A0A2K5XTU6_MANLE Loading...

BMP/retinoic acid inducible neural specific 2

AlphaFold DB , UniProt , Accession A0A2K5XTU6, Species MANLE (Mandrillus leucophaeus, Drill), Gene BRINP2, Length 783 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	24.2	Very low	24.9	Very low	228 Å²	228	184.2 Å²	184.2	100%	1.123	89%	0.893	S	S	*	*				0	119.9	0	-70.9	-178.2	173.9	0	0	108.1
2	R	21.5	Very low	24.9	Very low	254 Å²	254	183.8 Å²	183.8	96%	0.958	90%	0.897	S	S	*	*			trans	-97.6	121.1	172.3	-76	-179.9	175.8	176.6	-1.2	106.9
3	W	26.1	Very low	24.8	Very low	238 Å²	238	188.5 Å²	188.5	90%	0.902	90%	0.899	S	S	*	*			trans	-108.2	115.5	170.9	-88.4	55.6	0	0	0	108.1
4	Q	24.9	Very low	25.1	Very low	191 Å²	191	184.2 Å²	184.2	89%	0.893	89%	0.894	S	S	*	*			trans	-78	129.5	170.5	-79.1	176.8	-22.4	0	0	108.7	G6	Q4-G6 PolarHBondContact O-N 2.76Å
5	C	24.6	Very low	25	Very low	138 Å²	138	178.6 Å²	178.6	93%	0.932	89%	0.89	S	S	*	*			trans	-80.3	108.7	177.9	-155.3	0	0	0	0	108.8
6	G	25.6	Very low	24.9	Very low	70 Å²	70	176.6 Å²	176.6	72%	0.722	89%	0.889	S	S	*	*			trans	-79.5	140.6	-179	0	0	0	0	0	113.4	Q4	Q4-G6 PolarHBondContact O-N 2.76Å
7	T	27.6	Very low	24.9	Very low	129 Å²	129	171.5 Å²	171.5	79%	0.791	88%	0.881	S	S	*	*			trans	-52.9	148.3	-179.9	39.7	0	0	0	0	117.1
8	R	28.5	Very low	25.3	Very low	249 Å²	249	167.9 Å²	167.9	94%	0.94	87%	0.871	S	S	*	*			trans	-35.5	128.4	162.5	-93.1	174	166.4	171.2	-3.1	113.6
9	F	23.3	Very low	25.3	Very low	213 Å²	213	172.6 Å²	172.6	93%	0.934	88%	0.876	S	S	*	*			trans	-120.1	135.7	151.3	-104.8	-87.9	0	0	0	109.9
10	R	23.7	Very low	25.4	Very low	250 Å²	250	170.4 Å²	170.4	94%	0.943	87%	0.871	S	S	*	*			trans	-109.3	129.7	-174.1	-147	-174.9	-164.8	-170.8	2.9	107.8
11	G	23.7	Very low	25.5	Very low	66 Å²	66	166 Å²	166	68%	0.68	86%	0.861	S	S	*	*			trans	87.9	108.9	151.4	0	0	0	0	0	117.1
12	L	24.9	Very low	25.6	Very low	180 Å²	180	162.6 Å²	162.6	94%	0.942	85%	0.847	S	S	*	*			trans	-166.2	133	130.2	-100.4	139.7	0	0	0	108.8
13	R	24.6	Very low	25.9	Very low	244 Å²	244	157.9 Å²	157.9	92%	0.921	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-62.3	149.9	-179.4	-64.2	173.2	171.3	-179.6	-3.7	111
14	P	28.1	Very low	25.9	Very low	129 Å²	129	150.3 Å²	150.3	84%	0.838	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-97.3	136.1	158	32.9	-23.5	0	0	0	111
15	A	23.6	Very low	25.9	Very low	100 Å²	100	149.3 Å²	149.3	83%	0.826	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-80.9	156.7	168.7	0	0	0	0	0	111
16	V	23.5	Very low	26	Very low	146 Å²	146	145.8 Å²	145.8	89%	0.885	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-62.4	137.2	-179.4	176.9	0	0	0	0	112.5
17	A	25.2	Very low	26.1	Very low	91 Å²	91	150.2 Å²	150.2	75%	0.752	82%	0.821	S	S	*	*				175.3	154.8	122.3	0	0	0	0	0	113.1
18	P	31.5	Very low	26.4	Very low	106 Å²	106	149 Å²	149	69%	0.688	82%	0.815	S	S	*	*			trans	-116.7	153.3	-152.3	38.2	-24.5	0	0	0	113.8
19	W	26.5	Very low	26	Very low	258 Å²	258	140.4 Å²	140.4	98%	0.977	81%	0.805	S	S	*	*			trans	-139	111	157.7	-79.9	76.3	0	0	0	110.9
20	T	27.2	Very low	26.1	Very low	127 Å²	127	141.9 Å²	141.9	78%	0.779	80%	0.804	S	S	*	*			trans	-52.8	160.4	152	51.3	0	0	0	0	110.2
21	A	26.8	Very low	26.1	Very low	80 Å²	80	135.8 Å²	135.8	66%	0.661	79%	0.794	S	S	*	*			cis	-172.5	142.2	23.5	0	0	0	0	0	105.8
22	L	26.9	Very low	26.1	Very low	155 Å²	155	140.5 Å²	140.5	81%	0.812	80%	0.803	S	S	*	*				145	127.1	100.9	-87.3	155.4	0	0	0	104.1
23	L	28	Very low	26	Very low	155 Å²	155	136.6 Å²	136.6	81%	0.812	80%	0.797	S	S	*	*				-175.2	120.5	74.8	-77	164.4	0	0	0	105
24	A	24.8	Very low	25.9	Very low	80 Å²	80	131.7 Å²	131.7	66%	0.661	79%	0.794	S	S	*	*				44.9	126.1	77.8	0	0	0	0	0	113.5
25	L	26.1	Very low	25.7	Very low	170 Å²	170	131.4 Å²	131.4	89%	0.89	80%	0.795	S	S	*	*			cis	-171.4	156.5	10.9	-102.7	157.7	0	0	0	109
26	G	26	Very low	25.6	Very low	64 Å²	64	131.1 Å²	131.1	66%	0.66	79%	0.792	S	S	*	*			trans	124.8	84	149.6	0	0	0	0	0	115.7
27	L	28.5	Very low	25.6	Very low	162 Å²	162	131 Å²	131	85%	0.848	79%	0.792	S	S	*	*				68.4	149.6	88.8	-75	168.3	0	0	0	115.5
28	P	32.5	Very low	25.5	Very low	103 Å²	103	131.9 Å²	131.9	67%	0.669	80%	0.799	S	S	*	*			cis	-130.6	170.1	-43.3	33.9	-15.9	0	0	0	112.5
29	G	21.6	Very low	25	Very low	70 Å²	70	131.5 Å²	131.5	72%	0.722	81%	0.805	S	S	*	*			trans	-82.1	146.5	172.3	0	0	0	0	0	113.4
30	W	24.9	Very low	24.9	Very low	243 Å²	243	123.9 Å²	123.9	92%	0.92	80%	0.797	S	S	*	*			trans	-134.9	143.4	161.3	-87.8	65.5	0	0	0	109.8
31	V	23.4	Very low	24.7	Very low	122 Å²	122	124.2 Å²	124.2	74%	0.739	80%	0.799	S	S	*	*			trans	-116.5	145.6	-166.3	161.1	0	0	0	0	108.7
32	L	23.5	Very low	24.8	Very low	166 Å²	166	126.8 Å²	126.8	87%	0.869	81%	0.806	S	S	*	*			trans	74.8	121.8	164.5	-69.4	156.8	0	0	0	118.7
33	A	22.5	Very low	24.6	Very low	97 Å²	97	124.6 Å²	124.6	80%	0.802	80%	0.801	S	S	*	*				166.9	153.6	83.5	0	0	0	0	0	111.8
34	V	22.3	Very low	24.3	Very low	141 Å²	141	125.6 Å²	125.6	86%	0.855	80%	0.802	S	S	*	*			trans	-82.4	139.6	-174.6	168.5	0	0	0	0	111.9
35	S	23.7	Very low	24.3	Very low	123 Å²	123	130.4 Å²	130.4	86%	0.86	81%	0.81	S	S	*	*			trans	-163	127.4	140.5	38.4	0	0	0	0	111.6
36	A	21.6	Very low	24.3	Very low	94 Å²	94	132.2 Å²	132.2	78%	0.777	81%	0.814	S	S	*	*			trans	-85.2	143.6	-176.9	0	0	0	0	0	112.4
37	T	24.2	Very low	24.6	Very low	145 Å²	145	133.5 Å²	133.5	89%	0.89	82%	0.818	S	S	*	*			trans	-138.5	112.3	149.3	46.2	0	0	0	0	108.6
38	A	22.6	Very low	24.3	Very low	108 Å²	108	131.5 Å²	131.5	89%	0.893	82%	0.818	S	S	*	*			trans	-76	131.9	176.4	0	0	0	0	0	110.7
39	A	22.4	Very low	23.9	Very low	98 Å²	98	132 Å²	132	81%	0.81	82%	0.819	S	S	*	*			trans	-135	121.5	154.4	0	0	0	0	0	107.4
40	A	24.3	Very low	24.4	Very low	99 Å²	99	133.3 Å²	133.3	82%	0.818	82%	0.823	S	S	*	*			trans	-69.2	131	-169.5	0	0	0	0	0	112.5
41	V	22.5	Very low	24.6	Very low	134 Å²	134	125 Å²	125	81%	0.812	81%	0.812	S	S	*	*			trans	-134.3	117.6	153	179.6	0	0	0	0	106.3	P43	V41-P43 WeakPolarHBondContact O-CD 3.46Å
42	V	28.4	Very low	25.1	Very low	133 Å²	133	127.7 Å²	127.7	81%	0.806	82%	0.817	S	S	*	*			trans	-71.7	135.3	170.4	174.5	0	0	0	0	108.2
43	P	22.5	Very low	26	Very low	110 Å²	110	125.9 Å²	125.9	71%	0.714	80%	0.804	S	S	*	*			trans	-130	131.4	142.7	21.4	-2	0	0	0	112.5	V41	V41-P43 WeakPolarHBondContact O-CD 3.46Å
44	E	22.7	Very low	27.2	Very low	175 Å²	175	126.5 Å²	126.5	82%	0.818	80%	0.8	S	S	*	*			trans	-47.8	134.1	149.8	-72.3	173.7	117.1	0	0	110.3
45	Q	23.8	Very low	28.7	Very low	181 Å²	181	125.1 Å²	125.1	85%	0.846	79%	0.787	S	S	*	*			trans	162	117.7	131.2	-89.1	170.2	3.4	0	0	110.2	A47	Q45-A47 PolarHBondContact O-N 3.01Å
46	H	27.3	Very low	30.2	Very low	209 Å²	209	122.2 Å²	122.2	97%	0.968	76%	0.761	S	S	*	*			trans	-68	83.1	161	-80.4	-61.9	0	0	0	110
47	A	30.7	Very low	32.1	Very low	91 Å²	91	125.1 Å²	125.1	75%	0.752	75%	0.752	S	S	*	*			trans	-164.5	94.4	153.6	0	0	0	0	0	108.3	Q45	Q45-A47 PolarHBondContact O-N 3.01Å
48	S	22.1	Very low	34	Very low	119 Å²	119	119.5 Å²	119.5	83%	0.832	72%	0.717	S	S	*	*			trans	-128.6	140.7	165.5	62.1	0	0	0	0	112.3
49	V	26.1	Very low	36	Very low	114 Å²	114	117.6 Å²	117.6	69%	0.691	69%	0.691	S	S	*	*			trans	-84.9	146.3	-176.5	165.1	0	0	0	0	109.4
50	A	31.9	Very low	38	Very low	97 Å²	97	115 Å²	115	80%	0.802	67%	0.665	S	S	*	*	S	Bend	trans	63.8	125.2	161.1	0	0	0	0	0	118.1
51	G	27.7	Very low	39.8	Very low	68 Å²	68	111.6 Å²	111.6	70%	0.701	63%	0.633	S	S	*	*	S	Bend	trans	117.3	116.4	176.5	0	0	0	0	0	109.5	H53	G51-H53 PolarHBondContact O-N 2.81Å
52	Q	35.1	Very low	41.6	Very low	179 Å²	179	109.4 Å²	109.4	84%	0.836	61%	0.61	S	S	*	*			trans	-45.3	128.2	161.7	-70.3	164	-51.8	0	0	107	P54	Q52-P54 VanDerWaalsContact O-CD 3.32Å; Q52-P54 WeakPolarHBondContact O-CD 3.26Å; Q52-P54 VanDerWaalsContact O-N 3.08Å
53	H	41.4	Very low	43.4	Very low	129 Å²	129	103.4 Å²	103.4	60%	0.597	58%	0.576	S	S	*	*			trans	-56.4	125.7	165.2	-71	-73.6	0	0	0	105.2	G51 L55 D56	G51-H53 PolarHBondContact O-N 2.81Å; H53-L55 PolarHBondContact O-N 2.75Å; H53-D56 IonicContact CD2-OD2 3.61Å; H53-D56 WeakPolarHBondContact O-CB 3.29Å; H53-D56 PolarHBondContact O-N 3.18Å
54	P	48	Very low	45.3	Very low	110 Å²	110	101.6 Å²	101.6	71%	0.714	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	-7.2	-169.8	11	-22.2	0	0	0	114.2	Q52 W57	Q52-P54 VanDerWaalsContact O-CD 3.32Å; Q52-P54 WeakPolarHBondContact O-CD 3.26Å; Q52-P54 VanDerWaalsContact O-N 3.08Å; P54-W57 VanDerWaalsContact O-CD1 3.26Å; P54-W57 PolarHBondContact O-NE1 3.39Å
55	L	54.2	Low	47.5	Very low	112 Å²	112	98.2 Å²	98.2	59%	0.586	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	-1.4	-177.7	-61.2	176.6	0	0	0	113.3	H53 W57 L58	H53-L55 PolarHBondContact O-N 2.75Å; L55-W57 PolarHBondContact O-N 3.48Å; L55-L58 HydrophobicContact CB-CD1 3.9Å; L55-L58 HydrophobicContact CD2-CD1 3.55Å; L55-L58 HydrophobicContact CG-CD1 4.25Å; L55-L58 WeakPolarHBondContact O-CB 3.13Å; L55-L58 PolarHBondContact O-N 3.06Å
56	D	55	Low	49.6	Very low	61 Å²	61	92.1 Å²	92.1	33%	0.326	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-59.9	-32.8	-178.8	-89	-7.5	0	0	0	112.3	H53 L58 L59 T60	H53-D56 IonicContact CD2-OD2 3.61Å; H53-D56 WeakPolarHBondContact O-CB 3.29Å; H53-D56 PolarHBondContact O-N 3.18Å; D56-L58 PolarHBondContact O-N 3.27Å; D56-L59 PolarHBondContact O-N 3.45Å; D56-L59 VanDerWaalsContact O-N 3.09Å; D56-T60 PolarHBondContact O-N 2.88Å
57	W	62.4	Low	51.5	Low	155 Å²	155	91 Å²	91	59%	0.587	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-59.4	-27.1	176.4	72.5	-89.9	0	0	0	112.4	P54 L55 L59 T60 G63 P64	P54-W57 VanDerWaalsContact O-CD1 3.26Å; P54-W57 PolarHBondContact O-NE1 3.39Å; L55-W57 PolarHBondContact O-N 3.48Å; W57-L59 PolarHBondContact O-N 3.23Å; W57-T60 PolarHBondContact O-OG1 2.98Å; W57-G63 VanDerWaalsContact O-CA 3.24Å; W57-G63 WeakPolarHBondContact O-CA 3.36Å; W57-P64 HydrophobicContact CZ3-CG 4.31Å
58	L	63.5	Low	53.5	Low	27 Å²	27	88.3 Å²	88.3	14%	0.141	48%	0.484	C	S	.	.	G	3₁₀ helix	trans	-68.1	-23.4	179.2	-65.9	165.8	0	0	0	113.2	L55 D56 G63 P64 F65	L55-L58 HydrophobicContact CB-CD1 3.9Å; L55-L58 HydrophobicContact CD2-CD1 3.55Å; L55-L58 HydrophobicContact CG-CD1 4.25Å; L55-L58 WeakPolarHBondContact O-CB 3.13Å; L55-L58 PolarHBondContact O-N 3.06Å; D56-L58 PolarHBondContact O-N 3.27Å; L58-G63 CarbonylContact O-C 3.6Å; L58-G63 WeakPolarHBondContact O-CA 3.49Å; L58-P64 HydrophobicContact CD2-CG 3.56Å; L58-F65 HydrophobicContact CB-CD2 3.72Å; L58-F65 HydrophobicContact CB-CE2 4.14Å; L58-F65 HydrophobicContact CD1-CD2 4.36Å; L58-F65 HydrophobicContact CD1-CE2 4Å; L58-F65 HydrophobicContact CD2-CD2 4.19Å; L58-F65 HydrophobicContact CD2-CE2 3.84Å; L58-F65 HydrophobicContact CG-CD2 4.33Å; L58-F65 HydrophobicContact CG-CE2 4.24Å; L58-F65 PolarHBondContact O-N 2.61Å; L58-F65 VanDerWaalsContact O-N 3.12Å
59	L	64.8	Low	55.9	Low	69 Å²	69	90 Å²	90	36%	0.361	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-7	-175.1	-56.8	177.4	0	0	0	113.5	D56 W57 F65 H66 Y71	D56-L59 PolarHBondContact O-N 3.45Å; D56-L59 VanDerWaalsContact O-N 3.09Å; W57-L59 PolarHBondContact O-N 3.23Å; L59-F65 HydrophobicContact CD2-CB 4.05Å; L59-H66 PolarHBondContact O-ND1 3.27Å; L59-Y71 HydrophobicContact CB-CE2 4.45Å; L59-Y71 HydrophobicContact CD1-CE2 4.42Å; L59-Y71 HydrophobicContact CD2-CD2 3.96Å; L59-Y71 HydrophobicContact CD2-CE2 3.88Å; L59-Y71 HydrophobicContact CG-CE2 4.48Å
60	T	64.5	Low	58	Low	42 Å²	42	88.5 Å²	88.5	26%	0.258	46%	0.464	S	S	.	.	S	Bend	trans	-59.7	160.3	172.2	59.4	0	0	0	0	111.4	D56 W57 R62 G63 H66	D56-T60 PolarHBondContact O-N 2.88Å; W57-T60 PolarHBondContact O-OG1 2.98Å; T60-R62 PolarHBondContact O-N 3.21Å; T60-G63 WeakPolarHBondContact O-CA 3.41Å; T60-G63 PolarHBondContact O-N 2.65Å; T60-G63 PolarHBondContact OG1-N 3.47Å; T60-H66 WeakPolarHBondContact O-CB 3.04Å
61	D	61.9	Low	60.1	Low	28 Å²	28	86.6 Å²	86.6	15%	0.15	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	-25.8	179	-77.1	-10	0	0	0	114.3	H66 P309 D312	D61-H66 IonicContact OD1-CE1 3.56Å; D61-H66 PolarHBondContact OD1-CE1 2.94Å; D61-H66 IonicContact OD1-ND1 2.95Å; D61-H66 IonicContact OD1-NE2 3.69Å; D61-H66 PolarHBondContact OD1-NE2 3.45Å; D61-P309 HydrophobicContact CB-CB 3.87Å; D61-P309 WeakPolarHBondContact OD2-CA 3.49Å; D61-P309 VanDerWaalsContact OD2-CB 3.3Å; D61-P309 WeakPolarHBondContact OD2-CB 3.18Å; D61-D312 VanDerWaalsContact CG-OD2 3.32Å; D61-D312 PolarHBondContact N-OD2 2.74Å; D61-D312 VanDerWaalsContact N-OD2 3.16Å; D61-D312 PolarHBondContact OD2-N 2.92Å
62	R	60.3	Low	62.4	Low	88 Å²	88	85.5 Å²	85.5	33%	0.332	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-2.9	178.8	-57	-177.3	-170.8	-118.7	-30.1	114.6	T60 C306 N307	T60-R62 PolarHBondContact O-N 3.21Å; R62-C306 PolarHBondContact NH1-O 3.37Å; R62-C306 PolarHBondContact NH2-O 3.01Å; R62-N307 PolarHBondContact NH2-O 3.09Å
63	G	65.6	Low	64.4	Low	8 Å²	8	80.4 Å²	80.4	8%	0.082	40%	0.399	C	S	.	.	S	Bend	trans	-68.2	146	175.3	0	0	0	0	0	110.7	W57 L58 T60 F65 H66	W57-G63 VanDerWaalsContact O-CA 3.24Å; W57-G63 WeakPolarHBondContact O-CA 3.36Å; L58-G63 CarbonylContact O-C 3.6Å; L58-G63 WeakPolarHBondContact O-CA 3.49Å; T60-G63 WeakPolarHBondContact O-CA 3.41Å; T60-G63 PolarHBondContact O-N 2.65Å; T60-G63 PolarHBondContact OG1-N 3.47Å; G63-F65 PolarHBondContact O-N 3.31Å; G63-H66 PolarHBondContact O-N 3.21Å
64	P	62.8	Low	66.2	Low	71 Å²	71	77 Å²	77	46%	0.461	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-21.6	-177.6	23.7	-36.2	0	0	0	114.3	W57 L58	W57-P64 HydrophobicContact CZ3-CG 4.31Å; L58-P64 HydrophobicContact CD2-CG 3.56Å
65	F	67.8	Low	67.7	Low	104 Å²	104	74.4 Å²	74.4	46%	0.456	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-4.2	-177.5	-57.2	-48.6	0	0	0	114.2	L58 L59 G63 R67 A68 Y71	L58-F65 HydrophobicContact CB-CD2 3.72Å; L58-F65 HydrophobicContact CB-CE2 4.14Å; L58-F65 HydrophobicContact CD1-CD2 4.36Å; L58-F65 HydrophobicContact CD1-CE2 4Å; L58-F65 HydrophobicContact CD2-CD2 4.19Å; L58-F65 HydrophobicContact CD2-CE2 3.84Å; L58-F65 HydrophobicContact CG-CD2 4.33Å; L58-F65 HydrophobicContact CG-CE2 4.24Å; L58-F65 PolarHBondContact O-N 2.61Å; L58-F65 VanDerWaalsContact O-N 3.12Å; L59-F65 HydrophobicContact CD2-CB 4.05Å; G63-F65 PolarHBondContact O-N 3.31Å; F65-R67 VanDerWaalsContact C-N 3.28Å; F65-R67 PolarHBondContact O-N 2.64Å; F65-A68 HydrophobicContact CB-CB 4.46Å; F65-A68 VanDerWaalsContact O-CB 3.23Å; F65-A68 WeakPolarHBondContact O-CB 3.42Å; F65-A68 PolarHBondContact O-N 3.18Å; F65-Y71 WeakPolarHBondContact O-CB 3.44Å
66	H	67.8	Low	68.9	Low	53 Å²	53	73.7 Å²	73.7	25%	0.245	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-33.9	-179.7	-175.3	89	0	0	0	113.1	L59 T60 D61 G63 Y71	L59-H66 PolarHBondContact O-ND1 3.27Å; T60-H66 WeakPolarHBondContact O-CB 3.04Å; D61-H66 IonicContact OD1-CE1 3.56Å; D61-H66 PolarHBondContact OD1-CE1 2.94Å; D61-H66 IonicContact OD1-ND1 2.95Å; D61-H66 IonicContact OD1-NE2 3.69Å; D61-H66 PolarHBondContact OD1-NE2 3.45Å; G63-H66 PolarHBondContact O-N 3.21Å; H66-Y71 AromaticContact ND1-CE1 3.88Å; H66-Y71 WeakPolarHBondContact O-CD1 3.32Å
67	R	68.1	Low	70.2	Confident	185 Å²	185	73.6 Å²	73.6	70%	0.698	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	4	174.2	-63.3	-173.7	-177.8	160.3	5.1	113.4	F65 Q69 S283	F65-R67 VanDerWaalsContact C-N 3.28Å; F65-R67 PolarHBondContact O-N 2.64Å; R67-Q69 PolarHBondContact O-N 3.12Å; R67-S283 PolarHBondContact NH2-OG 3.05Å
68	A	72.9	Confident	71.1	Confident	36 Å²	36	72.1 Å²	72.1	30%	0.298	35%	0.346	S	S	.	.			trans	-64.6	129.8	175.9	0	0	0	0	0	108.5	F65 E70 Y71 A72	F65-A68 HydrophobicContact CB-CB 4.46Å; F65-A68 VanDerWaalsContact O-CB 3.23Å; F65-A68 WeakPolarHBondContact O-CB 3.42Å; F65-A68 PolarHBondContact O-N 3.18Å; A68-E70 PolarHBondContact O-N 3.06Å; A68-Y71 PolarHBondContact O-N 3.35Å; A68-A72 PolarHBondContact O-N 3.37Å
69	Q	71.6	Confident	71.8	Confident	153 Å²	153	80.1 Å²	80.1	72%	0.715	37%	0.374	S	S	*	.	H	α-helix	trans	-55	-41.2	-175.9	-171	169.2	-5.1	0	0	111.5	R67 Y71 A72 D73	R67-Q69 PolarHBondContact O-N 3.12Å; Q69-Y71 VanDerWaalsContact C-N 3.33Å; Q69-Y71 PolarHBondContact O-N 3.33Å; Q69-A72 PolarHBondContact O-N 2.79Å; Q69-D73 VanDerWaalsContact O-CB 3.3Å; Q69-D73 WeakPolarHBondContact O-CB 3.47Å; Q69-D73 PolarHBondContact O-N 2.9Å
70	E	71.1	Confident	72.5	Confident	83 Å²	83	81 Å²	81	39%	0.388	38%	0.376	S	S	.	.	H	α-helix	trans	-63.6	-34.7	176.8	-61.2	-171.3	-166.5	0	0	114.2	A68 F74 P251	A68-E70 PolarHBondContact O-N 3.06Å; E70-F74 VanDerWaalsContact O-CB 3.29Å; E70-F74 WeakPolarHBondContact O-CB 3.4Å; E70-F74 PolarHBondContact O-N 3.4Å; E70-P251 VanDerWaalsContact OE1-CB 3.23Å; E70-P251 WeakPolarHBondContact OE1-CB 3.39Å; E70-P251 VanDerWaalsContact OE1-CG 3.24Å; E70-P251 WeakPolarHBondContact OE1-CG 3.28Å
71	Y	75.8	Confident	73.1	Confident	57 Å²	57	80.2 Å²	80.2	22%	0.224	38%	0.376	C	S	.	.	H	α-helix	trans	-75.3	-42.5	177.8	178	-102.6	0	0	0	110.8	L59 F65 H66 A68 Q69 F74 M75	L59-Y71 HydrophobicContact CB-CE2 4.45Å; L59-Y71 HydrophobicContact CD1-CE2 4.42Å; L59-Y71 HydrophobicContact CD2-CD2 3.96Å; L59-Y71 HydrophobicContact CD2-CE2 3.88Å; L59-Y71 HydrophobicContact CG-CE2 4.48Å; F65-Y71 WeakPolarHBondContact O-CB 3.44Å; H66-Y71 AromaticContact ND1-CE1 3.88Å; H66-Y71 WeakPolarHBondContact O-CD1 3.32Å; A68-Y71 PolarHBondContact O-N 3.35Å; Q69-Y71 VanDerWaalsContact C-N 3.33Å; Q69-Y71 PolarHBondContact O-N 3.33Å; Y71-F74 PolarHBondContact O-N 3.43Å; Y71-M75 HydrophobicContact CD1-CG 4.23Å; Y71-M75 HydrophobicContact CD2-CG 4.42Å; Y71-M75 HydrophobicContact CE1-CG 3.77Å; Y71-M75 HydrophobicContact CE2-CG 3.97Å; Y71-M75 HydrophobicContact CE2-SD 4.45Å; Y71-M75 WeakPolarHBondContact O-CB 3.49Å; Y71-M75 WeakPolarHBondContact O-CG 3.26Å; Y71-M75 PolarHBondContact O-N 3.26Å
72	A	75.8	Confident	74.2	Confident	46 Å²	46	80 Å²	80	38%	0.38	37%	0.374	S	S	.	.	H	α-helix	trans	-60.6	-47	174.5	0	0	0	0	0	111.3	A68 Q69 F74 M75 E76	A68-A72 PolarHBondContact O-N 3.37Å; Q69-A72 PolarHBondContact O-N 2.79Å; A72-F74 PolarHBondContact O-N 3.45Å; A72-M75 PolarHBondContact O-N 2.85Å; A72-E76 WeakPolarHBondContact O-CB 3.29Å; A72-E76 PolarHBondContact O-N 2.69Å
73	D	77.9	Confident	75.1	Confident	72 Å²	72	78.3 Å²	78.3	39%	0.385	37%	0.373	S	S	.	.	H	α-helix	trans	-60.3	-46.2	176.1	-70	-15.8	0	0	0	110.7	Q69 M75 E76 R77	Q69-D73 VanDerWaalsContact O-CB 3.3Å; Q69-D73 WeakPolarHBondContact O-CB 3.47Å; Q69-D73 PolarHBondContact O-N 2.9Å; D73-M75 PolarHBondContact O-N 3.43Å; D73-E76 PolarHBondContact O-N 3.25Å; D73-R77 WeakPolarHBondContact O-CG 3.21Å; D73-R77 PolarHBondContact O-N 3.38Å
74	F	79.2	Confident	75.9	Confident	58 Å²	58	79 Å²	79	25%	0.254	38%	0.376	S	S	.	.	H	α-helix	trans	-60.9	-45.4	175.8	176.1	-91.6	0	0	0	112	E70 Y71 A72 E76 R77 Y78 R85 F161	E70-F74 VanDerWaalsContact O-CB 3.29Å; E70-F74 WeakPolarHBondContact O-CB 3.4Å; E70-F74 PolarHBondContact O-N 3.4Å; Y71-F74 PolarHBondContact O-N 3.43Å; A72-F74 PolarHBondContact O-N 3.45Å; F74-E76 VanDerWaalsContact C-N 3.33Å; F74-E76 PolarHBondContact O-N 2.67Å; F74-R77 PolarHBondContact O-N 3.13Å; F74-Y78 HydrophobicContact CZ-CD2 4.43Å; F74-Y78 VanDerWaalsContact O-CB 3.3Å; F74-Y78 WeakPolarHBondContact O-CB 3.41Å; F74-Y78 PolarHBondContact O-N 3.23Å; F74-R85 HydrophobicContact CD2-CB 4.26Å; F74-R85 HydrophobicContact CE2-CB 4.05Å; F74-F161 HydrophobicContact CD2-CD1 4.5Å; F74-F161 AromaticContact CD2-CE1 3.93Å; F74-F161 HydrophobicContact CD2-CE1 3.93Å
75	M	78.1	Confident	77	Confident	55 Å²	55	79.7 Å²	79.7	27%	0.271	37%	0.369	S	S	.	.	H	α-helix	trans	-63.7	-38.3	179.5	-82	-63.8	-64.8	0	0	112.2	Y71 A72 D73 Y78 R79	Y71-M75 HydrophobicContact CD1-CG 4.23Å; Y71-M75 HydrophobicContact CD2-CG 4.42Å; Y71-M75 HydrophobicContact CE1-CG 3.77Å; Y71-M75 HydrophobicContact CE2-CG 3.97Å; Y71-M75 HydrophobicContact CE2-SD 4.45Å; Y71-M75 WeakPolarHBondContact O-CB 3.49Å; Y71-M75 WeakPolarHBondContact O-CG 3.26Å; Y71-M75 PolarHBondContact O-N 3.26Å; A72-M75 PolarHBondContact O-N 2.85Å; D73-M75 PolarHBondContact O-N 3.43Å; M75-Y78 PolarHBondContact O-N 3.42Å; M75-R79 WeakPolarHBondContact O-CG 3.46Å; M75-R79 PolarHBondContact O-N 2.73Å
76	E	80.8	Confident	77.9	Confident	96 Å²	96	77.7 Å²	77.7	45%	0.449	36%	0.359	S	S	.	.	H	α-helix	trans	-64.8	-46	174.3	-163.5	-166.1	143.6	0	0	111.2	A72 D73 F74 Y78 R79 Q80	A72-E76 WeakPolarHBondContact O-CB 3.29Å; A72-E76 PolarHBondContact O-N 2.69Å; D73-E76 PolarHBondContact O-N 3.25Å; F74-E76 VanDerWaalsContact C-N 3.33Å; F74-E76 PolarHBondContact O-N 2.67Å; E76-Y78 VanDerWaalsContact C-N 3.29Å; E76-Y78 PolarHBondContact O-N 3.48Å; E76-R79 PolarHBondContact O-N 3.17Å; E76-Q80 WeakPolarHBondContact O-CG 3.37Å; E76-Q80 PolarHBondContact O-N 3.01Å; E76-Q80 PolarHBondContact OE1-NE2 3.35Å; E76-Q80 VanDerWaalsContact OE1-NE2 3.09Å
77	R	82.4	Confident	78.7	Confident	59 Å²	59	78.2 Å²	78.2	22%	0.223	36%	0.359	C	S	.	.	H	α-helix	trans	-62.8	-36.8	174.6	-63.4	-63.1	179.3	-147	-8.1	111.7	D73 F74 Q80 G81 F82 F161	D73-R77 WeakPolarHBondContact O-CG 3.21Å; D73-R77 PolarHBondContact O-N 3.38Å; F74-R77 PolarHBondContact O-N 3.13Å; R77-Q80 CarbonylContact O-C 3.41Å; R77-Q80 WeakPolarHBondContact O-CB 3.44Å; R77-Q80 PolarHBondContact O-N 3.49Å; R77-G81 PolarHBondContact O-N 2.94Å; R77-F82 HydrophobicContact CB-CB 4.46Å; R77-F82 HydrophobicContact CB-CD2 4.26Å; R77-F82 WeakPolarHBondContact O-CB 3.43Å; R77-F82 WeakPolarHBondContact O-CD2 3.15Å; R77-F82 PolarHBondContact O-N 3.4Å; R77-F82 VanDerWaalsContact O-N 3.11Å; R77-F161 HydrophobicContact CB-CD1 3.92Å; R77-F161 HydrophobicContact CB-CE1 4.11Å; R77-F161 HydrophobicContact CB-CG 4.32Å; R77-F161 HydrophobicContact CG-CD1 4.14Å; R77-F161 HydrophobicContact CG-CD2 4.33Å; R77-F161 HydrophobicContact CG-CE1 4.08Å; R77-F161 HydrophobicContact CG-CE2 4.3Å; R77-F161 HydrophobicContact CG-CG 4.26Å; R77-F161 HydrophobicContact CG-CZ 4.17Å
78	Y	80.3	Confident	79.5	Confident	124 Å²	124	71.5 Å²	71.5	49%	0.486	34%	0.337	S	S	.	.	H	α-helix	trans	-65	-42.5	176.2	-174.1	-98.1	0	0	0	112	F74 M75 E76 Q80 G81 F82 T83	F74-Y78 HydrophobicContact CZ-CD2 4.43Å; F74-Y78 VanDerWaalsContact O-CB 3.3Å; F74-Y78 WeakPolarHBondContact O-CB 3.41Å; F74-Y78 PolarHBondContact O-N 3.23Å; M75-Y78 PolarHBondContact O-N 3.42Å; E76-Y78 VanDerWaalsContact C-N 3.29Å; E76-Y78 PolarHBondContact O-N 3.48Å; Y78-Q80 VanDerWaalsContact C-N 3.25Å; Y78-Q80 PolarHBondContact O-N 3Å; Y78-G81 PolarHBondContact O-N 3.48Å; Y78-F82 WeakPolarHBondContact CA-O 3.39Å; Y78-F82 WeakPolarHBondContact CD2-O 3.25Å; Y78-T83 HydrophobicContact CE2-CG2 4.38Å
79	R	78.6	Confident	79.8	Confident	196 Å²	196	74.5 Å²	74.5	74%	0.74	34%	0.341	S	S	*	.	H	α-helix	trans	-61.3	-33.6	171.8	-73.5	176.1	-179.5	156.1	0.5	112.4	M75 E76 G81	M75-R79 WeakPolarHBondContact O-CG 3.46Å; M75-R79 PolarHBondContact O-N 2.73Å; E76-R79 PolarHBondContact O-N 3.17Å; R79-G81 PolarHBondContact O-N 3.05Å
80	Q	79.1	Confident	80.1	Confident	87 Å²	87	73.4 Å²	73.4	41%	0.407	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-2.1	174.1	-68.1	166.7	8.1	0	0	113.6	E76 R77 Y78 F82	E76-Q80 WeakPolarHBondContact O-CG 3.37Å; E76-Q80 PolarHBondContact O-N 3.01Å; E76-Q80 PolarHBondContact OE1-NE2 3.35Å; E76-Q80 VanDerWaalsContact OE1-NE2 3.09Å; R77-Q80 CarbonylContact O-C 3.41Å; R77-Q80 WeakPolarHBondContact O-CB 3.44Å; R77-Q80 PolarHBondContact O-N 3.49Å; Y78-Q80 VanDerWaalsContact C-N 3.25Å; Y78-Q80 PolarHBondContact O-N 3Å; Q80-F82 HydrophobicContact CB-CD2 4.04Å; Q80-F82 HydrophobicContact CB-CE2 4.08Å
81	G	77.8	Confident	80.2	Confident	25 Å²	25	72.7 Å²	72.7	26%	0.258	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.4	-1	174.7	0	0	0	0	0	115.1	R77 Y78 R79 T83 D163	R77-G81 PolarHBondContact O-N 2.94Å; Y78-G81 PolarHBondContact O-N 3.48Å; R79-G81 PolarHBondContact O-N 3.05Å; G81-T83 PolarHBondContact O-N 3.24Å; G81-D163 VanDerWaalsContact O-CG 3.24Å
