R99-A103 PolarHBondContact O-N 2.97Å; V101-A103 PolarHBondContact O-N 2.94Å; A103-E110 HydrophobicContact CB-CB 4.16Å; A103-F113 HydrophobicContact CB-CD2 4.43Å
104	A	89.3	Confident	88.6	Confident	85 Å²	85	45 Å²	45	70%	0.702	27%	0.268	S	S	*	.	H	α-helix	trans	-71.2	-33.8	176	0	0	0	0	0	112.5	A100 V101 L102	A100-A104 WeakPolarHBondContact O-CB 3.46Å; A100-A104 PolarHBondContact O-N 3.12Å; A100-A104 VanDerWaalsContact O-N 3.12Å; V101-A104 PolarHBondContact O-N 3.34Å; L102-A104 VanDerWaalsContact C-N 3.3Å; L102-A104 PolarHBondContact O-N 3.11Å
105	C	88.8	Confident	87.6	Confident	53 Å²	53	44.2 Å²	44.2	36%	0.358	27%	0.269	S	S	.	.	H	α-helix	trans	-90.9	-24.6	-176.4	-64.9	0	0	0	0	114.2	V101 L102 A143 F167	V101-C105 PolarHBondContact O-N 3.02Å; V101-C105 VanDerWaalsContact O-N 3.11Å; V101-C105 PolarHBondContact O-SG 3.38Å; V101-C105 VanDerWaalsContact O-SG 3.4Å; L102-C105 PolarHBondContact O-N 3.34Å; C105-A143 HydrophobicContact CB-CB 4.3Å; C105-F167 HydrophobicContact CB-CE1 3.81Å; C105-F167 HydrophobicContact CB-CZ 4.5Å
106	S	91.4	Very high	86.4	Confident	3 Å²	3	46.8 Å²	46.8	2%	0.021	30%	0.299	C	S	.	.			trans	-139.5	130	-174.8	150.5	0	0	0	0	111.9	L102 Y108 F109 E110 L165	L102-S106 PolarHBondContact O-N 3.48Å; S106-Y108 VanDerWaalsContact C-N 3.26Å; S106-Y108 PolarHBondContact O-N 2.87Å; S106-Y108 PolarHBondContact OG-N 3.39Å; S106-F109 PolarHBondContact O-N 2.88Å; S106-F109 WeakPolarHBondContact OG-CD2 3.47Å; S106-F109 PolarHBondContact OG-N 2.9Å; S106-E110 PolarHBondContact O-N 3.09Å; S106-L165 WeakPolarHBondContact CB-O 3.49Å; S106-L165 PolarHBondContact OG-O 3.38Å
107	R	88.4	Confident	85.2	Confident	151 Å²	151	50.4 Å²	50.4	57%	0.57	32%	0.316	S	S	*	.	H	α-helix	trans	-67.2	-27.9	177.4	-64.7	-58.6	180	-179.6	-5.9	112.6	E110 A111 Q166	R107-E110 WeakPolarHBondContact CD-OE2 3.2Å; R107-E110 IonicContact CZ-OE2 3.66Å; R107-E110 IonicContact NE-OE2 2.86Å; R107-E110 IonicContact NH1-OE1 3.56Å; R107-E110 PolarHBondContact NH1-OE1 3.48Å; R107-E110 IonicContact NH1-OE2 3.62Å; R107-E110 PolarHBondContact NH1-OE2 3.35Å; R107-A111 WeakPolarHBondContact O-CB 3.26Å; R107-A111 PolarHBondContact O-N 2.96Å; R107-Q166 HydrophobicContact CB-CB 4.43Å
108	Y	89.3	Confident	83.8	Confident	74 Å²	74	60.7 Å²	60.7	29%	0.29	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-50	173.9	174.8	-98.1	0	0	0	111	S106 A111 M112 F127 L165 Q166	S106-Y108 VanDerWaalsContact C-N 3.26Å; S106-Y108 PolarHBondContact O-N 2.87Å; S106-Y108 PolarHBondContact OG-N 3.39Å; Y108-A111 PolarHBondContact O-N 3.25Å; Y108-M112 HydrophobicContact CD1-CE 4.26Å; Y108-M112 HydrophobicContact CE1-CE 3.28Å; Y108-M112 HydrophobicContact CE2-CE 4.38Å; Y108-M112 WeakPolarHBondContact O-CB 3.49Å; Y108-M112 PolarHBondContact O-N 3.07Å; Y108-M112 WeakPolarHBondContact OH-CE 3.4Å; Y108-F127 HydrophobicContact CE1-CE1 4.17Å; Y108-F127 HydrophobicContact CE1-CZ 4.41Å; Y108-L165 WeakPolarHBondContact CB-O 3.42Å; Y108-L165 HydrophobicContact CD1-CD2 3.68Å; Y108-L165 HydrophobicContact CE1-CD2 3.6Å; Y108-L165 HydrophobicContact CG-CD2 4.45Å; Y108-Q166 VanDerWaalsContact N-OE1 3.1Å
109	F	88.4	Confident	82.5	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.009	37%	0.374	C	S	.	.	H	α-helix	trans	-69.1	-36.4	178.1	-71.5	-59.6	0	0	0	112.4	L88 L102 S106 M112 F113 F127 L165 F167	L88-F109 HydrophobicContact CD1-CE1 4.37Å; L88-F109 HydrophobicContact CD1-CZ 4.06Å; L88-F109 HydrophobicContact CD2-CE1 4.26Å; L102-F109 HydrophobicContact CB-CB 3.95Å; L102-F109 HydrophobicContact CB-CD2 3.95Å; L102-F109 HydrophobicContact CB-CG 3.93Å; L102-F109 HydrophobicContact CD2-CD2 4.33Å; L102-F109 HydrophobicContact CD2-CE2 4.27Å; S106-F109 PolarHBondContact O-N 2.88Å; S106-F109 WeakPolarHBondContact OG-CD2 3.47Å; S106-F109 PolarHBondContact OG-N 2.9Å; F109-M112 HydrophobicContact CD1-SD 4.39Å; F109-M112 PolarHBondContact O-N 2.93Å; F109-F113 HydrophobicContact CB-CD2 4.26Å; F109-F113 HydrophobicContact CB-CE2 3.93Å; F109-F113 HydrophobicContact CD1-CE2 4.13Å; F109-F113 HydrophobicContact CD1-CZ 4.07Å; F109-F113 HydrophobicContact CG-CE2 4.37Å; F109-F113 WeakPolarHBondContact O-CB 3.41Å; F109-F113 WeakPolarHBondContact O-CD2 3.48Å; F109-F113 VanDerWaalsContact O-CG 3.31Å; F109-F113 WeakPolarHBondContact O-CG 3.42Å; F109-F113 PolarHBondContact O-N 3.5Å; F109-F127 AromaticContact CE1-CZ 3.91Å; F109-F127 HydrophobicContact CE1-CZ 3.91Å; F109-F127 AromaticContact CZ-CZ 4Å; F109-F127 HydrophobicContact CZ-CZ 4Å; F109-L165 HydrophobicContact CZ-CD2 4.21Å; F109-F167 HydrophobicContact CD2-CE2 4.37Å; F109-F167 AromaticContact CE2-CE2 3.97Å; F109-F167 HydrophobicContact CE2-CE2 3.97Å; F109-F167 HydrophobicContact CE2-CZ 4.31Å
110	E	87.8	Confident	81.4	Confident	75 Å²	75	63.1 Å²	63.1	35%	0.35	37%	0.37	S	S	.	.	H	α-helix	trans	-57.5	-49.4	172.5	-171.2	-176.6	-159.7	0	0	111.1	A103 S106 R107 F113 S114	A103-E110 HydrophobicContact CB-CB 4.16Å; S106-E110 PolarHBondContact O-N 3.09Å; R107-E110 WeakPolarHBondContact CD-OE2 3.2Å; R107-E110 IonicContact CZ-OE2 3.66Å; R107-E110 IonicContact NE-OE2 2.86Å; R107-E110 IonicContact NH1-OE1 3.56Å; R107-E110 PolarHBondContact NH1-OE1 3.48Å; R107-E110 IonicContact NH1-OE2 3.62Å; R107-E110 PolarHBondContact NH1-OE2 3.35Å; E110-F113 PolarHBondContact O-N 3.39Å; E110-S114 WeakPolarHBondContact O-CB 3.35Å; E110-S114 PolarHBondContact O-N 3.15Å; E110-S114 PolarHBondContact O-OG 3.13Å
111	A	86	Confident	80.5	Confident	59 Å²	59	66.3 Å²	66.3	49%	0.488	38%	0.376	S	S	.	.	H	α-helix	trans	-64.4	-43.1	178.2	0	0	0	0	0	112.2	R107 Y108 F113 G115	R107-A111 WeakPolarHBondContact O-CB 3.26Å; R107-A111 PolarHBondContact O-N 2.96Å; Y108-A111 PolarHBondContact O-N 3.25Å; A111-F113 PolarHBondContact O-N 3.15Å; A111-G115 WeakPolarHBondContact O-CA 3.43Å; A111-G115 PolarHBondContact O-N 3.42Å
112	M	84.9	Confident	79.9	Confident	25 Å²	25	70.2 Å²	70.2	12%	0.123	40%	0.396	C	S	.	.	H	α-helix	trans	-60	-44.8	177.9	-178.6	-175.9	-72.8	0	0	111.9	Y108 F109 E119 V125	Y108-M112 HydrophobicContact CD1-CE 4.26Å; Y108-M112 HydrophobicContact CE1-CE 3.28Å; Y108-M112 HydrophobicContact CE2-CE 4.38Å; Y108-M112 WeakPolarHBondContact O-CB 3.49Å; Y108-M112 PolarHBondContact O-N 3.07Å; Y108-M112 WeakPolarHBondContact OH-CE 3.4Å; F109-M112 HydrophobicContact CD1-SD 4.39Å; F109-M112 PolarHBondContact O-N 2.93Å; M112-E119 HydrophobicContact CG-CB 4.24Å; M112-V125 HydrophobicContact CE-CG1 4.22Å; M112-V125 HydrophobicContact SD-CG1 4.06Å; M112-V125 HydrophobicContact SD-CG2 4.02Å
113	F	84.4	Confident	79.4	Confident	27 Å²	27	75.4 Å²	75.4	12%	0.118	42%	0.424	C	S	.	.	H	α-helix	trans	-83.5	-25.4	-176.1	-60.9	-35.4	0	0	0	113.9	V86 R99 L102 A103 F109 E110 A111	V86-F113 HydrophobicContact CG1-CZ 4.37Å; V86-F113 HydrophobicContact CG2-CE1 4.4Å; V86-F113 HydrophobicContact CG2-CZ 4.3Å; R99-F113 HydrophobicContact CB-CD2 3.84Å; R99-F113 HydrophobicContact CB-CE2 3.87Å; R99-F113 HydrophobicContact CB-CG 4.4Å; R99-F113 HydrophobicContact CB-CZ 4.43Å; R99-F113 HydrophobicContact CG-CD1 4.45Å; R99-F113 HydrophobicContact CG-CD2 4.13Å; R99-F113 HydrophobicContact CG-CE1 4.22Å; R99-F113 HydrophobicContact CG-CE2 3.9Å; R99-F113 HydrophobicContact CG-CG 4.41Å; R99-F113 HydrophobicContact CG-CZ 3.95Å; R99-F113 VanDerWaalsContact NH2-CD1 3.31Å; L102-F113 HydrophobicContact CB-CE2 4.13Å; L102-F113 HydrophobicContact CD1-CE2 4.34Å; L102-F113 HydrophobicContact CD1-CZ 4.45Å; A103-F113 HydrophobicContact CB-CD2 4.43Å; F109-F113 HydrophobicContact CB-CD2 4.26Å; F109-F113 HydrophobicContact CB-CE2 3.93Å; F109-F113 HydrophobicContact CD1-CE2 4.13Å; F109-F113 HydrophobicContact CD1-CZ 4.07Å; F109-F113 HydrophobicContact CG-CE2 4.37Å; F109-F113 WeakPolarHBondContact O-CB 3.41Å; F109-F113 WeakPolarHBondContact O-CD2 3.48Å; F109-F113 VanDerWaalsContact O-CG 3.31Å; F109-F113 WeakPolarHBondContact O-CG 3.42Å; F109-F113 PolarHBondContact O-N 3.5Å; E110-F113 PolarHBondContact O-N 3.39Å; A111-F113 PolarHBondContact O-N 3.15Å
114	S	82.1	Confident	79.1	Confident	92 Å²	92	79.6 Å²	79.6	64%	0.643	44%	0.439	S	S	*	.	H	α-helix	trans	-90.4	-21	178.4	63.4	0	0	0	0	114.1	E110 G116	E110-S114 WeakPolarHBondContact O-CB 3.35Å; E110-S114 PolarHBondContact O-N 3.15Å; E110-S114 PolarHBondContact O-OG 3.13Å; S114-G116 VanDerWaalsContact C-N 3.29Å; S114-G116 PolarHBondContact O-N 3.48Å; S114-G116 VanDerWaalsContact O-N 3.12Å
115	G	69.5	Low	78.9	Confident	44 Å²	44	76.4 Å²	76.4	45%	0.454	41%	0.411	S	S	.	.	S	Bend	trans	-73	0.7	-166.2	0	0	0	0	0	117.7	A111 L117	A111-G115 WeakPolarHBondContact O-CA 3.43Å; A111-G115 PolarHBondContact O-N 3.42Å; G115-L117 PolarHBondContact O-N 3.02Å
116	G	63.7	Low	78.7	Confident	67 Å²	67	78.1 Å²	78.1	69%	0.691	42%	0.416	S	S	*	.			trans	62.3	11.6	178.6	0	0	0	0	0	115.5	S114	S114-G116 VanDerWaalsContact C-N 3.29Å; S114-G116 PolarHBondContact O-N 3.48Å; S114-G116 VanDerWaalsContact O-N 3.12Å
117	L	67.7	Low	78.2	Confident	112 Å²	112	78.7 Å²	78.7	59%	0.586	42%	0.418	S	S	*	.	S	Bend	trans	-79.7	169.2	176.1	-71.7	154.7	0	0	0	110.8	G115 E119 S120	G115-L117 PolarHBondContact O-N 3.02Å; L117-E119 WeakPolarHBondContact CB-OE2 3.34Å; L117-E119 PolarHBondContact O-N 3.1Å; L117-S120 WeakPolarHBondContact O-CB 3.37Å; L117-S120 PolarHBondContact O-N 3.18Å; L117-S120 PolarHBondContact O-OG 2.92Å
118	R	60.3	Low	77.8	Confident	216 Å²	216	80.3 Å²	80.3	82%	0.815	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-58.1	-34	-177	-77.4	176.4	72.8	121.4	-2.3	112.3	S120 L121 D122	R118-S120 PolarHBondContact O-N 2.9Å; R118-L121 PolarHBondContact O-N 3.14Å; R118-L121 VanDerWaalsContact O-N 3.12Å; R118-D122 PolarHBondContact O-N 2.88Å
119	E	64.7	Low	77.1	Confident	105 Å²	105	84.2 Å²	84.2	49%	0.491	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-64.1	-20.8	177.2	-63	78.6	-176.2	0	0	112.6	M112 L117 L121	M112-E119 HydrophobicContact CG-CB 4.24Å; L117-E119 WeakPolarHBondContact CB-OE2 3.34Å; L117-E119 PolarHBondContact O-N 3.1Å; E119-L121 VanDerWaalsContact C-N 3.3Å
120	S	67.1	Low	76.7	Confident	16 Å²	16	87.5 Å²	87.5	11%	0.112	47%	0.474	C	S	.	.	G	3₁₀ helix	trans	-76.1	-18.5	175.8	72.1	0	0	0	0	113.3	R99 L117 R118	R99-S120 PolarHBondContact NH1-O 3.16Å; R99-S120 VanDerWaalsContact NH1-O 3.09Å; R99-S120 PolarHBondContact NH2-O 3.05Å; L117-S120 WeakPolarHBondContact O-CB 3.37Å; L117-S120 PolarHBondContact O-N 3.18Å; L117-S120 PolarHBondContact O-OG 2.92Å; R118-S120 PolarHBondContact O-N 2.9Å
121	L	66.6	Low	76.6	Confident	145 Å²	145	84.3 Å²	84.3	76%	0.759	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-12.7	180	-67.8	167.1	0	0	0	112.8	R118 E119	R118-L121 PolarHBondContact O-N 3.14Å; R118-L121 VanDerWaalsContact O-N 3.12Å; E119-L121 VanDerWaalsContact C-N 3.3Å
122	D	77.8	Confident	76.6	Confident	99 Å²	99	87.5 Å²	87.5	53%	0.529	46%	0.464	S	S	.	.			trans	-82.2	135.7	-179.7	-122.3	-29	0	0	0	110.7	R118 E124	R118-D122 PolarHBondContact O-N 2.88Å; D122-E124 VanDerWaalsContact C-N 3.27Å
123	N	78.9	Confident	76.8	Confident	108 Å²	108	87.9 Å²	87.9	58%	0.578	47%	0.468	S	S	*	.	S	Bend	trans	-84.4	-8.1	177.5	-65.7	-22.8	0	0	0	111.8	V86 T87	V86-N123 WeakPolarHBondContact CA-O 3.46Å; T87-N123 PolarHBondContact N-O 3.01Å
124	E	84.6	Confident	77.1	Confident	114 Å²	114	93.4 Å²	93.4	53%	0.533	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	126.5	-177.8	-62.7	-172.5	166.7	0	0	110.6	T87 D122	T87-E124 WeakPolarHBondContact O-CA 3.18Å; D122-E124 VanDerWaalsContact C-N 3.27Å
125	V	84.6	Confident	77.6	Confident	17 Å²	17	89.4 Å²	89.4	10%	0.103	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	120.1	175.6	180	0	0	0	0	108	V86 T87 L88 W89 M112 F127	V86-V125 HydrophobicContact CG2-CG2 4.15Å; T87-V125 PolarHBondContact O-N 3.08Å; L88-V125 CarbonylContact C-O 3.54Å; L88-V125 WeakPolarHBondContact CA-O 3.39Å; L88-V125 HydrophobicContact CD2-CB 3.75Å; L88-V125 HydrophobicContact CD2-CG1 4.34Å; L88-V125 HydrophobicContact CD2-CG2 4.22Å; W89-V125 PolarHBondContact N-O 3.41Å; M112-V125 HydrophobicContact CE-CG1 4.22Å; M112-V125 HydrophobicContact SD-CG1 4.06Å; M112-V125 HydrophobicContact SD-CG2 4.02Å; V125-F127 HydrophobicContact CG1-CE1 4.38Å; V125-F127 HydrophobicContact CG1-CE2 4.01Å; V125-F127 HydrophobicContact CG1-CZ 3.87Å
126	N	83.6	Confident	78.6	Confident	89 Å²	89	87.4 Å²	87.4	48%	0.476	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	115.2	-174.7	-167.2	-20.3	0	0	0	111.9	W89 R128	W89-N126 HydrophobicContact CB-CB 3.99Å; N126-R128 WeakPolarHBondContact OD1-CA 3.39Å; N126-R128 PolarHBondContact OD1-N 3.37Å
127	F	81.4	Confident	79.9	Confident	16 Å²	16	87.5 Å²	87.5	7%	0.07	43%	0.427	C	S	.	.			trans	-85.8	-6.5	176.8	-63.6	-74.2	0	0	0	113.1	L88 W89 Y108 F109 V125 D129 S130 V131 L136 L165	L88-F127 HydrophobicContact CB-CE2 4.3Å; L88-F127 HydrophobicContact CD1-CE2 4.33Å; L88-F127 HydrophobicContact CD2-CE2 4.13Å; L88-F127 HydrophobicContact CG-CE2 4.49Å; W89-F127 PolarHBondContact O-N 2.9Å; Y108-F127 HydrophobicContact CE1-CE1 4.17Å; Y108-F127 HydrophobicContact CE1-CZ 4.41Å; F109-F127 AromaticContact CE1-CZ 3.91Å; F109-F127 HydrophobicContact CE1-CZ 3.91Å; F109-F127 AromaticContact CZ-CZ 4Å; F109-F127 HydrophobicContact CZ-CZ 4Å; V125-F127 HydrophobicContact CG1-CE1 4.38Å; V125-F127 HydrophobicContact CG1-CE2 4.01Å; V125-F127 HydrophobicContact CG1-CZ 3.87Å; F127-D129 PolarHBondContact O-N 2.94Å; F127-D129 VanDerWaalsContact O-N 3.14Å; F127-S130 WeakPolarHBondContact O-CB 3.47Å; F127-S130 PolarHBondContact O-N 3.39Å; F127-S130 PolarHBondContact O-OG 3.22Å; F127-V131 HydrophobicContact CB-CG2 4.31Å; F127-V131 HydrophobicContact CG-CG2 4.45Å; F127-L136 HydrophobicContact CD2-CD2 4.26Å; F127-L165 HydrophobicContact CE1-CD2 3.69Å; F127-L165 HydrophobicContact CZ-CD2 3.95Å
128	R	79.5	Confident	81.1	Confident	185 Å²	185	84.1 Å²	84.1	70%	0.698	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	-119.5	-178.6	-57.5	-179	-178.2	-179.7	0.7	110.2	G91 N126	G91-R128 PolarHBondContact N-O 2.75Å; N126-R128 WeakPolarHBondContact OD1-CA 3.39Å; N126-R128 PolarHBondContact OD1-N 3.37Å
129	D	74.5	Confident	82.6	Confident	156 Å²	156	73.9 Å²	73.9	83%	0.834	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	6.3	-178.6	-55.8	-39.9	0	0	0	113.4	F127 V131	F127-D129 PolarHBondContact O-N 2.94Å; F127-D129 VanDerWaalsContact O-N 3.14Å; D129-V131 VanDerWaalsContact C-N 3.33Å; D129-V131 PolarHBondContact O-N 3.05Å
130	S	80	Confident	83.9	Confident	71 Å²	71	69 Å²	69	50%	0.497	35%	0.348	S	S	.	.	S	Bend	trans	-78.9	-15.5	-176.7	77.7	0	0	0	0	113.9	F127	F127-S130 WeakPolarHBondContact O-CB 3.47Å; F127-S130 PolarHBondContact O-N 3.39Å; F127-S130 PolarHBondContact O-OG 3.22Å
131	V	85.7	Confident	85	Confident	8 Å²	8	70.5 Å²	70.5	5%	0.048	36%	0.355	C	S	.	.	S	Bend	trans	-139.2	131.1	177.4	-172.1	0	0	0	0	109.6	F127 D129 V135 L136 A161 M164	F127-V131 HydrophobicContact CB-CG2 4.31Å; F127-V131 HydrophobicContact CG-CG2 4.45Å; D129-V131 VanDerWaalsContact C-N 3.33Å; D129-V131 PolarHBondContact O-N 3.05Å; V131-V135 HydrophobicContact CG1-CB 4.48Å; V131-L136 HydrophobicContact CG1-CB 3.96Å; V131-A161 HydrophobicContact CG1-CB 4.22Å; V131-M164 HydrophobicContact CG2-CE 3.16Å
132	H	87.9	Confident	86.2	Confident	126 Å²	126	65.5 Å²	65.5	58%	0.583	33%	0.327	S	S	*	.			trans	-63.8	132.5	171.4	-77.8	-66.1	0	0	0	111.1	E134 V135 L136	H132-E134 PolarHBondContact O-N 2.79Å; H132-E134 VanDerWaalsContact O-N 3.16Å; H132-V135 HydrophobicContact CB-CB 4.34Å; H132-V135 HydrophobicContact CB-CG2 3.91Å; H132-V135 WeakPolarHBondContact O-CB 3.3Å; H132-V135 PolarHBondContact O-N 2.94Å; H132-L136 PolarHBondContact O-N 3.32Å
133	P	88.6	Confident	86.8	Confident	32 Å²	32	60.9 Å²	60.9	21%	0.208	30%	0.303	C	S	.	.	H	α-helix	trans	-58.2	-33.3	-175.8	-26.5	34	0	0	0	114.6	A90 R93 F95 E137	A90-P133 HydrophobicContact CB-CB 4.33Å; A90-P133 HydrophobicContact CB-CG 4.19Å; A90-P133 WeakPolarHBondContact O-CG 3.3Å; R93-P133 HydrophobicContact CB-CB 4.13Å; R93-P133 HydrophobicContact CG-CB 4.19Å; F95-P133 HydrophobicContact CZ-CB 4.48Å; F95-P133 WeakPolarHBondContact CZ-O 3.41Å; P133-E137 WeakPolarHBondContact O-CB 3.46Å; P133-E137 PolarHBondContact O-N 3.35Å
134	E	90	Very high	87.4	Confident	144 Å²	144	55.8 Å²	55.8	67%	0.673	28%	0.276	S	S	*	.	H	α-helix	trans	-68.2	-38.2	177.4	-62.8	179.7	-175.1	0	0	112	H132 E137 L138	H132-E134 PolarHBondContact O-N 2.79Å; H132-E134 VanDerWaalsContact O-N 3.16Å; E134-E137 PolarHBondContact O-N 3.17Å; E134-L138 WeakPolarHBondContact O-CG 3.47Å; E134-L138 PolarHBondContact O-N 3.41Å
135	V	91.8	Very high	87.6	Confident	8 Å²	8	52.4 Å²	52.4	5%	0.048	27%	0.265	C	S	.	.	H	α-helix	trans	-68.8	-44	177	179.6	0	0	0	0	110	V131 H132 E137 L138 L139 L158 A161	V131-V135 HydrophobicContact CG1-CB 4.48Å; H132-V135 HydrophobicContact CB-CB 4.34Å; H132-V135 HydrophobicContact CB-CG2 3.91Å; H132-V135 WeakPolarHBondContact O-CB 3.3Å; H132-V135 PolarHBondContact O-N 2.94Å; V135-E137 VanDerWaalsContact C-N 3.28Å; V135-E137 PolarHBondContact O-N 3.03Å; V135-L138 WeakPolarHBondContact O-CB 3.35Å; V135-L138 PolarHBondContact O-N 3.01Å; V135-L138 VanDerWaalsContact O-N 3.16Å; V135-L139 WeakPolarHBondContact O-CG 3.22Å; V135-L139 PolarHBondContact O-N 3.34Å; V135-L158 HydrophobicContact CG1-CD2 3.83Å; V135-L158 HydrophobicContact CG1-CG 4.2Å; V135-A161 HydrophobicContact CG1-CB 3.67Å
136	L	91.1	Very high	87.7	Confident	2 Å²	2	55 Å²	55	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-60.4	-40.8	175.8	-175.4	61.5	0	0	0	111.3	L88 A90 F95 F127 V131 H132 L138 L139 L140 L165	L88-L136 HydrophobicContact CB-CD2 4.28Å; L88-L136 HydrophobicContact CD1-CD1 4.44Å; A90-L136 HydrophobicContact CB-CD2 3.7Å; F95-L136 HydrophobicContact CD2-CD2 3.91Å; F95-L136 HydrophobicContact CD2-CG 4.5Å; F95-L136 HydrophobicContact CE2-CD2 4.14Å; F127-L136 HydrophobicContact CD2-CD2 4.26Å; V131-L136 HydrophobicContact CG1-CB 3.96Å; H132-L136 PolarHBondContact O-N 3.32Å; L136-L138 PolarHBondContact O-N 3.5Å; L136-L139 PolarHBondContact O-N 3.08Å; L136-L140 HydrophobicContact CD1-CG 4.5Å; L136-L140 HydrophobicContact CG-CD1 4.23Å; L136-L140 HydrophobicContact CG-CG 4.49Å; L136-L140 WeakPolarHBondContact O-CB 3.21Å; L136-L140 VanDerWaalsContact O-CG 3.22Å; L136-L140 WeakPolarHBondContact O-CG 3.31Å; L136-L140 PolarHBondContact O-N 2.68Å; L136-L165 HydrophobicContact CD1-CD1 4.17Å
137	E	91.3	Very high	88	Confident	69 Å²	69	60.4 Å²	60.4	32%	0.322	30%	0.297	S	S	.	.	H	α-helix	trans	-60.1	-43.6	174.7	-175.3	167	-152.5	0	0	112.1	R93 F95 P133 E134 V135 L140 D141	R93-E137 IonicContact CZ-OE2 3.02Å; R93-E137 VanDerWaalsContact CZ-OE2 3.25Å; R93-E137 IonicContact NH1-OE2 2.64Å; R93-E137 PolarHBondContact NH1-OE2 2.77Å; R93-E137 VanDerWaalsContact NH2-CD 3.3Å; R93-E137 IonicContact NH2-OE1 3.62Å; R93-E137 PolarHBondContact NH2-OE1 2.91Å; R93-E137 IonicContact NH2-OE2 2.65Å; R93-E137 PolarHBondContact NH2-OE2 3.22Å; F95-E137 HydrophobicContact CE1-CB 3.82Å; F95-E137 HydrophobicContact CE1-CG 4.1Å; F95-E137 HydrophobicContact CZ-CB 4.12Å; P133-E137 WeakPolarHBondContact O-CB 3.46Å; P133-E137 PolarHBondContact O-N 3.35Å; E134-E137 PolarHBondContact O-N 3.17Å; V135-E137 VanDerWaalsContact C-N 3.28Å; V135-E137 PolarHBondContact O-N 3.03Å; E137-L140 PolarHBondContact O-N 2.94Å; E137-D141 WeakPolarHBondContact O-CB 3.46Å; E137-D141 PolarHBondContact O-N 3.45Å
138	L	92.5	Very high	88.5	Confident	40 Å²	40	61.5 Å²	61.5	21%	0.209	31%	0.305	C	S	.	.	H	α-helix	trans	-63.6	-41.3	175.7	-71.6	172	0	0	0	112.9	E134 V135 L136 L140 D141 F142 V148 L158	E134-L138 WeakPolarHBondContact O-CG 3.47Å; E134-L138 PolarHBondContact O-N 3.41Å; V135-L138 WeakPolarHBondContact O-CB 3.35Å; V135-L138 PolarHBondContact O-N 3.01Å; V135-L138 VanDerWaalsContact O-N 3.16Å; L136-L138 PolarHBondContact O-N 3.5Å; L138-L140 VanDerWaalsContact C-N 3.34Å; L138-D141 PolarHBondContact O-N 2.68Å; L138-F142 WeakPolarHBondContact O-CB 3.44Å; L138-F142 PolarHBondContact O-N 2.62Å; L138-V148 HydrophobicContact CB-CG2 4.32Å; L138-L158 HydrophobicContact CB-CD2 4.29Å; L138-L158 HydrophobicContact CD1-CD1 4.46Å
139	L	92.2	Very high	89.1	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-63.8	-41.2	175.5	-66.1	177.9	0	0	0	111.5	V135 L136 F142 A143 L158 A161 L165 F167 I170	V135-L139 WeakPolarHBondContact O-CG 3.22Å; V135-L139 PolarHBondContact O-N 3.34Å; L136-L139 PolarHBondContact O-N 3.08Å; L139-F142 WeakPolarHBondContact O-CB 3.31Å; L139-F142 PolarHBondContact O-N 2.89Å; L139-A143 PolarHBondContact O-N 3.3Å; L139-L158 HydrophobicContact CD2-CD2 4.12Å; L139-L158 HydrophobicContact CG-CD2 4.5Å; L139-A161 HydrophobicContact CD1-CB 3.85Å; L139-L165 HydrophobicContact CD1-CD1 3.76Å; L139-F167 HydrophobicContact CD2-CD2 4.5Å; L139-I170 HydrophobicContact CD2-CB 4.42Å; L139-I170 HydrophobicContact CD2-CD1 3.35Å; L139-I170 HydrophobicContact CD2-CG1 4.49Å; L139-I170 HydrophobicContact CD2-CG2 3.97Å
140	L	91.1	Very high	90	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-66.9	-45.6	175.3	-69.2	175.5	0	0	0	110.9	L88 F95 L102 L136 E137 L138 F142 A143 Y144	L88-L140 HydrophobicContact CD1-CD1 4.48Å; L88-L140 HydrophobicContact CD1-CD2 4.04Å; F95-L140 HydrophobicContact CB-CD1 3.57Å; F95-L140 HydrophobicContact CD1-CD1 4.1Å; F95-L140 HydrophobicContact CG-CD1 3.86Å; L102-L140 HydrophobicContact CD2-CD2 3.54Å; L136-L140 HydrophobicContact CD1-CG 4.5Å; L136-L140 HydrophobicContact CG-CD1 4.23Å; L136-L140 HydrophobicContact CG-CG 4.49Å; L136-L140 WeakPolarHBondContact O-CB 3.21Å; L136-L140 VanDerWaalsContact O-CG 3.22Å; L136-L140 WeakPolarHBondContact O-CG 3.31Å; L136-L140 PolarHBondContact O-N 2.68Å; E137-L140 PolarHBondContact O-N 2.94Å; L138-L140 VanDerWaalsContact C-N 3.34Å; L140-F142 PolarHBondContact O-N 3.31Å; L140-A143 WeakPolarHBondContact O-CB 3.49Å; L140-A143 PolarHBondContact O-N 3.05Å; L140-Y144 VanDerWaalsContact O-CD2 3.26Å; L140-Y144 WeakPolarHBondContact O-CD2 3.43Å; L140-Y144 PolarHBondContact O-N 3.03Å
141	D	90.5	Very high	90.6	Very high	49 Å²	49	52.9 Å²	52.9	26%	0.262	27%	0.266	S	S	.	.	H	α-helix	trans	-59	-37.8	176.1	-81.6	-2.9	0	0	0	111.4	R78 E137 L138 Y144 S145	R78-D141 IonicContact CZ-OD1 2.67Å; R78-D141 IonicContact NH1-OD1 3.73Å; R78-D141 IonicContact NH2-OD1 3.79Å; R78-D141 PolarHBondContact NH2-OD1 3.25Å; E137-D141 WeakPolarHBondContact O-CB 3.46Å; E137-D141 PolarHBondContact O-N 3.45Å; L138-D141 PolarHBondContact O-N 2.68Å; D141-Y144 PolarHBondContact O-N 3.16Å; D141-S145 WeakPolarHBondContact O-CB 3.42Å; D141-S145 PolarHBondContact O-N 2.93Å; D141-S145 PolarHBondContact O-OG 3.19Å
142	F	92.6	Very high	90.6	Very high	39 Å²	39	59.3 Å²	59.3	17%	0.171	30%	0.295	C	S	.	.	H	α-helix	trans	-61	-47.7	170.4	176.5	-92.4	0	0	0	112.1	L138 L139 L140 Y144 S145 S146 R147 V148 F167 D169 I170	L138-F142 WeakPolarHBondContact O-CB 3.44Å; L138-F142 PolarHBondContact O-N 2.62Å; L139-F142 WeakPolarHBondContact O-CB 3.31Å; L139-F142 PolarHBondContact O-N 2.89Å; L140-F142 PolarHBondContact O-N 3.31Å; F142-Y144 PolarHBondContact O-N 3.03Å; F142-Y144 VanDerWaalsContact O-N 3.08Å; F142-S145 PolarHBondContact O-N 3.5Å; F142-S146 VanDerWaalsContact O-CA 3.31Å; F142-S146 WeakPolarHBondContact O-CA 3.45Å; F142-S146 PolarHBondContact O-N 3.05Å; F142-R147 WeakPolarHBondContact CA-O 3.45Å; F142-V148 HydrophobicContact CB-CB 4.38Å; F142-V148 HydrophobicContact CD2-CB 4.22Å; F142-V148 HydrophobicContact CD2-CG1 4.29Å; F142-F167 HydrophobicContact CD1-CD1 4.33Å; F142-D169 HydrophobicContact CZ-CB 4.3Å; F142-I170 HydrophobicContact CB-CD1 3.83Å; F142-I170 HydrophobicContact CD1-CD1 3.46Å; F142-I170 VanDerWaalsContact CD1-CD1 3.46Å; F142-I170 HydrophobicContact CD1-CG1 3.9Å; F142-I170 HydrophobicContact CD2-CD1 4.22Å; F142-I170 HydrophobicContact CD2-CG1 4.15Å; F142-I170 HydrophobicContact CE1-CD1 3.99Å; F142-I170 HydrophobicContact CE1-CG1 3.95Å; F142-I170 HydrophobicContact CE2-CG1 4.23Å; F142-I170 HydrophobicContact CG-CD1 3.56Å; F142-I170 HydrophobicContact CG-CG1 3.97Å; F142-I170 HydrophobicContact CZ-CG1 4.12Å
143	A	90.8	Very high	90.6	Very high	3 Å²	3	61.8 Å²	61.8	3%	0.025	31%	0.307	C	S	.	.	H	α-helix	trans	-57.6	-27.8	179.8	0	0	0	0	0	113.4	V101 C105 L139 L140 F167	V101-A143 HydrophobicContact CG1-CB 4.41Å; C105-A143 HydrophobicContact CB-CB 4.3Å; L139-A143 PolarHBondContact O-N 3.3Å; L140-A143 WeakPolarHBondContact O-CB 3.49Å; L140-A143 PolarHBondContact O-N 3.05Å; A143-F167 HydrophobicContact CB-CE1 4.47Å
144	Y	90.4	Very high	90.7	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-106.2	-7.1	-179	-71.1	-87.6	0	0	0	115.1	L74 N75 R78 H98 V101 L140 D141 F142	L74-Y144 HydrophobicContact CB-CD1 4.01Å; L74-Y144 HydrophobicContact CB-CE1 4.21Å; N75-Y144 HydrophobicContact CB-CD1 4.48Å; N75-Y144 HydrophobicContact CB-CG 4.49Å; R78-Y144 HydrophobicContact CB-CE1 4.38Å; H98-Y144 WeakPolarHBondContact CB-OH 3.4Å; H98-Y144 PolarHBondContact N-OH 3.26Å; H98-Y144 AromaticContact ND1-CE1 3.52Å; H98-Y144 AromaticContact ND1-CZ 3.65Å; H98-Y144 PolarHBondContact ND1-OH 3.41Å; V101-Y144 HydrophobicContact CB-CE1 4Å; V101-Y144 HydrophobicContact CG1-CD1 4.14Å; V101-Y144 HydrophobicContact CG1-CD2 4.42Å; V101-Y144 HydrophobicContact CG1-CE1 3.76Å; V101-Y144 HydrophobicContact CG1-CE2 4.02Å; V101-Y144 HydrophobicContact CG1-CG 4.45Å; V101-Y144 HydrophobicContact CG2-CE1 3.81Å; L140-Y144 VanDerWaalsContact O-CD2 3.26Å; L140-Y144 WeakPolarHBondContact O-CD2 3.43Å; L140-Y144 PolarHBondContact O-N 3.03Å; D141-Y144 PolarHBondContact O-N 3.16Å; F142-Y144 PolarHBondContact O-N 3.03Å; F142-Y144 VanDerWaalsContact O-N 3.08Å
145	S	88.7	Confident	90.8	Very high	43 Å²	43	54.3 Å²	54.3	30%	0.301	27%	0.27	S	S	.	.	H	α-helix	trans	-133.1	-11.1	-177.2	74.9	0	0	0	0	115	D141 F142 R147	D141-S145 WeakPolarHBondContact O-CB 3.42Å; D141-S145 PolarHBondContact O-N 2.93Å; D141-S145 PolarHBondContact O-OG 3.19Å; F142-S145 PolarHBondContact O-N 3.5Å; S145-R147 PolarHBondContact O-N 3.03Å; S145-R147 PolarHBondContact OG-N 3.13Å; S145-R147 PolarHBondContact OG-O 3.11Å
146	S	87.6	Confident	90.7	Very high	72 Å²	72	57.5 Å²	57.5	50%	0.503	28%	0.284	S	S	.	.	S	Bend	trans	57.5	23.5	-171.5	-50.2	0	0	0	0	113.9	F142	F142-S146 VanDerWaalsContact O-CA 3.31Å; F142-S146 WeakPolarHBondContact O-CA 3.45Å; F142-S146 PolarHBondContact O-N 3.05Å
147	R	89.1	Confident	90.7	Very high	202 Å²	202	58.8 Å²	58.8	76%	0.762	29%	0.294	S	S	*	.			trans	-131.6	139	-178.6	-63.2	176.8	-173.1	-162.4	-0.4	110.3	F142 S145	F142-R147 WeakPolarHBondContact CA-O 3.45Å; S145-R147 PolarHBondContact O-N 3.03Å; S145-R147 PolarHBondContact OG-N 3.13Å; S145-R147 PolarHBondContact OG-O 3.11Å
148	V	93.2	Very high	90.7	Very high	40 Å²	40	55.5 Å²	55.5	24%	0.242	28%	0.278	C	S	.	.			trans	-138.9	143.7	175.2	64.9	0	0	0	0	109.2	L138 F142 I150 L158	L138-V148 HydrophobicContact CB-CG2 4.32Å; F142-V148 HydrophobicContact CB-CB 4.38Å; F142-V148 HydrophobicContact CD2-CB 4.22Å; F142-V148 HydrophobicContact CD2-CG1 4.29Å; V148-I150 HydrophobicContact CG1-CD1 4.3Å; V148-I150 HydrophobicContact CG1-CG1 4.16Å; V148-L158 HydrophobicContact CG2-CD1 4.39Å; V148-L158 HydrophobicContact CG2-CD2 4.43Å
149	I	91.8	Very high	90.7	Very high	128 Å²	128	53.6 Å²	53.6	66%	0.656	27%	0.268	S	S	*	.			trans	-102.1	118.1	175.7	-60.6	173.2	0	0	0	107.4	N154	I149-N154 PolarHBondContact O-ND2 3.4Å
150	I	93.2	Very high	90.6	Very high	37 Å²	37	57.7 Å²	57.7	19%	0.19	29%	0.287	C	S	.	.			trans	-107.4	128.7	179.3	-51.4	178.6	0	0	0	108.2	V148 N154 A155 L158 A173 F177	V148-I150 HydrophobicContact CG1-CD1 4.3Å; V148-I150 HydrophobicContact CG1-CG1 4.16Å; I150-N154 WeakPolarHBondContact CA-OD1 3.35Å; I150-A155 HydrophobicContact CG2-CB 3.86Å; I150-L158 HydrophobicContact CG1-CD1 4.19Å; I150-A173 HydrophobicContact CD1-CB 3.91Å; I150-F177 HydrophobicContact CG2-CB 3.96Å; I150-F177 HydrophobicContact CG2-CD1 3.78Å; I150-F177 HydrophobicContact CG2-CD2 4.25Å; I150-F177 HydrophobicContact CG2-CE1 4.34Å; I150-F177 HydrophobicContact CG2-CG 3.72Å
151	N	92.1	Very high	90.6	Very high	65 Å²	65	57.9 Å²	57.9	35%	0.348	29%	0.289	S	S	.	.			trans	-134	175.6	177.8	68.8	24.3	0	0	0	109.9	E153 N154 A155	N151-E153 VanDerWaalsContact C-N 3.31Å; N151-E153 PolarHBondContact O-N 3.46Å; N151-E153 PolarHBondContact OD1-N 2.84Å; N151-E153 VanDerWaalsContact OD1-N 3.13Å; N151-N154 PolarHBondContact N-OD1 3.04Å; N151-N154 PolarHBondContact O-N 2.94Å; N151-N154 PolarHBondContact O-OD1 2.95Å; N151-N154 VanDerWaalsContact O-OD1 3.11Å; N151-N154 VanDerWaalsContact OD1-CB 3.26Å; N151-N154 WeakPolarHBondContact OD1-CB 3.38Å; N151-N154 PolarHBondContact OD1-N 3.04Å; N151-N154 PolarHBondContact OD1-ND2 3.39Å; N151-N154 PolarHBondContact OD1-OD1 2.98Å; N151-N154 VanDerWaalsContact OD1-OD1 3.11Å; N151-A155 WeakPolarHBondContact O-CB 3.38Å; N151-A155 PolarHBondContact O-N 3.16Å
152	E	87	Confident	90.6	Very high	143 Å²	143	55.5 Å²	55.5	67%	0.668	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-31.5	-177.3	-65.8	178.4	-179.5	0	0	113.4	F177	E152-F177 HydrophobicContact CG-CE1 4.34Å; E152-F177 HydrophobicContact CG-CZ 4.35Å
153	E	87.8	Confident	90.5	Very high	178 Å²	178	55.9 Å²	55.9	83%	0.832	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-29.1	-178.2	-62.8	179.7	172.7	0	0	112.8	N151	N151-E153 VanDerWaalsContact C-N 3.31Å; N151-E153 PolarHBondContact O-N 3.46Å; N151-E153 PolarHBondContact OD1-N 2.84Å; N151-E153 VanDerWaalsContact OD1-N 3.13Å
154	N	91.1	Very high	90.4	Very high	19 Å²	19	59.4 Å²	59.4	10%	0.102	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-15.7	-173.7	76.7	12.3	0	0	0	113.9	I149 I150 N151 E156 S157 L158	I149-N154 PolarHBondContact O-ND2 3.4Å; I150-N154 WeakPolarHBondContact CA-OD1 3.35Å; N151-N154 PolarHBondContact N-OD1 3.04Å; N151-N154 PolarHBondContact O-N 2.94Å; N151-N154 PolarHBondContact O-OD1 2.95Å; N151-N154 VanDerWaalsContact O-OD1 3.11Å; N151-N154 VanDerWaalsContact OD1-CB 3.26Å; N151-N154 WeakPolarHBondContact OD1-CB 3.38Å; N151-N154 PolarHBondContact OD1-N 3.04Å; N151-N154 PolarHBondContact OD1-ND2 3.39Å; N151-N154 PolarHBondContact OD1-OD1 2.98Å; N151-N154 VanDerWaalsContact OD1-OD1 3.11Å; N154-E156 VanDerWaalsContact C-N 3.34Å; N154-E156 PolarHBondContact O-N 3.39Å; N154-S157 PolarHBondContact O-N 2.89Å; N154-L158 HydrophobicContact CB-CD1 4.18Å; N154-L158 WeakPolarHBondContact O-CB 3.23Å; N154-L158 VanDerWaalsContact O-CG 3.27Å; N154-L158 WeakPolarHBondContact O-CG 3.5Å; N154-L158 PolarHBondContact O-N 2.71Å; N154-L158 WeakPolarHBondContact OD1-CD1 3.38Å
155	A	90.7	Very high	90.4	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-61.1	-41.5	-173	0	0	0	0	0	112.7	I150 N151 L159 F177 L178	I150-A155 HydrophobicContact CG2-CB 3.86Å; N151-A155 WeakPolarHBondContact O-CB 3.38Å; N151-A155 PolarHBondContact O-N 3.16Å; A155-L159 WeakPolarHBondContact O-CB 3.31Å; A155-L159 PolarHBondContact O-N 3.35Å; A155-F177 HydrophobicContact CB-CD1 3.73Å; A155-F177 HydrophobicContact CB-CE1 4.11Å; A155-L178 HydrophobicContact CB-CD2 3.62Å; A155-L178 HydrophobicContact CB-CG 4.08Å
156	E	90.4	Very high	90.5	Very high	75 Å²	75	61.1 Å²	61.1	35%	0.35	30%	0.3	S	S	.	.	H	α-helix	trans	-64.2	-56.9	177.9	-65	179.5	-164.8	0	0	110.3	N154 L158 L159 E160 L178 M190 L193	N154-E156 VanDerWaalsContact C-N 3.34Å; N154-E156 PolarHBondContact O-N 3.39Å; E156-L158 VanDerWaalsContact C-N 3.26Å; E156-L158 PolarHBondContact O-N 3.05Å; E156-L159 WeakPolarHBondContact O-CA 3.42Å; E156-L159 VanDerWaalsContact O-CB 3.31Å; E156-L159 WeakPolarHBondContact O-CB 3.46Å; E156-L159 PolarHBondContact O-N 3.03Å; E156-E160 WeakPolarHBondContact O-CG 3.46Å; E156-E160 PolarHBondContact O-N 3.31Å; E156-L178 HydrophobicContact CG-CD2 4.4Å; E156-M190 HydrophobicContact CG-CE 3.85Å; E156-M190 WeakPolarHBondContact OE1-CE 3.46Å; E156-L193 HydrophobicContact CB-CD2 4.19Å; E156-L193 HydrophobicContact CG-CD2 4.02Å
157	S	90.8	Very high	90.7	Very high	30 Å²	30	58 Å²	58	21%	0.21	28%	0.278	C	S	.	.	H	α-helix	trans	-62.7	-30.1	179.9	-50.3	0	0	0	0	113.5	N154 A161	N154-S157 PolarHBondContact O-N 2.89Å; S157-A161 VanDerWaalsContact O-CB 3.23Å; S157-A161 WeakPolarHBondContact O-CB 3.41Å; S157-A161 PolarHBondContact O-N 3.22Å
158	L	92.2	Very high	90.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-68.4	-37.9	172.6	-82.5	169.3	0	0	0	112.1	V135 L138 L139 V148 I150 N154 E156 G162 I170 A174	V135-L158 HydrophobicContact CG1-CD2 3.83Å; V135-L158 HydrophobicContact CG1-CG 4.2Å; L138-L158 HydrophobicContact CB-CD2 4.29Å; L138-L158 HydrophobicContact CD1-CD1 4.46Å; L139-L158 HydrophobicContact CD2-CD2 4.12Å; L139-L158 HydrophobicContact CG-CD2 4.5Å; V148-L158 HydrophobicContact CG2-CD1 4.39Å; V148-L158 HydrophobicContact CG2-CD2 4.43Å; I150-L158 HydrophobicContact CG1-CD1 4.19Å; N154-L158 HydrophobicContact CB-CD1 4.18Å; N154-L158 WeakPolarHBondContact O-CB 3.23Å; N154-L158 VanDerWaalsContact O-CG 3.27Å; N154-L158 WeakPolarHBondContact O-CG 3.5Å; N154-L158 PolarHBondContact O-N 2.71Å; N154-L158 WeakPolarHBondContact OD1-CD1 3.38Å; E156-L158 VanDerWaalsContact C-N 3.26Å; E156-L158 PolarHBondContact O-N 3.05Å; L158-G162 WeakPolarHBondContact O-CA 3.49Å; L158-G162 PolarHBondContact O-N 3.32Å; L158-I170 HydrophobicContact CD2-CG2 4.21Å; L158-A174 HydrophobicContact CB-CB 4.39Å
159	L	91.4	Very high	90.6	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.3	-48.2	174.4	-173.3	75.7	0	0	0	110.3	A155 E156 G162 D163 R171 A174 A175 L178 L193	A155-L159 WeakPolarHBondContact O-CB 3.31Å; A155-L159 PolarHBondContact O-N 3.35Å; E156-L159 WeakPolarHBondContact O-CA 3.42Å; E156-L159 VanDerWaalsContact O-CB 3.31Å; E156-L159 WeakPolarHBondContact O-CB 3.46Å; E156-L159 PolarHBondContact O-N 3.03Å; L159-G162 PolarHBondContact O-N 2.9Å; L159-D163 WeakPolarHBondContact O-CB 3.45Å; L159-D163 PolarHBondContact O-N 2.88Å; L159-R171 HydrophobicContact CD1-CB 4.42Å; L159-R171 HydrophobicContact CD1-CG 3.56Å; L159-R171 WeakPolarHBondContact CD1-O 3.26Å; L159-R171 HydrophobicContact CG-CG 4.43Å; L159-A174 HydrophobicContact CB-CB 4.15Å; L159-A174 HydrophobicContact CD1-CB 4.21Å; L159-A175 HydrophobicContact CD1-CB 3.92Å; L159-L178 HydrophobicContact CD2-CD1 4.04Å; L159-L193 HydrophobicContact CD2-CD2 3.75Å; L159-L193 HydrophobicContact CD2-CG 3.92Å
160	E	90.1	Very high	90.6	Very high	86 Å²	86	50.2 Å²	50.2	40%	0.402	25%	0.249	S	C	.	.	H	α-helix	trans	-61.2	-51.4	179.7	-59.1	-175.2	161.9	0	0	111.6	E156 D163 M164 L193 H197	E156-E160 WeakPolarHBondContact O-CG 3.46Å; E156-E160 PolarHBondContact O-N 3.31Å; E160-D163 PolarHBondContact O-N 3.39Å; E160-M164 WeakPolarHBondContact O-CB 3.31Å; E160-M164 PolarHBondContact O-N 3.29Å; E160-L193 HydrophobicContact CG-CD1 3.84Å; E160-H197 WeakPolarHBondContact CG-NE2 3.4Å
161	A	90.7	Very high	90.5	Very high	6 Å²	6	50.8 Å²	50.8	5%	0.05	25%	0.248	C	C	.	.	H	α-helix	trans	-69.5	-35.2	-178.8	0	0	0	0	0	112	V131 V135 L139 S157 L165	V131-A161 HydrophobicContact CG1-CB 4.22Å; V135-A161 HydrophobicContact CG1-CB 3.67Å; L139-A161 HydrophobicContact CD1-CB 3.85Å; S157-A161 VanDerWaalsContact O-CB 3.23Å; S157-A161 WeakPolarHBondContact O-CB 3.41Å; S157-A161 PolarHBondContact O-N 3.22Å; A161-L165 VanDerWaalsContact O-CB 3.3Å; A161-L165 WeakPolarHBondContact O-CB 3.49Å; A161-L165 PolarHBondContact O-N 3.26Å
162	G	91.1	Very high	90.4	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.2	-39.9	175.5	0	0	0	0	0	112.2	L158 L159 Q166 F167	L158-G162 WeakPolarHBondContact O-CA 3.49Å; L158-G162 PolarHBondContact O-N 3.32Å; L159-G162 PolarHBondContact O-N 2.9Å; G162-Q166 CarbonylContact O-C 3.59Å; G162-Q166 WeakPolarHBondContact O-CA 3.27Å; G162-Q166 PolarHBondContact O-N 3.08Å; G162-F167 PolarHBondContact O-N 3.02Å
163	D	90.1	Very high	90.6	Very high	46 Å²	46	46.8 Å²	46.8	25%	0.246	24%	0.237	C	C	.	.	H	α-helix	trans	-70.9	-48.8	174.5	-169.7	55	0	0	0	111.8	L159 E160 L165 Q166 R171 H197	L159-D163 WeakPolarHBondContact O-CB 3.45Å; L159-D163 PolarHBondContact O-N 2.88Å; E160-D163 PolarHBondContact O-N 3.39Å; D163-L165 PolarHBondContact O-N 3.03Å; D163-Q166 PolarHBondContact O-N 3.39Å; D163-Q166 VanDerWaalsContact O-N 3.08Å; D163-R171 HydrophobicContact CB-CG 4.36Å; D163-R171 IonicContact OD1-NH1 2.7Å; D163-H197 HydrophobicContact CB-CB 4.37Å; D163-H197 IonicContact OD2-CG 3.58Å; D163-H197 IonicContact OD2-ND1 3.39Å; D163-H197 PolarHBondContact OD2-ND1 3.49Å; D163-H197 VanDerWaalsContact OD2-ND1 3.11Å
164	M	89.4	Confident	90.8	Very high	78 Å²	78	38.3 Å²	38.3	38%	0.384	20%	0.197	S	C	.	.	H	α-helix	trans	-59.5	-46.4	-179.7	-178.3	177.4	68.2	0	0	112.8	V131 E160 Q166	V131-M164 HydrophobicContact CG2-CE 3.16Å; E160-M164 WeakPolarHBondContact O-CB 3.31Å; E160-M164 PolarHBondContact O-N 3.29Å; M164-Q166 VanDerWaalsContact C-N 3.29Å
165	L	90.2	Very high	90.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	6.9	178.9	-60.3	176.4	0	0	0	112.5	S106 Y108 F109 F127 L136 L139 A161 D163 F167	S106-L165 WeakPolarHBondContact CB-O 3.49Å; S106-L165 PolarHBondContact OG-O 3.38Å; Y108-L165 WeakPolarHBondContact CB-O 3.42Å; Y108-L165 HydrophobicContact CD1-CD2 3.68Å; Y108-L165 HydrophobicContact CE1-CD2 3.6Å; Y108-L165 HydrophobicContact CG-CD2 4.45Å; F109-L165 HydrophobicContact CZ-CD2 4.21Å; F127-L165 HydrophobicContact CE1-CD2 3.69Å; F127-L165 HydrophobicContact CZ-CD2 3.95Å; L136-L165 HydrophobicContact CD1-CD1 4.17Å; L139-L165 HydrophobicContact CD1-CD1 3.76Å; A161-L165 VanDerWaalsContact O-CB 3.3Å; A161-L165 WeakPolarHBondContact O-CB 3.49Å; A161-L165 PolarHBondContact O-N 3.26Å; D163-L165 PolarHBondContact O-N 3.03Å; L165-F167 VanDerWaalsContact C-N 3.34Å; L165-F167 HydrophobicContact CB-CD2 3.83Å; L165-F167 HydrophobicContact CB-CE2 4Å; L165-F167 PolarHBondContact O-N 2.79Å
166	Q	91.6	Very high	90.7	Very high	78 Å²	78	42 Å²	42	36%	0.364	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	38.3	176.1	-57	-178.9	-8.4	0	0	114.9	R107 Y108 G162 D163 M164 H168	R107-Q166 HydrophobicContact CB-CB 4.43Å; Y108-Q166 VanDerWaalsContact N-OE1 3.1Å; G162-Q166 CarbonylContact O-C 3.59Å; G162-Q166 WeakPolarHBondContact O-CA 3.27Å; G162-Q166 PolarHBondContact O-N 3.08Å; D163-Q166 PolarHBondContact O-N 3.39Å; D163-Q166 VanDerWaalsContact O-N 3.08Å; M164-Q166 VanDerWaalsContact C-N 3.29Å; Q166-H168 PolarHBondContact O-N 3.3Å
167	F	91.3	Very high	90.8	Very high	7 Å²	7	41.1 Å²	41.1	3%	0.031	21%	0.211	C	C	.	.			trans	-87.3	78.9	164.2	-73.4	-93.4	0	0	0	110.1	C105 F109 L139 F142 A143 G162 L165 D169 I170 R171	C105-F167 HydrophobicContact CB-CE1 3.81Å; C105-F167 HydrophobicContact CB-CZ 4.5Å; F109-F167 HydrophobicContact CD2-CE2 4.37Å; F109-F167 AromaticContact CE2-CE2 3.97Å; F109-F167 HydrophobicContact CE2-CE2 3.97Å; F109-F167 HydrophobicContact CE2-CZ 4.31Å; L139-F167 HydrophobicContact CD2-CD2 4.5Å; F142-F167 HydrophobicContact CD1-CD1 4.33Å; A143-F167 HydrophobicContact CB-CE1 4.47Å; G162-F167 PolarHBondContact O-N 3.02Å; L165-F167 VanDerWaalsContact C-N 3.34Å; L165-F167 HydrophobicContact CB-CD2 3.83Å; L165-F167 HydrophobicContact CB-CE2 4Å; L165-F167 PolarHBondContact O-N 2.79Å; F167-D169 VanDerWaalsContact C-N 3.33Å; F167-D169 PolarHBondContact O-N 3.28Å; F167-I170 HydrophobicContact CB-CB 4.21Å; F167-I170 HydrophobicContact CB-CD1 3.94Å; F167-I170 HydrophobicContact CB-CG1 4.23Å; F167-I170 HydrophobicContact CD1-CD1 3.96Å; F167-I170 HydrophobicContact CG-CD1 4.12Å; F167-I170 PolarHBondContact O-N 3.49Å; F167-R171 PolarHBondContact O-N 3.37Å