82	F	84.2	Confident	79.7	Confident	24 Å²	24	72.9 Å²	72.9	11%	0.105	33%	0.329	C	S	.	.			trans	-78.2	119.4	176.9	-60.1	-78.8	0	0	0	110.6	R77 Y78 Q80 F161 D163 K223	R77-F82 HydrophobicContact CB-CB 4.46Å; R77-F82 HydrophobicContact CB-CD2 4.26Å; R77-F82 WeakPolarHBondContact O-CB 3.43Å; R77-F82 WeakPolarHBondContact O-CD2 3.15Å; R77-F82 PolarHBondContact O-N 3.4Å; R77-F82 VanDerWaalsContact O-N 3.11Å; Y78-F82 WeakPolarHBondContact CA-O 3.39Å; Y78-F82 WeakPolarHBondContact CD2-O 3.25Å; Q80-F82 HydrophobicContact CB-CD2 4.04Å; Q80-F82 HydrophobicContact CB-CE2 4.08Å; F82-F161 HydrophobicContact CB-CB 3.9Å; F82-F161 HydrophobicContact CD1-CB 4.06Å; F82-F161 HydrophobicContact CG-CB 3.95Å; F82-D163 HydrophobicContact CD1-CB 4.09Å; F82-D163 HydrophobicContact CE1-CB 4.43Å; F82-K223 HydrophobicContact CE1-CB 4.01Å; F82-K223 HydrophobicContact CE2-CB 4.14Å; F82-K223 HydrophobicContact CZ-CB 3.78Å
83	T	79.1	Confident	79	Confident	52 Å²	52	72.8 Å²	72.8	32%	0.319	33%	0.328	S	S	.	.			trans	-103.3	-18.8	-171.6	49.3	0	0	0	0	113.7	Y78 G81 V162	Y78-T83 HydrophobicContact CE2-CG2 4.38Å; G81-T83 PolarHBondContact O-N 3.24Å; T83-V162 PolarHBondContact N-O 3.08Å
84	T	83.4	Confident	78.4	Confident	22 Å²	22	75.7 Å²	75.7	14%	0.135	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.4	-175.3	-49.3	0	0	0	0	110.1	Y86 F161 V162 K164	T84-Y86 HydrophobicContact CG2-CD2 4.29Å; T84-Y86 HydrophobicContact CG2-CE1 4.19Å; T84-Y86 HydrophobicContact CG2-CE2 3.64Å; T84-F161 CarbonylContact O-C 3.3Å; T84-F161 WeakPolarHBondContact O-CA 3.42Å; T84-V162 PolarHBondContact N-O 3.04Å; T84-V162 VanDerWaalsContact N-O 3.1Å; T84-V162 PolarHBondContact O-N 2.79Å; T84-K164 WeakPolarHBondContact OG1-CD 3.45Å; T84-K164 WeakPolarHBondContact OG1-CE 3.12Å; T84-K164 PolarHBondContact OG1-NZ 3.07Å
85	R	85.5	Confident	77.9	Confident	86 Å²	86	81.2 Å²	81.2	33%	0.325	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	119.8	174.9	179.2	-175.2	178.3	-179	-1	108.7	F74 T159 F161	F74-R85 HydrophobicContact CD2-CB 4.26Å; F74-R85 HydrophobicContact CE2-CB 4.05Å; R85-T159 HydrophobicContact CG-CG2 3.74Å; R85-F161 HydrophobicContact CB-CD1 4.13Å; R85-F161 HydrophobicContact CB-CE1 4.18Å; R85-F161 HydrophobicContact CG-CD1 4.19Å; R85-F161 HydrophobicContact CG-CE1 3.9Å; R85-F161 HydrophobicContact CG-CZ 4.32Å
86	Y	85.7	Confident	77.5	Confident	62 Å²	62	85.7 Å²	85.7	24%	0.243	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	131.3	167.2	-63.8	-71.1	0	0	0	108.6	T84 T159 I160 V162 L191 H195	T84-Y86 HydrophobicContact CG2-CD2 4.29Å; T84-Y86 HydrophobicContact CG2-CE1 4.19Å; T84-Y86 HydrophobicContact CG2-CE2 3.64Å; Y86-T159 CarbonylContact O-C 3.57Å; Y86-T159 VanDerWaalsContact O-CA 3.28Å; Y86-T159 WeakPolarHBondContact O-CA 3.35Å; Y86-I160 PolarHBondContact N-O 2.96Å; Y86-I160 PolarHBondContact O-N 2.67Å; Y86-V162 HydrophobicContact CD2-CG2 3.75Å; Y86-V162 HydrophobicContact CE2-CB 4.43Å; Y86-V162 HydrophobicContact CE2-CG2 3.85Å; Y86-L191 HydrophobicContact CE2-CD1 3.86Å; Y86-H195 AromaticContact CD1-NE2 3.92Å; Y86-H195 AromaticContact CE1-NE2 3.32Å; Y86-H195 VanDerWaalsContact CE1-NE2 3.32Å; Y86-H195 WeakPolarHBondContact CE1-NE2 3.49Å; Y86-H195 AromaticContact CE2-NE2 3.92Å; Y86-H195 AromaticContact CZ-NE2 3.3Å; Y86-H195 VanDerWaalsContact CZ-NE2 3.3Å
87	R	85.5	Confident	76.9	Confident	65 Å²	65	83.3 Å²	83.3	25%	0.245	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	120.6	173.3	179	179.4	173.3	-175	-0.8	107.6	E155 L158 P251	R87-E155 IonicContact CZ-OE1 2.68Å; R87-E155 IonicContact NE-OE1 3.18Å; R87-E155 VanDerWaalsContact NH2-CD 3.32Å; R87-E155 IonicContact NH2-OE1 3.61Å; R87-E155 PolarHBondContact NH2-OE1 2.93Å; R87-E155 IonicContact NH2-OE2 2.85Å; R87-E155 PolarHBondContact NH2-OE2 3.27Å; R87-L158 WeakPolarHBondContact CA-O 3.5Å; R87-P251 VanDerWaalsContact NH2-CG 3.26Å
88	I	85.1	Confident	76	Confident	44 Å²	44	85.1 Å²	85.1	23%	0.226	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	141.8	166.6	62.8	175.6	0	0	0	107.1	S157 L158 A198 Y201 F202	I88-S157 CarbonylContact O-C 3.26Å; I88-S157 VanDerWaalsContact O-CA 3.26Å; I88-S157 WeakPolarHBondContact O-CA 3.48Å; I88-S157 WeakPolarHBondContact O-CB 3.16Å; I88-L158 HydrophobicContact CD1-CB 4.04Å; I88-L158 HydrophobicContact CD1-CD2 3.91Å; I88-L158 HydrophobicContact CG1-CB 3.69Å; I88-L158 HydrophobicContact CG1-CD2 4.36Å; I88-L158 HydrophobicContact CG1-CG 4.46Å; I88-L158 PolarHBondContact N-O 3.01Å; I88-L158 PolarHBondContact O-N 3.26Å; I88-A198 HydrophobicContact CD1-CB 4.09Å; I88-A198 WeakPolarHBondContact CD1-O 3.14Å; I88-Y201 HydrophobicContact CD1-CD1 3.98Å; I88-Y201 HydrophobicContact CD1-CG 4.24Å; I88-F202 HydrophobicContact CB-CE2 4.16Å; I88-F202 HydrophobicContact CD1-CE2 3.98Å; I88-F202 HydrophobicContact CD1-CZ 4.42Å; I88-F202 HydrophobicContact CG1-CE2 4.12Å; I88-F202 HydrophobicContact CG1-CZ 4.26Å
89	Y	79.8	Confident	75.2	Confident	99 Å²	99	83 Å²	83	39%	0.388	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	155.3	179.2	67.7	-90.1	0	0	0	111.2	E91 E155 E156 F202 E252	Y89-E91 HydrophobicContact CD2-CG 4.31Å; Y89-E91 HydrophobicContact CE2-CG 4.31Å; Y89-E155 WeakPolarHBondContact CB-OE1 3.5Å; Y89-E155 HydrophobicContact CD2-CG 4.36Å; Y89-E156 CarbonylContact C-O 3.45Å; Y89-E156 VanDerWaalsContact CA-O 3.28Å; Y89-E156 WeakPolarHBondContact CA-O 3.45Å; Y89-F202 VanDerWaalsContact C-CZ 3.43Å; Y89-E252 HydrophobicContact CE2-CG 4.35Å
90	R	76.8	Confident	74.4	Confident	129 Å²	129	76.8 Å²	76.8	49%	0.487	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	128.4	173.2	179.6	-176.7	-176.8	-173.6	2.6	108.2	E155 E156 F202	R90-E155 WeakPolarHBondContact O-CA 3.4Å; R90-E156 PolarHBondContact N-O 2.94Å; R90-E156 PolarHBondContact O-N 3.15Å; R90-F202 HydrophobicContact CB-CD1 3.81Å; R90-F202 HydrophobicContact CB-CE1 3.32Å; R90-F202 HydrophobicContact CB-CE2 4.37Å; R90-F202 HydrophobicContact CB-CZ 3.66Å; R90-F202 HydrophobicContact CG-CE1 4.48Å
91	E	73.6	Confident	73.4	Confident	68 Å²	68	74.9 Å²	74.9	32%	0.318	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	133.4	170.4	-61.2	-179.8	174.6	0	0	109.3	Y89 G154	Y89-E91 HydrophobicContact CD2-CG 4.31Å; Y89-E91 HydrophobicContact CE2-CG 4.31Å; E91-G154 WeakPolarHBondContact CA-O 3.21Å
92	F	64.7	Low	72.4	Confident	62 Å²	62	76.5 Å²	76.5	27%	0.272	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-36.9	178.5	-62.9	-68.7	0	0	0	113	G154 E156 L232	F92-G154 PolarHBondContact N-O 3.49Å; F92-E156 HydrophobicContact CE1-CB 4.49Å; F92-E156 HydrophobicContact CE2-CB 3.41Å; F92-E156 VanDerWaalsContact CE2-CB 3.41Å; F92-E156 HydrophobicContact CZ-CB 3.3Å; F92-E156 HydrophobicContact CZ-CG 4.24Å; F92-E156 WeakPolarHBondContact CZ-OE2 2.97Å; F92-L232 HydrophobicContact CD1-CD2 3.54Å; F92-L232 HydrophobicContact CD2-CD2 3.66Å; F92-L232 HydrophobicContact CD2-CG 4.01Å; F92-L232 HydrophobicContact CE1-CD2 3.25Å; F92-L232 HydrophobicContact CE1-CG 4.46Å; F92-L232 HydrophobicContact CE2-CD1 3.98Å; F92-L232 HydrophobicContact CE2-CD2 3.36Å; F92-L232 HydrophobicContact CE2-CG 3.73Å; F92-L232 HydrophobicContact CG-CD2 3.74Å; F92-L232 HydrophobicContact CG-CG 4.48Å; F92-L232 HydrophobicContact CZ-CD1 4.16Å; F92-L232 HydrophobicContact CZ-CD2 3.16Å; F92-L232 HydrophobicContact CZ-CG 3.99Å
93	A	60.6	Low	70.8	Confident	43 Å²	43	84.8 Å²	84.8	36%	0.355	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	141.5	176.4	0	0	0	0	0	109.9	G153	A93-G153 WeakPolarHBondContact O-CA 3Å
94	R	66.4	Low	69.6	Low	134 Å²	134	92 Å²	92	51%	0.506	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	105.5	179.2	-172.5	178.6	-172.6	160.3	13.2	110.4	T151	R94-T151 HydrophobicContact CG-CG2 4.41Å
95	W	67.5	Low	68	Low	173 Å²	173	99.8 Å²	99.8	66%	0.655	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	106.7	178.7	-57.5	74.8	0	0	0	108.5	V97 T151 L152	W95-V97 HydrophobicContact CB-CG2 4.39Å; W95-V97 PolarHBondContact O-N 2.78Å; W95-V97 VanDerWaalsContact O-N 3.13Å; W95-T151 CarbonylContact O-C 3.44Å; W95-T151 WeakPolarHBondContact O-CA 3.46Å; W95-L152 HydrophobicContact CB-CB 4.24Å; W95-L152 WeakPolarHBondContact CB-O 3.35Å; W95-L152 PolarHBondContact N-O 2.88Å; W95-L152 PolarHBondContact O-N 3.4Å
96	K	69.7	Low	66.5	Low	149 Å²	149	101.3 Å²	101.3	65%	0.648	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.3	102.4	171.4	-171.8	-179.2	-178.8	-175.7	0	108.5	N98 T151	K96-N98 VanDerWaalsContact CE-OD1 3.25Å; K96-N98 WeakPolarHBondContact CE-OD1 3.36Å; K96-T151 HydrophobicContact CB-CG2 4.3Å; K96-T151 HydrophobicContact CG-CG2 4.32Å
97	V	68.2	Low	64.9	Low	46 Å²	46	101.9 Å²	101.9	28%	0.279	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	106.9	175.6	-169.9	0	0	0	0	108.3	W95 L100 S149 A150 L152	W95-V97 HydrophobicContact CB-CG2 4.39Å; W95-V97 PolarHBondContact O-N 2.78Å; W95-V97 VanDerWaalsContact O-N 3.13Å; V97-L100 HydrophobicContact CB-CD1 4.26Å; V97-L100 HydrophobicContact CB-CD2 3.74Å; V97-L100 HydrophobicContact CB-CG 3.84Å; V97-L100 HydrophobicContact CG1-CD2 3.4Å; V97-L100 VanDerWaalsContact CG1-CD2 3.4Å; V97-L100 HydrophobicContact CG1-CG 3.67Å; V97-L100 HydrophobicContact CG2-CD2 4.43Å; V97-S149 WeakPolarHBondContact O-CA 3.28Å; V97-S149 WeakPolarHBondContact O-CB 3.44Å; V97-A150 PolarHBondContact N-O 2.99Å; V97-A150 PolarHBondContact O-N 3.4Å; V97-L152 HydrophobicContact CB-CD1 4.4Å; V97-L152 HydrophobicContact CB-CG 4.45Å; V97-L152 HydrophobicContact CG2-CB 4.27Å; V97-L152 HydrophobicContact CG2-CD1 3.6Å; V97-L152 HydrophobicContact CG2-CG 3.83Å
98	N	63.6	Low	63.4	Low	97 Å²	97	108.3 Å²	108.3	52%	0.519	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	141	171.3	-63.6	-29.5	0	0	0	108.9	K96	K96-N98 VanDerWaalsContact CE-OD1 3.25Å; K96-N98 WeakPolarHBondContact CE-OD1 3.36Å
99	N	63.9	Low	61.9	Low	79 Å²	79	110.6 Å²	110.6	42%	0.422	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	50.3	177.5	-53.1	-19.8	0	0	0	114.1	A101 L102 L148	N99-A101 PolarHBondContact O-N 2.81Å; N99-A101 VanDerWaalsContact O-N 3.1Å; N99-L102 WeakPolarHBondContact CB-O 3.19Å; N99-L102 CarbonylContact O-C 3.42Å; N99-L102 PolarHBondContact O-N 2.76Å; N99-L102 VanDerWaalsContact O-O 3.13Å; N99-L148 CarbonylContact C-O 3.35Å; N99-L148 WeakPolarHBondContact CA-O 3.36Å; N99-L148 PolarHBondContact N-O 3.39Å; N99-L148 VanDerWaalsContact N-O 3.1Å
100	L	62.2	Low	60.7	Low	66 Å²	66	112 Å²	112	35%	0.346	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-23.9	172.8	-80.1	164.4	0	0	0	112.9	V97 L147 L148 A150 L152	V97-L100 HydrophobicContact CB-CD1 4.26Å; V97-L100 HydrophobicContact CB-CD2 3.74Å; V97-L100 HydrophobicContact CB-CG 3.84Å; V97-L100 HydrophobicContact CG1-CD2 3.4Å; V97-L100 VanDerWaalsContact CG1-CD2 3.4Å; V97-L100 HydrophobicContact CG1-CG 3.67Å; V97-L100 HydrophobicContact CG2-CD2 4.43Å; L100-L147 HydrophobicContact CB-CD2 4.27Å; L100-L147 HydrophobicContact CB-CG 4.47Å; L100-L147 HydrophobicContact CD1-CD2 3.54Å; L100-L147 HydrophobicContact CD1-CG 4.13Å; L100-L148 PolarHBondContact N-O 3.09Å; L100-A150 HydrophobicContact CD1-CB 3.51Å; L100-L152 HydrophobicContact CD1-CD2 4.49Å; L100-L152 HydrophobicContact CD2-CD1 4.21Å
101	A	59.1	Low	59.9	Low	47 Å²	47	111.6 Å²	111.6	39%	0.388	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-25.5	176.2	0	0	0	0	0	114.3	N99 F146 L147	N99-A101 PolarHBondContact O-N 2.81Å; N99-A101 VanDerWaalsContact O-N 3.1Å; A101-F146 HydrophobicContact CB-CD2 4.31Å; A101-F146 HydrophobicContact CB-CE2 4.4Å; A101-L147 WeakPolarHBondContact CB-O 3.37Å
102	L	54.8	Low	59.4	Low	59 Å²	59	110.4 Å²	110.4	31%	0.309	54%	0.541	S	S	.	.			trans	-167.3	141.1	-174.1	-98.7	126.4	0	0	0	114.8	N99 R104 L112 P113	N99-L102 WeakPolarHBondContact CB-O 3.19Å; N99-L102 CarbonylContact O-C 3.42Å; N99-L102 PolarHBondContact O-N 2.76Å; N99-L102 VanDerWaalsContact O-O 3.13Å; L102-R104 VanDerWaalsContact C-N 3.29Å; L102-R104 PolarHBondContact O-N 2.86Å; L102-L112 HydrophobicContact CD1-CB 4.27Å; L102-L112 HydrophobicContact CD1-CD2 3.17Å; L102-L112 HydrophobicContact CD1-CG 3.59Å; L102-P113 HydrophobicContact CD2-CG 4.34Å
103	E	52.3	Low	59.7	Low	198 Å²	198	112.9 Å²	112.9	93%	0.925	56%	0.563	S	S	*	*	S	Bend	trans	-70	-11.9	-179.8	-130.4	179	178.6	0	0	115.3
104	R	53.5	Low	60.6	Low	203 Å²	203	113.2 Å²	113.2	77%	0.766	56%	0.559	S	S	*	*			trans	-120.2	136.7	-168.2	-67.4	-174.4	-179.5	177.8	0	113.7	L102 D106	L102-R104 VanDerWaalsContact C-N 3.29Å; L102-R104 PolarHBondContact O-N 2.86Å; R104-D106 VanDerWaalsContact C-N 3.34Å; R104-D106 PolarHBondContact O-N 2.88Å
105	K	50.3	Low	61.4	Low	187 Å²	187	109.6 Å²	109.6	81%	0.813	56%	0.557	S	S	*	*	S	Bend	trans	-74.6	-10	-172.1	-79.8	179	173.7	176.4	0	115.7	F107	K105-F107 PolarHBondContact O-N 3.28Å
106	D	52.7	Low	62.2	Low	118 Å²	118	106.5 Å²	106.5	63%	0.631	56%	0.56	S	S	*	*			trans	-97.1	76.2	-171.1	-59.1	-34.2	0	0	0	111.9	R104 F108	R104-D106 VanDerWaalsContact C-N 3.34Å; R104-D106 PolarHBondContact O-N 2.88Å; D106-F108 PolarHBondContact O-N 2.79Å
107	F	52.4	Low	63.1	Low	74 Å²	74	105 Å²	105	33%	0.325	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.2	-13.4	-176.2	-161	-93.9	0	0	0	114.4	K105 F146 L148 L258 V262	K105-F107 PolarHBondContact O-N 3.28Å; F107-F146 HydrophobicContact CZ-CZ 4.25Å; F107-L148 HydrophobicContact CE2-CD2 4.4Å; F107-L258 HydrophobicContact CE1-CD2 4.32Å; F107-L258 HydrophobicContact CZ-CD2 3.85Å; F107-V262 HydrophobicContact CE1-CG1 3.93Å; F107-V262 HydrophobicContact CZ-CG1 4.36Å
108	F	54.9	Low	64	Low	200 Å²	200	103.4 Å²	103.4	88%	0.877	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	-3.6	-165.6	-66.8	-74	0	0	0	115.9	D106	D106-F108 PolarHBondContact O-N 2.79Å
109	S	53.8	Low	65.1	Low	91 Å²	91	101.5 Å²	101.5	64%	0.636	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127	-10.4	-170.3	57.1	0	0	0	0	116.7
110	L	53.5	Low	66.2	Low	128 Å²	128	106 Å²	106	67%	0.67	55%	0.545	S	S	*	.	S	Bend	trans	-135.2	142.3	178.5	-77	159.2	0	0	0	111.8	L112	L110-L112 PolarHBondContact O-N 3.45Å
111	P	59.4	Low	67.4	Low	122 Å²	122	104.1 Å²	104.1	79%	0.792	54%	0.535	S	S	*	.			trans	-66.4	124.7	178.9	26.2	-31.4	0	0	0	110.2
112	L	63.3	Low	68.7	Low	43 Å²	43	102.7 Å²	102.7	23%	0.225	52%	0.52	C	S	.	.			trans	-54.5	141.3	174.7	-79.5	84.1	0	0	0	110.4	L102 L110 L114 L263	L102-L112 HydrophobicContact CD1-CB 4.27Å; L102-L112 HydrophobicContact CD1-CD2 3.17Å; L102-L112 HydrophobicContact CD1-CG 3.59Å; L110-L112 PolarHBondContact O-N 3.45Å; L112-L114 HydrophobicContact CB-CD2 4.1Å; L112-L114 HydrophobicContact CB-CG 4.28Å; L112-L114 PolarHBondContact O-N 3.26Å; L112-L263 HydrophobicContact CD1-CD2 4.13Å; L112-L263 HydrophobicContact CD2-CD2 3.87Å
113	P	70.7	Confident	70.2	Confident	113 Å²	113	109.2 Å²	109.2	73%	0.734	54%	0.541	S	S	*	.			trans	-70.5	81.8	168.7	30.5	-32.8	0	0	0	109.2	L102	L102-P113 HydrophobicContact CD2-CG 4.34Å
114	L	79.8	Confident	71.9	Confident	51 Å²	51	105.7 Å²	105.7	27%	0.267	53%	0.527	S	S	.	.			trans	-73.4	146.2	175.8	-60.1	172.9	0	0	0	109.7	L112 F118 I119 L263	L112-L114 HydrophobicContact CB-CD2 4.1Å; L112-L114 HydrophobicContact CB-CG 4.28Å; L112-L114 PolarHBondContact O-N 3.26Å; L114-F118 HydrophobicContact CB-CD1 4.14Å; L114-F118 HydrophobicContact CD1-CD1 4.02Å; L114-F118 HydrophobicContact CD1-CE1 4.08Å; L114-F118 HydrophobicContact CD2-CD1 4.3Å; L114-F118 HydrophobicContact CD2-CE1 4.35Å; L114-F118 HydrophobicContact CG-CD1 4.39Å; L114-I119 HydrophobicContact CB-CD1 3.98Å; L114-I119 HydrophobicContact CB-CG1 3.78Å; L114-I119 HydrophobicContact CD1-CG1 4.39Å; L114-L263 HydrophobicContact CD2-CD1 4.05Å
115	A	84.1	Confident	73.4	Confident	57 Å²	57	96.7 Å²	96.7	47%	0.471	50%	0.495	S	S	.	.			trans	-54.1	135.8	176.2	0	0	0	0	0	110.6	E117 F118 I119	A115-E117 PolarHBondContact O-N 2.94Å; A115-E117 VanDerWaalsContact O-N 3.15Å; A115-F118 HydrophobicContact CB-CB 4.28Å; A115-F118 WeakPolarHBondContact O-CA 3.24Å; A115-F118 WeakPolarHBondContact O-CB 3.31Å; A115-F118 PolarHBondContact O-N 3.42Å; A115-I119 PolarHBondContact O-N 2.81Å; A115-I119 VanDerWaalsContact O-N 3.15Å
116	P	84.9	Confident	75	Confident	109 Å²	109	89.4 Å²	89.4	71%	0.708	47%	0.473	S	S	*	.	H	α-helix	trans	-59.4	-32.1	-176	22.5	-33.1	0	0	0	112.1	R120	P116-R120 WeakPolarHBondContact O-CB 3.48Å; P116-R120 PolarHBondContact O-N 2.86Å
117	E	87.8	Confident	76.3	Confident	118 Å²	118	94.2 Å²	94.2	55%	0.551	48%	0.482	S	S	*	.	H	α-helix	trans	-63.1	-41.4	172.3	-65.2	-156.4	172.9	0	0	113.4	A115 R120 N121 K141	A115-E117 PolarHBondContact O-N 2.94Å; A115-E117 VanDerWaalsContact O-N 3.15Å; E117-R120 PolarHBondContact O-N 3.01Å; E117-N121 WeakPolarHBondContact O-CB 3.43Å; E117-N121 VanDerWaalsContact O-CG 3.27Å; E117-N121 PolarHBondContact O-N 2.78Å; E117-N121 PolarHBondContact O-ND2 3Å; E117-K141 IonicContact OE2-NZ 3Å; E117-K141 PolarHBondContact OE2-NZ 2.92Å
118	F	87.8	Confident	77.7	Confident	12 Å²	12	101 Å²	101	5%	0.053	51%	0.505	C	S	.	.	H	α-helix	trans	-65.5	-44.9	-179.6	-178	-108.4	0	0	0	110.5	L114 A115 R120 N121 I122 L138 Y142 L260 L264	L114-F118 HydrophobicContact CB-CD1 4.14Å; L114-F118 HydrophobicContact CD1-CD1 4.02Å; L114-F118 HydrophobicContact CD1-CE1 4.08Å; L114-F118 HydrophobicContact CD2-CD1 4.3Å; L114-F118 HydrophobicContact CD2-CE1 4.35Å; L114-F118 HydrophobicContact CG-CD1 4.39Å; A115-F118 HydrophobicContact CB-CB 4.28Å; A115-F118 WeakPolarHBondContact O-CA 3.24Å; A115-F118 WeakPolarHBondContact O-CB 3.31Å; A115-F118 PolarHBondContact O-N 3.42Å; F118-R120 VanDerWaalsContact C-N 3.34Å; F118-R120 PolarHBondContact O-N 2.76Å; F118-N121 PolarHBondContact O-N 2.9Å; F118-I122 HydrophobicContact CD1-CD1 3.76Å; F118-I122 HydrophobicContact CE1-CD1 3.38Å; F118-I122 HydrophobicContact CE1-CG1 4.44Å; F118-I122 HydrophobicContact CE2-CD1 4.41Å; F118-I122 HydrophobicContact CG-CD1 4.45Å; F118-I122 HydrophobicContact CZ-CD1 3.74Å; F118-I122 HydrophobicContact CZ-CG1 4.47Å; F118-I122 WeakPolarHBondContact O-CG1 3.43Å; F118-I122 PolarHBondContact O-N 2.89Å; F118-L138 HydrophobicContact CD2-CD2 4.37Å; F118-L138 HydrophobicContact CE2-CD2 3.89Å; F118-Y142 HydrophobicContact CB-CE1 4.37Å; F118-Y142 AromaticContact CD2-CD1 3.98Å; F118-Y142 HydrophobicContact CD2-CD1 3.98Å; F118-Y142 AromaticContact CD2-CD2 3.67Å; F118-Y142 HydrophobicContact CD2-CD2 3.67Å; F118-Y142 AromaticContact CD2-CE1 3.99Å; F118-Y142 HydrophobicContact CD2-CE1 3.99Å; F118-Y142 AromaticContact CD2-CE2 3.7Å; F118-Y142 HydrophobicContact CD2-CE2 3.7Å; F118-Y142 AromaticContact CD2-CG 3.82Å; F118-Y142 HydrophobicContact CD2-CG 3.82Å; F118-Y142 AromaticContact CD2-CZ 3.85Å; F118-Y142 AromaticContact CE2-CD2 3.93Å; F118-Y142 HydrophobicContact CE2-CD2 3.93Å; F118-Y142 HydrophobicContact CE2-CE2 4.36Å; F118-Y142 HydrophobicContact CE2-CG 4.04Å; F118-L260 HydrophobicContact CE2-CD1 4.48Å; F118-L260 HydrophobicContact CE2-CD2 4.1Å; F118-L260 HydrophobicContact CZ-CD1 4.04Å; F118-L260 HydrophobicContact CZ-CD2 4.19Å; F118-L260 HydrophobicContact CZ-CG 4.24Å; F118-L264 HydrophobicContact CZ-CD2 4.13Å
119	I	85.6	Confident	79.2	Confident	56 Å²	56	91.5 Å²	91.5	29%	0.287	46%	0.464	S	S	.	.	H	α-helix	trans	-61.3	-43.8	174.9	-60.3	174	0	0	0	110.6	L114 A115 N121 I122 R123	L114-I119 HydrophobicContact CB-CD1 3.98Å; L114-I119 HydrophobicContact CB-CG1 3.78Å; L114-I119 HydrophobicContact CD1-CG1 4.39Å; A115-I119 PolarHBondContact O-N 2.81Å; A115-I119 VanDerWaalsContact O-N 3.15Å; I119-N121 VanDerWaalsContact C-N 3.34Å; I119-N121 PolarHBondContact O-N 2.92Å; I119-I122 PolarHBondContact O-N 2.97Å; I119-R123 WeakPolarHBondContact O-CG 3.41Å; I119-R123 PolarHBondContact O-N 3.33Å
120	R	87.4	Confident	80.7	Confident	175 Å²	175	90.9 Å²	90.9	66%	0.66	45%	0.453	S	S	*	.	H	α-helix	trans	-58.9	-45.6	176.8	-175.8	-179.6	178.9	-174.1	-0.2	111.1	P116 E117 F118 I122 R123 L124	P116-R120 WeakPolarHBondContact O-CB 3.48Å; P116-R120 PolarHBondContact O-N 2.86Å; E117-R120 PolarHBondContact O-N 3.01Å; F118-R120 VanDerWaalsContact C-N 3.34Å; F118-R120 PolarHBondContact O-N 2.76Å; R120-I122 PolarHBondContact O-N 2.82Å; R120-R123 PolarHBondContact O-N 3.03Å; R120-L124 HydrophobicContact CG-CD1 4.15Å; R120-L124 HydrophobicContact CG-CG 4.5Å; R120-L124 VanDerWaalsContact O-CG 3.31Å; R120-L124 WeakPolarHBondContact O-CG 3.32Å; R120-L124 PolarHBondContact O-N 3.43Å
121	N	87	Confident	82.2	Confident	26 Å²	26	86.7 Å²	86.7	14%	0.139	43%	0.432	C	S	.	.	H	α-helix	trans	-65.2	-38.9	179.2	-71.4	-26.6	0	0	0	112.6	E117 F118 I119 R123 L124 L125 Y142	E117-N121 WeakPolarHBondContact O-CB 3.43Å; E117-N121 VanDerWaalsContact O-CG 3.27Å; E117-N121 PolarHBondContact O-N 2.78Å; E117-N121 PolarHBondContact O-ND2 3Å; F118-N121 PolarHBondContact O-N 2.9Å; I119-N121 VanDerWaalsContact C-N 3.34Å; I119-N121 PolarHBondContact O-N 2.92Å; N121-R123 VanDerWaalsContact C-N 3.33Å; N121-R123 PolarHBondContact O-N 2.95Å; N121-L124 PolarHBondContact O-N 3.27Å; N121-L125 WeakPolarHBondContact O-CG 3.42Å; N121-L125 PolarHBondContact O-N 3.11Å; N121-Y142 PolarHBondContact ND2-OH 3.18Å
122	I	87.1	Confident	83.3	Confident	16 Å²	16	86.7 Å²	86.7	8%	0.082	42%	0.421	C	S	.	.	H	α-helix	trans	-61.8	-42.7	172.5	-67.5	169.5	0	0	0	111	F118 I119 R120 L124 L125 L138 L264 P265 L268	F118-I122 HydrophobicContact CD1-CD1 3.76Å; F118-I122 HydrophobicContact CE1-CD1 3.38Å; F118-I122 HydrophobicContact CE1-CG1 4.44Å; F118-I122 HydrophobicContact CE2-CD1 4.41Å; F118-I122 HydrophobicContact CG-CD1 4.45Å; F118-I122 HydrophobicContact CZ-CD1 3.74Å; F118-I122 HydrophobicContact CZ-CG1 4.47Å; F118-I122 WeakPolarHBondContact O-CG1 3.43Å; F118-I122 PolarHBondContact O-N 2.89Å; I119-I122 PolarHBondContact O-N 2.97Å; R120-I122 PolarHBondContact O-N 2.82Å; I122-L124 PolarHBondContact O-N 3.01Å; I122-L125 PolarHBondContact O-N 3.31Å; I122-L138 HydrophobicContact CG1-CD2 4.08Å; I122-L264 HydrophobicContact CD1-CD2 3.62Å; I122-L264 HydrophobicContact CG1-CD2 3.99Å; I122-P265 HydrophobicContact CG2-CG 4.23Å; I122-L268 HydrophobicContact CG2-CD1 4.16Å
123	R	86.4	Confident	84.5	Confident	196 Å²	196	89 Å²	89	74%	0.74	43%	0.431	S	S	*	.	H	α-helix	trans	-65.6	-37.9	179.1	-71.2	176.1	-175.9	175.5	2.9	112.4	I119 R120 N121 L125 G126	I119-R123 WeakPolarHBondContact O-CG 3.41Å; I119-R123 PolarHBondContact O-N 3.33Å; R120-R123 PolarHBondContact O-N 3.03Å; N121-R123 VanDerWaalsContact C-N 3.33Å; N121-R123 PolarHBondContact O-N 2.95Å; R123-L125 VanDerWaalsContact C-N 3.25Å; R123-L125 PolarHBondContact O-N 2.88Å; R123-G126 PolarHBondContact O-N 2.96Å
124	L	87.3	Confident	85.3	Confident	124 Å²	124	83.9 Å²	83.9	65%	0.649	40%	0.397	S	S	*	.	H	α-helix	trans	-65.9	-24.8	179	-72.2	171.5	0	0	0	113.4	R120 N121 I122 G126	R120-L124 HydrophobicContact CG-CD1 4.15Å; R120-L124 HydrophobicContact CG-CG 4.5Å; R120-L124 VanDerWaalsContact O-CG 3.31Å; R120-L124 WeakPolarHBondContact O-CG 3.32Å; R120-L124 PolarHBondContact O-N 3.43Å; N121-L124 PolarHBondContact O-N 3.27Å; I122-L124 PolarHBondContact O-N 3.01Å; L124-G126 VanDerWaalsContact C-N 3.29Å; L124-G126 PolarHBondContact O-N 3.48Å
125	L	85.8	Confident	85.6	Confident	15 Å²	15	82.1 Å²	82.1	8%	0.079	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-20.7	177.2	-73.1	171.1	0	0	0	113.9	N121 I122 R123 P129 Q133 N137 L138	N121-L125 WeakPolarHBondContact O-CG 3.42Å; N121-L125 PolarHBondContact O-N 3.11Å; I122-L125 PolarHBondContact O-N 3.31Å; R123-L125 VanDerWaalsContact C-N 3.25Å; R123-L125 PolarHBondContact O-N 2.88Å; L125-P129 HydrophobicContact CB-CB 3.99Å; L125-P129 HydrophobicContact CB-CG 4.21Å; L125-P129 HydrophobicContact CD2-CB 3.99Å; L125-P129 WeakPolarHBondContact O-CB 3.42Å; L125-Q133 HydrophobicContact CD2-CB 3.84Å; L125-N137 HydrophobicContact CD2-CB 4.22Å; L125-L138 HydrophobicContact CD1-CD1 3.37Å; L125-L138 HydrophobicContact CD1-CD2 4.47Å; L125-L138 HydrophobicContact CD1-CG 3.73Å
126	G	83.1	Confident	85.8	Confident	34 Å²	34	84.9 Å²	84.9	35%	0.351	39%	0.392	S	S	.	.			trans	67.4	-167.3	-177.9	0	0	0	0	0	114.2	R123 L124	R123-G126 PolarHBondContact O-N 2.96Å; L124-G126 VanDerWaalsContact C-N 3.29Å; L124-G126 PolarHBondContact O-N 3.48Å
127	R	80.6	Confident	85.9	Confident	219 Å²	219	83 Å²	83	83%	0.826	38%	0.376	S	S	*	.	S	Bend	trans	-79.4	-23.8	-173.2	-69.2	-175.5	179.3	179.3	-0.1	114.6	Y267	R127-Y267 WeakPolarHBondContact O-CD2 3.27Å
128	R	81.9	Confident	86	Confident	215 Å²	215	77.5 Å²	77.5	81%	0.811	35%	0.35	S	S	*	.	S	Bend	trans	-139.4	63.4	-176.1	-68.2	-174	177.4	-176.3	0.2	111.6	R271	R128-R271 PolarHBondContact O-NH1 3.24Å
129	P	85.9	Confident	86	Confident	1 Å²	1	77.1 Å²	77.1	1%	0.006	35%	0.349	C	S	.	.			trans	-66.5	148.8	179.2	27.8	-34.3	0	0	0	111.8	L125 Q133 V134 L268 R271	L125-P129 HydrophobicContact CB-CB 3.99Å; L125-P129 HydrophobicContact CB-CG 4.21Å; L125-P129 HydrophobicContact CD2-CB 3.99Å; L125-P129 WeakPolarHBondContact O-CB 3.42Å; P129-Q133 HydrophobicContact CB-CB 4.48Å; P129-V134 HydrophobicContact CB-CG2 3.93Å; P129-V134 HydrophobicContact CG-CG2 3.8Å; P129-L268 HydrophobicContact CG-CD2 3.45Å; P129-L268 VanDerWaalsContact CG-CD2 3.45Å; P129-R271 PolarHBondContact O-NH1 2.95Å
130	N	85.7	Confident	86	Confident	78 Å²	78	79.9 Å²	79.9	42%	0.417	36%	0.358	S	S	.	.			trans	-71	154.7	169.6	-167.7	11.6	0	0	0	110.8	Q132 Q133 V134	N130-Q132 VanDerWaalsContact C-N 3.25Å; N130-Q132 PolarHBondContact O-N 2.88Å; N130-Q133 HydrophobicContact CB-CG 4.22Å; N130-Q133 WeakPolarHBondContact O-CB 3.29Å; N130-Q133 PolarHBondContact O-N 2.71Å; N130-Q133 VanDerWaalsContact O-N 3.08Å; N130-V134 PolarHBondContact O-N 2.56Å; N130-V134 VanDerWaalsContact O-N 3.15Å
131	L	84.8	Confident	86.1	Confident	41 Å²	41	76.9 Å²	76.9	22%	0.215	35%	0.35	C	S	.	.	H	α-helix	trans	-59.4	-35.9	-179.4	-64.8	176.9	0	0	0	112.4	V134 T135 A274 A275 E287	L131-V134 PolarHBondContact O-N 3.4Å; L131-T135 PolarHBondContact O-N 3.44Å; L131-T135 PolarHBondContact O-OG1 3.47Å; L131-A274 HydrophobicContact CD2-CB 4.15Å; L131-A275 HydrophobicContact CB-CB 4.47Å; L131-A275 HydrophobicContact CD2-CB 4.08Å; L131-E287 HydrophobicContact CD1-CG 4.28Å
132	Q	83.1	Confident	86.1	Confident	121 Å²	121	78.9 Å²	78.9	57%	0.565	36%	0.356	S	S	*	.	H	α-helix	trans	-64.3	-43	174.6	-72	179.5	-19	0	0	112	N130 V134 T135 E136	N130-Q132 VanDerWaalsContact C-N 3.25Å; N130-Q132 PolarHBondContact O-N 2.88Å; Q132-V134 VanDerWaalsContact C-N 3.3Å; Q132-V134 PolarHBondContact O-N 2.03Å; Q132-T135 WeakPolarHBondContact O-CB 3.43Å; Q132-T135 PolarHBondContact O-N 3.25Å; Q132-T135 VanDerWaalsContact O-N 3.1Å; Q132-E136 WeakPolarHBondContact O-CG 3.39Å; Q132-E136 PolarHBondContact O-N 3.47Å
133	Q	87.3	Confident	86.1	Confident	93 Å²	93	79.5 Å²	79.5	44%	0.435	37%	0.367	S	S	.	.	H	α-helix	trans	-63.4	-38	178.9	-67.3	174.1	-35.4	0	0	111.6	L125 P129 N130 N137	L125-Q133 HydrophobicContact CD2-CB 3.84Å; P129-Q133 HydrophobicContact CB-CB 4.48Å; N130-Q133 HydrophobicContact CB-CG 4.22Å; N130-Q133 WeakPolarHBondContact O-CB 3.29Å; N130-Q133 PolarHBondContact O-N 2.71Å; N130-Q133 VanDerWaalsContact O-N 3.08Å; Q133-N137 VanDerWaalsContact O-CB 3.31Å; Q133-N137 WeakPolarHBondContact O-CB 3.36Å; Q133-N137 PolarHBondContact O-N 3.5Å; Q133-N137 PolarHBondContact O-ND2 2.76Å
134	V	88.3	Confident	86.1	Confident	4 Å²	4	71.6 Å²	71.6	2%	0.024	34%	0.341	C	S	.	.	H	α-helix	trans	-66.4	-42.2	173.8	177.4	0	0	0	0	110.8	P129 N130 L131 Q132 L138 I139 F272 A275	P129-V134 HydrophobicContact CB-CG2 3.93Å; P129-V134 HydrophobicContact CG-CG2 3.8Å; N130-V134 PolarHBondContact O-N 2.56Å; N130-V134 VanDerWaalsContact O-N 3.15Å; L131-V134 PolarHBondContact O-N 3.4Å; Q132-V134 VanDerWaalsContact C-N 3.3Å; Q132-V134 PolarHBondContact O-N 2.03Å; V134-L138 HydrophobicContact CG1-CD1 4.34Å; V134-L138 WeakPolarHBondContact O-CA 3.17Å; V134-L138 WeakPolarHBondContact O-CB 3.46Å; V134-L138 PolarHBondContact O-N 3.25Å; V134-I139 HydrophobicContact CG1-CD1 4.32Å; V134-I139 PolarHBondContact O-N 3.35Å; V134-I139 VanDerWaalsContact O-N 3.16Å; V134-F272 HydrophobicContact CG1-CB 4.4Å; V134-F272 HydrophobicContact CG1-CD2 3.76Å; V134-F272 HydrophobicContact CG1-CG 4.5Å; V134-A275 HydrophobicContact CB-CB 4.11Å; V134-A275 HydrophobicContact CG1-CB 3.9Å
135	T	86.9	Confident	86.1	Confident	15 Å²	15	70 Å²	70	9%	0.092	33%	0.329	C	S	.	.	I	π-helix	trans	-62.3	-47.1	179	-56.6	0	0	0	0	112.2	L131 Q132 I139 K140 Y279	L131-T135 PolarHBondContact O-N 3.44Å; L131-T135 PolarHBondContact O-OG1 3.47Å; Q132-T135 WeakPolarHBondContact O-CB 3.43Å; Q132-T135 PolarHBondContact O-N 3.25Å; Q132-T135 VanDerWaalsContact O-N 3.1Å; T135-I139 PolarHBondContact O-N 3.41Å; T135-K140 HydrophobicContact CG2-CG 4.5Å; T135-K140 PolarHBondContact O-N 3.23Å; T135-Y279 HydrophobicContact CG2-CD2 3.58Å; T135-Y279 HydrophobicContact CG2-CE2 4.32Å; T135-Y279 HydrophobicContact CG2-CG 4.23Å
136	E	87	Confident	85.9	Confident	114 Å²	114	70.8 Å²	70.8	53%	0.533	33%	0.332	S	S	.	.	I	π-helix	trans	-74.5	-44.7	-176.3	-69.3	175.9	169.3	0	0	113	Q132	Q132-E136 WeakPolarHBondContact O-CG 3.39Å; Q132-E136 PolarHBondContact O-N 3.47Å
137	N	87.7	Confident	85.8	Confident	71 Å²	71	71.2 Å²	71.2	38%	0.38	33%	0.327	S	S	.	.	I	π-helix	trans	-88.1	-24.5	-172.9	-63.7	-64.8	0	0	0	113.9	L125 Q133	L125-N137 HydrophobicContact CD2-CB 4.22Å; Q133-N137 VanDerWaalsContact O-CB 3.31Å; Q133-N137 WeakPolarHBondContact O-CB 3.36Å; Q133-N137 PolarHBondContact O-N 3.5Å; Q133-N137 PolarHBondContact O-ND2 2.76Å
138	L	88.8	Confident	85.6	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.01	30%	0.295	C	S	.	.	I	π-helix	trans	-111.9	-60.6	179	-65.9	173.9	0	0	0	112.2	F118 I122 L125 V134 K141 Y142 L264 F272	F118-L138 HydrophobicContact CD2-CD2 4.37Å; F118-L138 HydrophobicContact CE2-CD2 3.89Å; I122-L138 HydrophobicContact CG1-CD2 4.08Å; L125-L138 HydrophobicContact CD1-CD1 3.37Å; L125-L138 HydrophobicContact CD1-CD2 4.47Å; L125-L138 HydrophobicContact CD1-CG 3.73Å; V134-L138 HydrophobicContact CG1-CD1 4.34Å; V134-L138 WeakPolarHBondContact O-CA 3.17Å; V134-L138 WeakPolarHBondContact O-CB 3.46Å; V134-L138 PolarHBondContact O-N 3.25Å; L138-K141 PolarHBondContact O-N 3.41Å; L138-Y142 HydrophobicContact CD2-CD2 4.22Å; L138-Y142 HydrophobicContact CD2-CE2 4.45Å; L138-Y142 WeakPolarHBondContact O-CB 3.37Å; L138-Y142 PolarHBondContact O-N 2.97Å; L138-L264 HydrophobicContact CD1-CD1 4.41Å; L138-L264 HydrophobicContact CD1-CD2 4.23Å; L138-F272 HydrophobicContact CB-CE2 4.14Å; L138-F272 HydrophobicContact CD1-CD2 4.36Å
139	I	88.7	Confident	85.4	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.021	26%	0.259	C	S	.	.	I	π-helix	trans	-68.5	-46.7	-167.1	-60.8	170.7	0	0	0	112	V134 T135 K141 G143 T144 F272 A275 A276 Y279	V134-I139 HydrophobicContact CG1-CD1 4.32Å; V134-I139 PolarHBondContact O-N 3.35Å; V134-I139 VanDerWaalsContact O-N 3.16Å; T135-I139 PolarHBondContact O-N 3.41Å; I139-K141 VanDerWaalsContact C-N 3.33Å; I139-K141 PolarHBondContact O-N 3.08Å; I139-G143 WeakPolarHBondContact O-CA 3.44Å; I139-G143 PolarHBondContact O-N 3.13Å; I139-T144 HydrophobicContact CG2-CG2 3.76Å; I139-F272 HydrophobicContact CD1-CD2 4.5Å; I139-F272 HydrophobicContact CD1-CE2 4.28Å; I139-F272 HydrophobicContact CG1-CD2 4.18Å; I139-F272 HydrophobicContact CG1-CE2 3.56Å; I139-F272 HydrophobicContact CG1-CZ 4.01Å; I139-A275 HydrophobicContact CD1-CB 3.72Å; I139-A276 HydrophobicContact CD1-CB 4Å; I139-Y279 HydrophobicContact CG2-CD1 3.58Å; I139-Y279 HydrophobicContact CG2-CD2 4.45Å; I139-Y279 HydrophobicContact CG2-CE1 3.95Å; I139-Y279 HydrophobicContact CG2-CG 3.87Å
140	K	86.4	Confident	84.9	Confident	113 Å²	113	52.5 Å²	52.5	49%	0.491	26%	0.26	S	S	.	.	H	α-helix	trans	-67	-32.5	178.6	-74.4	-177.5	179.5	176	0	112.8	T135 Y279	T135-K140 HydrophobicContact CG2-CG 4.5Å; T135-K140 PolarHBondContact O-N 3.23Å; K140-Y279 HydrophobicContact CG-CE2 4.01Å
141	K	88.1	Confident	84.3	Confident	112 Å²	112	49.1 Å²	49.1	49%	0.487	24%	0.241	S	C	.	.	H	α-helix	trans	-85.8	-39	-176.6	-170.1	174.6	179.3	-169.3	0	113.3	E117 L138 I139	E117-K141 IonicContact OE2-NZ 3Å; E117-K141 PolarHBondContact OE2-NZ 2.92Å; L138-K141 PolarHBondContact O-N 3.41Å; I139-K141 VanDerWaalsContact C-N 3.33Å; I139-K141 PolarHBondContact O-N 3.08Å
142	Y	87.7	Confident	83.6	Confident	68 Å²	68	48.7 Å²	48.7	27%	0.267	24%	0.239	S	C	.	.	H	α-helix	trans	-118.6	-5.8	-171.9	-58.1	-74.4	0	0	0	114.1	F118 N121 L138	F118-Y142 HydrophobicContact CB-CE1 4.37Å; F118-Y142 AromaticContact CD2-CD1 3.98Å; F118-Y142 HydrophobicContact CD2-CD1 3.98Å; F118-Y142 AromaticContact CD2-CD2 3.67Å; F118-Y142 HydrophobicContact CD2-CD2 3.67Å; F118-Y142 AromaticContact CD2-CE1 3.99Å; F118-Y142 HydrophobicContact CD2-CE1 3.99Å; F118-Y142 AromaticContact CD2-CE2 3.7Å; F118-Y142 HydrophobicContact CD2-CE2 3.7Å; F118-Y142 AromaticContact CD2-CG 3.82Å; F118-Y142 HydrophobicContact CD2-CG 3.82Å; F118-Y142 AromaticContact CD2-CZ 3.85Å; F118-Y142 AromaticContact CE2-CD2 3.93Å; F118-Y142 HydrophobicContact CE2-CD2 3.93Å; F118-Y142 HydrophobicContact CE2-CE2 4.36Å; F118-Y142 HydrophobicContact CE2-CG 4.04Å; N121-Y142 PolarHBondContact ND2-OH 3.18Å; L138-Y142 HydrophobicContact CD2-CD2 4.22Å; L138-Y142 HydrophobicContact CD2-CE2 4.45Å; L138-Y142 WeakPolarHBondContact O-CB 3.37Å; L138-Y142 PolarHBondContact O-N 2.97Å
143	G	86.4	Confident	83	Confident	30 Å²	30	43.2 Å²	43.2	31%	0.309	22%	0.216	S	C	.	.			trans	81.4	-176.8	-176.6	0	0	0	0	0	113.8	I139	I139-G143 WeakPolarHBondContact O-CA 3.44Å; I139-G143 PolarHBondContact O-N 3.13Å
144	T	86.6	Confident	82.2	Confident	30 Å²	30	39 Å²	39	18%	0.184	20%	0.197	C	C	.	.	S	Bend	trans	-93.6	-24.3	178.6	52	0	0	0	0	112.9	I139 L260 A276 I280	I139-T144 HydrophobicContact CG2-CG2 3.76Å; T144-L260 WeakPolarHBondContact O-CB 3.48Å; T144-L260 PolarHBondContact O-N 3.43Å; T144-A276 HydrophobicContact CG2-CB 3.92Å; T144-I280 HydrophobicContact CG2-CD1 4.29Å
145	H	86.7	Confident	81.4	Confident	89 Å²	89	39 Å²	39	41%	0.412	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	154.2	-175.8	-62.2	74.8	0	0	0	110.3	L257 L258	H145-L257 HydrophobicContact CB-CB 3.95Å; H145-L257 HydrophobicContact CB-CD1 4.29Å; H145-L257 HydrophobicContact CB-CD2 4.37Å; H145-L257 HydrophobicContact CB-CG 4.44Å; H145-L258 CarbonylContact C-O 3.57Å; H145-L258 VanDerWaalsContact CA-O 3.24Å; H145-L258 WeakPolarHBondContact CA-O 3.36Å; H145-L258 WeakPolarHBondContact CB-O 3.39Å
146	F	82.9	Confident	81	Confident	32 Å²	32	38.8 Å²	38.8	14%	0.14	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	159.5	169.1	70.7	-83.6	0	0	0	110.5	A101 F107 L148 L257 L258 L260 L263	A101-F146 HydrophobicContact CB-CD2 4.31Å; A101-F146 HydrophobicContact CB-CE2 4.4Å; F107-F146 HydrophobicContact CZ-CZ 4.25Å; F146-L148 HydrophobicContact CE2-CD2 3.68Å; F146-L148 HydrophobicContact CE2-CG 4.4Å; F146-L148 HydrophobicContact CZ-CD2 4.15Å; F146-L257 WeakPolarHBondContact O-CA 3.08Å; F146-L258 HydrophobicContact CD1-CB 4.41Å; F146-L258 VanDerWaalsContact CD1-O 3.3Å; F146-L258 WeakPolarHBondContact CD1-O 3.42Å; F146-L258 HydrophobicContact CE1-CB 3.84Å; F146-L258 HydrophobicContact CE1-CD2 3.99Å; F146-L258 HydrophobicContact CE1-CG 4.11Å; F146-L258 HydrophobicContact CE2-CB 4.44Å; F146-L258 HydrophobicContact CZ-CB 3.88Å; F146-L258 HydrophobicContact CZ-CD2 3.66Å; F146-L258 HydrophobicContact CZ-CG 4.18Å; F146-L258 PolarHBondContact N-O 3.17Å; F146-L258 PolarHBondContact O-N 3.37Å; F146-L260 HydrophobicContact CD1-CD1 4.12Å; F146-L263 HydrophobicContact CD1-CD1 3.98Å; F146-L263 HydrophobicContact CD1-CG 4.38Å; F146-L263 HydrophobicContact CE1-CD1 3.83Å; F146-L263 HydrophobicContact CE1-CD2 4.36Å; F146-L263 HydrophobicContact CE1-CG 3.81Å; F146-L263 HydrophobicContact CG-CD1 4.39Å; F146-L263 HydrophobicContact CZ-CD1 4.1Å; F146-L263 HydrophobicContact CZ-CD2 4.19Å; F146-L263 HydrophobicContact CZ-CG 4.12Å
147	L	80	Confident	80.7	Confident	44 Å²	44	33.4 Å²	33.4	23%	0.23	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	117.3	-173.7	-171.3	62	0	0	0	111.4	L100 A101 A150 V248 V255 L257	L100-L147 HydrophobicContact CB-CD2 4.27Å; L100-L147 HydrophobicContact CB-CG 4.47Å; L100-L147 HydrophobicContact CD1-CD2 3.54Å; L100-L147 HydrophobicContact CD1-CG 4.13Å; A101-L147 WeakPolarHBondContact CB-O 3.37Å; L147-A150 HydrophobicContact CD1-CB 4.12Å; L147-A150 HydrophobicContact CD2-CB 4.1Å; L147-A150 HydrophobicContact CG-CB 4.46Å; L147-V248 HydrophobicContact CD2-CG1 3.97Å; L147-V248 HydrophobicContact CD2-CG2 4.11Å; L147-V255 HydrophobicContact CD1-CB 4.41Å; L147-V255 HydrophobicContact CD1-CG1 3.22Å; L147-L257 HydrophobicContact CD1-CD2 4.05Å
148	L	77.4	Confident	80.6	Confident	32 Å²	32	30.1 Å²	30.1	17%	0.168	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-51.9	172	-76.1	-179.5	0	0	0	111.5	N99 L100 F107 F146 Q256 L258	N99-L148 CarbonylContact C-O 3.35Å; N99-L148 WeakPolarHBondContact CA-O 3.36Å; N99-L148 PolarHBondContact N-O 3.39Å; N99-L148 VanDerWaalsContact N-O 3.1Å; L100-L148 PolarHBondContact N-O 3.09Å; F107-L148 HydrophobicContact CE2-CD2 4.4Å; F146-L148 HydrophobicContact CE2-CD2 3.68Å; F146-L148 HydrophobicContact CE2-CG 4.4Å; F146-L148 HydrophobicContact CZ-CD2 4.15Å; L148-Q256 HydrophobicContact CB-CG 4.41Å; L148-Q256 HydrophobicContact CD1-CG 4.44Å; L148-Q256 PolarHBondContact N-O 3.05Å; L148-L258 HydrophobicContact CD1-CB 3.58Å; L148-L258 HydrophobicContact CD1-CD1 4.35Å; L148-L258 HydrophobicContact CD1-CD2 4.21Å; L148-L258 HydrophobicContact CD1-CG 4.26Å; L148-L258 HydrophobicContact CD2-CB 4.17Å; L148-L258 HydrophobicContact CD2-CD2 4.27Å; L148-L258 HydrophobicContact CG-CB 3.64Å
149	S	76.3	Confident	80.5	Confident	9 Å²	9	30.2 Å²	30.2	6%	0.063	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	148.5	178.4	67.6	0	0	0	0	109.7	V97 Q256	V97-S149 WeakPolarHBondContact O-CA 3.28Å; V97-S149 WeakPolarHBondContact O-CB 3.44Å; S149-Q256 PolarHBondContact N-O 3.36Å; S149-Q256 PolarHBondContact O-N 3.45Å; S149-Q256 VanDerWaalsContact OG-CB 3.24Å; S149-Q256 WeakPolarHBondContact OG-CB 3.3Å; S149-Q256 PolarHBondContact OG-OE1 3.42Å
150	A	75.3	Confident	80.5	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.008	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	157.9	171.8	0	0	0	0	0	109.9	V97 L100 L147 V248	V97-A150 PolarHBondContact N-O 2.99Å; V97-A150 PolarHBondContact O-N 3.4Å; L100-A150 HydrophobicContact CD1-CB 3.51Å; L147-A150 HydrophobicContact CD1-CB 4.12Å; L147-A150 HydrophobicContact CD2-CB 4.1Å; L147-A150 HydrophobicContact CG-CB 4.46Å; A150-V248 HydrophobicContact CB-CG1 3.85Å; A150-V248 HydrophobicContact CB-CG2 4.44Å
151	T	73.7	Confident	80.6	Confident	6 Å²	6	25.4 Å²	25.4	4%	0.037	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	120.4	158.1	51.9	0	0	0	0	108.1	R94 W95 K96 N253 K254	R94-T151 HydrophobicContact CG-CG2 4.41Å; W95-T151 CarbonylContact O-C 3.44Å; W95-T151 WeakPolarHBondContact O-CA 3.46Å; K96-T151 HydrophobicContact CB-CG2 4.3Å; K96-T151 HydrophobicContact CG-CG2 4.32Å; T151-N253 PolarHBondContact O-ND2 2.96Å; T151-N253 PolarHBondContact O-OD1 3.31Å; T151-N253 WeakPolarHBondContact OG1-CA 3.38Å; T151-N253 WeakPolarHBondContact OG1-CB 2.76Å; T151-N253 PolarHBondContact OG1-OD1 2.97Å; T151-K254 PolarHBondContact OG1-N 3.35Å; T151-K254 VanDerWaalsContact OG1-N 3.16Å
152	L	71.2	Confident	80.7	Confident	32 Å²	32	20 Å²	20	17%	0.168	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	133.1	171.7	-68.7	-168.9	0	0	0	108.3	W95 V97 L100 V246 V248	W95-L152 HydrophobicContact CB-CB 4.24Å; W95-L152 WeakPolarHBondContact CB-O 3.35Å; W95-L152 PolarHBondContact N-O 2.88Å; W95-L152 PolarHBondContact O-N 3.4Å; V97-L152 HydrophobicContact CB-CD1 4.4Å; V97-L152 HydrophobicContact CB-CG 4.45Å; V97-L152 HydrophobicContact CG2-CB 4.27Å; V97-L152 HydrophobicContact CG2-CD1 3.6Å; V97-L152 HydrophobicContact CG2-CG 3.83Å; L100-L152 HydrophobicContact CD1-CD2 4.49Å; L100-L152 HydrophobicContact CD2-CD1 4.21Å; L152-V246 HydrophobicContact CB-CG1 3.54Å; L152-V246 HydrophobicContact CD1-CG1 3.97Å; L152-V246 HydrophobicContact CD2-CG1 4.18Å; L152-V246 HydrophobicContact CG-CG1 4.11Å; L152-V248 HydrophobicContact CD2-CB 4.32Å; L152-V248 HydrophobicContact CD2-CG2 3.31Å
153	G	69.3	Low	80.6	Confident	7 Å²	7	17.1 Å²	17.1	7%	0.072	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.3	-179.9	-178.1	0	0	0	0	0	113.1	A93	A93-G153 WeakPolarHBondContact O-CA 3Å
154	G	70.6	Confident	80.3	Confident	4 Å²	4	21.5 Å²	21.5	4%	0.041	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.5	169.1	0	0	0	0	0	110.6	E91 F92 T229	E91-G154 WeakPolarHBondContact CA-O 3.21Å; F92-G154 PolarHBondContact N-O 3.49Å; G154-T229 CarbonylContact C-O 3.54Å; G154-T229 VanDerWaalsContact C-O 3.3Å; G154-T229 WeakPolarHBondContact CA-O 3.43Å
155	E	72.3	Confident	79.8	Confident	5 Å²	5	29.7 Å²	29.7	2%	0.023	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131	178.3	-170.4	-169.9	157.9	0	0	109.4	R87 Y89 R90 S157 T229	R87-E155 IonicContact CZ-OE1 2.68Å; R87-E155 IonicContact NE-OE1 3.18Å; R87-E155 VanDerWaalsContact NH2-CD 3.32Å; R87-E155 IonicContact NH2-OE1 3.61Å; R87-E155 PolarHBondContact NH2-OE1 2.93Å; R87-E155 IonicContact NH2-OE2 2.85Å; R87-E155 PolarHBondContact NH2-OE2 3.27Å; Y89-E155 WeakPolarHBondContact CB-OE1 3.5Å; Y89-E155 HydrophobicContact CD2-CG 4.36Å; R90-E155 WeakPolarHBondContact O-CA 3.4Å; E155-S157 VanDerWaalsContact OE1-CB 3.26Å; E155-S157 WeakPolarHBondContact OE1-CB 3.2Å; E155-T229 PolarHBondContact N-O 3.41Å; E155-T229 PolarHBondContact O-N 3.41Å; E155-T229 PolarHBondContact O-OG1 2.82Å
156	E	77.8	Confident	79.1	Confident	9 Å²	9	30.7 Å²	30.7	4%	0.042	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	120.1	160	170.4	178	-134.3	0	0	108.1	Y89 R90 F92 Y201 F202 T227 R228	Y89-E156 CarbonylContact C-O 3.45Å; Y89-E156 VanDerWaalsContact CA-O 3.28Å; Y89-E156 WeakPolarHBondContact CA-O 3.45Å; R90-E156 PolarHBondContact N-O 2.94Å; R90-E156 PolarHBondContact O-N 3.15Å; F92-E156 HydrophobicContact CE1-CB 4.49Å; F92-E156 HydrophobicContact CE2-CB 3.41Å; F92-E156 VanDerWaalsContact CE2-CB 3.41Å; F92-E156 HydrophobicContact CZ-CB 3.3Å; F92-E156 HydrophobicContact CZ-CG 4.24Å; F92-E156 WeakPolarHBondContact CZ-OE2 2.97Å; E156-Y201 HydrophobicContact CG-CE1 3.96Å; E156-Y201 WeakPolarHBondContact CG-OH 3.45Å; E156-Y201 PolarHBondContact OE1-OH 3.22Å; E156-F202 HydrophobicContact CG-CE1 4.16Å; E156-T227 CarbonylContact C-O 3.47Å; E156-T227 WeakPolarHBondContact CA-O 3.27Å; E156-R228 HydrophobicContact CB-CG 4.05Å; E156-R228 HydrophobicContact CG-CG 3.91Å; E156-R228 IonicContact OE1-CZ 3.1Å; E156-R228 IonicContact OE1-NE 2.75Å; E156-R228 PolarHBondContact OE1-NE 3.26Å; E156-R228 IonicContact OE1-NH2 2.66Å; E156-R228 PolarHBondContact OE1-NH2 2.94Å; E156-R228 IonicContact OE2-NH2 3.94Å
157	S	80.6	Confident	78.5	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.014	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	142.2	178.9	100.2	0	0	0	0	112	I88 E155 E226 T227	I88-S157 CarbonylContact O-C 3.26Å; I88-S157 VanDerWaalsContact O-CA 3.26Å; I88-S157 WeakPolarHBondContact O-CA 3.48Å; I88-S157 WeakPolarHBondContact O-CB 3.16Å; E155-S157 VanDerWaalsContact OE1-CB 3.26Å; E155-S157 WeakPolarHBondContact OE1-CB 3.2Å; S157-E226 WeakPolarHBondContact O-CA 3.35Å; S157-T227 PolarHBondContact N-O 2.99Å; S157-T227 PolarHBondContact O-N 2.92Å; S157-T227 PolarHBondContact OG-OG1 2.98Å
158	L	86.3	Confident	77.6	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	116.4	169.5	178.2	73	0	0	0	107.7	R87 I88 I160 Y201 L209 L212 V224	R87-L158 WeakPolarHBondContact CA-O 3.5Å; I88-L158 HydrophobicContact CD1-CB 4.04Å; I88-L158 HydrophobicContact CD1-CD2 3.91Å; I88-L158 HydrophobicContact CG1-CB 3.69Å; I88-L158 HydrophobicContact CG1-CD2 4.36Å; I88-L158 HydrophobicContact CG1-CG 4.46Å; I88-L158 PolarHBondContact N-O 3.01Å; I88-L158 PolarHBondContact O-N 3.26Å; L158-I160 HydrophobicContact CD2-CD1 4.03Å; L158-I160 HydrophobicContact CD2-CG1 4.27Å; L158-I160 HydrophobicContact CG-CD1 4.44Å; L158-I160 HydrophobicContact CG-CG1 4.14Å; L158-Y201 HydrophobicContact CB-CD1 3.92Å; L158-Y201 HydrophobicContact CB-CD2 4.37Å; L158-Y201 HydrophobicContact CB-CE1 3.83Å; L158-Y201 HydrophobicContact CB-CE2 4.29Å; L158-Y201 HydrophobicContact CB-CG 4.2Å; L158-Y201 HydrophobicContact CD1-CD2 4.38Å; L158-Y201 HydrophobicContact CD1-CE2 4.19Å; L158-Y201 HydrophobicContact CD2-CD1 4.26Å; L158-Y201 HydrophobicContact CD2-CD2 3.76Å; L158-Y201 HydrophobicContact CD2-CE2 4.35Å; L158-Y201 HydrophobicContact CD2-CG 3.71Å; L158-Y201 HydrophobicContact CG-CD2 4.4Å; L158-Y201 HydrophobicContact CG-CG 4.48Å; L158-L209 HydrophobicContact CD1-CD2 3.82Å; L158-L212 HydrophobicContact CD1-CD1 4.48Å; L158-L212 HydrophobicContact CD2-CD1 3.74Å; L158-V224 HydrophobicContact CD1-CG1 3.4Å; L158-V224 HydrophobicContact CG-CG1 4.42Å
159	T	87.2	Confident	76.6	Confident	5 Å²	5	39.8 Å²	39.8	3%	0.031	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128.1	172.6	-60.6	0	0	0	0	109.9	R85 Y86 F161 V224 T225	R85-T159 HydrophobicContact CG-CG2 3.74Å; Y86-T159 CarbonylContact O-C 3.57Å; Y86-T159 VanDerWaalsContact O-CA 3.28Å; Y86-T159 WeakPolarHBondContact O-CA 3.35Å; T159-F161 HydrophobicContact CG2-CD2 4.15Å; T159-F161 HydrophobicContact CG2-CE2 3.6Å; T159-F161 HydrophobicContact CG2-CZ 3.87Å; T159-V224 WeakPolarHBondContact O-CA 3.39Å; T159-T225 WeakPolarHBondContact CB-OG1 3.29Å; T159-T225 PolarHBondContact N-O 2.75Å; T159-T225 PolarHBondContact O-N 3.24Å; T159-T225 PolarHBondContact O-OG1 3.5Å
160	I	88.8	Confident	75.3	Confident	5 Å²	5	47.1 Å²	47.1	3%	0.026	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	115.3	179	-52.8	174.3	0	0	0	108.2	Y86 L158 V162 A198 L212 I222 K223 V224	Y86-I160 PolarHBondContact N-O 2.96Å; Y86-I160 PolarHBondContact O-N 2.67Å; L158-I160 HydrophobicContact CD2-CD1 4.03Å; L158-I160 HydrophobicContact CD2-CG1 4.27Å; L158-I160 HydrophobicContact CG-CD1 4.44Å; L158-I160 HydrophobicContact CG-CG1 4.14Å; I160-V162 HydrophobicContact CG2-CG2 3.88Å; I160-A198 HydrophobicContact CD1-CB 4.16Å; I160-L212 HydrophobicContact CD1-CD1 4.13Å; I160-L212 HydrophobicContact CD1-CD2 4.17Å; I160-I222 HydrophobicContact CG2-CB 4.2Å; I160-I222 HydrophobicContact CG2-CG2 4.46Å; I160-K223 WeakPolarHBondContact CA-O 3.27Å; I160-V224 HydrophobicContact CG1-CG1 4.47Å; I160-V224 HydrophobicContact CG1-CG2 4.31Å; I160-V224 HydrophobicContact CG2-CG2 4.27Å
161	F	88.4	Confident	73.8	Confident	10 Å²	10	53.2 Å²	53.2	4%	0.044	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	134.3	170.1	-61.2	-93	0	0	0	109.4	F74 R77 F82 T84 R85 T159 I222 K223	F74-F161 HydrophobicContact CD2-CD1 4.5Å; F74-F161 AromaticContact CD2-CE1 3.93Å; F74-F161 HydrophobicContact CD2-CE1 3.93Å; R77-F161 HydrophobicContact CB-CD1 3.92Å; R77-F161 HydrophobicContact CB-CE1 4.11Å; R77-F161 HydrophobicContact CB-CG 4.32Å; R77-F161 HydrophobicContact CG-CD1 4.14Å; R77-F161 HydrophobicContact CG-CD2 4.33Å; R77-F161 HydrophobicContact CG-CE1 4.08Å; R77-F161 HydrophobicContact CG-CE2 4.3Å; R77-F161 HydrophobicContact CG-CG 4.26Å; R77-F161 HydrophobicContact CG-CZ 4.17Å; F82-F161 HydrophobicContact CB-CB 3.9Å; F82-F161 HydrophobicContact CD1-CB 4.06Å; F82-F161 HydrophobicContact CG-CB 3.95Å; T84-F161 CarbonylContact O-C 3.3Å; T84-F161 WeakPolarHBondContact O-CA 3.42Å; R85-F161 HydrophobicContact CB-CD1 4.13Å; R85-F161 HydrophobicContact CB-CE1 4.18Å; R85-F161 HydrophobicContact CG-CD1 4.19Å; R85-F161 HydrophobicContact CG-CE1 3.9Å; R85-F161 HydrophobicContact CG-CZ 4.32Å; T159-F161 HydrophobicContact CG2-CD2 4.15Å; T159-F161 HydrophobicContact CG2-CE2 3.6Å; T159-F161 HydrophobicContact CG2-CZ 3.87Å; F161-I222 CarbonylContact O-C 3.59Å; F161-I222 WeakPolarHBondContact O-CA 3.35Å; F161-K223 HydrophobicContact CB-CB 4.23Å; F161-K223 PolarHBondContact N-O 2.95Å; F161-K223 PolarHBondContact O-N 3.39Å
162	V	88.6	Confident	72.4	Confident	0 Å²	0	61 Å²	61	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	129.2	-172.7	-177.2	0	0	0	0	110.6	T83 T84 Y86 I160 L167 L194 I222	T83-V162 PolarHBondContact N-O 3.08Å; T84-V162 PolarHBondContact N-O 3.04Å; T84-V162 VanDerWaalsContact N-O 3.1Å; T84-V162 PolarHBondContact O-N 2.79Å; Y86-V162 HydrophobicContact CD2-CG2 3.75Å; Y86-V162 HydrophobicContact CE2-CB 4.43Å; Y86-V162 HydrophobicContact CE2-CG2 3.85Å; I160-V162 HydrophobicContact CG2-CG2 3.88Å; V162-L167 HydrophobicContact CG1-CB 4.43Å; V162-L167 HydrophobicContact CG1-CD1 4.3Å; V162-L167 HydrophobicContact CG1-CD2 3.97Å; V162-L167 HydrophobicContact CG1-CG 4.47Å; V162-L194 HydrophobicContact CG2-CD1 4.36Å; V162-I222 HydrophobicContact CG1-CG2 4.45Å; V162-I222 HydrophobicContact CG2-CG2 4.1Å