168	H	89.6	Confident	90.8	Very high	84 Å²	84	40.1 Å²	40.1	39%	0.389	20%	0.203	S	C	.	.	H	α-helix	trans	-59.3	-38.6	-174.7	-64.1	-52.5	0	0	0	113.8	Q166 I170 R171 D172	Q166-H168 PolarHBondContact O-N 3.3Å; H168-I170 VanDerWaalsContact C-N 3.31Å; H168-I170 PolarHBondContact O-N 3.08Å; H168-R171 PolarHBondContact ND1-NH1 3.45Å; H168-R171 PolarHBondContact O-N 3.22Å; H168-D172 WeakPolarHBondContact O-CB 3.39Å; H168-D172 PolarHBondContact O-N 2.93Å
169	D	90.4	Very high	90.7	Very high	122 Å²	122	41.7 Å²	41.7	65%	0.652	21%	0.21	S	C	*	.	H	α-helix	trans	-63.2	-38.4	180	-60.7	-39.1	0	0	0	112.1	F142 F167 A173	F142-D169 HydrophobicContact CZ-CB 4.3Å; F167-D169 VanDerWaalsContact C-N 3.33Å; F167-D169 PolarHBondContact O-N 3.28Å; D169-A173 VanDerWaalsContact O-CB 3.31Å; D169-A173 WeakPolarHBondContact O-CB 3.22Å; D169-A173 PolarHBondContact O-N 3.5Å
170	I	91.5	Very high	90.5	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-74.2	-41.9	178.7	-58.4	175.5	0	0	0	110.1	L139 F142 L158 F167 H168 D172 A173 A174	L139-I170 HydrophobicContact CD2-CB 4.42Å; L139-I170 HydrophobicContact CD2-CD1 3.35Å; L139-I170 HydrophobicContact CD2-CG1 4.49Å; L139-I170 HydrophobicContact CD2-CG2 3.97Å; F142-I170 HydrophobicContact CB-CD1 3.83Å; F142-I170 HydrophobicContact CD1-CD1 3.46Å; F142-I170 VanDerWaalsContact CD1-CD1 3.46Å; F142-I170 HydrophobicContact CD1-CG1 3.9Å; F142-I170 HydrophobicContact CD2-CD1 4.22Å; F142-I170 HydrophobicContact CD2-CG1 4.15Å; F142-I170 HydrophobicContact CE1-CD1 3.99Å; F142-I170 HydrophobicContact CE1-CG1 3.95Å; F142-I170 HydrophobicContact CE2-CG1 4.23Å; F142-I170 HydrophobicContact CG-CD1 3.56Å; F142-I170 HydrophobicContact CG-CG1 3.97Å; F142-I170 HydrophobicContact CZ-CG1 4.12Å; L158-I170 HydrophobicContact CD2-CG2 4.21Å; F167-I170 HydrophobicContact CB-CB 4.21Å; F167-I170 HydrophobicContact CB-CD1 3.94Å; F167-I170 HydrophobicContact CB-CG1 4.23Å; F167-I170 HydrophobicContact CD1-CD1 3.96Å; F167-I170 HydrophobicContact CG-CD1 4.12Å; F167-I170 PolarHBondContact O-N 3.49Å; H168-I170 VanDerWaalsContact C-N 3.31Å; H168-I170 PolarHBondContact O-N 3.08Å; I170-D172 VanDerWaalsContact C-N 3.32Å; I170-D172 PolarHBondContact O-N 3.28Å; I170-A173 PolarHBondContact O-N 2.98Å; I170-A174 VanDerWaalsContact O-CB 3.31Å; I170-A174 WeakPolarHBondContact O-CB 3.16Å; I170-A174 PolarHBondContact O-N 2.83Å
171	R	90.6	Very high	90.4	Very high	49 Å²	49	46.9 Å²	46.9	19%	0.185	23%	0.234	C	C	.	.	H	α-helix	trans	-56.5	-48.1	174.4	-177.8	-159.4	65.8	-166.3	-2.8	110.7	L159 D163 F167 H168 A174 A175	L159-R171 HydrophobicContact CD1-CB 4.42Å; L159-R171 HydrophobicContact CD1-CG 3.56Å; L159-R171 WeakPolarHBondContact CD1-O 3.26Å; L159-R171 HydrophobicContact CG-CG 4.43Å; D163-R171 HydrophobicContact CB-CG 4.36Å; D163-R171 IonicContact OD1-NH1 2.7Å; F167-R171 PolarHBondContact O-N 3.37Å; H168-R171 PolarHBondContact ND1-NH1 3.45Å; H168-R171 PolarHBondContact O-N 3.22Å; R171-A174 PolarHBondContact O-N 2.85Å; R171-A175 WeakPolarHBondContact O-CB 3.31Å; R171-A175 PolarHBondContact O-N 2.89Å
172	D	90.1	Very high	90.2	Very high	83 Å²	83	48.2 Å²	48.2	44%	0.444	24%	0.24	S	C	.	.	H	α-helix	trans	-68.6	-38	-177.7	-65.9	-6.8	0	0	0	111.2	H168 I170 A175 E176	H168-D172 WeakPolarHBondContact O-CB 3.39Å; H168-D172 PolarHBondContact O-N 2.93Å; I170-D172 VanDerWaalsContact C-N 3.32Å; I170-D172 PolarHBondContact O-N 3.28Å; D172-A175 PolarHBondContact O-N 3.45Å; D172-E176 PolarHBondContact O-N 2.99Å
173	A	91.5	Very high	89.9	Confident	40 Å²	40	53.2 Å²	53.2	33%	0.331	26%	0.263	S	S	.	.	H	α-helix	trans	-66.2	-40.7	173.8	0	0	0	0	0	113.1	I150 D169 I170 E176 F177	I150-A173 HydrophobicContact CD1-CB 3.91Å; D169-A173 VanDerWaalsContact O-CB 3.31Å; D169-A173 WeakPolarHBondContact O-CB 3.22Å; D169-A173 PolarHBondContact O-N 3.5Å; I170-A173 PolarHBondContact O-N 2.98Å; A173-E176 PolarHBondContact O-N 3.02Å; A173-F177 PolarHBondContact O-N 3.22Å
174	A	91.8	Very high	89.5	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.9	-44.1	174.7	0	0	0	0	0	110.9	L158 L159 I170 R171 E176 F177 L178	L158-A174 HydrophobicContact CB-CB 4.39Å; L159-A174 HydrophobicContact CB-CB 4.15Å; L159-A174 HydrophobicContact CD1-CB 4.21Å; I170-A174 VanDerWaalsContact O-CB 3.31Å; I170-A174 WeakPolarHBondContact O-CB 3.16Å; I170-A174 PolarHBondContact O-N 2.83Å; R171-A174 PolarHBondContact O-N 2.85Å; A174-E176 PolarHBondContact O-N 3.42Å; A174-F177 WeakPolarHBondContact O-CB 3.37Å; A174-F177 PolarHBondContact O-N 3.38Å; A174-L178 WeakPolarHBondContact O-CG 3.11Å; A174-L178 PolarHBondContact O-N 2.95Å
175	A	89.9	Confident	89.2	Confident	9 Å²	9	53.1 Å²	53.1	7%	0.074	27%	0.274	C	S	.	.	H	α-helix	trans	-59.4	-44.2	175.1	0	0	0	0	0	111.8	L159 R171 D172 F177 L178 E179	L159-A175 HydrophobicContact CD1-CB 3.92Å; R171-A175 WeakPolarHBondContact O-CB 3.31Å; R171-A175 PolarHBondContact O-N 2.89Å; D172-A175 PolarHBondContact O-N 3.45Å; A175-F177 VanDerWaalsContact C-N 3.31Å; A175-F177 PolarHBondContact O-N 3.38Å; A175-L178 PolarHBondContact O-N 2.83Å; A175-E179 WeakPolarHBondContact O-CG 3.34Å; A175-E179 PolarHBondContact O-N 3.34Å
176	E	90.9	Very high	88.9	Confident	89 Å²	89	55.5 Å²	55.5	42%	0.416	29%	0.286	S	S	.	.	H	α-helix	trans	-63.8	-36.5	177.1	-166.3	-172	155.8	0	0	112.4	D172 A173 A174 K180	D172-E176 PolarHBondContact O-N 2.99Å; A173-E176 PolarHBondContact O-N 3.02Å; A174-E176 PolarHBondContact O-N 3.42Å; E176-K180 WeakPolarHBondContact O-CG 3.36Å; E176-K180 PolarHBondContact O-N 3.44Å; E176-K180 WeakPolarHBondContact OE1-CE 3.46Å; E176-K180 IonicContact OE1-NZ 3.08Å; E176-K180 PolarHBondContact OE1-NZ 3.45Å
177	F	92.2	Very high	88.7	Confident	56 Å²	56	51.8 Å²	51.8	25%	0.246	27%	0.269	C	S	.	.	H	α-helix	trans	-65.7	-43.1	174.5	-178.5	-92.8	0	0	0	111.8	I150 E152 A155 A173 A174 A175 E179 K180 N181	I150-F177 HydrophobicContact CG2-CB 3.96Å; I150-F177 HydrophobicContact CG2-CD1 3.78Å; I150-F177 HydrophobicContact CG2-CD2 4.25Å; I150-F177 HydrophobicContact CG2-CE1 4.34Å; I150-F177 HydrophobicContact CG2-CG 3.72Å; E152-F177 HydrophobicContact CG-CE1 4.34Å; E152-F177 HydrophobicContact CG-CZ 4.35Å; A155-F177 HydrophobicContact CB-CD1 3.73Å; A155-F177 HydrophobicContact CB-CE1 4.11Å; A173-F177 PolarHBondContact O-N 3.22Å; A174-F177 WeakPolarHBondContact O-CB 3.37Å; A174-F177 PolarHBondContact O-N 3.38Å; A175-F177 VanDerWaalsContact C-N 3.31Å; A175-F177 PolarHBondContact O-N 3.38Å; F177-E179 VanDerWaalsContact C-N 3.35Å; F177-K180 PolarHBondContact O-N 3.5Å; F177-N181 WeakPolarHBondContact CE1-ND2 3.46Å; F177-N181 WeakPolarHBondContact CE2-ND2 3.41Å; F177-N181 VanDerWaalsContact CZ-ND2 3.27Å; F177-N181 WeakPolarHBondContact CZ-ND2 3.3Å; F177-N181 PolarHBondContact O-N 3.08Å; F177-N181 PolarHBondContact O-ND2 3.1Å
178	L	90.4	Very high	88.4	Confident	9 Å²	9	51.5 Å²	51.5	5%	0.047	27%	0.268	C	S	.	.	H	α-helix	trans	-65.4	-37.4	176.8	-67.9	175	0	0	0	112	A155 E156 L159 A174 A175 K180 N181 L182 M190 L193 L202	A155-L178 HydrophobicContact CB-CD2 3.62Å; A155-L178 HydrophobicContact CB-CG 4.08Å; E156-L178 HydrophobicContact CG-CD2 4.4Å; L159-L178 HydrophobicContact CD2-CD1 4.04Å; A174-L178 WeakPolarHBondContact O-CG 3.11Å; A174-L178 PolarHBondContact O-N 2.95Å; A175-L178 PolarHBondContact O-N 2.83Å; L178-K180 VanDerWaalsContact C-N 3.3Å; L178-K180 PolarHBondContact O-N 3.32Å; L178-N181 CarbonylContact O-C 3.46Å; L178-N181 PolarHBondContact O-N 2.97Å; L178-L182 PolarHBondContact O-N 3.2Å; L178-M190 HydrophobicContact CB-SD 4.1Å; L178-M190 HydrophobicContact CD1-SD 3.91Å; L178-M190 HydrophobicContact CD2-CE 3.57Å; L178-M190 HydrophobicContact CD2-SD 3.85Å; L178-M190 HydrophobicContact CG-CE 4.49Å; L178-M190 HydrophobicContact CG-SD 4.16Å; L178-L193 HydrophobicContact CD1-CD2 4.14Å; L178-L202 HydrophobicContact CB-CD1 4.33Å; L178-L202 HydrophobicContact CB-CD2 4.15Å; L178-L202 HydrophobicContact CD1-CD2 4.21Å
179	E	89	Confident	88.3	Confident	32 Å²	32	48.4 Å²	48.4	15%	0.15	26%	0.259	C	S	.	.	H	α-helix	trans	-60.5	-39.1	174.2	-75.2	179.9	-168.2	0	0	112.4	A175 F177 N181 R201 L202 L205	A175-E179 WeakPolarHBondContact O-CG 3.34Å; A175-E179 PolarHBondContact O-N 3.34Å; F177-E179 VanDerWaalsContact C-N 3.35Å; E179-N181 VanDerWaalsContact C-N 3.33Å; E179-R201 VanDerWaalsContact CD-NE 3.33Å; E179-R201 WeakPolarHBondContact OE1-CD 3.49Å; E179-R201 VanDerWaalsContact OE1-CG 3.25Å; E179-R201 WeakPolarHBondContact OE1-CG 3Å; E179-R201 IonicContact OE1-CZ 3.29Å; E179-R201 IonicContact OE1-NE 2.79Å; E179-R201 PolarHBondContact OE1-NE 3.06Å; E179-R201 IonicContact OE2-CZ 3.65Å; E179-R201 IonicContact OE2-NE 2.89Å; E179-R201 PolarHBondContact OE2-NE 2.89Å; E179-R201 IonicContact OE2-NH2 3.25Å; E179-R201 PolarHBondContact OE2-NH2 3.41Å; E179-L202 HydrophobicContact CG-CB 4.25Å; E179-L202 HydrophobicContact CG-CD1 3.71Å; E179-L205 HydrophobicContact CB-CD1 4.39Å; E179-L205 HydrophobicContact CG-CD1 3.88Å
180	K	87.7	Confident	88.2	Confident	148 Å²	148	42.9 Å²	42.9	64%	0.643	23%	0.229	S	C	*	.	H	α-helix	trans	-72.5	-26.7	179.2	-72.3	172.8	-173.6	162.8	0	112.9	E176 F177 L178	E176-K180 WeakPolarHBondContact O-CG 3.36Å; E176-K180 PolarHBondContact O-N 3.44Å; E176-K180 WeakPolarHBondContact OE1-CE 3.46Å; E176-K180 IonicContact OE1-NZ 3.08Å; E176-K180 PolarHBondContact OE1-NZ 3.45Å; F177-K180 PolarHBondContact O-N 3.5Å; L178-K180 VanDerWaalsContact C-N 3.3Å; L178-K180 PolarHBondContact O-N 3.32Å
181	N	88.1	Confident	88.1	Confident	48 Å²	48	43 Å²	43	26%	0.257	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	26.4	-178.1	-63.9	-62.4	0	0	0	112.7	F177 L178 E179 H183	F177-N181 WeakPolarHBondContact CE1-ND2 3.46Å; F177-N181 WeakPolarHBondContact CE2-ND2 3.41Å; F177-N181 VanDerWaalsContact CZ-ND2 3.27Å; F177-N181 WeakPolarHBondContact CZ-ND2 3.3Å; F177-N181 PolarHBondContact O-N 3.08Å; F177-N181 PolarHBondContact O-ND2 3.1Å; L178-N181 CarbonylContact O-C 3.46Å; L178-N181 PolarHBondContact O-N 2.97Å; E179-N181 VanDerWaalsContact C-N 3.33Å; N181-H183 PolarHBondContact O-CE1 3.28Å; N181-H183 PolarHBondContact O-N 2.64Å; N181-H183 PolarHBondContact O-ND1 3.25Å
182	L	87.2	Confident	88	Confident	33 Å²	33	43.5 Å²	43.5	17%	0.173	24%	0.236	C	C	.	.			trans	-74.8	120.3	178.8	-162.8	102.9	0	0	0	111.2	L178 M190 L202 S206 M209	L178-L182 PolarHBondContact O-N 3.2Å; L182-M190 HydrophobicContact CD1-CB 3.98Å; L182-M190 HydrophobicContact CD1-CG 4.19Å; L182-L202 HydrophobicContact CD1-CD1 4.17Å; L182-S206 VanDerWaalsContact CD1-OG 3.3Å; L182-S206 WeakPolarHBondContact CD1-OG 3.31Å; L182-M209 HydrophobicContact CD2-CB 3.54Å; L182-M209 HydrophobicContact CD2-CG 3.67Å; L182-M209 HydrophobicContact CD2-SD 4.41Å
183	H	84.9	Confident	87.8	Confident	106 Å²	106	40.4 Å²	40.4	49%	0.491	22%	0.219	S	C	.	.			trans	-122	159.9	178.2	-62.2	88.8	0	0	0	110.9	N181 S185 N186 C187	N181-H183 PolarHBondContact O-CE1 3.28Å; N181-H183 PolarHBondContact O-N 2.64Å; N181-H183 PolarHBondContact O-ND1 3.25Å; H183-S185 PolarHBondContact O-N 2.83Å; H183-N186 PolarHBondContact O-N 3.33Å; H183-N186 VanDerWaalsContact O-N 3.15Å; H183-C187 WeakPolarHBondContact O-CB 3.08Å; H183-C187 PolarHBondContact O-N 3.49Å
184	S	81.1	Confident	87.7	Confident	43 Å²	43	38.5 Å²	38.5	30%	0.301	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-29	178.9	52.1	0	0	0	0	113.4	C187	S184-C187 PolarHBondContact O-SG 3.04Å
185	S	82.9	Confident	87.4	Confident	79 Å²	79	42.1 Å²	42.1	55%	0.552	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-27	176.9	52.2	0	0	0	0	114.2	H183	H183-S185 PolarHBondContact O-N 2.83Å
186	N	84.7	Confident	87.3	Confident	49 Å²	49	45 Å²	45	26%	0.262	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-4	-175.2	-164.6	-0.9	0	0	0	112.9	H183 L188 G189 M190	H183-N186 PolarHBondContact O-N 3.33Å; H183-N186 VanDerWaalsContact O-N 3.15Å; N186-L188 VanDerWaalsContact C-N 3.28Å; N186-L188 PolarHBondContact O-N 3.26Å; N186-G189 PolarHBondContact O-N 2.87Å; N186-M190 WeakPolarHBondContact ND2-CE 3.21Å; N186-M190 VanDerWaalsContact O-CG 3.3Å; N186-M190 WeakPolarHBondContact O-CG 3.43Å; N186-M190 PolarHBondContact O-N 2.95Å; N186-M190 WeakPolarHBondContact OD1-CE 3.32Å
187	C	86.6	Confident	87	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.1	-30.6	-172.3	64.7	0	0	0	0	114.1	H183 S184 M191 M209 C210 V217	H183-C187 WeakPolarHBondContact O-CB 3.08Å; H183-C187 PolarHBondContact O-N 3.49Å; S184-C187 PolarHBondContact O-SG 3.04Å; C187-M191 VanDerWaalsContact O-CB 3.3Å; C187-M191 WeakPolarHBondContact O-CB 3.43Å; C187-M191 PolarHBondContact O-N 3.16Å; C187-M209 HydrophobicContact CB-CB 4.16Å; C187-M209 HydrophobicContact CB-CG 4.2Å; C187-C210 PolarHBondContact SG-SG 3.35Å; C187-V217 WeakPolarHBondContact SG-CG2 3.25Å
188	L	86	Confident	86.6	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-72.6	-48	175.9	-78.1	-179.2	0	0	0	112.5	N186 M190 M191 L192 V217 D222 F223 L226	N186-L188 VanDerWaalsContact C-N 3.28Å; N186-L188 PolarHBondContact O-N 3.26Å; L188-M190 VanDerWaalsContact C-N 3.3Å; L188-M190 PolarHBondContact O-N 3.17Å; L188-M191 HydrophobicContact CD2-CE 3.64Å; L188-M191 WeakPolarHBondContact O-CB 3.26Å; L188-M191 PolarHBondContact O-N 2.99Å; L188-M191 VanDerWaalsContact O-N 3.15Å; L188-L192 WeakPolarHBondContact O-CG 3.22Å; L188-L192 PolarHBondContact O-N 3.34Å; L188-V217 HydrophobicContact CD1-CG1 3.24Å; L188-V217 HydrophobicContact CD2-CG1 3.9Å; L188-V217 HydrophobicContact CG-CG1 3.38Å; L188-D222 HydrophobicContact CB-CB 3.73Å; L188-D222 HydrophobicContact CD1-CB 4.04Å; L188-F223 HydrophobicContact CD1-CB 3.75Å; L188-F223 HydrophobicContact CD1-CD2 4.08Å; L188-F223 HydrophobicContact CD1-CG 4.44Å; L188-L226 HydrophobicContact CD1-CD1 4.18Å; L188-L226 HydrophobicContact CD2-CD1 4.05Å; L188-L226 HydrophobicContact CD2-CD2 4.35Å
189	G	86.6	Confident	86.3	Confident	20 Å²	20	47.8 Å²	47.8	21%	0.206	26%	0.262	C	S	.	.	H	α-helix	trans	-53.5	-49.5	173.5	0	0	0	0	0	111.2	N186 M191 L192 L193 D222	N186-G189 PolarHBondContact O-N 2.87Å; G189-M191 VanDerWaalsContact C-N 3.33Å; G189-M191 PolarHBondContact O-N 3.15Å; G189-L192 PolarHBondContact O-N 2.86Å; G189-L192 VanDerWaalsContact O-N 3.16Å; G189-L193 VanDerWaalsContact O-CB 3.32Å; G189-L193 WeakPolarHBondContact O-CB 3.06Å; G189-L193 PolarHBondContact O-N 3.41Å; G189-D222 PolarHBondContact N-OD2 3.39Å
190	M	88.8	Confident	86.1	Confident	5 Å²	5	54.2 Å²	54.2	3%	0.025	29%	0.289	C	S	.	.	H	α-helix	trans	-62.4	-35.7	177.3	-66	-62.2	154.9	0	0	113.5	E156 L178 L182 N186 L188 L193 S194	E156-M190 HydrophobicContact CG-CE 3.85Å; E156-M190 WeakPolarHBondContact OE1-CE 3.46Å; L178-M190 HydrophobicContact CB-SD 4.1Å; L178-M190 HydrophobicContact CD1-SD 3.91Å; L178-M190 HydrophobicContact CD2-CE 3.57Å; L178-M190 HydrophobicContact CD2-SD 3.85Å; L178-M190 HydrophobicContact CG-CE 4.49Å; L178-M190 HydrophobicContact CG-SD 4.16Å; L182-M190 HydrophobicContact CD1-CB 3.98Å; L182-M190 HydrophobicContact CD1-CG 4.19Å; N186-M190 WeakPolarHBondContact ND2-CE 3.21Å; N186-M190 VanDerWaalsContact O-CG 3.3Å; N186-M190 WeakPolarHBondContact O-CG 3.43Å; N186-M190 PolarHBondContact O-N 2.95Å; N186-M190 WeakPolarHBondContact OD1-CE 3.32Å; L188-M190 VanDerWaalsContact C-N 3.3Å; L188-M190 PolarHBondContact O-N 3.17Å; M190-L193 HydrophobicContact SD-CD2 4.26Å; M190-S194 VanDerWaalsContact O-CB 3.22Å; M190-S194 WeakPolarHBondContact O-CB 3.38Å; M190-S194 PolarHBondContact O-N 2.8Å; M190-S194 PolarHBondContact O-OG 3.35Å
191	M	89.3	Confident	85.9	Confident	3 Å²	3	54.5 Å²	54.5	2%	0.015	29%	0.287	C	S	.	.	H	α-helix	trans	-65.4	-44	174.1	179.6	-169.3	68.3	0	0	111.7	C187 L188 G189 S194 D195 Y203 W207 L226	C187-M191 VanDerWaalsContact O-CB 3.3Å; C187-M191 WeakPolarHBondContact O-CB 3.43Å; C187-M191 PolarHBondContact O-N 3.16Å; L188-M191 HydrophobicContact CD2-CE 3.64Å; L188-M191 WeakPolarHBondContact O-CB 3.26Å; L188-M191 PolarHBondContact O-N 2.99Å; L188-M191 VanDerWaalsContact O-N 3.15Å; G189-M191 VanDerWaalsContact C-N 3.33Å; G189-M191 PolarHBondContact O-N 3.15Å; M191-S194 WeakPolarHBondContact CA-OG 3.48Å; M191-S194 PolarHBondContact O-OG 3.01Å; M191-D195 WeakPolarHBondContact O-CB 3.5Å; M191-D195 PolarHBondContact O-N 3.3Å; M191-D195 VanDerWaalsContact O-N 3.08Å; M191-Y203 HydrophobicContact CG-CD2 3.83Å; M191-Y203 HydrophobicContact CG-CE2 3.49Å; M191-Y203 VanDerWaalsContact CG-CE2 3.49Å; M191-Y203 WeakPolarHBondContact O-CD2 3.26Å; M191-Y203 HydrophobicContact SD-CE2 4.41Å; M191-W207 HydrophobicContact SD-CE3 3.53Å; M191-W207 VanDerWaalsContact SD-CE3 3.53Å; M191-W207 HydrophobicContact SD-CZ3 3.93Å; M191-L226 HydrophobicContact CE-CD2 3.9Å
192	L	87.5	Confident	85.9	Confident	60 Å²	60	52.2 Å²	52.2	31%	0.314	27%	0.274	S	S	.	.	H	α-helix	trans	-68.8	-43.2	178.9	-69.3	173.4	0	0	0	111.6	L188 G189 S194 D195 A196 L226	L188-L192 WeakPolarHBondContact O-CG 3.22Å; L188-L192 PolarHBondContact O-N 3.34Å; G189-L192 PolarHBondContact O-N 2.86Å; G189-L192 VanDerWaalsContact O-N 3.16Å; L192-S194 PolarHBondContact O-N 2.96Å; L192-D195 PolarHBondContact O-N 3.43Å; L192-A196 PolarHBondContact O-N 2.69Å; L192-L226 HydrophobicContact CD1-CD2 4.19Å; L192-L226 HydrophobicContact CD2-CD2 4.06Å; L192-L226 HydrophobicContact CG-CD2 4.35Å
193	L	87	Confident	86	Confident	18 Å²	18	53.1 Å²	53.1	9%	0.094	28%	0.276	C	S	.	.	H	α-helix	trans	-60.2	-46	176.2	-175.4	70.4	0	0	0	111.2	E156 L159 E160 L178 G189 M190 D195 A196 H197	E156-L193 HydrophobicContact CB-CD2 4.19Å; E156-L193 HydrophobicContact CG-CD2 4.02Å; L159-L193 HydrophobicContact CD2-CD2 3.75Å; L159-L193 HydrophobicContact CD2-CG 3.92Å; E160-L193 HydrophobicContact CG-CD1 3.84Å; L178-L193 HydrophobicContact CD1-CD2 4.14Å; G189-L193 VanDerWaalsContact O-CB 3.32Å; G189-L193 WeakPolarHBondContact O-CB 3.06Å; G189-L193 PolarHBondContact O-N 3.41Å; M190-L193 HydrophobicContact SD-CD2 4.26Å; L193-D195 VanDerWaalsContact C-N 3.34Å; L193-D195 PolarHBondContact O-N 3.46Å; L193-A196 PolarHBondContact O-N 2.89Å; L193-H197 PolarHBondContact O-CD2 3.04Å; L193-H197 VanDerWaalsContact O-CD2 3.28Å; L193-H197 PolarHBondContact O-N 3.45Å
194	S	88.4	Confident	86.1	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.007	28%	0.278	C	S	.	.	H	α-helix	trans	-68.2	-30.8	178.9	55.6	0	0	0	0	113.7	M190 M191 L192 Q198 C199 Y203	M190-S194 VanDerWaalsContact O-CB 3.22Å; M190-S194 WeakPolarHBondContact O-CB 3.38Å; M190-S194 PolarHBondContact O-N 2.8Å; M190-S194 PolarHBondContact O-OG 3.35Å; M191-S194 WeakPolarHBondContact CA-OG 3.48Å; M191-S194 PolarHBondContact O-OG 3.01Å; L192-S194 PolarHBondContact O-N 2.96Å; S194-Q198 CarbonylContact O-C 3.6Å; S194-Q198 WeakPolarHBondContact O-CA 3.25Å; S194-Q198 PolarHBondContact O-N 2.77Å; S194-C199 PolarHBondContact O-N 3.13Å; S194-Y203 VanDerWaalsContact OG-CA 3.26Å; S194-Y203 WeakPolarHBondContact OG-CA 3.2Å; S194-Y203 WeakPolarHBondContact OG-CB 3.42Å; S194-Y203 PolarHBondContact OG-N 3.43Å
195	D	87.1	Confident	86.2	Confident	75 Å²	75	54.2 Å²	54.2	40%	0.401	28%	0.278	S	S	.	.	H	α-helix	trans	-68.2	-41.8	172.5	-164	53	0	0	0	111.1	M191 L192 L193 Q198 Y203 K230	M191-D195 WeakPolarHBondContact O-CB 3.5Å; M191-D195 PolarHBondContact O-N 3.3Å; M191-D195 VanDerWaalsContact O-N 3.08Å; L192-D195 PolarHBondContact O-N 3.43Å; L193-D195 VanDerWaalsContact C-N 3.34Å; L193-D195 PolarHBondContact O-N 3.46Å; D195-Q198 PolarHBondContact O-N 3.37Å; D195-Y203 HydrophobicContact CB-CD2 4.14Å; D195-Y203 HydrophobicContact CB-CE2 4.12Å; D195-K230 IonicContact OD1-NZ 3.11Å; D195-K230 PolarHBondContact OD1-NZ 3.22Å; D195-K230 VanDerWaalsContact OD1-NZ 3.08Å; D195-K230 WeakPolarHBondContact OD2-CE 3.48Å; D195-K230 IonicContact OD2-NZ 2.68Å; D195-K230 PolarHBondContact OD2-NZ 3.45Å
196	A	86.3	Confident	86.5	Confident	71 Å²	71	50.4 Å²	50.4	59%	0.587	25%	0.251	S	S	*	.	H	α-helix	trans	-63.5	-41.2	177.8	0	0	0	0	0	112.7	L192 L193	L192-A196 PolarHBondContact O-N 2.69Å; L193-A196 PolarHBondContact O-N 2.89Å
197	H	85.1	Confident	86.6	Confident	31 Å²	31	50.3 Å²	50.3	14%	0.144	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	13	-178	-63.5	-65.1	0	0	0	114.3	E160 D163 L193 C199	E160-H197 WeakPolarHBondContact CG-NE2 3.4Å; D163-H197 HydrophobicContact CB-CB 4.37Å; D163-H197 IonicContact OD2-CG 3.58Å; D163-H197 IonicContact OD2-ND1 3.39Å; D163-H197 PolarHBondContact OD2-ND1 3.49Å; D163-H197 VanDerWaalsContact OD2-ND1 3.11Å; L193-H197 PolarHBondContact O-CD2 3.04Å; L193-H197 VanDerWaalsContact O-CD2 3.28Å; L193-H197 PolarHBondContact O-N 3.45Å; H197-C199 PolarHBondContact O-N 2.69Å; H197-C199 VanDerWaalsContact O-N 3.13Å
198	Q	83.1	Confident	86.5	Confident	166 Å²	166	56.6 Å²	56.6	78%	0.776	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	29.7	178.2	-55.6	-167.9	-15.8	0	0	115	S194 D195 K200	S194-Q198 CarbonylContact O-C 3.6Å; S194-Q198 WeakPolarHBondContact O-CA 3.25Å; S194-Q198 PolarHBondContact O-N 2.77Å; D195-Q198 PolarHBondContact O-N 3.37Å; Q198-K200 PolarHBondContact O-N 3.41Å
199	C	84.7	Confident	86.3	Confident	15 Å²	15	59 Å²	59	10%	0.101	28%	0.283	C	S	.	.			trans	-80	80.5	176.6	-66.1	0	0	0	0	111	S194 H197 R201 L202 Y203	S194-C199 PolarHBondContact O-N 3.13Å; H197-C199 PolarHBondContact O-N 2.69Å; H197-C199 VanDerWaalsContact O-N 3.13Å; C199-R201 VanDerWaalsContact C-N 3.32Å; C199-R201 PolarHBondContact O-N 3.36Å; C199-L202 HydrophobicContact CB-CB 4.22Å; C199-L202 PolarHBondContact O-N 3.11Å; C199-Y203 WeakPolarHBondContact O-CB 3.32Å; C199-Y203 PolarHBondContact O-N 3.18Å
200	K	85.4	Confident	86.2	Confident	166 Å²	166	58.1 Å²	58.1	72%	0.722	27%	0.273	S	S	*	.	H	α-helix	trans	-54.5	-41.7	-174.7	-63.4	-175.6	-179.4	-179.2	0	114.6	Q198 Y203 E204	Q198-K200 PolarHBondContact O-N 3.41Å; K200-Y203 WeakPolarHBondContact O-CB 3.47Å; K200-Y203 PolarHBondContact O-N 3.11Å; K200-E204 WeakPolarHBondContact O-CG 3.16Å; K200-E204 PolarHBondContact O-N 2.76Å
201	R	83.8	Confident	85.8	Confident	155 Å²	155	58 Å²	58	59%	0.585	27%	0.273	S	S	*	.	H	α-helix	trans	-68.2	-47.3	-175.8	-171.1	178.1	135.3	-179.4	-3.6	111.9	E179 C199 Y203 E204 L205	E179-R201 VanDerWaalsContact CD-NE 3.33Å; E179-R201 WeakPolarHBondContact OE1-CD 3.49Å; E179-R201 VanDerWaalsContact OE1-CG 3.25Å; E179-R201 WeakPolarHBondContact OE1-CG 3Å; E179-R201 IonicContact OE1-CZ 3.29Å; E179-R201 IonicContact OE1-NE 2.79Å; E179-R201 PolarHBondContact OE1-NE 3.06Å; E179-R201 IonicContact OE2-CZ 3.65Å; E179-R201 IonicContact OE2-NE 2.89Å; E179-R201 PolarHBondContact OE2-NE 2.89Å; E179-R201 IonicContact OE2-NH2 3.25Å; E179-R201 PolarHBondContact OE2-NH2 3.41Å; C199-R201 VanDerWaalsContact C-N 3.32Å; C199-R201 PolarHBondContact O-N 3.36Å; R201-Y203 VanDerWaalsContact C-N 3.29Å; R201-Y203 PolarHBondContact O-N 2.79Å; R201-E204 PolarHBondContact O-N 3.32Å; R201-L205 HydrophobicContact CG-CD1 4.48Å; R201-L205 WeakPolarHBondContact O-CG 3.33Å; R201-L205 PolarHBondContact O-N 3.02Å
202	L	88.4	Confident	85.2	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-61.9	-39.4	173.9	-180	60.3	0	0	0	110.9	L178 E179 L182 C199 L205 S206	L178-L202 HydrophobicContact CB-CD1 4.33Å; L178-L202 HydrophobicContact CB-CD2 4.15Å; L178-L202 HydrophobicContact CD1-CD2 4.21Å; E179-L202 HydrophobicContact CG-CB 4.25Å; E179-L202 HydrophobicContact CG-CD1 3.71Å; L182-L202 HydrophobicContact CD1-CD1 4.17Å; C199-L202 HydrophobicContact CB-CB 4.22Å; C199-L202 PolarHBondContact O-N 3.11Å; L202-L205 PolarHBondContact O-N 3.25Å; L202-S206 VanDerWaalsContact O-CB 3.26Å; L202-S206 WeakPolarHBondContact O-CB 3.49Å; L202-S206 PolarHBondContact O-N 2.95Å; L202-S206 PolarHBondContact O-OG 3.19Å
203	Y	89.1	Confident	84.8	Confident	52 Å²	52	61.6 Å²	61.6	20%	0.204	29%	0.292	C	S	.	.	H	α-helix	trans	-60.9	-50.3	176.3	-177.1	-94.5	0	0	0	112.5	M191 S194 D195 C199 K200 R201 L205 S206 W207	M191-Y203 HydrophobicContact CG-CD2 3.83Å; M191-Y203 HydrophobicContact CG-CE2 3.49Å; M191-Y203 VanDerWaalsContact CG-CE2 3.49Å; M191-Y203 WeakPolarHBondContact O-CD2 3.26Å; M191-Y203 HydrophobicContact SD-CE2 4.41Å; S194-Y203 VanDerWaalsContact OG-CA 3.26Å; S194-Y203 WeakPolarHBondContact OG-CA 3.2Å; S194-Y203 WeakPolarHBondContact OG-CB 3.42Å; S194-Y203 PolarHBondContact OG-N 3.43Å; D195-Y203 HydrophobicContact CB-CD2 4.14Å; D195-Y203 HydrophobicContact CB-CE2 4.12Å; C199-Y203 WeakPolarHBondContact O-CB 3.32Å; C199-Y203 PolarHBondContact O-N 3.18Å; K200-Y203 WeakPolarHBondContact O-CB 3.47Å; K200-Y203 PolarHBondContact O-N 3.11Å; R201-Y203 VanDerWaalsContact C-N 3.29Å; R201-Y203 PolarHBondContact O-N 2.79Å; Y203-L205 VanDerWaalsContact C-N 3.3Å; Y203-L205 PolarHBondContact O-N 2.67Å; Y203-S206 PolarHBondContact O-N 2.82Å; Y203-W207 WeakPolarHBondContact O-CB 3.37Å; Y203-W207 PolarHBondContact O-N 2.7Å
204	E	86.1	Confident	84.6	Confident	113 Å²	113	60.8 Å²	60.8	53%	0.528	29%	0.288	S	S	.	.	H	α-helix	trans	-63.2	-34.1	-179.6	-74.3	174.5	-170.2	0	0	113.2	K200 R201 R208	K200-E204 WeakPolarHBondContact O-CG 3.16Å; K200-E204 PolarHBondContact O-N 2.76Å; R201-E204 PolarHBondContact O-N 3.32Å; E204-R208 WeakPolarHBondContact O-CG 3.34Å; E204-R208 PolarHBondContact O-N 3.27Å; E204-R208 PolarHBondContact O-NE 3.15Å
205	L	83.9	Confident	84	Confident	58 Å²	58	64.9 Å²	64.9	30%	0.304	31%	0.306	S	S	.	.	H	α-helix	trans	-72.5	-47.8	174.9	-73.4	167.4	0	0	0	111.3	E179 R201 L202 Y203 W207 R208 M209	E179-L205 HydrophobicContact CB-CD1 4.39Å; E179-L205 HydrophobicContact CG-CD1 3.88Å; R201-L205 HydrophobicContact CG-CD1 4.48Å; R201-L205 WeakPolarHBondContact O-CG 3.33Å; R201-L205 PolarHBondContact O-N 3.02Å; L202-L205 PolarHBondContact O-N 3.25Å; Y203-L205 VanDerWaalsContact C-N 3.3Å; Y203-L205 PolarHBondContact O-N 2.67Å; L205-W207 VanDerWaalsContact C-N 3.33Å; L205-W207 PolarHBondContact O-N 3.47Å; L205-R208 PolarHBondContact O-N 3.38Å; L205-M209 PolarHBondContact O-N 3.24Å
206	S	88.6	Confident	83.6	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60.4	-43.5	177.9	-55.8	0	0	0	0	111.3	L182 L202 Y203 M209 C210	L182-S206 VanDerWaalsContact CD1-OG 3.3Å; L182-S206 WeakPolarHBondContact CD1-OG 3.31Å; L202-S206 VanDerWaalsContact O-CB 3.26Å; L202-S206 WeakPolarHBondContact O-CB 3.49Å; L202-S206 PolarHBondContact O-N 2.95Å; L202-S206 PolarHBondContact O-OG 3.19Å; Y203-S206 PolarHBondContact O-N 2.82Å; S206-M209 PolarHBondContact O-N 3.47Å; S206-C210 PolarHBondContact O-N 3.35Å; S206-C210 PolarHBondContact O-SG 3.19Å
207	W	87.6	Confident	83.5	Confident	47 Å²	47	60.2 Å²	60.2	18%	0.178	28%	0.279	C	S	.	.	H	α-helix	trans	-59.1	-49.4	175.9	-179.8	-104	0	0	0	112.2	M191 Y203 L205 M209 C210 L211 D233 L234	M191-W207 HydrophobicContact SD-CE3 3.53Å; M191-W207 VanDerWaalsContact SD-CE3 3.53Å; M191-W207 HydrophobicContact SD-CZ3 3.93Å; Y203-W207 WeakPolarHBondContact O-CB 3.37Å; Y203-W207 PolarHBondContact O-N 2.7Å; L205-W207 VanDerWaalsContact C-N 3.33Å; L205-W207 PolarHBondContact O-N 3.47Å; W207-M209 VanDerWaalsContact C-N 3.29Å; W207-M209 PolarHBondContact O-N 3.28Å; W207-C210 WeakPolarHBondContact O-CB 3.16Å; W207-C210 PolarHBondContact O-N 3.48Å; W207-L211 HydrophobicContact CZ2-CD2 4.43Å; W207-L211 WeakPolarHBondContact O-CG 3.46Å; W207-L211 PolarHBondContact O-N 3.25Å; W207-D233 HydrophobicContact CH2-CB 3.98Å; W207-L234 HydrophobicContact CH2-CB 3.99Å; W207-L234 HydrophobicContact CZ3-CB 4.37Å
208	R	82.8	Confident	83.3	Confident	132 Å²	132	61.5 Å²	61.5	50%	0.498	28%	0.282	S	S	.	.	H	α-helix	trans	-60.9	-39.5	176.8	-79.1	-176.3	-71.9	-175	-3.5	111.9	E204 L205 L211 V212	E204-R208 WeakPolarHBondContact O-CG 3.34Å; E204-R208 PolarHBondContact O-N 3.27Å; E204-R208 PolarHBondContact O-NE 3.15Å; L205-R208 PolarHBondContact O-N 3.38Å; R208-L211 PolarHBondContact O-N 2.93Å; R208-V212 WeakPolarHBondContact O-CG2 3.41Å; R208-V212 PolarHBondContact O-N 2.85Å; R208-V212 VanDerWaalsContact O-N 3.13Å
209	M	82.3	Confident	83.1	Confident	52 Å²	52	57.5 Å²	57.5	26%	0.256	27%	0.266	S	S	.	.	H	α-helix	trans	-65.5	-40.9	176.9	-161	71.5	170.2	0	0	112	L182 C187 L205 S206 W207 L211 V212 H213	L182-M209 HydrophobicContact CD2-CB 3.54Å; L182-M209 HydrophobicContact CD2-CG 3.67Å; L182-M209 HydrophobicContact CD2-SD 4.41Å; C187-M209 HydrophobicContact CB-CB 4.16Å; C187-M209 HydrophobicContact CB-CG 4.2Å; L205-M209 PolarHBondContact O-N 3.24Å; S206-M209 PolarHBondContact O-N 3.47Å; W207-M209 VanDerWaalsContact C-N 3.29Å; W207-M209 PolarHBondContact O-N 3.28Å; M209-L211 VanDerWaalsContact C-N 3.28Å; M209-L211 PolarHBondContact O-N 2.84Å; M209-V212 PolarHBondContact O-N 2.95Å; M209-H213 VanDerWaalsContact CE-CD2 3.43Å; M209-H213 WeakPolarHBondContact CE-CD2 3.3Å; M209-H213 PolarHBondContact O-N 3.33Å
210	C	84.9	Confident	83	Confident	0 Å²	0	58 Å²	58	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.6	-41.1	174.4	-67.4	0	0	0	0	111.6	C187 S206 W207 F214 L234	C187-C210 PolarHBondContact SG-SG 3.35Å; S206-C210 PolarHBondContact O-N 3.35Å; S206-C210 PolarHBondContact O-SG 3.19Å; W207-C210 WeakPolarHBondContact O-CB 3.16Å; W207-C210 PolarHBondContact O-N 3.48Å; C210-F214 WeakPolarHBondContact O-CA 3.33Å; C210-F214 PolarHBondContact O-N 3.36Å; C210-L234 HydrophobicContact CB-CD1 4.42Å
211	L	80.2	Confident	82.7	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-68.7	-35.4	179.5	-67.8	172.9	0	0	0	113.1	W207 R208 M209 E239 L240 E241	W207-L211 HydrophobicContact CZ2-CD2 4.43Å; W207-L211 WeakPolarHBondContact O-CG 3.46Å; W207-L211 PolarHBondContact O-N 3.25Å; R208-L211 PolarHBondContact O-N 2.93Å; M209-L211 VanDerWaalsContact C-N 3.28Å; M209-L211 PolarHBondContact O-N 2.84Å; L211-E239 HydrophobicContact CD1-CB 3.81Å; L211-L240 HydrophobicContact CD2-CB 4.15Å; L211-L240 HydrophobicContact CD2-CD1 3.86Å; L211-E241 PolarHBondContact O-N 2.86Å
212	V	77.1	Confident	82.6	Confident	61 Å²	61	53.8 Å²	53.8	37%	0.37	26%	0.26	S	S	.	.	H	α-helix	trans	-79.3	-36.6	-179	174.2	0	0	0	0	112	R208 M209	R208-V212 WeakPolarHBondContact O-CG2 3.41Å; R208-V212 PolarHBondContact O-N 2.85Å; R208-V212 VanDerWaalsContact O-N 3.13Å; M209-V212 PolarHBondContact O-N 2.95Å
213	H	78.3	Confident	82.4	Confident	78 Å²	78	53.9 Å²	53.9	36%	0.361	26%	0.261	S	S	.	.	S	Bend	trans	-113.3	35	-174.2	-65.9	-67.2	0	0	0	113.6	M209 E215 A216 V217	M209-H213 VanDerWaalsContact CE-CD2 3.43Å; M209-H213 WeakPolarHBondContact CE-CD2 3.3Å; M209-H213 PolarHBondContact O-N 3.33Å; H213-E215 PolarHBondContact O-N 3.27Å; H213-E215 VanDerWaalsContact O-N 3.11Å; H213-A216 PolarHBondContact O-N 3.32Å; H213-A216 VanDerWaalsContact O-N 3.07Å; H213-V217 VanDerWaalsContact O-CG2 3.32Å; H213-V217 WeakPolarHBondContact O-CG2 3.39Å; H213-V217 PolarHBondContact O-N 3.47Å
214	F	82.6	Confident	82	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.009	26%	0.26	C	S	.	.	H	α-helix	trans	-54.3	-34.7	-176	-177	-106.9	0	0	0	114	C210 A216 V217 R218 F223 L234 L240 I242 I247 V248 A251	C210-F214 WeakPolarHBondContact O-CA 3.33Å; C210-F214 PolarHBondContact O-N 3.36Å; F214-A216 VanDerWaalsContact C-N 3.34Å; F214-A216 PolarHBondContact O-N 3.26Å; F214-V217 PolarHBondContact O-N 3.03Å; F214-R218 PolarHBondContact O-N 3.17Å; F214-F223 AromaticContact CE2-CE2 3.95Å; F214-F223 HydrophobicContact CE2-CE2 3.95Å; F214-F223 HydrophobicContact CE2-CZ 4.45Å; F214-F223 HydrophobicContact CZ-CE2 4.36Å; F214-F223 HydrophobicContact CZ-CZ 4.42Å; F214-L234 HydrophobicContact CD2-CD2 3.61Å; F214-L234 HydrophobicContact CE2-CD2 3.27Å; F214-L234 HydrophobicContact CZ-CD2 4.18Å; F214-L240 HydrophobicContact CB-CD1 3.75Å; F214-L240 HydrophobicContact CD1-CD1 4.5Å; F214-L240 HydrophobicContact CD2-CD1 3.87Å; F214-L240 HydrophobicContact CG-CD1 3.77Å; F214-I242 HydrophobicContact CB-CG2 4.15Å; F214-I242 HydrophobicContact CD1-CG2 3.64Å; F214-I242 HydrophobicContact CG-CG2 4.24Å; F214-I247 HydrophobicContact CD1-CG2 4.19Å; F214-I247 HydrophobicContact CE1-CG2 4.11Å; F214-V248 HydrophobicContact CD1-CG2 4.25Å; F214-V248 HydrophobicContact CE1-CB 4.44Å; F214-V248 HydrophobicContact CE1-CG2 3.66Å; F214-V248 HydrophobicContact CZ-CG2 4.27Å; F214-A251 HydrophobicContact CE1-CB 4.25Å; F214-A251 HydrophobicContact CZ-CB 3.96Å
215	E	76.6	Confident	81.8	Confident	86 Å²	86	50.7 Å²	50.7	40%	0.402	26%	0.26	S	S	.	.	H	α-helix	trans	-62.9	-36.7	179	-65.9	-170.9	-175.6	0	0	114	H213 R218 I247	H213-E215 PolarHBondContact O-N 3.27Å; H213-E215 VanDerWaalsContact O-N 3.11Å; E215-R218 WeakPolarHBondContact O-CG 3.25Å; E215-R218 PolarHBondContact O-NE 3.46Å; E215-I247 HydrophobicContact CG-CD1 4.21Å; E215-I247 HydrophobicContact CG-CG2 4.41Å; E215-I247 WeakPolarHBondContact OE1-CD1 3.44Å
216	A	79.5	Confident	81.9	Confident	49 Å²	49	48.1 Å²	48.1	41%	0.405	25%	0.246	S	C	.	.	H	α-helix	trans	-76.3	-33.6	175.6	0	0	0	0	0	111	H213 F214	H213-A216 PolarHBondContact O-N 3.32Å; H213-A216 VanDerWaalsContact O-N 3.07Å; F214-A216 VanDerWaalsContact C-N 3.34Å; F214-A216 PolarHBondContact O-N 3.26Å
217	V	83.8	Confident	81.7	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-72.3	-34.3	-175.3	172.2	0	0	0	0	112.6	C187 L188 H213 F214 D219 T220 F223	C187-V217 WeakPolarHBondContact SG-CG2 3.25Å; L188-V217 HydrophobicContact CD1-CG1 3.24Å; L188-V217 HydrophobicContact CD2-CG1 3.9Å; L188-V217 HydrophobicContact CG-CG1 3.38Å; H213-V217 VanDerWaalsContact O-CG2 3.32Å; H213-V217 WeakPolarHBondContact O-CG2 3.39Å; H213-V217 PolarHBondContact O-N 3.47Å; F214-V217 PolarHBondContact O-N 3.03Å; V217-D219 PolarHBondContact O-N 3.38Å; V217-D219 VanDerWaalsContact O-N 3.13Å; V217-T220 PolarHBondContact O-N 3.38Å; V217-T220 PolarHBondContact O-OG1 3.22Å; V217-F223 HydrophobicContact CG1-CD2 4.43Å; V217-F223 WeakPolarHBondContact O-CB 3.4Å
218	R	80.1	Confident	81.5	Confident	57 Å²	57	53.2 Å²	53.2	22%	0.215	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-24.3	-177.5	79.5	-171.3	179.2	-173.5	-7.8	114.3	F214 E215 A251	F214-R218 PolarHBondContact O-N 3.17Å; E215-R218 WeakPolarHBondContact O-CG 3.25Å; E215-R218 PolarHBondContact O-NE 3.46Å; R218-A251 HydrophobicContact CB-CB 3.98Å
219	D	78.6	Confident	81.6	Confident	82 Å²	82	52 Å²	52	44%	0.439	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-2.5	-173.3	-68.8	-48.5	0	0	0	111.6	V217 R254	V217-D219 PolarHBondContact O-N 3.38Å; V217-D219 VanDerWaalsContact O-N 3.13Å; D219-R254 IonicContact OD1-NH1 3.02Å; D219-R254 PolarHBondContact OD1-NH1 3.26Å
220	T	83.2	Confident	81.8	Confident	27 Å²	27	51.3 Å²	51.3	17%	0.166	27%	0.274	C	S	.	.	S	Bend	trans	-81.6	154.7	178.3	67.1	0	0	0	0	112.6	V217 D222 F223 Y224	V217-T220 PolarHBondContact O-N 3.38Å; V217-T220 PolarHBondContact O-OG1 3.22Å; T220-D222 VanDerWaalsContact C-N 3.31Å; T220-D222 PolarHBondContact O-N 2.76Å; T220-F223 WeakPolarHBondContact O-CB 3.41Å; T220-F223 PolarHBondContact O-N 3.27Å; T220-Y224 WeakPolarHBondContact O-CD2 3.3Å
221	E	78.8	Confident	81.8	Confident	171 Å²	171	51.3 Å²	51.3	80%	0.799	27%	0.274	S	S	*	.	H	α-helix	trans	-64	-37.1	177.9	-66.2	-168.7	170.9	0	0	112.3	F223 Y224 G225	E221-F223 PolarHBondContact O-N 2.94Å; E221-F223 VanDerWaalsContact O-N 3.17Å; E221-Y224 PolarHBondContact O-N 3.05Å; E221-G225 PolarHBondContact O-N 3.44Å
222	D	81.3	Confident	82.1	Confident	61 Å²	61	52.7 Å²	52.7	33%	0.326	28%	0.281	S	S	.	.	H	α-helix	trans	-55.3	-34.2	176.7	-62.1	-17.6	0	0	0	112.5	L188 G189 T220 Y224 G225 L226	L188-D222 HydrophobicContact CB-CB 3.73Å; L188-D222 HydrophobicContact CD1-CB 4.04Å; G189-D222 PolarHBondContact N-OD2 3.39Å; T220-D222 VanDerWaalsContact C-N 3.31Å; T220-D222 PolarHBondContact O-N 2.76Å; D222-Y224 VanDerWaalsContact C-N 3.34Å; D222-Y224 PolarHBondContact O-N 3.02Å; D222-G225 PolarHBondContact O-N 3.29Å; D222-L226 PolarHBondContact O-N 3.5Å
223	F	85.1	Confident	82.4	Confident	1 Å²	1	53.6 Å²	53.6	0%	0.004	28%	0.284	C	S	.	.	H	α-helix	trans	-63.8	-40.5	178.8	-173.4	-97.8	0	0	0	111.5	L188 F214 V217 T220 E221 G225 L226 L231 A251 W255	L188-F223 HydrophobicContact CD1-CB 3.75Å; L188-F223 HydrophobicContact CD1-CD2 4.08Å; L188-F223 HydrophobicContact CD1-CG 4.44Å; F214-F223 AromaticContact CE2-CE2 3.95Å; F214-F223 HydrophobicContact CE2-CE2 3.95Å; F214-F223 HydrophobicContact CE2-CZ 4.45Å; F214-F223 HydrophobicContact CZ-CE2 4.36Å; F214-F223 HydrophobicContact CZ-CZ 4.42Å; V217-F223 HydrophobicContact CG1-CD2 4.43Å; V217-F223 WeakPolarHBondContact O-CB 3.4Å; T220-F223 WeakPolarHBondContact O-CB 3.41Å; T220-F223 PolarHBondContact O-N 3.27Å; E221-F223 PolarHBondContact O-N 2.94Å; E221-F223 VanDerWaalsContact O-N 3.17Å; F223-G225 VanDerWaalsContact C-N 3.25Å; F223-G225 PolarHBondContact O-N 3.29Å; F223-L226 HydrophobicContact CD2-CD1 3.59Å; F223-L226 HydrophobicContact CE2-CD1 4.02Å; F223-L226 HydrophobicContact CG-CD1 4.25Å; F223-L226 WeakPolarHBondContact O-CB 3.31Å; F223-L226 PolarHBondContact O-N 3.14Å; F223-L231 HydrophobicContact CE2-CD1 3.81Å; F223-L231 HydrophobicContact CZ-CD1 3.63Å; F223-A251 HydrophobicContact CE1-CB 4.06Å; F223-A251 HydrophobicContact CZ-CB 3.99Å; F223-W255 HydrophobicContact CE1-CB 4.1Å
224	Y	81.7	Confident	82.6	Confident	47 Å²	47	50 Å²	50	18%	0.184	27%	0.267	C	S	.	.	H	α-helix	trans	-68.9	-25.3	177.9	-58.5	-65.7	0	0	0	112.9	T220 E221 D222 R254 Y258 R263	T220-Y224 WeakPolarHBondContact O-CD2 3.3Å; E221-Y224 PolarHBondContact O-N 3.05Å; D222-Y224 VanDerWaalsContact C-N 3.34Å; D222-Y224 PolarHBondContact O-N 3.02Å; Y224-R254 HydrophobicContact CE1-CB 4.05Å; Y224-Y258 HydrophobicContact CD1-CD2 4.24Å; Y224-Y258 HydrophobicContact CD1-CG 4.37Å; Y224-Y258 HydrophobicContact CG-CD2 4.07Å; Y224-Y258 HydrophobicContact CG-CE2 4.49Å; Y224-Y258 HydrophobicContact CG-CG 4.39Å; Y224-R263 PolarHBondContact O-NH1 2.95Å; Y224-R263 PolarHBondContact O-NH2 3.46Å
225	G	81.4	Confident	82.6	Confident	51 Å²	51	49.9 Å²	49.9	53%	0.526	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-8.3	175.7	0	0	0	0	0	115.1	E221 D222 F223	E221-G225 PolarHBondContact O-N 3.44Å; D222-G225 PolarHBondContact O-N 3.29Å; F223-G225 VanDerWaalsContact C-N 3.25Å; F223-G225 PolarHBondContact O-N 3.29Å
226	L	84.6	Confident	82.8	Confident	5 Å²	5	50.2 Å²	50.2	3%	0.026	27%	0.271	C	S	.	.			trans	-62.1	142.3	-176.3	-78.6	168.1	0	0	0	113.4	L188 M191 L192 D222 F223 K230 W255	L188-L226 HydrophobicContact CD1-CD1 4.18Å; L188-L226 HydrophobicContact CD2-CD1 4.05Å; L188-L226 HydrophobicContact CD2-CD2 4.35Å; M191-L226 HydrophobicContact CE-CD2 3.9Å; L192-L226 HydrophobicContact CD1-CD2 4.19Å; L192-L226 HydrophobicContact CD2-CD2 4.06Å; L192-L226 HydrophobicContact CG-CD2 4.35Å; D222-L226 PolarHBondContact O-N 3.5Å; F223-L226 HydrophobicContact CD2-CD1 3.59Å; F223-L226 HydrophobicContact CE2-CD1 4.02Å; F223-L226 HydrophobicContact CG-CD1 4.25Å; F223-L226 WeakPolarHBondContact O-CB 3.31Å; F223-L226 PolarHBondContact O-N 3.14Å; L226-K230 HydrophobicContact CD2-CB 4.44Å; L226-W255 VanDerWaalsContact O-CZ2 3.25Å; L226-W255 WeakPolarHBondContact O-CZ2 3.31Å; L226-W255 PolarHBondContact O-NE1 3.42Å
227	N	85.8	Confident	82.6	Confident	114 Å²	114	48.8 Å²	48.8	61%	0.61	26%	0.258	S	S	*	.			trans	-69.6	148.2	169.2	-71.8	-12.4	0	0	0	111.3	D229 K230 L231	N227-D229 VanDerWaalsContact C-N 3.3Å; N227-D229 PolarHBondContact O-N 3.31Å; N227-K230 PolarHBondContact O-N 3.21Å; N227-L231 PolarHBondContact O-N 3.01Å