163	D	86.3	Confident	70.8	Confident	7 Å²	7	64.7 Å²	64.7	4%	0.037	32%	0.315	C	S	.	.			trans	-91.7	99.4	166.6	-177.8	-7.7	0	0	0	109	G81 F82 R165 K166 L167 A221	G81-D163 VanDerWaalsContact O-CG 3.24Å; F82-D163 HydrophobicContact CD1-CB 4.09Å; F82-D163 HydrophobicContact CE1-CB 4.43Å; D163-R165 PolarHBondContact O-N 2.69Å; D163-R165 VanDerWaalsContact O-N 3.08Å; D163-R165 WeakPolarHBondContact OD1-CB 3.47Å; D163-R165 PolarHBondContact OD1-N 3.35Å; D163-K166 HydrophobicContact CB-CB 4.42Å; D163-K166 HydrophobicContact CB-CD 4.49Å; D163-K166 PolarHBondContact O-N 3.49Å; D163-K166 VanDerWaalsContact O-N 3.16Å; D163-K166 VanDerWaalsContact OD2-CD 3.22Å; D163-K166 WeakPolarHBondContact OD2-CD 3.46Å; D163-K166 VanDerWaalsContact OD2-CE 3.26Å; D163-K166 WeakPolarHBondContact OD2-CE 3.26Å; D163-K166 WeakPolarHBondContact OD2-CG 3.31Å; D163-K166 IonicContact OD2-NZ 3.87Å; D163-L167 PolarHBondContact O-N 3.23Å; D163-A221 PolarHBondContact N-O 2.93Å
164	K	79.8	Confident	69.2	Low	122 Å²	122	70.5 Å²	70.5	53%	0.53	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-21.9	178.8	-75.3	178.3	165.6	166.4	0	114	T84	T84-K164 WeakPolarHBondContact OG1-CD 3.45Å; T84-K164 WeakPolarHBondContact OG1-CE 3.12Å; T84-K164 PolarHBondContact OG1-NZ 3.07Å
165	R	76.1	Confident	67.8	Low	201 Å²	201	74.6 Å²	74.6	76%	0.758	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-30.4	-178.3	-56.3	175.3	-179.9	174.5	1.1	112.2	D163	D163-R165 PolarHBondContact O-N 2.69Å; D163-R165 VanDerWaalsContact O-N 3.08Å; D163-R165 WeakPolarHBondContact OD1-CB 3.47Å; D163-R165 PolarHBondContact OD1-N 3.35Å
166	K	73.2	Confident	66.1	Low	110 Å²	110	77.4 Å²	77.4	48%	0.478	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-24.7	179.3	-66.6	179.6	-172.8	171.1	0	111.8	D163 G168 A221	D163-K166 HydrophobicContact CB-CB 4.42Å; D163-K166 HydrophobicContact CB-CD 4.49Å; D163-K166 PolarHBondContact O-N 3.49Å; D163-K166 VanDerWaalsContact O-N 3.16Å; D163-K166 VanDerWaalsContact OD2-CD 3.22Å; D163-K166 WeakPolarHBondContact OD2-CD 3.46Å; D163-K166 VanDerWaalsContact OD2-CE 3.26Å; D163-K166 WeakPolarHBondContact OD2-CE 3.26Å; D163-K166 WeakPolarHBondContact OD2-CG 3.31Å; D163-K166 IonicContact OD2-NZ 3.87Å; K166-G168 PolarHBondContact O-N 3.02Å; K166-A221 HydrophobicContact CB-CB 3.78Å
167	L	70.3	Confident	64.5	Low	30 Å²	30	82.3 Å²	82.3	16%	0.157	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	110.3	174.2	-153.1	82.7	0	0	0	110.1	V162 D163 V189 L191 L194 A221 I222	V162-L167 HydrophobicContact CG1-CB 4.43Å; V162-L167 HydrophobicContact CG1-CD1 4.3Å; V162-L167 HydrophobicContact CG1-CD2 3.97Å; V162-L167 HydrophobicContact CG1-CG 4.47Å; D163-L167 PolarHBondContact O-N 3.23Å; L167-V189 HydrophobicContact CD1-CG1 4.5Å; L167-L191 HydrophobicContact CD2-CB 3.99Å; L167-L191 HydrophobicContact CD2-CD1 3.86Å; L167-L194 HydrophobicContact CD1-CD1 3.6Å; L167-L194 HydrophobicContact CD2-CD1 3.96Å; L167-L194 HydrophobicContact CG-CD1 4.43Å; L167-A221 HydrophobicContact CB-CB 4.48Å; L167-A221 HydrophobicContact CD1-CB 3.96Å; L167-I222 HydrophobicContact CD1-CG2 4.21Å
168	G	60.2	Low	62	Low	57 Å²	57	87.9 Å²	87.9	59%	0.588	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.9	0.1	178.5	0	0	0	0	0	115.9	K166 K170	K166-G168 PolarHBondContact O-N 3.02Å; G168-K170 PolarHBondContact O-N 3Å
169	R	56.4	Low	59.9	Low	213 Å²	213	94.9 Å²	94.9	80%	0.804	54%	0.539	S	S	*	.			trans	-72.1	97.1	166.9	-120.2	177.7	167.8	179.3	-4.6	108	T171	R169-T171 PolarHBondContact O-N 3.07Å
170	K	49.1	Very low	57.7	Low	163 Å²	163	102.2 Å²	102.2	71%	0.709	58%	0.576	S	S	*	*			trans	-50.9	126.3	163.9	-158.6	177.3	-176.5	-174.8	0	106	G168 E172	G168-K170 PolarHBondContact O-N 3Å; K170-E172 PolarHBondContact O-N 2.96Å
171	T	44.3	Very low	55.3	Low	128 Å²	128	105.8 Å²	105.8	79%	0.785	61%	0.614	S	S	*	*			trans	-62.9	83.8	174.9	42.4	0	0	0	0	108.7	R169 T173	R169-T171 PolarHBondContact O-N 3.07Å; T171-T173 VanDerWaalsContact C-N 3.32Å; T171-T173 PolarHBondContact O-N 2.87Å
172	E	44.3	Very low	52.7	Low	170 Å²	170	109 Å²	109	79%	0.794	65%	0.65	S	S	*	*			trans	-88.9	82.9	159.5	-76.9	-177.3	179.1	0	0	106.6	K170	K170-E172 PolarHBondContact O-N 2.96Å
173	T	37	Very low	50.5	Low	110 Å²	110	115 Å²	115	68%	0.675	69%	0.692	S	S	*	*			trans	-126	110.9	161.8	-15.7	0	0	0	0	108.1	T171	T171-T173 VanDerWaalsContact C-N 3.32Å; T171-T173 PolarHBondContact O-N 2.87Å
174	T	34.9	Very low	48.3	Very low	128 Å²	128	117.5 Å²	117.5	79%	0.785	72%	0.719	S	S	*	*			trans	71.9	109.5	146.9	48.7	0	0	0	0	118.7	G176	T174-G176 PolarHBondContact O-N 3.42Å
175	G	42.2	Very low	46.6	Very low	90 Å²	90	119.1 Å²	119.1	93%	0.928	73%	0.734	S	S	*	*			trans	-51.9	128.2	148.4	0	0	0	0	0	110.3
176	G	37.5	Very low	45.1	Very low	65 Å²	65	114.8 Å²	114.8	67%	0.67	73%	0.734	S	S	*	*			trans	165.3	106.3	-177.8	0	0	0	0	0	107.9	T174	T174-G176 PolarHBondContact O-N 3.42Å
177	A	42.6	Very low	44.3	Very low	111 Å²	111	113.6 Å²	113.6	92%	0.917	74%	0.74	S	S	*	*			trans	-47.5	136.5	-170.1	0	0	0	0	0	114.4
178	S	28.4	Very low	43.8	Very low	120 Å²	120	115.7 Å²	115.7	84%	0.839	76%	0.761	S	S	*	*			trans	-146.5	141.2	151.4	53.7	0	0	0	0	111.2
179	I	42.4	Very low	44.1	Very low	147 Å²	147	114.3 Å²	114.3	75%	0.754	74%	0.741	S	S	*	*			trans	-90.2	142.8	-172.5	-72.5	170.1	0	0	0	108.4
180	I	40.7	Very low	45.1	Very low	160 Å²	160	106.4 Å²	106.4	82%	0.821	72%	0.719	S	S	*	*	S	Bend	trans	68.8	116.7	160.4	-63.5	160	0	0	0	118.8
181	G	39.5	Very low	46.6	Very low	80 Å²	80	101.6 Å²	101.6	83%	0.825	70%	0.7	S	S	*	*				83.3	91.7	128.1	0	0	0	0	0	118.2
182	G	32.6	Very low	48.3	Very low	78 Å²	78	102.2 Å²	102.2	80%	0.804	69%	0.694	S	S	*	*			trans	171.1	78.7	165.3	0	0	0	0	0	113.2	G184	G182-G184 VanDerWaalsContact C-N 3.33Å; G182-G184 PolarHBondContact O-N 3.35Å
183	S	43.3	Very low	50.1	Low	126 Å²	126	96.4 Å²	96.4	88%	0.881	67%	0.671	S	S	*	*			trans	-66.4	92.7	167.2	-178	0	0	0	0	109.4
184	G	39.5	Very low	52.4	Low	58 Å²	58	91.3 Å²	91.3	60%	0.598	64%	0.639	S	S	*	*			trans	-118.3	104.1	165.4	0	0	0	0	0	108.2	G182 S186	G182-G184 VanDerWaalsContact C-N 3.33Å; G182-G184 PolarHBondContact O-N 3.35Å; G184-S186 PolarHBondContact O-N 3.2Å
185	N	43.4	Very low	54.8	Low	156 Å²	156	89.3 Å²	89.3	83%	0.834	62%	0.621	S	S	*	*			trans	-61.2	85.4	170.1	-79.1	-16.9	0	0	0	109.7	S187	N185-S187 PolarHBondContact O-N 2.77Å
186	S	45.5	Very low	56.8	Low	110 Å²	110	91.6 Å²	91.6	77%	0.769	61%	0.607	S	S	*	*			trans	-77.6	73.3	167.7	52.9	0	0	0	0	108.6	G184 A188	G184-S186 PolarHBondContact O-N 3.2Å; S186-A188 PolarHBondContact O-N 2.79Å
187	S	56.6	Low	59.2	Low	86 Å²	86	89.4 Å²	89.4	60%	0.601	58%	0.58	S	S	*	*			trans	-52.7	116.8	168.4	57.5	0	0	0	0	107.8	N185 V189	N185-S187 PolarHBondContact O-N 2.77Å; S187-V189 PolarHBondContact O-N 2.91Å
188	A	58.7	Low	61.2	Low	73 Å²	73	84.5 Å²	84.5	60%	0.603	54%	0.54	S	S	*	.			trans	-50.2	120.2	176.1	0	0	0	0	0	108.6	S186 S190	S186-A188 PolarHBondContact O-N 2.79Å; A188-S190 PolarHBondContact O-N 2.87Å
189	V	68.3	Low	63.9	Low	28 Å²	28	82.1 Å²	82.1	17%	0.17	53%	0.527	C	S	.	.			trans	-71.6	104.3	-175.7	179.5	0	0	0	0	108.1	L167 S187 L194 I215	L167-V189 HydrophobicContact CD1-CG1 4.5Å; S187-V189 PolarHBondContact O-N 2.91Å; V189-L194 HydrophobicContact CG1-CD1 4.44Å; V189-L194 HydrophobicContact CG1-CD2 4.24Å; V189-L194 HydrophobicContact CG1-CG 3.96Å; V189-I215 HydrophobicContact CB-CG2 4.49Å; V189-I215 HydrophobicContact CG1-CD1 4.16Å; V189-I215 HydrophobicContact CG1-CG2 4.05Å; V189-I215 HydrophobicContact CG2-CD1 4.29Å; V189-I215 HydrophobicContact CG2-CG1 4.11Å; V189-I215 HydrophobicContact CG2-CG2 4.17Å
190	S	76.1	Confident	66	Low	48 Å²	48	77 Å²	77	34%	0.336	50%	0.504	S	S	.	.			trans	-81.9	160.5	174.2	72.4	0	0	0	0	111	A188 E192 T193 L194	A188-S190 PolarHBondContact O-N 2.87Å; S190-E192 PolarHBondContact O-N 2.87Å; S190-T193 PolarHBondContact N-OG1 2.8Å; S190-T193 PolarHBondContact O-N 3.4Å; S190-T193 VanDerWaalsContact O-N 3.16Å; S190-T193 PolarHBondContact O-OG1 2.77Å; S190-T193 PolarHBondContact OG-N 2.85Å; S190-L194 PolarHBondContact O-N 2.78Å
191	L	80	Confident	68.2	Low	61 Å²	61	69.3 Å²	69.3	32%	0.319	47%	0.465	S	S	.	.	H	α-helix	trans	-58.3	-33.8	176.3	-171.5	67.4	0	0	0	112.6	Y86 L167 L194 H195	Y86-L191 HydrophobicContact CE2-CD1 3.86Å; L167-L191 HydrophobicContact CD2-CB 3.99Å; L167-L191 HydrophobicContact CD2-CD1 3.86Å; L191-L194 PolarHBondContact O-N 2.69Å; L191-H195 PolarHBondContact O-N 3.08Å; L191-H195 VanDerWaalsContact O-N 3.08Å
192	E	81.1	Confident	70.3	Confident	141 Å²	141	68.7 Å²	68.7	66%	0.659	44%	0.44	S	S	*	.	H	α-helix	trans	-65.9	-39.8	177.9	-66.7	170.2	179.5	0	0	112.1	S190 L194 H195 Q196	S190-E192 PolarHBondContact O-N 2.87Å; E192-L194 VanDerWaalsContact C-N 3.31Å; E192-L194 PolarHBondContact O-N 3.38Å; E192-H195 PolarHBondContact O-N 3.39Å; E192-Q196 WeakPolarHBondContact O-CG 3.43Å; E192-Q196 PolarHBondContact O-N 3.14Å
193	T	82.9	Confident	72.8	Confident	49 Å²	49	72.4 Å²	72.4	30%	0.301	44%	0.439	S	S	.	.	H	α-helix	trans	-65	-34.9	175.8	59.3	0	0	0	0	112.4	S190 Q196 L197	S190-T193 PolarHBondContact N-OG1 2.8Å; S190-T193 PolarHBondContact O-N 3.4Å; S190-T193 VanDerWaalsContact O-N 3.16Å; S190-T193 PolarHBondContact O-OG1 2.77Å; S190-T193 PolarHBondContact OG-N 2.85Å; T193-Q196 PolarHBondContact O-N 2.87Å; T193-L197 WeakPolarHBondContact O-CB 3.31Å; T193-L197 VanDerWaalsContact O-CG 3.28Å; T193-L197 WeakPolarHBondContact O-CG 3.38Å; T193-L197 PolarHBondContact O-N 3.19Å
194	L	85.1	Confident	74.8	Confident	2 Å²	2	70.2 Å²	70.2	1%	0.01	42%	0.418	C	S	.	.	H	α-helix	trans	-66.9	-39	172.2	-74.4	171.8	0	0	0	112.2	V162 L167 V189 S190 L191 E192 L197 A198 L212 I215 I222	V162-L194 HydrophobicContact CG2-CD1 4.36Å; L167-L194 HydrophobicContact CD1-CD1 3.6Å; L167-L194 HydrophobicContact CD2-CD1 3.96Å; L167-L194 HydrophobicContact CG-CD1 4.43Å; V189-L194 HydrophobicContact CG1-CD1 4.44Å; V189-L194 HydrophobicContact CG1-CD2 4.24Å; V189-L194 HydrophobicContact CG1-CG 3.96Å; S190-L194 PolarHBondContact O-N 2.78Å; L191-L194 PolarHBondContact O-N 2.69Å; E192-L194 VanDerWaalsContact C-N 3.31Å; E192-L194 PolarHBondContact O-N 3.38Å; L194-L197 PolarHBondContact O-N 2.67Å; L194-A198 VanDerWaalsContact O-CB 3.3Å; L194-A198 WeakPolarHBondContact O-CB 3.33Å; L194-A198 PolarHBondContact O-N 3.42Å; L194-L212 HydrophobicContact CD2-CD2 3.93Å; L194-I215 HydrophobicContact CD2-CD1 4.37Å; L194-I222 HydrophobicContact CD1-CG2 3.68Å; L194-I222 HydrophobicContact CD2-CD1 3.78Å; L194-I222 HydrophobicContact CD2-CG2 4.14Å
195	H	83.8	Confident	76.9	Confident	86 Å²	86	70.9 Å²	70.9	40%	0.398	40%	0.402	S	S	.	.	H	α-helix	trans	-65.6	-40.1	175.5	-71.9	-177.1	0	0	0	112.1	Y86 L191 E192 A198 A199	Y86-H195 AromaticContact CD1-NE2 3.92Å; Y86-H195 AromaticContact CE1-NE2 3.32Å; Y86-H195 VanDerWaalsContact CE1-NE2 3.32Å; Y86-H195 WeakPolarHBondContact CE1-NE2 3.49Å; Y86-H195 AromaticContact CE2-NE2 3.92Å; Y86-H195 AromaticContact CZ-NE2 3.3Å; Y86-H195 VanDerWaalsContact CZ-NE2 3.3Å; L191-H195 PolarHBondContact O-N 3.08Å; L191-H195 VanDerWaalsContact O-N 3.08Å; E192-H195 PolarHBondContact O-N 3.39Å; H195-A198 PolarHBondContact O-N 2.78Å; H195-A199 WeakPolarHBondContact O-CB 3.27Å; H195-A199 PolarHBondContact O-N 3.41Å
196	Q	85.8	Confident	78.9	Confident	138 Å²	138	68.4 Å²	68.4	65%	0.645	39%	0.386	S	S	*	.	H	α-helix	trans	-64.7	-42.6	175.3	-72.6	177.4	-6	0	0	111.9	E192 T193 A199 S200	E192-Q196 WeakPolarHBondContact O-CG 3.43Å; E192-Q196 PolarHBondContact O-N 3.14Å; T193-Q196 PolarHBondContact O-N 2.87Å; Q196-A199 PolarHBondContact O-N 2.93Å; Q196-S200 PolarHBondContact O-N 3.49Å
197	L	86.5	Confident	80.8	Confident	20 Å²	20	65.4 Å²	65.4	11%	0.105	37%	0.365	C	S	.	.	H	α-helix	trans	-65.2	-40.8	174.2	-71.3	170.8	0	0	0	111.8	T193 L194 A199 S200 Y201 T208 R211 L212 I215	T193-L197 WeakPolarHBondContact O-CB 3.31Å; T193-L197 VanDerWaalsContact O-CG 3.28Å; T193-L197 WeakPolarHBondContact O-CG 3.38Å; T193-L197 PolarHBondContact O-N 3.19Å; L194-L197 PolarHBondContact O-N 2.67Å; L197-A199 VanDerWaalsContact C-N 3.31Å; L197-A199 PolarHBondContact O-N 2.9Å; L197-S200 PolarHBondContact O-N 2.89Å; L197-S200 PolarHBondContact O-OG 3.05Å; L197-Y201 PolarHBondContact O-N 2.85Å; L197-T208 HydrophobicContact CB-CG2 4.44Å; L197-T208 WeakPolarHBondContact O-CG2 3.36Å; L197-R211 HydrophobicContact CD1-CG 4.17Å; L197-R211 HydrophobicContact CD2-CB 4.47Å; L197-R211 HydrophobicContact CD2-CG 4.12Å; L197-L212 HydrophobicContact CB-CD2 4.27Å; L197-L212 HydrophobicContact CD1-CD2 4.34Å; L197-I215 HydrophobicContact CD1-CD1 3.6Å
198	A	85	Confident	82.3	Confident	8 Å²	8	61.4 Å²	61.4	7%	0.066	34%	0.337	C	S	.	.	H	α-helix	trans	-59.2	-44.8	173.3	0	0	0	0	0	110.6	I88 I160 L194 H195 S200 Y201	I88-A198 HydrophobicContact CD1-CB 4.09Å; I88-A198 WeakPolarHBondContact CD1-O 3.14Å; I160-A198 HydrophobicContact CD1-CB 4.16Å; L194-A198 VanDerWaalsContact O-CB 3.3Å; L194-A198 WeakPolarHBondContact O-CB 3.33Å; L194-A198 PolarHBondContact O-N 3.42Å; H195-A198 PolarHBondContact O-N 2.78Å; A198-S200 VanDerWaalsContact C-N 3.31Å; A198-S200 PolarHBondContact O-N 3.38Å; A198-Y201 VanDerWaalsContact O-CB 3.25Å; A198-Y201 WeakPolarHBondContact O-CB 3.33Å; A198-Y201 PolarHBondContact O-N 2.91Å
199	A	85.1	Confident	83.7	Confident	70 Å²	70	58.7 Å²	58.7	58%	0.579	31%	0.312	S	S	*	.	H	α-helix	trans	-63.3	-33.1	177.3	0	0	0	0	0	113.4	H195 Q196 L197 Y201	H195-A199 WeakPolarHBondContact O-CB 3.27Å; H195-A199 PolarHBondContact O-N 3.41Å; Q196-A199 PolarHBondContact O-N 2.93Å; L197-A199 VanDerWaalsContact C-N 3.31Å; L197-A199 PolarHBondContact O-N 2.9Å; A199-Y201 VanDerWaalsContact C-N 3.3Å; A199-Y201 PolarHBondContact O-N 3.16Å
200	S	87.3	Confident	84.6	Confident	38 Å²	38	64.4 Å²	64.4	27%	0.266	33%	0.331	S	S	.	.	H	α-helix	trans	-77.2	-12.6	178.4	67.9	0	0	0	0	114.3	Q196 L197 A198 F202 I203 D204 T208	Q196-S200 PolarHBondContact O-N 3.49Å; L197-S200 PolarHBondContact O-N 2.89Å; L197-S200 PolarHBondContact O-OG 3.05Å; A198-S200 VanDerWaalsContact C-N 3.31Å; A198-S200 PolarHBondContact O-N 3.38Å; S200-F202 VanDerWaalsContact C-N 3.33Å; S200-F202 PolarHBondContact O-N 3.43Å; S200-I203 PolarHBondContact O-N 2.96Å; S200-D204 PolarHBondContact O-N 3.07Å; S200-T208 PolarHBondContact OG-OG1 3.3Å
201	Y	87	Confident	85.1	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-42.6	-175.3	172.3	-104.9	0	0	0	113.6	I88 E156 L158 L197 A198 A199 I203 R205 T208 L209 E226	I88-Y201 HydrophobicContact CD1-CD1 3.98Å; I88-Y201 HydrophobicContact CD1-CG 4.24Å; E156-Y201 HydrophobicContact CG-CE1 3.96Å; E156-Y201 WeakPolarHBondContact CG-OH 3.45Å; E156-Y201 PolarHBondContact OE1-OH 3.22Å; L158-Y201 HydrophobicContact CB-CD1 3.92Å; L158-Y201 HydrophobicContact CB-CD2 4.37Å; L158-Y201 HydrophobicContact CB-CE1 3.83Å; L158-Y201 HydrophobicContact CB-CE2 4.29Å; L158-Y201 HydrophobicContact CB-CG 4.2Å; L158-Y201 HydrophobicContact CD1-CD2 4.38Å; L158-Y201 HydrophobicContact CD1-CE2 4.19Å; L158-Y201 HydrophobicContact CD2-CD1 4.26Å; L158-Y201 HydrophobicContact CD2-CD2 3.76Å; L158-Y201 HydrophobicContact CD2-CE2 4.35Å; L158-Y201 HydrophobicContact CD2-CG 3.71Å; L158-Y201 HydrophobicContact CG-CD2 4.4Å; L158-Y201 HydrophobicContact CG-CG 4.48Å; L197-Y201 PolarHBondContact O-N 2.85Å; A198-Y201 VanDerWaalsContact O-CB 3.25Å; A198-Y201 WeakPolarHBondContact O-CB 3.33Å; A198-Y201 PolarHBondContact O-N 2.91Å; A199-Y201 VanDerWaalsContact C-N 3.3Å; A199-Y201 PolarHBondContact O-N 3.16Å; Y201-I203 VanDerWaalsContact C-N 3.27Å; Y201-I203 PolarHBondContact O-N 3.4Å; Y201-R205 HydrophobicContact CD2-CG 4.19Å; Y201-R205 HydrophobicContact CE2-CG 3.6Å; Y201-R205 VanDerWaalsContact O-CA 3.23Å; Y201-R205 WeakPolarHBondContact O-CA 3.36Å; Y201-R205 PolarHBondContact O-N 2.97Å; Y201-T208 HydrophobicContact CD2-CG2 4.47Å; Y201-L209 HydrophobicContact CD2-CD2 4.45Å; Y201-L209 HydrophobicContact CD2-CG 4.25Å; Y201-L209 HydrophobicContact CE2-CD1 4.07Å; Y201-L209 HydrophobicContact CE2-CD2 4.02Å; Y201-L209 HydrophobicContact CE2-CG 3.86Å; Y201-E226 WeakPolarHBondContact OH-CG 3.42Å; Y201-E226 PolarHBondContact OH-OE1 2.94Å
202	F	82.8	Confident	85.5	Confident	67 Å²	67	66.5 Å²	66.5	29%	0.294	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-12.5	179.9	-64.1	-61.7	0	0	0	113.9	I88 Y89 R90 E156 S200	I88-F202 HydrophobicContact CB-CE2 4.16Å; I88-F202 HydrophobicContact CD1-CE2 3.98Å; I88-F202 HydrophobicContact CD1-CZ 4.42Å; I88-F202 HydrophobicContact CG1-CE2 4.12Å; I88-F202 HydrophobicContact CG1-CZ 4.26Å; Y89-F202 VanDerWaalsContact C-CZ 3.43Å; R90-F202 HydrophobicContact CB-CD1 3.81Å; R90-F202 HydrophobicContact CB-CE1 3.32Å; R90-F202 HydrophobicContact CB-CE2 4.37Å; R90-F202 HydrophobicContact CB-CZ 3.66Å; R90-F202 HydrophobicContact CG-CE1 4.48Å; E156-F202 HydrophobicContact CG-CE1 4.16Å; S200-F202 VanDerWaalsContact C-N 3.33Å; S200-F202 PolarHBondContact O-N 3.43Å
203	I	84.7	Confident	85.8	Confident	155 Å²	155	63.7 Å²	63.7	80%	0.795	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-48.5	179.2	-60	172.9	0	0	0	109.9	S200 Y201	S200-I203 PolarHBondContact O-N 2.96Å; Y201-I203 VanDerWaalsContact C-N 3.27Å; Y201-I203 PolarHBondContact O-N 3.4Å
204	D	85.9	Confident	86	Confident	81 Å²	81	67.8 Å²	67.8	43%	0.433	33%	0.329	S	S	.	.	S	Bend	trans	-137.4	85	179.1	-175	0.5	0	0	0	110.5	S200 S207 T208	S200-D204 PolarHBondContact O-N 3.07Å; D204-S207 PolarHBondContact OD1-N 3.36Å; D204-S207 PolarHBondContact OD1-OG 3.01Å; D204-S207 WeakPolarHBondContact OD2-CB 3.47Å; D204-S207 PolarHBondContact OD2-OG 2.9Å; D204-T208 WeakPolarHBondContact O-CB 3.08Å; D204-T208 PolarHBondContact O-N 3.18Å; D204-T208 VanDerWaalsContact O-N 3.17Å; D204-T208 PolarHBondContact O-OG1 2.84Å
205	R	83.8	Confident	86	Confident	71 Å²	71	68.4 Å²	68.4	27%	0.268	33%	0.332	S	S	.	.	H	α-helix	trans	-61	-51.1	-172.4	-172.4	-170.6	74.8	97.1	2.9	112.6	Y201 T208 L209 E226	Y201-R205 HydrophobicContact CD2-CG 4.19Å; Y201-R205 HydrophobicContact CE2-CG 3.6Å; Y201-R205 VanDerWaalsContact O-CA 3.23Å; Y201-R205 WeakPolarHBondContact O-CA 3.36Å; Y201-R205 PolarHBondContact O-N 2.97Å; R205-T208 PolarHBondContact O-N 2.89Å; R205-L209 HydrophobicContact CG-CD1 4.03Å; R205-L209 WeakPolarHBondContact O-CB 3.46Å; R205-L209 WeakPolarHBondContact O-CG 3.48Å; R205-L209 PolarHBondContact O-N 3.09Å; R205-E226 WeakPolarHBondContact CD-OE1 3.46Å; R205-E226 IonicContact CZ-OE1 3.99Å; R205-E226 IonicContact NH1-OE1 2.99Å; R205-E226 PolarHBondContact NH1-OE1 2.82Å; R205-E226 IonicContact NH1-OE2 3.32Å; R205-E226 PolarHBondContact NH1-OE2 3.36Å
206	E	84.5	Confident	86.2	Confident	104 Å²	104	66.1 Å²	66.1	49%	0.486	32%	0.322	S	S	.	.	H	α-helix	trans	-70.1	-42.1	-170.8	-68.3	-171.3	-178	0	0	112.2	R210	E206-R210 WeakPolarHBondContact O-CB 3.43Å; E206-R210 VanDerWaalsContact O-CG 3.27Å; E206-R210 WeakPolarHBondContact O-CG 3.48Å; E206-R210 PolarHBondContact O-N 3.22Å; E206-R210 PolarHBondContact O-NE 3.3Å; E206-R210 IonicContact OE2-NH2 2.97Å; E206-R210 PolarHBondContact OE2-NH2 2.96Å
207	S	86.2	Confident	86.1	Confident	48 Å²	48	66.2 Å²	66.2	34%	0.336	33%	0.325	S	S	.	.	H	α-helix	trans	-68.1	-39.5	178.2	80.7	0	0	0	0	111.1	D204 R210 R211	D204-S207 PolarHBondContact OD1-N 3.36Å; D204-S207 PolarHBondContact OD1-OG 3.01Å; D204-S207 WeakPolarHBondContact OD2-CB 3.47Å; D204-S207 PolarHBondContact OD2-OG 2.9Å; S207-R210 PolarHBondContact O-N 3.26Å; S207-R211 WeakPolarHBondContact O-CB 3.44Å; S207-R211 PolarHBondContact O-N 3.22Å
208	T	87.9	Confident	85.9	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.012	35%	0.353	C	S	.	.	H	α-helix	trans	-64.2	-47.7	177.9	-60.5	0	0	0	0	111.2	L197 S200 Y201 D204 R205 R211 L212	L197-T208 HydrophobicContact CB-CG2 4.44Å; L197-T208 WeakPolarHBondContact O-CG2 3.36Å; S200-T208 PolarHBondContact OG-OG1 3.3Å; Y201-T208 HydrophobicContact CD2-CG2 4.47Å; D204-T208 WeakPolarHBondContact O-CB 3.08Å; D204-T208 PolarHBondContact O-N 3.18Å; D204-T208 VanDerWaalsContact O-N 3.17Å; D204-T208 PolarHBondContact O-OG1 2.84Å; R205-T208 PolarHBondContact O-N 2.89Å; T208-R211 PolarHBondContact O-N 3.05Å; T208-L212 HydrophobicContact CG2-CD1 3.96Å; T208-L212 HydrophobicContact CG2-CG 4.38Å; T208-L212 WeakPolarHBondContact O-CB 3.27Å; T208-L212 WeakPolarHBondContact O-CG 3.48Å; T208-L212 PolarHBondContact O-N 2.94Å
209	L	87.1	Confident	85.6	Confident	15 Å²	15	71.8 Å²	71.8	8%	0.079	37%	0.368	C	S	.	.	H	α-helix	trans	-63.4	-43.1	177.5	-79.5	174.3	0	0	0	112.3	L158 Y201 R205 R211 L212 H213 V224 E226	L158-L209 HydrophobicContact CD1-CD2 3.82Å; Y201-L209 HydrophobicContact CD2-CD2 4.45Å; Y201-L209 HydrophobicContact CD2-CG 4.25Å; Y201-L209 HydrophobicContact CE2-CD1 4.07Å; Y201-L209 HydrophobicContact CE2-CD2 4.02Å; Y201-L209 HydrophobicContact CE2-CG 3.86Å; R205-L209 HydrophobicContact CG-CD1 4.03Å; R205-L209 WeakPolarHBondContact O-CB 3.46Å; R205-L209 WeakPolarHBondContact O-CG 3.48Å; R205-L209 PolarHBondContact O-N 3.09Å; L209-R211 VanDerWaalsContact C-N 3.29Å; L209-R211 PolarHBondContact O-N 3.42Å; L209-L212 PolarHBondContact O-N 3.08Å; L209-H213 WeakPolarHBondContact O-CB 3.2Å; L209-H213 PolarHBondContact O-CD2 3.2Å; L209-H213 VanDerWaalsContact O-CD2 3.22Å; L209-H213 PolarHBondContact O-N 3.2Å; L209-V224 HydrophobicContact CD2-CG1 4.39Å; L209-E226 VanDerWaalsContact CD1-OE2 3.27Å; L209-E226 WeakPolarHBondContact CD1-OE2 3.3Å
210	R	88.1	Confident	85.4	Confident	148 Å²	148	70 Å²	70	56%	0.558	36%	0.357	S	S	*	.	H	α-helix	trans	-57.2	-45.7	174.5	-76.4	-178.7	-123	151.7	-2.3	110.7	E206 S207 H213 H214	E206-R210 WeakPolarHBondContact O-CB 3.43Å; E206-R210 VanDerWaalsContact O-CG 3.27Å; E206-R210 WeakPolarHBondContact O-CG 3.48Å; E206-R210 PolarHBondContact O-N 3.22Å; E206-R210 PolarHBondContact O-NE 3.3Å; E206-R210 IonicContact OE2-NH2 2.97Å; E206-R210 PolarHBondContact OE2-NH2 2.96Å; S207-R210 PolarHBondContact O-N 3.26Å; R210-H213 PolarHBondContact O-N 3.07Å; R210-H214 PolarHBondContact O-CD2 3.12Å; R210-H214 PolarHBondContact O-N 3.38Å
211	R	86.8	Confident	85.1	Confident	154 Å²	154	68.2 Å²	68.2	58%	0.581	34%	0.344	S	S	*	.	H	α-helix	trans	-66.2	-40.9	179.3	-167.1	157.6	-179.4	177	3.4	112.7	L197 S207 T208 L209 H214 I215	L197-R211 HydrophobicContact CD1-CG 4.17Å; L197-R211 HydrophobicContact CD2-CB 4.47Å; L197-R211 HydrophobicContact CD2-CG 4.12Å; S207-R211 WeakPolarHBondContact O-CB 3.44Å; S207-R211 PolarHBondContact O-N 3.22Å; T208-R211 PolarHBondContact O-N 3.05Å; L209-R211 VanDerWaalsContact C-N 3.29Å; L209-R211 PolarHBondContact O-N 3.42Å; R211-H214 PolarHBondContact O-N 3.28Å; R211-I215 VanDerWaalsContact O-CG1 3.31Å; R211-I215 WeakPolarHBondContact O-CG1 3.42Å; R211-I215 PolarHBondContact O-N 3.14Å
212	L	88.1	Confident	85.2	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-65.3	-41.4	174.5	-76.7	175.2	0	0	0	112.4	L158 I160 L194 L197 T208 L209 I215 Q216 I222 V224	L158-L212 HydrophobicContact CD1-CD1 4.48Å; L158-L212 HydrophobicContact CD2-CD1 3.74Å; I160-L212 HydrophobicContact CD1-CD1 4.13Å; I160-L212 HydrophobicContact CD1-CD2 4.17Å; L194-L212 HydrophobicContact CD2-CD2 3.93Å; L197-L212 HydrophobicContact CB-CD2 4.27Å; L197-L212 HydrophobicContact CD1-CD2 4.34Å; T208-L212 HydrophobicContact CG2-CD1 3.96Å; T208-L212 HydrophobicContact CG2-CG 4.38Å; T208-L212 WeakPolarHBondContact O-CB 3.27Å; T208-L212 WeakPolarHBondContact O-CG 3.48Å; T208-L212 PolarHBondContact O-N 2.94Å; L209-L212 PolarHBondContact O-N 3.08Å; L212-I215 PolarHBondContact O-N 2.86Å; L212-Q216 WeakPolarHBondContact O-CB 3.45Å; L212-Q216 PolarHBondContact O-N 2.76Å; L212-I222 HydrophobicContact CD2-CD1 4.05Å; L212-V224 HydrophobicContact CB-CG2 4.17Å; L212-V224 HydrophobicContact CD1-CG1 4.37Å
213	H	88.1	Confident	85.4	Confident	82 Å²	82	68.1 Å²	68.1	38%	0.38	34%	0.344	S	S	.	.	H	α-helix	trans	-65.3	-39	173.8	-80.9	-57.2	0	0	0	112.3	L209 R210 I215 Q216 I217	L209-H213 WeakPolarHBondContact O-CB 3.2Å; L209-H213 PolarHBondContact O-CD2 3.2Å; L209-H213 VanDerWaalsContact O-CD2 3.22Å; L209-H213 PolarHBondContact O-N 3.2Å; R210-H213 PolarHBondContact O-N 3.07Å; H213-I215 VanDerWaalsContact C-N 3.34Å; H213-I215 PolarHBondContact O-N 3.28Å; H213-Q216 WeakPolarHBondContact O-CB 3.49Å; H213-Q216 PolarHBondContact O-N 2.9Å; H213-I217 VanDerWaalsContact O-CG1 3.31Å; H213-I217 WeakPolarHBondContact O-CG1 3.43Å; H213-I217 PolarHBondContact O-N 3.45Å
214	H	87.1	Confident	85.5	Confident	134 Å²	134	61.2 Å²	61.2	62%	0.62	31%	0.309	S	S	*	.	H	α-helix	trans	-59.1	-44.6	171.7	-84.3	-62.8	0	0	0	111.8	R210 R211 I217 A218	R210-H214 PolarHBondContact O-CD2 3.12Å; R210-H214 PolarHBondContact O-N 3.38Å; R211-H214 PolarHBondContact O-N 3.28Å; H214-I217 PolarHBondContact O-N 3.21Å; H214-A218 WeakPolarHBondContact O-CB 3.37Å; H214-A218 PolarHBondContact O-N 2.86Å
215	I	84.9	Confident	85.5	Confident	16 Å²	16	59.5 Å²	59.5	8%	0.082	30%	0.301	C	S	.	.	H	α-helix	trans	-64.2	-42.6	176.4	-65.5	165.4	0	0	0	111	V189 L194 L197 R211 L212 H213 I217 A218 T219 I222	V189-I215 HydrophobicContact CB-CG2 4.49Å; V189-I215 HydrophobicContact CG1-CD1 4.16Å; V189-I215 HydrophobicContact CG1-CG2 4.05Å; V189-I215 HydrophobicContact CG2-CD1 4.29Å; V189-I215 HydrophobicContact CG2-CG1 4.11Å; V189-I215 HydrophobicContact CG2-CG2 4.17Å; L194-I215 HydrophobicContact CD2-CD1 4.37Å; L197-I215 HydrophobicContact CD1-CD1 3.6Å; R211-I215 VanDerWaalsContact O-CG1 3.31Å; R211-I215 WeakPolarHBondContact O-CG1 3.42Å; R211-I215 PolarHBondContact O-N 3.14Å; L212-I215 PolarHBondContact O-N 2.86Å; H213-I215 VanDerWaalsContact C-N 3.34Å; H213-I215 PolarHBondContact O-N 3.28Å; I215-I217 VanDerWaalsContact C-N 3.35Å; I215-I217 PolarHBondContact O-N 3.4Å; I215-A218 PolarHBondContact O-N 3.05Å; I215-T219 HydrophobicContact CG2-CG2 4.44Å; I215-T219 WeakPolarHBondContact O-CB 3.36Å; I215-T219 PolarHBondContact O-N 2.85Å; I215-T219 PolarHBondContact O-OG1 2.79Å; I215-I222 HydrophobicContact CB-CD1 3.84Å; I215-I222 HydrophobicContact CG2-CD1 3.55Å; I215-I222 HydrophobicContact CG2-CG1 3.98Å
216	Q	87.1	Confident	85.4	Confident	37 Å²	37	59.5 Å²	59.5	17%	0.173	30%	0.304	C	S	.	.	H	α-helix	trans	-57.8	-45.7	176	170.7	171.3	-32.6	0	0	111.7	L212 H213 G220 I222	L212-Q216 WeakPolarHBondContact O-CB 3.45Å; L212-Q216 PolarHBondContact O-N 2.76Å; H213-Q216 WeakPolarHBondContact O-CB 3.49Å; H213-Q216 PolarHBondContact O-N 2.9Å; Q216-G220 VanDerWaalsContact O-CA 3.23Å; Q216-G220 WeakPolarHBondContact O-CA 3.34Å; Q216-G220 PolarHBondContact O-N 2.65Å; Q216-I222 HydrophobicContact CB-CG1 3.93Å; Q216-I222 VanDerWaalsContact CG-O 3.23Å; Q216-I222 WeakPolarHBondContact CG-O 3.41Å
217	I	83.7	Confident	84.9	Confident	140 Å²	140	57.6 Å²	57.6	72%	0.718	30%	0.3	S	S	*	.	H	α-helix	trans	-71.7	-43.5	179.8	-65.3	165.7	0	0	0	110.9	H213 H214 I215	H213-I217 VanDerWaalsContact O-CG1 3.31Å; H213-I217 WeakPolarHBondContact O-CG1 3.43Å; H213-I217 PolarHBondContact O-N 3.45Å; H214-I217 PolarHBondContact O-N 3.21Å; I215-I217 VanDerWaalsContact C-N 3.35Å; I215-I217 PolarHBondContact O-N 3.4Å
218	A	82.5	Confident	84.1	Confident	84 Å²	84	60.6 Å²	60.6	69%	0.694	30%	0.304	S	S	*	.	H	α-helix	trans	-72.4	-36.5	-174.1	0	0	0	0	0	113.5	H214 I215	H214-A218 WeakPolarHBondContact O-CB 3.37Å; H214-A218 PolarHBondContact O-N 2.86Å; I215-A218 PolarHBondContact O-N 3.05Å
219	T	78.8	Confident	83	Confident	61 Å²	61	62.4 Å²	62.4	37%	0.374	32%	0.315	S	S	.	.	H	α-helix	trans	-110.7	-24.9	-173.8	66.1	0	0	0	0	113.4	I215 A221	I215-T219 HydrophobicContact CG2-CG2 4.44Å; I215-T219 WeakPolarHBondContact O-CB 3.36Å; I215-T219 PolarHBondContact O-N 2.85Å; I215-T219 PolarHBondContact O-OG1 2.79Å; T219-A221 PolarHBondContact O-N 3.47Å; T219-A221 WeakPolarHBondContact OG1-CB 3.29Å; T219-A221 PolarHBondContact OG1-N 3.29Å
220	G	80.3	Confident	81.7	Confident	33 Å²	33	61.8 Å²	61.8	34%	0.34	31%	0.312	S	S	.	.	S	Bend	trans	58.2	8.7	-167.9	0	0	0	0	0	114.1	Q216 I222	Q216-G220 VanDerWaalsContact O-CA 3.23Å; Q216-G220 WeakPolarHBondContact O-CA 3.34Å; Q216-G220 PolarHBondContact O-N 2.65Å; G220-I222 VanDerWaalsContact C-N 3.35Å
221	A	82.8	Confident	80.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.305	C	S	.	.			trans	-83	-16	-174.9	0	0	0	0	0	112.4	D163 K166 L167 T219	D163-A221 PolarHBondContact N-O 2.93Å; K166-A221 HydrophobicContact CB-CB 3.78Å; L167-A221 HydrophobicContact CB-CB 4.48Å; L167-A221 HydrophobicContact CD1-CB 3.96Å; T219-A221 PolarHBondContact O-N 3.47Å; T219-A221 WeakPolarHBondContact OG1-CB 3.29Å; T219-A221 PolarHBondContact OG1-N 3.29Å
222	I	87.5	Confident	78.5	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.01	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	149.9	179.4	71	174.4	0	0	0	111.8	I160 F161 V162 L167 L194 L212 I215 Q216 G220 V224	I160-I222 HydrophobicContact CG2-CB 4.2Å; I160-I222 HydrophobicContact CG2-CG2 4.46Å; F161-I222 CarbonylContact O-C 3.59Å; F161-I222 WeakPolarHBondContact O-CA 3.35Å; V162-I222 HydrophobicContact CG1-CG2 4.45Å; V162-I222 HydrophobicContact CG2-CG2 4.1Å; L167-I222 HydrophobicContact CD1-CG2 4.21Å; L194-I222 HydrophobicContact CD1-CG2 3.68Å; L194-I222 HydrophobicContact CD2-CD1 3.78Å; L194-I222 HydrophobicContact CD2-CG2 4.14Å; L212-I222 HydrophobicContact CD2-CD1 4.05Å; I215-I222 HydrophobicContact CB-CD1 3.84Å; I215-I222 HydrophobicContact CG2-CD1 3.55Å; I215-I222 HydrophobicContact CG2-CG1 3.98Å; Q216-I222 HydrophobicContact CB-CG1 3.93Å; Q216-I222 VanDerWaalsContact CG-O 3.23Å; Q216-I222 WeakPolarHBondContact CG-O 3.41Å; G220-I222 VanDerWaalsContact C-N 3.35Å; I222-V224 HydrophobicContact CD1-CG2 4Å; I222-V224 HydrophobicContact CG1-CG2 4.32Å
223	K	87.4	Confident	76.5	Confident	64 Å²	64	55.9 Å²	55.9	28%	0.278	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	124.6	168.3	-177.3	73.4	-178.1	-175.4	0	109	F82 I160 F161	F82-K223 HydrophobicContact CE1-CB 4.01Å; F82-K223 HydrophobicContact CE2-CB 4.14Å; F82-K223 HydrophobicContact CZ-CB 3.78Å; I160-K223 WeakPolarHBondContact CA-O 3.27Å; F161-K223 HydrophobicContact CB-CB 4.23Å; F161-K223 PolarHBondContact N-O 2.95Å; F161-K223 PolarHBondContact O-N 3.39Å
224	V	87.9	Confident	74.6	Confident	10 Å²	10	58.6 Å²	58.6	6%	0.061	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	133.7	-173.8	-175.1	0	0	0	0	110.5	L158 T159 I160 L209 L212 I222	L158-V224 HydrophobicContact CD1-CG1 3.4Å; L158-V224 HydrophobicContact CG-CG1 4.42Å; T159-V224 WeakPolarHBondContact O-CA 3.39Å; I160-V224 HydrophobicContact CG1-CG1 4.47Å; I160-V224 HydrophobicContact CG1-CG2 4.31Å; I160-V224 HydrophobicContact CG2-CG2 4.27Å; L209-V224 HydrophobicContact CD2-CG1 4.39Å; L212-V224 HydrophobicContact CB-CG2 4.17Å; L212-V224 HydrophobicContact CD1-CG1 4.37Å; I222-V224 HydrophobicContact CD1-CG2 4Å; I222-V224 HydrophobicContact CG1-CG2 4.32Å
225	T	84.1	Confident	72.6	Confident	45 Å²	45	57 Å²	57	28%	0.276	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	114.3	176.3	52.5	0	0	0	0	109.1	T159	T159-T225 WeakPolarHBondContact CB-OG1 3.29Å; T159-T225 PolarHBondContact N-O 2.75Å; T159-T225 PolarHBondContact O-N 3.24Å; T159-T225 PolarHBondContact O-OG1 3.5Å
226	E	82	Confident	70.7	Confident	71 Å²	71	63.2 Å²	63.2	33%	0.332	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	129.9	170.7	178.1	177.8	-142	0	0	108.7	S157 Y201 R205 L209 R228	S157-E226 WeakPolarHBondContact O-CA 3.35Å; Y201-E226 WeakPolarHBondContact OH-CG 3.42Å; Y201-E226 PolarHBondContact OH-OE1 2.94Å; R205-E226 WeakPolarHBondContact CD-OE1 3.46Å; R205-E226 IonicContact CZ-OE1 3.99Å; R205-E226 IonicContact NH1-OE1 2.99Å; R205-E226 PolarHBondContact NH1-OE1 2.82Å; R205-E226 IonicContact NH1-OE2 3.32Å; R205-E226 PolarHBondContact NH1-OE2 3.36Å; L209-E226 VanDerWaalsContact CD1-OE2 3.27Å; L209-E226 WeakPolarHBondContact CD1-OE2 3.3Å; E226-R228 IonicContact OE1-NE 3.88Å
227	T	74.8	Confident	68.9	Low	63 Å²	63	70.7 Å²	70.7	39%	0.387	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	125.7	170.1	60.9	0	0	0	0	109.4	E156 S157	E156-T227 CarbonylContact C-O 3.47Å; E156-T227 WeakPolarHBondContact CA-O 3.27Å; S157-T227 PolarHBondContact N-O 2.99Å; S157-T227 PolarHBondContact O-N 2.92Å; S157-T227 PolarHBondContact OG-OG1 2.98Å
228	R	70.1	Confident	67.3	Low	111 Å²	111	70.7 Å²	70.7	42%	0.419	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	122.1	173.1	-88.5	177.5	166.3	-160.3	-10.5	108.5	E156 E226 L232	E156-R228 HydrophobicContact CB-CG 4.05Å; E156-R228 HydrophobicContact CG-CG 3.91Å; E156-R228 IonicContact OE1-CZ 3.1Å; E156-R228 IonicContact OE1-NE 2.75Å; E156-R228 PolarHBondContact OE1-NE 3.26Å; E156-R228 IonicContact OE1-NH2 2.66Å; E156-R228 PolarHBondContact OE1-NH2 2.94Å; E156-R228 IonicContact OE2-NH2 3.94Å; E226-R228 IonicContact OE1-NE 3.88Å; R228-L232 HydrophobicContact CG-CD1 4.42Å
229	T	64.1	Low	65.8	Low	41 Å²	41	73.5 Å²	73.5	25%	0.252	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	141	-179.4	54.4	0	0	0	0	109.5	G154 E155 L247	G154-T229 CarbonylContact C-O 3.54Å; G154-T229 VanDerWaalsContact C-O 3.3Å; G154-T229 WeakPolarHBondContact CA-O 3.43Å; E155-T229 PolarHBondContact N-O 3.41Å; E155-T229 PolarHBondContact O-N 3.41Å; E155-T229 PolarHBondContact O-OG1 2.82Å; T229-L247 HydrophobicContact CG2-CD1 4.12Å
230	G	59.8	Low	64.3	Low	2 Å²	2	74.5 Å²	74.5	2%	0.021	42%	0.419	C	S	.	.	S	Bend	trans	96.6	168.7	176.9	0	0	0	0	0	116.2	L232 V243 S245	G230-L232 PolarHBondContact O-N 2.81Å; G230-V243 CarbonylContact C-O 3.52Å; G230-S245 VanDerWaalsContact CA-O 3.31Å; G230-S245 WeakPolarHBondContact CA-O 3.37Å
231	P	54.2	Low	62.6	Low	64 Å²	64	81.1 Å²	81.1	42%	0.416	45%	0.447	S	S	.	.			trans	-73.2	103	-171.6	30.7	-35.8	0	0	0	111.5	G233 V243 V246	P231-G233 PolarHBondContact O-N 3.26Å; P231-V243 WeakPolarHBondContact CA-O 3.35Å; P231-V246 HydrophobicContact CG-CG2 3.67Å
232	L	52.5	Low	60.9	Low	55 Å²	55	85.6 Å²	85.6	29%	0.288	48%	0.478	S	S	.	.			trans	-88.4	76.4	170.9	-85.5	164.3	0	0	0	109.9	F92 R228 G230 V243	F92-L232 HydrophobicContact CD1-CD2 3.54Å; F92-L232 HydrophobicContact CD2-CD2 3.66Å; F92-L232 HydrophobicContact CD2-CG 4.01Å; F92-L232 HydrophobicContact CE1-CD2 3.25Å; F92-L232 HydrophobicContact CE1-CG 4.46Å; F92-L232 HydrophobicContact CE2-CD1 3.98Å; F92-L232 HydrophobicContact CE2-CD2 3.36Å; F92-L232 HydrophobicContact CE2-CG 3.73Å; F92-L232 HydrophobicContact CG-CD2 3.74Å; F92-L232 HydrophobicContact CG-CG 4.48Å; F92-L232 HydrophobicContact CZ-CD1 4.16Å; F92-L232 HydrophobicContact CZ-CD2 3.16Å; F92-L232 HydrophobicContact CZ-CG 3.99Å; R228-L232 HydrophobicContact CG-CD1 4.42Å; G230-L232 PolarHBondContact O-N 2.81Å; L232-V243 HydrophobicContact CB-CG1 3.62Å; L232-V243 HydrophobicContact CD1-CG1 4.28Å; L232-V243 HydrophobicContact CG-CG1 4.39Å
233	G	47.9	Very low	59.1	Low	58 Å²	58	88 Å²	88	60%	0.598	49%	0.493	S	S	*	.			trans	74.2	134.2	165.7	0	0	0	0	0	116.3	P231 S235	P231-G233 PolarHBondContact O-N 3.26Å; G233-S235 PolarHBondContact O-N 2.94Å
234	C	46.3	Very low	57	Low	140 Å²	140	88.3 Å²	88.3	95%	0.946	50%	0.503	S	S	*	.	S	Bend	trans	-79.3	46.1	172.4	-59.6	0	0	0	0	112.3
235	S	45.1	Very low	55.4	Low	99 Å²	99	90.5 Å²	90.5	69%	0.692	52%	0.519	S	S	*	.	S	Bend	trans	-124.9	8.3	-170.2	60.6	0	0	0	0	116.7	G233	G233-S235 PolarHBondContact O-N 2.94Å
236	N	45.6	Very low	54	Low	147 Å²	147	91.5 Å²	91.5	79%	0.786	53%	0.525	S	S	*	.			trans	-161.3	123.9	154	-96.6	-19.6	0	0	0	110.9	D238	N236-D238 VanDerWaalsContact C-N 3.26Å; N236-D238 PolarHBondContact O-N 3.43Å
237	Y	50	Low	52.9	Low	194 Å²	194	90.4 Å²	90.4	76%	0.761	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	1.9	-171.7	-108.2	-91.7	0	0	0	114.6	L240	Y237-L240 HydrophobicContact CD1-CD1 3.87Å; Y237-L240 HydrophobicContact CE1-CD1 4.44Å; Y237-L240 HydrophobicContact CG-CD1 4.38Å; Y237-L240 WeakPolarHBondContact O-CD1 3.36Å
238	D	50.8	Low	52	Low	141 Å²	141	89.7 Å²	89.7	75%	0.754	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-0.3	-164.3	-69.1	-26.7	0	0	0	115.9	N236	N236-D238 VanDerWaalsContact C-N 3.26Å; N236-D238 PolarHBondContact O-N 3.43Å
239	N	49.7	Very low	51.2	Low	142 Å²	142	92.1 Å²	92.1	76%	0.759	53%	0.532	S	S	*	.			trans	-140.5	59.8	177.2	-90.1	-37.2	0	0	0	112.3	D241	N239-D241 PolarHBondContact O-N 2.95Å
240	L	48.3	Very low	51	Low	82 Å²	82	90.6 Å²	90.6	43%	0.429	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-9.1	-174.5	-105.8	98.8	0	0	0	115.8	Y237 S242 S244	Y237-L240 HydrophobicContact CD1-CD1 3.87Å; Y237-L240 HydrophobicContact CE1-CD1 4.44Å; Y237-L240 HydrophobicContact CG-CD1 4.38Å; Y237-L240 WeakPolarHBondContact O-CD1 3.36Å; L240-S242 VanDerWaalsContact C-N 3.34Å; L240-S242 PolarHBondContact O-N 3.44Å; L240-S244 WeakPolarHBondContact O-CB 3.49Å; L240-S244 PolarHBondContact O-OG 2.99Å
241	D	44.5	Very low	50.8	Low	173 Å²	173	93.7 Å²	93.7	93%	0.925	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-11.7	-167.8	-76.3	-10.2	0	0	0	115.2	N239	N239-D241 PolarHBondContact O-N 2.95Å
242	S	47	Very low	51	Low	94 Å²	94	94.3 Å²	94.3	66%	0.657	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.1	-12.3	179.5	60	0	0	0	0	115.8	L240	L240-S242 VanDerWaalsContact C-N 3.34Å; L240-S242 PolarHBondContact O-N 3.44Å
243	V	48.1	Very low	51.6	Low	51 Å²	51	92.6 Å²	92.6	31%	0.309	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-1.5	-166.2	-165.5	0	0	0	0	113.2	G230 P231 L232	G230-V243 CarbonylContact C-O 3.52Å; P231-V243 WeakPolarHBondContact CA-O 3.35Å; L232-V243 HydrophobicContact CB-CG1 3.62Å; L232-V243 HydrophobicContact CD1-CG1 4.28Å; L232-V243 HydrophobicContact CG-CG1 4.39Å
244	S	43.9	Very low	52.6	Low	71 Å²	71	97.5 Å²	97.5	50%	0.497	54%	0.537	S	S	.	.			trans	-97.4	-4.8	-169.8	55.6	0	0	0	0	115.4	L240	L240-S244 WeakPolarHBondContact O-CB 3.49Å; L240-S244 PolarHBondContact O-OG 2.99Å
245	S	53.6	Low	54	Low	56 Å²	56	93.8 Å²	93.8	39%	0.392	51%	0.51	S	S	.	.			trans	-97.6	116	-178.5	57	0	0	0	0	112.3	G230 L247	G230-S245 VanDerWaalsContact CA-O 3.31Å; G230-S245 WeakPolarHBondContact CA-O 3.37Å; S245-L247 PolarHBondContact O-N 3.47Å
246	V	56	Low	55.6	Low	67 Å²	67	94.5 Å²	94.5	41%	0.406	50%	0.502	S	S	.	.			trans	-68.3	105.8	164.1	176.5	0	0	0	0	107.3	L152 P231	L152-V246 HydrophobicContact CB-CG1 3.54Å; L152-V246 HydrophobicContact CD1-CG1 3.97Å; L152-V246 HydrophobicContact CD2-CG1 4.18Å; L152-V246 HydrophobicContact CG-CG1 4.11Å; P231-V246 HydrophobicContact CG-CG2 3.67Å
247	L	57.7	Low	57.4	Low	48 Å²	48	92 Å²	92	25%	0.251	49%	0.488	S	S	.	.	B	Isolated β-bridge	trans	-96.2	129.9	-174.1	-67.3	175.6	0	0	0	111.2	T229 S245 Q249 N253	T229-L247 HydrophobicContact CG2-CD1 4.12Å; S245-L247 PolarHBondContact O-N 3.47Å; L247-Q249 HydrophobicContact CB-CB 4.39Å; L247-Q249 PolarHBondContact O-N 2.96Å; L247-N253 PolarHBondContact O-ND2 3.47Å
248	V	57.1	Low	59	Low	47 Å²	47	85.1 Å²	85.1	29%	0.285	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-17.6	164.2	177.1	0	0	0	0	110.8	L147 A150 L152 S250 N253 V255	L147-V248 HydrophobicContact CD2-CG1 3.97Å; L147-V248 HydrophobicContact CD2-CG2 4.11Å; A150-V248 HydrophobicContact CB-CG1 3.85Å; A150-V248 HydrophobicContact CB-CG2 4.44Å; L152-V248 HydrophobicContact CD2-CB 4.32Å; L152-V248 HydrophobicContact CD2-CG2 3.31Å; V248-S250 PolarHBondContact O-N 3.33Å; V248-N253 PolarHBondContact O-ND2 2.94Å; V248-V255 HydrophobicContact CG1-CG2 4.13Å
249	Q	54	Low	60.6	Low	162 Å²	162	78.7 Å²	78.7	76%	0.757	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-3.1	-165.1	-77.5	-178.2	-25.9	0	0	116.9	L247	L247-Q249 HydrophobicContact CB-CB 4.39Å; L247-Q249 PolarHBondContact O-N 2.96Å
250	S	58.1	Low	62.4	Low	10 Å²	10	72.3 Å²	72.3	7%	0.07	40%	0.397	C	S	.	.			trans	-61.8	132.1	175.4	-48.9	0	0	0	0	109.8	V248 E252 N253	V248-S250 PolarHBondContact O-N 3.33Å; S250-E252 PolarHBondContact O-N 3.42Å; S250-E252 VanDerWaalsContact O-N 3.13Å; S250-N253 WeakPolarHBondContact CB-ND2 3.03Å; S250-N253 PolarHBondContact N-ND2 3.49Å; S250-N253 WeakPolarHBondContact O-CB 3.41Å; S250-N253 PolarHBondContact O-N 3.3Å
251	P	57.3	Low	64.2	Low	67 Å²	67	71.3 Å²	71.3	44%	0.435	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-17.7	-172.5	27.5	-37.8	0	0	0	113.8	E70 R87 N253	E70-P251 VanDerWaalsContact OE1-CB 3.23Å; E70-P251 WeakPolarHBondContact OE1-CB 3.39Å; E70-P251 VanDerWaalsContact OE1-CG 3.24Å; E70-P251 WeakPolarHBondContact OE1-CG 3.28Å; R87-P251 VanDerWaalsContact NH2-CG 3.26Å; P251-N253 VanDerWaalsContact C-N 3.33Å
252	E	58	Low	66.2	Low	77 Å²	77	65.5 Å²	65.5	36%	0.36	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-8.8	173.9	-62.7	-68	163.4	0	0	112.6	Y89 S250 K254	Y89-E252 HydrophobicContact CE2-CG 4.35Å; S250-E252 PolarHBondContact O-N 3.42Å; S250-E252 VanDerWaalsContact O-N 3.13Å; E252-K254 PolarHBondContact O-N 3.04Å
253	N	64.5	Low	67.9	Low	19 Å²	19	62.7 Å²	62.7	10%	0.102	34%	0.338	C	S	.	.	S	Bend	trans	-71.2	124.6	178.2	-73.1	-31.6	0	0	0	110.4	T151 L247 V248 S250 P251 V255	T151-N253 PolarHBondContact O-ND2 2.96Å; T151-N253 PolarHBondContact O-OD1 3.31Å; T151-N253 WeakPolarHBondContact OG1-CA 3.38Å; T151-N253 WeakPolarHBondContact OG1-CB 2.76Å; T151-N253 PolarHBondContact OG1-OD1 2.97Å; L247-N253 PolarHBondContact O-ND2 3.47Å; V248-N253 PolarHBondContact O-ND2 2.94Å; S250-N253 WeakPolarHBondContact CB-ND2 3.03Å; S250-N253 PolarHBondContact N-ND2 3.49Å; S250-N253 WeakPolarHBondContact O-CB 3.41Å; S250-N253 PolarHBondContact O-N 3.3Å; P251-N253 VanDerWaalsContact C-N 3.33Å; N253-V255 PolarHBondContact O-N 2.83Å
254	K	68.1	Low	69.7	Low	161 Å²	161	60.4 Å²	60.4	70%	0.7	32%	0.324	S	S	*	.			trans	-77.1	98.5	174.3	-69	-175.7	179.3	-179.5	0	108.3	T151 E252	T151-K254 PolarHBondContact OG1-N 3.35Å; T151-K254 VanDerWaalsContact OG1-N 3.16Å; E252-K254 PolarHBondContact O-N 3.04Å
255	V	76.3	Confident	71.7	Confident	62 Å²	62	59.2 Å²	59.2	38%	0.376	32%	0.315	S	S	.	.			trans	-89.4	122.4	175.9	-178.6	0	0	0	0	108.6	L147 V248 N253 L257	L147-V255 HydrophobicContact CD1-CB 4.41Å; L147-V255 HydrophobicContact CD1-CG1 3.22Å; V248-V255 HydrophobicContact CG1-CG2 4.13Å; N253-V255 PolarHBondContact O-N 2.83Å; V255-L257 HydrophobicContact CG1-CD1 4.42Å; V255-L257 HydrophobicContact CG1-CD2 3.53Å; V255-L257 HydrophobicContact CG1-CG 3.72Å
256	Q	79.7	Confident	73.2	Confident	114 Å²	114	64.1 Å²	64.1	53%	0.533	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	113.1	169.8	-169.6	174.5	-8.1	0	0	108.7	L148 S149	L148-Q256 HydrophobicContact CB-CG 4.41Å; L148-Q256 HydrophobicContact CD1-CG 4.44Å; L148-Q256 PolarHBondContact N-O 3.05Å; S149-Q256 PolarHBondContact N-O 3.36Å; S149-Q256 PolarHBondContact O-N 3.45Å; S149-Q256 VanDerWaalsContact OG-CB 3.24Å; S149-Q256 WeakPolarHBondContact OG-CB 3.3Å; S149-Q256 PolarHBondContact OG-OE1 3.42Å
257	L	82.2	Confident	74.6	Confident	95 Å²	95	66.6 Å²	66.6	50%	0.497	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	140.7	-179.5	-65.6	177.9	0	0	0	110.1	H145 F146 L147 V255	H145-L257 HydrophobicContact CB-CB 3.95Å; H145-L257 HydrophobicContact CB-CD1 4.29Å; H145-L257 HydrophobicContact CB-CD2 4.37Å; H145-L257 HydrophobicContact CB-CG 4.44Å; F146-L257 WeakPolarHBondContact O-CA 3.08Å; L147-L257 HydrophobicContact CD1-CD2 4.05Å; V255-L257 HydrophobicContact CG1-CD1 4.42Å; V255-L257 HydrophobicContact CG1-CD2 3.53Å; V255-L257 HydrophobicContact CG1-CG 3.72Å
258	L	83.6	Confident	76	Confident	49 Å²	49	64.5 Å²	64.5	26%	0.257	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	141.3	165.1	-167.3	67.1	0	0	0	109.5	F107 H145 F146 L148 L260 V262	F107-L258 HydrophobicContact CE1-CD2 4.32Å; F107-L258 HydrophobicContact CZ-CD2 3.85Å; H145-L258 CarbonylContact C-O 3.57Å; H145-L258 VanDerWaalsContact CA-O 3.24Å; H145-L258 WeakPolarHBondContact CA-O 3.36Å; H145-L258 WeakPolarHBondContact CB-O 3.39Å; F146-L258 HydrophobicContact CD1-CB 4.41Å; F146-L258 VanDerWaalsContact CD1-O 3.3Å; F146-L258 WeakPolarHBondContact CD1-O 3.42Å; F146-L258 HydrophobicContact CE1-CB 3.84Å; F146-L258 HydrophobicContact CE1-CD2 3.99Å; F146-L258 HydrophobicContact CE1-CG 4.11Å; F146-L258 HydrophobicContact CE2-CB 4.44Å; F146-L258 HydrophobicContact CZ-CB 3.88Å; F146-L258 HydrophobicContact CZ-CD2 3.66Å; F146-L258 HydrophobicContact CZ-CG 4.18Å; F146-L258 PolarHBondContact N-O 3.17Å; F146-L258 PolarHBondContact O-N 3.37Å; L148-L258 HydrophobicContact CD1-CB 3.58Å; L148-L258 HydrophobicContact CD1-CD1 4.35Å; L148-L258 HydrophobicContact CD1-CD2 4.21Å; L148-L258 HydrophobicContact CD1-CG 4.26Å; L148-L258 HydrophobicContact CD2-CB 4.17Å; L148-L258 HydrophobicContact CD2-CD2 4.27Å; L148-L258 HydrophobicContact CG-CB 3.64Å; L258-L260 PolarHBondContact O-N 2.95Å; L258-V262 HydrophobicContact CD1-CG2 4.45Å; L258-V262 HydrophobicContact CD2-CB 4.19Å; L258-V262 HydrophobicContact CD2-CG1 4.26Å; L258-V262 HydrophobicContact CD2-CG2 4.05Å; L258-V262 HydrophobicContact CG-CG2 4.12Å
259	G	84.6	Confident	77.5	Confident	5 Å²	5	67.3 Å²	67.3	5%	0.052	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	135.4	178.7	0	0	0	0	0	111.7	Q261 V262	G259-Q261 PolarHBondContact O-N 3.09Å; G259-Q261 VanDerWaalsContact O-N 3.1Å; G259-Q261 PolarHBondContact O-OE1 2.93Å; G259-V262 PolarHBondContact O-N 3.36Å
260	L	88.1	Confident	79.1	Confident	9 Å²	9	67.4 Å²	67.4	5%	0.047	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-62.6	-19.6	-177.5	-169.3	67.6	0	0	0	112.3	F118 T144 F146 L258 V262 L263 F272	F118-L260 HydrophobicContact CE2-CD1 4.48Å; F118-L260 HydrophobicContact CE2-CD2 4.1Å; F118-L260 HydrophobicContact CZ-CD1 4.04Å; F118-L260 HydrophobicContact CZ-CD2 4.19Å; F118-L260 HydrophobicContact CZ-CG 4.24Å; T144-L260 WeakPolarHBondContact O-CB 3.48Å; T144-L260 PolarHBondContact O-N 3.43Å; F146-L260 HydrophobicContact CD1-CD1 4.12Å; L258-L260 PolarHBondContact O-N 2.95Å; L260-V262 PolarHBondContact O-N 2.98Å; L260-V262 VanDerWaalsContact O-N 3.07Å; L260-L263 HydrophobicContact CD1-CD1 3.96Å; L260-L263 PolarHBondContact O-N 3.46Å; L260-F272 HydrophobicContact CB-CE1 4.03Å; L260-F272 HydrophobicContact CB-CZ 3.8Å; L260-F272 HydrophobicContact CD2-CE2 4.18Å; L260-F272 HydrophobicContact CD2-CZ 3.93Å; L260-F272 HydrophobicContact CG-CZ 4.3Å
261	Q	86.4	Confident	80.6	Confident	60 Å²	60	71.4 Å²	71.4	28%	0.28	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-54.8	-27.4	175.6	70.8	-81	4.9	0	0	113.4	G259 L263 L264 R269 F272 V273	G259-Q261 PolarHBondContact O-N 3.09Å; G259-Q261 VanDerWaalsContact O-N 3.1Å; G259-Q261 PolarHBondContact O-OE1 2.93Å; Q261-L263 VanDerWaalsContact C-N 3.27Å; Q261-L263 PolarHBondContact O-N 3.05Å; Q261-L264 PolarHBondContact O-N 3.41Å; Q261-R269 HydrophobicContact CB-CB 4.49Å; Q261-R269 WeakPolarHBondContact O-CG 3.43Å; Q261-R269 PolarHBondContact O-NE 2.93Å; Q261-F272 HydrophobicContact CB-CD1 3.93Å; Q261-V273 HydrophobicContact CB-CG2 4.18Å; Q261-V273 HydrophobicContact CG-CG2 4.15Å
262	V	85.2	Confident	82.1	Confident	52 Å²	52	68.3 Å²	68.3	32%	0.315	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-66.2	-33.4	-179.8	-179.6	0	0	0	0	111.3	F107 L258 G259 L260 L264 R269	F107-V262 HydrophobicContact CE1-CG1 3.93Å; F107-V262 HydrophobicContact CZ-CG1 4.36Å; L258-V262 HydrophobicContact CD1-CG2 4.45Å; L258-V262 HydrophobicContact CD2-CB 4.19Å; L258-V262 HydrophobicContact CD2-CG1 4.26Å; L258-V262 HydrophobicContact CD2-CG2 4.05Å; L258-V262 HydrophobicContact CG-CG2 4.12Å; G259-V262 PolarHBondContact O-N 3.36Å; L260-V262 PolarHBondContact O-N 2.98Å; L260-V262 VanDerWaalsContact O-N 3.07Å; V262-L264 VanDerWaalsContact C-N 3.33Å; V262-R269 PolarHBondContact O-NH2 3.18Å
263	L	83.4	Confident	83.6	Confident	34 Å²	34	67.4 Å²	67.4	18%	0.178	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-81.9	-11.5	178.5	-56.4	-175.3	0	0	0	113.1	L112 L114 F146 L260 Q261	L112-L263 HydrophobicContact CD1-CD2 4.13Å; L112-L263 HydrophobicContact CD2-CD2 3.87Å; L114-L263 HydrophobicContact CD2-CD1 4.05Å; F146-L263 HydrophobicContact CD1-CD1 3.98Å; F146-L263 HydrophobicContact CD1-CG 4.38Å; F146-L263 HydrophobicContact CE1-CD1 3.83Å; F146-L263 HydrophobicContact CE1-CD2 4.36Å; F146-L263 HydrophobicContact CE1-CG 3.81Å; F146-L263 HydrophobicContact CG-CD1 4.39Å; F146-L263 HydrophobicContact CZ-CD1 4.1Å; F146-L263 HydrophobicContact CZ-CD2 4.19Å; F146-L263 HydrophobicContact CZ-CG 4.12Å; L260-L263 HydrophobicContact CD1-CD1 3.96Å; L260-L263 PolarHBondContact O-N 3.46Å; Q261-L263 VanDerWaalsContact C-N 3.27Å; Q261-L263 PolarHBondContact O-N 3.05Å
264	L	85.6	Confident	84.7	Confident	4 Å²	4	68.5 Å²	68.5	2%	0.021	33%	0.334	C	S	.	.	S	Bend	trans	-87.1	149.4	-179.4	-62.3	179.6	0	0	0	111.7	F118 I122 L138 Q261 V262 L268 R269 F272	F118-L264 HydrophobicContact CZ-CD2 4.13Å; I122-L264 HydrophobicContact CD1-CD2 3.62Å; I122-L264 HydrophobicContact CG1-CD2 3.99Å; L138-L264 HydrophobicContact CD1-CD1 4.41Å; L138-L264 HydrophobicContact CD1-CD2 4.23Å; Q261-L264 PolarHBondContact O-N 3.41Å; V262-L264 VanDerWaalsContact C-N 3.33Å; L264-L268 HydrophobicContact CB-CB 4.42Å; L264-R269 PolarHBondContact O-NE 3.43Å; L264-F272 HydrophobicContact CD1-CB 3.56Å; L264-F272 HydrophobicContact CD1-CD1 4.08Å; L264-F272 HydrophobicContact CD1-CD2 3.39Å; L264-F272 HydrophobicContact CD1-CE2 4.06Å; L264-F272 HydrophobicContact CD1-CG 3.39Å