228	K	83.9	Confident	81.7	Confident	40 Å²	40	52 Å²	52	17%	0.174	28%	0.275	C	S	.	.	H	α-helix	trans	-49.8	-47.9	177.9	179.5	-153.1	176.9	-172.9	0	112.6	K230 L231 L232 W255 Y266 E269	K228-K230 PolarHBondContact O-N 3.33Å; K228-L231 PolarHBondContact O-N 3.03Å; K228-L232 WeakPolarHBondContact O-CB 3.48Å; K228-L232 PolarHBondContact O-N 3.26Å; K228-W255 HydrophobicContact CB-CH2 4.42Å; K228-Y266 HydrophobicContact CD-CD1 3.46Å; K228-Y266 VanDerWaalsContact CD-CD1 3.46Å; K228-Y266 HydrophobicContact CD-CD2 4.29Å; K228-Y266 HydrophobicContact CD-CE1 3.88Å; K228-Y266 HydrophobicContact CD-CG 3.68Å; K228-Y266 VanDerWaalsContact CE-CD1 3.48Å; K228-Y266 HydrophobicContact CG-CD1 4.33Å; K228-Y266 HydrophobicContact CG-CD2 4.43Å; K228-Y266 HydrophobicContact CG-CG 4.05Å; K228-E269 WeakPolarHBondContact CE-OE2 3.37Å; K228-E269 IonicContact NZ-OE1 2.83Å; K228-E269 IonicContact NZ-OE2 2.95Å; K228-E269 PolarHBondContact NZ-OE2 2.79Å
229	D	84.6	Confident	81	Confident	105 Å²	105	54.3 Å²	54.3	56%	0.561	29%	0.289	S	S	*	.	H	α-helix	trans	-65.2	-42.5	-173.9	-59.4	-37	0	0	0	111.6	N227 L232 D233	N227-D229 VanDerWaalsContact C-N 3.3Å; N227-D229 PolarHBondContact O-N 3.31Å; D229-L232 PolarHBondContact O-N 2.9Å; D229-D233 VanDerWaalsContact O-CG 3.29Å; D229-D233 PolarHBondContact O-N 3.38Å
230	K	85	Confident	80.5	Confident	38 Å²	38	50.5 Å²	50.5	17%	0.165	27%	0.268	C	S	.	.	H	α-helix	trans	-67.7	-38.7	177.2	-62.8	-64.1	-171.6	176	0	111.9	D195 L226 N227 K228 L232 D233 L234	D195-K230 IonicContact OD1-NZ 3.11Å; D195-K230 PolarHBondContact OD1-NZ 3.22Å; D195-K230 VanDerWaalsContact OD1-NZ 3.08Å; D195-K230 WeakPolarHBondContact OD2-CE 3.48Å; D195-K230 IonicContact OD2-NZ 2.68Å; D195-K230 PolarHBondContact OD2-NZ 3.45Å; L226-K230 HydrophobicContact CD2-CB 4.44Å; N227-K230 PolarHBondContact O-N 3.21Å; K228-K230 PolarHBondContact O-N 3.33Å; K230-L232 VanDerWaalsContact C-N 3.34Å; K230-D233 PolarHBondContact O-N 3.24Å; K230-L234 WeakPolarHBondContact O-CB 3.47Å; K230-L234 PolarHBondContact O-N 2.62Å
231	L	86.4	Confident	79.6	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-64.1	-42.1	173.8	179.6	62.6	0	0	0	110.9	F223 N227 K228 L234 I235 W255 L270	F223-L231 HydrophobicContact CE2-CD1 3.81Å; F223-L231 HydrophobicContact CZ-CD1 3.63Å; N227-L231 PolarHBondContact O-N 3.01Å; K228-L231 PolarHBondContact O-N 3.03Å; L231-L234 PolarHBondContact O-N 3.45Å; L231-I235 HydrophobicContact CD1-CD1 3.83Å; L231-I235 HydrophobicContact CD1-CG1 4.27Å; L231-I235 HydrophobicContact CD2-CD1 4.37Å; L231-I235 HydrophobicContact CG-CD1 3.66Å; L231-I235 HydrophobicContact CG-CG1 4.49Å; L231-I235 WeakPolarHBondContact O-CD1 3.48Å; L231-I235 WeakPolarHBondContact O-CG1 3.4Å; L231-I235 PolarHBondContact O-N 3.4Å; L231-W255 HydrophobicContact CD2-CB 4.35Å; L231-W255 HydrophobicContact CD2-CD2 3.46Å; L231-W255 VanDerWaalsContact CD2-CD2 3.46Å; L231-W255 HydrophobicContact CD2-CE3 3.7Å; L231-W255 HydrophobicContact CD2-CG 3.75Å; L231-W255 HydrophobicContact CD2-CZ2 4.32Å; L231-W255 HydrophobicContact CD2-CZ3 4.23Å; L231-L270 HydrophobicContact CD2-CD1 4.28Å; L231-L270 HydrophobicContact CD2-CD2 4.05Å; L231-L270 HydrophobicContact CG-CD2 4.17Å
232	L	85.1	Confident	78.8	Confident	32 Å²	32	45.1 Å²	45.1	17%	0.168	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-42.8	176.8	-170.3	73.1	0	0	0	111.3	K228 D229 K230 L234 I235 L236 L270	K228-L232 WeakPolarHBondContact O-CB 3.48Å; K228-L232 PolarHBondContact O-N 3.26Å; D229-L232 PolarHBondContact O-N 2.9Å; K230-L232 VanDerWaalsContact C-N 3.34Å; L232-L234 VanDerWaalsContact C-N 3.28Å; L232-L234 PolarHBondContact O-N 3.19Å; L232-I235 CarbonylContact O-C 3.55Å; L232-I235 PolarHBondContact O-N 3.24Å; L232-L236 HydrophobicContact CD1-CD1 4.3Å; L232-L236 HydrophobicContact CD1-CG 4.41Å; L232-L236 HydrophobicContact CD2-CD1 4.17Å; L232-L236 HydrophobicContact CG-CD1 3.77Å; L232-L236 HydrophobicContact CG-CG 4.23Å; L232-L236 VanDerWaalsContact O-CB 3.31Å; L232-L236 WeakPolarHBondContact O-CB 3.27Å; L232-L236 VanDerWaalsContact O-CG 3.3Å; L232-L236 WeakPolarHBondContact O-CG 3.37Å; L232-L236 PolarHBondContact O-N 3.25Å; L232-L270 HydrophobicContact CB-CD2 4.44Å; L232-L270 HydrophobicContact CD1-CD2 4.14Å
233	D	83.8	Confident	77.5	Confident	79 Å²	79	47.7 Å²	47.7	42%	0.422	25%	0.252	S	S	.	.	H	α-helix	trans	-59.1	-41	174.9	-72.5	-23.2	0	0	0	111.5	W207 D229 K230 L236 S237	W207-D233 HydrophobicContact CH2-CB 3.98Å; D229-D233 VanDerWaalsContact O-CG 3.29Å; D229-D233 PolarHBondContact O-N 3.38Å; K230-D233 PolarHBondContact O-N 3.24Å; D233-L236 PolarHBondContact O-N 2.96Å; D233-S237 WeakPolarHBondContact O-CB 3.3Å; D233-S237 PolarHBondContact O-N 3Å
234	L	83.6	Confident	76.2	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-68	-41.6	178.6	-169.5	147.7	0	0	0	111.5	W207 C210 F214 K230 L231 L232 S237 L240	W207-L234 HydrophobicContact CH2-CB 3.99Å; W207-L234 HydrophobicContact CZ3-CB 4.37Å; C210-L234 HydrophobicContact CB-CD1 4.42Å; F214-L234 HydrophobicContact CD2-CD2 3.61Å; F214-L234 HydrophobicContact CE2-CD2 3.27Å; F214-L234 HydrophobicContact CZ-CD2 4.18Å; K230-L234 WeakPolarHBondContact O-CB 3.47Å; K230-L234 PolarHBondContact O-N 2.62Å; L231-L234 PolarHBondContact O-N 3.45Å; L232-L234 VanDerWaalsContact C-N 3.28Å; L232-L234 PolarHBondContact O-N 3.19Å; L234-S237 WeakPolarHBondContact O-CB 3.3Å; L234-S237 PolarHBondContact O-N 3.23Å; L234-L240 HydrophobicContact CD2-CD1 4.02Å
235	I	82.4	Confident	75.6	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-74.6	-28.6	177.8	-62.6	160.2	0	0	0	111.7	L231 L232 S237 V248 V252 L270 G273 I274 R329	L231-I235 HydrophobicContact CD1-CD1 3.83Å; L231-I235 HydrophobicContact CD1-CG1 4.27Å; L231-I235 HydrophobicContact CD2-CD1 4.37Å; L231-I235 HydrophobicContact CG-CD1 3.66Å; L231-I235 HydrophobicContact CG-CG1 4.49Å; L231-I235 WeakPolarHBondContact O-CD1 3.48Å; L231-I235 WeakPolarHBondContact O-CG1 3.4Å; L231-I235 PolarHBondContact O-N 3.4Å; L232-I235 CarbonylContact O-C 3.55Å; L232-I235 PolarHBondContact O-N 3.24Å; I235-S237 VanDerWaalsContact C-N 3.34Å; I235-V248 HydrophobicContact CG1-CG1 4.26Å; I235-V248 HydrophobicContact CG2-CG1 4.23Å; I235-V252 HydrophobicContact CD1-CG2 3.34Å; I235-V252 HydrophobicContact CG1-CG2 4.17Å; I235-L270 HydrophobicContact CD1-CD2 3.94Å; I235-G273 VanDerWaalsContact CG2-C 3.47Å; I235-I274 HydrophobicContact CG2-CG1 3.9Å; I235-R329 PolarHBondContact O-NH1 3.28Å; I235-R329 PolarHBondContact O-NH2 3.35Å
236	L	79.8	Confident	75.1	Confident	92 Å²	92	48.4 Å²	48.4	48%	0.482	24%	0.244	S	C	.	.	H	α-helix	trans	-80.1	-21.5	175.5	-73.3	174.1	0	0	0	112.2	L232 D233 D238	L232-L236 HydrophobicContact CD1-CD1 4.3Å; L232-L236 HydrophobicContact CD1-CG 4.41Å; L232-L236 HydrophobicContact CD2-CD1 4.17Å; L232-L236 HydrophobicContact CG-CD1 3.77Å; L232-L236 HydrophobicContact CG-CG 4.23Å; L232-L236 VanDerWaalsContact O-CB 3.31Å; L232-L236 WeakPolarHBondContact O-CB 3.27Å; L232-L236 VanDerWaalsContact O-CG 3.3Å; L232-L236 WeakPolarHBondContact O-CG 3.37Å; L232-L236 PolarHBondContact O-N 3.25Å; D233-L236 PolarHBondContact O-N 2.96Å; L236-D238 PolarHBondContact O-N 3.39Å
237	S	74.9	Confident	74.4	Confident	19 Å²	19	49.3 Å²	49.3	13%	0.133	25%	0.249	C	C	.	.			trans	-57	122.5	-179.4	-174.7	0	0	0	0	112.4	D233 L234 I235 E239	D233-S237 WeakPolarHBondContact O-CB 3.3Å; D233-S237 PolarHBondContact O-N 3Å; L234-S237 WeakPolarHBondContact O-CB 3.3Å; L234-S237 PolarHBondContact O-N 3.23Å; I235-S237 VanDerWaalsContact C-N 3.34Å; S237-E239 PolarHBondContact O-N 3.36Å; S237-E239 PolarHBondContact OG-N 2.97Å
238	D	66.3	Low	74.1	Confident	68 Å²	68	43.9 Å²	43.9	36%	0.364	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-13.4	171.4	-85.5	-27.3	0	0	0	112.2	L236 R275 R327 K330	L236-D238 PolarHBondContact O-N 3.39Å; D238-R275 IonicContact OD1-CZ 3.88Å; D238-R275 IonicContact OD1-NH1 2.82Å; D238-R275 PolarHBondContact OD1-NH1 3.13Å; D238-R275 IonicContact OD1-NH2 3.74Å; D238-R275 PolarHBondContact OD1-NH2 2.97Å; D238-R327 IonicContact OD2-NH1 2.64Å; D238-K330 VanDerWaalsContact O-CA 3.26Å; D238-K330 WeakPolarHBondContact O-CA 3.36Å; D238-K330 VanDerWaalsContact O-CB 3.24Å; D238-K330 WeakPolarHBondContact O-CB 3.33Å; D238-K330 PolarHBondContact O-N 3.24Å
239	E	64.5	Low	73.9	Confident	106 Å²	106	42.7 Å²	42.7	50%	0.495	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-1.9	-174.7	-64.7	-160.3	166	0	0	114.9	L211 S237 E241 K330	L211-E239 HydrophobicContact CD1-CB 3.81Å; S237-E239 PolarHBondContact O-N 3.36Å; S237-E239 PolarHBondContact OG-N 2.97Å; E239-E241 PolarHBondContact O-N 2.72Å; E239-K330 WeakPolarHBondContact O-CD 3.42Å; E239-K330 PolarHBondContact O-NZ 3.27Å; E239-K330 VanDerWaalsContact O-NZ 3.15Å
240	L	68.6	Low	73.6	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	20%	0.203	C	C	.	.			trans	-62.2	121.4	178	-170.4	72	0	0	0	110.5	L211 F214 L234 I242 V248	L211-L240 HydrophobicContact CD2-CB 4.15Å; L211-L240 HydrophobicContact CD2-CD1 3.86Å; F214-L240 HydrophobicContact CB-CD1 3.75Å; F214-L240 HydrophobicContact CD1-CD1 4.5Å; F214-L240 HydrophobicContact CD2-CD1 3.87Å; F214-L240 HydrophobicContact CG-CD1 3.77Å; L234-L240 HydrophobicContact CD2-CD1 4.02Å; L240-I242 HydrophobicContact CD2-CD1 4.33Å; L240-I242 HydrophobicContact CD2-CG1 4.02Å; L240-I242 HydrophobicContact CD2-CG2 4.09Å; L240-I242 HydrophobicContact CG-CG1 4.2Å; L240-I242 HydrophobicContact CG-CG2 4.03Å; L240-I242 PolarHBondContact O-N 2.62Å; L240-V248 HydrophobicContact CD2-CG2 3.68Å
241	E	63.5	Low	73.5	Confident	64 Å²	64	38.8 Å²	38.8	30%	0.299	20%	0.196	S	C	.	.			trans	-88.9	92.4	177	-63.8	-165.8	-164.4	0	0	109.5	L211 E239 K330 K354	L211-E241 PolarHBondContact O-N 2.86Å; E239-E241 PolarHBondContact O-N 2.72Å; E241-K330 HydrophobicContact CG-CD 3.92Å; E241-K330 IonicContact OE1-NZ 2.7Å; E241-K330 PolarHBondContact OE1-NZ 2.94Å; E241-K354 IonicContact OE2-NZ 3.6Å; E241-K354 PolarHBondContact OE2-NZ 3.38Å; E241-K354 VanDerWaalsContact OE2-NZ 3.08Å
242	I	63.4	Low	73.4	Confident	22 Å²	22	38.9 Å²	38.9	11%	0.113	20%	0.197	C	C	.	.			trans	-132	142.1	174	50.5	142.8	0	0	0	111	F214 L240 E245 V248	F214-I242 HydrophobicContact CB-CG2 4.15Å; F214-I242 HydrophobicContact CD1-CG2 3.64Å; F214-I242 HydrophobicContact CG-CG2 4.24Å; L240-I242 HydrophobicContact CD2-CD1 4.33Å; L240-I242 HydrophobicContact CD2-CG1 4.02Å; L240-I242 HydrophobicContact CD2-CG2 4.09Å; L240-I242 HydrophobicContact CG-CG1 4.2Å; L240-I242 HydrophobicContact CG-CG2 4.03Å; L240-I242 PolarHBondContact O-N 2.62Å; I242-E245 WeakPolarHBondContact CD1-OE2 3.42Å; I242-V248 HydrophobicContact CD1-CB 4.4Å; I242-V248 HydrophobicContact CD1-CG2 3.41Å; I242-V248 VanDerWaalsContact CD1-CG2 3.41Å; I242-V248 HydrophobicContact CG1-CG2 4.28Å; I242-V248 HydrophobicContact CG2-CG2 4.31Å
243	E	52.3	Low	73.2	Confident	115 Å²	115	37.8 Å²	37.8	54%	0.537	19%	0.191	S	C	.	.	S	Bend	trans	-84.4	-36.1	-180	-47.6	-159.4	142.3	0	0	111.8	L625	E243-L625 HydrophobicContact CB-CB 4.26Å; E243-L625 HydrophobicContact CB-CD1 4.21Å; E243-L625 HydrophobicContact CG-CD1 3.95Å
244	D	57.8	Low	73.1	Confident	46 Å²	46	38.8 Å²	38.8	25%	0.246	19%	0.189	C	C	.	.			trans	-128.9	128.7	179	-165.6	-14.8	0	0	0	111.6	Q246 I247	D244-Q246 HydrophobicContact CB-CB 4.37Å; D244-Q246 VanDerWaalsContact CG-CB 3.41Å; D244-Q246 PolarHBondContact O-N 2.89Å; D244-Q246 VanDerWaalsContact OD1-CB 3.26Å; D244-Q246 WeakPolarHBondContact OD1-CB 3.47Å; D244-Q246 PolarHBondContact OD1-N 3.47Å; D244-Q246 WeakPolarHBondContact OD2-CB 3.26Å; D244-Q246 PolarHBondContact OD2-OE1 3.26Å; D244-I247 HydrophobicContact CB-CD1 4.32Å; D244-I247 HydrophobicContact CB-CG1 4.41Å; D244-I247 WeakPolarHBondContact O-CB 3.17Å; D244-I247 PolarHBondContact O-N 3.26Å; D244-I247 VanDerWaalsContact O-N 3.08Å
245	E	70.9	Confident	73.2	Confident	12 Å²	12	39 Å²	39	6%	0.056	19%	0.189	C	C	.	.	H	α-helix	trans	-65.2	-17.7	173.5	-157.7	80.3	-175.6	0	0	111.5	I242 I247 V248 F249 I274 R275 L279 R329	I242-E245 WeakPolarHBondContact CD1-OE2 3.42Å; E245-I247 PolarHBondContact O-N 3.31Å; E245-V248 PolarHBondContact O-N 3.42Å; E245-V248 VanDerWaalsContact O-N 3.17Å; E245-F249 PolarHBondContact O-N 3.45Å; E245-I274 HydrophobicContact CG-CG2 3.78Å; E245-R275 HydrophobicContact CG-CB 4.13Å; E245-R275 PolarHBondContact OE1-N 3.27Å; E245-L279 VanDerWaalsContact C-CD2 3.46Å; E245-L279 HydrophobicContact CB-CD2 4.04Å; E245-R329 VanDerWaalsContact CD-NE 3.27Å; E245-R329 IonicContact OE1-CZ 2.79Å; E245-R329 IonicContact OE1-NE 2.67Å; E245-R329 PolarHBondContact OE1-NE 3.23Å; E245-R329 IonicContact OE1-NH2 3.08Å; E245-R329 PolarHBondContact OE1-NH2 2.82Å; E245-R329 WeakPolarHBondContact OE2-CD 3.05Å; E245-R329 IonicContact OE2-CZ 3.35Å; E245-R329 IonicContact OE2-NE 3.1Å; E245-R329 PolarHBondContact OE2-NE 3Å
246	Q	68.9	Low	73.2	Confident	56 Å²	56	39.1 Å²	39.1	26%	0.262	19%	0.19	S	C	.	.	H	α-helix	trans	-56.7	-34.9	170.6	180	173.1	26	0	0	111.3	D244 F249 N250 L279 C283	D244-Q246 HydrophobicContact CB-CB 4.37Å; D244-Q246 VanDerWaalsContact CG-CB 3.41Å; D244-Q246 PolarHBondContact O-N 2.89Å; D244-Q246 VanDerWaalsContact OD1-CB 3.26Å; D244-Q246 WeakPolarHBondContact OD1-CB 3.47Å; D244-Q246 PolarHBondContact OD1-N 3.47Å; D244-Q246 WeakPolarHBondContact OD2-CB 3.26Å; D244-Q246 PolarHBondContact OD2-OE1 3.26Å; Q246-F249 PolarHBondContact O-N 3.45Å; Q246-N250 VanDerWaalsContact O-CB 3.31Å; Q246-N250 WeakPolarHBondContact O-CB 3.35Å; Q246-N250 VanDerWaalsContact O-CG 3.24Å; Q246-N250 PolarHBondContact O-N 3.13Å; Q246-N250 PolarHBondContact O-ND2 3.02Å; Q246-L279 VanDerWaalsContact CA-CD2 3.46Å; Q246-L279 HydrophobicContact CB-CD2 4.09Å; Q246-C283 HydrophobicContact CG-CB 4.46Å
247	I	71.9	Confident	73.2	Confident	23 Å²	23	40.8 Å²	40.8	12%	0.118	19%	0.19	C	C	.	.	H	α-helix	trans	-65	-44.5	178.8	-64.9	167.3	0	0	0	110.4	F214 E215 D244 E245 N250 A251	F214-I247 HydrophobicContact CD1-CG2 4.19Å; F214-I247 HydrophobicContact CE1-CG2 4.11Å; E215-I247 HydrophobicContact CG-CD1 4.21Å; E215-I247 HydrophobicContact CG-CG2 4.41Å; E215-I247 WeakPolarHBondContact OE1-CD1 3.44Å; D244-I247 HydrophobicContact CB-CD1 4.32Å; D244-I247 HydrophobicContact CB-CG1 4.41Å; D244-I247 WeakPolarHBondContact O-CB 3.17Å; D244-I247 PolarHBondContact O-N 3.26Å; D244-I247 VanDerWaalsContact O-N 3.08Å; E245-I247 PolarHBondContact O-N 3.31Å; I247-N250 PolarHBondContact O-N 2.92Å; I247-A251 VanDerWaalsContact O-CB 3.32Å; I247-A251 WeakPolarHBondContact O-CB 3.39Å; I247-A251 PolarHBondContact O-N 3.2Å
248	V	78.8	Confident	73.6	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-67.1	-42.6	177.1	174.7	0	0	0	0	110.5	F214 I235 L240 I242 E245 A251 V252 I274	F214-V248 HydrophobicContact CD1-CG2 4.25Å; F214-V248 HydrophobicContact CE1-CB 4.44Å; F214-V248 HydrophobicContact CE1-CG2 3.66Å; F214-V248 HydrophobicContact CZ-CG2 4.27Å; I235-V248 HydrophobicContact CG1-CG1 4.26Å; I235-V248 HydrophobicContact CG2-CG1 4.23Å; L240-V248 HydrophobicContact CD2-CG2 3.68Å; I242-V248 HydrophobicContact CD1-CB 4.4Å; I242-V248 HydrophobicContact CD1-CG2 3.41Å; I242-V248 VanDerWaalsContact CD1-CG2 3.41Å; I242-V248 HydrophobicContact CG1-CG2 4.28Å; I242-V248 HydrophobicContact CG2-CG2 4.31Å; E245-V248 PolarHBondContact O-N 3.42Å; E245-V248 VanDerWaalsContact O-N 3.17Å; V248-A251 PolarHBondContact O-N 3.19Å; V248-V252 HydrophobicContact CG1-CG2 4.45Å; V248-V252 VanDerWaalsContact O-CG2 3.31Å; V248-V252 WeakPolarHBondContact O-CG2 3.43Å; V248-V252 PolarHBondContact O-N 3.48Å; V248-I274 HydrophobicContact CG1-CG1 4.16Å
249	F	78.4	Confident	74.3	Confident	15 Å²	15	47.4 Å²	47.4	7%	0.066	21%	0.213	C	C	.	.	H	α-helix	trans	-58.7	-50.8	175.4	-179.6	-99	0	0	0	111.8	E245 Q246 A251 V252 M253 L271 I274 L276 L279 A287	E245-F249 PolarHBondContact O-N 3.45Å; Q246-F249 PolarHBondContact O-N 3.45Å; F249-A251 VanDerWaalsContact C-N 3.33Å; F249-A251 PolarHBondContact O-N 3.5Å; F249-V252 PolarHBondContact O-N 2.66Å; F249-M253 HydrophobicContact CD1-CG 4.19Å; F249-M253 HydrophobicContact CD2-CG 4.44Å; F249-M253 HydrophobicContact CE1-CG 3.77Å; F249-M253 HydrophobicContact CE2-CG 4.04Å; F249-M253 HydrophobicContact CE2-SD 4.15Å; F249-M253 HydrophobicContact CG-CG 4.5Å; F249-M253 HydrophobicContact CZ-CG 3.68Å; F249-M253 HydrophobicContact CZ-SD 4Å; F249-M253 VanDerWaalsContact O-CG 3.28Å; F249-M253 WeakPolarHBondContact O-CG 3.5Å; F249-M253 PolarHBondContact O-N 2.87Å; F249-L271 HydrophobicContact CD2-CD2 4.34Å; F249-L271 HydrophobicContact CE2-CD2 3.92Å; F249-I274 HydrophobicContact CD2-CD1 4.19Å; F249-L276 HydrophobicContact CD2-CD2 4.07Å; F249-L276 HydrophobicContact CE2-CD2 4.43Å; F249-L279 HydrophobicContact CB-CD2 4.26Å; F249-L279 HydrophobicContact CG-CD1 4.49Å; F249-A287 HydrophobicContact CE1-CB 3.79Å; F249-A287 HydrophobicContact CE2-CB 4.08Å; F249-A287 HydrophobicContact CZ-CB 3.4Å; F249-A287 VanDerWaalsContact CZ-CB 3.4Å
250	N	79.4	Confident	74.8	Confident	61 Å²	61	45.8 Å²	45.8	33%	0.326	21%	0.207	S	C	.	.	H	α-helix	trans	-61	-40.7	178	-74.8	-21.7	0	0	0	112.1	Q246 I247 M253 R254	Q246-N250 VanDerWaalsContact O-CB 3.31Å; Q246-N250 WeakPolarHBondContact O-CB 3.35Å; Q246-N250 VanDerWaalsContact O-CG 3.24Å; Q246-N250 PolarHBondContact O-N 3.13Å; Q246-N250 PolarHBondContact O-ND2 3.02Å; I247-N250 PolarHBondContact O-N 2.92Å; N250-M253 PolarHBondContact O-N 3.09Å; N250-R254 WeakPolarHBondContact O-CB 3.41Å; N250-R254 VanDerWaalsContact O-CG 3.26Å; N250-R254 WeakPolarHBondContact O-CG 3.22Å; N250-R254 PolarHBondContact O-N 3.39Å
251	A	82.9	Confident	75	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-62.2	-46.5	176.9	0	0	0	0	0	111.8	F214 R218 F223 I247 V248 F249 M253 R254 W255	F214-A251 HydrophobicContact CE1-CB 4.25Å; F214-A251 HydrophobicContact CZ-CB 3.96Å; R218-A251 HydrophobicContact CB-CB 3.98Å; F223-A251 HydrophobicContact CE1-CB 4.06Å; F223-A251 HydrophobicContact CZ-CB 3.99Å; I247-A251 VanDerWaalsContact O-CB 3.32Å; I247-A251 WeakPolarHBondContact O-CB 3.39Å; I247-A251 PolarHBondContact O-N 3.2Å; V248-A251 PolarHBondContact O-N 3.19Å; F249-A251 VanDerWaalsContact C-N 3.33Å; F249-A251 PolarHBondContact O-N 3.5Å; A251-M253 PolarHBondContact O-N 3.17Å; A251-R254 PolarHBondContact O-N 2.92Å; A251-W255 PolarHBondContact O-N 3.31Å
252	V	84.7	Confident	75.7	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.012	25%	0.249	C	C	.	.	H	α-helix	trans	-62.5	-44.3	177.2	171.9	0	0	0	0	111.4	I235 V248 F249 R254 W255 V256 L270 I274	I235-V252 HydrophobicContact CD1-CG2 3.34Å; I235-V252 HydrophobicContact CG1-CG2 4.17Å; V248-V252 HydrophobicContact CG1-CG2 4.45Å; V248-V252 VanDerWaalsContact O-CG2 3.31Å; V248-V252 WeakPolarHBondContact O-CG2 3.43Å; V248-V252 PolarHBondContact O-N 3.48Å; F249-V252 PolarHBondContact O-N 2.66Å; V252-R254 VanDerWaalsContact C-N 3.34Å; V252-R254 PolarHBondContact O-N 3.26Å; V252-W255 WeakPolarHBondContact O-CB 3.47Å; V252-W255 PolarHBondContact O-N 3.39Å; V252-V256 WeakPolarHBondContact O-CG2 3.37Å; V252-V256 PolarHBondContact O-N 3.49Å; V252-L270 HydrophobicContact CG1-CB 3.96Å; V252-L270 HydrophobicContact CG1-CD1 4.18Å; V252-I274 HydrophobicContact CB-CD1 4.06Å; V252-I274 HydrophobicContact CG1-CD1 4.19Å; V252-I274 HydrophobicContact CG2-CD1 3.96Å
253	M	79.8	Confident	76.5	Confident	9 Å²	9	52.2 Å²	52.2	4%	0.044	25%	0.249	C	C	.	.	H	α-helix	trans	-63.1	-40.7	178	-67.5	-54.4	-64.6	0	0	111.6	F249 N250 A251 V256 R257 L267 E291 V294	F249-M253 HydrophobicContact CD1-CG 4.19Å; F249-M253 HydrophobicContact CD2-CG 4.44Å; F249-M253 HydrophobicContact CE1-CG 3.77Å; F249-M253 HydrophobicContact CE2-CG 4.04Å; F249-M253 HydrophobicContact CE2-SD 4.15Å; F249-M253 HydrophobicContact CG-CG 4.5Å; F249-M253 HydrophobicContact CZ-CG 3.68Å; F249-M253 HydrophobicContact CZ-SD 4Å; F249-M253 VanDerWaalsContact O-CG 3.28Å; F249-M253 WeakPolarHBondContact O-CG 3.5Å; F249-M253 PolarHBondContact O-N 2.87Å; N250-M253 PolarHBondContact O-N 3.09Å; A251-M253 PolarHBondContact O-N 3.17Å; M253-V256 PolarHBondContact O-N 3.39Å; M253-R257 WeakPolarHBondContact O-CB 3.21Å; M253-R257 VanDerWaalsContact O-CG 3.22Å; M253-R257 WeakPolarHBondContact O-CG 3.49Å; M253-R257 PolarHBondContact O-N 3.44Å; M253-L267 HydrophobicContact SD-CD1 4.12Å; M253-E291 HydrophobicContact CE-CG 4.5Å; M253-E291 WeakPolarHBondContact CE-OE2 3.26Å; M253-V294 HydrophobicContact CE-CG2 4.26Å
254	R	82.3	Confident	77.4	Confident	100 Å²	100	52 Å²	52	38%	0.377	24%	0.244	S	C	.	.	H	α-helix	trans	-63.7	-39.6	174.1	-71.9	176.3	-178.3	-177.7	0.6	112.2	D219 Y224 N250 A251 V252 R257 Y258	D219-R254 IonicContact OD1-NH1 3.02Å; D219-R254 PolarHBondContact OD1-NH1 3.26Å; Y224-R254 HydrophobicContact CE1-CB 4.05Å; N250-R254 WeakPolarHBondContact O-CB 3.41Å; N250-R254 VanDerWaalsContact O-CG 3.26Å; N250-R254 WeakPolarHBondContact O-CG 3.22Å; N250-R254 PolarHBondContact O-N 3.39Å; A251-R254 PolarHBondContact O-N 2.92Å; V252-R254 VanDerWaalsContact C-N 3.34Å; V252-R254 PolarHBondContact O-N 3.26Å; R254-R257 PolarHBondContact O-N 2.94Å; R254-Y258 PolarHBondContact O-N 3.49Å
255	W	86.6	Confident	78.3	Confident	6 Å²	6	55.7 Å²	55.7	2%	0.023	26%	0.263	C	S	.	.	H	α-helix	trans	-63.9	-40.1	175.8	-177	91.4	0	0	0	112.9	F223 L226 K228 L231 A251 V252 R263 L270	F223-W255 HydrophobicContact CE1-CB 4.1Å; L226-W255 VanDerWaalsContact O-CZ2 3.25Å; L226-W255 WeakPolarHBondContact O-CZ2 3.31Å; L226-W255 PolarHBondContact O-NE1 3.42Å; K228-W255 HydrophobicContact CB-CH2 4.42Å; L231-W255 HydrophobicContact CD2-CB 4.35Å; L231-W255 HydrophobicContact CD2-CD2 3.46Å; L231-W255 VanDerWaalsContact CD2-CD2 3.46Å; L231-W255 HydrophobicContact CD2-CE3 3.7Å; L231-W255 HydrophobicContact CD2-CG 3.75Å; L231-W255 HydrophobicContact CD2-CZ2 4.32Å; L231-W255 HydrophobicContact CD2-CZ3 4.23Å; A251-W255 PolarHBondContact O-N 3.31Å; V252-W255 WeakPolarHBondContact O-CB 3.47Å; V252-W255 PolarHBondContact O-N 3.39Å; W255-R263 HydrophobicContact CE3-CB 4.47Å; W255-R263 HydrophobicContact CH2-CB 4.22Å; W255-R263 HydrophobicContact CH2-CG 3.78Å; W255-R263 HydrophobicContact CZ2-CG 4.39Å; W255-R263 HydrophobicContact CZ3-CB 3.82Å; W255-R263 HydrophobicContact CZ3-CG 3.85Å; W255-R263 WeakPolarHBondContact O-CD 3.24Å; W255-R263 PolarHBondContact O-NH1 3.28Å; W255-L270 HydrophobicContact CE3-CD1 4Å; W255-L270 HydrophobicContact CZ3-CD1 3.72Å
256	V	82.6	Confident	78.6	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.024	28%	0.278	C	S	.	.	H	α-helix	trans	-70.5	-40	175.8	176	0	0	0	0	111.3	V252 M253 Y258 D259 L260 R263 L267 L270	V252-V256 WeakPolarHBondContact O-CG2 3.37Å; V252-V256 PolarHBondContact O-N 3.49Å; M253-V256 PolarHBondContact O-N 3.39Å; V256-Y258 PolarHBondContact O-N 2.96Å; V256-D259 CarbonylContact O-C 3.54Å; V256-D259 VanDerWaalsContact O-C 3.28Å; V256-D259 PolarHBondContact O-N 3.45Å; V256-L260 PolarHBondContact O-N 2.94Å; V256-R263 HydrophobicContact CG1-CB 4.45Å; V256-L267 HydrophobicContact CG2-CD1 4.13Å; V256-L270 HydrophobicContact CG2-CD1 4.29Å
257	R	79.8	Confident	79	Confident	127 Å²	127	57.1 Å²	57.1	48%	0.479	27%	0.267	S	S	.	.	H	α-helix	trans	-62.6	-26.1	177.5	-76.6	173.1	-178.8	176	1.6	113.7	M253 R254 D259 E291	M253-R257 WeakPolarHBondContact O-CB 3.21Å; M253-R257 VanDerWaalsContact O-CG 3.22Å; M253-R257 WeakPolarHBondContact O-CG 3.49Å; M253-R257 PolarHBondContact O-N 3.44Å; R254-R257 PolarHBondContact O-N 2.94Å; R257-D259 VanDerWaalsContact C-N 3.31Å; R257-D259 PolarHBondContact O-N 3.2Å; R257-E291 IonicContact CZ-OE1 3.76Å; R257-E291 IonicContact NE-OE1 2.85Å; R257-E291 PolarHBondContact NE-OE1 2.88Å; R257-E291 IonicContact NH2-OE1 2.72Å; R257-E291 PolarHBondContact NH2-OE1 3.34Å
258	Y	83.1	Confident	79.1	Confident	158 Å²	158	56.5 Å²	56.5	62%	0.62	26%	0.264	S	S	*	.	H	α-helix	trans	-64.3	-34.8	178.4	-173.3	-93.1	0	0	0	112.5	Y224 R254 V256	Y224-Y258 HydrophobicContact CD1-CD2 4.24Å; Y224-Y258 HydrophobicContact CD1-CG 4.37Å; Y224-Y258 HydrophobicContact CG-CD2 4.07Å; Y224-Y258 HydrophobicContact CG-CE2 4.49Å; Y224-Y258 HydrophobicContact CG-CG 4.39Å; R254-Y258 PolarHBondContact O-N 3.49Å; V256-Y258 PolarHBondContact O-N 2.96Å
259	D	80.3	Confident	79.1	Confident	67 Å²	67	61.1 Å²	61.1	36%	0.358	29%	0.286	S	S	.	.	S	Bend	trans	-142.8	84.7	176.4	169.6	22.6	0	0	0	109.9	V256 R257 D261 G262 R263	V256-D259 CarbonylContact O-C 3.54Å; V256-D259 VanDerWaalsContact O-C 3.28Å; V256-D259 PolarHBondContact O-N 3.45Å; R257-D259 VanDerWaalsContact C-N 3.31Å; R257-D259 PolarHBondContact O-N 3.2Å; D259-D261 VanDerWaalsContact C-N 3.34Å; D259-D261 PolarHBondContact O-N 3.32Å; D259-G262 PolarHBondContact OD1-N 3.21Å; D259-R263 HydrophobicContact CB-CG 4.1Å; D259-R263 WeakPolarHBondContact O-CB 3.42Å; D259-R263 VanDerWaalsContact O-CG 3.3Å; D259-R263 WeakPolarHBondContact O-CG 3.43Å; D259-R263 PolarHBondContact O-N 2.99Å; D259-R263 VanDerWaalsContact O-N 3.1Å; D259-R263 IonicContact OD2-NE 2.74Å
260	L	74.7	Confident	79.2	Confident	72 Å²	72	60.4 Å²	60.4	38%	0.377	28%	0.282	S	S	.	.	H	α-helix	trans	-67.8	-31.7	-174.8	-72.9	172.1	0	0	0	113.3	V256 R264 L293	V256-L260 PolarHBondContact O-N 2.94Å; L260-R264 VanDerWaalsContact O-CB 3.31Å; L260-R264 WeakPolarHBondContact O-CB 3.26Å; L260-L293 HydrophobicContact CD2-CD1 3.6Å; L260-L293 HydrophobicContact CD2-CD2 4.4Å
261	D	73.7	Confident	79	Confident	160 Å²	160	57.5 Å²	57.5	86%	0.856	27%	0.267	S	S	*	.	H	α-helix	trans	-77.8	-37.3	-173.2	-68.5	-40.1	0	0	0	111.6	D259	D259-D261 VanDerWaalsContact C-N 3.34Å; D259-D261 PolarHBondContact O-N 3.32Å
262	G	77	Confident	78.5	Confident	32 Å²	32	66.9 Å²	66.9	33%	0.33	30%	0.302	S	S	.	.	H	α-helix	trans	-90.4	-30.1	179	0	0	0	0	0	115	D259 Y266	D259-G262 PolarHBondContact OD1-N 3.21Å; G262-Y266 WeakPolarHBondContact O-CE2 3.45Å
263	R	80.1	Confident	77.6	Confident	30 Å²	30	67.1 Å²	67.1	11%	0.113	31%	0.305	C	S	.	.	H	α-helix	trans	-98.7	-10.4	-168.4	-57.2	175.2	-179.3	-173.1	-3.6	114.8	Y224 W255 V256 D259 D265 Y266	Y224-R263 PolarHBondContact O-NH1 2.95Å; Y224-R263 PolarHBondContact O-NH2 3.46Å; W255-R263 HydrophobicContact CE3-CB 4.47Å; W255-R263 HydrophobicContact CH2-CB 4.22Å; W255-R263 HydrophobicContact CH2-CG 3.78Å; W255-R263 HydrophobicContact CZ2-CG 4.39Å; W255-R263 HydrophobicContact CZ3-CB 3.82Å; W255-R263 HydrophobicContact CZ3-CG 3.85Å; W255-R263 WeakPolarHBondContact O-CD 3.24Å; W255-R263 PolarHBondContact O-NH1 3.28Å; V256-R263 HydrophobicContact CG1-CB 4.45Å; D259-R263 HydrophobicContact CB-CG 4.1Å; D259-R263 WeakPolarHBondContact O-CB 3.42Å; D259-R263 VanDerWaalsContact O-CG 3.3Å; D259-R263 WeakPolarHBondContact O-CG 3.43Å; D259-R263 PolarHBondContact O-N 2.99Å; D259-R263 VanDerWaalsContact O-N 3.1Å; D259-R263 IonicContact OD2-NE 2.74Å; R263-D265 VanDerWaalsContact C-N 3.26Å; R263-D265 PolarHBondContact O-N 2.76Å; R263-Y266 HydrophobicContact CB-CD2 4.45Å; R263-Y266 PolarHBondContact O-N 2.65Å; R263-Y266 VanDerWaalsContact O-N 3.08Å
264	R	71	Confident	77.3	Confident	112 Å²	112	66.7 Å²	66.7	42%	0.423	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-59.2	-35.7	-179.3	-172	178.3	-174.9	175.9	5.1	113.1	L260 Y266 L267 L293 S296	L260-R264 VanDerWaalsContact O-CB 3.31Å; L260-R264 WeakPolarHBondContact O-CB 3.26Å; R264-Y266 PolarHBondContact O-N 3.24Å; R264-L267 WeakPolarHBondContact O-CB 3.47Å; R264-L267 PolarHBondContact O-N 2.64Å; R264-L293 HydrophobicContact CG-CD2 4.47Å; R264-S296 PolarHBondContact NH2-OG 2.81Å
265	D	76.8	Confident	76.7	Confident	122 Å²	122	62.6 Å²	62.6	65%	0.652	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-69.1	-20.1	179.3	-71.8	-22.9	0	0	0	113.3	R263 P268	R263-D265 VanDerWaalsContact C-N 3.26Å; R263-D265 PolarHBondContact O-N 2.76Å; D265-P268 WeakPolarHBondContact O-CD 3.39Å
266	Y	77.8	Confident	75.7	Confident	95 Å²	95	62.5 Å²	62.5	37%	0.373	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-90.9	-12.7	-179.7	-53.6	-46.8	0	0	0	113.6	K228 G262 R263 R264 P268 E269 L270	K228-Y266 HydrophobicContact CD-CD1 3.46Å; K228-Y266 VanDerWaalsContact CD-CD1 3.46Å; K228-Y266 HydrophobicContact CD-CD2 4.29Å; K228-Y266 HydrophobicContact CD-CE1 3.88Å; K228-Y266 HydrophobicContact CD-CG 3.68Å; K228-Y266 VanDerWaalsContact CE-CD1 3.48Å; K228-Y266 HydrophobicContact CG-CD1 4.33Å; K228-Y266 HydrophobicContact CG-CD2 4.43Å; K228-Y266 HydrophobicContact CG-CG 4.05Å; G262-Y266 WeakPolarHBondContact O-CE2 3.45Å; R263-Y266 HydrophobicContact CB-CD2 4.45Å; R263-Y266 PolarHBondContact O-N 2.65Å; R263-Y266 VanDerWaalsContact O-N 3.08Å; R264-Y266 PolarHBondContact O-N 3.24Å; Y266-P268 VanDerWaalsContact C-CD 3.43Å; Y266-E269 PolarHBondContact O-N 2.92Å; Y266-L270 WeakPolarHBondContact O-CG 3.48Å; Y266-L270 PolarHBondContact O-N 3.31Å; Y266-L270 VanDerWaalsContact O-N 3.15Å
267	L	77.5	Confident	74.5	Confident	4 Å²	4	62.5 Å²	62.5	2%	0.021	29%	0.288	C	S	.	.	H	α-helix	trans	-54	-43.3	-178.5	-176.5	66.4	0	0	0	113.8	M253 V256 R264 E269 L270 L271 V294	M253-L267 HydrophobicContact SD-CD1 4.12Å; V256-L267 HydrophobicContact CG2-CD1 4.13Å; R264-L267 WeakPolarHBondContact O-CB 3.47Å; R264-L267 PolarHBondContact O-N 2.64Å; L267-E269 VanDerWaalsContact C-N 3.31Å; L267-E269 PolarHBondContact O-N 3.24Å; L267-L270 PolarHBondContact O-N 3.05Å; L267-L271 HydrophobicContact CD1-CD1 4.16Å; L267-L271 HydrophobicContact CD1-CG 4.07Å; L267-L271 HydrophobicContact CG-CD1 3.89Å; L267-L271 HydrophobicContact CG-CG 4.25Å; L267-L271 WeakPolarHBondContact O-CB 3.42Å; L267-L271 VanDerWaalsContact O-CG 3.25Å; L267-L271 WeakPolarHBondContact O-CG 3.35Å; L267-L271 PolarHBondContact O-N 3.45Å; L267-V294 HydrophobicContact CD2-CG2 4.13Å
268	P	75.1	Confident	73.4	Confident	10 Å²	10	59.9 Å²	59.9	7%	0.065	28%	0.283	C	S	.	.	H	α-helix	trans	-63	-36.3	-179.8	-19	30.1	0	0	0	113.4	D265 Y266 R272 D297 R299 S300 I303	D265-P268 WeakPolarHBondContact O-CD 3.39Å; Y266-P268 VanDerWaalsContact C-CD 3.43Å; P268-R272 PolarHBondContact O-N 3.13Å; P268-D297 WeakPolarHBondContact CG-OD2 3.21Å; P268-R299 HydrophobicContact CB-CB 4.15Å; P268-R299 HydrophobicContact CG-CB 4.34Å; P268-S300 WeakPolarHBondContact CG-OG 3.43Å; P268-I303 HydrophobicContact CB-CD1 4.43Å; P268-I303 WeakPolarHBondContact O-CD1 3.32Å
269	E	78.1	Confident	72.4	Confident	96 Å²	96	52.5 Å²	52.5	45%	0.449	25%	0.254	S	S	.	.	H	α-helix	trans	-73.7	-40.6	-179.8	-69.4	-179.4	-153.6	0	0	111.4	K228 Y266 L267 R272 G273	K228-E269 WeakPolarHBondContact CE-OE2 3.37Å; K228-E269 IonicContact NZ-OE1 2.83Å; K228-E269 IonicContact NZ-OE2 2.95Å; K228-E269 PolarHBondContact NZ-OE2 2.79Å; Y266-E269 PolarHBondContact O-N 2.92Å; L267-E269 VanDerWaalsContact C-N 3.31Å; L267-E269 PolarHBondContact O-N 3.24Å; E269-R272 PolarHBondContact O-N 3.39Å; E269-G273 PolarHBondContact O-N 3.25Å
270	L	79.6	Confident	71.2	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.5	-45.1	175.5	-65.6	170.7	0	0	0	111.2	L231 L232 I235 V252 W255 V256 Y266 L267 R272 G273 I274	L231-L270 HydrophobicContact CD2-CD1 4.28Å; L231-L270 HydrophobicContact CD2-CD2 4.05Å; L231-L270 HydrophobicContact CG-CD2 4.17Å; L232-L270 HydrophobicContact CB-CD2 4.44Å; L232-L270 HydrophobicContact CD1-CD2 4.14Å; I235-L270 HydrophobicContact CD1-CD2 3.94Å; V252-L270 HydrophobicContact CG1-CB 3.96Å; V252-L270 HydrophobicContact CG1-CD1 4.18Å; W255-L270 HydrophobicContact CE3-CD1 4Å; W255-L270 HydrophobicContact CZ3-CD1 3.72Å; V256-L270 HydrophobicContact CG2-CD1 4.29Å; Y266-L270 WeakPolarHBondContact O-CG 3.48Å; Y266-L270 PolarHBondContact O-N 3.31Å; Y266-L270 VanDerWaalsContact O-N 3.15Å; L267-L270 PolarHBondContact O-N 3.05Å; L270-R272 PolarHBondContact O-N 3.18Å; L270-G273 PolarHBondContact O-N 3.15Å; L270-I274 WeakPolarHBondContact O-CG1 3.43Å; L270-I274 PolarHBondContact O-N 2.86Å
271	L	75.1	Confident	70.4	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-59.9	-32.8	177	-74.5	174.5	0	0	0	112.8	F249 L267 G273 I274 L276 V294 I303	F249-L271 HydrophobicContact CD2-CD2 4.34Å; F249-L271 HydrophobicContact CE2-CD2 3.92Å; L267-L271 HydrophobicContact CD1-CD1 4.16Å; L267-L271 HydrophobicContact CD1-CG 4.07Å; L267-L271 HydrophobicContact CG-CD1 3.89Å; L267-L271 HydrophobicContact CG-CG 4.25Å; L267-L271 WeakPolarHBondContact O-CB 3.42Å; L267-L271 VanDerWaalsContact O-CG 3.25Å; L267-L271 WeakPolarHBondContact O-CG 3.35Å; L267-L271 PolarHBondContact O-N 3.45Å; L271-G273 VanDerWaalsContact C-N 3.29Å; L271-G273 PolarHBondContact O-N 3.39Å; L271-I274 HydrophobicContact CD2-CD1 4.28Å; L271-I274 PolarHBondContact O-N 3.25Å; L271-L276 HydrophobicContact CB-CD1 4.5Å; L271-L276 HydrophobicContact CD2-CD2 4.43Å; L271-V294 HydrophobicContact CD1-CG1 4.38Å; L271-I303 HydrophobicContact CB-CG2 4.49Å
272	R	73.4	Confident	69.7	Low	197 Å²	197	51 Å²	51	74%	0.743	25%	0.249	S	C	*	.	H	α-helix	trans	-70.3	-26.2	175.8	-174.2	174.2	160.3	144	-3.8	112.8	P268 E269 L270 I303	P268-R272 PolarHBondContact O-N 3.13Å; E269-R272 PolarHBondContact O-N 3.39Å; L270-R272 PolarHBondContact O-N 3.18Å; R272-I303 HydrophobicContact CB-CD1 4.31Å
273	G	66.4	Low	68.7	Low	7 Å²	7	49.7 Å²	49.7	7%	0.072	24%	0.235	C	C	.	.	H	α-helix	trans	-76.3	-23.2	173.3	0	0	0	0	0	113.6	I235 E269 L270 L271 R329	I235-G273 VanDerWaalsContact CG2-C 3.47Å; E269-G273 PolarHBondContact O-N 3.25Å; L270-G273 PolarHBondContact O-N 3.15Å; L271-G273 VanDerWaalsContact C-N 3.29Å; L271-G273 PolarHBondContact O-N 3.39Å; G273-R329 PolarHBondContact O-NH2 3.24Å
274	I	72.3	Confident	67.7	Low	1 Å²	1	48.4 Å²	48.4	1%	0.005	23%	0.23	C	C	.	.	S	Bend	trans	-80.7	137.3	179.3	-56.8	171.7	0	0	0	109.9	I235 E245 V248 F249 V252 L270 L271 L276	I235-I274 HydrophobicContact CG2-CG1 3.9Å; E245-I274 HydrophobicContact CG-CG2 3.78Å; V248-I274 HydrophobicContact CG1-CG1 4.16Å; F249-I274 HydrophobicContact CD2-CD1 4.19Å; V252-I274 HydrophobicContact CB-CD1 4.06Å; V252-I274 HydrophobicContact CG1-CD1 4.19Å; V252-I274 HydrophobicContact CG2-CD1 3.96Å; L270-I274 WeakPolarHBondContact O-CG1 3.43Å; L270-I274 PolarHBondContact O-N 2.86Å; L271-I274 HydrophobicContact CD2-CD1 4.28Å; L271-I274 PolarHBondContact O-N 3.25Å; I274-L276 HydrophobicContact CB-CD2 4.15Å; I274-L276 HydrophobicContact CB-CG 4.26Å; I274-L276 HydrophobicContact CG2-CD2 3.81Å; I274-L276 HydrophobicContact CG2-CG 4.22Å; I274-L276 PolarHBondContact O-N 3.4Å
275	R	69.8	Low	67.1	Low	13 Å²	13	48.1 Å²	48.1	5%	0.049	24%	0.236	C	C	.	.			trans	-79.7	64.9	175.1	-65.3	129.6	-161.1	-124.4	12.6	111.7	D238 E245 A277 L278 P324 C325 R327 P328 R329	D238-R275 IonicContact OD1-CZ 3.88Å; D238-R275 IonicContact OD1-NH1 2.82Å; D238-R275 PolarHBondContact OD1-NH1 3.13Å; D238-R275 IonicContact OD1-NH2 3.74Å; D238-R275 PolarHBondContact OD1-NH2 2.97Å; E245-R275 HydrophobicContact CG-CB 4.13Å; E245-R275 PolarHBondContact OE1-N 3.27Å; R275-A277 PolarHBondContact O-N 3.11Å; R275-L278 HydrophobicContact CB-CD1 3.83Å; R275-L278 HydrophobicContact CB-CG 4.27Å; R275-L278 HydrophobicContact CG-CD1 4.47Å; R275-L278 WeakPolarHBondContact O-CB 3.21Å; R275-L278 PolarHBondContact O-N 3.15Å; R275-P324 VanDerWaalsContact CG-O 3.32Å; R275-P324 WeakPolarHBondContact CG-O 3.19Å; R275-C325 CarbonylContact C-O 3.28Å; R275-C325 VanDerWaalsContact C-O 3.25Å; R275-C325 WeakPolarHBondContact CA-O 3.45Å; R275-C325 WeakPolarHBondContact CB-O 3.38Å; R275-R327 WeakPolarHBondContact CD-O 3.5Å; R275-R327 VanDerWaalsContact CG-O 3.26Å; R275-R327 WeakPolarHBondContact CG-O 3.44Å; R275-R327 PolarHBondContact NE-O 2.7Å; R275-R327 PolarHBondContact NH1-O 2.79Å; R275-P328 PolarHBondContact NH1-O 3.27Å; R275-P328 VanDerWaalsContact NH1-O 3.11Å; R275-R329 VanDerWaalsContact NE-CG 3.33Å
276	L	65.4	Low	66.1	Low	4 Å²	4	47.4 Å²	47.4	2%	0.021	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-54.3	-26.4	-174.7	-65.1	172.5	0	0	0	113.9	F249 L271 I274 L278 L279 L284 I303 V304 A307	F249-L276 HydrophobicContact CD2-CD2 4.07Å; F249-L276 HydrophobicContact CE2-CD2 4.43Å; L271-L276 HydrophobicContact CB-CD1 4.5Å; L271-L276 HydrophobicContact CD2-CD2 4.43Å; I274-L276 HydrophobicContact CB-CD2 4.15Å; I274-L276 HydrophobicContact CB-CG 4.26Å; I274-L276 HydrophobicContact CG2-CD2 3.81Å; I274-L276 HydrophobicContact CG2-CG 4.22Å; I274-L276 PolarHBondContact O-N 3.4Å; L276-L278 PolarHBondContact O-N 2.78Å; L276-L279 HydrophobicContact CB-CD1 4.43Å; L276-L279 HydrophobicContact CD2-CD1 3.63Å; L276-L279 PolarHBondContact O-N 3.47Å; L276-L284 WeakPolarHBondContact O-CD1 3.39Å; L276-I303 HydrophobicContact CD1-CG2 3.82Å; L276-V304 HydrophobicContact CD1-CG2 4.46Å; L276-A307 HydrophobicContact CB-CB 3.55Å; L276-A307 HydrophobicContact CD1-CB 4.25Å
277	A	56.8	Low	65	Low	4 Å²	4	43.3 Å²	43.3	3%	0.033	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-72.8	-14.3	179.5	0	0	0	0	0	113.5	R275 C310 I314 C325 A326	R275-A277 PolarHBondContact O-N 3.11Å; A277-C310 HydrophobicContact CB-CB 4.13Å; A277-I314 HydrophobicContact CB-CD1 4.06Å; A277-C325 WeakPolarHBondContact CB-O 3.36Å; A277-C325 PolarHBondContact N-O 3.23Å; A277-C325 VanDerWaalsContact N-O 3.15Å; A277-A326 HydrophobicContact CB-CB 4.11Å
278	L	58	Low	63.9	Low	72 Å²	72	45.8 Å²	45.8	38%	0.377	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-92.7	-8.3	177.3	-62.1	175.1	0	0	0	113.6	R275 L276 P328	R275-L278 HydrophobicContact CB-CD1 3.83Å; R275-L278 HydrophobicContact CB-CG 4.27Å; R275-L278 HydrophobicContact CG-CD1 4.47Å; R275-L278 WeakPolarHBondContact O-CB 3.21Å; R275-L278 PolarHBondContact O-N 3.15Å; L276-L278 PolarHBondContact O-N 2.78Å; L278-P328 HydrophobicContact CD1-CB 4.3Å; L278-P328 HydrophobicContact CD1-CG 4.31Å
279	L	61.3	Low	62.7	Low	4 Å²	4	49 Å²	49	2%	0.021	26%	0.257	C	S	.	.	S	Bend	trans	-63.9	150.7	178.9	-71.4	171.6	0	0	0	111.8	E245 Q246 F249 L276 L284 K311	E245-L279 VanDerWaalsContact C-CD2 3.46Å; E245-L279 HydrophobicContact CB-CD2 4.04Å; Q246-L279 VanDerWaalsContact CA-CD2 3.46Å; Q246-L279 HydrophobicContact CB-CD2 4.09Å; F249-L279 HydrophobicContact CB-CD2 4.26Å; F249-L279 HydrophobicContact CG-CD1 4.49Å; L276-L279 HydrophobicContact CB-CD1 4.43Å; L276-L279 HydrophobicContact CD2-CD1 3.63Å; L276-L279 PolarHBondContact O-N 3.47Å; L279-L284 HydrophobicContact CB-CD1 4.08Å; L279-L284 HydrophobicContact CB-CG 4.15Å; L279-L284 HydrophobicContact CD1-CG 4.35Å; L279-K311 WeakPolarHBondContact O-CE 3.37Å; L279-K311 PolarHBondContact O-NZ 3.41Å
280	P	55.8	Low	61.4	Low	52 Å²	52	48.4 Å²	48.4	34%	0.338	26%	0.262	S	S	.	.			trans	-58.3	152.7	168.9	-24.5	34	0	0	0	113.3	E282 C283 L284 K311	P280-E282 VanDerWaalsContact C-N 3.26Å; P280-E282 PolarHBondContact O-N 3.04Å; P280-C283 HydrophobicContact CB-CB 4.35Å; P280-C283 PolarHBondContact O-N 3.23Å; P280-L284 PolarHBondContact O-N 2.63Å; P280-K311 PolarHBondContact O-NZ 3.3Å
281	S	58	Low	60.1	Low	58 Å²	58	49.8 Å²	49.8	41%	0.406	27%	0.269	S	S	.	.	H	α-helix	trans	-67	-30.6	-174.3	-60.9	0	0	0	0	112.7	I285 K311	S281-I285 WeakPolarHBondContact O-CD1 3.37Å; S281-I285 VanDerWaalsContact O-CG1 3.24Å; S281-I285 WeakPolarHBondContact O-CG1 3.41Å; S281-I285 PolarHBondContact O-N 3.28Å; S281-K311 VanDerWaalsContact OG-CE 3.23Å; S281-K311 WeakPolarHBondContact OG-CE 3.29Å; S281-K311 PolarHBondContact OG-NZ 3.47Å
282	E	57.2	Low	59.1	Low	156 Å²	156	58.3 Å²	58.3	73%	0.729	31%	0.309	S	S	*	.	H	α-helix	trans	-68.6	-48.8	175.2	-62.3	173.8	-175.6	0	0	110.5	P280 L284 I285 E286	P280-E282 VanDerWaalsContact C-N 3.26Å; P280-E282 PolarHBondContact O-N 3.04Å; E282-L284 VanDerWaalsContact C-N 3.33Å; E282-L284 PolarHBondContact O-N 2.74Å; E282-I285 PolarHBondContact O-N 2.7Å; E282-E286 WeakPolarHBondContact O-CB 3.37Å; E282-E286 WeakPolarHBondContact O-CG 3.46Å; E282-E286 PolarHBondContact O-N 2.56Å