265	P	86.1	Confident	85.6	Confident	46 Å²	46	60.9 Å²	60.9	30%	0.299	30%	0.301	S	S	.	.			trans	-53.4	145.3	169.6	-24.6	33.3	0	0	0	112	I122 Y267 L268 R269	I122-P265 HydrophobicContact CG2-CG 4.23Å; P265-Y267 VanDerWaalsContact C-N 3.27Å; P265-Y267 HydrophobicContact CB-CD1 3.63Å; P265-Y267 HydrophobicContact CB-CE1 3.23Å; P265-Y267 HydrophobicContact CG-CE1 3.96Å; P265-Y267 PolarHBondContact O-N 3.36Å; P265-Y267 VanDerWaalsContact O-N 3.15Å; P265-L268 HydrophobicContact CG-CD1 4.48Å; P265-L268 PolarHBondContact O-N 3.44Å; P265-R269 PolarHBondContact O-N 3.49Å
266	E	84.8	Confident	86.1	Confident	158 Å²	158	58.4 Å²	58.4	74%	0.738	29%	0.287	S	S	*	.	H	α-helix	trans	-51.6	-43.4	-173.4	-168.7	171.9	-166.2	0	0	113.3	L268 R269	E266-L268 PolarHBondContact O-N 3.1Å; E266-L268 VanDerWaalsContact O-N 3.13Å; E266-R269 PolarHBondContact O-N 3.36Å; E266-R269 VanDerWaalsContact O-N 3.15Å
267	Y	85.8	Confident	86.4	Confident	119 Å²	119	57 Å²	57	47%	0.467	28%	0.282	S	S	.	.	H	α-helix	trans	-64.3	-17.3	179	71.2	-91.2	0	0	0	114.8	R127 P265	R127-Y267 WeakPolarHBondContact O-CD2 3.27Å; P265-Y267 VanDerWaalsContact C-N 3.27Å; P265-Y267 HydrophobicContact CB-CD1 3.63Å; P265-Y267 HydrophobicContact CB-CE1 3.23Å; P265-Y267 HydrophobicContact CG-CE1 3.96Å; P265-Y267 PolarHBondContact O-N 3.36Å; P265-Y267 VanDerWaalsContact O-N 3.15Å
268	L	87.6	Confident	86.5	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-98.7	-15.7	177.1	-67.5	-177.8	0	0	0	113.5	I122 P129 L264 P265 E266 E270 R271 F272	I122-L268 HydrophobicContact CG2-CD1 4.16Å; P129-L268 HydrophobicContact CG-CD2 3.45Å; P129-L268 VanDerWaalsContact CG-CD2 3.45Å; L264-L268 HydrophobicContact CB-CB 4.42Å; P265-L268 HydrophobicContact CG-CD1 4.48Å; P265-L268 PolarHBondContact O-N 3.44Å; E266-L268 PolarHBondContact O-N 3.1Å; E266-L268 VanDerWaalsContact O-N 3.13Å; L268-E270 PolarHBondContact O-N 3.29Å; L268-R271 PolarHBondContact O-N 3.41Å; L268-F272 VanDerWaalsContact O-CB 3.32Å; L268-F272 WeakPolarHBondContact O-CB 3.15Å; L268-F272 PolarHBondContact O-N 3.14Å
269	R	88.9	Confident	86.5	Confident	106 Å²	106	54.6 Å²	54.6	40%	0.4	27%	0.266	S	S	.	.	H	α-helix	trans	-60.4	-51.7	-171.6	-64	-172.8	176.7	170.8	-6.4	112.2	Q261 V262 L264 P265 E266 R271 F272 V273	Q261-R269 HydrophobicContact CB-CB 4.49Å; Q261-R269 WeakPolarHBondContact O-CG 3.43Å; Q261-R269 PolarHBondContact O-NE 2.93Å; V262-R269 PolarHBondContact O-NH2 3.18Å; L264-R269 PolarHBondContact O-NE 3.43Å; P265-R269 PolarHBondContact O-N 3.49Å; E266-R269 PolarHBondContact O-N 3.36Å; E266-R269 VanDerWaalsContact O-N 3.15Å; R269-R271 PolarHBondContact O-N 2.68Å; R269-F272 PolarHBondContact O-N 2.89Å; R269-V273 WeakPolarHBondContact O-CG2 3.37Å; R269-V273 PolarHBondContact O-N 3.07Å
270	E	88	Confident	86.3	Confident	164 Å²	164	58.1 Å²	58.1	77%	0.766	28%	0.282	S	S	*	.	H	α-helix	trans	-61.9	-43.3	180	-65.7	-174.2	165.6	0	0	112.1	L268 F272 V273 A274	L268-E270 PolarHBondContact O-N 3.29Å; E270-F272 VanDerWaalsContact C-N 3.34Å; E270-F272 PolarHBondContact O-N 2.81Å; E270-V273 PolarHBondContact O-N 3.03Å; E270-A274 WeakPolarHBondContact O-CB 3.35Å; E270-A274 PolarHBondContact O-N 2.04Å
271	R	87.9	Confident	85.8	Confident	95 Å²	95	59.8 Å²	59.8	36%	0.358	29%	0.293	S	S	.	.	H	α-helix	trans	-65.2	-38.3	177.7	-69.2	-171.9	179.7	-142.4	-4	112	R128 P129 L268 R269 A274 A275	R128-R271 PolarHBondContact O-NH1 3.24Å; P129-R271 PolarHBondContact O-NH1 2.95Å; L268-R271 PolarHBondContact O-N 3.41Å; R269-R271 PolarHBondContact O-N 2.68Å; R271-A274 PolarHBondContact O-N 2.94Å; R271-A275 VanDerWaalsContact O-CB 3.26Å; R271-A275 WeakPolarHBondContact O-CB 3.39Å; R271-A275 PolarHBondContact O-N 2.92Å
272	F	90.1	Very high	85.4	Confident	2 Å²	2	57 Å²	57	1%	0.009	28%	0.28	C	S	.	.	H	α-helix	trans	-64.8	-44.6	175.1	-178.2	-91.1	0	0	0	111.4	V134 L138 I139 L260 Q261 L264 L268 R269 E270 A275 A276	V134-F272 HydrophobicContact CG1-CB 4.4Å; V134-F272 HydrophobicContact CG1-CD2 3.76Å; V134-F272 HydrophobicContact CG1-CG 4.5Å; L138-F272 HydrophobicContact CB-CE2 4.14Å; L138-F272 HydrophobicContact CD1-CD2 4.36Å; I139-F272 HydrophobicContact CD1-CD2 4.5Å; I139-F272 HydrophobicContact CD1-CE2 4.28Å; I139-F272 HydrophobicContact CG1-CD2 4.18Å; I139-F272 HydrophobicContact CG1-CE2 3.56Å; I139-F272 HydrophobicContact CG1-CZ 4.01Å; L260-F272 HydrophobicContact CB-CE1 4.03Å; L260-F272 HydrophobicContact CB-CZ 3.8Å; L260-F272 HydrophobicContact CD2-CE2 4.18Å; L260-F272 HydrophobicContact CD2-CZ 3.93Å; L260-F272 HydrophobicContact CG-CZ 4.3Å; Q261-F272 HydrophobicContact CB-CD1 3.93Å; L264-F272 HydrophobicContact CD1-CB 3.56Å; L264-F272 HydrophobicContact CD1-CD1 4.08Å; L264-F272 HydrophobicContact CD1-CD2 3.39Å; L264-F272 HydrophobicContact CD1-CE2 4.06Å; L264-F272 HydrophobicContact CD1-CG 3.39Å; L268-F272 VanDerWaalsContact O-CB 3.32Å; L268-F272 WeakPolarHBondContact O-CB 3.15Å; L268-F272 PolarHBondContact O-N 3.14Å; R269-F272 PolarHBondContact O-N 2.89Å; E270-F272 VanDerWaalsContact C-N 3.34Å; E270-F272 PolarHBondContact O-N 2.81Å; F272-A275 PolarHBondContact O-N 2.8Å; F272-A276 HydrophobicContact CE1-CB 4.45Å; F272-A276 WeakPolarHBondContact O-CB 2.97Å; F272-A276 PolarHBondContact O-N 3.46Å
273	V	88.7	Confident	85	Confident	58 Å²	58	56.1 Å²	56.1	35%	0.352	28%	0.276	S	S	.	.	H	α-helix	trans	-62.3	-45.1	176.5	174	0	0	0	0	110.7	Q261 R269 E270 A275 A276 L277	Q261-V273 HydrophobicContact CB-CG2 4.18Å; Q261-V273 HydrophobicContact CG-CG2 4.15Å; R269-V273 WeakPolarHBondContact O-CG2 3.37Å; R269-V273 PolarHBondContact O-N 3.07Å; E270-V273 PolarHBondContact O-N 3.03Å; V273-A275 PolarHBondContact O-N 2.83Å; V273-A276 PolarHBondContact O-N 3.46Å; V273-L277 HydrophobicContact CG1-CD1 4.03Å; V273-L277 HydrophobicContact CG1-CG 4.38Å; V273-L277 WeakPolarHBondContact O-CB 3.28Å; V273-L277 WeakPolarHBondContact O-CG 2.97Å; V273-L277 PolarHBondContact O-N 3.04Å
274	A	87.2	Confident	84.6	Confident	42 Å²	42	57.4 Å²	57.4	35%	0.347	29%	0.288	S	S	.	.	H	α-helix	trans	-61.8	-42.3	176.5	0	0	0	0	0	112.6	L131 E270 R271 S278	L131-A274 HydrophobicContact CD2-CB 4.15Å; E270-A274 WeakPolarHBondContact O-CB 3.35Å; E270-A274 PolarHBondContact O-N 2.04Å; R271-A274 PolarHBondContact O-N 2.94Å; A274-S278 WeakPolarHBondContact O-CB 3.43Å; A274-S278 PolarHBondContact O-N 2.92Å; A274-S278 PolarHBondContact O-OG 3.31Å
275	A	87.7	Confident	84.3	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-66.3	-40.3	175.4	0	0	0	0	0	111.9	L131 V134 I139 R271 F272 V273 S278 Y279	L131-A275 HydrophobicContact CB-CB 4.47Å; L131-A275 HydrophobicContact CD2-CB 4.08Å; V134-A275 HydrophobicContact CB-CB 4.11Å; V134-A275 HydrophobicContact CG1-CB 3.9Å; I139-A275 HydrophobicContact CD1-CB 3.72Å; R271-A275 VanDerWaalsContact O-CB 3.26Å; R271-A275 WeakPolarHBondContact O-CB 3.39Å; R271-A275 PolarHBondContact O-N 2.92Å; F272-A275 PolarHBondContact O-N 2.8Å; V273-A275 PolarHBondContact O-N 2.83Å; A275-S278 PolarHBondContact O-N 2.9Å; A275-Y279 VanDerWaalsContact O-CB 3.27Å; A275-Y279 WeakPolarHBondContact O-CB 3.31Å; A275-Y279 PolarHBondContact O-N 2.85Å
276	A	87.3	Confident	84.1	Confident	10 Å²	10	59 Å²	59	8%	0.083	30%	0.295	C	S	.	.	H	α-helix	trans	-66.5	-44.3	178.2	0	0	0	0	0	112.2	I139 T144 F272 V273 Y279 I280	I139-A276 HydrophobicContact CD1-CB 4Å; T144-A276 HydrophobicContact CG2-CB 3.92Å; F272-A276 HydrophobicContact CE1-CB 4.45Å; F272-A276 WeakPolarHBondContact O-CB 2.97Å; F272-A276 PolarHBondContact O-N 3.46Å; V273-A276 PolarHBondContact O-N 3.46Å; A276-Y279 PolarHBondContact O-N 2.93Å; A276-I280 VanDerWaalsContact O-CG1 3.25Å; A276-I280 WeakPolarHBondContact O-CG1 3.35Å; A276-I280 PolarHBondContact O-N 2.82Å
277	L	85.1	Confident	84.1	Confident	84 Å²	84	55.1 Å²	55.1	44%	0.44	28%	0.277	S	S	.	.	H	α-helix	trans	-62.6	-45.9	174.4	-69.6	174.5	0	0	0	110.7	V273 Y279 I280 T281 L288	V273-L277 HydrophobicContact CG1-CD1 4.03Å; V273-L277 HydrophobicContact CG1-CG 4.38Å; V273-L277 WeakPolarHBondContact O-CB 3.28Å; V273-L277 WeakPolarHBondContact O-CG 2.97Å; V273-L277 PolarHBondContact O-N 3.04Å; L277-Y279 VanDerWaalsContact C-N 3.32Å; L277-Y279 PolarHBondContact O-N 2.89Å; L277-I280 PolarHBondContact O-N 3.34Å; L277-T281 PolarHBondContact O-N 2.92Å; L277-T281 PolarHBondContact O-OG1 3.05Å; L277-L288 HydrophobicContact CB-CD2 3.85Å
278	S	84.7	Confident	84.1	Confident	10 Å²	10	51.5 Å²	51.5	7%	0.07	27%	0.266	C	S	.	.	H	α-helix	trans	-60.2	-40.6	175.6	-57.5	0	0	0	0	112.3	A274 A275 C282 L288	A274-S278 WeakPolarHBondContact O-CB 3.43Å; A274-S278 PolarHBondContact O-N 2.92Å; A274-S278 PolarHBondContact O-OG 3.31Å; A275-S278 PolarHBondContact O-N 2.9Å; S278-C282 WeakPolarHBondContact O-CA 3.21Å; S278-C282 WeakPolarHBondContact O-CB 3.46Å; S278-C282 PolarHBondContact O-N 3.42Å; S278-L288 PolarHBondContact OG-N 3.16Å
279	Y	83.9	Confident	84.1	Confident	85 Å²	85	53.4 Å²	53.4	33%	0.333	28%	0.277	S	S	.	.	H	α-helix	trans	-62.8	-45.6	176.7	177.1	-103.7	0	0	0	112.1	T135 I139 K140 A275 A276 L277 S283	T135-Y279 HydrophobicContact CG2-CD2 3.58Å; T135-Y279 HydrophobicContact CG2-CE2 4.32Å; T135-Y279 HydrophobicContact CG2-CG 4.23Å; I139-Y279 HydrophobicContact CG2-CD1 3.58Å; I139-Y279 HydrophobicContact CG2-CD2 4.45Å; I139-Y279 HydrophobicContact CG2-CE1 3.95Å; I139-Y279 HydrophobicContact CG2-CG 3.87Å; K140-Y279 HydrophobicContact CG-CE2 4.01Å; A275-Y279 VanDerWaalsContact O-CB 3.27Å; A275-Y279 WeakPolarHBondContact O-CB 3.31Å; A275-Y279 PolarHBondContact O-N 2.85Å; A276-Y279 PolarHBondContact O-N 2.93Å; L277-Y279 VanDerWaalsContact C-N 3.32Å; L277-Y279 PolarHBondContact O-N 2.89Å; Y279-S283 WeakPolarHBondContact O-CA 3.5Å; Y279-S283 PolarHBondContact O-N 2.81Å
280	I	79.1	Confident	83.8	Confident	79 Å²	79	51.9 Å²	51.9	41%	0.405	28%	0.282	S	S	.	.	H	α-helix	trans	-71.2	-49.5	-178.2	-65.5	165	0	0	0	111.2	T144 A276 L277	T144-I280 HydrophobicContact CG2-CD1 4.29Å; A276-I280 VanDerWaalsContact O-CG1 3.25Å; A276-I280 WeakPolarHBondContact O-CG1 3.35Å; A276-I280 PolarHBondContact O-N 2.82Å; L277-I280 PolarHBondContact O-N 3.34Å
281	T	77.7	Confident	83.7	Confident	43 Å²	43	50.4 Å²	50.4	26%	0.264	27%	0.273	S	S	.	.	H	α-helix	trans	-84.9	-29.2	-171.6	60.9	0	0	0	0	113.8	L277 L288	L277-T281 PolarHBondContact O-N 2.92Å; L277-T281 PolarHBondContact O-OG1 3.05Å; T281-L288 HydrophobicContact CG2-CD2 4.31Å
282	C	79.5	Confident	83.1	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.02	30%	0.3	C	S	.	.	H	α-helix	trans	-111	8.3	-175.3	-49.2	0	0	0	0	113.1	S278 S284 E285 C297	S278-C282 WeakPolarHBondContact O-CA 3.21Å; S278-C282 WeakPolarHBondContact O-CB 3.46Å; S278-C282 PolarHBondContact O-N 3.42Å; C282-S284 PolarHBondContact O-N 2.81Å; C282-E285 PolarHBondContact O-N 2.84Å; C282-C297 WeakPolarHBondContact CA-SG 3.19Å; C282-C297 HydrophobicContact CB-CB 3.67Å; C282-C297 WeakPolarHBondContact CB-SG 3.5Å; C282-C297 WeakPolarHBondContact SG-CB 3.48Å; C282-C297 CovalentContact SG-SG 2.02Å; C282-C297 PolarHBondContact SG-SG 3.45Å
283	S	77.1	Confident	82.5	Confident	33 Å²	33	63.6 Å²	63.6	23%	0.231	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	30.9	178.9	-65.7	0	0	0	0	114.7	R67 Y279 E285	R67-S283 PolarHBondContact NH2-OG 3.05Å; Y279-S283 WeakPolarHBondContact O-CA 3.5Å; Y279-S283 PolarHBondContact O-N 2.81Å; S283-E285 PolarHBondContact O-N 3Å
284	S	73.4	Confident	82	Confident	61 Å²	61	63.1 Å²	63.1	43%	0.427	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	10.6	-173.2	70.5	0	0	0	0	117	C282	C282-S284 PolarHBondContact O-N 2.81Å
285	E	78.9	Confident	81.8	Confident	68 Å²	68	64.6 Å²	64.6	32%	0.318	35%	0.347	S	S	.	.	S	Bend	trans	-92.6	-3.1	179.6	-64	173.3	-175.2	0	0	113.3	C282 S283 S300 F303 C306	C282-E285 PolarHBondContact O-N 2.84Å; S283-E285 PolarHBondContact O-N 3Å; E285-S300 WeakPolarHBondContact O-CB 3.46Å; E285-S300 PolarHBondContact O-N 3.04Å; E285-F303 HydrophobicContact CB-CB 4.17Å; E285-F303 HydrophobicContact CB-CD2 4.39Å; E285-F303 HydrophobicContact CB-CG 4.4Å; E285-F303 HydrophobicContact CG-CB 4.45Å; E285-F303 HydrophobicContact CG-CD2 4.21Å; E285-F303 HydrophobicContact CG-CG 4.22Å; E285-C306 HydrophobicContact CB-CB 3.83Å
286	G	82.4	Confident	81.6	Confident	15 Å²	15	67.4 Å²	67.4	16%	0.155	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.9	179.7	-179.3	0	0	0	0	0	113.7	K298	G286-K298 WeakPolarHBondContact CA-O 3.31Å
287	E	85.9	Confident	81.5	Confident	76 Å²	76	67 Å²	67	36%	0.355	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	133.3	-179.9	-64.5	178	165.2	0	0	110.9	L131 V289 C297 K298	L131-E287 HydrophobicContact CD1-CG 4.28Å; E287-V289 PolarHBondContact O-N 3Å; E287-C297 CarbonylContact O-C 3.55Å; E287-C297 WeakPolarHBondContact O-CA 3.34Å; E287-K298 PolarHBondContact N-O 2.93Å; E287-K298 PolarHBondContact O-N 3.3Å
288	L	85.9	Confident	81.6	Confident	43 Å²	43	69.4 Å²	69.4	23%	0.225	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	126.6	177.7	-175.8	66.5	0	0	0	111	L277 S278 T281 C295	L277-L288 HydrophobicContact CB-CD2 3.85Å; S278-L288 PolarHBondContact OG-N 3.16Å; T281-L288 HydrophobicContact CG2-CD2 4.31Å; L288-C295 HydrophobicContact CD1-CB 4.12Å
289	V	86.3	Confident	81.7	Confident	44 Å²	44	70.6 Å²	70.6	27%	0.267	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	123.2	175.6	-177.7	0	0	0	0	109	E287 K291 C295 W296 K298	E287-V289 PolarHBondContact O-N 3Å; V289-K291 HydrophobicContact CG1-CG 4.35Å; V289-C295 WeakPolarHBondContact O-CA 3.14Å; V289-W296 HydrophobicContact CG1-CZ2 4.27Å; V289-W296 PolarHBondContact N-O 3.46Å; V289-W296 PolarHBondContact O-N 2.91Å; V289-K298 HydrophobicContact CG2-CB 4.25Å
290	C	83.8	Confident	81.6	Confident	75 Å²	75	68.3 Å²	68.3	51%	0.507	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	125.9	175.2	-63.7	0	0	0	0	110.3	D294 C295	C290-D294 WeakPolarHBondContact CA-O 3.47Å; C290-C295 HydrophobicContact CB-CB 4.12Å; C290-C295 WeakPolarHBondContact CB-SG 3.19Å; C290-C295 WeakPolarHBondContact SG-CB 3.48Å; C290-C295 CovalentContact SG-SG 2.04Å; C290-C295 PolarHBondContact SG-SG 2.76Å
291	K	84.5	Confident	81.7	Confident	133 Å²	133	70.6 Å²	70.6	58%	0.578	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.4	132.9	170.6	-63.7	-169.2	-179.6	-176.4	0	109.5	V289 N293 D294 W296	V289-K291 HydrophobicContact CG1-CG 4.35Å; K291-N293 VanDerWaalsContact C-N 3.33Å; K291-N293 PolarHBondContact O-N 2.94Å; K291-D294 PolarHBondContact N-O 2.85Å; K291-D294 PolarHBondContact O-N 3.32Å; K291-D294 VanDerWaalsContact O-O 3.11Å; K291-W296 HydrophobicContact CB-CH2 3.87Å; K291-W296 HydrophobicContact CB-CZ3 4.07Å; K291-W296 HydrophobicContact CD-CH2 4.01Å; K291-W296 HydrophobicContact CG-CH2 3.91Å; K291-W296 HydrophobicContact CG-CZ3 4.48Å
292	E	75.2	Confident	81.9	Confident	196 Å²	196	73.2 Å²	73.2	92%	0.916	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	48.9	172.5	-60.9	174.7	-172.5	0	0	113.4	D294	E292-D294 PolarHBondContact O-N 3.36Å; E292-D294 VanDerWaalsContact O-N 3.16Å
293	N	77.4	Confident	81.9	Confident	177 Å²	177	78.3 Å²	78.3	95%	0.947	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	8.5	-176.7	-62.9	-16.8	0	0	0	116.4	K291	K291-N293 VanDerWaalsContact C-N 3.33Å; K291-N293 PolarHBondContact O-N 2.94Å
294	D	78.6	Confident	81.9	Confident	48 Å²	48	80.1 Å²	80.1	26%	0.257	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	118.4	170	-163.1	11.3	0	0	0	108.8	C290 K291 E292 W296 K398 R399	C290-D294 WeakPolarHBondContact CA-O 3.47Å; K291-D294 PolarHBondContact N-O 2.85Å; K291-D294 PolarHBondContact O-N 3.32Å; K291-D294 VanDerWaalsContact O-O 3.11Å; E292-D294 PolarHBondContact O-N 3.36Å; E292-D294 VanDerWaalsContact O-N 3.16Å; D294-W296 HydrophobicContact CB-CE3 4.34Å; D294-W296 HydrophobicContact CB-CZ3 4.22Å; D294-W296 VanDerWaalsContact O-CE3 3.3Å; D294-W296 WeakPolarHBondContact O-CZ3 3.24Å; D294-K398 IonicContact OD2-NZ 2.87Å; D294-K398 PolarHBondContact OD2-NZ 3.48Å; D294-R399 IonicContact OD2-CZ 2.93Å; D294-R399 IonicContact OD2-NE 2.85Å; D294-R399 IonicContact OD2-NH2 2.67Å; D294-R399 PolarHBondContact OD2-NH2 3.1Å
295	C	82.8	Confident	82	Confident	73 Å²	73	81.9 Å²	81.9	49%	0.493	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.2	177.7	-66.4	0	0	0	0	109.9	L288 V289 C290	L288-C295 HydrophobicContact CD1-CB 4.12Å; V289-C295 WeakPolarHBondContact O-CA 3.14Å; C290-C295 HydrophobicContact CB-CB 4.12Å; C290-C295 WeakPolarHBondContact CB-SG 3.19Å; C290-C295 WeakPolarHBondContact SG-CB 3.48Å; C290-C295 CovalentContact SG-SG 2.04Å; C290-C295 PolarHBondContact SG-SG 2.76Å
296	W	83.9	Confident	82	Confident	59 Å²	59	78.8 Å²	78.8	22%	0.223	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	163.2	178.6	68.2	91.6	0	0	0	111.7	V289 K291 D294 R399	V289-W296 HydrophobicContact CG1-CZ2 4.27Å; V289-W296 PolarHBondContact N-O 3.46Å; V289-W296 PolarHBondContact O-N 2.91Å; K291-W296 HydrophobicContact CB-CH2 3.87Å; K291-W296 HydrophobicContact CB-CZ3 4.07Å; K291-W296 HydrophobicContact CD-CH2 4.01Å; K291-W296 HydrophobicContact CG-CH2 3.91Å; K291-W296 HydrophobicContact CG-CZ3 4.48Å; D294-W296 HydrophobicContact CB-CE3 4.34Å; D294-W296 HydrophobicContact CB-CZ3 4.22Å; D294-W296 VanDerWaalsContact O-CE3 3.3Å; D294-W296 WeakPolarHBondContact O-CZ3 3.24Å; W296-R399 HydrophobicContact CB-CG 4.43Å
297	C	85.9	Confident	81.8	Confident	3 Å²	3	79.2 Å²	79.2	2%	0.02	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	128.9	178.4	-55.1	0	0	0	0	110.4	C282 E287 C299 N307	C282-C297 WeakPolarHBondContact CA-SG 3.19Å; C282-C297 HydrophobicContact CB-CB 3.67Å; C282-C297 WeakPolarHBondContact CB-SG 3.5Å; C282-C297 WeakPolarHBondContact SG-CB 3.48Å; C282-C297 CovalentContact SG-SG 2.02Å; C282-C297 PolarHBondContact SG-SG 3.45Å; E287-C297 CarbonylContact O-C 3.55Å; E287-C297 WeakPolarHBondContact O-CA 3.34Å; C297-C299 PolarHBondContact O-N 2.97Å; C297-N307 WeakPolarHBondContact CA-OD1 3.5Å; C297-N307 WeakPolarHBondContact CB-OD1 3.38Å; C297-N307 PolarHBondContact N-OD1 2.83Å; C297-N307 PolarHBondContact O-ND2 3.49Å; C297-N307 PolarHBondContact O-OD1 3.36Å
298	K	86.9	Confident	81.6	Confident	134 Å²	134	76.1 Å²	76.1	58%	0.583	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	101.8	163.6	-175.4	-174.6	174.9	-167.4	0	107.6	G286 E287 V289	G286-K298 WeakPolarHBondContact CA-O 3.31Å; E287-K298 PolarHBondContact N-O 2.93Å; E287-K298 PolarHBondContact O-N 3.3Å; V289-K298 HydrophobicContact CG2-CB 4.25Å
299	C	85.7	Confident	81.2	Confident	35 Å²	35	74.7 Å²	74.7	24%	0.236	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	141.9	-175.4	-59.2	0	0	0	0	113.1	C297 F303 C306	C297-C299 PolarHBondContact O-N 2.97Å; C299-F303 VanDerWaalsContact CB-O 3.29Å; C299-F303 WeakPolarHBondContact CB-O 3.23Å; C299-C306 WeakPolarHBondContact CA-SG 3.27Å; C299-C306 HydrophobicContact CB-CB 3.78Å; C299-C306 WeakPolarHBondContact CB-SG 3.46Å; C299-C306 VanDerWaalsContact SG-CA 3.59Å; C299-C306 WeakPolarHBondContact SG-CB 3.5Å; C299-C306 PolarHBondContact SG-N 3.1Å; C299-C306 VanDerWaalsContact SG-N 3.45Å; C299-C306 CovalentContact SG-SG 2.02Å; C299-C306 PolarHBondContact SG-SG 2.72Å
300	S	82.5	Confident	80.8	Confident	37 Å²	37	75.2 Å²	75.2	26%	0.259	40%	0.402	S	S	.	.			trans	-61.4	147.2	165.6	178	0	0	0	0	110.2	E285 T302 F303	E285-S300 WeakPolarHBondContact O-CB 3.46Å; E285-S300 PolarHBondContact O-N 3.04Å; S300-T302 PolarHBondContact O-N 3.16Å; S300-T302 VanDerWaalsContact O-N 3.13Å; S300-T302 PolarHBondContact OG-N 2.93Å; S300-T302 PolarHBondContact OG-OG1 2.91Å; S300-F303 CarbonylContact O-C 3.5Å; S300-F303 VanDerWaalsContact O-C 3.26Å; S300-F303 PolarHBondContact O-N 3.17Å
301	P	81.3	Confident	80.5	Confident	127 Å²	127	73.9 Å²	73.9	83%	0.825	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-23.3	172.9	24.4	-35.3	0	0	0	113.4	F303	P301-F303 VanDerWaalsContact C-N 3.34Å
302	T	82.4	Confident	80.2	Confident	98 Å²	98	69 Å²	69	60%	0.601	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-23.7	175.5	55.5	0	0	0	0	113.4	S300	S300-T302 PolarHBondContact O-N 3.16Å; S300-T302 VanDerWaalsContact O-N 3.13Å; S300-T302 PolarHBondContact OG-N 2.93Å; S300-T302 PolarHBondContact OG-OG1 2.91Å
303	F	78.7	Confident	80.5	Confident	109 Å²	109	59.7 Å²	59.7	48%	0.478	33%	0.334	S	S	.	.			trans	-134.4	68.8	-177.4	-64	-75.4	0	0	0	110.1	E285 C299 S300 P301 E305 C306	E285-F303 HydrophobicContact CB-CB 4.17Å; E285-F303 HydrophobicContact CB-CD2 4.39Å; E285-F303 HydrophobicContact CB-CG 4.4Å; E285-F303 HydrophobicContact CG-CB 4.45Å; E285-F303 HydrophobicContact CG-CD2 4.21Å; E285-F303 HydrophobicContact CG-CG 4.22Å; C299-F303 VanDerWaalsContact CB-O 3.29Å; C299-F303 WeakPolarHBondContact CB-O 3.23Å; S300-F303 CarbonylContact O-C 3.5Å; S300-F303 VanDerWaalsContact O-C 3.26Å; S300-F303 PolarHBondContact O-N 3.17Å; P301-F303 VanDerWaalsContact C-N 3.34Å; F303-E305 PolarHBondContact O-N 3.2Å; F303-E305 VanDerWaalsContact O-N 3.08Å; F303-C306 WeakPolarHBondContact O-CB 3.17Å; F303-C306 PolarHBondContact O-N 3.27Å; F303-C306 VanDerWaalsContact O-N 3.11Å
304	P	78.3	Confident	80.8	Confident	72 Å²	72	56.1 Å²	56.1	47%	0.468	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-16.1	-175.9	27.4	-35.5	0	0	0	113.8	H401	P304-H401 PolarHBondContact O-ND1 3.31Å
305	E	75.4	Confident	81	Confident	97 Å²	97	56.4 Å²	56.4	45%	0.453	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	13.7	179.2	-62.2	-173.5	158.2	0	0	112.9	F303 N307 C308	F303-E305 PolarHBondContact O-N 3.2Å; F303-E305 VanDerWaalsContact O-N 3.08Å; E305-N307 PolarHBondContact O-N 2.68Å; E305-C308 HydrophobicContact CB-CB 4.23Å; E305-C308 VanDerWaalsContact O-CB 3.29Å; E305-C308 WeakPolarHBondContact O-CB 3.37Å; E305-C308 PolarHBondContact O-N 3.31Å
306	C	77.8	Confident	81.1	Confident	4 Å²	4	54.1 Å²	54.1	3%	0.027	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-13.2	-178.6	89.2	0	0	0	0	115.1	R62 E285 C299 F303	R62-C306 PolarHBondContact NH1-O 3.37Å; R62-C306 PolarHBondContact NH2-O 3.01Å; E285-C306 HydrophobicContact CB-CB 3.83Å; C299-C306 WeakPolarHBondContact CA-SG 3.27Å; C299-C306 HydrophobicContact CB-CB 3.78Å; C299-C306 WeakPolarHBondContact CB-SG 3.46Å; C299-C306 VanDerWaalsContact SG-CA 3.59Å; C299-C306 WeakPolarHBondContact SG-CB 3.5Å; C299-C306 PolarHBondContact SG-N 3.1Å; C299-C306 VanDerWaalsContact SG-N 3.45Å; C299-C306 CovalentContact SG-SG 2.02Å; C299-C306 PolarHBondContact SG-SG 2.72Å; F303-C306 WeakPolarHBondContact O-CB 3.17Å; F303-C306 PolarHBondContact O-N 3.27Å; F303-C306 VanDerWaalsContact O-N 3.11Å
307	N	79.2	Confident	81.2	Confident	24 Å²	24	52.9 Å²	52.9	13%	0.128	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-6.8	175.2	-75.6	-43.9	0	0	0	114.1	R62 C297 E305 P309 R399	R62-N307 PolarHBondContact NH2-O 3.09Å; C297-N307 WeakPolarHBondContact CA-OD1 3.5Å; C297-N307 WeakPolarHBondContact CB-OD1 3.38Å; C297-N307 PolarHBondContact N-OD1 2.83Å; C297-N307 PolarHBondContact O-ND2 3.49Å; C297-N307 PolarHBondContact O-OD1 3.36Å; E305-N307 PolarHBondContact O-N 2.68Å; N307-P309 WeakPolarHBondContact O-CD 3.26Å; N307-R399 HydrophobicContact CB-CB 4.16Å
308	C	81.1	Confident	81.2	Confident	11 Å²	11	57 Å²	57	7%	0.074	32%	0.321	C	S	.	.			trans	-91.5	117.7	-175.8	-55	0	0	0	0	110.1	E305 D310 C400	E305-C308 HydrophobicContact CB-CB 4.23Å; E305-C308 VanDerWaalsContact O-CB 3.29Å; E305-C308 WeakPolarHBondContact O-CB 3.37Å; E305-C308 PolarHBondContact O-N 3.31Å; C308-D310 PolarHBondContact O-N 3.44Å; C308-C400 HydrophobicContact CB-CB 4.05Å; C308-C400 WeakPolarHBondContact CB-SG 3.37Å; C308-C400 WeakPolarHBondContact SG-CA 3.44Å; C308-C400 WeakPolarHBondContact SG-CB 3.5Å; C308-C400 CovalentContact SG-SG 2.02Å; C308-C400 PolarHBondContact SG-SG 3.2Å
309	P	77.8	Confident	81.2	Confident	12 Å²	12	52 Å²	52	8%	0.078	30%	0.303	C	S	.	.			trans	-85.5	88.3	169	33.3	-31.5	0	0	0	109.2	D61 N307 A311 D312 I313 L396	D61-P309 HydrophobicContact CB-CB 3.87Å; D61-P309 WeakPolarHBondContact OD2-CA 3.49Å; D61-P309 VanDerWaalsContact OD2-CB 3.3Å; D61-P309 WeakPolarHBondContact OD2-CB 3.18Å; N307-P309 WeakPolarHBondContact O-CD 3.26Å; P309-A311 VanDerWaalsContact C-N 3.35Å; P309-A311 PolarHBondContact O-N 3.32Å; P309-D312 HydrophobicContact CB-CB 4.07Å; P309-D312 HydrophobicContact CG-CB 4.35Å; P309-D312 PolarHBondContact O-N 3.02Å; P309-I313 HydrophobicContact CG-CD1 4.48Å; P309-I313 HydrophobicContact CG-CG1 4.48Å; P309-I313 WeakPolarHBondContact O-CB 3.25Å; P309-I313 VanDerWaalsContact O-CG1 3.22Å; P309-I313 WeakPolarHBondContact O-CG1 3.27Å; P309-I313 PolarHBondContact O-N 3.44Å; P309-L396 HydrophobicContact CG-CB 4.3Å; P309-L396 HydrophobicContact CG-CD2 3.89Å
310	D	77.4	Confident	81.3	Confident	55 Å²	55	51.3 Å²	51.3	29%	0.294	30%	0.297	S	S	.	.	H	α-helix	trans	-64.3	-35.9	-171.5	-77.2	-56.1	0	0	0	113.7	C308 I313 Q314 R402	C308-D310 PolarHBondContact O-N 3.44Å; D310-I313 PolarHBondContact O-N 3.31Å; D310-Q314 WeakPolarHBondContact O-CB 2.97Å; D310-Q314 VanDerWaalsContact O-CG 3.25Å; D310-Q314 WeakPolarHBondContact O-CG 3.44Å; D310-Q314 PolarHBondContact O-N 3.11Å; D310-R402 IonicContact OD1-NH1 3.8Å; D310-R402 PolarHBondContact OD1-NH1 3.35Å
311	A	77.1	Confident	81.6	Confident	47 Å²	47	54 Å²	54	39%	0.388	31%	0.308	S	S	.	.	H	α-helix	trans	-69.2	-43.4	179.6	0	0	0	0	0	110.9	P309 Q314 A315	P309-A311 VanDerWaalsContact C-N 3.35Å; P309-A311 PolarHBondContact O-N 3.32Å; A311-Q314 PolarHBondContact O-N 3.26Å; A311-A315 VanDerWaalsContact O-CB 3.31Å; A311-A315 WeakPolarHBondContact O-CB 3.26Å; A311-A315 PolarHBondContact O-N 3.37Å
312	D	78.3	Confident	81.9	Confident	32 Å²	32	54 Å²	54	17%	0.171	30%	0.297	C	S	.	.	H	α-helix	trans	-64.1	-40	173.7	-75.5	-37.9	0	0	0	112.2	D61 P309 A315 M316 L396	D61-D312 VanDerWaalsContact CG-OD2 3.32Å; D61-D312 PolarHBondContact N-OD2 2.74Å; D61-D312 VanDerWaalsContact N-OD2 3.16Å; D61-D312 PolarHBondContact OD2-N 2.92Å; P309-D312 HydrophobicContact CB-CB 4.07Å; P309-D312 HydrophobicContact CG-CB 4.35Å; P309-D312 PolarHBondContact O-N 3.02Å; D312-A315 PolarHBondContact O-N 3.13Å; D312-M316 VanDerWaalsContact O-CG 3.27Å; D312-M316 WeakPolarHBondContact O-CG 3.42Å; D312-M316 PolarHBondContact O-N 2.77Å; D312-L396 HydrophobicContact CB-CD1 4.19Å
313	I	82.3	Confident	82.3	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.6	-48.9	176.4	-72.2	167	0	0	0	110.3	P309 D310 A315 M316 E317 L393 L396	P309-I313 HydrophobicContact CG-CD1 4.48Å; P309-I313 HydrophobicContact CG-CG1 4.48Å; P309-I313 WeakPolarHBondContact O-CB 3.25Å; P309-I313 VanDerWaalsContact O-CG1 3.22Å; P309-I313 WeakPolarHBondContact O-CG1 3.27Å; P309-I313 PolarHBondContact O-N 3.44Å; D310-I313 PolarHBondContact O-N 3.31Å; I313-A315 PolarHBondContact O-N 2.7Å; I313-M316 PolarHBondContact O-N 2.9Å; I313-E317 HydrophobicContact CG2-CG 4.48Å; I313-E317 WeakPolarHBondContact O-CG 3.35Å; I313-E317 PolarHBondContact O-N 3.41Å; I313-L393 HydrophobicContact CB-CD1 4.49Å; I313-L393 HydrophobicContact CG1-CD1 4.42Å; I313-L393 HydrophobicContact CG2-CD1 4.06Å; I313-L396 HydrophobicContact CG1-CB 4.34Å
314	Q	83.6	Confident	82.8	Confident	101 Å²	101	48.4 Å²	48.4	47%	0.472	27%	0.265	S	S	.	.	H	α-helix	trans	-60.7	-44.1	177.3	-76.3	175	-4.5	0	0	111.4	D310 A311 M316 E317 D318	D310-Q314 WeakPolarHBondContact O-CB 2.97Å; D310-Q314 VanDerWaalsContact O-CG 3.25Å; D310-Q314 WeakPolarHBondContact O-CG 3.44Å; D310-Q314 PolarHBondContact O-N 3.11Å; A311-Q314 PolarHBondContact O-N 3.26Å; Q314-M316 VanDerWaalsContact C-N 3.27Å; Q314-M316 PolarHBondContact O-N 3.41Å; Q314-E317 PolarHBondContact O-N 2.72Å; Q314-E317 VanDerWaalsContact O-N 3.13Å; Q314-D318 WeakPolarHBondContact O-CB 3.26Å; Q314-D318 VanDerWaalsContact O-CG 3.3Å; Q314-D318 PolarHBondContact O-N 3.2Å
315	A	82.6	Confident	83.3	Confident	55 Å²	55	49.9 Å²	49.9	46%	0.455	27%	0.269	S	S	.	.	H	α-helix	trans	-61.1	-36.2	177	0	0	0	0	0	112.6	A311 D312 I313 S319	A311-A315 VanDerWaalsContact O-CB 3.31Å; A311-A315 WeakPolarHBondContact O-CB 3.26Å; A311-A315 PolarHBondContact O-N 3.37Å; D312-A315 PolarHBondContact O-N 3.13Å; I313-A315 PolarHBondContact O-N 2.7Å; A315-S319 WeakPolarHBondContact O-CB 3.46Å; A315-S319 PolarHBondContact O-N 3.24Å
316	M	84.5	Confident	84	Confident	24 Å²	24	47.5 Å²	47.5	12%	0.118	26%	0.264	C	S	.	.	H	α-helix	trans	-70.4	-41.4	173.7	-71.4	-63.7	-177.6	0	0	112.3	D312 I313 Q314 S319 L320 I389 R392 L393 L396	D312-M316 VanDerWaalsContact O-CG 3.27Å; D312-M316 WeakPolarHBondContact O-CG 3.42Å; D312-M316 PolarHBondContact O-N 2.77Å; I313-M316 PolarHBondContact O-N 2.9Å; Q314-M316 VanDerWaalsContact C-N 3.27Å; Q314-M316 PolarHBondContact O-N 3.41Å; M316-S319 PolarHBondContact O-N 3.06Å; M316-L320 WeakPolarHBondContact O-CG 3.37Å; M316-L320 PolarHBondContact O-N 3.29Å; M316-I389 HydrophobicContact CB-CG2 4.22Å; M316-I389 HydrophobicContact SD-CG1 4.45Å; M316-I389 HydrophobicContact SD-CG2 3.74Å; M316-R392 HydrophobicContact CE-CB 4.29Å; M316-R392 HydrophobicContact CE-CG 3.71Å; M316-R392 VanDerWaalsContact CE-CZ 3.43Å; M316-L393 HydrophobicContact CB-CD1 4.03Å; M316-L396 HydrophobicContact CG-CD1 4.3Å
317	E	86	Confident	84.6	Confident	34 Å²	34	48.3 Å²	48.3	16%	0.159	27%	0.266	C	S	.	.	H	α-helix	trans	-61.3	-45	174.3	-71.7	-179.8	156	0	0	110.9	I313 Q314 S319 L320 L321 R402	I313-E317 HydrophobicContact CG2-CG 4.48Å; I313-E317 WeakPolarHBondContact O-CG 3.35Å; I313-E317 PolarHBondContact O-N 3.41Å; Q314-E317 PolarHBondContact O-N 2.72Å; Q314-E317 VanDerWaalsContact O-N 3.13Å; E317-S319 VanDerWaalsContact C-N 3.35Å; E317-S319 PolarHBondContact O-N 2.83Å; E317-L320 WeakPolarHBondContact O-CB 3.17Å; E317-L320 PolarHBondContact O-N 3.36Å; E317-L320 VanDerWaalsContact O-N 3.14Å; E317-L321 WeakPolarHBondContact O-CG 3.37Å; E317-L321 PolarHBondContact O-N 3.12Å; E317-R402 IonicContact OE1-NH2 2.87Å; E317-R402 IonicContact OE2-CZ 3.05Å; E317-R402 IonicContact OE2-NH2 3.85Å; E317-R402 PolarHBondContact OE2-NH2 3.1Å
318	D	86.1	Confident	85.1	Confident	89 Å²	89	49.8 Å²	49.8	48%	0.476	28%	0.282	S	S	.	.	H	α-helix	trans	-63.2	-39.3	175.1	-71	-19.7	0	0	0	111.9	Q314 L320 L321 Q322	Q314-D318 WeakPolarHBondContact O-CB 3.26Å; Q314-D318 VanDerWaalsContact O-CG 3.3Å; Q314-D318 PolarHBondContact O-N 3.2Å; D318-L320 VanDerWaalsContact C-N 3.29Å; D318-L320 PolarHBondContact O-N 3.11Å; D318-L321 WeakPolarHBondContact O-CB 3.42Å; D318-L321 PolarHBondContact O-N 3.28Å; D318-Q322 WeakPolarHBondContact O-CG 3.49Å; D318-Q322 PolarHBondContact O-N 3.46Å
319	S	87	Confident	85.6	Confident	28 Å²	28	52.6 Å²	52.6	20%	0.196	30%	0.298	C	S	.	.	H	α-helix	trans	-64.4	-36	174.7	-164.8	0	0	0	0	111.9	A315 M316 E317 Q322 I323	A315-S319 WeakPolarHBondContact O-CB 3.46Å; A315-S319 PolarHBondContact O-N 3.24Å; M316-S319 PolarHBondContact O-N 3.06Å; E317-S319 VanDerWaalsContact C-N 3.35Å; E317-S319 PolarHBondContact O-N 2.83Å; S319-Q322 PolarHBondContact O-N 3.01Å; S319-I323 VanDerWaalsContact O-CG1 3.28Å; S319-I323 WeakPolarHBondContact O-CG1 3.27Å; S319-I323 PolarHBondContact O-N 3.13Å
320	L	88.6	Confident	86.2	Confident	21 Å²	21	55.3 Å²	55.3	11%	0.11	31%	0.31	C	S	.	.	H	α-helix	trans	-67.3	-39.9	173.6	-69.3	172.5	0	0	0	111.7	M316 E317 D318 I323 Q324 T386 I389 V390 L393 F406	M316-L320 WeakPolarHBondContact O-CG 3.37Å; M316-L320 PolarHBondContact O-N 3.29Å; E317-L320 WeakPolarHBondContact O-CB 3.17Å; E317-L320 PolarHBondContact O-N 3.36Å; E317-L320 VanDerWaalsContact O-N 3.14Å; D318-L320 VanDerWaalsContact C-N 3.29Å; D318-L320 PolarHBondContact O-N 3.11Å; L320-I323 PolarHBondContact O-N 3.48Å; L320-Q324 PolarHBondContact O-N 3.48Å; L320-T386 HydrophobicContact CD2-CG2 3.83Å; L320-I389 HydrophobicContact CD1-CG2 4.18Å; L320-I389 HydrophobicContact CD2-CB 4.05Å; L320-I389 HydrophobicContact CD2-CG2 3.67Å; L320-I389 HydrophobicContact CG-CG2 3.69Å; L320-V390 HydrophobicContact CD1-CG2 4.33Å; L320-V390 HydrophobicContact CD2-CG2 4.11Å; L320-L393 HydrophobicContact CD1-CD2 4.14Å; L320-F406 HydrophobicContact CD1-CB 3.87Å
321	L	87.9	Confident	86.8	Confident	93 Å²	93	52.8 Å²	52.8	49%	0.487	30%	0.296	S	S	.	.	H	α-helix	trans	-61.6	-46.6	173.2	-69.3	173.9	0	0	0	111.3	E317 D318 I323 Q324 D325	E317-L321 WeakPolarHBondContact O-CG 3.37Å; E317-L321 PolarHBondContact O-N 3.12Å; D318-L321 WeakPolarHBondContact O-CB 3.42Å; D318-L321 PolarHBondContact O-N 3.28Å; L321-I323 VanDerWaalsContact C-N 3.29Å; L321-I323 PolarHBondContact O-N 3.31Å; L321-Q324 WeakPolarHBondContact O-CA 2.89Å; L321-Q324 WeakPolarHBondContact O-CB 3.44Å; L321-Q324 PolarHBondContact O-N 3.06Å; L321-D325 PolarHBondContact O-N 2.86Å
322	Q	89.1	Confident	87.4	Confident	127 Å²	127	58.1 Å²	58.1	59%	0.593	31%	0.307	S	S	*	.	H	α-helix	trans	-60.2	-36.9	175.8	-74.2	-178.3	-0.2	0	0	112.9	D318 S319 S326	D318-Q322 WeakPolarHBondContact O-CG 3.49Å; D318-Q322 PolarHBondContact O-N 3.46Å; S319-Q322 PolarHBondContact O-N 3.01Å; Q322-S326 WeakPolarHBondContact O-CB 2.96Å; Q322-S326 PolarHBondContact O-N 2.77Å; Q322-S326 PolarHBondContact O-OG 3.38Å
323	I	88.9	Confident	88	Confident	4 Å²	4	61.1 Å²	61.1	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-69.2	-37.5	174.8	-68.4	165.2	0	0	0	110.7	S319 L320 L321 S326 W327 L382 K385 T386 I389	S319-I323 VanDerWaalsContact O-CG1 3.28Å; S319-I323 WeakPolarHBondContact O-CG1 3.27Å; S319-I323 PolarHBondContact O-N 3.13Å; L320-I323 PolarHBondContact O-N 3.48Å; L321-I323 VanDerWaalsContact C-N 3.29Å; L321-I323 PolarHBondContact O-N 3.31Å; I323-S326 PolarHBondContact O-N 2.99Å; I323-W327 VanDerWaalsContact O-CB 3.25Å; I323-W327 WeakPolarHBondContact O-CB 3.32Å; I323-W327 PolarHBondContact O-N 2.84Å; I323-L382 HydrophobicContact CG2-CB 4.23Å; I323-L382 HydrophobicContact CG2-CD2 4.38Å; I323-K385 HydrophobicContact CD1-CB 4.4Å; I323-K385 HydrophobicContact CD1-CD 3.84Å; I323-K385 HydrophobicContact CD1-CG 3.91Å; I323-K385 HydrophobicContact CG1-CD 4.34Å; I323-T386 WeakPolarHBondContact CG2-OG1 3.4Å; I323-I389 HydrophobicContact CD1-CD1 3.39Å
324	Q	90.1	Very high	88.4	Confident	87 Å²	87	61.2 Å²	61.2	41%	0.407	32%	0.32	S	S	.	.	H	α-helix	trans	-63.1	-43.6	175	-177	-180	-21.8	0	0	111.5	L320 L321 W327 A328	L320-Q324 PolarHBondContact O-N 3.48Å; L321-Q324 WeakPolarHBondContact O-CA 2.89Å; L321-Q324 WeakPolarHBondContact O-CB 3.44Å; L321-Q324 PolarHBondContact O-N 3.06Å; Q324-W327 WeakPolarHBondContact O-CB 3.31Å; Q324-W327 PolarHBondContact O-N 3.42Å; Q324-A328 PolarHBondContact O-N 2.82Å
325	D	89.4	Confident	88.7	Confident	102 Å²	102	57.9 Å²	57.9	55%	0.545	30%	0.304	S	S	.	.	H	α-helix	trans	-63.7	-47.3	175.1	-67.9	-22.8	0	0	0	110.7	L321 W327 A328 T329	L321-D325 PolarHBondContact O-N 2.86Å; D325-W327 VanDerWaalsContact C-N 3.27Å; D325-W327 PolarHBondContact O-N 3.13Å; D325-A328 WeakPolarHBondContact O-CB 3.49Å; D325-A328 PolarHBondContact O-N 3.27Å; D325-A328 VanDerWaalsContact O-N 3.08Å; D325-T329 PolarHBondContact O-N 3.16Å; D325-T329 PolarHBondContact O-OG1 3.45Å
326	S	89.8	Confident	89	Confident	48 Å²	48	60.5 Å²	60.5	34%	0.336	31%	0.307	S	S	.	.	H	α-helix	trans	-57.4	-41.3	175.5	-59.8	0	0	0	0	111.6	Q322 I323 T329 H330	Q322-S326 WeakPolarHBondContact O-CB 2.96Å; Q322-S326 PolarHBondContact O-N 2.77Å; Q322-S326 PolarHBondContact O-OG 3.38Å; I323-S326 PolarHBondContact O-N 2.99Å; S326-T329 PolarHBondContact O-N 2.98Å; S326-H330 PolarHBondContact O-N 3.04Å; S326-H330 PolarHBondContact O-ND1 3.01Å
327	W	90.7	Very high	89.3	Confident	20 Å²	20	59.8 Å²	59.8	8%	0.076	31%	0.305	C	S	.	.	H	α-helix	trans	-61.7	-44.1	176.1	-173.9	-78	0	0	0	111.4	I323 Q324 D325 H330 N331 L379 L382 F383 P409	I323-W327 VanDerWaalsContact O-CB 3.25Å; I323-W327 WeakPolarHBondContact O-CB 3.32Å; I323-W327 PolarHBondContact O-N 2.84Å; Q324-W327 WeakPolarHBondContact O-CB 3.31Å; Q324-W327 PolarHBondContact O-N 3.42Å; D325-W327 VanDerWaalsContact C-N 3.27Å; D325-W327 PolarHBondContact O-N 3.13Å; W327-H330 PolarHBondContact O-N 3.44Å; W327-N331 PolarHBondContact NE1-ND2 3.31Å; W327-N331 VanDerWaalsContact NE1-ND2 3.18Å; W327-N331 PolarHBondContact O-N 3.44Å; W327-N331 PolarHBondContact O-ND2 3.37Å; W327-L379 HydrophobicContact CD2-CD2 3.6Å; W327-L379 HydrophobicContact CE3-CB 4.42Å; W327-L379 HydrophobicContact CE3-CD2 3.67Å; W327-L379 HydrophobicContact CG-CD2 4.15Å; W327-L379 HydrophobicContact CH2-CB 3.69Å; W327-L379 HydrophobicContact CH2-CD1 4.21Å; W327-L379 HydrophobicContact CH2-CD2 4.13Å; W327-L379 HydrophobicContact CH2-CG 4.21Å; W327-L379 HydrophobicContact CZ2-CB 4.23Å; W327-L379 HydrophobicContact CZ2-CD1 3.88Å; W327-L379 HydrophobicContact CZ2-CD2 4.07Å; W327-L379 HydrophobicContact CZ2-CG 4.27Å; W327-L379 HydrophobicContact CZ3-CB 3.8Å; W327-L379 HydrophobicContact CZ3-CD2 3.94Å; W327-L379 HydrophobicContact CZ3-CG 4.36Å; W327-L379 WeakPolarHBondContact CZ3-O 3.45Å; W327-L382 HydrophobicContact CE3-CB 4.05Å; W327-L382 HydrophobicContact CE3-CD1 4.29Å; W327-L382 HydrophobicContact CZ3-CB 4.29Å; W327-F383 HydrophobicContact CZ3-CB 4.32Å; W327-P409 HydrophobicContact CD2-CB 3.58Å; W327-P409 HydrophobicContact CD2-CG 4.1Å; W327-P409 HydrophobicContact CE3-CB 3.9Å; W327-P409 HydrophobicContact CE3-CG 3.88Å; W327-P409 HydrophobicContact CG-CB 3.91Å; W327-P409 HydrophobicContact CH2-CB 4.46Å; W327-P409 HydrophobicContact CZ2-CB 4.18Å; W327-P409 HydrophobicContact CZ3-CB 4.33Å; W327-P409 HydrophobicContact CZ3-CG 4.17Å
328	A	89.3	Confident	89.5	Confident	56 Å²	56	66.3 Å²	66.3	46%	0.463	34%	0.335	S	S	.	.	H	α-helix	trans	-63.6	-43	175.1	0	0	0	0	0	111.5	Q324 D325 N331 R332	Q324-A328 PolarHBondContact O-N 2.82Å; D325-A328 WeakPolarHBondContact O-CB 3.49Å; D325-A328 PolarHBondContact O-N 3.27Å; D325-A328 VanDerWaalsContact O-N 3.08Å; A328-N331 PolarHBondContact O-N 3.49Å; A328-R332 WeakPolarHBondContact O-CB 3.01Å; A328-R332 PolarHBondContact O-N 2.01Å
329	T	90.9	Very high	89.7	Confident	69 Å²	69	65.1 Å²	65.1	42%	0.423	33%	0.327	S	S	.	.	H	α-helix	trans	-61.2	-44.6	176.7	-50.6	0	0	0	0	112.2	D325 S326 N331 R332 Q333	D325-T329 PolarHBondContact O-N 3.16Å; D325-T329 PolarHBondContact O-OG1 3.45Å; S326-T329 PolarHBondContact O-N 2.98Å; T329-N331 VanDerWaalsContact C-N 3.34Å; T329-N331 PolarHBondContact O-N 3.07Å; T329-R332 PolarHBondContact O-N 2.03Å; T329-Q333 HydrophobicContact CG2-CG 4.31Å; T329-Q333 WeakPolarHBondContact O-CB 3.41Å; T329-Q333 VanDerWaalsContact O-CG 3.29Å; T329-Q333 WeakPolarHBondContact O-CG 3.33Å; T329-Q333 PolarHBondContact O-N 3.4Å
330	H	90.6	Very high	89.9	Confident	69 Å²	69	63.8 Å²	63.8	32%	0.319	32%	0.318	S	S	.	.	H	α-helix	trans	-62.7	-41.2	177.9	-76.8	73.1	0	0	0	111.8	S326 W327 F334 L375 L379	S326-H330 PolarHBondContact O-N 3.04Å; S326-H330 PolarHBondContact O-ND1 3.01Å; W327-H330 PolarHBondContact O-N 3.44Å; H330-F334 PolarHBondContact O-N 2.6Å; H330-F334 VanDerWaalsContact O-N 3.1Å; H330-L375 HydrophobicContact CB-CD1 3.91Å; H330-L375 WeakPolarHBondContact O-CD1 3.42Å; H330-L379 HydrophobicContact CB-CD2 4.19Å
331	N	90.5	Very high	89.9	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.011	33%	0.329	C	S	.	.	H	α-helix	trans	-65.6	-39.6	175.4	-73.3	-61.4	0	0	0	111.9	W327 A328 T329 F334 E335 W417	W327-N331 PolarHBondContact NE1-ND2 3.31Å; W327-N331 VanDerWaalsContact NE1-ND2 3.18Å; W327-N331 PolarHBondContact O-N 3.44Å; W327-N331 PolarHBondContact O-ND2 3.37Å; A328-N331 PolarHBondContact O-N 3.49Å; T329-N331 VanDerWaalsContact C-N 3.34Å; T329-N331 PolarHBondContact O-N 3.07Å; N331-F334 PolarHBondContact O-N 3.19Å; N331-E335 PolarHBondContact O-N 3.29Å; N331-E335 VanDerWaalsContact O-N 3.1Å; N331-W417 HydrophobicContact CB-CH2 4.21Å; N331-W417 HydrophobicContact CB-CZ2 4.44Å; N331-W417 WeakPolarHBondContact OD1-CZ2 3.47Å
332	R	89.3	Confident	90	Very high	159 Å²	159	63.9 Å²	63.9	60%	0.6	32%	0.322	S	S	*	.	H	α-helix	trans	-66.6	-42.9	176.8	-176.2	176.6	174.1	164.1	3.4	112	A328 T329 F334 E335 E336	A328-R332 WeakPolarHBondContact O-CB 3.01Å; A328-R332 PolarHBondContact O-N 2.01Å; T329-R332 PolarHBondContact O-N 2.03Å; R332-F334 PolarHBondContact O-N 3.26Å; R332-E335 PolarHBondContact O-N 3.14Å; R332-E335 VanDerWaalsContact O-N 3.11Å; R332-E336 HydrophobicContact CG-CG 4.37Å; R332-E336 IonicContact CZ-OE1 3.95Å; R332-E336 IonicContact NE-OE1 3.2Å; R332-E336 PolarHBondContact NE-OE1 3.14Å; R332-E336 IonicContact NE-OE2 3.81Å; R332-E336 IonicContact NH2-OE1 3.01Å; R332-E336 PolarHBondContact NH2-OE1 2.93Å; R332-E336 WeakPolarHBondContact O-CB 3.35Å; R332-E336 WeakPolarHBondContact O-CG 3.44Å; R332-E336 PolarHBondContact O-N 3.26Å
333	Q	90.9	Very high	90	Very high	95 Å²	95	58 Å²	58	44%	0.444	30%	0.295	S	S	.	.	H	α-helix	trans	-62.8	-28.4	174.9	-75.4	175.1	-11.2	0	0	113.1	T329 S337	T329-Q333 HydrophobicContact CG2-CG 4.31Å; T329-Q333 WeakPolarHBondContact O-CB 3.41Å; T329-Q333 VanDerWaalsContact O-CG 3.29Å; T329-Q333 WeakPolarHBondContact O-CG 3.33Å; T329-Q333 PolarHBondContact O-N 3.4Å; Q333-S337 WeakPolarHBondContact O-CB 3.47Å; Q333-S337 PolarHBondContact O-N 3.18Å
334	F	91.6	Very high	90	Very high	3 Å²	3	59 Å²	59	1%	0.013	30%	0.3	C	S	.	.	H	α-helix	trans	-72.7	-43.7	171.5	177.6	-97.8	0	0	0	111.4	H330 N331 R332 E336 S337 F340 W362 L368 R371 Y372 L375 W417	H330-F334 PolarHBondContact O-N 2.6Å; H330-F334 VanDerWaalsContact O-N 3.1Å; N331-F334 PolarHBondContact O-N 3.19Å; R332-F334 PolarHBondContact O-N 3.26Å; F334-E336 VanDerWaalsContact C-N 3.35Å; F334-E336 PolarHBondContact O-N 2.8Å; F334-S337 VanDerWaalsContact O-CB 3.29Å; F334-S337 WeakPolarHBondContact O-CB 3.42Å; F334-S337 PolarHBondContact O-N 3.12Å; F334-S337 PolarHBondContact O-OG 3.04Å; F334-F340 HydrophobicContact CD1-CD2 4.4Å; F334-F340 AromaticContact CE1-CD2 3.74Å; F334-F340 HydrophobicContact CE1-CD2 3.74Å; F334-F340 HydrophobicContact CE1-CE2 4.15Å; F334-F340 HydrophobicContact CZ-CD2 4.18Å; F334-F340 WeakPolarHBondContact O-CB 3.12Å; F334-W362 AromaticContact CE1-CH2 3.84Å; F334-W362 HydrophobicContact CE1-CH2 3.84Å; F334-W362 AromaticContact CZ-CH2 3.59Å; F334-W362 HydrophobicContact CZ-CH2 3.59Å; F334-W362 HydrophobicContact CZ-CZ2 4Å; F334-L368 HydrophobicContact CE2-CD1 4.2Å; F334-L368 HydrophobicContact CZ-CD1 3.92Å; F334-R371 HydrophobicContact CD2-CG 3.91Å; F334-R371 HydrophobicContact CE2-CB 4.3Å; F334-R371 HydrophobicContact CE2-CG 3.94Å; F334-Y372 HydrophobicContact CE2-CD2 4.42Å; F334-Y372 HydrophobicContact CZ-CD2 4.08Å; F334-L375 HydrophobicContact CB-CD1 4.31Å; F334-L375 HydrophobicContact CB-CD2 3.9Å; F334-L375 HydrophobicContact CD1-CD2 4.1Å; F334-L375 HydrophobicContact CD2-CB 4.31Å; F334-L375 HydrophobicContact CD2-CD2 4.11Å; F334-L375 HydrophobicContact CG-CD2 3.75Å; F334-W417 HydrophobicContact CD1-CD2 4.31Å; F334-W417 HydrophobicContact CD1-CE3 4.08Å; F334-W417 AromaticContact CD1-CH2 3.63Å; F334-W417 HydrophobicContact CD1-CH2 3.63Å; F334-W417 AromaticContact CD1-CZ2 3.88Å; F334-W417 HydrophobicContact CD1-CZ2 3.88Å; F334-W417 AromaticContact CD1-CZ3 3.75Å; F334-W417 HydrophobicContact CD1-CZ3 3.75Å; F334-W417 HydrophobicContact CE1-CD2 4.06Å; F334-W417 HydrophobicContact CE1-CE3 4.02Å; F334-W417 HydrophobicContact CE1-CH2 4.34Å; F334-W417 HydrophobicContact CE1-CZ2 4.38Å; F334-W417 HydrophobicContact CE1-CZ3 4.17Å
335	E	88.5	Confident	89.8	Confident	30 Å²	30	63.6 Å²	63.6	14%	0.14	32%	0.318	C	S	.	.	H	α-helix	trans	-65.1	-35.8	176.9	-171.3	173.7	-178.5	0	0	113	N331 R332 S337 F340 Q341 W417 R420	N331-E335 PolarHBondContact O-N 3.29Å; N331-E335 VanDerWaalsContact O-N 3.1Å; R332-E335 PolarHBondContact O-N 3.14Å; R332-E335 VanDerWaalsContact O-N 3.11Å; E335-S337 VanDerWaalsContact C-N 3.3Å; E335-F340 HydrophobicContact CG-CD1 4.5Å; E335-F340 HydrophobicContact CG-CE1 4.09Å; E335-F340 WeakPolarHBondContact O-CD1 3.49Å; E335-Q341 PolarHBondContact O-NE2 2.98Å; E335-W417 HydrophobicContact CB-CZ3 4.37Å; E335-R420 IonicContact OE1-CZ 3Å; E335-R420 IonicContact OE1-NE 3.07Å; E335-R420 PolarHBondContact OE1-NE 2.82Å; E335-R420 IonicContact OE1-NH2 3.94Å; E335-R420 PolarHBondContact OE1-NH2 3.34Å; E335-R420 IonicContact OE2-NE 3.53Å; E335-R420 IonicContact OE2-NH2 3.77Å
336	E	88.7	Confident	89.7	Confident	111 Å²	111	67.4 Å²	67.4	52%	0.519	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-1.4	176.1	-67.9	172.9	172.6	0	0	113.1	R332 F334	R332-E336 HydrophobicContact CG-CG 4.37Å; R332-E336 IonicContact CZ-OE1 3.95Å; R332-E336 IonicContact NE-OE1 3.2Å; R332-E336 PolarHBondContact NE-OE1 3.14Å; R332-E336 IonicContact NE-OE2 3.81Å; R332-E336 IonicContact NH2-OE1 3.01Å; R332-E336 PolarHBondContact NH2-OE1 2.93Å; R332-E336 WeakPolarHBondContact O-CB 3.35Å; R332-E336 WeakPolarHBondContact O-CG 3.44Å; R332-E336 PolarHBondContact O-N 3.26Å; F334-E336 VanDerWaalsContact C-N 3.35Å; F334-E336 PolarHBondContact O-N 2.8Å
337	S	92.3	Very high	89.6	Confident	9 Å²	9	65.5 Å²	65.5	6%	0.063	31%	0.311	C	S	.	.	S	Bend	trans	-68	146.2	-178.1	69.6	0	0	0	0	112.4	Q333 F334 E335 E339 F340 Q341	Q333-S337 WeakPolarHBondContact O-CB 3.47Å; Q333-S337 PolarHBondContact O-N 3.18Å; F334-S337 VanDerWaalsContact O-CB 3.29Å; F334-S337 WeakPolarHBondContact O-CB 3.42Å; F334-S337 PolarHBondContact O-N 3.12Å; F334-S337 PolarHBondContact O-OG 3.04Å; E335-S337 VanDerWaalsContact C-N 3.3Å; S337-E339 WeakPolarHBondContact CB-OE2 3.48Å; S337-E339 PolarHBondContact O-N 3.15Å; S337-F340 PolarHBondContact O-N 3.08Å; S337-F340 WeakPolarHBondContact OG-CB 3.2Å; S337-F340 PolarHBondContact OG-N 3.38Å; S337-Q341 WeakPolarHBondContact O-CG 3.32Å; S337-Q341 PolarHBondContact O-N 3.23Å
338	E	89.3	Confident	89.2	Confident	170 Å²	170	65.9 Å²	65.9	79%	0.794	32%	0.316	S	S	*	.	H	α-helix	trans	-60.4	-34.6	179.8	-66.9	-175	178.7	0	0	111.5	Q341 A342	E338-Q341 PolarHBondContact O-N 3.4Å; E338-A342 WeakPolarHBondContact O-CB 3.19Å; E338-A342 PolarHBondContact O-N 3.43Å
339	E	91	Very high	88.7	Confident	65 Å²	65	69 Å²	69	30%	0.304	33%	0.325	S	S	.	.	H	α-helix	trans	-65.9	-42.4	178.1	-56	90.6	155.1	0	0	111.8	S337 A342 L343 L368	S337-E339 WeakPolarHBondContact CB-OE2 3.48Å; S337-E339 PolarHBondContact O-N 3.15Å; E339-A342 PolarHBondContact O-N 3.31Å; E339-L343 PolarHBondContact O-N 3.01Å; E339-L343 VanDerWaalsContact O-N 3.1Å; E339-L368 HydrophobicContact CB-CD1 4.28Å
340	F	90.4	Very high	87.9	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-69.2	-42	177.5	-174.2	-91	0	0	0	111.6	F334 E335 S337 A342 L343 L344 W362 L368 W417 I421 L424	F334-F340 HydrophobicContact CD1-CD2 4.4Å; F334-F340 AromaticContact CE1-CD2 3.74Å; F334-F340 HydrophobicContact CE1-CD2 3.74Å; F334-F340 HydrophobicContact CE1-CE2 4.15Å; F334-F340 HydrophobicContact CZ-CD2 4.18Å; F334-F340 WeakPolarHBondContact O-CB 3.12Å; E335-F340 HydrophobicContact CG-CD1 4.5Å; E335-F340 HydrophobicContact CG-CE1 4.09Å; E335-F340 WeakPolarHBondContact O-CD1 3.49Å; S337-F340 PolarHBondContact O-N 3.08Å; S337-F340 WeakPolarHBondContact OG-CB 3.2Å; S337-F340 PolarHBondContact OG-N 3.38Å; F340-A342 VanDerWaalsContact C-N 3.34Å; F340-L343 PolarHBondContact O-N 3.33Å; F340-L344 HydrophobicContact CD1-CD1 4.04Å; F340-L344 HydrophobicContact CE1-CD1 3.77Å; F340-L344 HydrophobicContact CE1-CG 4.3Å; F340-L344 PolarHBondContact O-N 3.3Å; F340-L344 VanDerWaalsContact O-N 3.15Å; F340-W362 HydrophobicContact CD2-CH2 4.45Å; F340-W362 HydrophobicContact CD2-CZ3 4.22Å; F340-W362 HydrophobicContact CE2-CH2 4.44Å; F340-W362 HydrophobicContact CE2-CZ3 4.01Å; F340-L368 HydrophobicContact CB-CD1 4.13Å; F340-L368 HydrophobicContact CD2-CD1 4.3Å; F340-W417 HydrophobicContact CE2-CE3 4.3Å; F340-I421 HydrophobicContact CE2-CD1 4.03Å; F340-I421 HydrophobicContact CE2-CG1 3.87Å; F340-I421 HydrophobicContact CZ-CD1 4.29Å; F340-I421 HydrophobicContact CZ-CG1 3.62Å; F340-L424 HydrophobicContact CE1-CD1 3.83Å; F340-L424 HydrophobicContact CZ-CD1 4.3Å
341	Q	89.4	Confident	87.4	Confident	74 Å²	74	70.1 Å²	70.1	35%	0.346	32%	0.324	S	S	.	.	H	α-helix	trans	-68.9	-32.8	176.4	-64.7	-61.9	-37	0	0	112.4	E335 S337 E338 L344 K345	E335-Q341 PolarHBondContact O-NE2 2.98Å; S337-Q341 WeakPolarHBondContact O-CG 3.32Å; S337-Q341 PolarHBondContact O-N 3.23Å; E338-Q341 PolarHBondContact O-N 3.4Å; Q341-L344 PolarHBondContact O-N 2.95Å; Q341-K345 WeakPolarHBondContact O-CG 3.17Å; Q341-K345 PolarHBondContact O-N 3.09Å; Q341-K345 VanDerWaalsContact O-N 3.1Å