283	C	56.3	Low	58.3	Low	5 Å²	5	50.7 Å²	50.7	3%	0.034	28%	0.283	C	S	.	.	H	α-helix	trans	-66.1	-30.5	178.4	-172.2	0	0	0	0	113.3	Q246 P280 E286 A287	Q246-C283 HydrophobicContact CG-CB 4.46Å; P280-C283 HydrophobicContact CB-CB 4.35Å; P280-C283 PolarHBondContact O-N 3.23Å; C283-E286 CarbonylContact O-C 3.56Å; C283-A287 WeakPolarHBondContact O-CB 2.87Å; C283-A287 PolarHBondContact O-N 3.21Å
284	L	60	Low	57.9	Low	3 Å²	3	50.6 Å²	50.6	2%	0.016	28%	0.281	C	S	.	.	H	α-helix	trans	-71.5	-36.8	173.7	-113.2	158.7	0	0	0	112.4	L276 L279 P280 E282 A287 V288 V304 M308 K311	L276-L284 WeakPolarHBondContact O-CD1 3.39Å; L279-L284 HydrophobicContact CB-CD1 4.08Å; L279-L284 HydrophobicContact CB-CG 4.15Å; L279-L284 HydrophobicContact CD1-CG 4.35Å; P280-L284 PolarHBondContact O-N 2.63Å; E282-L284 VanDerWaalsContact C-N 3.33Å; E282-L284 PolarHBondContact O-N 2.74Å; L284-A287 PolarHBondContact O-N 2.95Å; L284-V288 WeakPolarHBondContact O-CB 3.34Å; L284-V288 WeakPolarHBondContact O-CG2 3.5Å; L284-V288 PolarHBondContact O-N 3.5Å; L284-V288 VanDerWaalsContact O-N 3.08Å; L284-V304 HydrophobicContact CD2-CG1 4.35Å; L284-M308 HydrophobicContact CB-SD 4.17Å; L284-M308 HydrophobicContact CD1-SD 4.3Å; L284-M308 HydrophobicContact CD2-CG 3.87Å; L284-M308 HydrophobicContact CD2-SD 3.72Å; L284-M308 HydrophobicContact CG-SD 4.29Å; L284-K311 HydrophobicContact CD1-CD 3.34Å
285	I	57.7	Low	57	Low	106 Å²	106	54.5 Å²	54.5	54%	0.544	30%	0.3	S	S	.	.	H	α-helix	trans	-70.3	-40.1	173.5	-67.2	165.6	0	0	0	109.7	S281 E282 V288 A289	S281-I285 WeakPolarHBondContact O-CD1 3.37Å; S281-I285 VanDerWaalsContact O-CG1 3.24Å; S281-I285 WeakPolarHBondContact O-CG1 3.41Å; S281-I285 PolarHBondContact O-N 3.28Å; E282-I285 PolarHBondContact O-N 2.7Å; I285-V288 CarbonylContact O-C 3.51Å; I285-V288 PolarHBondContact O-N 2.82Å; I285-A289 WeakPolarHBondContact O-CB 3.28Å; I285-A289 PolarHBondContact O-N 2.9Å
286	E	56.2	Low	56.5	Low	107 Å²	107	56.7 Å²	56.7	50%	0.5	32%	0.317	S	S	.	.	H	α-helix	trans	-64.1	-40.9	170.8	-73.4	178.9	169	0	0	111.8	E282 C283 V288 A289 C290	E282-E286 WeakPolarHBondContact O-CB 3.37Å; E282-E286 WeakPolarHBondContact O-CG 3.46Å; E282-E286 PolarHBondContact O-N 2.56Å; C283-E286 CarbonylContact O-C 3.56Å; E286-V288 PolarHBondContact O-N 3.06Å; E286-A289 CarbonylContact O-C 3.55Å; E286-A289 PolarHBondContact O-N 2.82Å; E286-A289 VanDerWaalsContact O-N 3.15Å; E286-C290 WeakPolarHBondContact O-CA 3.38Å; E286-C290 WeakPolarHBondContact O-CB 3.28Å; E286-C290 PolarHBondContact O-N 3.1Å; E286-C290 PolarHBondContact O-SG 3.2Å; E286-C290 VanDerWaalsContact O-SG 3.33Å
287	A	55	Low	56.6	Low	9 Å²	9	58.5 Å²	58.5	7%	0.074	33%	0.327	C	S	.	.	H	α-helix	trans	-62.6	-32.4	175.2	0	0	0	0	0	112.4	F249 C283 L284	F249-A287 HydrophobicContact CE1-CB 3.79Å; F249-A287 HydrophobicContact CE2-CB 4.08Å; F249-A287 HydrophobicContact CZ-CB 3.4Å; F249-A287 VanDerWaalsContact CZ-CB 3.4Å; C283-A287 WeakPolarHBondContact O-CB 2.87Å; C283-A287 PolarHBondContact O-N 3.21Å; L284-A287 PolarHBondContact O-N 2.95Å
288	V	54.9	Low	57.1	Low	56 Å²	56	66.2 Å²	66.2	34%	0.339	36%	0.36	S	S	.	.	H	α-helix	trans	-79.3	-34	173.8	172.5	0	0	0	0	112	L284 I285 E286 V304	L284-V288 WeakPolarHBondContact O-CB 3.34Å; L284-V288 WeakPolarHBondContact O-CG2 3.5Å; L284-V288 PolarHBondContact O-N 3.5Å; L284-V288 VanDerWaalsContact O-N 3.08Å; I285-V288 CarbonylContact O-C 3.51Å; I285-V288 PolarHBondContact O-N 2.82Å; E286-V288 PolarHBondContact O-N 3.06Å; V288-V304 HydrophobicContact CG2-CG1 3.48Å; V288-V304 VanDerWaalsContact CG2-CG1 3.48Å
289	A	49.2	Very low	57.6	Low	78 Å²	78	70.4 Å²	70.4	65%	0.645	37%	0.371	S	S	*	.	H	α-helix	trans	-92	-26.4	-174.3	0	0	0	0	0	114	I285 E286	I285-A289 WeakPolarHBondContact O-CB 3.28Å; I285-A289 PolarHBondContact O-N 2.9Å; E286-A289 CarbonylContact O-C 3.55Å; E286-A289 PolarHBondContact O-N 2.82Å; E286-A289 VanDerWaalsContact O-N 3.15Å
290	C	50	Low	57.9	Low	83 Å²	83	70.2 Å²	70.2	56%	0.561	37%	0.37	S	S	*	.	S	Bend	trans	-82.6	-21.9	-166.8	-82.1	0	0	0	0	114	E286	E286-C290 WeakPolarHBondContact O-CA 3.38Å; E286-C290 WeakPolarHBondContact O-CB 3.28Å; E286-C290 PolarHBondContact O-N 3.1Å; E286-C290 PolarHBondContact O-SG 3.2Å; E286-C290 VanDerWaalsContact O-SG 3.33Å
291	E	53.9	Low	58.5	Low	30 Å²	30	73 Å²	73	14%	0.14	37%	0.373	C	S	.	.			trans	-145.3	118.8	-177.6	-68.5	-164.3	165.4	0	0	115.8	M253 R257 L293 V294 M295	M253-E291 HydrophobicContact CE-CG 4.5Å; M253-E291 WeakPolarHBondContact CE-OE2 3.26Å; R257-E291 IonicContact CZ-OE1 3.76Å; R257-E291 IonicContact NE-OE1 2.85Å; R257-E291 PolarHBondContact NE-OE1 2.88Å; R257-E291 IonicContact NH2-OE1 2.72Å; R257-E291 PolarHBondContact NH2-OE1 3.34Å; E291-L293 HydrophobicContact CB-CB 4.15Å; E291-L293 PolarHBondContact O-N 2.84Å; E291-L293 WeakPolarHBondContact OE2-CD1 3.46Å; E291-V294 PolarHBondContact O-N 3.31Å; E291-V294 VanDerWaalsContact O-N 3.13Å; E291-M295 PolarHBondContact O-N 3.37Å
292	E	53.4	Low	59	Low	180 Å²	180	75.4 Å²	75.4	84%	0.841	38%	0.378	S	S	*	.	H	α-helix	trans	-48.4	-19	162.9	-64.5	-177.6	156.3	0	0	113	S296	E292-S296 WeakPolarHBondContact O-CB 2.98Å; E292-S296 PolarHBondContact O-N 2.65Å; E292-S296 PolarHBondContact O-OG 2.94Å
293	L	56.4	Low	59.5	Low	37 Å²	37	69.7 Å²	69.7	19%	0.194	35%	0.352	C	S	.	.	H	α-helix	trans	-68.3	-49.7	175.6	-69.2	162.3	0	0	0	113.3	L260 R264 E291 M295 S296	L260-L293 HydrophobicContact CD2-CD1 3.6Å; L260-L293 HydrophobicContact CD2-CD2 4.4Å; R264-L293 HydrophobicContact CG-CD2 4.47Å; E291-L293 HydrophobicContact CB-CB 4.15Å; E291-L293 PolarHBondContact O-N 2.84Å; E291-L293 WeakPolarHBondContact OE2-CD1 3.46Å; L293-M295 VanDerWaalsContact C-N 3.31Å; L293-M295 PolarHBondContact O-N 2.64Å; L293-S296 PolarHBondContact O-N 3.11Å; L293-S296 PolarHBondContact O-OG 2.85Å
294	V	57.6	Low	60.1	Low	5 Å²	5	70.1 Å²	70.1	3%	0.03	36%	0.355	C	S	.	.	H	α-helix	trans	-68.1	-37.4	178.1	-179.3	0	0	0	0	110.2	M253 L267 L271 E291 S296 V304	M253-V294 HydrophobicContact CE-CG2 4.26Å; L267-V294 HydrophobicContact CD2-CG2 4.13Å; L271-V294 HydrophobicContact CD1-CG1 4.38Å; E291-V294 PolarHBondContact O-N 3.31Å; E291-V294 VanDerWaalsContact O-N 3.13Å; V294-S296 VanDerWaalsContact C-N 3.34Å; V294-V304 HydrophobicContact CG1-CG2 4.06Å
295	M	53.9	Low	60.4	Low	82 Å²	82	76.1 Å²	76.1	40%	0.404	38%	0.382	S	S	.	.	H	α-helix	trans	-75.3	-19.8	178.1	-72.6	-68.4	-83.9	0	0	112.9	E291 L293 R301	E291-M295 PolarHBondContact O-N 3.37Å; L293-M295 VanDerWaalsContact C-N 3.31Å; L293-M295 PolarHBondContact O-N 2.64Å; M295-R301 PolarHBondContact O-NH2 3.39Å; M295-R301 HydrophobicContact SD-CG 4.2Å
296	S	59.7	Low	60.8	Low	59 Å²	59	75.7 Å²	75.7	41%	0.413	38%	0.378	S	S	.	.	H	α-helix	trans	-72.3	-34.9	178.7	66	0	0	0	0	113.8	R264 E292 L293 V294	R264-S296 PolarHBondContact NH2-OG 2.81Å; E292-S296 WeakPolarHBondContact O-CB 2.98Å; E292-S296 PolarHBondContact O-N 2.65Å; E292-S296 PolarHBondContact O-OG 2.94Å; L293-S296 PolarHBondContact O-N 3.11Å; L293-S296 PolarHBondContact O-OG 2.85Å; V294-S296 VanDerWaalsContact C-N 3.34Å
297	D	66.6	Low	61.2	Low	43 Å²	43	70.7 Å²	70.7	23%	0.23	36%	0.355	C	S	.	.	S	Bend	trans	-92.6	128.4	179.5	-169.7	4.7	0	0	0	111.3	P268 R299 R301	P268-D297 WeakPolarHBondContact CG-OD2 3.21Å; D297-R299 PolarHBondContact O-N 2.92Å; D297-R299 PolarHBondContact OD1-N 2.94Å; D297-R299 IonicContact OD2-NE 3.9Å; D297-R301 PolarHBondContact O-N 2.84Å
298	K	68.6	Low	61.6	Low	166 Å²	166	73.9 Å²	73.9	72%	0.722	37%	0.369	S	S	*	.	H	α-helix	trans	-62.9	-31.6	179.8	-167.8	177.6	179.1	-177.5	0	111.9	Q302	K298-Q302 PolarHBondContact O-N 3.28Å
299	R	68.1	Low	62	Low	160 Å²	160	76.6 Å²	76.6	60%	0.604	38%	0.379	S	S	*	.	H	α-helix	trans	-73.5	-47.4	-178.7	-72	-179.3	-78.3	-178.6	-4.7	112.3	P268 D297 R301 Q302 I303	P268-R299 HydrophobicContact CB-CB 4.15Å; P268-R299 HydrophobicContact CG-CB 4.34Å; D297-R299 PolarHBondContact O-N 2.92Å; D297-R299 PolarHBondContact OD1-N 2.94Å; D297-R299 IonicContact OD2-NE 3.9Å; R299-R301 VanDerWaalsContact C-N 3.32Å; R299-R301 PolarHBondContact O-N 3.5Å; R299-Q302 PolarHBondContact O-N 3.3Å; R299-I303 WeakPolarHBondContact O-CG1 3.47Å; R299-I303 PolarHBondContact O-N 3.15Å
300	S	66.4	Low	62.4	Low	0 Å²	0	73.8 Å²	73.8	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-60.7	-41.5	175.5	-59.1	0	0	0	0	111.9	P268 Q302 I303 V304	P268-S300 WeakPolarHBondContact CG-OG 3.43Å; S300-Q302 VanDerWaalsContact C-N 3.34Å; S300-Q302 PolarHBondContact O-N 2.96Å; S300-I303 PolarHBondContact O-N 2.9Å; S300-V304 WeakPolarHBondContact O-CG2 3.43Å; S300-V304 PolarHBondContact O-N 3.3Å; S300-V304 VanDerWaalsContact O-N 3.09Å
301	R	68.4	Low	62.5	Low	109 Å²	109	70.6 Å²	70.6	41%	0.411	33%	0.331	S	S	.	.	H	α-helix	trans	-59.1	-44	176	-168	-173.1	-62.1	153.7	-5.2	112.4	M295 D297 R299 I303 V304 E305	M295-R301 PolarHBondContact O-NH2 3.39Å; M295-R301 HydrophobicContact SD-CG 4.2Å; D297-R301 PolarHBondContact O-N 2.84Å; R299-R301 VanDerWaalsContact C-N 3.32Å; R299-R301 PolarHBondContact O-N 3.5Å; R301-I303 VanDerWaalsContact C-N 3.34Å; R301-I303 PolarHBondContact O-N 3Å; R301-V304 PolarHBondContact O-N 2.87Å; R301-E305 WeakPolarHBondContact O-CB 3.01Å; R301-E305 PolarHBondContact O-N 2.93Å
302	Q	69.2	Low	62.5	Low	109 Å²	109	75.1 Å²	75.1	51%	0.509	35%	0.35	S	S	.	.	H	α-helix	trans	-64	-39.9	179.4	-171.2	178.8	-17.3	0	0	111.8	K298 R299 S300 E305 E306	K298-Q302 PolarHBondContact O-N 3.28Å; R299-Q302 PolarHBondContact O-N 3.3Å; S300-Q302 VanDerWaalsContact C-N 3.34Å; S300-Q302 PolarHBondContact O-N 2.96Å; Q302-E305 PolarHBondContact O-N 3.32Å; Q302-E306 WeakPolarHBondContact CG-OE1 3.35Å; Q302-E306 PolarHBondContact NE2-OE1 3.28Å; Q302-E306 WeakPolarHBondContact O-CB 3.33Å; Q302-E306 VanDerWaalsContact O-CG 3.26Å; Q302-E306 WeakPolarHBondContact O-CG 3.37Å; Q302-E306 PolarHBondContact O-N 3.07Å
303	I	68.5	Low	62.3	Low	37 Å²	37	70.9 Å²	70.9	19%	0.19	33%	0.328	C	S	.	.	H	α-helix	trans	-64.7	-41.8	177.9	-66	165.5	0	0	0	111.3	P268 L271 R272 L276 R299 S300 R301 A307	P268-I303 HydrophobicContact CB-CD1 4.43Å; P268-I303 WeakPolarHBondContact O-CD1 3.32Å; L271-I303 HydrophobicContact CB-CG2 4.49Å; R272-I303 HydrophobicContact CB-CD1 4.31Å; L276-I303 HydrophobicContact CD1-CG2 3.82Å; R299-I303 WeakPolarHBondContact O-CG1 3.47Å; R299-I303 PolarHBondContact O-N 3.15Å; S300-I303 PolarHBondContact O-N 2.9Å; R301-I303 VanDerWaalsContact C-N 3.34Å; R301-I303 PolarHBondContact O-N 3Å; I303-A307 WeakPolarHBondContact O-CB 3.4Å; I303-A307 PolarHBondContact O-N 2.94Å
304	V	68.2	Low	61.8	Low	13 Å²	13	72.6 Å²	72.6	8%	0.079	34%	0.337	C	S	.	.	H	α-helix	trans	-69.7	-38.1	178.1	177.5	0	0	0	0	111.4	L276 L284 V288 V294 S300 R301 A307 M308	L276-V304 HydrophobicContact CD1-CG2 4.46Å; L284-V304 HydrophobicContact CD2-CG1 4.35Å; V288-V304 HydrophobicContact CG2-CG1 3.48Å; V288-V304 VanDerWaalsContact CG2-CG1 3.48Å; V294-V304 HydrophobicContact CG1-CG2 4.06Å; S300-V304 WeakPolarHBondContact O-CG2 3.43Å; S300-V304 PolarHBondContact O-N 3.3Å; S300-V304 VanDerWaalsContact O-N 3.09Å; R301-V304 PolarHBondContact O-N 2.87Å; V304-A307 PolarHBondContact O-N 2.95Å; V304-M308 WeakPolarHBondContact O-CB 3.32Å; V304-M308 WeakPolarHBondContact O-CG 3.26Å; V304-M308 PolarHBondContact O-N 2.87Å
305	E	66.4	Low	61	Low	129 Å²	129	77.9 Å²	77.9	60%	0.603	37%	0.365	S	S	*	.	H	α-helix	trans	-67	-41	175.5	-168.2	168.4	-165	0	0	111.8	R301 Q302 A307 M308 Q309	R301-E305 WeakPolarHBondContact O-CB 3.01Å; R301-E305 PolarHBondContact O-N 2.93Å; Q302-E305 PolarHBondContact O-N 3.32Å; E305-A307 VanDerWaalsContact C-N 3.35Å; E305-M308 PolarHBondContact O-N 3.4Å; E305-Q309 WeakPolarHBondContact O-CB 3.32Å; E305-Q309 PolarHBondContact O-N 3.32Å
306	E	67.1	Low	60.3	Low	97 Å²	97	79.4 Å²	79.4	45%	0.453	37%	0.371	S	S	.	.	H	α-helix	trans	-61.1	-42.1	171.1	-76.2	174.1	-164.9	0	0	111.4	Q302 Q309 C310	Q302-E306 WeakPolarHBondContact CG-OE1 3.35Å; Q302-E306 PolarHBondContact NE2-OE1 3.28Å; Q302-E306 WeakPolarHBondContact O-CB 3.33Å; Q302-E306 VanDerWaalsContact O-CG 3.26Å; Q302-E306 WeakPolarHBondContact O-CG 3.37Å; Q302-E306 PolarHBondContact O-N 3.07Å; E306-Q309 PolarHBondContact O-N 3.48Å; E306-C310 WeakPolarHBondContact O-CB 3.4Å; E306-C310 PolarHBondContact O-N 3.17Å; E306-C310 PolarHBondContact O-SG 3.11Å
307	A	63.5	Low	59.4	Low	2 Å²	2	80.4 Å²	80.4	2%	0.017	37%	0.372	C	S	.	.	H	α-helix	trans	-65.6	-41.3	175.7	0	0	0	0	0	112.5	L276 I303 V304 E305 C310 K311	L276-A307 HydrophobicContact CB-CB 3.55Å; L276-A307 HydrophobicContact CD1-CB 4.25Å; I303-A307 WeakPolarHBondContact O-CB 3.4Å; I303-A307 PolarHBondContact O-N 2.94Å; V304-A307 PolarHBondContact O-N 2.95Å; E305-A307 VanDerWaalsContact C-N 3.35Å; A307-C310 WeakPolarHBondContact O-CB 3.29Å; A307-C310 PolarHBondContact O-N 3.32Å; A307-K311 WeakPolarHBondContact O-CB 3.49Å; A307-K311 PolarHBondContact O-N 3.29Å
308	M	63.7	Low	57.7	Low	76 Å²	76	83.6 Å²	83.6	37%	0.374	39%	0.389	S	S	.	.	H	α-helix	trans	-62.9	-41.1	173.9	-79.6	-72.1	-99.3	0	0	111.8	L284 V304 E305 K311 K312	L284-M308 HydrophobicContact CB-SD 4.17Å; L284-M308 HydrophobicContact CD1-SD 4.3Å; L284-M308 HydrophobicContact CD2-CG 3.87Å; L284-M308 HydrophobicContact CD2-SD 3.72Å; L284-M308 HydrophobicContact CG-SD 4.29Å; V304-M308 WeakPolarHBondContact O-CB 3.32Å; V304-M308 WeakPolarHBondContact O-CG 3.26Å; V304-M308 PolarHBondContact O-N 2.87Å; E305-M308 PolarHBondContact O-N 3.4Å; M308-K311 PolarHBondContact O-N 2.99Å; M308-K312 VanDerWaalsContact O-CB 3.27Å; M308-K312 WeakPolarHBondContact O-CB 3.4Å; M308-K312 PolarHBondContact O-N 2.74Å
309	Q	62.3	Low	56.1	Low	114 Å²	114	77.3 Å²	77.3	53%	0.533	37%	0.371	S	S	.	.	H	α-helix	trans	-68.5	-39.1	176.3	-165	170.5	13.8	0	0	111.4	E305 E306 K312 K313	E305-Q309 WeakPolarHBondContact O-CB 3.32Å; E305-Q309 PolarHBondContact O-N 3.32Å; E306-Q309 PolarHBondContact O-N 3.48Å; Q309-K312 PolarHBondContact O-N 2.76Å; Q309-K313 WeakPolarHBondContact O-CB 3.26Å; Q309-K313 VanDerWaalsContact O-CG 3.23Å; Q309-K313 WeakPolarHBondContact O-CG 2.98Å; Q309-K313 PolarHBondContact O-N 3.49Å
310	C	57.5	Low	54.6	Low	19 Å²	19	73.8 Å²	73.8	13%	0.128	37%	0.367	C	S	.	.	H	α-helix	trans	-62.6	-44.6	172.3	-72.4	0	0	0	0	111.6	A277 E306 A307 K313 I314 V321	A277-C310 HydrophobicContact CB-CB 4.13Å; E306-C310 WeakPolarHBondContact O-CB 3.4Å; E306-C310 PolarHBondContact O-N 3.17Å; E306-C310 PolarHBondContact O-SG 3.11Å; A307-C310 WeakPolarHBondContact O-CB 3.29Å; A307-C310 PolarHBondContact O-N 3.32Å; C310-K313 WeakPolarHBondContact O-CB 3.47Å; C310-K313 PolarHBondContact O-N 2.95Å; C310-I314 VanDerWaalsContact O-CG1 3.26Å; C310-I314 WeakPolarHBondContact O-CG1 3.49Å; C310-I314 PolarHBondContact O-N 2.83Å; C310-V321 HydrophobicContact CB-CB 4.5Å; C310-V321 HydrophobicContact CB-CG1 3.77Å; C310-V321 HydrophobicContact CB-CG2 3.86Å; C310-V321 VanDerWaalsContact SG-CG1 3.59Å
311	K	53.2	Low	53.2	Low	16 Å²	16	75.1 Å²	75.1	7%	0.07	38%	0.375	C	S	.	.	H	α-helix	trans	-67.2	-39.5	177.3	-174.7	173.6	177.3	177.7	0	112.8	L279 P280 S281 L284 A307 M308 K313 I314 L315	L279-K311 WeakPolarHBondContact O-CE 3.37Å; L279-K311 PolarHBondContact O-NZ 3.41Å; P280-K311 PolarHBondContact O-NZ 3.3Å; S281-K311 VanDerWaalsContact OG-CE 3.23Å; S281-K311 WeakPolarHBondContact OG-CE 3.29Å; S281-K311 PolarHBondContact OG-NZ 3.47Å; L284-K311 HydrophobicContact CD1-CD 3.34Å; A307-K311 WeakPolarHBondContact O-CB 3.49Å; A307-K311 PolarHBondContact O-N 3.29Å; M308-K311 PolarHBondContact O-N 2.99Å; K311-K313 VanDerWaalsContact C-N 3.28Å; K311-K313 PolarHBondContact O-N 3.46Å; K311-I314 CarbonylContact O-C 3.51Å; K311-I314 WeakPolarHBondContact O-CB 3.39Å; K311-I314 PolarHBondContact O-N 3.19Å; K311-I314 VanDerWaalsContact O-N 3.15Å; K311-L315 HydrophobicContact CG-CD1 3.97Å; K311-L315 HydrophobicContact CG-CG 4.33Å; K311-L315 WeakPolarHBondContact O-CB 3.42Å; K311-L315 WeakPolarHBondContact O-CG 3.38Å; K311-L315 PolarHBondContact O-N 3.23Å
312	K	53.6	Low	51.7	Low	124 Å²	124	76.2 Å²	76.2	54%	0.539	39%	0.394	S	S	.	.	H	α-helix	trans	-61.3	-39.2	172.6	-174.1	175.8	178.3	-180	0	110.9	M308 Q309 L315 Q316	M308-K312 VanDerWaalsContact O-CB 3.27Å; M308-K312 WeakPolarHBondContact O-CB 3.4Å; M308-K312 PolarHBondContact O-N 2.74Å; Q309-K312 PolarHBondContact O-N 2.76Å; K312-L315 PolarHBondContact O-N 3.28Å; K312-Q316 VanDerWaalsContact CE-OE1 3.3Å; K312-Q316 HydrophobicContact CG-CG 4.22Å; K312-Q316 WeakPolarHBondContact O-CB 3.36Å; K312-Q316 WeakPolarHBondContact O-CG 3.31Å; K312-Q316 PolarHBondContact O-N 3.36Å
313	K	49.2	Very low	50.7	Low	91 Å²	91	72.9 Å²	72.9	40%	0.396	38%	0.383	S	S	.	.	H	α-helix	trans	-63.9	-40.5	171.7	-74	175.1	179.7	178.2	0	112.6	Q309 C310 K311 N317 D318 V321	Q309-K313 WeakPolarHBondContact O-CB 3.26Å; Q309-K313 VanDerWaalsContact O-CG 3.23Å; Q309-K313 WeakPolarHBondContact O-CG 2.98Å; Q309-K313 PolarHBondContact O-N 3.49Å; C310-K313 WeakPolarHBondContact O-CB 3.47Å; C310-K313 PolarHBondContact O-N 2.95Å; K311-K313 VanDerWaalsContact C-N 3.28Å; K311-K313 PolarHBondContact O-N 3.46Å; K313-N317 PolarHBondContact O-N 3.36Å; K313-D318 VanDerWaalsContact CB-O 3.23Å; K313-D318 WeakPolarHBondContact CB-O 3.49Å; K313-D318 VanDerWaalsContact CG-O 3.23Å; K313-D318 WeakPolarHBondContact CG-O 3.41Å; K313-D318 PolarHBondContact O-N 2.9Å; K313-V321 HydrophobicContact CB-CG2 4.44Å
314	I	46.6	Very low	49.6	Very low	73 Å²	73	76.2 Å²	76.2	37%	0.374	41%	0.407	S	S	.	.	H	α-helix	trans	-63.8	-45.2	174.5	-68	163.2	0	0	0	111.3	A277 C310 K311 V321 A326	A277-I314 HydrophobicContact CB-CD1 4.06Å; C310-I314 VanDerWaalsContact O-CG1 3.26Å; C310-I314 WeakPolarHBondContact O-CG1 3.49Å; C310-I314 PolarHBondContact O-N 2.83Å; K311-I314 CarbonylContact O-C 3.51Å; K311-I314 WeakPolarHBondContact O-CB 3.39Å; K311-I314 PolarHBondContact O-N 3.19Å; K311-I314 VanDerWaalsContact O-N 3.15Å; I314-V321 HydrophobicContact CD1-CG2 4.15Å; I314-V321 HydrophobicContact CG1-CG2 3.9Å; I314-A326 HydrophobicContact CD1-CB 4.04Å
315	L	40.7	Very low	48.6	Very low	116 Å²	116	76.8 Å²	76.8	61%	0.607	41%	0.411	S	S	*	.	H	α-helix	trans	-74.6	-28.6	-179.4	-71.2	169.9	0	0	0	113.4	K311 K312	K311-L315 HydrophobicContact CG-CD1 3.97Å; K311-L315 HydrophobicContact CG-CG 4.33Å; K311-L315 WeakPolarHBondContact O-CB 3.42Å; K311-L315 WeakPolarHBondContact O-CG 3.38Å; K311-L315 PolarHBondContact O-N 3.23Å; K312-L315 PolarHBondContact O-N 3.28Å
316	Q	39.8	Very low	47.7	Very low	115 Å²	115	71.3 Å²	71.3	54%	0.537	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	4.8	-180	-65	-175.8	-26.4	0	0	113.4	K312 D318	K312-Q316 VanDerWaalsContact CE-OE1 3.3Å; K312-Q316 HydrophobicContact CG-CG 4.22Å; K312-Q316 WeakPolarHBondContact O-CB 3.36Å; K312-Q316 WeakPolarHBondContact O-CG 3.31Å; K312-Q316 PolarHBondContact O-N 3.36Å; Q316-D318 PolarHBondContact O-N 3.35Å
317	N	40.2	Very low	47	Very low	80 Å²	80	74.2 Å²	74.2	43%	0.428	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	31.7	-172.9	-79.5	-19.5	0	0	0	113.2	K313 L458	K313-N317 PolarHBondContact O-N 3.36Å; N317-L458 WeakPolarHBondContact O-CD2 3.39Å
318	D	30	Very low	46.2	Very low	110 Å²	110	75.9 Å²	75.9	59%	0.588	41%	0.405	S	S	*	.			trans	-111.5	75.8	-177.5	-105.1	-9.2	0	0	0	110.4	K313 Q316	K313-D318 VanDerWaalsContact CB-O 3.23Å; K313-D318 WeakPolarHBondContact CB-O 3.49Å; K313-D318 VanDerWaalsContact CG-O 3.23Å; K313-D318 WeakPolarHBondContact CG-O 3.41Å; K313-D318 PolarHBondContact O-N 2.9Å; Q316-D318 PolarHBondContact O-N 3.35Å
319	G	35.8	Very low	45.8	Very low	33 Å²	33	73.2 Å²	73.2	34%	0.34	39%	0.391	S	S	.	.			trans	104.5	150.9	165.1	0	0	0	0	0	116.3	V321	G319-V321 PolarHBondContact O-N 3.07Å
320	V	37	Very low	45	Very low	86 Å²	86	72.1 Å²	72.1	52%	0.521	38%	0.384	S	S	.	.			trans	-78	118	178.4	-175	0	0	0	0	108.7	T322 N426	V320-T322 HydrophobicContact CG1-CG2 3.99Å; V320-T322 PolarHBondContact O-N 3.11Å; V320-N426 HydrophobicContact CG2-CB 4.43Å; V320-N426 WeakPolarHBondContact CG2-ND2 3.49Å
321	V	36.1	Very low	44.3	Very low	28 Å²	28	73.3 Å²	73.3	17%	0.17	40%	0.395	C	S	.	.			trans	-83	100.1	170.9	-177	0	0	0	0	107.6	C310 K313 I314 G319 S323 A326	C310-V321 HydrophobicContact CB-CB 4.5Å; C310-V321 HydrophobicContact CB-CG1 3.77Å; C310-V321 HydrophobicContact CB-CG2 3.86Å; C310-V321 VanDerWaalsContact SG-CG1 3.59Å; K313-V321 HydrophobicContact CB-CG2 4.44Å; I314-V321 HydrophobicContact CD1-CG2 4.15Å; I314-V321 HydrophobicContact CG1-CG2 3.9Å; G319-V321 PolarHBondContact O-N 3.07Å; V321-S323 VanDerWaalsContact C-N 3.28Å; V321-S323 WeakPolarHBondContact CG1-OG 3.39Å; V321-A326 HydrophobicContact CB-CB 3.69Å; V321-A326 HydrophobicContact CG1-CB 3.4Å; V321-A326 VanDerWaalsContact CG1-CB 3.4Å
322	T	38.1	Very low	44.2	Very low	133 Å²	133	74.3 Å²	74.3	82%	0.816	41%	0.41	S	S	*	.			trans	-84.5	-1.2	176.8	52.3	0	0	0	0	113.2	V320	V320-T322 HydrophobicContact CG1-CG2 3.99Å; V320-T322 PolarHBondContact O-N 3.11Å
323	S	46.7	Very low	44.3	Very low	39 Å²	39	71.3 Å²	71.3	27%	0.273	40%	0.398	S	S	.	.	S	Bend	trans	-74.2	147	-179.8	44.6	0	0	0	0	111.3	V321 C325 A326	V321-S323 VanDerWaalsContact C-N 3.28Å; V321-S323 WeakPolarHBondContact CG1-OG 3.39Å; S323-C325 VanDerWaalsContact CB-SG 3.56Å; S323-C325 PolarHBondContact O-N 2.97Å; S323-C325 PolarHBondContact OG-SG 3.44Å; S323-A326 PolarHBondContact O-N 3.3Å
324	P	46.3	Very low	45.1	Very low	107 Å²	107	67.3 Å²	67.3	70%	0.695	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-51.3	-23.6	177.3	-25.3	32.5	0	0	0	113.6	R275 A326 R327	R275-P324 VanDerWaalsContact CG-O 3.32Å; R275-P324 WeakPolarHBondContact CG-O 3.19Å; P324-A326 VanDerWaalsContact C-N 3.28Å; P324-A326 PolarHBondContact O-N 2.98Å; P324-R327 PolarHBondContact O-N 3.2Å
325	C	47.6	Very low	46.5	Very low	24 Å²	24	63.9 Å²	63.9	16%	0.162	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-70.9	-12.3	-179	63.9	0	0	0	0	115.7	R275 A277 S323	R275-C325 CarbonylContact C-O 3.28Å; R275-C325 VanDerWaalsContact C-O 3.25Å; R275-C325 WeakPolarHBondContact CA-O 3.45Å; R275-C325 WeakPolarHBondContact CB-O 3.38Å; A277-C325 WeakPolarHBondContact CB-O 3.36Å; A277-C325 PolarHBondContact N-O 3.23Å; A277-C325 VanDerWaalsContact N-O 3.15Å; S323-C325 VanDerWaalsContact CB-SG 3.56Å; S323-C325 PolarHBondContact O-N 2.97Å; S323-C325 PolarHBondContact OG-SG 3.44Å
326	A	47.6	Very low	48.4	Very low	14 Å²	14	58.5 Å²	58.5	12%	0.116	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-113.8	4.7	174.6	0	0	0	0	0	113.6	A277 I314 V321 S323 P324 P328	A277-A326 HydrophobicContact CB-CB 4.11Å; I314-A326 HydrophobicContact CD1-CB 4.04Å; V321-A326 HydrophobicContact CB-CB 3.69Å; V321-A326 HydrophobicContact CG1-CB 3.4Å; V321-A326 VanDerWaalsContact CG1-CB 3.4Å; S323-A326 PolarHBondContact O-N 3.3Å; P324-A326 VanDerWaalsContact C-N 3.28Å; P324-A326 PolarHBondContact O-N 2.98Å; A326-P328 VanDerWaalsContact O-CD 3.31Å; A326-P328 WeakPolarHBondContact O-CD 3.48Å
327	R	50.9	Low	50.4	Low	158 Å²	158	53 Å²	53	60%	0.596	31%	0.31	S	S	*	.			trans	-64.6	104	169	168.1	-117.2	-161.2	-148.6	-0.1	114.5	D238 R275 P324 R329	D238-R327 IonicContact OD2-NH1 2.64Å; R275-R327 WeakPolarHBondContact CD-O 3.5Å; R275-R327 VanDerWaalsContact CG-O 3.26Å; R275-R327 WeakPolarHBondContact CG-O 3.44Å; R275-R327 PolarHBondContact NE-O 2.7Å; R275-R327 PolarHBondContact NH1-O 2.79Å; P324-R327 PolarHBondContact O-N 3.2Å; R327-R329 PolarHBondContact O-N 3.08Å
328	P	48.4	Very low	52.3	Low	38 Å²	38	49.3 Å²	49.3	25%	0.247	29%	0.29	C	S	.	.			trans	-60.5	139.7	171.6	-21.3	33.7	0	0	0	112.1	R275 L278 A326 W622	R275-P328 PolarHBondContact NH1-O 3.27Å; R275-P328 VanDerWaalsContact NH1-O 3.11Å; L278-P328 HydrophobicContact CD1-CB 4.3Å; L278-P328 HydrophobicContact CD1-CG 4.31Å; A326-P328 VanDerWaalsContact O-CD 3.31Å; A326-P328 WeakPolarHBondContact O-CD 3.48Å; P328-W622 HydrophobicContact CG-CE3 4.21Å; P328-W622 HydrophobicContact CG-CZ3 4.42Å
329	R	54.3	Low	54.1	Low	20 Å²	20	44.2 Å²	44.2	8%	0.075	26%	0.263	C	S	.	.	S	Bend	trans	-70	139	173	-70	169.9	-167.4	-103.5	-4.8	108.6	I235 E245 G273 R275 R327 A331	I235-R329 PolarHBondContact O-NH1 3.28Å; I235-R329 PolarHBondContact O-NH2 3.35Å; E245-R329 VanDerWaalsContact CD-NE 3.27Å; E245-R329 IonicContact OE1-CZ 2.79Å; E245-R329 IonicContact OE1-NE 2.67Å; E245-R329 PolarHBondContact OE1-NE 3.23Å; E245-R329 IonicContact OE1-NH2 3.08Å; E245-R329 PolarHBondContact OE1-NH2 2.82Å; E245-R329 WeakPolarHBondContact OE2-CD 3.05Å; E245-R329 IonicContact OE2-CZ 3.35Å; E245-R329 IonicContact OE2-NE 3.1Å; E245-R329 PolarHBondContact OE2-NE 3Å; G273-R329 PolarHBondContact O-NH2 3.24Å; R275-R329 VanDerWaalsContact NE-CG 3.33Å; R327-R329 PolarHBondContact O-N 3.08Å; R329-A331 PolarHBondContact O-N 2.86Å
330	K	44.8	Very low	55.4	Low	90 Å²	90	42.6 Å²	42.6	39%	0.391	25%	0.247	S	C	.	.	S	Bend	trans	32.2	78.3	179.6	-144.1	-175.7	-160.1	166.3	0	111.5	D238 E239 E241 G332	D238-K330 VanDerWaalsContact O-CA 3.26Å; D238-K330 WeakPolarHBondContact O-CA 3.36Å; D238-K330 VanDerWaalsContact O-CB 3.24Å; D238-K330 WeakPolarHBondContact O-CB 3.33Å; D238-K330 PolarHBondContact O-N 3.24Å; E239-K330 WeakPolarHBondContact O-CD 3.42Å; E239-K330 PolarHBondContact O-NZ 3.27Å; E239-K330 VanDerWaalsContact O-NZ 3.15Å; E241-K330 HydrophobicContact CG-CD 3.92Å; E241-K330 IonicContact OE1-NZ 2.7Å; E241-K330 PolarHBondContact OE1-NZ 2.94Å; K330-G332 VanDerWaalsContact C-N 3.35Å; K330-G332 PolarHBondContact O-N 2.91Å
331	A	44.2	Very low	56.3	Low	44 Å²	44	41.1 Å²	41.1	36%	0.364	23%	0.234	S	C	.	.			trans	-47.1	100.6	179.9	0	0	0	0	0	109.8	R329 H333	R329-A331 PolarHBondContact O-N 2.86Å; A331-H333 PolarHBondContact O-CD2 2.81Å; A331-H333 VanDerWaalsContact O-CD2 3.27Å; A331-H333 PolarHBondContact O-N 2.97Å
332	G	50.6	Low	57.2	Low	37 Å²	37	41.3 Å²	41.3	38%	0.381	24%	0.236	S	C	.	.			trans	-61.8	95.7	161.3	0	0	0	0	0	104	K330 T334 K623	K330-G332 VanDerWaalsContact C-N 3.35Å; K330-G332 PolarHBondContact O-N 2.91Å; G332-T334 PolarHBondContact O-N 2.84Å; G332-K623 WeakPolarHBondContact O-CA 3.36Å; G332-K623 WeakPolarHBondContact O-CB 3Å; G332-K623 PolarHBondContact O-N 3Å
333	H	55.4	Low	58	Low	62 Å²	62	43.9 Å²	43.9	29%	0.287	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	108.2	173.2	-82.6	-88.4	0	0	0	106	A331 S574 S620 T621	A331-H333 PolarHBondContact O-CD2 2.81Å; A331-H333 VanDerWaalsContact O-CD2 3.27Å; A331-H333 PolarHBondContact O-N 2.97Å; H333-S574 WeakPolarHBondContact CB-OG 3.36Å; H333-S620 WeakPolarHBondContact CB-OG 3.32Å; H333-S620 PolarHBondContact ND1-OG 2.97Å; H333-S620 VanDerWaalsContact ND1-OG 3.14Å; H333-T621 CarbonylContact C-O 3.57Å; H333-T621 WeakPolarHBondContact CA-O 3.18Å
334	T	67.1	Low	58.5	Low	7 Å²	7	44.9 Å²	44.9	4%	0.043	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	130.6	170.8	-74.5	0	0	0	0	108.3	G332 L336 Q350 S620 T621 K623	G332-T334 PolarHBondContact O-N 2.84Å; T334-L336 HydrophobicContact CG2-CD2 3.86Å; T334-L336 HydrophobicContact CG2-CG 4.04Å; T334-Q350 HydrophobicContact CG2-CB 4.22Å; T334-Q350 VanDerWaalsContact CG2-CD 3.47Å; T334-Q350 HydrophobicContact CG2-CG 3.51Å; T334-Q350 PolarHBondContact OG1-NE2 3.18Å; T334-S620 WeakPolarHBondContact O-CA 3.3Å; T334-T621 PolarHBondContact N-O 3.27Å; T334-T621 PolarHBondContact O-N 3.05Å; T334-K623 WeakPolarHBondContact OG1-CB 3.44Å; T334-K623 WeakPolarHBondContact OG1-CD 3.26Å; T334-K623 WeakPolarHBondContact OG1-CG 3.1Å
335	L	74.8	Confident	59.3	Low	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	122.8	170.2	-60.1	-178.1	0	0	0	108.8	V351 H353 V572 Y579 F618	L335-V351 HydrophobicContact CB-CB 4.13Å; L335-V351 HydrophobicContact CB-CG2 4.37Å; L335-V351 PolarHBondContact O-N 2.91Å; L335-H353 WeakPolarHBondContact CD1-CE1 3.31Å; L335-H353 WeakPolarHBondContact CD1-NE2 3.22Å; L335-H353 WeakPolarHBondContact CG-NE2 3.2Å; L335-V572 HydrophobicContact CD2-CG1 3.49Å; L335-V572 VanDerWaalsContact CD2-CG1 3.49Å; L335-Y579 HydrophobicContact CD1-CD1 3.82Å; L335-Y579 HydrophobicContact CD1-CD2 3.87Å; L335-Y579 HydrophobicContact CD1-CE1 4.22Å; L335-Y579 HydrophobicContact CD1-CE2 4.28Å; L335-Y579 HydrophobicContact CD1-CG 3.63Å; L335-F618 HydrophobicContact CB-CE2 3.86Å; L335-F618 HydrophobicContact CB-CZ 3.98Å; L335-F618 HydrophobicContact CD1-CZ 3.87Å; L335-F618 HydrophobicContact CD2-CZ 4.28Å; L335-F618 HydrophobicContact CG-CZ 4.28Å
336	L	80.4	Confident	60.3	Low	3 Å²	3	41.8 Å²	41.8	2%	0.016	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	125.1	176.8	-64.2	172.1	0	0	0	110	T334 I348 Y349 Q350 V380 T401 F618 V619 T621	T334-L336 HydrophobicContact CG2-CD2 3.86Å; T334-L336 HydrophobicContact CG2-CG 4.04Å; L336-I348 HydrophobicContact CD2-CG2 4.19Å; L336-Y349 CarbonylContact C-O 3.54Å; L336-Y349 WeakPolarHBondContact CA-O 3.27Å; L336-Q350 HydrophobicContact CD2-CB 3.84Å; L336-V380 HydrophobicContact CD1-CG2 3.66Å; L336-T401 HydrophobicContact CD1-CG2 3.83Å; L336-F618 VanDerWaalsContact O-CD2 3.31Å; L336-F618 WeakPolarHBondContact O-CD2 3.36Å; L336-V619 HydrophobicContact CB-CG2 3.84Å; L336-V619 HydrophobicContact CD1-CG2 4.48Å; L336-V619 PolarHBondContact N-O 3.03Å; L336-V619 PolarHBondContact O-N 2.76Å; L336-T621 HydrophobicContact CD1-CG2 3.84Å
337	I	81.9	Confident	61.6	Low	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	121.8	174.5	-61.8	175.1	0	0	0	107.1	Y349 V351 V581 V609 P615 F618	I337-Y349 PolarHBondContact N-O 2.8Å; I337-Y349 PolarHBondContact O-N 2.89Å; I337-V351 HydrophobicContact CD1-CG2 3.53Å; I337-V351 HydrophobicContact CG1-CG2 3.98Å; I337-V581 HydrophobicContact CD1-CG2 4.14Å; I337-V609 HydrophobicContact CD1-CG1 3.8Å; I337-P615 HydrophobicContact CG2-CB 3.83Å; I337-P615 HydrophobicContact CG2-CG 4.35Å; I337-F618 HydrophobicContact CD1-CE2 4.5Å; I337-F618 HydrophobicContact CG1-CD2 3.75Å; I337-F618 HydrophobicContact CG1-CE2 3.66Å
338	L	79.6	Confident	63	Low	3 Å²	3	37 Å²	37	2%	0.016	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	120.3	-174.7	-58	166.7	0	0	0	110.7	I348 F371 A373 V380 V382 T616 A617 V619	L338-I348 HydrophobicContact CD2-CB 4.21Å; L338-I348 HydrophobicContact CD2-CD1 3.31Å; L338-I348 HydrophobicContact CD2-CG1 3.5Å; L338-I348 VanDerWaalsContact CD2-CG1 3.5Å; L338-I348 HydrophobicContact CD2-CG2 3.94Å; L338-F371 HydrophobicContact CB-CE2 4.05Å; L338-F371 HydrophobicContact CB-CZ 4.04Å; L338-A373 HydrophobicContact CD1-CB 3.29Å; L338-V380 HydrophobicContact CD1-CG1 3.82Å; L338-V382 HydrophobicContact CD1-CG2 4.45Å; L338-T616 PolarHBondContact O-N 3.01Å; L338-A617 HydrophobicContact CB-CB 4.26Å; L338-A617 HydrophobicContact CD1-CB 4.17Å; L338-A617 PolarHBondContact N-O 2.86Å; L338-A617 PolarHBondContact O-N 3.13Å; L338-A617 VanDerWaalsContact O-N 3.14Å; L338-V619 HydrophobicContact CD1-CG1 4.3Å; L338-V619 HydrophobicContact CD1-CG2 3.92Å
339	G	69	Low	64.4	Low	2 Å²	2	36.3 Å²	36.3	2%	0.021	19%	0.188	C	C	.	.			trans	70.3	-173.4	169.1	0	0	0	0	0	116.2	M344 K347 P615	G339-M344 CarbonylContact C-O 3.56Å; G339-K347 PolarHBondContact N-O 3.14Å; G339-P615 WeakPolarHBondContact O-CA 3.23Å
340	G	62.5	Low	65.7	Low	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.189	C	C	.	.			trans	-157.7	126.2	-172.3	0	0	0	0	0	111.8	T342 M344 C345 I614	G340-T342 PolarHBondContact O-N 2.8Å; G340-T342 VanDerWaalsContact O-N 3.1Å; G340-M344 WeakPolarHBondContact CA-O 3.35Å; G340-M344 PolarHBondContact N-O 3.25Å; G340-C345 PolarHBondContact O-SG 3.05Å; G340-I614 VanDerWaalsContact CA-O 3.25Å; G340-I614 WeakPolarHBondContact CA-O 3.38Å
341	Q	56.2	Low	67	Low	54 Å²	54	32.3 Å²	32.3	25%	0.252	17%	0.172	S	C	.	.	S	Bend	trans	-63.2	-18	-173.3	-157.4	174.6	14.7	0	0	114.9	K369 I614	Q341-K369 WeakPolarHBondContact O-CD 3.23Å; Q341-K369 VanDerWaalsContact O-CE 3.26Å; Q341-K369 WeakPolarHBondContact O-CE 3.23Å; Q341-K369 PolarHBondContact O-NZ 2.85Å; Q341-I614 HydrophobicContact CB-CB 4.46Å; Q341-I614 HydrophobicContact CB-CG2 4.45Å; Q341-I614 PolarHBondContact N-O 3.37Å
342	T	54.9	Low	68.1	Low	33 Å²	33	31.9 Å²	31.9	20%	0.202	16%	0.163	C	C	.	.	S	Bend	trans	-105.8	-70.1	-171.9	40.8	0	0	0	0	114	G340 K369	G340-T342 PolarHBondContact O-N 2.8Å; G340-T342 VanDerWaalsContact O-N 3.1Å; T342-K369 PolarHBondContact O-NZ 3.41Å
343	F	53.9	Low	68.4	Low	186 Å²	186	33.3 Å²	33.3	82%	0.816	16%	0.16	S	C	*	.	S	Bend	trans	-130.8	-14.9	-166.9	-60.5	-74.7	0	0	0	116.1
344	M	57.2	Low	68.4	Low	60 Å²	60	38.4 Å²	38.4	30%	0.296	18%	0.181	S	C	.	.			trans	-123.7	75	-178.9	-66.1	-171.1	178.1	0	0	109.7	G339 G340 D346 K347 S612	G339-M344 CarbonylContact C-O 3.56Å; G340-M344 WeakPolarHBondContact CA-O 3.35Å; G340-M344 PolarHBondContact N-O 3.25Å; M344-D346 VanDerWaalsContact C-N 3.3Å; M344-K347 HydrophobicContact CB-CG 4.43Å; M344-K347 HydrophobicContact SD-CD 3.95Å; M344-S612 PolarHBondContact SD-OG 2.97Å
345	C	64.6	Low	67.5	Low	15 Å²	15	40.4 Å²	40.4	10%	0.101	20%	0.199	C	C	.	.	S	Bend	trans	-88	-0.9	-175.6	-52.5	0	0	0	0	113.4	G340 P367 K369	G340-C345 PolarHBondContact O-SG 3.05Å; C345-P367 HydrophobicContact CB-CB 3.76Å; C345-K369 WeakPolarHBondContact SG-CE 3.45Å
346	D	68.9	Low	67	Low	51 Å²	51	46.9 Å²	46.9	27%	0.273	23%	0.227	S	C	.	.	S	Bend	trans	-103.6	-30.7	-174.7	47.9	-7.2	0	0	0	113	M344 D363 L364 P367	M344-D346 VanDerWaalsContact C-N 3.3Å; D346-D363 HydrophobicContact CB-CB 4.45Å; D346-D363 CarbonylContact O-C 3.59Å; D346-L364 VanDerWaalsContact O-CB 3.24Å; D346-L364 WeakPolarHBondContact O-CB 3.08Å; D346-L364 PolarHBondContact O-N 3.15Å; D346-P367 HydrophobicContact CB-CB 4.15Å
347	K	74.2	Confident	66.4	Low	69 Å²	69	52.9 Å²	52.9	30%	0.3	26%	0.255	S	S	.	.			trans	-76.2	141.5	-168.5	-57.6	-159.8	170.9	-166.9	0	114.8	G339 M344 Y349	G339-K347 PolarHBondContact N-O 3.14Å; M344-K347 HydrophobicContact CB-CG 4.43Å; M344-K347 HydrophobicContact SD-CD 3.95Å; K347-Y349 HydrophobicContact CB-CD2 4.35Å; K347-Y349 HydrophobicContact CB-CE2 3.45Å; K347-Y349 VanDerWaalsContact CB-CE2 3.45Å; K347-Y349 HydrophobicContact CD-CE2 4.41Å; K347-Y349 WeakPolarHBondContact CD-OH 3.34Å
348	I	79.4	Confident	66	Low	3 Å²	3	54.7 Å²	54.7	2%	0.015	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	139.4	166.9	-61.5	-162.7	0	0	0	109.4	L336 L338 K361 Y399 W406	L336-I348 HydrophobicContact CD2-CG2 4.19Å; L338-I348 HydrophobicContact CD2-CB 4.21Å; L338-I348 HydrophobicContact CD2-CD1 3.31Å; L338-I348 HydrophobicContact CD2-CG1 3.5Å; L338-I348 VanDerWaalsContact CD2-CG1 3.5Å; L338-I348 HydrophobicContact CD2-CG2 3.94Å; I348-K361 HydrophobicContact CB-CB 4.06Å; I348-K361 HydrophobicContact CG2-CB 3.86Å; I348-K361 HydrophobicContact CG2-CG 4.39Å; I348-K361 PolarHBondContact O-N 2.72Å; I348-Y399 HydrophobicContact CD1-CD1 4.28Å; I348-Y399 HydrophobicContact CD1-CG 4.3Å; I348-W406 HydrophobicContact CD1-CH2 3.64Å; I348-W406 HydrophobicContact CD1-CZ2 3.12Å; I348-W406 HydrophobicContact CG1-CZ2 4Å
349	Y	79.2	Confident	65.9	Low	23 Å²	23	57.4 Å²	57.4	9%	0.09	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	135.9	172.1	-58.2	-92.9	0	0	0	111.7	L336 I337 K347 I358 I359 P360 L613	L336-Y349 CarbonylContact C-O 3.54Å; L336-Y349 WeakPolarHBondContact CA-O 3.27Å; I337-Y349 PolarHBondContact N-O 2.8Å; I337-Y349 PolarHBondContact O-N 2.89Å; K347-Y349 HydrophobicContact CB-CD2 4.35Å; K347-Y349 HydrophobicContact CB-CE2 3.45Å; K347-Y349 VanDerWaalsContact CB-CE2 3.45Å; K347-Y349 HydrophobicContact CD-CE2 4.41Å; K347-Y349 WeakPolarHBondContact CD-OH 3.34Å; Y349-I358 HydrophobicContact CD1-CG2 3.64Å; Y349-I358 HydrophobicContact CG-CG2 3.86Å; Y349-I359 CarbonylContact C-O 3.59Å; Y349-I359 WeakPolarHBondContact CA-O 3.26Å; Y349-P360 HydrophobicContact CD1-CB 4.21Å; Y349-P360 HydrophobicContact CE1-CB 4.15Å; Y349-L613 HydrophobicContact CD1-CD1 4.35Å; Y349-L613 HydrophobicContact CD2-CD1 3.72Å; Y349-L613 HydrophobicContact CD2-CD2 3.81Å; Y349-L613 HydrophobicContact CD2-CG 4.4Å; Y349-L613 HydrophobicContact CE1-CD1 4.08Å; Y349-L613 HydrophobicContact CE2-CD1 3.48Å; Y349-L613 VanDerWaalsContact CE2-CD1 3.48Å; Y349-L613 HydrophobicContact CE2-CD2 3.11Å; Y349-L613 HydrophobicContact CE2-CG 3.9Å; Y349-L613 HydrophobicContact CG-CD1 4.15Å
350	Q	79.9	Confident	66.3	Low	22 Å²	22	61.7 Å²	61.7	10%	0.103	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	129.9	169.4	163.9	163.5	0.7	0	0	109.8	T334 L336 I358 I359 K361	T334-Q350 HydrophobicContact CG2-CB 4.22Å; T334-Q350 VanDerWaalsContact CG2-CD 3.47Å; T334-Q350 HydrophobicContact CG2-CG 3.51Å; T334-Q350 PolarHBondContact OG1-NE2 3.18Å; L336-Q350 HydrophobicContact CD2-CB 3.84Å; Q350-I358 CarbonylContact O-C 3.58Å; Q350-I358 WeakPolarHBondContact O-CA 3.39Å; Q350-I359 HydrophobicContact CB-CB 4.46Å; Q350-I359 PolarHBondContact N-O 2.91Å; Q350-I359 PolarHBondContact O-N 3.01Å; Q350-K361 HydrophobicContact CB-CG 4.16Å
351	V	73.4	Confident	67.2	Low	5 Å²	5	63.7 Å²	63.7	3%	0.03	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	119.2	171.9	-174.4	0	0	0	0	108.4	L335 I337 L593	L335-V351 HydrophobicContact CB-CB 4.13Å; L335-V351 HydrophobicContact CB-CG2 4.37Å; L335-V351 PolarHBondContact O-N 2.91Å; I337-V351 HydrophobicContact CD1-CG2 3.53Å; I337-V351 HydrophobicContact CG1-CG2 3.98Å; V351-L593 HydrophobicContact CG1-CD2 3.85Å; V351-L593 HydrophobicContact CG2-CD2 4.5Å
352	D	66.6	Low	68.2	Low	34 Å²	34	63 Å²	63	18%	0.182	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-90.3	117	170.4	-172.7	7.5	0	0	0	110.5	K354 A355 K356 E357 I359	D352-K354 VanDerWaalsContact C-N 3.32Å; D352-K354 PolarHBondContact OD1-N 2.68Å; D352-A355 HydrophobicContact CB-CB 4.26Å; D352-A355 WeakPolarHBondContact OD2-CB 3.41Å; D352-A355 PolarHBondContact OD2-N 3.48Å; D352-K356 WeakPolarHBondContact O-CA 3.26Å; D352-K356 PolarHBondContact O-N 2.72Å; D352-E357 PolarHBondContact N-O 2.76Å; D352-I359 HydrophobicContact CB-CD1 4.29Å
353	H	57.6	Low	69.4	Low	67 Å²	67	65.6 Å²	65.6	31%	0.31	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-30.5	177.4	-72.2	-66	0	0	0	113.1	L335 Y579	L335-H353 WeakPolarHBondContact CD1-CE1 3.31Å; L335-H353 WeakPolarHBondContact CD1-NE2 3.22Å; L335-H353 WeakPolarHBondContact CG-NE2 3.2Å; H353-Y579 AromaticContact CE1-CE1 3.39Å; H353-Y579 WeakPolarHBondContact CE1-CE1 3.5Å; H353-Y579 AromaticContact CE1-CZ 3.48Å; H353-Y579 VanDerWaalsContact CE1-CZ 3.48Å
354	K	54.5	Low	70.7	Confident	169 Å²	169	57.2 Å²	57.2	74%	0.735	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-45	-177.9	-69.3	-171.3	175.5	-172.6	0	110.6	E241 D352	E241-K354 IonicContact OE2-NZ 3.6Å; E241-K354 PolarHBondContact OE2-NZ 3.38Å; E241-K354 VanDerWaalsContact OE2-NZ 3.08Å; D352-K354 VanDerWaalsContact C-N 3.32Å; D352-K354 PolarHBondContact OD1-N 2.68Å
355	A	49.3	Very low	71.7	Confident	50 Å²	50	57.9 Å²	57.9	41%	0.413	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-13.8	-179.3	0	0	0	0	0	115	D352 E357	D352-A355 HydrophobicContact CB-CB 4.26Å; D352-A355 WeakPolarHBondContact OD2-CB 3.41Å; D352-A355 PolarHBondContact OD2-N 3.48Å; A355-E357 HydrophobicContact CB-CB 4.11Å; A355-E357 HydrophobicContact CB-CG 4.07Å; A355-E357 PolarHBondContact O-N 3.31Å; A355-E357 VanDerWaalsContact O-N 3.15Å
356	K	63.4	Low	72.3	Confident	135 Å²	135	58.7 Å²	58.7	59%	0.587	31%	0.306	S	S	*	.			trans	55.5	19.1	-166.6	-63.1	-178.2	179.4	178.9	0	113.7	D352	D352-K356 WeakPolarHBondContact O-CA 3.26Å; D352-K356 PolarHBondContact O-N 2.72Å
357	E	67.6	Low	72.5	Confident	129 Å²	129	59.5 Å²	59.5	60%	0.603	31%	0.314	S	S	*	.			trans	-97.9	157.2	-179.8	-68.1	-169.6	167	0	0	111.7	D352 A355	D352-E357 PolarHBondContact N-O 2.76Å; A355-E357 HydrophobicContact CB-CB 4.11Å; A355-E357 HydrophobicContact CB-CG 4.07Å; A355-E357 PolarHBondContact O-N 3.31Å; A355-E357 VanDerWaalsContact O-N 3.15Å
358	I	73.3	Confident	72.7	Confident	38 Å²	38	57 Å²	57	20%	0.195	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	110.7	178.1	-60	173.1	0	0	0	107.3	Y349 Q350 V609	Y349-I358 HydrophobicContact CD1-CG2 3.64Å; Y349-I358 HydrophobicContact CG-CG2 3.86Å; Q350-I358 CarbonylContact O-C 3.58Å; Q350-I358 WeakPolarHBondContact O-CA 3.39Å; I358-V609 HydrophobicContact CD1-CB 4.22Å; I358-V609 HydrophobicContact CD1-CG1 3.82Å
359	I	77.6	Confident	72.7	Confident	61 Å²	61	60.7 Å²	60.7	31%	0.313	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	121.6	-173.6	-55	169.7	0	0	0	108.8	Y349 Q350 D352	Y349-I359 CarbonylContact C-O 3.59Å; Y349-I359 WeakPolarHBondContact CA-O 3.26Å; Q350-I359 HydrophobicContact CB-CB 4.46Å; Q350-I359 PolarHBondContact N-O 2.91Å; Q350-I359 PolarHBondContact O-N 3.01Å; D352-I359 HydrophobicContact CB-CD1 4.29Å
360	P	77.3	Confident	72.7	Confident	91 Å²	91	62.5 Å²	62.5	59%	0.591	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	144.7	174.7	29.6	-33.3	0	0	0	111.2	Y349	Y349-P360 HydrophobicContact CD1-CB 4.21Å; Y349-P360 HydrophobicContact CE1-CB 4.15Å
361	K	82	Confident	73	Confident	42 Å²	42	61.8 Å²	61.8	18%	0.183	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	-179.5	179.2	-66.9	-63.2	-173.3	178.2	0	111.5	I348 Q350 D363 E404	I348-K361 HydrophobicContact CB-CB 4.06Å; I348-K361 HydrophobicContact CG2-CB 3.86Å; I348-K361 HydrophobicContact CG2-CG 4.39Å; I348-K361 PolarHBondContact O-N 2.72Å; Q350-K361 HydrophobicContact CB-CG 4.16Å; K361-D363 PolarHBondContact O-N 2.66Å; K361-E404 IonicContact NZ-OE1 2.82Å; K361-E404 PolarHBondContact NZ-OE1 2.83Å
362	S	77.4	Confident	73.7	Confident	41 Å²	41	62.3 Å²	62.3	29%	0.287	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-51.6	124.1	179.5	-52.2	0	0	0	0	112.6	E404 W406	S362-E404 WeakPolarHBondContact CB-O 3.45Å; S362-E404 PolarHBondContact OG-O 2.79Å; S362-W406 PolarHBondContact O-NE1 2.8Å; S362-W406 VanDerWaalsContact O-NE1 3.12Å
363	D	80.8	Confident	74.8	Confident	86 Å²	86	61.3 Å²	61.3	46%	0.46	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-65.9	141.3	-178	-65.9	-36.8	0	0	0	111.8	D346 K361 P365 W406	D346-D363 HydrophobicContact CB-CB 4.45Å; D346-D363 CarbonylContact O-C 3.59Å; K361-D363 PolarHBondContact O-N 2.66Å; D363-P365 WeakPolarHBondContact O-CD 3.35Å; D363-W406 PolarHBondContact O-NE1 3.47Å; D363-W406 VanDerWaalsContact O-NE1 3.1Å
364	L	80.3	Confident	76.3	Confident	10 Å²	10	58.7 Å²	58.7	5%	0.052	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-60.7	123.5	173.7	177.1	71	0	0	0	109.3	D346 S366 V382 W397 W406	D346-L364 VanDerWaalsContact O-CB 3.24Å; D346-L364 WeakPolarHBondContact O-CB 3.08Å; D346-L364 PolarHBondContact O-N 3.15Å; L364-S366 VanDerWaalsContact CD2-O 3.24Å; L364-S366 WeakPolarHBondContact CD2-O 3.31Å; L364-S366 PolarHBondContact O-N 3.38Å; L364-V382 HydrophobicContact CD1-CG1 4.48Å; L364-W397 HydrophobicContact CD1-CB 4.09Å; L364-W397 HydrophobicContact CD1-CG 4.15Å; L364-W406 HydrophobicContact CB-CH2 4.28Å; L364-W406 HydrophobicContact CB-CZ2 3.82Å; L364-W406 HydrophobicContact CD1-CE3 4.19Å; L364-W406 HydrophobicContact CD1-CH2 3.27Å; L364-W406 HydrophobicContact CD1-CZ2 3.62Å; L364-W406 HydrophobicContact CD1-CZ3 3.59Å; L364-W406 HydrophobicContact CG-CH2 4.35Å; L364-W406 HydrophobicContact CG-CZ2 4.34Å
365	P	78.6	Confident	77.6	Confident	74 Å²	74	51.7 Å²	51.7	48%	0.481	29%	0.287	S	S	.	.	S	Bend	trans	-60.2	-18.6	-176	-27.6	35.1	0	0	0	115.3	D363 W397 W406	D363-P365 WeakPolarHBondContact O-CD 3.35Å; P365-W397 HydrophobicContact CB-CH2 3.93Å; P365-W397 HydrophobicContact CB-CZ2 4.12Å; P365-W397 HydrophobicContact CB-CZ3 4.18Å; P365-W397 HydrophobicContact CG-CE3 4.17Å; P365-W397 HydrophobicContact CG-CH2 4.26Å; P365-W397 HydrophobicContact CG-CZ3 3.98Å; P365-W406 HydrophobicContact CG-CB 3.87Å; P365-W406 HydrophobicContact CG-CD2 4.5Å; P365-W406 HydrophobicContact CG-CG 3.95Å
366	S	76.3	Confident	79.1	Confident	32 Å²	32	50.3 Å²	50.3	22%	0.224	27%	0.273	C	S	.	.	S	Bend	trans	-136.5	96.1	-177.5	-173.7	0	0	0	0	110.5	L364 R368	L364-S366 VanDerWaalsContact CD2-O 3.24Å; L364-S366 WeakPolarHBondContact CD2-O 3.31Å; L364-S366 PolarHBondContact O-N 3.38Å; S366-R368 VanDerWaalsContact O-CD 3.29Å; S366-R368 WeakPolarHBondContact O-CD 3.02Å; S366-R368 WeakPolarHBondContact O-CG 3.39Å; S366-R368 PolarHBondContact O-N 3.08Å; S366-R368 PolarHBondContact O-NE 3.29Å; S366-R368 PolarHBondContact OG-NE 3.47Å; S366-R368 PolarHBondContact OG-NH2 2.73Å
367	P	74.3	Confident	79.4	Confident	69 Å²	69	45.1 Å²	45.1	45%	0.448	26%	0.257	S	S	.	.			trans	-61.8	124.6	-177.5	19.7	-29.8	0	0	0	111.8	C345 D346	C345-P367 HydrophobicContact CB-CB 3.76Å; D346-P367 HydrophobicContact CB-CB 4.15Å
368	R	78.4	Confident	79.7	Confident	15 Å²	15	40.8 Å²	40.8	6%	0.057	24%	0.241	C	C	.	.			trans	-139.1	153.5	-174	-72.5	152	-170.6	-118.4	-4.1	111.8	S366 F371 G384 S393 D395	S366-R368 VanDerWaalsContact O-CD 3.29Å; S366-R368 WeakPolarHBondContact O-CD 3.02Å; S366-R368 WeakPolarHBondContact O-CG 3.39Å; S366-R368 PolarHBondContact O-N 3.08Å; S366-R368 PolarHBondContact O-NE 3.29Å; S366-R368 PolarHBondContact OG-NE 3.47Å; S366-R368 PolarHBondContact OG-NH2 2.73Å; R368-F371 HydrophobicContact CB-CD1 3.9Å; R368-F371 VanDerWaalsContact O-CD1 3.3Å; R368-F371 WeakPolarHBondContact O-CD1 3.27Å; R368-F371 VanDerWaalsContact O-CE1 3.29Å; R368-F371 WeakPolarHBondContact O-CE1 3.49Å; R368-G384 PolarHBondContact NH1-O 3.08Å; R368-S393 PolarHBondContact NH1-OG 2.63Å; R368-S393 PolarHBondContact NH2-OG 2.95Å; R368-D395 IonicContact CZ-OD2 3.68Å; R368-D395 IonicContact NH1-OD2 3.75Å; R368-D395 IonicContact NH2-OD2 2.78Å; R368-D395 PolarHBondContact NH2-OD2 2.81Å
369	K	79.6	Confident	79.9	Confident	81 Å²	81	41.8 Å²	41.8	35%	0.352	24%	0.244	S	C	.	.	B	Isolated β-bridge	trans	-109.9	153.2	172.6	-60.4	-176.5	-179.1	-162.7	0	110	Q341 T342 C345 F371 G385 R386	Q341-K369 WeakPolarHBondContact O-CD 3.23Å; Q341-K369 VanDerWaalsContact O-CE 3.26Å; Q341-K369 WeakPolarHBondContact O-CE 3.23Å; Q341-K369 PolarHBondContact O-NZ 2.85Å; T342-K369 PolarHBondContact O-NZ 3.41Å; C345-K369 WeakPolarHBondContact SG-CE 3.45Å; K369-F371 PolarHBondContact O-N 2.8Å; K369-F371 VanDerWaalsContact O-N 3.09Å; K369-G385 CarbonylContact O-C 3.42Å; K369-G385 WeakPolarHBondContact O-CA 3.03Å; K369-R386 PolarHBondContact N-O 3.33Å; K369-R386 PolarHBondContact O-N 2.81Å
370	E	79.3	Confident	80.4	Confident	61 Å²	61	38.9 Å²	38.9	29%	0.285	23%	0.229	S	C	.	.	S	Bend	trans	53.2	32.5	174.7	-56	-179.9	167.2	0	0	113.4	F417 G418 T616	E370-F417 HydrophobicContact CB-CD2 4.44Å; E370-F417 WeakPolarHBondContact OE2-CD2 3.43Å; E370-F417 WeakPolarHBondContact OE2-CE2 3.5Å; E370-G418 PolarHBondContact O-N 3.49Å; E370-T616 VanDerWaalsContact N-CG2 3.28Å
371	F	85.8	Confident	81	Confident	8 Å²	8	35.2 Å²	35.2	4%	0.035	20%	0.204	C	C	.	.			trans	-78.9	162.1	166.5	63.8	-100.1	0	0	0	109.6	L338 R368 K369 A373 V382 T383 T616 A617	L338-F371 HydrophobicContact CB-CE2 4.05Å; L338-F371 HydrophobicContact CB-CZ 4.04Å; R368-F371 HydrophobicContact CB-CD1 3.9Å; R368-F371 VanDerWaalsContact O-CD1 3.3Å; R368-F371 WeakPolarHBondContact O-CD1 3.27Å; R368-F371 VanDerWaalsContact O-CE1 3.29Å; R368-F371 WeakPolarHBondContact O-CE1 3.49Å; K369-F371 PolarHBondContact O-N 2.8Å; K369-F371 VanDerWaalsContact O-N 3.09Å; F371-A373 HydrophobicContact CE2-CB 4.4Å; F371-V382 HydrophobicContact CB-CG1 4.25Å; F371-V382 HydrophobicContact CD2-CG1 3.55Å; F371-V382 HydrophobicContact CE2-CG1 3.96Å; F371-V382 HydrophobicContact CE2-CG2 4.45Å; F371-V382 HydrophobicContact CG-CG1 3.92Å; F371-T383 WeakPolarHBondContact CB-O 2.98Å; F371-T616 HydrophobicContact CD1-CG2 3.47Å; F371-T616 VanDerWaalsContact CD1-CG2 3.47Å; F371-T616 HydrophobicContact CD2-CG2 4.18Å; F371-T616 HydrophobicContact CE1-CG2 3.51Å; F371-T616 HydrophobicContact CE2-CG2 4.22Å; F371-T616 HydrophobicContact CG-CG2 3.83Å; F371-T616 HydrophobicContact CZ-CG2 3.91Å; F371-A617 HydrophobicContact CD2-CB 4.38Å; F371-A617 HydrophobicContact CE2-CB 3.91Å
372	S	87.9	Confident	81.4	Confident	16 Å²	16	33.3 Å²	33.3	11%	0.112	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	142.7	171.5	-160.6	0	0	0	0	109.4	T383 H419 S421	S372-T383 PolarHBondContact N-O 3.38Å; S372-T383 PolarHBondContact O-N 3.02Å; S372-T383 PolarHBondContact O-OG1 3.49Å; S372-T383 VanDerWaalsContact O-OG1 3.08Å; S372-H419 WeakPolarHBondContact CB-NE2 3.5Å; S372-H419 WeakPolarHBondContact CB-O 3.46Å; S372-S421 WeakPolarHBondContact CB-OG 3.43Å; S372-S421 WeakPolarHBondContact OG-CB 3.39Å; S372-S421 PolarHBondContact OG-N 3.44Å; S372-S421 PolarHBondContact OG-OG 3.46Å
373	A	89.3	Confident	82.1	Confident	12 Å²	12	31.3 Å²	31.3	10%	0.099	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	143.9	174.8	0	0	0	0	0	111.4	L338 F371 V380 Y381 V382 A617 V619	L338-A373 HydrophobicContact CD1-CB 3.29Å; F371-A373 HydrophobicContact CE2-CB 4.4Å; A373-V380 HydrophobicContact CB-CG1 4.34Å; A373-Y381 WeakPolarHBondContact CA-O 3.45Å; A373-V382 HydrophobicContact CB-CG2 4.17Å; A373-A617 HydrophobicContact CB-CB 3.46Å; A373-A617 VanDerWaalsContact CB-CB 3.46Å; A373-V619 HydrophobicContact CB-CG1 3.88Å; A373-V619 WeakPolarHBondContact O-CG1 3.29Å
374	C	88.8	Confident	82.4	Confident	13 Å²	13	27.3 Å²	27.3	9%	0.088	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	140	178.8	-174.9	0	0	0	0	109.5	Y381 A422 E423 L428	C374-Y381 PolarHBondContact N-O 3.39Å; C374-Y381 PolarHBondContact O-N 3.34Å; C374-A422 VanDerWaalsContact SG-C 3.59Å; C374-E423 PolarHBondContact SG-N 2.8Å; C374-L428 HydrophobicContact CB-CD1 3.4Å; C374-L428 VanDerWaalsContact CB-CD1 3.4Å
375	A	83.3	Confident	82.7	Confident	21 Å²	21	26.8 Å²	26.8	17%	0.174	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	135.8	177.1	0	0	0	0	0	110.3	K379 V619 S620 T621	A375-K379 WeakPolarHBondContact CA-O 3.36Å; A375-V619 HydrophobicContact CB-CB 4.25Å; A375-S620 WeakPolarHBondContact CB-O 3.08Å; A375-T621 HydrophobicContact CB-CG2 3.58Å
376	I	79.3	Confident	82.8	Confident	22 Å²	22	27.5 Å²	27.5	11%	0.113	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	106.8	168.9	-50	-178.2	0	0	0	106.4	C378 K379 Y381 E423 N426 L428 P457	I376-C378 PolarHBondContact O-N 2.87Å; I376-K379 PolarHBondContact N-O 3.22Å; I376-K379 PolarHBondContact O-N 3.32Å; I376-K379 VanDerWaalsContact O-N 3.1Å; I376-Y381 HydrophobicContact CB-CD2 4.29Å; I376-Y381 HydrophobicContact CB-CE2 3.83Å; I376-Y381 HydrophobicContact CD1-CD2 4.15Å; I376-Y381 HydrophobicContact CD1-CE2 4.06Å; I376-Y381 HydrophobicContact CG1-CD2 4Å; I376-Y381 HydrophobicContact CG1-CE2 3.97Å; I376-E423 HydrophobicContact CD1-CG 4.28Å; I376-E423 HydrophobicContact CG1-CB 4.17Å; I376-E423 HydrophobicContact CG1-CG 3.83Å; I376-E423 HydrophobicContact CG2-CG 4.33Å; I376-N426 HydrophobicContact CG2-CB 4.41Å; I376-L428 HydrophobicContact CD1-CB 3.99Å; I376-P457 HydrophobicContact CD1-CG 4.03Å
377	G	71.2	Confident	82.7	Confident	25 Å²	25	27.2 Å²	27.2	26%	0.258	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	-122	-173.5	0	0	0	0	0	113	W622	G377-W622 PolarHBondContact O-N 2.97Å
378	C	72.4	Confident	82.3	Confident	39 Å²	39	29.6 Å²	29.6	26%	0.264	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	12.3	176.7	-53.6	0	0	0	0	113.6	I376 T401 V402	I376-C378 PolarHBondContact O-N 2.87Å; C378-T401 PolarHBondContact O-N 3.49Å; C378-T401 PolarHBondContact O-OG1 2.82Å; C378-V402 HydrophobicContact CB-CG2 3.93Å
379	K	78.9	Confident	81.6	Confident	59 Å²	59	37.4 Å²	37.4	26%	0.257	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	134.7	-178.6	-66.6	-178.4	-177.8	177.1	0	110.8	A375 I376 Y381 I398 Y399	A375-K379 WeakPolarHBondContact CA-O 3.36Å; I376-K379 PolarHBondContact N-O 3.22Å; I376-K379 PolarHBondContact O-N 3.32Å; I376-K379 VanDerWaalsContact O-N 3.1Å; K379-Y381 HydrophobicContact CB-CD2 4.47Å; K379-Y381 HydrophobicContact CB-CE2 3.65Å; K379-I398 HydrophobicContact CB-CG2 4.12Å; K379-I398 HydrophobicContact CD-CG2 4.18Å; K379-I398 HydrophobicContact CG-CG2 4.43Å; K379-Y399 WeakPolarHBondContact CA-O 3.42Å
380	V	87.9	Confident	80.8	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125	173.1	-178.4	0	0	0	0	109.5	L336 L338 A373 V382 I398 Y399 T401 V619 T621	L336-V380 HydrophobicContact CD1-CG2 3.66Å; L338-V380 HydrophobicContact CD1-CG1 3.82Å; A373-V380 HydrophobicContact CB-CG1 4.34Å; V380-V382 HydrophobicContact CG1-CG2 4.41Å; V380-I398 CarbonylContact O-C 3.56Å; V380-I398 WeakPolarHBondContact O-CA 3.46Å; V380-Y399 PolarHBondContact N-O 3.06Å; V380-Y399 PolarHBondContact O-N 2.85Å; V380-T401 HydrophobicContact CG2-CG2 4.26Å; V380-V619 HydrophobicContact CG1-CG2 3.97Å; V380-V619 HydrophobicContact CG2-CG2 3.98Å; V380-T621 HydrophobicContact CG2-CG2 3.24Å
381	Y	89.8	Confident	80.5	Confident	13 Å²	13	37.4 Å²	37.4	5%	0.051	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	117.2	177.7	-63.4	-98.6	0	0	0	109.1	A373 C374 I376 K379 W397 I398 L428 Y455	A373-Y381 WeakPolarHBondContact CA-O 3.45Å; C374-Y381 PolarHBondContact N-O 3.39Å; C374-Y381 PolarHBondContact O-N 3.34Å; I376-Y381 HydrophobicContact CB-CD2 4.29Å; I376-Y381 HydrophobicContact CB-CE2 3.83Å; I376-Y381 HydrophobicContact CD1-CD2 4.15Å; I376-Y381 HydrophobicContact CD1-CE2 4.06Å; I376-Y381 HydrophobicContact CG1-CD2 4Å; I376-Y381 HydrophobicContact CG1-CE2 3.97Å; K379-Y381 HydrophobicContact CB-CD2 4.47Å; K379-Y381 HydrophobicContact CB-CE2 3.65Å; Y381-W397 CarbonylContact C-O 3.51Å; Y381-W397 WeakPolarHBondContact CA-O 2.96Å; Y381-I398 HydrophobicContact CD1-CB 4.47Å; Y381-I398 HydrophobicContact CD1-CD1 4.08Å; Y381-I398 HydrophobicContact CD1-CG1 3.67Å; Y381-I398 HydrophobicContact CD1-CG2 4.26Å; Y381-I398 HydrophobicContact CE1-CB 4.38Å; Y381-I398 HydrophobicContact CE1-CD1 3.61Å; Y381-I398 HydrophobicContact CE1-CG1 3.66Å; Y381-I398 HydrophobicContact CE1-CG2 3.87Å; Y381-L428 HydrophobicContact CD1-CD2 4.47Å; Y381-L428 HydrophobicContact CG-CD2 4.24Å; Y381-Y455 HydrophobicContact CD1-CE1 4.04Å; Y381-Y455 HydrophobicContact CE1-CD1 4.46Å; Y381-Y455 AromaticContact CE1-CE1 3.7Å; Y381-Y455 HydrophobicContact CE1-CE1 3.7Å
382	V	90.8	Very high	80.3	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.012	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	124.1	173.4	175.4	0	0	0	0	108.6	L338 L364 F371 A373 V380 V396 W397 W406	L338-V382 HydrophobicContact CD1-CG2 4.45Å; L364-V382 HydrophobicContact CD1-CG1 4.48Å; F371-V382 HydrophobicContact CB-CG1 4.25Å; F371-V382 HydrophobicContact CD2-CG1 3.55Å; F371-V382 HydrophobicContact CE2-CG1 3.96Å; F371-V382 HydrophobicContact CE2-CG2 4.45Å; F371-V382 HydrophobicContact CG-CG1 3.92Å; A373-V382 HydrophobicContact CB-CG2 4.17Å; V380-V382 HydrophobicContact CG1-CG2 4.41Å; V382-V396 WeakPolarHBondContact O-CA 3.46Å; V382-W397 HydrophobicContact CB-CB 4.29Å; V382-W397 PolarHBondContact N-O 3.21Å; V382-W397 PolarHBondContact O-N 2.75Å; V382-W406 HydrophobicContact CG2-CH2 3.98Å; V382-W406 HydrophobicContact CG2-CZ3 4.13Å
383	T	91.1	Very high	80.2	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	133.9	-173.6	56.6	0	0	0	0	112.2	F371 S372 V396 M412 H419 L428 V430 W462	F371-T383 WeakPolarHBondContact CB-O 2.98Å; S372-T383 PolarHBondContact N-O 3.38Å; S372-T383 PolarHBondContact O-N 3.02Å; S372-T383 PolarHBondContact O-OG1 3.49Å; S372-T383 VanDerWaalsContact O-OG1 3.08Å; T383-V396 HydrophobicContact CG2-CG1 4.21Å; T383-V396 HydrophobicContact CG2-CG2 4.32Å; T383-M412 HydrophobicContact CG2-SD 4.49Å; T383-H419 PolarHBondContact O-CE1 2.82Å; T383-H419 PolarHBondContact O-NE2 3.36Å; T383-H419 PolarHBondContact OG1-NE2 2.87Å; T383-L428 HydrophobicContact CG2-CD2 3.62Å; T383-V430 HydrophobicContact CG2-CG2 4.16Å; T383-W462 HydrophobicContact CG2-CH2 4.29Å; T383-W462 HydrophobicContact CG2-CZ2 4.44Å
384	G	88.3	Confident	80.1	Confident	1 Å²	1	43 Å²	43	1%	0.01	25%	0.249	C	C	.	.			trans	64.4	-138.5	168.4	0	0	0	0	0	114.7	R368 S393 D395	R368-G384 PolarHBondContact NH1-O 3.08Å; G384-S393 WeakPolarHBondContact CA-O 3.46Å; G384-D395 PolarHBondContact N-O 3.27Å; G384-D395 VanDerWaalsContact N-O 3.14Å
385	G	86.1	Confident	80.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.253	C	S	.	.			trans	94.2	177.4	-178.9	0	0	0	0	0	114	K369 S393 R416	K369-G385 CarbonylContact O-C 3.42Å; K369-G385 WeakPolarHBondContact O-CA 3.03Å; G385-S393 PolarHBondContact O-N 2.97Å; G385-S393 VanDerWaalsContact O-N 3.09Å; G385-R416 PolarHBondContact N-O 2.86Å
386	R	81.2	Confident	80.5	Confident	89 Å²	89	42.9 Å²	42.9	34%	0.336	25%	0.245	S	C	.	.	B	Isolated β-bridge	trans	-111.2	124.2	-177.9	-174.8	174.2	176.7	163.4	0.2	110.2	K369 N390 F417	K369-R386 PolarHBondContact N-O 3.33Å; K369-R386 PolarHBondContact O-N 2.81Å; R386-N390 VanDerWaalsContact CZ-OD1 3.29Å; R386-N390 PolarHBondContact NE-OD1 3.29Å; R386-N390 PolarHBondContact NH2-OD1 3.08Å; R386-F417 HydrophobicContact CB-CB 4.3Å; R386-F417 HydrophobicContact CB-CG 4.44Å
387	G	73.5	Confident	81	Confident	26 Å²	26	43.8 Å²	43.8	27%	0.268	25%	0.247	S	C	.	.			trans	-79	176.8	175.5	0	0	0	0	0	113.1	E389 N390 G391	G387-E389 VanDerWaalsContact C-N 3.28Å; G387-E389 PolarHBondContact O-N 3.21Å; G387-N390 PolarHBondContact O-N 3.45Å; G387-G391 PolarHBondContact N-O 3.19Å
388	S	66.2	Low	81.9	Confident	119 Å²	119	43.4 Å²	43.4	83%	0.832	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-33.1	177.8	48.3	0	0	0	0	113.6	N390	S388-N390 PolarHBondContact O-N 3.01Å
389	E	63.7	Low	82.5	Confident	179 Å²	179	41.7 Å²	41.7	84%	0.836	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	15.1	178.8	-60.9	-175.4	167.8	0	0	113.7	G387 G391	G387-E389 VanDerWaalsContact C-N 3.28Å; G387-E389 PolarHBondContact O-N 3.21Å; E389-G391 PolarHBondContact O-N 2.8Å
390	N	63.3	Low	82.4	Confident	99 Å²	99	40.2 Å²	40.2	53%	0.529	22%	0.222	S	C	.	.	S	Bend	trans	60.5	7.1	-172.2	-62.9	-41.5	0	0	0	115.4	R386 G387 S388	R386-N390 VanDerWaalsContact CZ-OD1 3.29Å; R386-N390 PolarHBondContact NE-OD1 3.29Å; R386-N390 PolarHBondContact NH2-OD1 3.08Å; G387-N390 PolarHBondContact O-N 3.45Å; S388-N390 PolarHBondContact O-N 3.01Å
391	G	71.9	Confident	81.6	Confident	43 Å²	43	41.2 Å²	41.2	44%	0.443	23%	0.227	S	C	.	.			trans	-65.5	131.3	170.7	0	0	0	0	0	111.2	G387 E389	G387-G391 PolarHBondContact N-O 3.19Å; E389-G391 PolarHBondContact O-N 2.8Å
392	V	82.3	Confident	80.5	Confident	26 Å²	26	42.8 Å²	42.8	16%	0.158	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-86.7	133.7	171.1	-174.7	0	0	0	0	107.9	A415 R416 F417 A436	V392-A415 HydrophobicContact CB-CB 4.32Å; V392-A415 HydrophobicContact CG1-CB 3.93Å; V392-A415 WeakPolarHBondContact CG1-O 3.41Å; V392-R416 VanDerWaalsContact CG1-C 3.47Å; V392-F417 HydrophobicContact CB-CD1 4.37Å; V392-F417 HydrophobicContact CG1-CD1 3.9Å; V392-F417 HydrophobicContact CG2-CD1 3.5Å; V392-F417 HydrophobicContact CG2-CE1 3.76Å; V392-A436 HydrophobicContact CB-CB 4.49Å; V392-A436 HydrophobicContact CG2-CB 3.47Å; V392-A436 VanDerWaalsContact CG2-CB 3.47Å
393	S	84.9	Confident	79.2	Confident	19 Å²	19	48.6 Å²	48.6	13%	0.133	27%	0.265	C	S	.	.			trans	-110.3	154.1	-174.8	-176.2	0	0	0	0	113.4	R368 G384 G385 D395 A415 R416	R368-S393 PolarHBondContact NH1-OG 2.63Å; R368-S393 PolarHBondContact NH2-OG 2.95Å; G384-S393 WeakPolarHBondContact CA-O 3.46Å; G385-S393 PolarHBondContact O-N 2.97Å; G385-S393 VanDerWaalsContact O-N 3.09Å; S393-D395 PolarHBondContact OG-N 3.14Å; S393-D395 PolarHBondContact OG-OD2 2.6Å; S393-A415 WeakPolarHBondContact O-CA 3.49Å; S393-R416 PolarHBondContact O-N 3.2Å
394	K	88.6	Confident	78.5	Confident	107 Å²	107	52.2 Å²	52.2	47%	0.465	28%	0.282	S	S	.	.			trans	-105.2	-1.5	171.4	63.1	177.2	-176.3	178.2	0	113.2	P411 M412 A415	K394-P411 HydrophobicContact CB-CB 4.45Å; K394-P411 HydrophobicContact CD-CB 4Å; K394-P411 HydrophobicContact CG-CB 3.91Å; K394-P411 CarbonylContact O-C 3.55Å; K394-P411 VanDerWaalsContact O-CA 3.31Å; K394-P411 WeakPolarHBondContact O-CA 3.33Å; K394-M412 HydrophobicContact CB-CB 4.24Å; K394-M412 PolarHBondContact O-N 3.1Å; K394-A415 HydrophobicContact CB-CB 4.2Å
395	D	89	Confident	78	Confident	33 Å²	33	58.5 Å²	58.5	18%	0.176	31%	0.311	C	S	.	.			trans	-66.4	150.2	-176	-60.7	-56.2	0	0	0	112	R368 G384 S393 K408	R368-D395 IonicContact CZ-OD2 3.68Å; R368-D395 IonicContact NH1-OD2 3.75Å; R368-D395 IonicContact NH2-OD2 2.78Å; R368-D395 PolarHBondContact NH2-OD2 2.81Å; G384-D395 PolarHBondContact N-O 3.27Å; G384-D395 VanDerWaalsContact N-O 3.14Å; S393-D395 PolarHBondContact OG-N 3.14Å; S393-D395 PolarHBondContact OG-OD2 2.6Å; D395-K408 WeakPolarHBondContact OD1-CE 3.17Å; D395-K408 IonicContact OD1-NZ 2.65Å; D395-K408 PolarHBondContact OD1-NZ 2.73Å
396	V	90.3	Very high	77.9	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	124.2	176.4	-177.6	0	0	0	0	107.6	V382 T383 G409 A410 M412 W462	V382-V396 WeakPolarHBondContact O-CA 3.46Å; T383-V396 HydrophobicContact CG2-CG1 4.21Å; T383-V396 HydrophobicContact CG2-CG2 4.32Å; V396-G409 PolarHBondContact O-N 3.14Å; V396-A410 VanDerWaalsContact CG2-O 3.25Å; V396-A410 WeakPolarHBondContact CG2-O 3.14Å; V396-M412 HydrophobicContact CG2-CG 3.83Å; V396-W462 HydrophobicContact CG2-CZ2 3.61Å
397	W	90.6	Very high	78.1	Confident	41 Å²	41	59.3 Å²	59.3	16%	0.155	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	135.5	176.4	-69.6	102.6	0	0	0	109.4	L364 P365 Y381 V382 W406 K408	L364-W397 HydrophobicContact CD1-CB 4.09Å; L364-W397 HydrophobicContact CD1-CG 4.15Å; P365-W397 HydrophobicContact CB-CH2 3.93Å; P365-W397 HydrophobicContact CB-CZ2 4.12Å; P365-W397 HydrophobicContact CB-CZ3 4.18Å; P365-W397 HydrophobicContact CG-CE3 4.17Å; P365-W397 HydrophobicContact CG-CH2 4.26Å; P365-W397 HydrophobicContact CG-CZ3 3.98Å; Y381-W397 CarbonylContact C-O 3.51Å; Y381-W397 WeakPolarHBondContact CA-O 2.96Å; V382-W397 HydrophobicContact CB-CB 4.29Å; V382-W397 PolarHBondContact N-O 3.21Å; V382-W397 PolarHBondContact O-N 2.75Å; W397-W406 HydrophobicContact CB-CE3 3.8Å; W397-W406 HydrophobicContact CB-CZ3 3.66Å; W397-K408 HydrophobicContact CE3-CB 4.22Å; W397-K408 HydrophobicContact CH2-CB 4.39Å; W397-K408 HydrophobicContact CH2-CD 4.29Å; W397-K408 HydrophobicContact CH2-CG 4.48Å; W397-K408 HydrophobicContact CZ2-CD 4.44Å; W397-K408 HydrophobicContact CZ3-CB 3.94Å; W397-K408 HydrophobicContact CZ3-CG 4.38Å
398	I	89.3	Confident	78.8	Confident	16 Å²	16	63.8 Å²	63.8	8%	0.082	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	114.7	-177.8	-50.5	172.8	0	0	0	106.7	K379 V380 Y381 S407	K379-I398 HydrophobicContact CB-CG2 4.12Å; K379-I398 HydrophobicContact CD-CG2 4.18Å; K379-I398 HydrophobicContact CG-CG2 4.43Å; V380-I398 CarbonylContact O-C 3.56Å; V380-I398 WeakPolarHBondContact O-CA 3.46Å; Y381-I398 HydrophobicContact CD1-CB 4.47Å; Y381-I398 HydrophobicContact CD1-CD1 4.08Å; Y381-I398 HydrophobicContact CD1-CG1 3.67Å; Y381-I398 HydrophobicContact CD1-CG2 4.26Å; Y381-I398 HydrophobicContact CE1-CB 4.38Å; Y381-I398 HydrophobicContact CE1-CD1 3.61Å; Y381-I398 HydrophobicContact CE1-CG1 3.66Å; Y381-I398 HydrophobicContact CE1-CG2 3.87Å; I398-S407 PolarHBondContact N-O 2.86Å; I398-S407 PolarHBondContact O-N 2.85Å; I398-S407 PolarHBondContact O-OG 2.85Å
399	Y	84.4	Confident	79.8	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.016	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	121.6	173.3	-177.9	-117.6	0	0	0	109	I348 K379 V380 T401 W406	I348-Y399 HydrophobicContact CD1-CD1 4.28Å; I348-Y399 HydrophobicContact CD1-CG 4.3Å; K379-Y399 WeakPolarHBondContact CA-O 3.42Å; V380-Y399 PolarHBondContact N-O 3.06Å; V380-Y399 PolarHBondContact O-N 2.85Å; Y399-T401 HydrophobicContact CD1-CG2 4.01Å; Y399-T401 HydrophobicContact CE1-CG2 4.08Å; Y399-W406 AromaticContact CD2-CD1 3.98Å; Y399-W406 AromaticContact CD2-CD2 3.81Å; Y399-W406 HydrophobicContact CD2-CD2 3.81Å; Y399-W406 AromaticContact CD2-CE2 3.66Å; Y399-W406 HydrophobicContact CD2-CE3 4.38Å; Y399-W406 HydrophobicContact CD2-CG 4.09Å; Y399-W406 HydrophobicContact CD2-CZ2 4.22Å; Y399-W406 AromaticContact CD2-NE1 3.7Å; Y399-W406 HydrophobicContact CG-CD2 4.33Å; Y399-W406 HydrophobicContact CG-CE3 4.5Å; Y399-W406 HydrophobicContact CG-CH2 4.46Å; Y399-W406 HydrophobicContact CG-CZ2 4.34Å
400	D	76.8	Confident	81	Confident	28 Å²	28	51 Å²	51	15%	0.15	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	114.8	172.3	-168.1	-17.8	0	0	0	109	V402 H403 E404 E405	D400-V402 PolarHBondContact O-N 3.1Å; D400-V402 VanDerWaalsContact OD1-CB 3.27Å; D400-V402 WeakPolarHBondContact OD1-CB 3.39Å; D400-V402 WeakPolarHBondContact OD1-CG2 3.31Å; D400-V402 PolarHBondContact OD1-N 2.94Å; D400-H403 IonicContact OD1-ND1 3.41Å; D400-H403 IonicContact OD2-CE1 2.63Å; D400-H403 IonicContact OD2-CG 3.04Å; D400-H403 IonicContact OD2-ND1 3.67Å; D400-H403 PolarHBondContact OD2-ND1 2.84Å; D400-E404 VanDerWaalsContact O-CA 3.25Å; D400-E404 WeakPolarHBondContact O-CA 3.3Å; D400-E404 PolarHBondContact O-N 2.93Å; D400-E405 PolarHBondContact N-O 3.09Å; D400-E405 PolarHBondContact O-N 3.43Å
401	T	71.1	Confident	82.3	Confident	20 Å²	20	49.1 Å²	49.1	12%	0.123	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-12.1	-179.9	64.9	0	0	0	0	112.9	L336 C378 V380 Y399 T621 W622	L336-T401 HydrophobicContact CD1-CG2 3.83Å; C378-T401 PolarHBondContact O-N 3.49Å; C378-T401 PolarHBondContact O-OG1 2.82Å; V380-T401 HydrophobicContact CG2-CG2 4.26Å; Y399-T401 HydrophobicContact CD1-CG2 4.01Å; Y399-T401 HydrophobicContact CE1-CG2 4.08Å; T401-T621 HydrophobicContact CG2-CG2 4.16Å; T401-W622 PolarHBondContact OG1-O 2.85Å
402	V	66.4	Low	83.2	Confident	47 Å²	47	47.3 Å²	47.3	29%	0.285	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-53.1	177.3	175.9	0	0	0	0	110.8	C378 D400 H624	C378-V402 HydrophobicContact CB-CG2 3.93Å; D400-V402 PolarHBondContact O-N 3.1Å; D400-V402 VanDerWaalsContact OD1-CB 3.27Å; D400-V402 WeakPolarHBondContact OD1-CB 3.39Å; D400-V402 WeakPolarHBondContact OD1-CG2 3.31Å; D400-V402 PolarHBondContact OD1-N 2.94Å; V402-H624 HydrophobicContact CB-CB 4.42Å; V402-H624 WeakPolarHBondContact CG1-CD2 3.48Å; V402-H624 HydrophobicContact CG2-CB 4.13Å
403	H	65.4	Low	83.5	Confident	124 Å²	124	50.5 Å²	50.5	57%	0.574	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-7.6	-175.6	-56.7	96.5	0	0	0	112.6	D400 E405	D400-H403 IonicContact OD1-ND1 3.41Å; D400-H403 IonicContact OD2-CE1 2.63Å; D400-H403 IonicContact OD2-CG 3.04Å; D400-H403 IonicContact OD2-ND1 3.67Å; D400-H403 PolarHBondContact OD2-ND1 2.84Å; H403-E405 HydrophobicContact CB-CB 4.4Å; H403-E405 HydrophobicContact CB-CG 4.34Å; H403-E405 PolarHBondContact O-N 3.44Å
404	E	75.4	Confident	83.6	Confident	75 Å²	75	51.6 Å²	51.6	35%	0.35	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	28.6	-173.5	-54.5	-165.4	160.8	0	0	114.2	K361 S362 D400	K361-E404 IonicContact NZ-OE1 2.82Å; K361-E404 PolarHBondContact NZ-OE1 2.83Å; S362-E404 WeakPolarHBondContact CB-O 3.45Å; S362-E404 PolarHBondContact OG-O 2.79Å; D400-E404 VanDerWaalsContact O-CA 3.25Å; D400-E404 WeakPolarHBondContact O-CA 3.3Å; D400-E404 PolarHBondContact O-N 2.93Å
405	E	77.8	Confident	83.5	Confident	134 Å²	134	47.8 Å²	47.8	63%	0.626	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	151	-175.8	-73.2	-175.1	175.5	0	0	112.9	D400 H403	D400-E405 PolarHBondContact N-O 3.09Å; D400-E405 PolarHBondContact O-N 3.43Å; H403-E405 HydrophobicContact CB-CB 4.4Å; H403-E405 HydrophobicContact CB-CG 4.34Å; H403-E405 PolarHBondContact O-N 3.44Å
406	W	83.8	Confident	83.5	Confident	46 Å²	46	46.2 Å²	46.2	17%	0.174	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	131.5	174.1	-74.3	100.9	0	0	0	111.4	I348 S362 D363 L364 P365 V382 W397 Y399	I348-W406 HydrophobicContact CD1-CH2 3.64Å; I348-W406 HydrophobicContact CD1-CZ2 3.12Å; I348-W406 HydrophobicContact CG1-CZ2 4Å; S362-W406 PolarHBondContact O-NE1 2.8Å; S362-W406 VanDerWaalsContact O-NE1 3.12Å; D363-W406 PolarHBondContact O-NE1 3.47Å; D363-W406 VanDerWaalsContact O-NE1 3.1Å; L364-W406 HydrophobicContact CB-CH2 4.28Å; L364-W406 HydrophobicContact CB-CZ2 3.82Å; L364-W406 HydrophobicContact CD1-CE3 4.19Å; L364-W406 HydrophobicContact CD1-CH2 3.27Å; L364-W406 HydrophobicContact CD1-CZ2 3.62Å; L364-W406 HydrophobicContact CD1-CZ3 3.59Å; L364-W406 HydrophobicContact CG-CH2 4.35Å; L364-W406 HydrophobicContact CG-CZ2 4.34Å; P365-W406 HydrophobicContact CG-CB 3.87Å; P365-W406 HydrophobicContact CG-CD2 4.5Å; P365-W406 HydrophobicContact CG-CG 3.95Å; V382-W406 HydrophobicContact CG2-CH2 3.98Å; V382-W406 HydrophobicContact CG2-CZ3 4.13Å; W397-W406 HydrophobicContact CB-CE3 3.8Å; W397-W406 HydrophobicContact CB-CZ3 3.66Å; Y399-W406 AromaticContact CD2-CD1 3.98Å; Y399-W406 AromaticContact CD2-CD2 3.81Å; Y399-W406 HydrophobicContact CD2-CD2 3.81Å; Y399-W406 AromaticContact CD2-CE2 3.66Å; Y399-W406 HydrophobicContact CD2-CE3 4.38Å; Y399-W406 HydrophobicContact CD2-CG 4.09Å; Y399-W406 HydrophobicContact CD2-CZ2 4.22Å; Y399-W406 AromaticContact CD2-NE1 3.7Å; Y399-W406 HydrophobicContact CG-CD2 4.33Å; Y399-W406 HydrophobicContact CG-CE3 4.5Å; Y399-W406 HydrophobicContact CG-CH2 4.46Å; Y399-W406 HydrophobicContact CG-CZ2 4.34Å
407	S	85.3	Confident	83.3	Confident	60 Å²	60	47 Å²	47	42%	0.42	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	156	171.5	61.4	0	0	0	0	110.9	I398	I398-S407 PolarHBondContact N-O 2.86Å; I398-S407 PolarHBondContact O-N 2.85Å; I398-S407 PolarHBondContact O-OG 2.85Å
408	K	87.7	Confident	83	Confident	120 Å²	120	45.3 Å²	45.3	52%	0.522	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	122.4	179.2	-165.6	172	-176.7	173.3	0	110	D395 W397	D395-K408 WeakPolarHBondContact OD1-CE 3.17Å; D395-K408 IonicContact OD1-NZ 2.65Å; D395-K408 PolarHBondContact OD1-NZ 2.73Å; W397-K408 HydrophobicContact CE3-CB 4.22Å; W397-K408 HydrophobicContact CH2-CB 4.39Å; W397-K408 HydrophobicContact CH2-CD 4.29Å; W397-K408 HydrophobicContact CH2-CG 4.48Å; W397-K408 HydrophobicContact CZ2-CD 4.44Å; W397-K408 HydrophobicContact CZ3-CB 3.94Å; W397-K408 HydrophobicContact CZ3-CG 4.38Å
409	G	87.9	Confident	83.1	Confident	8 Å²	8	45.1 Å²	45.1	8%	0.082	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-83.8	173.2	173.5	0	0	0	0	0	112.6	V396	V396-G409 PolarHBondContact O-N 3.14Å
410	A	88.8	Confident	83.3	Confident	21 Å²	21	45.3 Å²	45.3	17%	0.174	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-59	136.2	171.2	0	0	0	0	0	110.4	V396 Y455 N460 W462	V396-A410 VanDerWaalsContact CG2-O 3.25Å; V396-A410 WeakPolarHBondContact CG2-O 3.14Å; A410-Y455 HydrophobicContact CB-CE2 4.3Å; A410-N460 WeakPolarHBondContact CB-O 3.23Å; A410-N460 WeakPolarHBondContact CB-OD1 3.5Å; A410-N460 PolarHBondContact N-OD1 2.84Å; A410-W462 PolarHBondContact O-NE1 3.26Å
411	P	90.3	Very high	84.1	Confident	60 Å²	60	44.6 Å²	44.6	39%	0.39	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-68.3	146.3	-179.6	29.1	-34.5	0	0	0	110.9	K394 W462	K394-P411 HydrophobicContact CB-CB 4.45Å; K394-P411 HydrophobicContact CD-CB 4Å; K394-P411 HydrophobicContact CG-CB 3.91Å; K394-P411 CarbonylContact O-C 3.55Å; K394-P411 VanDerWaalsContact O-CA 3.31Å; K394-P411 WeakPolarHBondContact O-CA 3.33Å; P411-W462 PolarHBondContact O-NE1 2.79Å
412	M	91.4	Very high	85	Confident	4 Å²	4	43.9 Å²	43.9	2%	0.02	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-56.3	157.1	171.1	-61.8	-173.8	-61	0	0	111.2	T383 K394 V396 R416 V430 W462	T383-M412 HydrophobicContact CG2-SD 4.49Å; K394-M412 HydrophobicContact CB-CB 4.24Å; K394-M412 PolarHBondContact O-N 3.1Å; V396-M412 HydrophobicContact CG2-CG 3.83Å; M412-R416 HydrophobicContact CE-CG 3.88Å; M412-R416 HydrophobicContact SD-CG 4.39Å; M412-V430 HydrophobicContact SD-CG1 4.09Å; M412-V430 HydrophobicContact SD-CG2 4.32Å; M412-W462 HydrophobicContact CG-CD2 4.29Å; M412-W462 HydrophobicContact CG-CH2 3.83Å; M412-W462 HydrophobicContact CG-CZ2 3.53Å; M412-W462 HydrophobicContact CG-CZ3 4.32Å; M412-W462 HydrophobicContact SD-CH2 4.3Å; M412-W462 HydrophobicContact SD-CZ2 4.49Å
413	L	88.3	Confident	85.9	Confident	94 Å²	94	44.3 Å²	44.3	49%	0.492	24%	0.235	S	C	.	.	S	Bend	trans	-71.8	-36.3	176.3	-54.9	172.6	0	0	0	110.6	E453 W462 M464	L413-E453 WeakPolarHBondContact CA-OE2 3.13Å; L413-E453 WeakPolarHBondContact CB-OE2 3.43Å; L413-E453 WeakPolarHBondContact CG-OE2 3.23Å; L413-E453 PolarHBondContact N-OE2 3.02Å; L413-W462 HydrophobicContact CD1-CB 4.18Å; L413-W462 HydrophobicContact CD2-CB 4.17Å; L413-W462 HydrophobicContact CG-CB 3.81Å; L413-M464 HydrophobicContact CB-SD 4.5Å; L413-M464 HydrophobicContact CD1-CG 3.59Å; L413-M464 HydrophobicContact CD1-SD 3.6Å
414	I	86.7	Confident	86.6	Confident	41 Å²	41	38.6 Å²	38.6	21%	0.21	21%	0.209	C	C	.	.	S	Bend	trans	-121.7	127.9	-179.4	-54.2	173.4	0	0	0	110.4	R416 L449 Q451 E453	I414-R416 PolarHBondContact O-N 3.12Å; I414-L449 HydrophobicContact CG2-CD1 4.09Å; I414-Q451 HydrophobicContact CD1-CB 3.67Å; I414-Q451 HydrophobicContact CD1-CG 3.6Å; I414-E453 VanDerWaalsContact CB-OE1 3.28Å; I414-E453 WeakPolarHBondContact CB-OE1 3.46Å; I414-E453 PolarHBondContact N-OE1 2.84Å; I414-E453 VanDerWaalsContact N-OE1 3.08Å
415	A	86.9	Confident	86.6	Confident	27 Å²	27	39.9 Å²	39.9	22%	0.223	22%	0.215	C	C	.	.			trans	-69	123.4	170.8	0	0	0	0	0	110	V392 S393 K394 T435	V392-A415 HydrophobicContact CB-CB 4.32Å; V392-A415 HydrophobicContact CG1-CB 3.93Å; V392-A415 WeakPolarHBondContact CG1-O 3.41Å; S393-A415 WeakPolarHBondContact O-CA 3.49Å; K394-A415 HydrophobicContact CB-CB 4.2Å; A415-T435 WeakPolarHBondContact O-CB 3.46Å; A415-T435 PolarHBondContact O-OG1 2.91Å
416	R	88.8	Confident	86.3	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.202	C	C	.	.			trans	-146.8	156.9	-176.5	61.8	178.4	81.3	-145.5	6.6	114.6	G385 V392 S393 M412 I414 H419 V430 G432 H434 L449 Q451 E453	G385-R416 PolarHBondContact N-O 2.86Å; V392-R416 VanDerWaalsContact CG1-C 3.47Å; S393-R416 PolarHBondContact O-N 3.2Å; M412-R416 HydrophobicContact CE-CG 3.88Å; M412-R416 HydrophobicContact SD-CG 4.39Å; I414-R416 PolarHBondContact O-N 3.12Å; R416-H419 HydrophobicContact CG-CB 4.24Å; R416-V430 VanDerWaalsContact CD-CG1 3.43Å; R416-V430 HydrophobicContact CG-CG1 4.49Å; R416-G432 WeakPolarHBondContact CD-O 3.24Å; R416-G432 PolarHBondContact NH1-O 3.06Å; R416-H434 CarbonylContact C-O 3.57Å; R416-H434 WeakPolarHBondContact CA-O 3.38Å; R416-L449 HydrophobicContact CB-CD1 3.91Å; R416-Q451 PolarHBondContact NH1-O 3.42Å; R416-E453 IonicContact CZ-OE1 2.67Å; R416-E453 IonicContact NE-OE1 3.58Å; R416-E453 IonicContact NH2-OE1 2.63Å; R416-E453 PolarHBondContact NH2-OE1 3.5Å
417	F	87.4	Confident	86.2	Confident	16 Å²	16	35.4 Å²	35.4	7%	0.07	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-139.1	157	173.1	71	-85.9	0	0	0	111.1	E370 R386 V392 H419 G433 H434	E370-F417 HydrophobicContact CB-CD2 4.44Å; E370-F417 WeakPolarHBondContact OE2-CD2 3.43Å; E370-F417 WeakPolarHBondContact OE2-CE2 3.5Å; R386-F417 HydrophobicContact CB-CB 4.3Å; R386-F417 HydrophobicContact CB-CG 4.44Å; V392-F417 HydrophobicContact CB-CD1 4.37Å; V392-F417 HydrophobicContact CG1-CD1 3.9Å; V392-F417 HydrophobicContact CG2-CD1 3.5Å; V392-F417 HydrophobicContact CG2-CE1 3.76Å; F417-H419 PolarHBondContact O-N 3.17Å; F417-G433 WeakPolarHBondContact O-CA 3.46Å; F417-H434 HydrophobicContact CD1-CB 3.85Å; F417-H434 WeakPolarHBondContact CD1-O 3.4Å; F417-H434 HydrophobicContact CD2-CB 4.25Å; F417-H434 HydrophobicContact CE1-CB 3.38Å; F417-H434 HydrophobicContact CE2-CB 3.83Å; F417-H434 AromaticContact CE2-ND1 3.96Å; F417-H434 HydrophobicContact CG-CB 4.28Å; F417-H434 HydrophobicContact CZ-CB 3.38Å; F417-H434 AromaticContact CZ-CG 3.98Å; F417-H434 PolarHBondContact N-O 3.11Å; F417-H434 PolarHBondContact O-N 3.3Å
418	G	83.9	Confident	86.5	Confident	7 Å²	7	32.5 Å²	32.5	7%	0.072	18%	0.179	C	C	.	.	S	Bend	trans	62.4	24.2	-176.3	0	0	0	0	0	113.4	E370 N474	E370-G418 PolarHBondContact O-N 3.49Å; G418-N474 WeakPolarHBondContact CA-OD1 3.17Å; G418-N474 PolarHBondContact O-N 3.19Å
419	H	90.4	Very high	86.7	Confident	11 Å²	11	27 Å²	27	5%	0.051	16%	0.155	C	C	.	.			trans	-84.9	158.7	172.7	59.7	-79.4	0	0	0	110.6	S372 T383 R416 F417 V430 G432	S372-H419 WeakPolarHBondContact CB-NE2 3.5Å; S372-H419 WeakPolarHBondContact CB-O 3.46Å; T383-H419 PolarHBondContact O-CE1 2.82Å; T383-H419 PolarHBondContact O-NE2 3.36Å; T383-H419 PolarHBondContact OG1-NE2 2.87Å; R416-H419 HydrophobicContact CG-CB 4.24Å; F417-H419 PolarHBondContact O-N 3.17Å; H419-V430 HydrophobicContact CB-CG1 4.44Å; H419-G432 WeakPolarHBondContact CB-O 3.05Å
420	G	89.6	Confident	86.9	Confident	8 Å²	8	26.6 Å²	26.6	8%	0.082	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	149.9	168.3	0	0	0	0	0	110.8	V431	G420-V431 PolarHBondContact N-O 2.9Å; G420-V431 VanDerWaalsContact N-O 3.08Å; G420-V431 PolarHBondContact O-N 2.75Å
421	S	92	Very high	87.1	Confident	13 Å²	13	25.7 Å²	25.7	9%	0.091	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	144.7	170.4	65.7	0	0	0	0	110.6	S372 Y429	S372-S421 WeakPolarHBondContact CB-OG 3.43Å; S372-S421 WeakPolarHBondContact OG-CB 3.39Å; S372-S421 PolarHBondContact OG-N 3.44Å; S372-S421 PolarHBondContact OG-OG 3.46Å; S421-Y429 WeakPolarHBondContact CA-O 3.28Å
422	A	90.3	Very high	87	Confident	6 Å²	6	22.8 Å²	22.8	5%	0.05	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	149.2	178	0	0	0	0	0	110.4	C374 Y429 V477 L484	C374-A422 VanDerWaalsContact SG-C 3.59Å; A422-Y429 PolarHBondContact N-O 3.42Å; A422-Y429 PolarHBondContact O-N 3.2Å; A422-V477 HydrophobicContact CB-CG1 4.02Å; A422-L484 HydrophobicContact CB-CD2 3.75Å
423	E	85.5	Confident	86.8	Confident	56 Å²	56	22.7 Å²	22.7	26%	0.262	13%	0.125	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	128.8	173.6	177.7	-81	131.4	0	0	108.3	C374 I376 E425 N426 S479	C374-E423 PolarHBondContact SG-N 2.8Å; I376-E423 HydrophobicContact CD1-CG 4.28Å; I376-E423 HydrophobicContact CG1-CB 4.17Å; I376-E423 HydrophobicContact CG1-CG 3.83Å; I376-E423 HydrophobicContact CG2-CG 4.33Å; E423-E425 PolarHBondContact OE1-N 3.36Å; E423-N426 WeakPolarHBondContact OE1-CA 3.23Å; E423-N426 PolarHBondContact OE1-N 3.32Å; E423-S479 WeakPolarHBondContact O-CB 3.22Å; E423-S479 PolarHBondContact O-OG 3.15Å
424	L	81.1	Confident	86.6	Confident	4 Å²	4	19.3 Å²	19.3	2%	0.021	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	123.6	170.7	170.8	69.5	0	0	0	108.2	N426 C427 Y429 L482 L484 P505	L424-N426 PolarHBondContact O-N 2.64Å; L424-C427 PolarHBondContact N-O 3.01Å; L424-C427 PolarHBondContact O-N 3.19Å; L424-Y429 HydrophobicContact CB-CD2 3.78Å; L424-Y429 HydrophobicContact CB-CE2 3.69Å; L424-Y429 HydrophobicContact CD2-CE2 4Å; L424-Y429 HydrophobicContact CG-CE2 4.09Å; L424-Y429 WeakPolarHBondContact O-CE2 3.47Å; L424-L482 VanDerWaalsContact CD1-C 3.45Å; L424-L484 HydrophobicContact CB-CD2 3.94Å; L424-L484 HydrophobicContact CB-CG 4.32Å; L424-L484 HydrophobicContact CD2-CD1 4.21Å; L424-L484 HydrophobicContact CD2-CD2 4.35Å; L424-L484 HydrophobicContact CD2-CG 3.8Å; L424-P505 HydrophobicContact CD2-CB 4.15Å; L424-P505 HydrophobicContact CD2-CG 4.08Å
425	E	75.8	Confident	86.2	Confident	102 Å²	102	19 Å²	19	48%	0.477	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	41.4	-180	-59.9	-179.6	136.2	0	0	111.8	E423 C427 L482	E423-E425 PolarHBondContact OE1-N 3.36Å; E425-C427 PolarHBondContact O-N 2.97Å; E425-C427 VanDerWaalsContact O-N 3.08Å; E425-L482 HydrophobicContact CG-CD2 4.16Å
426	N	69.9	Low	85.2	Confident	67 Å²	67	20 Å²	20	36%	0.358	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	14	-177.4	-59	-29.8	0	0	0	115	V320 I376 E423 L424 P457	V320-N426 HydrophobicContact CG2-CB 4.43Å; V320-N426 WeakPolarHBondContact CG2-ND2 3.49Å; I376-N426 HydrophobicContact CG2-CB 4.41Å; E423-N426 WeakPolarHBondContact OE1-CA 3.23Å; E423-N426 PolarHBondContact OE1-N 3.32Å; L424-N426 PolarHBondContact O-N 2.64Å; N426-P457 WeakPolarHBondContact O-CD 3.37Å
427	C	82.6	Confident	83.5	Confident	18 Å²	18	25.5 Å²	25.5	12%	0.122	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	144.8	169.2	-64.3	0	0	0	0	109.5	L424 E425 Y429 R454 Y455	L424-C427 PolarHBondContact N-O 3.01Å; L424-C427 PolarHBondContact O-N 3.19Å; E425-C427 PolarHBondContact O-N 2.97Å; E425-C427 VanDerWaalsContact O-N 3.08Å; C427-Y429 HydrophobicContact CB-CD2 4.34Å; C427-Y429 HydrophobicContact CB-CE2 3.83Å; C427-R454 HydrophobicContact CB-CG 3.75Å; C427-Y455 WeakPolarHBondContact CA-O 3.44Å
428	L	90.6	Very high	81.4	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	121	174.5	176.9	65.8	0	0	0	109.1	C374 I376 Y381 T383 V430 R454 Y455 W462	C374-L428 HydrophobicContact CB-CD1 3.4Å; C374-L428 VanDerWaalsContact CB-CD1 3.4Å; I376-L428 HydrophobicContact CD1-CB 3.99Å; Y381-L428 HydrophobicContact CD1-CD2 4.47Å; Y381-L428 HydrophobicContact CG-CD2 4.24Å; T383-L428 HydrophobicContact CG2-CD2 3.62Å; L428-V430 HydrophobicContact CG-CG2 4.42Å; L428-R454 CarbonylContact O-C 3.58Å; L428-R454 WeakPolarHBondContact O-CA 3.37Å; L428-Y455 HydrophobicContact CB-CD1 4.18Å; L428-Y455 HydrophobicContact CD2-CD1 4.46Å; L428-Y455 PolarHBondContact N-O 3.4Å; L428-Y455 PolarHBondContact O-N 2.9Å; L428-W462 HydrophobicContact CD2-CH2 4.12Å
429	Y	92.2	Very high	79.5	Confident	3 Å²	3	32.7 Å²	32.7	1%	0.012	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	130.9	173.1	-73.2	-103.3	0	0	0	110.2	S421 A422 L424 C427 V452 E453 R454 M465 L484 Y503	S421-Y429 WeakPolarHBondContact CA-O 3.28Å; A422-Y429 PolarHBondContact N-O 3.42Å; A422-Y429 PolarHBondContact O-N 3.2Å; L424-Y429 HydrophobicContact CB-CD2 3.78Å; L424-Y429 HydrophobicContact CB-CE2 3.69Å; L424-Y429 HydrophobicContact CD2-CE2 4Å; L424-Y429 HydrophobicContact CG-CE2 4.09Å; L424-Y429 WeakPolarHBondContact O-CE2 3.47Å; C427-Y429 HydrophobicContact CB-CD2 4.34Å; C427-Y429 HydrophobicContact CB-CE2 3.83Å; Y429-V452 HydrophobicContact CD1-CG1 4.35Å; Y429-E453 WeakPolarHBondContact CA-O 3.44Å; Y429-R454 HydrophobicContact CD1-CB 3.97Å; Y429-R454 HydrophobicContact CD1-CG 4.23Å; Y429-R454 HydrophobicContact CD2-CG 4.29Å; Y429-R454 HydrophobicContact CE1-CB 3.78Å; Y429-R454 HydrophobicContact CE1-CG 3.82Å; Y429-R454 HydrophobicContact CE2-CG 3.88Å; Y429-R454 HydrophobicContact CG-CG 4.47Å; Y429-R454 VanDerWaalsContact CZ-CD 3.47Å; Y429-R454 VanDerWaalsContact OH-CD 3.27Å; Y429-R454 WeakPolarHBondContact OH-CD 3.28Å; Y429-M465 HydrophobicContact CD1-CG 4.43Å; Y429-M465 HydrophobicContact CE1-CG 4.05Å; Y429-L484 HydrophobicContact CD1-CD1 3.59Å; Y429-L484 HydrophobicContact CD2-CD1 4.12Å; Y429-L484 HydrophobicContact CE1-CD1 4.22Å; Y429-L484 HydrophobicContact CG-CD1 3.51Å; Y429-Y503 AromaticContact CE1-CE1 3.87Å; Y429-Y503 HydrophobicContact CE1-CE1 3.87Å
430	V	92.9	Very high	76.9	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	121.1	177	168.3	0	0	0	0	108.8	T383 M412 R416 H419 L428 V452 E453 W462	T383-V430 HydrophobicContact CG2-CG2 4.16Å; M412-V430 HydrophobicContact SD-CG1 4.09Å; M412-V430 HydrophobicContact SD-CG2 4.32Å; R416-V430 VanDerWaalsContact CD-CG1 3.43Å; R416-V430 HydrophobicContact CG-CG1 4.49Å; H419-V430 HydrophobicContact CB-CG1 4.44Å; L428-V430 HydrophobicContact CG-CG2 4.42Å; V430-V452 WeakPolarHBondContact O-CA 3.36Å; V430-E453 PolarHBondContact N-O 3.45Å; V430-E453 PolarHBondContact O-N 3.03Å; V430-W462 HydrophobicContact CB-CH2 4.34Å; V430-W462 HydrophobicContact CB-CZ3 4.06Å; V430-W462 HydrophobicContact CG2-CH2 3.58Å; V430-W462 HydrophobicContact CG2-CZ3 3.78Å
431	V	92.3	Very high	74.1	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.012	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	124.5	-166	179.9	0	0	0	0	110.6	G420 V452 L468 V477 V486 W510	G420-V431 PolarHBondContact N-O 2.9Å; G420-V431 VanDerWaalsContact N-O 3.08Å; G420-V431 PolarHBondContact O-N 2.75Å; V431-V452 HydrophobicContact CG1-CG2 4.14Å; V431-V452 HydrophobicContact CG2-CG1 3.92Å; V431-V452 HydrophobicContact CG2-CG2 4.34Å; V431-L468 HydrophobicContact CG1-CD1 3.76Å; V431-L468 HydrophobicContact CG1-CD2 3.84Å; V431-L468 HydrophobicContact CG1-CG 4.06Å; V431-V477 HydrophobicContact CB-CG1 4.24Å; V431-V477 HydrophobicContact CB-CG2 4.19Å; V431-V477 HydrophobicContact CG1-CG2 4.37Å; V431-V477 HydrophobicContact CG2-CG1 4.05Å; V431-V486 HydrophobicContact CG1-CG2 3.83Å; V431-W510 HydrophobicContact CG1-CH2 4.26Å; V431-W510 HydrophobicContact CG1-CZ2 4.44Å
432	G	88.8	Confident	71.9	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	31%	0.309	C	S	.	.			trans	66.5	-146.5	170.3	0	0	0	0	0	114.6	R416 H419 Q451 V472	R416-G432 WeakPolarHBondContact CD-O 3.24Å; R416-G432 PolarHBondContact NH1-O 3.06Å; H419-G432 WeakPolarHBondContact CB-O 3.05Å; G432-Q451 PolarHBondContact N-O 2.8Å; G432-V472 CarbonylContact C-O 3.53Å; G432-V472 WeakPolarHBondContact CA-O 3.36Å
433	G	86.4	Confident	69.6	Low	1 Å²	1	55.1 Å²	55.1	1%	0.01	34%	0.342	C	S	.	.			trans	94.8	-164.1	-177.9	0	0	0	0	0	113.4	F417 S448 L449 V472	F417-G433 WeakPolarHBondContact O-CA 3.46Å; G433-S448 CarbonylContact O-C 3.39Å; G433-S448 WeakPolarHBondContact O-CA 3.41Å; G433-L449 PolarHBondContact O-N 2.9Å; G433-V472 PolarHBondContact N-O 2.89Å
434	H	84	Confident	67.7	Low	23 Å²	23	56 Å²	56	11%	0.106	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	146.9	-177	-70.1	110.1	0	0	0	111.3	R416 F417 S446 S473	R416-H434 CarbonylContact C-O 3.57Å; R416-H434 WeakPolarHBondContact CA-O 3.38Å; F417-H434 HydrophobicContact CD1-CB 3.85Å; F417-H434 WeakPolarHBondContact CD1-O 3.4Å; F417-H434 HydrophobicContact CD2-CB 4.25Å; F417-H434 HydrophobicContact CE1-CB 3.38Å; F417-H434 HydrophobicContact CE2-CB 3.83Å; F417-H434 AromaticContact CE2-ND1 3.96Å; F417-H434 HydrophobicContact CG-CB 4.28Å; F417-H434 HydrophobicContact CZ-CB 3.38Å; F417-H434 AromaticContact CZ-CG 3.98Å; F417-H434 PolarHBondContact N-O 3.11Å; F417-H434 PolarHBondContact O-N 3.3Å; H434-S446 VanDerWaalsContact CB-OG 3.31Å; H434-S446 WeakPolarHBondContact CB-OG 3.15Å; H434-S446 PolarHBondContact CD2-OG 2.98Å; H434-S446 VanDerWaalsContact CG-OG 3.27Å; H434-S473 WeakPolarHBondContact CE1-CB 3.32Å; H434-S473 PolarHBondContact CE1-OG 3.34Å; H434-S473 WeakPolarHBondContact ND1-CB 3.42Å; H434-S473 PolarHBondContact NE2-OG 3.09Å; H434-S473 VanDerWaalsContact NE2-OG 3.16Å
435	T	79.3	Confident	66.3	Low	34 Å²	34	59.9 Å²	59.9	21%	0.209	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	142.8	166	-160.4	0	0	0	0	109.8	A415 L449	A415-T435 WeakPolarHBondContact O-CB 3.46Å; A415-T435 PolarHBondContact O-OG1 2.91Å; T435-L449 HydrophobicContact CG2-CD2 3.83Å
436	A	64.9	Low	65.4	Low	50 Å²	50	57.1 Å²	57.1	41%	0.413	37%	0.372	S	S	.	.			trans	-91.4	117.9	169	0	0	0	0	0	107.6	V392 A438	V392-A436 HydrophobicContact CB-CB 4.49Å; V392-A436 HydrophobicContact CG2-CB 3.47Å; V392-A436 VanDerWaalsContact CG2-CB 3.47Å; A436-A438 PolarHBondContact O-N 3.33Å
437	I	54.6	Low	65.2	Low	114 Å²	114	57.1 Å²	57.1	59%	0.585	37%	0.374	S	S	*	.			trans	-70.5	100.9	166.9	-63	169	0	0	0	106.3	G439	I437-G439 PolarHBondContact O-N 3.1Å
438	A	42.4	Very low	65	Low	102 Å²	102	56.5 Å²	56.5	84%	0.843	37%	0.37	S	S	*	.			trans	-69.2	119.1	166.6	0	0	0	0	0	108.4	A436	A436-A438 PolarHBondContact O-N 3.33Å
439	G	43.5	Very low	64.6	Low	73 Å²	73	57.2 Å²	57.2	75%	0.753	37%	0.373	S	S	*	.	S	Bend	trans	129.2	1.2	153.5	0	0	0	0	0	120.3	I437	I437-G439 PolarHBondContact O-N 3.1Å
440	V	36.8	Very low	64.4	Low	109 Å²	109	60.8 Å²	60.8	66%	0.661	39%	0.389	S	S	*	.			trans	-135.8	111.5	171.8	-171.6	0	0	0	0	110.9
441	F	30.6	Very low	64.3	Low	199 Å²	199	64 Å²	64	87%	0.873	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	138.4	161	-86.2	-92.6	0	0	0	108.6
442	P	46	Very low	64.3	Low	112 Å²	112	64 Å²	64	73%	0.727	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	cis	-79	144.4	7.6	32.4	-32.9	0	0	0	111.9	S444	P442-S444 PolarHBondContact O-N 3.31Å
443	A	42.4	Very low	64.5	Low	89 Å²	89	64 Å²	64	74%	0.736	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.8	102.6	-178.1	0	0	0	0	0	111.7
444	S	44.6	Very low	64.8	Low	73 Å²	73	67.5 Å²	67.5	51%	0.51	42%	0.417	S	S	.	.			trans	-61	135.2	172.2	-72.6	0	0	0	0	108.3	P442 S446	P442-S444 PolarHBondContact O-N 3.31Å; S444-S446 PolarHBondContact O-N 2.95Å
445	P	51.1	Low	65.2	Low	86 Å²	86	66.6 Å²	66.6	56%	0.558	41%	0.412	S	S	*	.			trans	-58.6	131	178.8	22.8	-30.6	0	0	0	108.8	V447	P445-V447 VanDerWaalsContact O-CG2 3.23Å; P445-V447 WeakPolarHBondContact O-CG2 3.45Å; P445-V447 PolarHBondContact O-N 2.82Å
446	S	56.8	Low	65.4	Low	45 Å²	45	66.4 Å²	66.4	32%	0.315	41%	0.41	S	S	.	.			trans	-42.5	109.6	168.4	-176.8	0	0	0	0	109.6	H434 S444	H434-S446 VanDerWaalsContact CB-OG 3.31Å; H434-S446 WeakPolarHBondContact CB-OG 3.15Å; H434-S446 PolarHBondContact CD2-OG 2.98Å; H434-S446 VanDerWaalsContact CG-OG 3.27Å; S444-S446 PolarHBondContact O-N 2.95Å
447	V	67	Low	66.1	Low	66 Å²	66	65 Å²	65	40%	0.4	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	127	-176.1	-175.5	0	0	0	0	108.4	P445 L449 I492	P445-V447 VanDerWaalsContact O-CG2 3.23Å; P445-V447 WeakPolarHBondContact O-CG2 3.45Å; P445-V447 PolarHBondContact O-N 2.82Å; V447-L449 PolarHBondContact O-N 2.93Å; V447-I492 HydrophobicContact CG1-CG2 4.19Å
448	S	78	Confident	67	Low	6 Å²	6	63.7 Å²	63.7	4%	0.042	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	127.8	173	-51.5	0	0	0	0	110.3	G433 S473 T490 I492	G433-S448 CarbonylContact O-C 3.39Å; G433-S448 WeakPolarHBondContact O-CA 3.41Å; S448-S473 PolarHBondContact OG-OG 2.88Å; S448-T490 PolarHBondContact OG-O 3.24Å; S448-I492 WeakPolarHBondContact O-CG1 3.44Å
449	L	82.7	Confident	68.7	Low	14 Å²	14	62.5 Å²	62.5	7%	0.073	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-78.8	146.5	-174.6	-64.4	175.4	0	0	0	111.4	I414 R416 G433 T435 V447 G471 V472	I414-L449 HydrophobicContact CG2-CD1 4.09Å; R416-L449 HydrophobicContact CB-CD1 3.91Å; G433-L449 PolarHBondContact O-N 2.9Å; T435-L449 HydrophobicContact CG2-CD2 3.83Å; V447-L449 PolarHBondContact O-N 2.93Å; L449-G471 WeakPolarHBondContact O-CA 3.42Å; L449-V472 PolarHBondContact O-N 2.84Å
450	K	88.1	Confident	70.7	Confident	79 Å²	79	62.6 Å²	62.6	34%	0.343	36%	0.356	S	S	.	.			trans	-97.2	-17.1	167.5	-64.9	-172	179.5	-155.9	0	112.2	P467 L468 R469	K450-P467 HydrophobicContact CB-CB 4.09Å; K450-P467 CarbonylContact O-C 3.56Å; K450-P467 VanDerWaalsContact O-CA 3.28Å; K450-P467 WeakPolarHBondContact O-CA 3.45Å; K450-L468 HydrophobicContact CB-CB 4.4Å; K450-L468 PolarHBondContact O-N 3.32Å; K450-R469 PolarHBondContact NZ-O 2.96Å
451	Q	89.1	Confident	73.2	Confident	68 Å²	68	63.9 Å²	63.9	32%	0.318	35%	0.353	S	S	.	.			trans	-68.6	134.4	-169.7	-68.1	83.8	-7.5	0	0	111.3	I414 R416 G432 M464	I414-Q451 HydrophobicContact CD1-CB 3.67Å; I414-Q451 HydrophobicContact CD1-CG 3.6Å; R416-Q451 PolarHBondContact NH1-O 3.42Å; G432-Q451 PolarHBondContact N-O 2.8Å; Q451-M464 HydrophobicContact CB-CE 4.01Å; Q451-M464 HydrophobicContact CG-CE 4.07Å
452	V	92.4	Very high	76.2	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	132.3	175.6	-179.6	0	0	0	0	108.2	Y429 V430 V431 M465 L468 W510	Y429-V452 HydrophobicContact CD1-CG1 4.35Å; V430-V452 WeakPolarHBondContact O-CA 3.36Å; V431-V452 HydrophobicContact CG1-CG2 4.14Å; V431-V452 HydrophobicContact CG2-CG1 3.92Å; V431-V452 HydrophobicContact CG2-CG2 4.34Å; V452-M465 HydrophobicContact CB-CB 4.31Å; V452-M465 HydrophobicContact CG1-CB 4.13Å; V452-M465 PolarHBondContact O-N 2.61Å; V452-L468 HydrophobicContact CG2-CG 3.97Å; V452-W510 HydrophobicContact CG1-CZ2 4.47Å; V452-W510 HydrophobicContact CG2-CZ2 3.82Å
453	E	93.5	Very high	78.5	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	139	179.5	-57.8	179.2	-135.6	0	0	109.3	L413 I414 R416 Y429 V430 W462 T463 M464	L413-E453 WeakPolarHBondContact CA-OE2 3.13Å; L413-E453 WeakPolarHBondContact CB-OE2 3.43Å; L413-E453 WeakPolarHBondContact CG-OE2 3.23Å; L413-E453 PolarHBondContact N-OE2 3.02Å; I414-E453 VanDerWaalsContact CB-OE1 3.28Å; I414-E453 WeakPolarHBondContact CB-OE1 3.46Å; I414-E453 PolarHBondContact N-OE1 2.84Å; I414-E453 VanDerWaalsContact N-OE1 3.08Å; R416-E453 IonicContact CZ-OE1 2.67Å; R416-E453 IonicContact NE-OE1 3.58Å; R416-E453 IonicContact NH2-OE1 2.63Å; R416-E453 PolarHBondContact NH2-OE1 3.5Å; Y429-E453 WeakPolarHBondContact CA-O 3.44Å; V430-E453 PolarHBondContact N-O 3.45Å; V430-E453 PolarHBondContact O-N 3.03Å; E453-W462 HydrophobicContact CB-CE3 3.6Å; E453-W462 HydrophobicContact CB-CZ3 3.88Å; E453-T463 WeakPolarHBondContact CA-O 3.31Å; E453-M464 HydrophobicContact CG-SD 3.74Å
454	R	93.8	Very high	80.8	Confident	75 Å²	75	52.7 Å²	52.7	28%	0.283	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123.2	174.7	179.4	-169.2	71	166.2	6.3	108.9	C427 L428 Y429 W462 T463 M465	C427-R454 HydrophobicContact CB-CG 3.75Å; L428-R454 CarbonylContact O-C 3.58Å; L428-R454 WeakPolarHBondContact O-CA 3.37Å; Y429-R454 HydrophobicContact CD1-CB 3.97Å; Y429-R454 HydrophobicContact CD1-CG 4.23Å; Y429-R454 HydrophobicContact CD2-CG 4.29Å; Y429-R454 HydrophobicContact CE1-CB 3.78Å; Y429-R454 HydrophobicContact CE1-CG 3.82Å; Y429-R454 HydrophobicContact CE2-CG 3.88Å; Y429-R454 HydrophobicContact CG-CG 4.47Å; Y429-R454 VanDerWaalsContact CZ-CD 3.47Å; Y429-R454 VanDerWaalsContact OH-CD 3.27Å; Y429-R454 WeakPolarHBondContact OH-CD 3.28Å; R454-W462 CarbonylContact O-C 3.6Å; R454-W462 WeakPolarHBondContact O-CA 3.24Å; R454-T463 PolarHBondContact N-O 2.9Å; R454-T463 PolarHBondContact NE-OG1 2.69Å; R454-T463 VanDerWaalsContact NE-OG1 3.11Å; R454-T463 PolarHBondContact NH2-OG1 2.85Å; R454-T463 PolarHBondContact O-N 2.86Å; R454-T463 PolarHBondContact O-OG1 2.84Å; R454-M465 HydrophobicContact CB-CG 3.57Å; R454-M465 HydrophobicContact CB-SD 3.76Å
455	Y	91.8	Very high	83.1	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.016	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	127	170	175	-103.7	0	0	0	109.9	Y381 A410 C427 L428 P457 N460 K461 W462	Y381-Y455 HydrophobicContact CD1-CE1 4.04Å; Y381-Y455 HydrophobicContact CE1-CD1 4.46Å; Y381-Y455 AromaticContact CE1-CE1 3.7Å; Y381-Y455 HydrophobicContact CE1-CE1 3.7Å; A410-Y455 HydrophobicContact CB-CE2 4.3Å; C427-Y455 WeakPolarHBondContact CA-O 3.44Å; L428-Y455 HydrophobicContact CB-CD1 4.18Å; L428-Y455 HydrophobicContact CD2-CD1 4.46Å; L428-Y455 PolarHBondContact N-O 3.4Å; L428-Y455 PolarHBondContact O-N 2.9Å; Y455-P457 HydrophobicContact CD1-CG 4.09Å; Y455-P457 HydrophobicContact CE1-CB 4.07Å; Y455-P457 HydrophobicContact CE1-CG 3.97Å; Y455-P457 WeakPolarHBondContact O-CD 3.14Å; Y455-N460 WeakPolarHBondContact CE2-OD1 3.47Å; Y455-N460 PolarHBondContact OH-OD1 2.86Å; Y455-K461 WeakPolarHBondContact CA-O 3.33Å; Y455-W462 VanDerWaalsContact CB-CH2 3.44Å; Y455-W462 VanDerWaalsContact CB-CZ2 3.48Å; Y455-W462 VanDerWaalsContact CB-CZ3 3.49Å; Y455-W462 AromaticContact CD2-CD1 3.76Å; Y455-W462 AromaticContact CD2-CD2 3.96Å; Y455-W462 HydrophobicContact CD2-CD2 3.96Å; Y455-W462 AromaticContact CD2-CE2 3.51Å; Y455-W462 HydrophobicContact CD2-CG 4.1Å; Y455-W462 AromaticContact CD2-CZ2 3.94Å; Y455-W462 HydrophobicContact CD2-CZ2 3.94Å; Y455-W462 AromaticContact CD2-NE1 3.38Å; Y455-W462 AromaticContact CE2-NE1 3.98Å; Y455-W462 HydrophobicContact CG-CD2 4.25Å; Y455-W462 AromaticContact CG-CE2 3.82Å; Y455-W462 HydrophobicContact CG-CH2 4.25Å; Y455-W462 AromaticContact CG-CZ2 3.81Å; Y455-W462 HydrophobicContact CG-CZ2 3.81Å
456	D	83.8	Confident	85	Confident	31 Å²	31	47.3 Å²	47.3	17%	0.166	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	112.5	170.8	173.7	8.3	0	0	0	108.5	L458 T459 N460 K461	D456-L458 PolarHBondContact O-N 2.98Å; D456-L458 VanDerWaalsContact OD1-CB 3.28Å; D456-L458 WeakPolarHBondContact OD1-CB 3.2Å; D456-L458 WeakPolarHBondContact OD1-CG 3.28Å; D456-L458 PolarHBondContact OD1-N 2.93Å; D456-T459 WeakPolarHBondContact CB-OG1 3.12Å; D456-T459 VanDerWaalsContact CG-OG1 3.26Å; D456-T459 PolarHBondContact O-N 3.02Å; D456-T459 VanDerWaalsContact OD2-CG2 3.28Å; D456-T459 WeakPolarHBondContact OD2-CG2 3.37Å; D456-T459 PolarHBondContact OD2-OG1 2.98Å; D456-N460 WeakPolarHBondContact O-CA 3.44Å; D456-N460 PolarHBondContact O-N 2.86Å; D456-K461 PolarHBondContact N-O 2.88Å; D456-K461 VanDerWaalsContact N-O 3.07Å; D456-K461 PolarHBondContact O-N 3.44Å
457	P	79.1	Confident	86.5	Confident	21 Å²	21	49 Å²	49	14%	0.136	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-26	177.3	-23.1	34.5	0	0	0	114.2	I376 N426 Y455	I376-P457 HydrophobicContact CD1-CG 4.03Å; N426-P457 WeakPolarHBondContact O-CD 3.37Å; Y455-P457 HydrophobicContact CD1-CG 4.09Å; Y455-P457 HydrophobicContact CE1-CB 4.07Å; Y455-P457 HydrophobicContact CE1-CG 3.97Å; Y455-P457 WeakPolarHBondContact O-CD 3.14Å
458	L	73.6	Confident	87.6	Confident	86 Å²	86	46.1 Å²	46.1	45%	0.45	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-47.8	-178	-53.4	173.1	0	0	0	110.3	N317 D456	N317-L458 WeakPolarHBondContact O-CD2 3.39Å; D456-L458 PolarHBondContact O-N 2.98Å; D456-L458 VanDerWaalsContact OD1-CB 3.28Å; D456-L458 WeakPolarHBondContact OD1-CB 3.2Å; D456-L458 WeakPolarHBondContact OD1-CG 3.28Å; D456-L458 PolarHBondContact OD1-N 2.93Å
459	T	78.2	Confident	88	Confident	77 Å²	77	52.2 Å²	52.2	47%	0.472	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-7.1	-179.1	59.3	0	0	0	0	113.6	D456 K461	D456-T459 WeakPolarHBondContact CB-OG1 3.12Å; D456-T459 VanDerWaalsContact CG-OG1 3.26Å; D456-T459 PolarHBondContact O-N 3.02Å; D456-T459 VanDerWaalsContact OD2-CG2 3.28Å; D456-T459 WeakPolarHBondContact OD2-CG2 3.37Å; D456-T459 PolarHBondContact OD2-OG1 2.98Å; T459-K461 WeakPolarHBondContact O-CG 3.38Å; T459-K461 PolarHBondContact O-N 3Å
460	N	85.9	Confident	88	Confident	74 Å²	74	54 Å²	54	40%	0.396	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	44.7	-174.1	-171	19.9	0	0	0	111.7	A410 Y455 D456	A410-N460 WeakPolarHBondContact CB-O 3.23Å; A410-N460 WeakPolarHBondContact CB-OD1 3.5Å; A410-N460 PolarHBondContact N-OD1 2.84Å; Y455-N460 WeakPolarHBondContact CE2-OD1 3.47Å; Y455-N460 PolarHBondContact OH-OD1 2.86Å; D456-N460 WeakPolarHBondContact O-CA 3.44Å; D456-N460 PolarHBondContact O-N 2.86Å
461	K	89.2	Confident	87.8	Confident	136 Å²	136	50.4 Å²	50.4	59%	0.591	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.6	143.6	-175.3	-77.2	174.6	-172	179.3	0	111.8	Y455 D456 T459	Y455-K461 WeakPolarHBondContact CA-O 3.33Å; D456-K461 PolarHBondContact N-O 2.88Å; D456-K461 VanDerWaalsContact N-O 3.07Å; D456-K461 PolarHBondContact O-N 3.44Å; T459-K461 WeakPolarHBondContact O-CG 3.38Å; T459-K461 PolarHBondContact O-N 3Å
462	W	93.6	Very high	87.6	Confident	23 Å²	23	47.3 Å²	47.3	9%	0.087	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	137.9	172.4	-70.8	91	0	0	0	110.7	T383 V396 A410 P411 M412 L413 L428 V430 E453 R454 Y455	T383-W462 HydrophobicContact CG2-CH2 4.29Å; T383-W462 HydrophobicContact CG2-CZ2 4.44Å; V396-W462 HydrophobicContact CG2-CZ2 3.61Å; A410-W462 PolarHBondContact O-NE1 3.26Å; P411-W462 PolarHBondContact O-NE1 2.79Å; M412-W462 HydrophobicContact CG-CD2 4.29Å; M412-W462 HydrophobicContact CG-CH2 3.83Å; M412-W462 HydrophobicContact CG-CZ2 3.53Å; M412-W462 HydrophobicContact CG-CZ3 4.32Å; M412-W462 HydrophobicContact SD-CH2 4.3Å; M412-W462 HydrophobicContact SD-CZ2 4.49Å; L413-W462 HydrophobicContact CD1-CB 4.18Å; L413-W462 HydrophobicContact CD2-CB 4.17Å; L413-W462 HydrophobicContact CG-CB 3.81Å; L428-W462 HydrophobicContact CD2-CH2 4.12Å; V430-W462 HydrophobicContact CB-CH2 4.34Å; V430-W462 HydrophobicContact CB-CZ3 4.06Å; V430-W462 HydrophobicContact CG2-CH2 3.58Å; V430-W462 HydrophobicContact CG2-CZ3 3.78Å; E453-W462 HydrophobicContact CB-CE3 3.6Å; E453-W462 HydrophobicContact CB-CZ3 3.88Å; R454-W462 CarbonylContact O-C 3.6Å; R454-W462 WeakPolarHBondContact O-CA 3.24Å; Y455-W462 VanDerWaalsContact CB-CH2 3.44Å; Y455-W462 VanDerWaalsContact CB-CZ2 3.48Å; Y455-W462 VanDerWaalsContact CB-CZ3 3.49Å; Y455-W462 AromaticContact CD2-CD1 3.76Å; Y455-W462 AromaticContact CD2-CD2 3.96Å; Y455-W462 HydrophobicContact CD2-CD2 3.96Å; Y455-W462 AromaticContact CD2-CE2 3.51Å; Y455-W462 HydrophobicContact CD2-CG 4.1Å; Y455-W462 AromaticContact CD2-CZ2 3.94Å; Y455-W462 HydrophobicContact CD2-CZ2 3.94Å; Y455-W462 AromaticContact CD2-NE1 3.38Å; Y455-W462 AromaticContact CE2-NE1 3.98Å; Y455-W462 HydrophobicContact CG-CD2 4.25Å; Y455-W462 AromaticContact CG-CE2 3.82Å; Y455-W462 HydrophobicContact CG-CH2 4.25Å; Y455-W462 AromaticContact CG-CZ2 3.81Å; Y455-W462 HydrophobicContact CG-CZ2 3.81Å
463	T	92.9	Very high	87.3	Confident	49 Å²	49	47.3 Å²	47.3	30%	0.301	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	135.3	178.8	47.9	0	0	0	0	109.6	E453 R454	E453-T463 WeakPolarHBondContact CA-O 3.31Å; R454-T463 PolarHBondContact N-O 2.9Å; R454-T463 PolarHBondContact NE-OG1 2.69Å; R454-T463 VanDerWaalsContact NE-OG1 3.11Å; R454-T463 PolarHBondContact NH2-OG1 2.85Å; R454-T463 PolarHBondContact O-N 2.86Å; R454-T463 PolarHBondContact O-OG1 2.84Å
464	M	92.2	Very high	86.9	Confident	94 Å²	94	48.6 Å²	48.6	46%	0.463	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	130	175.1	-71.5	-62.4	-55.2	0	0	109.7	L413 Q451 E453	L413-M464 HydrophobicContact CB-SD 4.5Å; L413-M464 HydrophobicContact CD1-CG 3.59Å; L413-M464 HydrophobicContact CD1-SD 3.6Å; Q451-M464 HydrophobicContact CB-CE 4.01Å; Q451-M464 HydrophobicContact CG-CE 4.07Å; E453-M464 HydrophobicContact CG-SD 3.74Å
465	M	93	Very high	86.6	Confident	27 Å²	27	45.7 Å²	45.7	13%	0.133	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	175.5	175	-53.2	-51.9	-67.2	0	0	110.3	Y429 V452 R454 Y503	Y429-M465 HydrophobicContact CD1-CG 4.43Å; Y429-M465 HydrophobicContact CE1-CG 4.05Å; V452-M465 HydrophobicContact CB-CB 4.31Å; V452-M465 HydrophobicContact CG1-CB 4.13Å; V452-M465 PolarHBondContact O-N 2.61Å; R454-M465 HydrophobicContact CB-CG 3.57Å; R454-M465 HydrophobicContact CB-SD 3.76Å; M465-Y503 WeakPolarHBondContact CE-OH 3.22Å
466	A	89.6	Confident	86.5	Confident	19 Å²	19	45.9 Å²	45.9	16%	0.157	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-57	133.8	176.1	0	0	0	0	0	111	Y503 N508 W510	A466-Y503 HydrophobicContact CB-CE2 4.34Å; A466-N508 WeakPolarHBondContact CB-O 3.38Å; A466-N508 WeakPolarHBondContact CB-OD1 3.39Å; A466-N508 PolarHBondContact N-OD1 2.96Å; A466-W510 PolarHBondContact O-NE1 3.29Å
467	P	89.9	Confident	86.9	Confident	81 Å²	81	45.1 Å²	45.1	53%	0.526	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-70	152.4	-180	30	-35	0	0	0	110.9	K450	K450-P467 HydrophobicContact CB-CB 4.09Å; K450-P467 CarbonylContact O-C 3.56Å; K450-P467 VanDerWaalsContact O-CA 3.28Å; K450-P467 WeakPolarHBondContact O-CA 3.45Å
468	L	88.8	Confident	87.4	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.021	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-53.4	150.1	169.1	-68.1	164.3	0	0	0	110.8	V431 K450 V452 D470 V472 V486 W510	V431-L468 HydrophobicContact CG1-CD1 3.76Å; V431-L468 HydrophobicContact CG1-CD2 3.84Å; V431-L468 HydrophobicContact CG1-CG 4.06Å; K450-L468 HydrophobicContact CB-CB 4.4Å; K450-L468 PolarHBondContact O-N 3.32Å; V452-L468 HydrophobicContact CG2-CG 3.97Å; L468-D470 WeakPolarHBondContact CB-O 3.43Å; L468-V472 HydrophobicContact CD1-CG2 3.86Å; L468-V486 HydrophobicContact CD2-CG2 4.16Å; L468-W510 HydrophobicContact CD2-CD2 3.88Å; L468-W510 HydrophobicContact CD2-CE3 3.85Å; L468-W510 HydrophobicContact CD2-CH2 3.6Å; L468-W510 HydrophobicContact CD2-CZ2 3.64Å; L468-W510 HydrophobicContact CD2-CZ3 3.7Å; L468-W510 HydrophobicContact CG-CZ2 4.44Å
469	R	86.2	Confident	87.9	Confident	134 Å²	134	42.2 Å²	42.2	51%	0.506	22%	0.224	S	C	.	.	S	Bend	trans	-66.8	-51.2	173.4	-56.2	-177.2	69.7	96.1	1.8	109.4	K450 W510	K450-R469 PolarHBondContact NZ-O 2.96Å; R469-W510 WeakPolarHBondContact CD-O 3.35Å; R469-W510 HydrophobicContact CG-CB 3.87Å; R469-W510 PolarHBondContact NH1-O 3.42Å
470	D	84.1	Confident	87.8	Confident	53 Å²	53	38.9 Å²	38.9	28%	0.283	20%	0.204	S	C	.	.	S	Bend	trans	-114.4	124.2	177.7	-66.4	-31	0	0	0	109.1	L468 V472 K499 Q501	L468-D470 WeakPolarHBondContact CB-O 3.43Å; D470-V472 PolarHBondContact O-N 3.42Å; D470-K499 VanDerWaalsContact OD2-CD 3.3Å; D470-K499 WeakPolarHBondContact OD2-CD 3.45Å; D470-K499 IonicContact OD2-NZ 2.62Å; D470-K499 PolarHBondContact OD2-NZ 3.42Å; D470-Q501 PolarHBondContact O-NE2 2.71Å
471	G	82.8	Confident	87.2	Confident	2 Å²	2	39.4 Å²	39.4	2%	0.021	20%	0.203	C	C	.	.			trans	-71.7	124.6	-178.4	0	0	0	0	0	109.8	L449 T491	L449-G471 WeakPolarHBondContact O-CA 3.42Å; G471-T491 WeakPolarHBondContact O-CA 3.49Å
472	V	85.9	Confident	86.5	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.018	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	151.1	-175.1	-66.9	0	0	0	0	111.5	G432 G433 L449 L468 D470 A475 V486 T490 A497	G432-V472 CarbonylContact C-O 3.53Å; G432-V472 WeakPolarHBondContact CA-O 3.36Å; G433-V472 PolarHBondContact N-O 2.89Å; L449-V472 PolarHBondContact O-N 2.84Å; L468-V472 HydrophobicContact CD1-CG2 3.86Å; D470-V472 PolarHBondContact O-N 3.42Å; V472-A475 HydrophobicContact CB-CB 4.11Å; V472-A475 HydrophobicContact CG2-CB 3.8Å; V472-V486 HydrophobicContact CG2-CG1 3.67Å; V472-T490 WeakPolarHBondContact CA-O 3.49Å; V472-A497 HydrophobicContact CG1-CB 4.21Å
473	S	85.8	Confident	85.9	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.007	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	151.2	175.4	58.2	0	0	0	0	110	H434 S448 A475 G489 T490	H434-S473 WeakPolarHBondContact CE1-CB 3.32Å; H434-S473 PolarHBondContact CE1-OG 3.34Å; H434-S473 WeakPolarHBondContact ND1-CB 3.42Å; H434-S473 PolarHBondContact NE2-OG 3.09Å; H434-S473 VanDerWaalsContact NE2-OG 3.16Å; S448-S473 PolarHBondContact OG-OG 2.88Å; S473-A475 PolarHBondContact O-N 2.89Å; S473-A475 VanDerWaalsContact O-N 3.16Å; S473-G489 CarbonylContact O-C 3.56Å; S473-G489 VanDerWaalsContact O-CA 3.24Å; S473-G489 WeakPolarHBondContact O-CA 3.41Å; S473-T490 PolarHBondContact N-O 2.81Å; S473-T490 PolarHBondContact O-N 2.66Å; S473-T490 PolarHBondContact OG-O 2.83Å; S473-T490 VanDerWaalsContact OG-O 3.13Å
474	N	85.6	Confident	85.7	Confident	27 Å²	27	39.3 Å²	39.3	14%	0.144	20%	0.204	C	C	.	.	S	Bend	trans	51.9	34.5	-173.9	-53.3	-42	0	0	0	112.7	G418 Y522	G418-N474 WeakPolarHBondContact CA-OD1 3.17Å; G418-N474 PolarHBondContact O-N 3.19Å; N474-Y522 HydrophobicContact CB-CD1 3.8Å; N474-Y522 HydrophobicContact CB-CE1 3.74Å; N474-Y522 VanDerWaalsContact CG-CE1 3.45Å; N474-Y522 VanDerWaalsContact ND2-CE1 3.29Å; N474-Y522 WeakPolarHBondContact ND2-CE1 3.47Å; N474-Y522 PolarHBondContact ND2-OH 3.47Å; N474-Y522 PolarHBondContact O-N 2.76Å
475	A	87.8	Confident	85.6	Confident	13 Å²	13	35.1 Å²	35.1	11%	0.107	18%	0.183	C	C	.	.			trans	-89.4	151.2	174.9	0	0	0	0	0	109.7	V472 S473 V486 G488	V472-A475 HydrophobicContact CB-CB 4.11Å; V472-A475 HydrophobicContact CG2-CB 3.8Å; S473-A475 PolarHBondContact O-N 2.89Å; S473-A475 VanDerWaalsContact O-N 3.16Å; A475-V486 HydrophobicContact CB-CG1 3.84Å; A475-G488 VanDerWaalsContact CB-O 3.31Å; A475-G488 WeakPolarHBondContact CB-O 3.23Å
476	A	89.6	Confident	85.5	Confident	8 Å²	8	33.9 Å²	33.9	7%	0.066	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	128.3	171.9	0	0	0	0	0	109.3	V486 F487 A525	A476-V486 WeakPolarHBondContact O-CA 3.27Å; A476-F487 HydrophobicContact CB-CB 4.41Å; A476-F487 PolarHBondContact N-O 2.83Å; A476-F487 PolarHBondContact O-N 2.86Å; A476-A525 HydrophobicContact CB-CB 3.6Å
477	V	91.2	Very high	85.5	Confident	16 Å²	16	33 Å²	33	10%	0.097	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	127.3	-176.7	-176.3	0	0	0	0	108.5	A422 V431 F485 V486	A422-V477 HydrophobicContact CB-CG1 4.02Å; V431-V477 HydrophobicContact CB-CG1 4.24Å; V431-V477 HydrophobicContact CB-CG2 4.19Å; V431-V477 HydrophobicContact CG1-CG2 4.37Å; V431-V477 HydrophobicContact CG2-CG1 4.05Å; V477-F485 WeakPolarHBondContact CA-O 3.36Å; V477-V486 HydrophobicContact CG1-CG2 4.36Å; V477-V486 HydrophobicContact CG2-CG1 4.32Å; V477-V486 HydrophobicContact CG2-CG2 4.15Å
478	V	89.2	Confident	85.4	Confident	13 Å²	13	29.2 Å²	29.2	8%	0.079	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	155.3	-177.5	-65.3	0	0	0	0	110.7	F485 F487 A525 V527 I532	V478-F485 HydrophobicContact CG2-CB 4.37Å; V478-F485 PolarHBondContact N-O 3.49Å; V478-F485 PolarHBondContact O-N 3.49Å; V478-F487 HydrophobicContact CG2-CD2 4.25Å; V478-F487 HydrophobicContact CG2-CE2 3.73Å; V478-A525 HydrophobicContact CG1-CB 3.65Å; V478-A525 HydrophobicContact CG2-CB 4.46Å; V478-V527 HydrophobicContact CB-CG2 3.79Å; V478-V527 HydrophobicContact CG1-CG2 4.37Å; V478-V527 HydrophobicContact CG2-CG2 4.06Å; V478-I532 HydrophobicContact CG2-CD1 4.22Å; V478-I532 HydrophobicContact CG2-CG2 3.66Å
479	S	84.3	Confident	85.2	Confident	33 Å²	33	29 Å²	29	23%	0.231	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132.4	173.6	54	0	0	0	0	111	E423 K483 V527	E423-S479 WeakPolarHBondContact O-CB 3.22Å; E423-S479 PolarHBondContact O-OG 3.15Å; S479-K483 CarbonylContact C-O 3.59Å; S479-K483 VanDerWaalsContact CA-O 3.31Å; S479-K483 WeakPolarHBondContact CA-O 3.24Å; S479-V527 VanDerWaalsContact O-CG2 3.26Å; S479-V527 WeakPolarHBondContact O-CG2 3.42Å
480	A	77.4	Confident	85.1	Confident	6 Å²	6	23.4 Å²	23.4	5%	0.05	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	139.2	174	0	0	0	0	0	109.7	L482 K483 F485 V527 I532	A480-L482 VanDerWaalsContact C-N 3.27Å; A480-L482 PolarHBondContact O-N 3.07Å; A480-K483 PolarHBondContact N-O 2.92Å; A480-K483 PolarHBondContact O-N 3.44Å; A480-F485 HydrophobicContact CB-CD2 4.25Å; A480-F485 HydrophobicContact CB-CE2 4.16Å; A480-V527 HydrophobicContact CB-CG1 4.21Å; A480-V527 HydrophobicContact CB-CG2 4.34Å; A480-I532 HydrophobicContact CB-CD1 3.68Å; A480-I532 HydrophobicContact CB-CG1 3.84Å
481	K	71.8	Confident	85.1	Confident	85 Å²	85	22 Å²	22	37%	0.37	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	46	48.1	179.8	-60.6	-168.5	-177.8	174.3	0	113.5	K483 C551 E552	K481-K483 PolarHBondContact O-N 3.25Å; K481-C551 VanDerWaalsContact CD-SG 3.51Å; K481-E552 HydrophobicContact CD-CG 4.4Å; K481-E552 IonicContact NZ-OE1 3.52Å; K481-E552 PolarHBondContact NZ-OE1 3.5Å; K481-E552 IonicContact NZ-OE2 2.71Å; K481-E552 PolarHBondContact NZ-OE2 3.32Å
482	L	75.1	Confident	84.7	Confident	116 Å²	116	25.2 Å²	25.2	61%	0.607	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.7	26.6	179.5	-53.4	173.6	0	0	0	114.6	L424 E425 A480 P505	L424-L482 VanDerWaalsContact CD1-C 3.45Å; E425-L482 HydrophobicContact CG-CD2 4.16Å; A480-L482 VanDerWaalsContact C-N 3.27Å; A480-L482 PolarHBondContact O-N 3.07Å; L482-P505 WeakPolarHBondContact O-CD 3.37Å; L482-P505 VanDerWaalsContact O-CG 3.29Å; L482-P505 WeakPolarHBondContact O-CG 3.49Å
483	K	81.2	Confident	84	Confident	90 Å²	90	32.4 Å²	32.4	39%	0.391	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	154.4	174.9	-65.4	-179.6	-175.8	176	0	110.3	S479 A480 K481 F485 Y503	S479-K483 CarbonylContact C-O 3.59Å; S479-K483 VanDerWaalsContact CA-O 3.31Å; S479-K483 WeakPolarHBondContact CA-O 3.24Å; A480-K483 PolarHBondContact N-O 2.92Å; A480-K483 PolarHBondContact O-N 3.44Å; K481-K483 PolarHBondContact O-N 3.25Å; K483-F485 HydrophobicContact CB-CD2 4.5Å; K483-F485 HydrophobicContact CB-CE2 3.83Å; K483-F485 HydrophobicContact CB-CZ 4.31Å; K483-Y503 WeakPolarHBondContact CB-O 3.31Å
484	L	87.8	Confident	83.3	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	140.2	169.9	-60.7	164.5	0	0	0	110	A422 L424 Y429 C502 Y503 W510	A422-L484 HydrophobicContact CB-CD2 3.75Å; L424-L484 HydrophobicContact CB-CD2 3.94Å; L424-L484 HydrophobicContact CB-CG 4.32Å; L424-L484 HydrophobicContact CD2-CD1 4.21Å; L424-L484 HydrophobicContact CD2-CD2 4.35Å; L424-L484 HydrophobicContact CD2-CG 3.8Å; Y429-L484 HydrophobicContact CD1-CD1 3.59Å; Y429-L484 HydrophobicContact CD2-CD1 4.12Å; Y429-L484 HydrophobicContact CE1-CD1 4.22Å; Y429-L484 HydrophobicContact CG-CD1 3.51Å; L484-C502 CarbonylContact O-C 3.49Å; L484-C502 VanDerWaalsContact O-CA 3.29Å; L484-C502 WeakPolarHBondContact O-CA 3.39Å; L484-Y503 HydrophobicContact CD1-CD1 3.88Å; L484-Y503 HydrophobicContact CG-CD1 4.38Å; L484-Y503 PolarHBondContact N-O 3.02Å; L484-Y503 PolarHBondContact O-N 3.06Å; L484-W510 HydrophobicContact CB-CH2 4.41Å
485	F	90	Very high	83	Confident	7 Å²	7	44 Å²	44	3%	0.031	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	137.8	173.7	-66.6	-94	0	0	0	109.8	V477 V478 A480 K483 F487 V500 Q501 C502 A513 I532 F549 C551	V477-F485 WeakPolarHBondContact CA-O 3.36Å; V478-F485 HydrophobicContact CG2-CB 4.37Å; V478-F485 PolarHBondContact N-O 3.49Å; V478-F485 PolarHBondContact O-N 3.49Å; A480-F485 HydrophobicContact CB-CD2 4.25Å; A480-F485 HydrophobicContact CB-CE2 4.16Å; K483-F485 HydrophobicContact CB-CD2 4.5Å; K483-F485 HydrophobicContact CB-CE2 3.83Å; K483-F485 HydrophobicContact CB-CZ 4.31Å; F485-F487 HydrophobicContact CB-CD2 4.23Å; F485-F487 HydrophobicContact CB-CE2 3.36Å; F485-F487 HydrophobicContact CB-CZ 3.63Å; F485-F487 HydrophobicContact CD1-CZ 4.33Å; F485-F487 HydrophobicContact CG-CE2 4.35Å; F485-F487 HydrophobicContact CG-CZ 4.21Å; F485-V500 HydrophobicContact CD1-CG1 4.23Å; F485-Q501 WeakPolarHBondContact CA-O 3.45Å; F485-C502 HydrophobicContact CD1-CB 3.94Å; F485-C502 HydrophobicContact CE1-CB 3.82Å; F485-C502 VanDerWaalsContact CE1-SG 3.54Å; F485-A513 HydrophobicContact CE1-CB 4.44Å; F485-I532 HydrophobicContact CB-CD1 4.18Å; F485-I532 HydrophobicContact CD2-CD1 3.73Å; F485-I532 HydrophobicContact CE2-CD1 4.22Å; F485-I532 HydrophobicContact CG-CD1 3.9Å; F485-F549 HydrophobicContact CD1-CE1 4.27Å; F485-F549 HydrophobicContact CE1-CE1 4.14Å; F485-C551 HydrophobicContact CE1-CB 4.35Å; F485-C551 HydrophobicContact CE2-CB 4.15Å; F485-C551 HydrophobicContact CZ-CB 3.74Å
486	V	92.1	Very high	82.5	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	120.3	178.6	-178.8	0	0	0	0	108	V431 L468 V472 A475 A476 V477 Q501 W510	V431-V486 HydrophobicContact CG1-CG2 3.83Å; L468-V486 HydrophobicContact CD2-CG2 4.16Å; V472-V486 HydrophobicContact CG2-CG1 3.67Å; A475-V486 HydrophobicContact CB-CG1 3.84Å; A476-V486 WeakPolarHBondContact O-CA 3.27Å; V477-V486 HydrophobicContact CG1-CG2 4.36Å; V477-V486 HydrophobicContact CG2-CG1 4.32Å; V477-V486 HydrophobicContact CG2-CG2 4.15Å; V486-Q501 HydrophobicContact CB-CB 4.28Å; V486-Q501 PolarHBondContact N-O 2.89Å; V486-Q501 PolarHBondContact O-N 2.69Å; V486-Q501 VanDerWaalsContact O-N 3.1Å; V486-W510 HydrophobicContact CB-CZ3 4.4Å; V486-W510 HydrophobicContact CG2-CH2 3.52Å; V486-W510 HydrophobicContact CG2-CZ3 3.55Å
487	F	90.2	Very high	82.1	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127.5	-176.4	-59.8	-84.9	0	0	0	110.7	A476 V478 F485 V500 I532 I534 F549 W556	A476-F487 HydrophobicContact CB-CB 4.41Å; A476-F487 PolarHBondContact N-O 2.83Å; A476-F487 PolarHBondContact O-N 2.86Å; V478-F487 HydrophobicContact CG2-CD2 4.25Å; V478-F487 HydrophobicContact CG2-CE2 3.73Å; F485-F487 HydrophobicContact CB-CD2 4.23Å; F485-F487 HydrophobicContact CB-CE2 3.36Å; F485-F487 HydrophobicContact CB-CZ 3.63Å; F485-F487 HydrophobicContact CD1-CZ 4.33Å; F485-F487 HydrophobicContact CG-CE2 4.35Å; F485-F487 HydrophobicContact CG-CZ 4.21Å; F487-V500 HydrophobicContact CD1-CB 4.39Å; F487-V500 HydrophobicContact CD1-CG1 3.78Å; F487-V500 HydrophobicContact CD1-CG2 3.8Å; F487-V500 HydrophobicContact CE1-CB 4.36Å; F487-V500 HydrophobicContact CE1-CG1 3.46Å; F487-V500 VanDerWaalsContact CE1-CG1 3.46Å; F487-V500 HydrophobicContact CE1-CG2 3.94Å; F487-V500 HydrophobicContact CZ-CG1 4.08Å; F487-I532 HydrophobicContact CE2-CD1 4.07Å; F487-I532 HydrophobicContact CE2-CG2 3.82Å; F487-I532 HydrophobicContact CZ-CB 4.48Å; F487-I532 HydrophobicContact CZ-CD1 3.85Å; F487-I532 HydrophobicContact CZ-CG2 4.07Å; F487-I534 HydrophobicContact CD1-CD1 4.41Å; F487-I534 HydrophobicContact CD1-CG1 4.23Å; F487-I534 HydrophobicContact CD2-CG1 4.41Å; F487-I534 HydrophobicContact CE1-CD1 4.28Å; F487-I534 HydrophobicContact CG-CG1 4.14Å; F487-I534 HydrophobicContact CZ-CD1 4.39Å; F487-F549 AromaticContact CE1-CD1 3.96Å; F487-F549 HydrophobicContact CE1-CD1 3.96Å; F487-F549 HydrophobicContact CE1-CE1 4.32Å; F487-F549 HydrophobicContact CE1-CG 4.17Å; F487-F549 AromaticContact CZ-CD1 3.84Å; F487-F549 HydrophobicContact CZ-CD1 3.84Å; F487-F549 HydrophobicContact CZ-CE1 4.27Å; F487-F549 HydrophobicContact CZ-CG 4.42Å; F487-W556 AromaticContact CD1-CH2 3.7Å; F487-W556 HydrophobicContact CD1-CH2 3.7Å; F487-W556 HydrophobicContact CD1-CZ2 4.15Å; F487-W556 AromaticContact CE1-CH2 3.7Å; F487-W556 HydrophobicContact CE1-CH2 3.7Å; F487-W556 HydrophobicContact CE1-CZ2 4.05Å
488	G	86.9	Confident	81.7	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.01	24%	0.235	C	C	.	.			trans	60.1	-148.7	174	0	0	0	0	0	114	A475 A497 W520	A475-G488 VanDerWaalsContact CB-O 3.31Å; A475-G488 WeakPolarHBondContact CB-O 3.23Å; G488-A497 WeakPolarHBondContact CA-O 3.27Å; G488-W520 CarbonylContact C-O 3.56Å; G488-W520 WeakPolarHBondContact CA-O 3.47Å
489	G	85.2	Confident	81.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.247	C	C	.	.			trans	101.9	-178	-176.8	0	0	0	0	0	113.3	S473 A497 W520	S473-G489 CarbonylContact O-C 3.56Å; S473-G489 VanDerWaalsContact O-CA 3.24Å; S473-G489 WeakPolarHBondContact O-CA 3.41Å; G489-A497 WeakPolarHBondContact O-CB 3.48Å; G489-A497 PolarHBondContact O-N 2.97Å; G489-W520 PolarHBondContact N-O 3.03Å
490	T	83.4	Confident	81.9	Confident	16 Å²	16	49.3 Å²	49.3	10%	0.098	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	123.6	176.8	-56.1	0	0	0	0	108.9	S448 V472 S473 R494	S448-T490 PolarHBondContact OG-O 3.24Å; V472-T490 WeakPolarHBondContact CA-O 3.49Å; S473-T490 PolarHBondContact N-O 2.81Å; S473-T490 PolarHBondContact O-N 2.66Å; S473-T490 PolarHBondContact OG-O 2.83Å; S473-T490 VanDerWaalsContact OG-O 3.13Å; T490-R494 HydrophobicContact CG2-CB 4.34Å
491	T	82.9	Confident	82.7	Confident	24 Å²	24	49.1 Å²	49.1	15%	0.147	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	171.1	176.9	65.3	0	0	0	0	111.8	G471 H493 R494 D495 A497	G471-T491 WeakPolarHBondContact O-CA 3.49Å; T491-H493 PolarHBondContact O-N 2.79Å; T491-H493 VanDerWaalsContact O-N 3.17Å; T491-R494 WeakPolarHBondContact O-CA 3.38Å; T491-R494 PolarHBondContact O-N 2.78Å; T491-D495 PolarHBondContact N-O 3.05Å; T491-D495 PolarHBondContact OG1-N 2.88Å; T491-D495 PolarHBondContact OG1-O 3.35Å; T491-D495 VanDerWaalsContact OG1-O 3.05Å; T491-A497 HydrophobicContact CG2-CB 3.82Å
492	I	74.6	Confident	83.6	Confident	70 Å²	70	45.8 Å²	45.8	36%	0.359	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-33.3	175.5	-59.9	166.2	0	0	0	112.2	V447 S448 R494	V447-I492 HydrophobicContact CG1-CG2 4.19Å; S448-I492 WeakPolarHBondContact O-CG1 3.44Å; I492-R494 PolarHBondContact O-N 2.95Å
493	H	73	Confident	84.4	Confident	154 Å²	154	40.2 Å²	40.2	71%	0.713	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	4.9	178.3	-59.4	-63.4	0	0	0	113.6	T491 D495	T491-H493 PolarHBondContact O-N 2.79Å; T491-H493 VanDerWaalsContact O-N 3.17Å; H493-D495 PolarHBondContact O-N 2.87Å
494	R	69.9	Low	84.6	Confident	170 Å²	170	37.6 Å²	37.6	64%	0.642	18%	0.183	S	C	*	.	S	Bend	trans	67.5	13.2	-173.9	-57.3	177.5	179.6	-104.9	-1.1	115.2	T490 T491 I492	T490-R494 HydrophobicContact CG2-CB 4.34Å; T491-R494 WeakPolarHBondContact O-CA 3.38Å; T491-R494 PolarHBondContact O-N 2.78Å; I492-R494 PolarHBondContact O-N 2.95Å
495	D	78.5	Confident	84.3	Confident	101 Å²	101	38.7 Å²	38.7	54%	0.54	19%	0.19	S	C	.	.	P	Polyproline II helix	trans	-80.5	150.4	172.8	-59	-43.6	0	0	0	111.2	T491 H493 A497	T491-D495 PolarHBondContact N-O 3.05Å; T491-D495 PolarHBondContact OG1-N 2.88Å; T491-D495 PolarHBondContact OG1-O 3.35Å; T491-D495 VanDerWaalsContact OG1-O 3.05Å; H493-D495 PolarHBondContact O-N 2.87Å; D495-A497 PolarHBondContact O-N 2.99Å
496	K	79.2	Confident	83.8	Confident	64 Å²	64	46.1 Å²	46.1	28%	0.278	23%	0.229	S	C	.	.	B	Isolated β-bridge	trans	-68.5	124.8	172.7	-64.3	-177.2	-179.8	-168	0	109.1	P519 D538	K496-P519 HydrophobicContact CB-CB 3.36Å; K496-P519 HydrophobicContact CD-CB 4.06Å; K496-P519 HydrophobicContact CG-CB 4.35Å; K496-D538 PolarHBondContact NZ-O 2.69Å; K496-D538 VanDerWaalsContact NZ-O 3.09Å; K496-D538 IonicContact NZ-OD1 2.76Å; K496-D538 PolarHBondContact NZ-OD1 3.37Å; K496-D538 IonicContact NZ-OD2 3.2Å
497	A	80.6	Confident	83.4	Confident	9 Å²	9	47.6 Å²	47.6	7%	0.074	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	131.5	178.5	0	0	0	0	0	110.7	V472 G488 G489 T491 D495 W520	V472-A497 HydrophobicContact CG1-CB 4.21Å; G488-A497 WeakPolarHBondContact CA-O 3.27Å; G489-A497 WeakPolarHBondContact O-CB 3.48Å; G489-A497 PolarHBondContact O-N 2.97Å; T491-A497 HydrophobicContact CG2-CB 3.82Å; D495-A497 PolarHBondContact O-N 2.99Å; A497-W520 PolarHBondContact O-N 2.82Å
498	S	83	Confident	83.4	Confident	43 Å²	43	51 Å²	51	30%	0.301	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-10.2	171.6	58.3	0	0	0	0	113	E515 C516	S498-E515 CarbonylContact O-C 3.6Å; S498-E515 WeakPolarHBondContact O-CA 3.46Å; S498-C516 WeakPolarHBondContact O-CB 3.33Å; S498-C516 PolarHBondContact O-N 3.16Å; S498-C516 PolarHBondContact O-SG 2.89Å
499	K	87.8	Confident	83.6	Confident	78 Å²	78	58 Å²	58	34%	0.339	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	134.8	-175.3	-61.7	172.9	-170.5	170.8	0	111.5	D470 I512	D470-K499 VanDerWaalsContact OD2-CD 3.3Å; D470-K499 WeakPolarHBondContact OD2-CD 3.45Å; D470-K499 IonicContact OD2-NZ 2.62Å; D470-K499 PolarHBondContact OD2-NZ 3.42Å; K499-I512 HydrophobicContact CB-CG2 4.44Å; K499-I512 HydrophobicContact CD-CD1 4.13Å
500	V	90.1	Very high	84	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	115.9	169.1	-174.9	0	0	0	0	108.9	F485 F487 I512 A513 A514 W556	F485-V500 HydrophobicContact CD1-CG1 4.23Å; F487-V500 HydrophobicContact CD1-CB 4.39Å; F487-V500 HydrophobicContact CD1-CG1 3.78Å; F487-V500 HydrophobicContact CD1-CG2 3.8Å; F487-V500 HydrophobicContact CE1-CB 4.36Å; F487-V500 HydrophobicContact CE1-CG1 3.46Å; F487-V500 VanDerWaalsContact CE1-CG1 3.46Å; F487-V500 HydrophobicContact CE1-CG2 3.94Å; F487-V500 HydrophobicContact CZ-CG1 4.08Å; V500-I512 WeakPolarHBondContact O-CA 3.5Å; V500-A513 HydrophobicContact CG1-CB 4.41Å; V500-A513 PolarHBondContact O-N 3.16Å; V500-A514 HydrophobicContact CB-CB 4.32Å; V500-A514 WeakPolarHBondContact CB-O 3.39Å; V500-A514 HydrophobicContact CG2-CB 4.16Å; V500-A514 PolarHBondContact N-O 2.93Å; V500-W556 HydrophobicContact CG2-CZ2 3.77Å
501	Q	92.5	Very high	84.3	Confident	3 Å²	3	60.3 Å²	60.3	1%	0.014	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	128	176.9	-59.5	-178.4	80.2	0	0	109.3	D470 F485 V486 W510 A511	D470-Q501 PolarHBondContact O-NE2 2.71Å; F485-Q501 WeakPolarHBondContact CA-O 3.45Å; V486-Q501 HydrophobicContact CB-CB 4.28Å; V486-Q501 PolarHBondContact N-O 2.89Å; V486-Q501 PolarHBondContact O-N 2.69Å; V486-Q501 VanDerWaalsContact O-N 3.1Å; Q501-W510 HydrophobicContact CB-CE3 3.81Å; Q501-W510 HydrophobicContact CB-CZ3 4.05Å; Q501-A511 WeakPolarHBondContact CA-O 3.32Å
502	C	92.4	Very high	84.7	Confident	14 Å²	14	62.9 Å²	62.9	10%	0.095	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	132	178.6	179.2	0	0	0	0	110.1	L484 F485 W510 A511 A513	L484-C502 CarbonylContact O-C 3.49Å; L484-C502 VanDerWaalsContact O-CA 3.29Å; L484-C502 WeakPolarHBondContact O-CA 3.39Å; F485-C502 HydrophobicContact CD1-CB 3.94Å; F485-C502 HydrophobicContact CE1-CB 3.82Å; F485-C502 VanDerWaalsContact CE1-SG 3.54Å; C502-W510 VanDerWaalsContact C-CE3 3.48Å; C502-W510 WeakPolarHBondContact O-CA 3.39Å; C502-A511 PolarHBondContact N-O 3.03Å; C502-A511 PolarHBondContact O-N 3.13Å; C502-A513 HydrophobicContact CB-CB 3.8Å
503	Y	91.2	Very high	85.3	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	127.5	176.4	-177.5	-115	0	0	0	110.6	Y429 M465 A466 K483 L484 P505 N508 R509 W510	Y429-Y503 AromaticContact CE1-CE1 3.87Å; Y429-Y503 HydrophobicContact CE1-CE1 3.87Å; M465-Y503 WeakPolarHBondContact CE-OH 3.22Å; A466-Y503 HydrophobicContact CB-CE2 4.34Å; K483-Y503 WeakPolarHBondContact CB-O 3.31Å; L484-Y503 HydrophobicContact CD1-CD1 3.88Å; L484-Y503 HydrophobicContact CG-CD1 4.38Å; L484-Y503 PolarHBondContact N-O 3.02Å; L484-Y503 PolarHBondContact O-N 3.06Å; Y503-P505 HydrophobicContact CD1-CB 4.5Å; Y503-P505 HydrophobicContact CE1-CB 4.01Å; Y503-N508 WeakPolarHBondContact CE2-OD1 3.42Å; Y503-N508 PolarHBondContact OH-OD1 2.97Å; Y503-R509 WeakPolarHBondContact CD2-O 3.43Å; Y503-W510 AromaticContact CD2-CD1 3.74Å; Y503-W510 AromaticContact CD2-CD2 3.91Å; Y503-W510 HydrophobicContact CD2-CD2 3.91Å; Y503-W510 AromaticContact CD2-CE2 3.52Å; Y503-W510 HydrophobicContact CD2-CG 4.06Å; Y503-W510 HydrophobicContact CD2-CZ2 4.01Å; Y503-W510 AromaticContact CD2-NE1 3.39Å; Y503-W510 AromaticContact CE2-NE1 3.94Å; Y503-W510 HydrophobicContact CG-CD2 4.3Å; Y503-W510 AromaticContact CG-CE2 3.9Å; Y503-W510 HydrophobicContact CG-CH2 4.4Å; Y503-W510 AromaticContact CG-CZ2 3.95Å; Y503-W510 HydrophobicContact CG-CZ2 3.95Å
504	D	86.3	Confident	86.1	Confident	35 Å²	35	54.4 Å²	54.4	19%	0.187	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	109.2	171.3	-179	3.5	0	0	0	108.7	L506 G507 N508 R509	D504-L506 VanDerWaalsContact C-N 3.33Å; D504-L506 PolarHBondContact O-N 3.4Å; D504-L506 PolarHBondContact OD1-N 2.79Å; D504-G507 PolarHBondContact O-N 2.88Å; D504-N508 WeakPolarHBondContact O-CA 3.21Å; D504-N508 PolarHBondContact O-N 2.85Å; D504-R509 HydrophobicContact CB-CG 4.34Å; D504-R509 PolarHBondContact N-O 2.81Å; D504-R509 PolarHBondContact O-N 2.79Å; D504-R509 IonicContact OD2-CZ 3.56Å; D504-R509 IonicContact OD2-NE 2.68Å; D504-R509 IonicContact OD2-NH2 3.8Å; D504-R509 PolarHBondContact OD2-NH2 3.15Å
505	P	79.6	Confident	86.9	Confident	23 Å²	23	52.7 Å²	52.7	15%	0.149	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-34.1	-177.5	26.9	-34.5	0	0	0	112.4	L424 L482 Y503 G507 N508	L424-P505 HydrophobicContact CD2-CB 4.15Å; L424-P505 HydrophobicContact CD2-CG 4.08Å; L482-P505 WeakPolarHBondContact O-CD 3.37Å; L482-P505 VanDerWaalsContact O-CG 3.29Å; L482-P505 WeakPolarHBondContact O-CG 3.49Å; Y503-P505 HydrophobicContact CD1-CB 4.5Å; Y503-P505 HydrophobicContact CE1-CB 4.01Å; P505-G507 VanDerWaalsContact C-N 3.34Å; P505-G507 PolarHBondContact O-N 2.89Å; P505-N508 PolarHBondContact O-N 3.45Å
506	L	80.5	Confident	87.2	Confident	163 Å²	163	48.4 Å²	48.4	85%	0.853	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-39.5	180	-64.2	175.7	0	0	0	111.6	D504	D504-L506 VanDerWaalsContact C-N 3.33Å; D504-L506 PolarHBondContact O-N 3.4Å; D504-L506 PolarHBondContact OD1-N 2.79Å
507	G	83.2	Confident	87.3	Confident	32 Å²	32	48.7 Å²	48.7	33%	0.33	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-3.8	178.3	0	0	0	0	0	114.5	D504 P505 R509	D504-G507 PolarHBondContact O-N 2.88Å; P505-G507 VanDerWaalsContact C-N 3.34Å; P505-G507 PolarHBondContact O-N 2.89Å; G507-R509 VanDerWaalsContact C-N 3.25Å; G507-R509 PolarHBondContact O-N 3.08Å
508	N	90.1	Very high	87.2	Confident	71 Å²	71	48.6 Å²	48.6	38%	0.38	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	37.4	55.5	-168.4	-173	22.8	0	0	0	112.2	A466 Y503 D504 P505	A466-N508 WeakPolarHBondContact CB-O 3.38Å; A466-N508 WeakPolarHBondContact CB-OD1 3.39Å; A466-N508 PolarHBondContact N-OD1 2.96Å; Y503-N508 WeakPolarHBondContact CE2-OD1 3.42Å; Y503-N508 PolarHBondContact OH-OD1 2.97Å; D504-N508 WeakPolarHBondContact O-CA 3.21Å; D504-N508 PolarHBondContact O-N 2.85Å; P505-N508 PolarHBondContact O-N 3.45Å
509	R	91.6	Very high	87.1	Confident	149 Å²	149	48.2 Å²	48.2	56%	0.562	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.5	152.1	-174.5	65.3	180	177.4	-121.4	-15.3	112.2	Y503 D504 G507	Y503-R509 WeakPolarHBondContact CD2-O 3.43Å; D504-R509 HydrophobicContact CB-CG 4.34Å; D504-R509 PolarHBondContact N-O 2.81Å; D504-R509 PolarHBondContact O-N 2.79Å; D504-R509 IonicContact OD2-CZ 3.56Å; D504-R509 IonicContact OD2-NE 2.68Å; D504-R509 IonicContact OD2-NH2 3.8Å; D504-R509 PolarHBondContact OD2-NH2 3.15Å; G507-R509 VanDerWaalsContact C-N 3.25Å; G507-R509 PolarHBondContact O-N 3.08Å
510	W	92.8	Very high	86.8	Confident	14 Å²	14	44.6 Å²	44.6	5%	0.053	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	131.7	174.9	-70	90.2	0	0	0	111.6	V431 V452 A466 L468 R469 L484 V486 Q501 C502 Y503	V431-W510 HydrophobicContact CG1-CH2 4.26Å; V431-W510 HydrophobicContact CG1-CZ2 4.44Å; V452-W510 HydrophobicContact CG1-CZ2 4.47Å; V452-W510 HydrophobicContact CG2-CZ2 3.82Å; A466-W510 PolarHBondContact O-NE1 3.29Å; L468-W510 HydrophobicContact CD2-CD2 3.88Å; L468-W510 HydrophobicContact CD2-CE3 3.85Å; L468-W510 HydrophobicContact CD2-CH2 3.6Å; L468-W510 HydrophobicContact CD2-CZ2 3.64Å; L468-W510 HydrophobicContact CD2-CZ3 3.7Å; L468-W510 HydrophobicContact CG-CZ2 4.44Å; R469-W510 WeakPolarHBondContact CD-O 3.35Å; R469-W510 HydrophobicContact CG-CB 3.87Å; R469-W510 PolarHBondContact NH1-O 3.42Å; L484-W510 HydrophobicContact CB-CH2 4.41Å; V486-W510 HydrophobicContact CB-CZ3 4.4Å; V486-W510 HydrophobicContact CG2-CH2 3.52Å; V486-W510 HydrophobicContact CG2-CZ3 3.55Å; Q501-W510 HydrophobicContact CB-CE3 3.81Å; Q501-W510 HydrophobicContact CB-CZ3 4.05Å; C502-W510 VanDerWaalsContact C-CE3 3.48Å; C502-W510 WeakPolarHBondContact O-CA 3.39Å; Y503-W510 AromaticContact CD2-CD1 3.74Å; Y503-W510 AromaticContact CD2-CD2 3.91Å; Y503-W510 HydrophobicContact CD2-CD2 3.91Å; Y503-W510 AromaticContact CD2-CE2 3.52Å; Y503-W510 HydrophobicContact CD2-CG 4.06Å; Y503-W510 HydrophobicContact CD2-CZ2 4.01Å; Y503-W510 AromaticContact CD2-NE1 3.39Å; Y503-W510 AromaticContact CE2-NE1 3.94Å; Y503-W510 HydrophobicContact CG-CD2 4.3Å; Y503-W510 AromaticContact CG-CE2 3.9Å; Y503-W510 HydrophobicContact CG-CH2 4.4Å; Y503-W510 AromaticContact CG-CZ2 3.95Å; Y503-W510 HydrophobicContact CG-CZ2 3.95Å
511	A	91.5	Very high	86.3	Confident	50 Å²	50	48.6 Å²	48.6	41%	0.413	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	157.5	172.4	0	0	0	0	0	110.4	Q501 C502	Q501-A511 WeakPolarHBondContact CA-O 3.32Å; C502-A511 PolarHBondContact N-O 3.03Å; C502-A511 PolarHBondContact O-N 3.13Å
512	I	91.1	Very high	85.7	Confident	77 Å²	77	51.3 Å²	51.3	40%	0.395	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	115.8	168.6	-59.5	171	0	0	0	105.9	K499 V500	K499-I512 HydrophobicContact CB-CG2 4.44Å; K499-I512 HydrophobicContact CD-CD1 4.13Å; V500-I512 WeakPolarHBondContact O-CA 3.5Å
513	A	87.3	Confident	85.4	Confident	29 Å²	29	51.2 Å²	51.2	24%	0.24	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-40.5	-175.4	0	0	0	0	0	112.3	F485 V500 C502	F485-A513 HydrophobicContact CE1-CB 4.44Å; V500-A513 HydrophobicContact CG1-CB 4.41Å; V500-A513 PolarHBondContact O-N 3.16Å; C502-A513 HydrophobicContact CB-CB 3.8Å
514	A	88.6	Confident	85.2	Confident	17 Å²	17	51.5 Å²	51.5	14%	0.14	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	174.1	-177.8	0	0	0	0	0	110.3	V500 F549 N554	V500-A514 HydrophobicContact CB-CB 4.32Å; V500-A514 WeakPolarHBondContact CB-O 3.39Å; V500-A514 HydrophobicContact CG2-CB 4.16Å; V500-A514 PolarHBondContact N-O 2.93Å; A514-F549 HydrophobicContact CB-CE2 3.85Å; A514-F549 HydrophobicContact CB-CZ 4.14Å; A514-N554 HydrophobicContact CB-CB 4.33Å
515	E	87.5	Confident	85.3	Confident	135 Å²	135	50.5 Å²	50.5	63%	0.631	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.7	140.5	163	-65.2	-174	169	0	0	109.1	S498 W556	S498-E515 CarbonylContact O-C 3.6Å; S498-E515 WeakPolarHBondContact O-CA 3.46Å; E515-W556 PolarHBondContact O-NE1 2.8Å
516	C	83.6	Confident	85.6	Confident	10 Å²	10	49.7 Å²	49.7	7%	0.068	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	144.8	172.4	-60.1	0	0	0	0	108.8	S498 Q518 W520	S498-C516 WeakPolarHBondContact O-CB 3.33Å; S498-C516 PolarHBondContact O-N 3.16Å; S498-C516 PolarHBondContact O-SG 2.89Å; C516-Q518 WeakPolarHBondContact CB-O 3.31Å; C516-Q518 PolarHBondContact O-N 3.3Å; C516-W520 HydrophobicContact CB-CD2 4.36Å; C516-W520 HydrophobicContact CB-CE3 3.74Å; C516-W520 HydrophobicContact CB-CH2 4.22Å; C516-W520 HydrophobicContact CB-CZ3 3.65Å; C516-W520 VanDerWaalsContact SG-CE3 3.55Å; C516-W520 VanDerWaalsContact SG-CZ3 3.59Å
517	P	82.6	Confident	85.4	Confident	71 Å²	71	43.8 Å²	43.8	46%	0.461	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	-23.9	176	-24.8	34.3	0	0	0	113.4	W520 Y547 W556	P517-W520 HydrophobicContact CG-CH2 4.33Å; P517-Y547 HydrophobicContact CG-CD1 4.37Å; P517-Y547 HydrophobicContact CG-CE1 4.45Å; P517-W556 HydrophobicContact CG-CB 3.8Å; P517-W556 HydrophobicContact CG-CD2 3.78Å; P517-W556 HydrophobicContact CG-CE3 4.18Å; P517-W556 HydrophobicContact CG-CG 3.58Å
518	Q	78.4	Confident	84.6	Confident	7 Å²	7	43.1 Å²	43.1	3%	0.033	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	159.9	175.6	54.4	172.2	-16.6	0	0	110.1	C516 W520	C516-Q518 WeakPolarHBondContact CB-O 3.31Å; C516-Q518 PolarHBondContact O-N 3.3Å; Q518-W520 HydrophobicContact CG-CZ2 4.1Å; Q518-W520 VanDerWaalsContact CG-NE1 3.25Å
519	P	79.9	Confident	83.4	Confident	34 Å²	34	43.1 Å²	43.1	22%	0.221	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	132.7	175.6	-17.2	31.3	0	0	0	112.2	K496	K496-P519 HydrophobicContact CB-CB 3.36Å; K496-P519 HydrophobicContact CD-CB 4.06Å; K496-P519 HydrophobicContact CG-CB 4.35Å
520	W	82.1	Confident	82.1	Confident	3 Å²	3	39 Å²	39	1%	0.011	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	143.4	-173.6	-76	-29.2	0	0	0	112.8	G488 G489 A497 C516 P517 Q518 T523 I534 Y547 W556	G488-W520 CarbonylContact C-O 3.56Å; G488-W520 WeakPolarHBondContact CA-O 3.47Å; G489-W520 PolarHBondContact N-O 3.03Å; A497-W520 PolarHBondContact O-N 2.82Å; C516-W520 HydrophobicContact CB-CD2 4.36Å; C516-W520 HydrophobicContact CB-CE3 3.74Å; C516-W520 HydrophobicContact CB-CH2 4.22Å; C516-W520 HydrophobicContact CB-CZ3 3.65Å; C516-W520 VanDerWaalsContact SG-CE3 3.55Å; C516-W520 VanDerWaalsContact SG-CZ3 3.59Å; P517-W520 HydrophobicContact CG-CH2 4.33Å; Q518-W520 HydrophobicContact CG-CZ2 4.1Å; Q518-W520 VanDerWaalsContact CG-NE1 3.25Å; W520-T523 HydrophobicContact CB-CG2 3.63Å; W520-T523 HydrophobicContact CD2-CG2 4.44Å; W520-T523 HydrophobicContact CG-CG2 3.81Å; W520-I534 HydrophobicContact CD2-CG2 4.36Å; W520-I534 HydrophobicContact CE3-CG2 3.96Å; W520-I534 HydrophobicContact CH2-CG2 4.34Å; W520-I534 HydrophobicContact CZ3-CB 4.38Å; W520-I534 HydrophobicContact CZ3-CG1 4.44Å; W520-I534 HydrophobicContact CZ3-CG2 3.96Å; W520-Y547 HydrophobicContact CH2-CD2 4.18Å; W520-Y547 HydrophobicContact CH2-CG 4.26Å; W520-Y547 AromaticContact CZ2-CD2 3.56Å; W520-Y547 HydrophobicContact CZ2-CD2 3.56Å; W520-Y547 AromaticContact CZ2-CE2 3.88Å; W520-Y547 HydrophobicContact CZ2-CE2 3.88Å; W520-Y547 HydrophobicContact CZ2-CG 4.04Å; W520-W556 AromaticContact CH2-CE3 3.97Å; W520-W556 HydrophobicContact CH2-CE3 3.97Å; W520-W556 AromaticContact CH2-CH2 3.68Å; W520-W556 HydrophobicContact CH2-CH2 3.68Å; W520-W556 HydrophobicContact CH2-CZ2 4.34Å; W520-W556 AromaticContact CH2-CZ3 3.42Å; W520-W556 HydrophobicContact CH2-CZ3 3.42Å; W520-W556 VanDerWaalsContact CH2-CZ3 3.42Å; W520-W556 HydrophobicContact CZ3-CE3 4.5Å; W520-W556 AromaticContact CZ3-CH2 3.37Å; W520-W556 HydrophobicContact CZ3-CH2 3.37Å; W520-W556 HydrophobicContact CZ3-CZ2 4.03Å; W520-W556 AromaticContact CZ3-CZ3 3.61Å; W520-W556 HydrophobicContact CZ3-CZ3 3.61Å
521	R	79.3	Confident	81.2	Confident	84 Å²	84	41.3 Å²	41.3	32%	0.317	25%	0.25	S	C	.	.	S	Bend	trans	-145.8	153.4	166.1	67	174.6	-171.9	175.4	1.3	111	T523 G537 D538	R521-T523 PolarHBondContact O-N 3.05Å; R521-G537 WeakPolarHBondContact O-CA 3.45Å; R521-D538 HydrophobicContact CG-CB 3.73Å; R521-D538 IonicContact CZ-OD2 2.7Å; R521-D538 IonicContact NE-OD2 3.71Å; R521-D538 PolarHBondContact NE-OD2 2.63Å; R521-D538 IonicContact NH2-OD2 3.89Å; R521-D538 PolarHBondContact NH2-OD2 2.7Å; R521-D538 PolarHBondContact O-N 3.29Å
522	Y	81	Confident	80.8	Confident	60 Å²	60	38.9 Å²	38.9	24%	0.235	23%	0.23	C	C	.	.	S	Bend	trans	55.5	33.6	-177.5	-56.4	-73.7	0	0	0	113.4	N474 G537 M567 S568	N474-Y522 HydrophobicContact CB-CD1 3.8Å; N474-Y522 HydrophobicContact CB-CE1 3.74Å; N474-Y522 VanDerWaalsContact CG-CE1 3.45Å; N474-Y522 VanDerWaalsContact ND2-CE1 3.29Å; N474-Y522 WeakPolarHBondContact ND2-CE1 3.47Å; N474-Y522 PolarHBondContact ND2-OH 3.47Å; N474-Y522 PolarHBondContact O-N 2.76Å; Y522-G537 WeakPolarHBondContact O-CA 2.91Å; Y522-M567 HydrophobicContact CD2-CE 4.06Å; Y522-M567 HydrophobicContact CG-CE 4.49Å; Y522-S568 WeakPolarHBondContact O-CA 3.42Å; Y522-S568 PolarHBondContact O-N 2.89Å
523	T	85.3	Confident	80.6	Confident	12 Å²	12	35.6 Å²	35.6	7%	0.074	21%	0.212	C	C	.	.			trans	-85.5	152	178.1	45.6	0	0	0	0	111.4	W520 R521 I534 G536	W520-T523 HydrophobicContact CB-CG2 3.63Å; W520-T523 HydrophobicContact CD2-CG2 4.44Å; W520-T523 HydrophobicContact CG-CG2 3.81Å; R521-T523 PolarHBondContact O-N 3.05Å; T523-I534 HydrophobicContact CG2-CG2 4.4Å; T523-G536 WeakPolarHBondContact CG2-O 3.11Å
524	A	87.2	Confident	80.7	Confident	5 Å²	5	34.3 Å²	34.3	4%	0.041	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	146.6	166.2	0	0	0	0	0	110.1	I534 M535 C569 A571	A524-I534 WeakPolarHBondContact O-CA 3.47Å; A524-M535 HydrophobicContact CB-CG 4.04Å; A524-M535 PolarHBondContact N-O 3.05Å; A524-M535 PolarHBondContact O-N 2.9Å; A524-C569 WeakPolarHBondContact CB-O 3.43Å; A524-A571 HydrophobicContact CB-CB 3.68Å
525	A	89	Confident	80.7	Confident	15 Å²	15	33.6 Å²	33.6	12%	0.124	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	146.2	168.1	0	0	0	0	0	110.7	A476 V478 F533 I534	A476-A525 HydrophobicContact CB-CB 3.6Å; V478-A525 HydrophobicContact CG1-CB 3.65Å; V478-A525 HydrophobicContact CG2-CB 4.46Å; A525-F533 CarbonylContact C-O 3.49Å; A525-F533 WeakPolarHBondContact CA-O 3.11Å; A525-I534 HydrophobicContact CB-CG1 4.34Å
526	A	84.6	Confident	80.6	Confident	5 Å²	5	27.2 Å²	27.2	4%	0.041	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	153.9	177.4	0	0	0	0	0	109.8	F533 M535 A571 L578	A526-F533 PolarHBondContact N-O 3.2Å; A526-F533 PolarHBondContact O-N 3.42Å; A526-M535 HydrophobicContact CB-CE 4.45Å; A526-A571 HydrophobicContact CB-CB 3.89Å; A526-L578 HydrophobicContact CB-CD2 3.51Å
527	V	77.4	Confident	80.5	Confident	40 Å²	40	26.8 Å²	26.8	24%	0.242	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	121.4	-174.3	178.1	0	0	0	0	108.2	V478 S479 A480 I532 A573	V478-V527 HydrophobicContact CB-CG2 3.79Å; V478-V527 HydrophobicContact CG1-CG2 4.37Å; V478-V527 HydrophobicContact CG2-CG2 4.06Å; S479-V527 VanDerWaalsContact O-CG2 3.26Å; S479-V527 WeakPolarHBondContact O-CG2 3.42Å; A480-V527 HydrophobicContact CB-CG1 4.21Å; A480-V527 HydrophobicContact CB-CG2 4.34Å; V527-I532 HydrophobicContact CG2-CG1 4.29Å; V527-I532 HydrophobicContact CG2-CG2 4.39Å; V527-A573 WeakPolarHBondContact O-CB 3.45Å
528	L	66	Low	80.4	Confident	17 Å²	17	25.3 Å²	25.3	9%	0.089	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	114.4	177.8	-174.3	72.6	0	0	0	108.8	S530 Q531 F533 A573 L578 P598	L528-S530 PolarHBondContact O-N 2.89Å; L528-Q531 PolarHBondContact N-O 3.17Å; L528-Q531 PolarHBondContact O-N 3.39Å; L528-Q531 VanDerWaalsContact O-N 3.11Å; L528-F533 HydrophobicContact CB-CD2 4.03Å; L528-F533 HydrophobicContact CB-CE2 3.82Å; L528-F533 HydrophobicContact CD2-CE2 4.3Å; L528-A573 HydrophobicContact CD1-CB 4.19Å; L528-L578 HydrophobicContact CB-CD1 4.23Å; L528-L578 HydrophobicContact CB-CD2 4.08Å; L528-L578 HydrophobicContact CB-CG 4.09Å; L528-L578 HydrophobicContact CD2-CD1 4.21Å; L528-L578 HydrophobicContact CD2-CG 4.08Å; L528-L578 HydrophobicContact CG-CG 4.46Å; L528-P598 HydrophobicContact CD2-CB 3.95Å; L528-P598 HydrophobicContact CD2-CG 3.88Å
529	G	63.7	Low	80.2	Confident	72 Å²	72	25.7 Å²	25.7	74%	0.742	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	60	-119.8	-172.6	0	0	0	0	0	111.4
530	S	64.8	Low	79.7	Confident	61 Å²	61	30.6 Å²	30.6	43%	0.427	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	2.6	178.5	63.6	0	0	0	0	114.3	L528 C551	L528-S530 PolarHBondContact O-N 2.89Å; S530-C551 PolarHBondContact O-SG 2.94Å
531	Q	73.7	Confident	79	Confident	63 Å²	63	37.7 Å²	37.7	29%	0.294	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	145.8	-172.4	-65.8	-177.7	-11.1	0	0	111	L528 F533	L528-Q531 PolarHBondContact N-O 3.17Å; L528-Q531 PolarHBondContact O-N 3.39Å; L528-Q531 VanDerWaalsContact O-N 3.11Å; Q531-F533 HydrophobicContact CB-CD2 4.42Å; Q531-F533 HydrophobicContact CB-CE2 3.79Å
532	I	84.1	Confident	78.9	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.4	178.1	-49.7	-179.9	0	0	0	108.4	V478 A480 F485 F487 V527 I534 R548 F549 C551	V478-I532 HydrophobicContact CG2-CD1 4.22Å; V478-I532 HydrophobicContact CG2-CG2 3.66Å; A480-I532 HydrophobicContact CB-CD1 3.68Å; A480-I532 HydrophobicContact CB-CG1 3.84Å; F485-I532 HydrophobicContact CB-CD1 4.18Å; F485-I532 HydrophobicContact CD2-CD1 3.73Å; F485-I532 HydrophobicContact CE2-CD1 4.22Å; F485-I532 HydrophobicContact CG-CD1 3.9Å; F487-I532 HydrophobicContact CE2-CD1 4.07Å; F487-I532 HydrophobicContact CE2-CG2 3.82Å; F487-I532 HydrophobicContact CZ-CB 4.48Å; F487-I532 HydrophobicContact CZ-CD1 3.85Å; F487-I532 HydrophobicContact CZ-CG2 4.07Å; V527-I532 HydrophobicContact CG2-CG1 4.29Å; V527-I532 HydrophobicContact CG2-CG2 4.39Å; I532-I534 HydrophobicContact CB-CD1 4.36Å; I532-I534 HydrophobicContact CG2-CD1 3.89Å; I532-R548 CarbonylContact O-C 3.55Å; I532-R548 WeakPolarHBondContact O-CA 3.24Å; I532-F549 HydrophobicContact CB-CB 4.36Å; I532-F549 HydrophobicContact CD1-CD1 4.15Å; I532-F549 PolarHBondContact N-O 2.92Å; I532-F549 PolarHBondContact O-N 2.82Å; I532-C551 HydrophobicContact CD1-CB 4.47Å
533	F	85.6	Confident	78.7	Confident	7 Å²	7	33.4 Å²	33.4	3%	0.031	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	128.5	178	-70.2	-105.7	0	0	0	109.4	A525 A526 L528 Q531 M535 Y547 R548 V559 L578 Y596	A525-F533 CarbonylContact C-O 3.49Å; A525-F533 WeakPolarHBondContact CA-O 3.11Å; A526-F533 PolarHBondContact N-O 3.2Å; A526-F533 PolarHBondContact O-N 3.42Å; L528-F533 HydrophobicContact CB-CD2 4.03Å; L528-F533 HydrophobicContact CB-CE2 3.82Å; L528-F533 HydrophobicContact CD2-CE2 4.3Å; Q531-F533 HydrophobicContact CB-CD2 4.42Å; Q531-F533 HydrophobicContact CB-CE2 3.79Å; F533-M535 HydrophobicContact CB-CE 3.64Å; F533-M535 WeakPolarHBondContact O-CE 3.38Å; F533-Y547 CarbonylContact C-O 3.57Å; F533-Y547 WeakPolarHBondContact CA-O 3.43Å; F533-R548 HydrophobicContact CD1-CB 4.12Å; F533-R548 HydrophobicContact CE1-CB 3.96Å; F533-R548 HydrophobicContact CZ-CB 4.22Å; F533-V559 HydrophobicContact CD1-CG2 4.47Å; F533-V559 HydrophobicContact CE1-CG1 4.13Å; F533-L578 HydrophobicContact CB-CD1 3.64Å; F533-L578 HydrophobicContact CD1-CD1 3.67Å; F533-L578 HydrophobicContact CD2-CD1 3.61Å; F533-L578 HydrophobicContact CE1-CD1 4.17Å; F533-L578 HydrophobicContact CE2-CD1 4.14Å; F533-L578 HydrophobicContact CG-CD1 3.35Å; F533-L578 HydrophobicContact CZ-CD1 4.4Å; F533-Y596 HydrophobicContact CD1-CE1 4.41Å; F533-Y596 AromaticContact CE1-CE1 3.74Å; F533-Y596 HydrophobicContact CE1-CE1 3.74Å; F533-Y596 HydrophobicContact CZ-CE1 4.31Å
534	I	89.5	Confident	78.5	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.01	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	130.9	178.3	-58.3	72.3	0	0	0	107.2	F487 W520 T523 A524 A525 I532 A546 Y547 F549 W556	F487-I534 HydrophobicContact CD1-CD1 4.41Å; F487-I534 HydrophobicContact CD1-CG1 4.23Å; F487-I534 HydrophobicContact CD2-CG1 4.41Å; F487-I534 HydrophobicContact CE1-CD1 4.28Å; F487-I534 HydrophobicContact CG-CG1 4.14Å; F487-I534 HydrophobicContact CZ-CD1 4.39Å; W520-I534 HydrophobicContact CD2-CG2 4.36Å; W520-I534 HydrophobicContact CE3-CG2 3.96Å; W520-I534 HydrophobicContact CH2-CG2 4.34Å; W520-I534 HydrophobicContact CZ3-CB 4.38Å; W520-I534 HydrophobicContact CZ3-CG1 4.44Å; W520-I534 HydrophobicContact CZ3-CG2 3.96Å; T523-I534 HydrophobicContact CG2-CG2 4.4Å; A524-I534 WeakPolarHBondContact O-CA 3.47Å; A525-I534 HydrophobicContact CB-CG1 4.34Å; I532-I534 HydrophobicContact CB-CD1 4.36Å; I532-I534 HydrophobicContact CG2-CD1 3.89Å; I534-A546 CarbonylContact O-C 3.53Å; I534-A546 WeakPolarHBondContact O-CA 3.19Å; I534-Y547 PolarHBondContact N-O 3.27Å; I534-Y547 PolarHBondContact O-N 2.83Å; I534-F549 HydrophobicContact CD1-CB 3.96Å; I534-W556 HydrophobicContact CD1-CH2 3.83Å; I534-W556 HydrophobicContact CD1-CZ3 3.56Å; I534-W556 HydrophobicContact CG1-CH2 4.16Å; I534-W556 HydrophobicContact CG1-CZ3 4.08Å
535	M	89.1	Confident	78.4	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	149.2	-173	62.4	-152.2	86.3	0	0	113.2	A524 A526 F533 A546 M562 A571 V580 W603	A524-M535 HydrophobicContact CB-CG 4.04Å; A524-M535 PolarHBondContact N-O 3.05Å; A524-M535 PolarHBondContact O-N 2.9Å; A526-M535 HydrophobicContact CB-CE 4.45Å; F533-M535 HydrophobicContact CB-CE 3.64Å; F533-M535 WeakPolarHBondContact O-CE 3.38Å; M535-A546 HydrophobicContact CB-CB 3.86Å; M535-M562 HydrophobicContact CB-SD 3.95Å; M535-M562 HydrophobicContact CG-SD 4.21Å; M535-A571 HydrophobicContact CE-CB 3.85Å; M535-A571 HydrophobicContact CG-CB 4.36Å; M535-A571 HydrophobicContact SD-CB 3.73Å; M535-V580 HydrophobicContact CG-CG2 4.14Å; M535-V580 HydrophobicContact SD-CG2 3.14Å; M535-V580 WeakPolarHBondContact SD-CG2 3.16Å; M535-W603 HydrophobicContact SD-CH2 3.57Å; M535-W603 VanDerWaalsContact SD-CH2 3.57Å; M535-W603 HydrophobicContact SD-CZ2 4.12Å
536	G	85.6	Confident	78.3	Confident	2 Å²	2	32.6 Å²	32.6	2%	0.021	19%	0.19	C	C	.	.			trans	70.1	-150.7	178	0	0	0	0	0	113.8	T523 T539 S545 R566	T523-G536 WeakPolarHBondContact CG2-O 3.11Å; G536-T539 WeakPolarHBondContact O-CG2 3.23Å; G536-S545 PolarHBondContact N-O 2.94Å; G536-S545 VanDerWaalsContact N-O 3.09Å; G536-R566 CarbonylContact C-O 3.58Å; G536-R566 VanDerWaalsContact CA-O 3.24Å; G536-R566 WeakPolarHBondContact CA-O 3.2Å
537	G	82.5	Confident	78.5	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.193	C	C	.	.	S	Bend	trans	87.8	-178.5	178.8	0	0	0	0	0	114.6	R521 Y522 T539 A543 R566	R521-G537 WeakPolarHBondContact O-CA 3.45Å; Y522-G537 WeakPolarHBondContact O-CA 2.91Å; G537-T539 PolarHBondContact O-N 2.81Å; G537-A543 VanDerWaalsContact O-CB 3.27Å; G537-A543 WeakPolarHBondContact O-CB 3.38Å; G537-R566 PolarHBondContact N-O 2.91Å
538	D	80.1	Confident	79.1	Confident	40 Å²	40	36.4 Å²	36.4	21%	0.214	20%	0.199	C	C	.	.	S	Bend	trans	-91.7	98.9	174	174.8	-5	0	0	0	109.5	K496 R521	K496-D538 PolarHBondContact NZ-O 2.69Å; K496-D538 VanDerWaalsContact NZ-O 3.09Å; K496-D538 IonicContact NZ-OD1 2.76Å; K496-D538 PolarHBondContact NZ-OD1 3.37Å; K496-D538 IonicContact NZ-OD2 3.2Å; R521-D538 HydrophobicContact CG-CB 3.73Å; R521-D538 IonicContact CZ-OD2 2.7Å; R521-D538 IonicContact NE-OD2 3.71Å; R521-D538 PolarHBondContact NE-OD2 2.63Å; R521-D538 IonicContact NH2-OD2 3.89Å; R521-D538 PolarHBondContact NH2-OD2 2.7Å; R521-D538 PolarHBondContact O-N 3.29Å
539	T	73.5	Confident	80	Confident	15 Å²	15	35.6 Å²	35.6	9%	0.092	20%	0.195	C	C	.	.			trans	-116.9	163	-175	80	0	0	0	0	109.8	G536 G537 F541 T542	G536-T539 WeakPolarHBondContact O-CG2 3.23Å; G537-T539 PolarHBondContact O-N 2.81Å; T539-F541 VanDerWaalsContact C-N 3.27Å; T539-F541 PolarHBondContact O-N 2.76Å; T539-T542 PolarHBondContact OG1-O 3.41Å
540	E	69.1	Low	80.9	Confident	138 Å²	138	34.1 Å²	34.1	65%	0.645	17%	0.17	S	C	*	.	S	Bend	trans	-75	-19.7	179.5	-66.7	-175.4	168.2	0	0	112.8
541	F	68.8	Low	81.4	Confident	152 Å²	152	32.1 Å²	32.1	67%	0.667	16%	0.156	S	C	*	.	S	Bend	trans	-98.8	-105.2	178.3	-59.2	-67.6	0	0	0	111.6	T539	T539-F541 VanDerWaalsContact C-N 3.27Å; T539-F541 PolarHBondContact O-N 2.76Å
542	T	75.8	Confident	81.5	Confident	46 Å²	46	35.7 Å²	35.7	28%	0.282	17%	0.173	S	C	.	.			trans	-117.9	133.2	-176.4	82.8	0	0	0	0	109.8	T539 A544 S545	T539-T542 PolarHBondContact OG1-O 3.41Å; T542-A544 PolarHBondContact O-N 2.88Å; T542-A544 VanDerWaalsContact O-N 3.1Å; T542-S545 WeakPolarHBondContact O-CB 3.17Å; T542-S545 PolarHBondContact O-N 3.31Å; T542-S545 VanDerWaalsContact O-N 3.12Å; T542-S545 PolarHBondContact O-OG 2.92Å; T542-S545 PolarHBondContact OG1-N 2.82Å
543	A	77.5	Confident	81.4	Confident	7 Å²	7	39.4 Å²	39.4	6%	0.058	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	7.3	168.9	0	0	0	0	0	112.8	G537 M562 K565 R566 F585	G537-A543 VanDerWaalsContact O-CB 3.27Å; G537-A543 WeakPolarHBondContact O-CB 3.38Å; A543-M562 VanDerWaalsContact O-CE 3.23Å; A543-M562 WeakPolarHBondContact O-CE 3.46Å; A543-K565 HydrophobicContact CB-CB 4.1Å; A543-R566 PolarHBondContact O-N 2.89Å; A543-F585 HydrophobicContact CB-CD2 3.75Å; A543-F585 HydrophobicContact CB-CE2 3.88Å
544	A	81	Confident	81.4	Confident	11 Å²	11	42 Å²	42	9%	0.091	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-11.5	170.4	0	0	0	0	0	112.2	T542 M562 K565	T542-A544 PolarHBondContact O-N 2.88Å; T542-A544 VanDerWaalsContact O-N 3.1Å; A544-M562 PolarHBondContact O-N 3.49Å; A544-K565 HydrophobicContact CB-CG 3.88Å
545	S	84.5	Confident	81.3	Confident	3 Å²	3	47.9 Å²	47.9	2%	0.021	24%	0.237	C	C	.	.			trans	-66.7	141.9	-176.8	58.9	0	0	0	0	112.6	G536 T542 D561	G536-S545 PolarHBondContact N-O 2.94Å; G536-S545 VanDerWaalsContact N-O 3.09Å; T542-S545 WeakPolarHBondContact O-CB 3.17Å; T542-S545 PolarHBondContact O-N 3.31Å; T542-S545 VanDerWaalsContact O-N 3.12Å; T542-S545 PolarHBondContact O-OG 2.92Å; T542-S545 PolarHBondContact OG1-N 2.82Å; S545-D561 WeakPolarHBondContact CA-OD1 3.19Å
546	A	87.7	Confident	81.3	Confident	2 Å²	2	50 Å²	50	2%	0.017	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	144	173.4	0	0	0	0	0	109.9	I534 M535 V559 W603	I534-A546 CarbonylContact O-C 3.53Å; I534-A546 WeakPolarHBondContact O-CA 3.19Å; M535-A546 HydrophobicContact CB-CB 3.86Å; A546-V559 VanDerWaalsContact C-CG2 3.48Å; A546-V559 HydrophobicContact CB-CG2 3.48Å; A546-V559 VanDerWaalsContact CB-CG2 3.48Å; A546-V559 WeakPolarHBondContact O-CG2 3.25Å; A546-V559 PolarHBondContact O-N 2.63Å; A546-V559 VanDerWaalsContact O-N 3.1Å; A546-W603 HydrophobicContact CB-CZ2 4.39Å
547	Y	89.4	Confident	81.5	Confident	28 Å²	28	52 Å²	52	11%	0.11	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	141	-176.7	-65.8	-92.8	0	0	0	109.5	P517 W520 F533 I534 S557 R558	P517-Y547 HydrophobicContact CG-CD1 4.37Å; P517-Y547 HydrophobicContact CG-CE1 4.45Å; W520-Y547 HydrophobicContact CH2-CD2 4.18Å; W520-Y547 HydrophobicContact CH2-CG 4.26Å; W520-Y547 AromaticContact CZ2-CD2 3.56Å; W520-Y547 HydrophobicContact CZ2-CD2 3.56Å; W520-Y547 AromaticContact CZ2-CE2 3.88Å; W520-Y547 HydrophobicContact CZ2-CE2 3.88Å; W520-Y547 HydrophobicContact CZ2-CG 4.04Å; F533-Y547 CarbonylContact C-O 3.57Å; F533-Y547 WeakPolarHBondContact CA-O 3.43Å; I534-Y547 PolarHBondContact N-O 3.27Å; I534-Y547 PolarHBondContact O-N 2.83Å; Y547-S557 CarbonylContact C-O 3.53Å; Y547-S557 WeakPolarHBondContact CA-O 3.34Å; Y547-R558 HydrophobicContact CD1-CB 4.29Å; Y547-R558 HydrophobicContact CE1-CB 4.19Å; Y547-R558 HydrophobicContact CE1-CG 4.22Å
548	R	88.4	Confident	81.8	Confident	97 Å²	97	58.8 Å²	58.8	37%	0.366	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	138.6	166	68.3	178.5	-175.2	-150.7	-4.7	109.8	I532 F533 S557 V559	I532-R548 CarbonylContact O-C 3.55Å; I532-R548 WeakPolarHBondContact O-CA 3.24Å; F533-R548 HydrophobicContact CD1-CB 4.12Å; F533-R548 HydrophobicContact CE1-CB 3.96Å; F533-R548 HydrophobicContact CZ-CB 4.22Å; R548-S557 PolarHBondContact N-O 2.92Å; R548-S557 VanDerWaalsContact NE-CB 3.32Å; R548-S557 PolarHBondContact NE-OG 2.78Å; R548-S557 PolarHBondContact O-N 2.79Å; R548-V559 HydrophobicContact CB-CG1 4.05Å; R548-V559 HydrophobicContact CG-CG1 3.92Å
549	F	86.3	Confident	82.1	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	124.2	175.3	179	-107	0	0	0	108.9	F485 F487 A514 I532 I534 C551 N554 W556	F485-F549 HydrophobicContact CD1-CE1 4.27Å; F485-F549 HydrophobicContact CE1-CE1 4.14Å; F487-F549 AromaticContact CE1-CD1 3.96Å; F487-F549 HydrophobicContact CE1-CD1 3.96Å; F487-F549 HydrophobicContact CE1-CE1 4.32Å; F487-F549 HydrophobicContact CE1-CG 4.17Å; F487-F549 AromaticContact CZ-CD1 3.84Å; F487-F549 HydrophobicContact CZ-CD1 3.84Å; F487-F549 HydrophobicContact CZ-CE1 4.27Å; F487-F549 HydrophobicContact CZ-CG 4.42Å; A514-F549 HydrophobicContact CB-CE2 3.85Å; A514-F549 HydrophobicContact CB-CZ 4.14Å; I532-F549 HydrophobicContact CB-CB 4.36Å; I532-F549 HydrophobicContact CD1-CD1 4.15Å; I532-F549 PolarHBondContact N-O 2.92Å; I532-F549 PolarHBondContact O-N 2.82Å; I534-F549 HydrophobicContact CD1-CB 3.96Å; F549-C551 HydrophobicContact CE1-CB 4.24Å; F549-N554 HydrophobicContact CE2-CB 4.31Å; F549-N554 HydrophobicContact CZ-CB 4.22Å; F549-W556 HydrophobicContact CB-CD2 4.32Å; F549-W556 HydrophobicContact CB-CE3 3.88Å; F549-W556 HydrophobicContact CB-CH2 3.88Å; F549-W556 HydrophobicContact CB-CZ2 4.37Å; F549-W556 HydrophobicContact CB-CZ3 3.67Å; F549-W556 AromaticContact CD2-CD2 3.7Å; F549-W556 HydrophobicContact CD2-CD2 3.7Å; F549-W556 AromaticContact CD2-CE2 3.41Å; F549-W556 VanDerWaalsContact CD2-CE2 3.41Å; F549-W556 HydrophobicContact CD2-CE3 4.14Å; F549-W556 HydrophobicContact CD2-CG 4.23Å; F549-W556 HydrophobicContact CD2-CH2 4.01Å; F549-W556 AromaticContact CD2-CZ2 3.6Å; F549-W556 HydrophobicContact CD2-CZ2 3.6Å; F549-W556 HydrophobicContact CD2-CZ3 4.3Å; F549-W556 AromaticContact CD2-NE1 3.81Å; F549-W556 AromaticContact CE2-CE2 3.94Å; F549-W556 HydrophobicContact CE2-CZ2 4.14Å; F549-W556 AromaticContact CE2-NE1 3.95Å; F549-W556 HydrophobicContact CG-CD2 4.46Å; F549-W556 HydrophobicContact CG-CE3 4.47Å; F549-W556 HydrophobicContact CG-CH2 4.09Å; F549-W556 HydrophobicContact CG-CZ2 4.13Å; F549-W556 HydrophobicContact CG-CZ3 4.31Å
550	D	81.1	Confident	82.4	Confident	41 Å²	41	57.5 Å²	57.5	22%	0.219	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	114.9	171.4	178.2	5.9	0	0	0	109.5	E552 T553 N554 Q555	D550-E552 VanDerWaalsContact C-N 3.26Å; D550-E552 PolarHBondContact O-N 2.83Å; D550-E552 PolarHBondContact OD1-N 3.26Å; D550-T553 WeakPolarHBondContact CB-OG1 3.4Å; D550-T553 WeakPolarHBondContact OD2-CG2 3.39Å; D550-T553 PolarHBondContact OD2-OG1 2.94Å; D550-N554 WeakPolarHBondContact O-CA 3.25Å; D550-N554 PolarHBondContact O-N 2.77Å; D550-Q555 PolarHBondContact N-O 2.67Å
551	C	75.9	Confident	83.1	Confident	18 Å²	18	54.3 Å²	54.3	12%	0.122	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-11.8	-177.7	59.1	0	0	0	0	114.4	K481 F485 S530 I532 F549	K481-C551 VanDerWaalsContact CD-SG 3.51Å; F485-C551 HydrophobicContact CE1-CB 4.35Å; F485-C551 HydrophobicContact CE2-CB 4.15Å; F485-C551 HydrophobicContact CZ-CB 3.74Å; S530-C551 PolarHBondContact O-SG 2.94Å; I532-C551 HydrophobicContact CD1-CB 4.47Å; F549-C551 HydrophobicContact CE1-CB 4.24Å
552	E	75.5	Confident	83.8	Confident	139 Å²	139	47.5 Å²	47.5	65%	0.65	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-48.4	173	-84.6	173.5	-174.8	0	0	112.1	K481 D550	K481-E552 HydrophobicContact CD-CG 4.4Å; K481-E552 IonicContact NZ-OE1 3.52Å; K481-E552 PolarHBondContact NZ-OE1 3.5Å; K481-E552 IonicContact NZ-OE2 2.71Å; K481-E552 PolarHBondContact NZ-OE2 3.32Å; D550-E552 VanDerWaalsContact C-N 3.26Å; D550-E552 PolarHBondContact O-N 2.83Å; D550-E552 PolarHBondContact OD1-N 3.26Å
553	T	82.5	Confident	84.1	Confident	77 Å²	77	48.5 Å²	48.5	47%	0.472	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-12.5	-176.4	60.1	0	0	0	0	112.9	D550 Q555	D550-T553 WeakPolarHBondContact CB-OG1 3.4Å; D550-T553 WeakPolarHBondContact OD2-CG2 3.39Å; D550-T553 PolarHBondContact OD2-OG1 2.94Å; T553-Q555 PolarHBondContact O-N 3.08Å
554	N	85.1	Confident	84.1	Confident	63 Å²	63	50.1 Å²	50.1	34%	0.337	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	55	29.5	-171.1	-62.1	-53.2	0	0	0	113	A514 F549 D550	A514-N554 HydrophobicContact CB-CB 4.33Å; F549-N554 HydrophobicContact CE2-CB 4.31Å; F549-N554 HydrophobicContact CZ-CB 4.22Å; D550-N554 WeakPolarHBondContact O-CA 3.25Å; D550-N554 PolarHBondContact O-N 2.77Å
555	Q	87.6	Confident	84.2	Confident	125 Å²	125	54.6 Å²	54.6	58%	0.584	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100	148.9	-179.2	-66.8	-61.7	-30.6	0	0	111.7	D550 T553	D550-Q555 PolarHBondContact N-O 2.67Å; T553-Q555 PolarHBondContact O-N 3.08Å
556	W	90.3	Very high	84.1	Confident	47 Å²	47	54.5 Å²	54.5	18%	0.178	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	139.6	176.4	-67.4	96.1	0	0	0	110.3	F487 V500 E515 P517 W520 I534 F549	F487-W556 AromaticContact CD1-CH2 3.7Å; F487-W556 HydrophobicContact CD1-CH2 3.7Å; F487-W556 HydrophobicContact CD1-CZ2 4.15Å; F487-W556 AromaticContact CE1-CH2 3.7Å; F487-W556 HydrophobicContact CE1-CH2 3.7Å; F487-W556 HydrophobicContact CE1-CZ2 4.05Å; V500-W556 HydrophobicContact CG2-CZ2 3.77Å; E515-W556 PolarHBondContact O-NE1 2.8Å; P517-W556 HydrophobicContact CG-CB 3.8Å; P517-W556 HydrophobicContact CG-CD2 3.78Å; P517-W556 HydrophobicContact CG-CE3 4.18Å; P517-W556 HydrophobicContact CG-CG 3.58Å; W520-W556 AromaticContact CH2-CE3 3.97Å; W520-W556 HydrophobicContact CH2-CE3 3.97Å; W520-W556 AromaticContact CH2-CH2 3.68Å; W520-W556 HydrophobicContact CH2-CH2 3.68Å; W520-W556 HydrophobicContact CH2-CZ2 4.34Å; W520-W556 AromaticContact CH2-CZ3 3.42Å; W520-W556 HydrophobicContact CH2-CZ3 3.42Å; W520-W556 VanDerWaalsContact CH2-CZ3 3.42Å; W520-W556 HydrophobicContact CZ3-CE3 4.5Å; W520-W556 AromaticContact CZ3-CH2 3.37Å; W520-W556 HydrophobicContact CZ3-CH2 3.37Å; W520-W556 HydrophobicContact CZ3-CZ2 4.03Å; W520-W556 AromaticContact CZ3-CZ3 3.61Å; W520-W556 HydrophobicContact CZ3-CZ3 3.61Å; I534-W556 HydrophobicContact CD1-CH2 3.83Å; I534-W556 HydrophobicContact CD1-CZ3 3.56Å; I534-W556 HydrophobicContact CG1-CH2 4.16Å; I534-W556 HydrophobicContact CG1-CZ3 4.08Å; F549-W556 HydrophobicContact CB-CD2 4.32Å; F549-W556 HydrophobicContact CB-CE3 3.88Å; F549-W556 HydrophobicContact CB-CH2 3.88Å; F549-W556 HydrophobicContact CB-CZ2 4.37Å; F549-W556 HydrophobicContact CB-CZ3 3.67Å; F549-W556 AromaticContact CD2-CD2 3.7Å; F549-W556 HydrophobicContact CD2-CD2 3.7Å; F549-W556 AromaticContact CD2-CE2 3.41Å; F549-W556 VanDerWaalsContact CD2-CE2 3.41Å; F549-W556 HydrophobicContact CD2-CE3 4.14Å; F549-W556 HydrophobicContact CD2-CG 4.23Å; F549-W556 HydrophobicContact CD2-CH2 4.01Å; F549-W556 AromaticContact CD2-CZ2 3.6Å; F549-W556 HydrophobicContact CD2-CZ2 3.6Å; F549-W556 HydrophobicContact CD2-CZ3 4.3Å; F549-W556 AromaticContact CD2-NE1 3.81Å; F549-W556 AromaticContact CE2-CE2 3.94Å; F549-W556 HydrophobicContact CE2-CZ2 4.14Å; F549-W556 AromaticContact CE2-NE1 3.95Å; F549-W556 HydrophobicContact CG-CD2 4.46Å; F549-W556 HydrophobicContact CG-CE3 4.47Å; F549-W556 HydrophobicContact CG-CH2 4.09Å; F549-W556 HydrophobicContact CG-CZ2 4.13Å; F549-W556 HydrophobicContact CG-CZ3 4.31Å
557	S	89.2	Confident	83.9	Confident	44 Å²	44	55.7 Å²	55.7	31%	0.308	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	144.9	164.4	-40.6	0	0	0	0	110	Y547 R548	Y547-S557 CarbonylContact C-O 3.53Å; Y547-S557 WeakPolarHBondContact CA-O 3.34Å; R548-S557 PolarHBondContact N-O 2.92Å; R548-S557 VanDerWaalsContact NE-CB 3.32Å; R548-S557 PolarHBondContact NE-OG 2.78Å; R548-S557 PolarHBondContact O-N 2.79Å
558	R	87.6	Confident	83.4	Confident	142 Å²	142	55.3 Å²	55.3	54%	0.536	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	141.4	172.7	-169.1	171.4	-178.3	-111.8	-1.5	109.6	Y547 D561	Y547-R558 HydrophobicContact CD1-CB 4.29Å; Y547-R558 HydrophobicContact CE1-CB 4.19Å; Y547-R558 HydrophobicContact CE1-CG 4.22Å; R558-D561 IonicContact CZ-OD1 3.77Å; R558-D561 IonicContact CZ-OD2 3.85Å; R558-D561 IonicContact NE-OD1 2.96Å; R558-D561 IonicContact NH2-OD1 2.69Å; R558-D561 PolarHBondContact NH2-OD1 2.9Å; R558-D561 IonicContact NH2-OD2 2.76Å; R558-D561 PolarHBondContact NH2-OD2 3.21Å
559	V	86.7	Confident	83.1	Confident	7 Å²	7	50.9 Å²	50.9	4%	0.042	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	175.1	173.8	-63.2	0	0	0	0	110	F533 A546 R548 D561	F533-V559 HydrophobicContact CD1-CG2 4.47Å; F533-V559 HydrophobicContact CE1-CG1 4.13Å; A546-V559 VanDerWaalsContact C-CG2 3.48Å; A546-V559 HydrophobicContact CB-CG2 3.48Å; A546-V559 VanDerWaalsContact CB-CG2 3.48Å; A546-V559 WeakPolarHBondContact O-CG2 3.25Å; A546-V559 PolarHBondContact O-N 2.63Å; A546-V559 VanDerWaalsContact O-N 3.1Å; R548-V559 HydrophobicContact CB-CG1 4.05Å; R548-V559 HydrophobicContact CG-CG1 3.92Å; V559-D561 PolarHBondContact O-N 3.39Å
560	G	80.1	Confident	83.1	Confident	20 Å²	20	53.2 Å²	53.2	21%	0.206	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-48.8	138	177.2	0	0	0	0	0	113	D601 W603	G560-D601 PolarHBondContact N-OD1 3.26Å; G560-W603 PolarHBondContact O-NE1 3.04Å
561	D	84.8	Confident	83.4	Confident	72 Å²	72	52 Å²	52	39%	0.385	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-67.9	142.7	177.8	-73.4	-35.2	0	0	0	110.5	S545 R558 V559	S545-D561 WeakPolarHBondContact CA-OD1 3.19Å; R558-D561 IonicContact CZ-OD1 3.77Å; R558-D561 IonicContact CZ-OD2 3.85Å; R558-D561 IonicContact NE-OD1 2.96Å; R558-D561 IonicContact NH2-OD1 2.69Å; R558-D561 PolarHBondContact NH2-OD1 2.9Å; R558-D561 IonicContact NH2-OD2 2.76Å; R558-D561 PolarHBondContact NH2-OD2 3.21Å; V559-D561 PolarHBondContact O-N 3.39Å
562	M	83.4	Confident	83.7	Confident	8 Å²	8	52 Å²	52	4%	0.039	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-61.6	154.5	174.7	-63	-174.9	-61.8	0	0	111.1	M535 A543 A544 S564 R566 V580 W603	M535-M562 HydrophobicContact CB-SD 3.95Å; M535-M562 HydrophobicContact CG-SD 4.21Å; A543-M562 VanDerWaalsContact O-CE 3.23Å; A543-M562 WeakPolarHBondContact O-CE 3.46Å; A544-M562 PolarHBondContact O-N 3.49Å; M562-S564 PolarHBondContact O-N 3.06Å; M562-R566 HydrophobicContact CE-CB 4.25Å; M562-V580 HydrophobicContact SD-CG1 4.26Å; M562-W603 HydrophobicContact CG-CD2 4.19Å; M562-W603 HydrophobicContact CG-CH2 4.44Å; M562-W603 HydrophobicContact CG-CZ2 4.04Å
563	T	80.7	Confident	83.5	Confident	67 Å²	67	46.7 Å²	46.7	41%	0.411	25%	0.25	S	C	.	.	S	Bend	trans	-61.4	-21.9	179.8	75.7	0	0	0	0	113.5	D594 W603	T563-D594 VanDerWaalsContact OG1-CG 3.3Å; T563-D594 PolarHBondContact OG1-OD1 3.1Å; T563-D594 PolarHBondContact OG1-OD2 2.89Å; T563-W603 HydrophobicContact CG2-CB 3.81Å
564	S	79.1	Confident	82.8	Confident	42 Å²	42	43.5 Å²	43.5	29%	0.294	23%	0.23	S	C	.	.	S	Bend	trans	-144.7	147.6	-177.1	-70.2	0	0	0	0	111.5	M562 R566	M562-S564 PolarHBondContact O-N 3.06Å; S564-R566 PolarHBondContact O-N 3.08Å
565	K	82.9	Confident	81.4	Confident	105 Å²	105	43.2 Å²	43.2	46%	0.457	24%	0.243	S	C	.	.			trans	-71.2	124.1	172.5	-68.2	177.2	-174.2	177.6	0	109.7	A543 A544 F585 C590	A543-K565 HydrophobicContact CB-CB 4.1Å; A544-K565 HydrophobicContact CB-CG 3.88Å; K565-F585 HydrophobicContact CB-CB 4.19Å; K565-F585 HydrophobicContact CB-CD1 4.13Å; K565-F585 HydrophobicContact CB-CD2 4Å; K565-F585 HydrophobicContact CB-CE2 4.45Å; K565-F585 HydrophobicContact CB-CG 3.83Å; K565-F585 HydrophobicContact CD-CD1 4.24Å; K565-F585 HydrophobicContact CD-CE1 3.9Å; K565-F585 HydrophobicContact CD-CE2 4.38Å; K565-F585 HydrophobicContact CD-CZ 3.99Å; K565-F585 WeakPolarHBondContact O-CB 3.28Å; K565-C590 PolarHBondContact O-SG 2.79Å; K565-C590 VanDerWaalsContact O-SG 3.41Å
566	R	82.5	Confident	80.2	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.244	C	C	.	.			trans	-139.7	127.8	-174.8	-61.2	167.3	-168.4	-108.7	10	111.4	G536 G537 A543 M562 S564 C569 G582 C590 T592 D594	G536-R566 CarbonylContact C-O 3.58Å; G536-R566 VanDerWaalsContact CA-O 3.24Å; G536-R566 WeakPolarHBondContact CA-O 3.2Å; G537-R566 PolarHBondContact N-O 2.91Å; A543-R566 PolarHBondContact O-N 2.89Å; M562-R566 HydrophobicContact CE-CB 4.25Å; S564-R566 PolarHBondContact O-N 3.08Å; R566-C569 HydrophobicContact CB-CB 3.99Å; R566-G582 WeakPolarHBondContact CD-O 3.35Å; R566-G582 PolarHBondContact NH1-O 3.19Å; R566-C590 HydrophobicContact CG-CB 3.97Å; R566-T592 PolarHBondContact NH1-O 2.86Å; R566-T592 PolarHBondContact NH2-O 2.81Å; R566-T592 PolarHBondContact NH2-OG1 2.9Å; R566-D594 IonicContact CZ-OD2 3.45Å; R566-D594 IonicContact NE-OD2 4Å; R566-D594 IonicContact NH2-OD1 3.87Å; R566-D594 PolarHBondContact NH2-OD1 3.12Å; R566-D594 IonicContact NH2-OD2 2.81Å; R566-D594 PolarHBondContact NH2-OD2 3.3Å
567	M	81.8	Confident	79	Confident	27 Å²	27	44 Å²	44	13%	0.133	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-110.5	150.8	160.7	53.4	172.3	-54.9	0	0	110	Y522 C569 G583 Y584	Y522-M567 HydrophobicContact CD2-CE 4.06Å; Y522-M567 HydrophobicContact CG-CE 4.49Å; M567-C569 PolarHBondContact O-N 3.01Å; M567-G583 CarbonylContact O-C 3.51Å; M567-G583 WeakPolarHBondContact O-CA 3.29Å; M567-Y584 HydrophobicContact CE-CD2 4.44Å; M567-Y584 HydrophobicContact CE-CE1 4.26Å; M567-Y584 HydrophobicContact CE-CE2 3.47Å; M567-Y584 VanDerWaalsContact CE-CE2 3.47Å; M567-Y584 WeakPolarHBondContact CE-OH 3.44Å; M567-Y584 HydrophobicContact CG-CD1 4.36Å; M567-Y584 HydrophobicContact CG-CD2 3.77Å; M567-Y584 HydrophobicContact CG-CE1 4.32Å; M567-Y584 HydrophobicContact CG-CE2 3.73Å; M567-Y584 HydrophobicContact CG-CG 4.11Å; M567-Y584 WeakPolarHBondContact CG-O 3.47Å; M567-Y584 PolarHBondContact N-O 3.23Å; M567-Y584 PolarHBondContact O-N 2.9Å; M567-Y584 HydrophobicContact SD-CD2 3.73Å; M567-Y584 HydrophobicContact SD-CE2 3.23Å; M567-Y584 WeakPolarHBondContact SD-CE2 3.16Å
568	S	79.8	Confident	78.3	Confident	21 Å²	21	41.9 Å²	41.9	15%	0.147	24%	0.236	C	C	.	.	S	Bend	trans	56.9	32.1	-176.2	-161.6	0	0	0	0	113.4	Y522	Y522-S568 WeakPolarHBondContact O-CA 3.42Å; Y522-S568 PolarHBondContact O-N 2.89Å
569	C	83.1	Confident	78	Confident	3 Å²	3	36 Å²	36	2%	0.02	21%	0.214	C	C	.	.			trans	-76.5	166.6	168.6	53.2	0	0	0	0	110.6	A524 R566 M567 V580	A524-C569 WeakPolarHBondContact CB-O 3.43Å; R566-C569 HydrophobicContact CB-CB 3.99Å; M567-C569 PolarHBondContact O-N 3.01Å; C569-V580 HydrophobicContact CB-CG1 4.02Å
570	H	85.7	Confident	78	Confident	50 Å²	50	35.7 Å²	35.7	23%	0.231	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	142.6	173.2	-65.4	87.1	0	0	0	109.7	V580 V581 P615 T616 F618	H570-V580 WeakPolarHBondContact O-CA 3.23Å; H570-V581 PolarHBondContact N-O 2.83Å; H570-V581 PolarHBondContact O-N 2.97Å; H570-P615 PolarHBondContact CE1-O 2.91Å; H570-P615 PolarHBondContact ND1-O 3.25Å; H570-T616 PolarHBondContact CE1-O 3.36Å; H570-T616 VanDerWaalsContact CE1-O 3.32Å; H570-T616 PolarHBondContact NE2-O 3.2Å; H570-T616 VanDerWaalsContact NE2-O 3.08Å; H570-F618 HydrophobicContact CB-CB 3.47Å; H570-F618 VanDerWaalsContact CB-CB 3.47Å
571	A	86.2	Confident	78.2	Confident	14 Å²	14	34.8 Å²	34.8	12%	0.116	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	145.1	-176.2	0	0	0	0	0	110.4	A524 A526 M535 Y579 V580	A524-A571 HydrophobicContact CB-CB 3.68Å; A526-A571 HydrophobicContact CB-CB 3.89Å; M535-A571 HydrophobicContact CE-CB 3.85Å; M535-A571 HydrophobicContact CG-CB 4.36Å; M535-A571 HydrophobicContact SD-CB 3.73Å; A571-Y579 CarbonylContact C-O 3.6Å; A571-Y579 WeakPolarHBondContact CA-O 3.48Å; A571-V580 HydrophobicContact CB-CG2 3.98Å
572	V	83.1	Confident	78.1	Confident	20 Å²	20	31.3 Å²	31.3	12%	0.121	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	149.1	173.8	76.3	0	0	0	0	110.7	L335 Y579 F618	L335-V572 HydrophobicContact CD2-CG1 3.49Å; L335-V572 VanDerWaalsContact CD2-CG1 3.49Å; V572-Y579 PolarHBondContact N-O 3.09Å; V572-Y579 PolarHBondContact O-N 3.14Å; V572-F618 HydrophobicContact CB-CD1 3.9Å; V572-F618 HydrophobicContact CB-CE1 4.13Å; V572-F618 HydrophobicContact CG1-CD1 3.49Å; V572-F618 VanDerWaalsContact CG1-CD1 3.49Å; V572-F618 HydrophobicContact CG1-CE1 3.24Å; V572-F618 HydrophobicContact CG1-CG 4.32Å; V572-F618 HydrophobicContact CG1-CZ 3.86Å
573	A	71.5	Confident	77.9	Confident	27 Å²	27	31 Å²	31	22%	0.223	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	136.2	171.7	0	0	0	0	0	110.3	V527 L528 K577 L578	V527-A573 WeakPolarHBondContact O-CB 3.45Å; L528-A573 HydrophobicContact CD1-CB 4.19Å; A573-K577 WeakPolarHBondContact CA-O 3.43Å; A573-L578 HydrophobicContact CB-CD2 3.77Å
574	S	66.9	Low	77.6	Confident	9 Å²	9	30.5 Å²	30.5	6%	0.063	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	138.8	176	170.5	0	0	0	0	108.9	H333 N576 K577 Y579	H333-S574 WeakPolarHBondContact CB-OG 3.36Å; S574-N576 VanDerWaalsContact C-N 3.28Å; S574-N576 PolarHBondContact O-N 3.08Å; S574-N576 VanDerWaalsContact O-N 3.14Å; S574-K577 PolarHBondContact N-O 2.9Å; S574-K577 PolarHBondContact O-N 3.32Å; S574-Y579 WeakPolarHBondContact O-CE2 3.38Å
575	G	57.3	Low	77.6	Confident	58 Å²	58	33 Å²	33	60%	0.598	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	40.1	173.3	0	0	0	0	0	115	K577	G575-K577 PolarHBondContact O-N 3.44Å
576	N	61.3	Low	77.1	Confident	114 Å²	114	31 Å²	31	61%	0.61	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.9	19.2	-175.8	-157.3	37.8	0	0	0	115.6	S574	S574-N576 VanDerWaalsContact C-N 3.28Å; S574-N576 PolarHBondContact O-N 3.08Å; S574-N576 VanDerWaalsContact O-N 3.14Å
577	K	66.3	Low	76.5	Confident	73 Å²	73	37.8 Å²	37.8	32%	0.317	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	163.6	172.6	-58.3	-164.2	-173.2	-143.7	0	110.6	A573 S574 G575 Y579 C595 D597	A573-K577 WeakPolarHBondContact CA-O 3.43Å; S574-K577 PolarHBondContact N-O 2.9Å; S574-K577 PolarHBondContact O-N 3.32Å; G575-K577 PolarHBondContact O-N 3.44Å; K577-Y579 HydrophobicContact CB-CE2 4.02Å; K577-C595 VanDerWaalsContact CD-SG 3.53Å; K577-D597 IonicContact NZ-OD2 3.93Å; K577-D597 PolarHBondContact NZ-OD2 2.89Å
578	L	74.1	Confident	76	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	134.1	175.9	-74.2	169.2	0	0	0	110	A526 L528 F533 A573 C595 Y596	A526-L578 HydrophobicContact CB-CD2 3.51Å; L528-L578 HydrophobicContact CB-CD1 4.23Å; L528-L578 HydrophobicContact CB-CD2 4.08Å; L528-L578 HydrophobicContact CB-CG 4.09Å; L528-L578 HydrophobicContact CD2-CD1 4.21Å; L528-L578 HydrophobicContact CD2-CG 4.08Å; L528-L578 HydrophobicContact CG-CG 4.46Å; F533-L578 HydrophobicContact CB-CD1 3.64Å; F533-L578 HydrophobicContact CD1-CD1 3.67Å; F533-L578 HydrophobicContact CD2-CD1 3.61Å; F533-L578 HydrophobicContact CE1-CD1 4.17Å; F533-L578 HydrophobicContact CE2-CD1 4.14Å; F533-L578 HydrophobicContact CG-CD1 3.35Å; F533-L578 HydrophobicContact CZ-CD1 4.4Å; A573-L578 HydrophobicContact CB-CD2 3.77Å; L578-C595 CarbonylContact O-C 3.49Å; L578-C595 VanDerWaalsContact O-CA 3.23Å; L578-C595 WeakPolarHBondContact O-CA 3.32Å; L578-Y596 HydrophobicContact CB-CD1 4.38Å; L578-Y596 HydrophobicContact CD1-CD1 3.97Å; L578-Y596 PolarHBondContact N-O 2.96Å; L578-Y596 PolarHBondContact O-N 3.09Å
579	Y	81.8	Confident	75.7	Confident	20 Å²	20	47.3 Å²	47.3	8%	0.078	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	133.8	179.7	-63.2	-91.9	0	0	0	109.8	L335 H353 A571 V572 S574 K577 D594 C595 I606	L335-Y579 HydrophobicContact CD1-CD1 3.82Å; L335-Y579 HydrophobicContact CD1-CD2 3.87Å; L335-Y579 HydrophobicContact CD1-CE1 4.22Å; L335-Y579 HydrophobicContact CD1-CE2 4.28Å; L335-Y579 HydrophobicContact CD1-CG 3.63Å; H353-Y579 AromaticContact CE1-CE1 3.39Å; H353-Y579 WeakPolarHBondContact CE1-CE1 3.5Å; H353-Y579 AromaticContact CE1-CZ 3.48Å; H353-Y579 VanDerWaalsContact CE1-CZ 3.48Å; A571-Y579 CarbonylContact C-O 3.6Å; A571-Y579 WeakPolarHBondContact CA-O 3.48Å; V572-Y579 PolarHBondContact N-O 3.09Å; V572-Y579 PolarHBondContact O-N 3.14Å; S574-Y579 WeakPolarHBondContact O-CE2 3.38Å; K577-Y579 HydrophobicContact CB-CE2 4.02Å; Y579-D594 CarbonylContact C-O 3.6Å; Y579-D594 WeakPolarHBondContact CA-O 3.43Å; Y579-C595 HydrophobicContact CD1-CB 3.97Å; Y579-C595 HydrophobicContact CE1-CB 3.91Å; Y579-I606 HydrophobicContact CD1-CD1 3.96Å; Y579-I606 HydrophobicContact CE1-CD1 3.44Å; Y579-I606 VanDerWaalsContact CE1-CD1 3.44Å
580	V	85.8	Confident	75.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	131	177.7	177.7	0	0	0	0	109.4	M535 M562 C569 H570 A571 L593 D594 W603	M535-V580 HydrophobicContact CG-CG2 4.14Å; M535-V580 HydrophobicContact SD-CG2 3.14Å; M535-V580 WeakPolarHBondContact SD-CG2 3.16Å; M562-V580 HydrophobicContact SD-CG1 4.26Å; C569-V580 HydrophobicContact CB-CG1 4.02Å; H570-V580 WeakPolarHBondContact O-CA 3.23Å; A571-V580 HydrophobicContact CB-CG2 3.98Å; V580-L593 CarbonylContact O-C 3.25Å; V580-L593 WeakPolarHBondContact O-CA 3.31Å; V580-D594 PolarHBondContact N-O 3.14Å; V580-D594 PolarHBondContact O-N 2.96Å; V580-W603 HydrophobicContact CB-CH2 4.5Å; V580-W603 HydrophobicContact CB-CZ3 4.02Å; V580-W603 HydrophobicContact CG2-CH2 3.48Å; V580-W603 VanDerWaalsContact CG2-CH2 3.48Å; V580-W603 HydrophobicContact CG2-CZ3 3.44Å; V580-W603 VanDerWaalsContact CG2-CZ3 3.44Å
581	V	85.1	Confident	74.8	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	142.9	-177.8	63	0	0	0	0	111.8	I337 H570 L593 V609 P615 F618	I337-V581 HydrophobicContact CD1-CG2 4.14Å; H570-V581 PolarHBondContact N-O 2.83Å; H570-V581 PolarHBondContact O-N 2.97Å; V581-L593 HydrophobicContact CB-CD1 3.74Å; V581-L593 HydrophobicContact CG2-CD1 4.2Å; V581-V609 HydrophobicContact CG2-CG1 3.8Å; V581-V609 HydrophobicContact CG2-CG2 4.21Å; V581-P615 HydrophobicContact CB-CG 4.37Å; V581-P615 HydrophobicContact CG1-CG 3.57Å; V581-P615 HydrophobicContact CG2-CG 4.16Å; V581-F618 HydrophobicContact CB-CE1 4.42Å; V581-F618 HydrophobicContact CB-CZ 4.49Å; V581-F618 HydrophobicContact CG1-CB 3.86Å; V581-F618 HydrophobicContact CG1-CD1 3.55Å; V581-F618 HydrophobicContact CG1-CD2 3.72Å; V581-F618 HydrophobicContact CG1-CE1 3.84Å; V581-F618 HydrophobicContact CG1-CE2 4.04Å; V581-F618 HydrophobicContact CG1-CG 3.46Å; V581-F618 VanDerWaalsContact CG1-CG 3.46Å; V581-F618 HydrophobicContact CG1-CZ 4.08Å
582	G	80.8	Confident	74.5	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.284	C	S	.	.			trans	68.1	-148.1	170	0	0	0	0	0	114.5	R566 C590	R566-G582 WeakPolarHBondContact CD-O 3.35Å; R566-G582 PolarHBondContact NH1-O 3.19Å; G582-C590 WeakPolarHBondContact CA-O 3.47Å
583	G	79.5	Confident	74.5	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.278	C	S	.	.			trans	92.3	174.6	-172.4	0	0	0	0	0	113.2	M567 C590	M567-G583 CarbonylContact O-C 3.51Å; M567-G583 WeakPolarHBondContact O-CA 3.29Å; G583-C590 PolarHBondContact O-N 3.37Å
584	Y	76	Confident	75.2	Confident	58 Å²	58	48.6 Å²	48.6	23%	0.227	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	165.2	176.1	62.3	-84.7	0	0	0	110.7	M567 Q588	M567-Y584 HydrophobicContact CE-CD2 4.44Å; M567-Y584 HydrophobicContact CE-CE1 4.26Å; M567-Y584 HydrophobicContact CE-CE2 3.47Å; M567-Y584 VanDerWaalsContact CE-CE2 3.47Å; M567-Y584 WeakPolarHBondContact CE-OH 3.44Å; M567-Y584 HydrophobicContact CG-CD1 4.36Å; M567-Y584 HydrophobicContact CG-CD2 3.77Å; M567-Y584 HydrophobicContact CG-CE1 4.32Å; M567-Y584 HydrophobicContact CG-CE2 3.73Å; M567-Y584 HydrophobicContact CG-CG 4.11Å; M567-Y584 WeakPolarHBondContact CG-O 3.47Å; M567-Y584 PolarHBondContact N-O 3.23Å; M567-Y584 PolarHBondContact O-N 2.9Å; M567-Y584 HydrophobicContact SD-CD2 3.73Å; M567-Y584 HydrophobicContact SD-CE2 3.23Å; M567-Y584 WeakPolarHBondContact SD-CE2 3.16Å; Y584-Q588 CarbonylContact C-O 3.5Å; Y584-Q588 WeakPolarHBondContact CA-O 3.17Å; Y584-Q588 WeakPolarHBondContact CB-O 3.25Å
585	F	77.3	Confident	76	Confident	93 Å²	93	48.6 Å²	48.6	41%	0.408	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	115.1	168.7	-176.8	-99.9	0	0	0	108.5	A543 K565 T587 Q588	A543-F585 HydrophobicContact CB-CD2 3.75Å; A543-F585 HydrophobicContact CB-CE2 3.88Å; K565-F585 HydrophobicContact CB-CB 4.19Å; K565-F585 HydrophobicContact CB-CD1 4.13Å; K565-F585 HydrophobicContact CB-CD2 4Å; K565-F585 HydrophobicContact CB-CE2 4.45Å; K565-F585 HydrophobicContact CB-CG 3.83Å; K565-F585 HydrophobicContact CD-CD1 4.24Å; K565-F585 HydrophobicContact CD-CE1 3.9Å; K565-F585 HydrophobicContact CD-CE2 4.38Å; K565-F585 HydrophobicContact CD-CZ 3.99Å; K565-F585 WeakPolarHBondContact O-CB 3.28Å; F585-T587 PolarHBondContact O-N 3.08Å; F585-Q588 PolarHBondContact N-O 3Å; F585-Q588 PolarHBondContact O-N 3.27Å; F585-Q588 VanDerWaalsContact O-N 3.08Å
586	G	74.1	Confident	76.9	Confident	64 Å²	64	46.1 Å²	46.1	66%	0.66	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	-123	-170	0	0	0	0	0	111.4
587	T	69.1	Low	77.3	Confident	142 Å²	142	42 Å²	42	87%	0.871	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-12.8	176.3	55.2	0	0	0	0	113.3	F585	F585-T587 PolarHBondContact O-N 3.08Å
588	Q	70.7	Confident	77.1	Confident	148 Å²	148	40.6 Å²	40.6	69%	0.692	22%	0.217	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	138.1	-177.8	-65.3	-173.1	-5.8	0	0	110.8	Y584 F585	Y584-Q588 CarbonylContact C-O 3.5Å; Y584-Q588 WeakPolarHBondContact CA-O 3.17Å; Y584-Q588 WeakPolarHBondContact CB-O 3.25Å; F585-Q588 PolarHBondContact N-O 3Å; F585-Q588 PolarHBondContact O-N 3.27Å; F585-Q588 VanDerWaalsContact O-N 3.08Å
589	R	74.2	Confident	76.7	Confident	100 Å²	100	46.5 Å²	46.5	38%	0.377	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	128.4	177.1	-64.9	-179.3	169.2	145.5	5.5	109.1	I614	R589-I614 HydrophobicContact CB-CD1 4.09Å; R589-I614 VanDerWaalsContact CD-CD1 3.49Å; R589-I614 HydrophobicContact CG-CD1 3.72Å
590	C	74.5	Confident	76.2	Confident	20 Å²	20	48.9 Å²	48.9	14%	0.135	27%	0.272	C	S	.	.			trans	-81.6	126.9	-178.3	-67.4	0	0	0	0	109.6	K565 R566 G582 G583	K565-C590 PolarHBondContact O-SG 2.79Å; K565-C590 VanDerWaalsContact O-SG 3.41Å; R566-C590 HydrophobicContact CG-CB 3.97Å; G582-C590 WeakPolarHBondContact CA-O 3.47Å; G583-C590 PolarHBondContact O-N 3.37Å
591	K	76.1	Confident	75.7	Confident	92 Å²	92	52.5 Å²	52.5	40%	0.4	29%	0.292	S	S	.	.			trans	-108	0.9	-178.9	-59.1	-178.1	-154.4	172.5	0	112.7	T608 V609 Y611	K591-T608 CarbonylContact O-C 3.52Å; K591-T608 WeakPolarHBondContact O-CA 3.48Å; K591-V609 WeakPolarHBondContact CB-O 3.47Å; K591-V609 VanDerWaalsContact O-CG2 3.24Å; K591-V609 WeakPolarHBondContact O-CG2 3.38Å; K591-V609 PolarHBondContact O-N 3.06Å; K591-Y611 HydrophobicContact CD-CD2 4.37Å
592	T	79.3	Confident	75.4	Confident	29 Å²	29	54.6 Å²	54.6	18%	0.178	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	140.4	-174	43.2	0	0	0	0	110.2	R566 D594 T608	R566-T592 PolarHBondContact NH1-O 2.86Å; R566-T592 PolarHBondContact NH2-O 2.81Å; R566-T592 PolarHBondContact NH2-OG1 2.9Å; T592-D594 WeakPolarHBondContact CB-OD1 3.47Å; T592-D594 PolarHBondContact OG1-OD1 3.32Å; T592-T608 HydrophobicContact CG2-CG2 4.04Å
593	L	83.8	Confident	75.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	106.5	162.3	176.5	69.5	0	0	0	106.9	V351 V580 V581 I606 T607 F618	V351-L593 HydrophobicContact CG1-CD2 3.85Å; V351-L593 HydrophobicContact CG2-CD2 4.5Å; V580-L593 CarbonylContact O-C 3.25Å; V580-L593 WeakPolarHBondContact O-CA 3.31Å; V581-L593 HydrophobicContact CB-CD1 3.74Å; V581-L593 HydrophobicContact CG2-CD1 4.2Å; L593-I606 PolarHBondContact O-N 2.74Å; L593-T607 HydrophobicContact CB-CG2 3.96Å; L593-T607 HydrophobicContact CD2-CG2 3.89Å; L593-T607 PolarHBondContact N-O 3.4Å; L593-F618 HydrophobicContact CD1-CE1 4.36Å; L593-F618 HydrophobicContact CD1-CZ 3.91Å
594	D	85.1	Confident	75.7	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	144.6	179.1	-63.9	-2.1	0	0	0	109.8	T563 R566 Y579 V580 T592 W603 N604	T563-D594 VanDerWaalsContact OG1-CG 3.3Å; T563-D594 PolarHBondContact OG1-OD1 3.1Å; T563-D594 PolarHBondContact OG1-OD2 2.89Å; R566-D594 IonicContact CZ-OD2 3.45Å; R566-D594 IonicContact NE-OD2 4Å; R566-D594 IonicContact NH2-OD1 3.87Å; R566-D594 PolarHBondContact NH2-OD1 3.12Å; R566-D594 IonicContact NH2-OD2 2.81Å; R566-D594 PolarHBondContact NH2-OD2 3.3Å; Y579-D594 CarbonylContact C-O 3.6Å; Y579-D594 WeakPolarHBondContact CA-O 3.43Å; V580-D594 PolarHBondContact N-O 3.14Å; V580-D594 PolarHBondContact O-N 2.96Å; T592-D594 WeakPolarHBondContact CB-OD1 3.47Å; T592-D594 PolarHBondContact OG1-OD1 3.32Å; D594-W603 HydrophobicContact CB-CE3 3.9Å; D594-W603 HydrophobicContact CB-CZ3 4.37Å; D594-N604 CarbonylContact C-O 3.57Å; D594-N604 WeakPolarHBondContact CA-O 3.48Å
595	C	83.4	Confident	75.9	Confident	10 Å²	10	60.3 Å²	60.3	7%	0.068	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	130.4	173.1	175.6	0	0	0	0	110.1	K577 L578 Y579 W603 N604 I606	K577-C595 VanDerWaalsContact CD-SG 3.53Å; L578-C595 CarbonylContact O-C 3.49Å; L578-C595 VanDerWaalsContact O-CA 3.23Å; L578-C595 WeakPolarHBondContact O-CA 3.32Å; Y579-C595 HydrophobicContact CD1-CB 3.97Å; Y579-C595 HydrophobicContact CE1-CB 3.91Å; C595-W603 WeakPolarHBondContact O-CA 3.45Å; C595-N604 PolarHBondContact N-O 2.82Å; C595-N604 PolarHBondContact O-N 3.45Å; C595-I606 HydrophobicContact CB-CD1 3.23Å; C595-I606 HydrophobicContact CB-CG1 3.7Å
596	Y	77.4	Confident	75.8	Confident	6 Å²	6	58.3 Å²	58.3	2%	0.024	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	128.9	171.7	174.3	-103.2	0	0	0	110.2	F533 L578 P598 D601 S602 W603	F533-Y596 HydrophobicContact CD1-CE1 4.41Å; F533-Y596 AromaticContact CE1-CE1 3.74Å; F533-Y596 HydrophobicContact CE1-CE1 3.74Å; F533-Y596 HydrophobicContact CZ-CE1 4.31Å; L578-Y596 HydrophobicContact CB-CD1 4.38Å; L578-Y596 HydrophobicContact CD1-CD1 3.97Å; L578-Y596 PolarHBondContact N-O 2.96Å; L578-Y596 PolarHBondContact O-N 3.09Å; Y596-P598 HydrophobicContact CE1-CB 4.09Å; Y596-D601 VanDerWaalsContact CE2-OD1 3.28Å; Y596-D601 WeakPolarHBondContact CE2-OD1 3.49Å; Y596-D601 PolarHBondContact OH-OD1 3.1Å; Y596-S602 WeakPolarHBondContact CA-O 3.31Å; Y596-W603 AromaticContact CD2-CD1 3.75Å; Y596-W603 AromaticContact CD2-CD2 3.96Å; Y596-W603 HydrophobicContact CD2-CD2 3.96Å; Y596-W603 AromaticContact CD2-CE2 3.57Å; Y596-W603 HydrophobicContact CD2-CG 4.06Å; Y596-W603 HydrophobicContact CD2-CZ2 4.04Å; Y596-W603 AromaticContact CD2-NE1 3.45Å; Y596-W603 HydrophobicContact CG-CD2 4.25Å; Y596-W603 AromaticContact CG-CE2 3.89Å; Y596-W603 HydrophobicContact CG-CH2 4.32Å; Y596-W603 AromaticContact CG-CZ2 3.95Å; Y596-W603 HydrophobicContact CG-CZ2 3.95Å
597	D	68.2	Low	75.8	Confident	27 Å²	27	56.6 Å²	56.6	14%	0.144	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	115.3	171.5	-163.6	-40.7	0	0	0	109.5	K577 T599 D601 S602	K577-D597 IonicContact NZ-OD2 3.93Å; K577-D597 PolarHBondContact NZ-OD2 2.89Å; D597-T599 PolarHBondContact O-N 3.4Å; D597-T599 WeakPolarHBondContact OD1-CB 3.2Å; D597-T599 PolarHBondContact OD1-N 2.73Å; D597-T599 PolarHBondContact OD1-OG1 2.82Å; D597-D601 PolarHBondContact O-N 2.92Å; D597-S602 PolarHBondContact N-O 3.34Å; D597-S602 PolarHBondContact O-N 2.91Å
598	P	63.4	Low	75.9	Confident	44 Å²	44	54.1 Å²	54.1	29%	0.286	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-19.8	-179.3	31.3	-39.3	0	0	0	113.1	L528 Y596	L528-P598 HydrophobicContact CD2-CB 3.95Å; L528-P598 HydrophobicContact CD2-CG 3.88Å; Y596-P598 HydrophobicContact CE1-CB 4.09Å
599	T	66.1	Low	75.9	Confident	124 Å²	124	47.2 Å²	47.2	76%	0.761	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-35.1	-177.9	65.2	0	0	0	0	112.3	D597	D597-T599 PolarHBondContact O-N 3.4Å; D597-T599 WeakPolarHBondContact OD1-CB 3.2Å; D597-T599 PolarHBondContact OD1-N 2.73Å; D597-T599 PolarHBondContact OD1-OG1 2.82Å
600	S	69.7	Low	75.3	Confident	69 Å²	69	45.4 Å²	45.4	48%	0.483	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-1.7	179	60.2	0	0	0	0	114	S602	S600-S602 PolarHBondContact O-N 3.45Å; S600-S602 PolarHBondContact OG-OG 2.92Å
601	D	76.3	Confident	74.1	Confident	77 Å²	77	51.5 Å²	51.5	41%	0.412	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	41.1	-174.7	-166.8	26.1	0	0	0	112.9	G560 Y596 D597	G560-D601 PolarHBondContact N-OD1 3.26Å; Y596-D601 VanDerWaalsContact CE2-OD1 3.28Å; Y596-D601 WeakPolarHBondContact CE2-OD1 3.49Å; Y596-D601 PolarHBondContact OH-OD1 3.1Å; D597-D601 PolarHBondContact O-N 2.92Å
602	S	78.9	Confident	72.9	Confident	43 Å²	43	48.4 Å²	48.4	30%	0.301	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	147.2	-173.8	66.9	0	0	0	0	113.2	Y596 D597 S600	Y596-S602 WeakPolarHBondContact CA-O 3.31Å; D597-S602 PolarHBondContact N-O 3.34Å; D597-S602 PolarHBondContact O-N 2.91Å; S600-S602 PolarHBondContact O-N 3.45Å; S600-S602 PolarHBondContact OG-OG 2.92Å
603	W	83.4	Confident	71.7	Confident	19 Å²	19	47.2 Å²	47.2	7%	0.072	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.5	177.6	-70.2	89.7	0	0	0	110.7	M535 A546 G560 M562 T563 V580 D594 C595 Y596	M535-W603 HydrophobicContact SD-CH2 3.57Å; M535-W603 VanDerWaalsContact SD-CH2 3.57Å; M535-W603 HydrophobicContact SD-CZ2 4.12Å; A546-W603 HydrophobicContact CB-CZ2 4.39Å; G560-W603 PolarHBondContact O-NE1 3.04Å; M562-W603 HydrophobicContact CG-CD2 4.19Å; M562-W603 HydrophobicContact CG-CH2 4.44Å; M562-W603 HydrophobicContact CG-CZ2 4.04Å; T563-W603 HydrophobicContact CG2-CB 3.81Å; V580-W603 HydrophobicContact CB-CH2 4.5Å; V580-W603 HydrophobicContact CB-CZ3 4.02Å; V580-W603 HydrophobicContact CG2-CH2 3.48Å; V580-W603 VanDerWaalsContact CG2-CH2 3.48Å; V580-W603 HydrophobicContact CG2-CZ3 3.44Å; V580-W603 VanDerWaalsContact CG2-CZ3 3.44Å; D594-W603 HydrophobicContact CB-CE3 3.9Å; D594-W603 HydrophobicContact CB-CZ3 4.37Å; C595-W603 WeakPolarHBondContact O-CA 3.45Å; Y596-W603 AromaticContact CD2-CD1 3.75Å; Y596-W603 AromaticContact CD2-CD2 3.96Å; Y596-W603 HydrophobicContact CD2-CD2 3.96Å; Y596-W603 AromaticContact CD2-CE2 3.57Å; Y596-W603 HydrophobicContact CD2-CG 4.06Å; Y596-W603 HydrophobicContact CD2-CZ2 4.04Å; Y596-W603 AromaticContact CD2-NE1 3.45Å; Y596-W603 HydrophobicContact CG-CD2 4.25Å; Y596-W603 AromaticContact CG-CE2 3.89Å; Y596-W603 HydrophobicContact CG-CH2 4.32Å; Y596-W603 AromaticContact CG-CZ2 3.95Å; Y596-W603 HydrophobicContact CG-CZ2 3.95Å
604	N	82	Confident	70.6	Confident	95 Å²	95	47.6 Å²	47.6	51%	0.508	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	137.1	178	-66.1	-52.7	0	0	0	110.8	D594 C595 I606	D594-N604 CarbonylContact C-O 3.57Å; D594-N604 WeakPolarHBondContact CA-O 3.48Å; C595-N604 PolarHBondContact N-O 2.82Å; C595-N604 PolarHBondContact O-N 3.45Å; N604-I606 PolarHBondContact O-N 2.78Å
605	S	81.1	Confident	69.6	Low	65 Å²	65	47.7 Å²	47.7	46%	0.455	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	118.8	173.8	174.2	0	0	0	0	110
606	I	75.3	Confident	68.7	Low	51 Å²	51	47.8 Å²	47.8	26%	0.262	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-51	-179.6	-65.8	-178.1	0	0	0	111.3	Y579 L593 C595 N604	Y579-I606 HydrophobicContact CD1-CD1 3.96Å; Y579-I606 HydrophobicContact CE1-CD1 3.44Å; Y579-I606 VanDerWaalsContact CE1-CD1 3.44Å; L593-I606 PolarHBondContact O-N 2.74Å; C595-I606 HydrophobicContact CB-CD1 3.23Å; C595-I606 HydrophobicContact CB-CG1 3.7Å; N604-I606 PolarHBondContact O-N 2.78Å
607	T	73.3	Confident	68.3	Low	28 Å²	28	47.7 Å²	47.7	17%	0.172	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	172.8	-174.6	-168.1	0	0	0	0	110.5	L593	L593-T607 HydrophobicContact CB-CG2 3.96Å; L593-T607 HydrophobicContact CD2-CG2 3.89Å; L593-T607 PolarHBondContact N-O 3.4Å
608	T	71.7	Confident	68.8	Low	89 Å²	89	47 Å²	47	55%	0.546	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	131.2	175.7	55.9	0	0	0	0	111.2	K591 T592	K591-T608 CarbonylContact O-C 3.52Å; K591-T608 WeakPolarHBondContact O-CA 3.48Å; T592-T608 HydrophobicContact CG2-CG2 4.04Å
609	V	70.3	Confident	69.5	Low	4 Å²	4	45.1 Å²	45.1	2%	0.024	26%	0.259	C	S	.	.			trans	-85	140.3	172.4	-60.7	0	0	0	0	111	I337 I358 V581 K591	I337-V609 HydrophobicContact CD1-CG1 3.8Å; I358-V609 HydrophobicContact CD1-CB 4.22Å; I358-V609 HydrophobicContact CD1-CG1 3.82Å; V581-V609 HydrophobicContact CG2-CG1 3.8Å; V581-V609 HydrophobicContact CG2-CG2 4.21Å; K591-V609 WeakPolarHBondContact CB-O 3.47Å; K591-V609 VanDerWaalsContact O-CG2 3.24Å; K591-V609 WeakPolarHBondContact O-CG2 3.38Å; K591-V609 PolarHBondContact O-N 3.06Å
610	P	61.9	Low	69.7	Low	62 Å²	62	40.1 Å²	40.1	40%	0.403	23%	0.229	S	C	.	.			trans	-51.8	149.1	176.2	-28.2	29.7	0	0	0	114.9	S612 L613	P610-S612 PolarHBondContact O-N 3.02Å; P610-L613 HydrophobicContact CB-CD1 3.98Å; P610-L613 HydrophobicContact CB-CG 4.45Å; P610-L613 HydrophobicContact CG-CD1 3.95Å; P610-L613 WeakPolarHBondContact O-CB 3.29Å; P610-L613 PolarHBondContact O-N 3.32Å
611	Y	50	Low	69.3	Low	147 Å²	147	37 Å²	37	58%	0.576	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-24.8	-173.6	-166	-88.7	0	0	0	115.1	K591 L613	K591-Y611 HydrophobicContact CD-CD2 4.37Å; Y611-L613 VanDerWaalsContact C-N 3.27Å; Y611-L613 PolarHBondContact O-N 3Å
612	S	49.9	Very low	68.5	Low	28 Å²	28	38.1 Å²	38.1	20%	0.196	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-5.5	-179.4	48.3	0	0	0	0	114.3	M344 P610	M344-S612 PolarHBondContact SD-OG 2.97Å; P610-S612 PolarHBondContact O-N 3.02Å
613	L	54.7	Low	67	Low	4 Å²	4	39.4 Å²	39.4	2%	0.021	21%	0.205	C	C	.	.			trans	-118.5	66.2	-163.9	-56.5	173.4	0	0	0	112.9	Y349 P610 Y611 P615	Y349-L613 HydrophobicContact CD1-CD1 4.35Å; Y349-L613 HydrophobicContact CD2-CD1 3.72Å; Y349-L613 HydrophobicContact CD2-CD2 3.81Å; Y349-L613 HydrophobicContact CD2-CG 4.4Å; Y349-L613 HydrophobicContact CE1-CD1 4.08Å; Y349-L613 HydrophobicContact CE2-CD1 3.48Å; Y349-L613 VanDerWaalsContact CE2-CD1 3.48Å; Y349-L613 HydrophobicContact CE2-CD2 3.11Å; Y349-L613 HydrophobicContact CE2-CG 3.9Å; Y349-L613 HydrophobicContact CG-CD1 4.15Å; P610-L613 HydrophobicContact CB-CD1 3.98Å; P610-L613 HydrophobicContact CB-CG 4.45Å; P610-L613 HydrophobicContact CG-CD1 3.95Å; P610-L613 WeakPolarHBondContact O-CB 3.29Å; P610-L613 PolarHBondContact O-N 3.32Å; Y611-L613 VanDerWaalsContact C-N 3.27Å; Y611-L613 PolarHBondContact O-N 3Å; L613-P615 WeakPolarHBondContact O-CD 3.24Å
614	I	60.8	Low	65	Low	7 Å²	7	43 Å²	43	4%	0.036	22%	0.223	C	C	.	.			trans	-76.9	103.9	152.8	-65.2	175.2	0	0	0	105.6	G340 Q341 R589 T616	G340-I614 VanDerWaalsContact CA-O 3.25Å; G340-I614 WeakPolarHBondContact CA-O 3.38Å; Q341-I614 HydrophobicContact CB-CB 4.46Å; Q341-I614 HydrophobicContact CB-CG2 4.45Å; Q341-I614 PolarHBondContact N-O 3.37Å; R589-I614 HydrophobicContact CB-CD1 4.09Å; R589-I614 VanDerWaalsContact CD-CD1 3.49Å; R589-I614 HydrophobicContact CG-CD1 3.72Å; I614-T616 PolarHBondContact O-N 3.04Å
615	P	62.8	Low	62.8	Low	2 Å²	2	41.3 Å²	41.3	1%	0.013	21%	0.214	C	C	.	.			trans	-60.6	139.7	-173.3	17	-20.4	0	0	0	110.5	I337 G339 H570 V581 L613 A617	I337-P615 HydrophobicContact CG2-CB 3.83Å; I337-P615 HydrophobicContact CG2-CG 4.35Å; G339-P615 WeakPolarHBondContact O-CA 3.23Å; H570-P615 PolarHBondContact CE1-O 2.91Å; H570-P615 PolarHBondContact ND1-O 3.25Å; V581-P615 HydrophobicContact CB-CG 4.37Å; V581-P615 HydrophobicContact CG1-CG 3.57Å; V581-P615 HydrophobicContact CG2-CG 4.16Å; L613-P615 WeakPolarHBondContact O-CD 3.24Å; P615-A617 WeakPolarHBondContact CB-O 3.24Å
616	T	64.8	Low	60.4	Low	12 Å²	12	42.9 Å²	42.9	7%	0.074	22%	0.222	C	C	.	.	S	Bend	trans	-83.5	-24.3	169.9	-56.7	0	0	0	0	110.7	L338 E370 F371 H570 I614	L338-T616 PolarHBondContact O-N 3.01Å; E370-T616 VanDerWaalsContact N-CG2 3.28Å; F371-T616 HydrophobicContact CD1-CG2 3.47Å; F371-T616 VanDerWaalsContact CD1-CG2 3.47Å; F371-T616 HydrophobicContact CD2-CG2 4.18Å; F371-T616 HydrophobicContact CE1-CG2 3.51Å; F371-T616 HydrophobicContact CE2-CG2 4.22Å; F371-T616 HydrophobicContact CG-CG2 3.83Å; F371-T616 HydrophobicContact CZ-CG2 3.91Å; H570-T616 PolarHBondContact CE1-O 3.36Å; H570-T616 VanDerWaalsContact CE1-O 3.32Å; H570-T616 PolarHBondContact NE2-O 3.2Å; H570-T616 VanDerWaalsContact NE2-O 3.08Å; I614-T616 PolarHBondContact O-N 3.04Å
617	A	70.6	Confident	58.2	Low	4 Å²	4	48.2 Å²	48.2	3%	0.033	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	157.7	165.5	0	0	0	0	0	111.1	L338 F371 A373 P615	L338-A617 HydrophobicContact CB-CB 4.26Å; L338-A617 HydrophobicContact CD1-CB 4.17Å; L338-A617 PolarHBondContact N-O 2.86Å; L338-A617 PolarHBondContact O-N 3.13Å; L338-A617 VanDerWaalsContact O-N 3.14Å; F371-A617 HydrophobicContact CD2-CB 4.38Å; F371-A617 HydrophobicContact CE2-CB 3.91Å; A373-A617 HydrophobicContact CB-CB 3.46Å; A373-A617 VanDerWaalsContact CB-CB 3.46Å; P615-A617 WeakPolarHBondContact CB-O 3.24Å
618	F	77.9	Confident	57.4	Low	12 Å²	12	49.3 Å²	49.3	5%	0.053	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	124	175.9	-173.8	-137	0	0	0	108.4	L335 L336 I337 H570 V572 V581 L593	L335-F618 HydrophobicContact CB-CE2 3.86Å; L335-F618 HydrophobicContact CB-CZ 3.98Å; L335-F618 HydrophobicContact CD1-CZ 3.87Å; L335-F618 HydrophobicContact CD2-CZ 4.28Å; L335-F618 HydrophobicContact CG-CZ 4.28Å; L336-F618 VanDerWaalsContact O-CD2 3.31Å; L336-F618 WeakPolarHBondContact O-CD2 3.36Å; I337-F618 HydrophobicContact CD1-CE2 4.5Å; I337-F618 HydrophobicContact CG1-CD2 3.75Å; I337-F618 HydrophobicContact CG1-CE2 3.66Å; H570-F618 HydrophobicContact CB-CB 3.47Å; H570-F618 VanDerWaalsContact CB-CB 3.47Å; V572-F618 HydrophobicContact CB-CD1 3.9Å; V572-F618 HydrophobicContact CB-CE1 4.13Å; V572-F618 HydrophobicContact CG1-CD1 3.49Å; V572-F618 VanDerWaalsContact CG1-CD1 3.49Å; V572-F618 HydrophobicContact CG1-CE1 3.24Å; V572-F618 HydrophobicContact CG1-CG 4.32Å; V572-F618 HydrophobicContact CG1-CZ 3.86Å; V581-F618 HydrophobicContact CB-CE1 4.42Å; V581-F618 HydrophobicContact CB-CZ 4.49Å; V581-F618 HydrophobicContact CG1-CB 3.86Å; V581-F618 HydrophobicContact CG1-CD1 3.55Å; V581-F618 HydrophobicContact CG1-CD2 3.72Å; V581-F618 HydrophobicContact CG1-CE1 3.84Å; V581-F618 HydrophobicContact CG1-CE2 4.04Å; V581-F618 HydrophobicContact CG1-CG 3.46Å; V581-F618 VanDerWaalsContact CG1-CG 3.46Å; V581-F618 HydrophobicContact CG1-CZ 4.08Å; L593-F618 HydrophobicContact CD1-CE1 4.36Å; L593-F618 HydrophobicContact CD1-CZ 3.91Å
619	V	77.1	Confident	56.7	Low	6 Å²	6	47.2 Å²	47.2	4%	0.036	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	151	-174.8	-61.4	0	0	0	0	110.6	L336 L338 A373 A375 V380 T621	L336-V619 HydrophobicContact CB-CG2 3.84Å; L336-V619 HydrophobicContact CD1-CG2 4.48Å; L336-V619 PolarHBondContact N-O 3.03Å; L336-V619 PolarHBondContact O-N 2.76Å; L338-V619 HydrophobicContact CD1-CG1 4.3Å; L338-V619 HydrophobicContact CD1-CG2 3.92Å; A373-V619 HydrophobicContact CB-CG1 3.88Å; A373-V619 WeakPolarHBondContact O-CG1 3.29Å; A375-V619 HydrophobicContact CB-CB 4.25Å; V380-V619 HydrophobicContact CG1-CG2 3.97Å; V380-V619 HydrophobicContact CG2-CG2 3.98Å; V619-T621 HydrophobicContact CG2-CG2 4.36Å
620	S	70.6	Confident	55.9	Low	19 Å²	19	49.6 Å²	49.6	13%	0.133	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	123.6	170.2	178.1	0	0	0	0	107.3	H333 T334 A375	H333-S620 WeakPolarHBondContact CB-OG 3.32Å; H333-S620 PolarHBondContact ND1-OG 2.97Å; H333-S620 VanDerWaalsContact ND1-OG 3.14Å; T334-S620 WeakPolarHBondContact O-CA 3.3Å; A375-S620 WeakPolarHBondContact CB-O 3.08Å
621	T	63	Low	55.6	Low	2 Å²	2	48.8 Å²	48.8	1%	0.012	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	165.4	175.9	61	0	0	0	0	109.6	H333 T334 L336 A375 V380 T401 V619	H333-T621 CarbonylContact C-O 3.57Å; H333-T621 WeakPolarHBondContact CA-O 3.18Å; T334-T621 PolarHBondContact N-O 3.27Å; T334-T621 PolarHBondContact O-N 3.05Å; L336-T621 HydrophobicContact CD1-CG2 3.84Å; A375-T621 HydrophobicContact CB-CG2 3.58Å; V380-T621 HydrophobicContact CG2-CG2 3.24Å; T401-T621 HydrophobicContact CG2-CG2 4.16Å; V619-T621 HydrophobicContact CG2-CG2 4.36Å
622	W	57.7	Low	55.9	Low	102 Å²	102	42.7 Å²	42.7	39%	0.386	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	135.4	164.6	-57.2	-16.5	0	0	0	109.6	P328 G377 T401	P328-W622 HydrophobicContact CG-CE3 4.21Å; P328-W622 HydrophobicContact CG-CZ3 4.42Å; G377-W622 PolarHBondContact O-N 2.97Å; T401-W622 PolarHBondContact OG1-O 2.85Å
623	K	47.4	Very low	56.3	Low	70 Å²	70	43.7 Å²	43.7	30%	0.304	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-79.6	122.8	174.1	-170.2	172.8	-173	-167.3	0	108	G332 T334 L625	G332-K623 WeakPolarHBondContact O-CA 3.36Å; G332-K623 WeakPolarHBondContact O-CB 3Å; G332-K623 PolarHBondContact O-N 3Å; T334-K623 WeakPolarHBondContact OG1-CB 3.44Å; T334-K623 WeakPolarHBondContact OG1-CD 3.26Å; T334-K623 WeakPolarHBondContact OG1-CG 3.1Å; K623-L625 HydrophobicContact CD-CD2 3.81Å; K623-L625 HydrophobicContact CD-CG 4.43Å; K623-L625 VanDerWaalsContact CE-CD2 3.47Å; K623-L625 HydrophobicContact CG-CD2 4.27Å; K623-L625 HydrophobicContact CG-CG 4.47Å
624	H	42.4	Very low	56.4	Low	93 Å²	93	46.5 Å²	46.5	43%	0.431	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-82.6	127.5	154.5	-165	-57.1	0	0	0	106.9	V402 P626	V402-H624 HydrophobicContact CB-CB 4.42Å; V402-H624 WeakPolarHBondContact CG1-CD2 3.48Å; V402-H624 HydrophobicContact CG2-CB 4.13Å; H624-P626 VanDerWaalsContact O-CD 3.31Å; H624-P626 WeakPolarHBondContact O-CD 3.45Å
625	L	35.7	Very low	56.1	Low	61 Å²	61	49.5 Å²	49.5	32%	0.319	29%	0.291	S	S	.	.			trans	-86.6	110.3	168.4	-69.3	164.5	0	0	0	106	E243 K623	E243-L625 HydrophobicContact CB-CB 4.26Å; E243-L625 HydrophobicContact CB-CD1 4.21Å; E243-L625 HydrophobicContact CG-CD1 3.95Å; K623-L625 HydrophobicContact CD-CD2 3.81Å; K623-L625 HydrophobicContact CD-CG 4.43Å; K623-L625 VanDerWaalsContact CE-CD2 3.47Å; K623-L625 HydrophobicContact CG-CD2 4.27Å; K623-L625 HydrophobicContact CG-CG 4.47Å
626	P	29.6	Very low	55.5	Low	97 Å²	97	53.5 Å²	53.5	63%	0.63	31%	0.314	S	S	*	.			trans	-67	145	173.2	27.5	-31.7	0	0	0	109.7	H624	H624-P626 VanDerWaalsContact O-CD 3.31Å; H624-P626 WeakPolarHBondContact O-CD 3.45Å
627	A	29.4	Very low	54.7	Low	164 Å²	164	57.3 Å²	57.3	100%	1.355	34%	0.336	S	S	*	.			trans	-59.3	0	-174.2	0	0	0	0	0	115.9

Retrieved 627 of 627 residues in 411.8 ms (Link to these results)

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