342	A	89.3	Confident	87.1	Confident	41 Å²	41	71.1 Å²	71.1	34%	0.339	33%	0.328	S	S	.	.	H	α-helix	trans	-67.2	-37.8	174.1	0	0	0	0	0	111.9	E338 E339 F340 K345 R346	E338-A342 WeakPolarHBondContact O-CB 3.19Å; E338-A342 PolarHBondContact O-N 3.43Å; E339-A342 PolarHBondContact O-N 3.31Å; F340-A342 VanDerWaalsContact C-N 3.34Å; A342-K345 PolarHBondContact O-N 3.13Å; A342-R346 WeakPolarHBondContact O-CB 3.33Å; A342-R346 WeakPolarHBondContact O-CG 3.26Å; A342-R346 PolarHBondContact O-N 2.7Å; A342-R346 VanDerWaalsContact O-N 3.12Å
343	L	89.7	Confident	86.9	Confident	5 Å²	5	63.7 Å²	63.7	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-60	-50.1	170.9	179	69.3	0	0	0	110.2	E339 F340 K345 R346 L347 F361 W362 L368 I421	E339-L343 PolarHBondContact O-N 3.01Å; E339-L343 VanDerWaalsContact O-N 3.1Å; F340-L343 PolarHBondContact O-N 3.33Å; L343-K345 VanDerWaalsContact C-N 3.28Å; L343-K345 PolarHBondContact O-N 2.99Å; L343-R346 WeakPolarHBondContact O-CB 3.38Å; L343-R346 PolarHBondContact O-N 3.07Å; L343-L347 HydrophobicContact CD1-CD2 4.42Å; L343-L347 WeakPolarHBondContact O-CG 3.46Å; L343-L347 PolarHBondContact O-N 3.13Å; L343-L347 VanDerWaalsContact O-N 3.11Å; L343-F361 HydrophobicContact CD1-CB 4.2Å; L343-W362 HydrophobicContact CD2-CE3 3.82Å; L343-W362 HydrophobicContact CD2-CZ3 4.43Å; L343-L368 HydrophobicContact CB-CD2 4.1Å; L343-L368 HydrophobicContact CD2-CD2 3.36Å; L343-L368 HydrophobicContact CG-CD2 4.21Å; L343-I421 HydrophobicContact CD2-CD1 3.83Å
344	L	87.6	Confident	86.8	Confident	24 Å²	24	62.3 Å²	62.3	13%	0.126	30%	0.296	C	S	.	.	H	α-helix	trans	-54.7	-43.1	179.7	-73.8	172.5	0	0	0	112.5	F340 Q341 R346 L347 I421 L424 L425	F340-L344 HydrophobicContact CD1-CD1 4.04Å; F340-L344 HydrophobicContact CE1-CD1 3.77Å; F340-L344 HydrophobicContact CE1-CG 4.3Å; F340-L344 PolarHBondContact O-N 3.3Å; F340-L344 VanDerWaalsContact O-N 3.15Å; Q341-L344 PolarHBondContact O-N 2.95Å; L344-R346 VanDerWaalsContact C-N 3.3Å; L344-R346 PolarHBondContact O-N 2.76Å; L344-L347 HydrophobicContact CD2-CD1 4.47Å; L344-L347 PolarHBondContact O-N 3.5Å; L344-I421 HydrophobicContact CD2-CB 4.38Å; L344-I421 HydrophobicContact CD2-CG1 4.24Å; L344-I421 HydrophobicContact CD2-CG2 3.82Å; L344-L424 HydrophobicContact CD1-CD1 3.9Å; L344-L424 HydrophobicContact CD2-CB 4.48Å; L344-L425 HydrophobicContact CD2-CD2 4.49Å
345	K	87.2	Confident	86.5	Confident	183 Å²	183	63.1 Å²	63.1	80%	0.796	30%	0.302	S	S	*	.	H	α-helix	trans	-71	-21.1	177.5	-69.9	177.5	-179	179.4	0	114.5	Q341 A342 L343	Q341-K345 WeakPolarHBondContact O-CG 3.17Å; Q341-K345 PolarHBondContact O-N 3.09Å; Q341-K345 VanDerWaalsContact O-N 3.1Å; A342-K345 PolarHBondContact O-N 3.13Å; L343-K345 VanDerWaalsContact C-N 3.28Å; L343-K345 PolarHBondContact O-N 2.99Å
346	R	86.6	Confident	86.4	Confident	183 Å²	183	65.6 Å²	65.6	69%	0.691	32%	0.32	S	S	*	.	H	α-helix	trans	-88.1	-16.8	178.5	-85.5	176.9	150.5	168.3	-4.3	112.9	A342 L343 L344 D365	A342-R346 WeakPolarHBondContact O-CB 3.33Å; A342-R346 WeakPolarHBondContact O-CG 3.26Å; A342-R346 PolarHBondContact O-N 2.7Å; A342-R346 VanDerWaalsContact O-N 3.12Å; L343-R346 WeakPolarHBondContact O-CB 3.38Å; L343-R346 PolarHBondContact O-N 3.07Å; L344-R346 VanDerWaalsContact C-N 3.3Å; L344-R346 PolarHBondContact O-N 2.76Å; R346-D365 IonicContact NH1-OD2 3.67Å
347	L	87.1	Confident	86.3	Confident	7 Å²	7	61.2 Å²	61.2	4%	0.037	30%	0.302	C	S	.	.	S	Bend	trans	-67.6	140.6	179.5	-70.3	173.6	0	0	0	109.7	L343 L344 D349 L353 F361 I421 L425	L343-L347 HydrophobicContact CD1-CD2 4.42Å; L343-L347 WeakPolarHBondContact O-CG 3.46Å; L343-L347 PolarHBondContact O-N 3.13Å; L343-L347 VanDerWaalsContact O-N 3.11Å; L344-L347 HydrophobicContact CD2-CD1 4.47Å; L344-L347 PolarHBondContact O-N 3.5Å; L347-D349 PolarHBondContact O-N 3.13Å; L347-L353 HydrophobicContact CB-CD1 3.83Å; L347-L353 HydrophobicContact CD1-CD1 4.44Å; L347-L353 HydrophobicContact CD2-CD1 4.05Å; L347-L353 HydrophobicContact CG-CD1 4.3Å; L347-F361 HydrophobicContact CD2-CB 3.82Å; L347-F361 HydrophobicContact CD2-CD2 3.77Å; L347-F361 HydrophobicContact CD2-CG 3.8Å; L347-I421 HydrophobicContact CD1-CG2 3.6Å; L347-L425 HydrophobicContact CD1-CD1 4Å
348	P	83.5	Confident	86.2	Confident	28 Å²	28	60.8 Å²	60.8	18%	0.182	30%	0.299	C	S	.	.			trans	-69.3	124.4	178.7	-13.4	24.7	0	0	0	111.6	D350 R351 L353 F361	P348-D350 VanDerWaalsContact C-N 3.31Å; P348-D350 WeakPolarHBondContact CB-OD1 3.45Å; P348-R351 HydrophobicContact CB-CG 4.47Å; P348-L353 HydrophobicContact CG-CD2 4.45Å; P348-F361 HydrophobicContact CG-CE2 4.43Å; P348-F361 HydrophobicContact CG-CZ 4.06Å
349	D	77.7	Confident	86.1	Confident	122 Å²	122	54.1 Å²	54.1	65%	0.652	27%	0.271	S	S	*	.	S	Bend	trans	-85.3	-7.3	173.9	-63	-30.5	0	0	0	112.7	L347 R351	L347-D349 PolarHBondContact O-N 3.13Å; D349-R351 VanDerWaalsContact C-N 3.34Å
350	D	74.4	Confident	86.1	Confident	75 Å²	75	56.8 Å²	56.8	40%	0.401	28%	0.284	S	S	.	.	S	Bend	trans	-79.4	-13.8	-175.9	67.5	-29.1	0	0	0	113.9	P348 C469	P348-D350 VanDerWaalsContact C-N 3.31Å; P348-D350 WeakPolarHBondContact CB-OD1 3.45Å; D350-C469 PolarHBondContact O-SG 2.91Å
351	R	80.1	Confident	86	Confident	87 Å²	87	60.2 Å²	60.2	33%	0.328	30%	0.299	S	S	.	.	S	Bend	trans	-147.1	158.4	-174.8	78.1	-166	93.2	-134.6	-4	112	P348 D349 L353 L460	P348-R351 HydrophobicContact CB-CG 4.47Å; D349-R351 VanDerWaalsContact C-N 3.34Å; R351-L353 HydrophobicContact CG-CD2 3.92Å; R351-L460 HydrophobicContact CB-CD1 3.87Å; R351-L460 HydrophobicContact CB-CG 3.99Å; R351-L460 HydrophobicContact CG-CD1 4.49Å
352	F	84.4	Confident	86.1	Confident	22 Å²	22	57.2 Å²	57.2	10%	0.096	29%	0.285	C	S	.	.			trans	-72.3	138.5	172.2	175.4	-102.9	0	0	0	111.2	N354 Y426 F436 E438 I456 P457 C458 A459	F352-N354 HydrophobicContact CE1-CB 4.24Å; F352-Y426 HydrophobicContact CD2-CE1 4.39Å; F352-Y426 AromaticContact CD2-CE2 3.73Å; F352-Y426 HydrophobicContact CD2-CE2 3.73Å; F352-Y426 AromaticContact CD2-CZ 3.64Å; F352-Y426 HydrophobicContact CE2-CD2 4.16Å; F352-Y426 AromaticContact CE2-CE2 3.51Å; F352-Y426 HydrophobicContact CE2-CE2 3.51Å; F352-Y426 AromaticContact CE2-CZ 3.94Å; F352-F436 AromaticContact CE2-CE1 3.78Å; F352-F436 HydrophobicContact CE2-CE1 3.78Å; F352-F436 AromaticContact CE2-CZ 3.64Å; F352-F436 HydrophobicContact CE2-CZ 3.64Å; F352-F436 AromaticContact CZ-CE1 3.89Å; F352-F436 HydrophobicContact CZ-CE1 3.89Å; F352-F436 HydrophobicContact CZ-CZ 4.07Å; F352-E438 HydrophobicContact CZ-CG 4.47Å; F352-I456 HydrophobicContact CD2-CG2 3.78Å; F352-I456 HydrophobicContact CE2-CG2 4.24Å; F352-P457 WeakPolarHBondContact CB-O 3.43Å; F352-C458 WeakPolarHBondContact CB-O 2.83Å; F352-C458 PolarHBondContact N-O 2.8Å; F352-A459 HydrophobicContact CB-CB 4.27Å; F352-A459 HydrophobicContact CD1-CB 4.13Å
353	L	86.3	Confident	86.1	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.021	29%	0.293	C	S	.	.			trans	-114.6	111.8	-178.7	-58.4	175	0	0	0	110.1	L347 P348 R351 A357 I358 F361 Q422 L425 Y426	L347-L353 HydrophobicContact CB-CD1 3.83Å; L347-L353 HydrophobicContact CD1-CD1 4.44Å; L347-L353 HydrophobicContact CD2-CD1 4.05Å; L347-L353 HydrophobicContact CG-CD1 4.3Å; P348-L353 HydrophobicContact CG-CD2 4.45Å; R351-L353 HydrophobicContact CG-CD2 3.92Å; L353-A357 HydrophobicContact CD2-CB 4.38Å; L353-I358 HydrophobicContact CB-CD1 4.3Å; L353-I358 HydrophobicContact CB-CG1 4.01Å; L353-F361 HydrophobicContact CD2-CE2 4.46Å; L353-Q422 PolarHBondContact O-NE2 3.19Å; L353-Q422 VanDerWaalsContact O-NE2 3.08Å; L353-L425 HydrophobicContact CD1-CD1 4.44Å; L353-Y426 PolarHBondContact N-OH 2.96Å
354	N	87.3	Confident	86.1	Confident	65 Å²	65	64.8 Å²	64.8	35%	0.348	33%	0.325	S	S	.	.			trans	-72.4	164.4	172.3	65.7	14.5	0	0	0	111.5	F352 T356 A357 I358 E438	F352-N354 HydrophobicContact CE1-CB 4.24Å; N354-T356 PolarHBondContact ND2-OG1 2.86Å; N354-T356 VanDerWaalsContact ND2-OG1 3.13Å; N354-T356 PolarHBondContact O-N 3.49Å; N354-T356 VanDerWaalsContact O-N 3.13Å; N354-T356 PolarHBondContact OD1-N 2.87Å; N354-T356 PolarHBondContact OD1-OG1 2.97Å; N354-A357 PolarHBondContact O-N 3.05Å; N354-A357 WeakPolarHBondContact OD1-CA 3.42Å; N354-A357 WeakPolarHBondContact OD1-CB 2.96Å; N354-A357 PolarHBondContact OD1-N 2.92Å; N354-I358 PolarHBondContact O-N 3.07Å; N354-I358 VanDerWaalsContact O-N 3.11Å; N354-E438 WeakPolarHBondContact CA-OE1 3.19Å; N354-E438 WeakPolarHBondContact CB-OE1 3.44Å
355	S	85.5	Confident	86.2	Confident	20 Å²	20	64.4 Å²	64.4	14%	0.14	32%	0.323	C	S	.	.	H	α-helix	trans	-57.4	-31.8	-178.8	-164	0	0	0	0	112.1	S359 E438	S355-S359 WeakPolarHBondContact O-CB 3.11Å; S355-S359 PolarHBondContact O-N 3.29Å; S355-E438 PolarHBondContact N-OE1 2.91Å
356	T	87.4	Confident	86.3	Confident	83 Å²	83	60.9 Å²	60.9	51%	0.509	32%	0.317	S	S	.	.	H	α-helix	trans	-72.3	-35.9	176.5	47.5	0	0	0	0	114.1	N354 S359 Q360	N354-T356 PolarHBondContact ND2-OG1 2.86Å; N354-T356 VanDerWaalsContact ND2-OG1 3.13Å; N354-T356 PolarHBondContact O-N 3.49Å; N354-T356 VanDerWaalsContact O-N 3.13Å; N354-T356 PolarHBondContact OD1-N 2.87Å; N354-T356 PolarHBondContact OD1-OG1 2.97Å; T356-S359 PolarHBondContact O-N 3.11Å; T356-S359 PolarHBondContact O-OG 2.96Å; T356-Q360 WeakPolarHBondContact O-CG 3.26Å; T356-Q360 PolarHBondContact O-N 3.37Å; T356-Q360 VanDerWaalsContact O-N 3.11Å
357	A	86.6	Confident	86.5	Confident	18 Å²	18	54.9 Å²	54.9	15%	0.149	30%	0.303	C	S	.	.	H	α-helix	trans	-69.3	-42.9	176.2	0	0	0	0	0	109.5	L353 N354 S359 Q360 F361	L353-A357 HydrophobicContact CD2-CB 4.38Å; N354-A357 PolarHBondContact O-N 3.05Å; N354-A357 WeakPolarHBondContact OD1-CA 3.42Å; N354-A357 WeakPolarHBondContact OD1-CB 2.96Å; N354-A357 PolarHBondContact OD1-N 2.92Å; A357-S359 VanDerWaalsContact C-N 3.27Å; A357-S359 PolarHBondContact O-N 3.12Å; A357-Q360 WeakPolarHBondContact O-CB 3.04Å; A357-Q360 PolarHBondContact O-N 3.27Å; A357-Q360 VanDerWaalsContact O-N 3.13Å; A357-F361 WeakPolarHBondContact O-CD2 3.29Å; A357-F361 PolarHBondContact O-N 3.49Å
358	I	88.9	Confident	86.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61	-39.2	174.3	-63.8	168.3	0	0	0	110.6	L353 N354 Q360 F361 W362 W418 I421 Q422	L353-I358 HydrophobicContact CB-CD1 4.3Å; L353-I358 HydrophobicContact CB-CG1 4.01Å; N354-I358 PolarHBondContact O-N 3.07Å; N354-I358 VanDerWaalsContact O-N 3.11Å; I358-Q360 VanDerWaalsContact C-N 3.32Å; I358-Q360 PolarHBondContact O-N 3.02Å; I358-F361 PolarHBondContact O-N 3.35Å; I358-W362 VanDerWaalsContact O-CB 3.26Å; I358-W362 WeakPolarHBondContact O-CB 3.1Å; I358-W362 PolarHBondContact O-N 2.77Å; I358-W418 HydrophobicContact CG2-CB 4.18Å; I358-W418 HydrophobicContact CG2-CG 4.25Å; I358-I421 HydrophobicContact CD1-CG2 4.03Å; I358-I421 HydrophobicContact CG1-CG2 4.49Å; I358-I421 HydrophobicContact CG2-CB 4.31Å; I358-I421 HydrophobicContact CG2-CD1 3.88Å; I358-I421 HydrophobicContact CG2-CG2 4.07Å; I358-Q422 HydrophobicContact CD1-CG 3.27Å
359	S	88.8	Confident	87	Confident	30 Å²	30	56.2 Å²	56.2	21%	0.21	31%	0.307	C	S	.	.	H	α-helix	trans	-65.4	-33.9	176.7	82.7	0	0	0	0	112.8	S355 T356 A357 A363 W418	S355-S359 WeakPolarHBondContact O-CB 3.11Å; S355-S359 PolarHBondContact O-N 3.29Å; T356-S359 PolarHBondContact O-N 3.11Å; T356-S359 PolarHBondContact O-OG 2.96Å; A357-S359 VanDerWaalsContact C-N 3.27Å; A357-S359 PolarHBondContact O-N 3.12Å; S359-A363 VanDerWaalsContact O-CB 3.26Å; S359-A363 WeakPolarHBondContact O-CB 3.49Å; S359-A363 PolarHBondContact O-N 3.29Å; S359-W418 VanDerWaalsContact CB-CZ2 3.44Å
360	Q	89.3	Confident	87.7	Confident	122 Å²	122	55.6 Å²	55.6	57%	0.57	30%	0.3	S	S	*	.	H	α-helix	trans	-67.5	-46.7	173.5	-70.6	174.7	-1.8	0	0	112	T356 A357 I358 W362 A363 M364	T356-Q360 WeakPolarHBondContact O-CG 3.26Å; T356-Q360 PolarHBondContact O-N 3.37Å; T356-Q360 VanDerWaalsContact O-N 3.11Å; A357-Q360 WeakPolarHBondContact O-CB 3.04Å; A357-Q360 PolarHBondContact O-N 3.27Å; A357-Q360 VanDerWaalsContact O-N 3.13Å; I358-Q360 VanDerWaalsContact C-N 3.32Å; I358-Q360 PolarHBondContact O-N 3.02Å; Q360-W362 VanDerWaalsContact C-N 3.3Å; Q360-W362 PolarHBondContact O-N 3.49Å; Q360-A363 WeakPolarHBondContact O-CA 3.42Å; Q360-A363 WeakPolarHBondContact O-CB 3.44Å; Q360-A363 PolarHBondContact O-N 2.02Å; Q360-M364 WeakPolarHBondContact O-CG 3.27Å; Q360-M364 PolarHBondContact O-N 3.35Å
361	F	88.9	Confident	88.5	Confident	72 Å²	72	55.7 Å²	55.7	32%	0.316	29%	0.294	S	S	.	.	H	α-helix	trans	-62.2	-39.5	175.4	-75.7	-70.8	0	0	0	111.9	L343 L347 P348 L353 A357 I358 A363 M364 D365	L343-F361 HydrophobicContact CD1-CB 4.2Å; L347-F361 HydrophobicContact CD2-CB 3.82Å; L347-F361 HydrophobicContact CD2-CD2 3.77Å; L347-F361 HydrophobicContact CD2-CG 3.8Å; P348-F361 HydrophobicContact CG-CE2 4.43Å; P348-F361 HydrophobicContact CG-CZ 4.06Å; L353-F361 HydrophobicContact CD2-CE2 4.46Å; A357-F361 WeakPolarHBondContact O-CD2 3.29Å; A357-F361 PolarHBondContact O-N 3.49Å; I358-F361 PolarHBondContact O-N 3.35Å; F361-A363 VanDerWaalsContact C-N 3.32Å; F361-A363 PolarHBondContact O-N 2.94Å; F361-M364 PolarHBondContact O-N 3.1Å; F361-D365 PolarHBondContact O-N 3.43Å
362	W	91.1	Very high	89	Confident	11 Å²	11	53.8 Å²	53.8	4%	0.042	29%	0.288	C	S	.	.	H	α-helix	trans	-62.6	-38.4	171.5	-172.5	-68.6	0	0	0	112.2	F334 F340 L343 I358 Q360 M364 D365 L368 Q369 Y372 L414 W417 W418 I421	F334-W362 AromaticContact CE1-CH2 3.84Å; F334-W362 HydrophobicContact CE1-CH2 3.84Å; F334-W362 AromaticContact CZ-CH2 3.59Å; F334-W362 HydrophobicContact CZ-CH2 3.59Å; F334-W362 HydrophobicContact CZ-CZ2 4Å; F340-W362 HydrophobicContact CD2-CH2 4.45Å; F340-W362 HydrophobicContact CD2-CZ3 4.22Å; F340-W362 HydrophobicContact CE2-CH2 4.44Å; F340-W362 HydrophobicContact CE2-CZ3 4.01Å; L343-W362 HydrophobicContact CD2-CE3 3.82Å; L343-W362 HydrophobicContact CD2-CZ3 4.43Å; I358-W362 VanDerWaalsContact O-CB 3.26Å; I358-W362 WeakPolarHBondContact O-CB 3.1Å; I358-W362 PolarHBondContact O-N 2.77Å; Q360-W362 VanDerWaalsContact C-N 3.3Å; Q360-W362 PolarHBondContact O-N 3.49Å; W362-M364 VanDerWaalsContact C-N 3.3Å; W362-M364 PolarHBondContact O-N 3.11Å; W362-D365 PolarHBondContact O-N 3.41Å; W362-L368 HydrophobicContact CD2-CD2 3.61Å; W362-L368 HydrophobicContact CD2-CG 4.35Å; W362-L368 HydrophobicContact CE3-CD2 3.5Å; W362-L368 VanDerWaalsContact CE3-CD2 3.5Å; W362-L368 HydrophobicContact CE3-CG 4.46Å; W362-L368 HydrophobicContact CG-CD2 4.25Å; W362-L368 HydrophobicContact CH2-CD1 4.41Å; W362-L368 HydrophobicContact CH2-CD2 4.06Å; W362-L368 HydrophobicContact CH2-CG 4.24Å; W362-L368 HydrophobicContact CZ2-CD2 4.14Å; W362-L368 HydrophobicContact CZ2-CG 4.1Å; W362-L368 HydrophobicContact CZ3-CD2 3.74Å; W362-L368 HydrophobicContact CZ3-CG 4.41Å; W362-Q369 PolarHBondContact O-NE2 3.01Å; W362-Q369 VanDerWaalsContact O-NE2 3.13Å; W362-Y372 HydrophobicContact CZ2-CD2 4.1Å; W362-Y372 HydrophobicContact CZ2-CG 4.11Å; W362-L414 HydrophobicContact CZ2-CD2 4.28Å; W362-W417 HydrophobicContact CH2-CB 4.12Å; W362-W417 HydrophobicContact CZ3-CB 4.24Å; W362-W418 AromaticContact CD2-NE1 3.99Å; W362-W418 AromaticContact CG-NE1 3.93Å; W362-I421 HydrophobicContact CE3-CD1 3.78Å; W362-I421 HydrophobicContact CZ3-CD1 3.73Å
363	A	89.5	Confident	89.3	Confident	62 Å²	62	58.9 Å²	58.9	51%	0.512	31%	0.312	S	S	.	.	H	α-helix	trans	-68.2	-29.5	178.4	0	0	0	0	0	112.6	S359 Q360 F361 Q369	S359-A363 VanDerWaalsContact O-CB 3.26Å; S359-A363 WeakPolarHBondContact O-CB 3.49Å; S359-A363 PolarHBondContact O-N 3.29Å; Q360-A363 WeakPolarHBondContact O-CA 3.42Å; Q360-A363 WeakPolarHBondContact O-CB 3.44Å; Q360-A363 PolarHBondContact O-N 2.02Å; F361-A363 VanDerWaalsContact C-N 3.32Å; F361-A363 PolarHBondContact O-N 2.94Å; A363-Q369 PolarHBondContact O-NE2 2.77Å
364	M	89.6	Confident	89.6	Confident	143 Å²	143	62.9 Å²	62.9	70%	0.704	33%	0.33	S	S	*	.	H	α-helix	trans	-78	-28.6	177.5	-69.2	178.8	-177	0	0	112.9	Q360 F361 W362 T366	Q360-M364 WeakPolarHBondContact O-CG 3.27Å; Q360-M364 PolarHBondContact O-N 3.35Å; F361-M364 PolarHBondContact O-N 3.1Å; W362-M364 VanDerWaalsContact C-N 3.3Å; W362-M364 PolarHBondContact O-N 3.11Å; M364-T366 PolarHBondContact O-N 3.27Å
365	D	89.8	Confident	89.8	Confident	15 Å²	15	60.5 Å²	60.5	8%	0.08	32%	0.317	C	S	.	.			trans	-85.3	98.1	-178.6	-159.2	-38.6	0	0	0	112.7	R346 F361 W362 S367 L368 Q369	R346-D365 IonicContact NH1-OD2 3.67Å; F361-D365 PolarHBondContact O-N 3.43Å; W362-D365 PolarHBondContact O-N 3.41Å; D365-S367 VanDerWaalsContact C-N 3.32Å; D365-S367 PolarHBondContact O-N 3.41Å; D365-S367 WeakPolarHBondContact OD1-CB 3.23Å; D365-S367 PolarHBondContact OD1-N 3.34Å; D365-S367 PolarHBondContact OD1-OG 3.12Å; D365-L368 HydrophobicContact CB-CB 4.05Å; D365-L368 PolarHBondContact OD1-N 3.43Å; D365-Q369 WeakPolarHBondContact O-CG 3.28Å; D365-Q369 PolarHBondContact O-N 2.97Å
366	T	89	Confident	90	Very high	109 Å²	109	60 Å²	60	67%	0.669	32%	0.316	S	S	*	.	H	α-helix	trans	-66.3	-31.2	178.9	56.4	0	0	0	0	113.2	M364 Q369 H370	M364-T366 PolarHBondContact O-N 3.27Å; T366-Q369 PolarHBondContact O-N 3.46Å; T366-H370 PolarHBondContact O-N 3.37Å
367	S	90.9	Very high	90.1	Very high	57 Å²	57	58.7 Å²	58.7	40%	0.399	31%	0.314	S	S	.	.	H	α-helix	trans	-69.1	-43.8	-179.2	72.1	0	0	0	0	111	D365 H370 R371	D365-S367 VanDerWaalsContact C-N 3.32Å; D365-S367 PolarHBondContact O-N 3.41Å; D365-S367 WeakPolarHBondContact OD1-CB 3.23Å; D365-S367 PolarHBondContact OD1-N 3.34Å; D365-S367 PolarHBondContact OD1-OG 3.12Å; S367-H370 PolarHBondContact O-N 3.3Å; S367-R371 PolarHBondContact O-N 2.99Å
368	L	91.4	Very high	90.3	Very high	0 Å²	0	59 Å²	59	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-65.8	-40	176.1	-176.7	64.9	0	0	0	112.1	F334 E339 F340 L343 W362 D365 H370 R371 Y372	F334-L368 HydrophobicContact CE2-CD1 4.2Å; F334-L368 HydrophobicContact CZ-CD1 3.92Å; E339-L368 HydrophobicContact CB-CD1 4.28Å; F340-L368 HydrophobicContact CB-CD1 4.13Å; F340-L368 HydrophobicContact CD2-CD1 4.3Å; L343-L368 HydrophobicContact CB-CD2 4.1Å; L343-L368 HydrophobicContact CD2-CD2 3.36Å; L343-L368 HydrophobicContact CG-CD2 4.21Å; W362-L368 HydrophobicContact CD2-CD2 3.61Å; W362-L368 HydrophobicContact CD2-CG 4.35Å; W362-L368 HydrophobicContact CE3-CD2 3.5Å; W362-L368 VanDerWaalsContact CE3-CD2 3.5Å; W362-L368 HydrophobicContact CE3-CG 4.46Å; W362-L368 HydrophobicContact CG-CD2 4.25Å; W362-L368 HydrophobicContact CH2-CD1 4.41Å; W362-L368 HydrophobicContact CH2-CD2 4.06Å; W362-L368 HydrophobicContact CH2-CG 4.24Å; W362-L368 HydrophobicContact CZ2-CD2 4.14Å; W362-L368 HydrophobicContact CZ2-CG 4.1Å; W362-L368 HydrophobicContact CZ3-CD2 3.74Å; W362-L368 HydrophobicContact CZ3-CG 4.41Å; D365-L368 HydrophobicContact CB-CB 4.05Å; D365-L368 PolarHBondContact OD1-N 3.43Å; L368-H370 PolarHBondContact O-N 2.89Å; L368-R371 PolarHBondContact O-N 3.26Å; L368-Y372 WeakPolarHBondContact O-CB 3.43Å; L368-Y372 PolarHBondContact O-N 3.03Å
369	Q	90.6	Very high	90.3	Very high	63 Å²	63	59.2 Å²	59.2	29%	0.294	32%	0.319	S	S	.	.	H	α-helix	trans	-61.2	-44.3	175.4	-74.7	176.8	17.6	0	0	112.2	W362 A363 D365 T366 R371 Y372 Q373	W362-Q369 PolarHBondContact O-NE2 3.01Å; W362-Q369 VanDerWaalsContact O-NE2 3.13Å; A363-Q369 PolarHBondContact O-NE2 2.77Å; D365-Q369 WeakPolarHBondContact O-CG 3.28Å; D365-Q369 PolarHBondContact O-N 2.97Å; T366-Q369 PolarHBondContact O-N 3.46Å; Q369-R371 VanDerWaalsContact C-N 3.33Å; Q369-R371 PolarHBondContact O-N 2.8Å; Q369-Y372 PolarHBondContact O-N 2.72Å; Q369-Q373 WeakPolarHBondContact O-CG 3.44Å; Q369-Q373 PolarHBondContact O-N 3.12Å
370	H	91.4	Very high	90.4	Very high	110 Å²	110	63.9 Å²	63.9	51%	0.509	34%	0.336	S	S	.	.	H	α-helix	trans	-62	-43.2	176.2	-177.9	-104	0	0	0	111.1	T366 S367 L368 Y372 Q373 Q374	T366-H370 PolarHBondContact O-N 3.37Å; S367-H370 PolarHBondContact O-N 3.3Å; L368-H370 PolarHBondContact O-N 2.89Å; H370-Y372 PolarHBondContact O-N 3.23Å; H370-Q373 PolarHBondContact O-N 3.03Å; H370-Q374 PolarHBondContact CE1-NE2 3.3Å; H370-Q374 PolarHBondContact ND1-NE2 3.32Å; H370-Q374 WeakPolarHBondContact O-CG 3.44Å; H370-Q374 PolarHBondContact O-N 3.08Å
371	R	91.8	Very high	90.5	Very high	76 Å²	76	62.8 Å²	62.8	29%	0.287	34%	0.337	S	S	.	.	H	α-helix	trans	-62	-40.2	175.4	-171.9	63.1	-179.7	161.3	-2.9	112.6	F334 S367 L368 Q369 Q374 L375	F334-R371 HydrophobicContact CD2-CG 3.91Å; F334-R371 HydrophobicContact CE2-CB 4.3Å; F334-R371 HydrophobicContact CE2-CG 3.94Å; S367-R371 PolarHBondContact O-N 2.99Å; L368-R371 PolarHBondContact O-N 3.26Å; Q369-R371 VanDerWaalsContact C-N 3.33Å; Q369-R371 PolarHBondContact O-N 2.8Å; R371-Q374 VanDerWaalsContact NH1-OE1 3.11Å; R371-Q374 WeakPolarHBondContact O-CB 3.41Å; R371-Q374 PolarHBondContact O-N 3.46Å; R371-L375 PolarHBondContact O-N 3.29Å
372	Y	91.3	Very high	90.5	Very high	48 Å²	48	60.4 Å²	60.4	19%	0.188	33%	0.328	C	S	.	.	H	α-helix	trans	-66.6	-38.3	175.2	179.2	-104.5	0	0	0	112.4	F334 W362 L368 Q369 H370 Q374 L375 G376 L414 W417	F334-Y372 HydrophobicContact CE2-CD2 4.42Å; F334-Y372 HydrophobicContact CZ-CD2 4.08Å; W362-Y372 HydrophobicContact CZ2-CD2 4.1Å; W362-Y372 HydrophobicContact CZ2-CG 4.11Å; L368-Y372 WeakPolarHBondContact O-CB 3.43Å; L368-Y372 PolarHBondContact O-N 3.03Å; Q369-Y372 PolarHBondContact O-N 2.72Å; H370-Y372 PolarHBondContact O-N 3.23Å; Y372-Q374 VanDerWaalsContact C-N 3.34Å; Y372-Q374 PolarHBondContact O-N 3.04Å; Y372-L375 HydrophobicContact CD2-CD2 4.44Å; Y372-L375 WeakPolarHBondContact O-CB 3.44Å; Y372-L375 PolarHBondContact O-N 2.9Å; Y372-G376 PolarHBondContact O-N 3.28Å; Y372-L414 HydrophobicContact CD1-CD2 4.1Å; Y372-L414 HydrophobicContact CE1-CD2 3.57Å; Y372-L414 HydrophobicContact CE1-CG 4.19Å; Y372-L414 HydrophobicContact CE2-CD2 4.13Å; Y372-W417 AromaticContact CE2-CD1 3.8Å; Y372-W417 AromaticContact CE2-NE1 3.75Å
373	Q	90.9	Very high	90.4	Very high	128 Å²	128	64.4 Å²	64.4	60%	0.598	35%	0.346	S	S	*	.	H	α-helix	trans	-63.3	-39.5	173.6	-72.5	175.9	8	0	0	111.9	Q369 H370 G376 A377	Q369-Q373 WeakPolarHBondContact O-CG 3.44Å; Q369-Q373 PolarHBondContact O-N 3.12Å; H370-Q373 PolarHBondContact O-N 3.03Å; Q373-G376 PolarHBondContact O-N 3.47Å; Q373-A377 PolarHBondContact O-N 3.06Å
374	Q	90.8	Very high	90.4	Very high	88 Å²	88	67.9 Å²	67.9	41%	0.411	35%	0.349	S	S	.	.	H	α-helix	trans	-61.5	-44.2	173.3	-69.8	178.7	-6.3	0	0	111.9	H370 R371 Y372 A377 G378	H370-Q374 PolarHBondContact CE1-NE2 3.3Å; H370-Q374 PolarHBondContact ND1-NE2 3.32Å; H370-Q374 WeakPolarHBondContact O-CG 3.44Å; H370-Q374 PolarHBondContact O-N 3.08Å; R371-Q374 VanDerWaalsContact NH1-OE1 3.11Å; R371-Q374 WeakPolarHBondContact O-CB 3.41Å; R371-Q374 PolarHBondContact O-N 3.46Å; Y372-Q374 VanDerWaalsContact C-N 3.34Å; Y372-Q374 PolarHBondContact O-N 3.04Å; Q374-A377 PolarHBondContact O-N 3.49Å; Q374-G378 PolarHBondContact O-N 3.02Å
375	L	91.4	Very high	90.4	Very high	15 Å²	15	66 Å²	66	8%	0.079	34%	0.337	C	S	.	.	H	α-helix	trans	-57.3	-51	173.1	177	69.3	0	0	0	110.3	H330 F334 R371 Y372 A377 G378 L379 W417	H330-L375 HydrophobicContact CB-CD1 3.91Å; H330-L375 WeakPolarHBondContact O-CD1 3.42Å; F334-L375 HydrophobicContact CB-CD1 4.31Å; F334-L375 HydrophobicContact CB-CD2 3.9Å; F334-L375 HydrophobicContact CD1-CD2 4.1Å; F334-L375 HydrophobicContact CD2-CB 4.31Å; F334-L375 HydrophobicContact CD2-CD2 4.11Å; F334-L375 HydrophobicContact CG-CD2 3.75Å; R371-L375 PolarHBondContact O-N 3.29Å; Y372-L375 HydrophobicContact CD2-CD2 4.44Å; Y372-L375 WeakPolarHBondContact O-CB 3.44Å; Y372-L375 PolarHBondContact O-N 2.9Å; L375-A377 VanDerWaalsContact C-N 3.3Å; L375-A377 PolarHBondContact O-N 3.33Å; L375-G378 PolarHBondContact O-N 3.01Å; L375-G378 VanDerWaalsContact O-N 3.14Å; L375-L379 HydrophobicContact CD1-CD1 4.1Å; L375-L379 HydrophobicContact CD1-CD2 4.32Å; L375-L379 HydrophobicContact CD1-CG 4.03Å; L375-L379 HydrophobicContact CD2-CD1 4.4Å; L375-L379 HydrophobicContact CG-CD1 3.92Å; L375-L379 HydrophobicContact CG-CG 4.16Å; L375-L379 WeakPolarHBondContact O-CB 3.44Å; L375-L379 VanDerWaalsContact O-CG 3.3Å; L375-L379 WeakPolarHBondContact O-CG 3.4Å; L375-L379 PolarHBondContact O-N 3.45Å; L375-W417 HydrophobicContact CD2-CZ2 4.02Å
376	G	89.9	Confident	90.3	Very high	11 Å²	11	65.5 Å²	65.5	11%	0.113	33%	0.334	C	S	.	.	H	α-helix	trans	-57.7	-39.5	178.5	0	0	0	0	0	113.1	Y372 Q373 K380	Y372-G376 PolarHBondContact O-N 3.28Å; Q373-G376 PolarHBondContact O-N 3.47Å; G376-K380 WeakPolarHBondContact O-CB 3.39Å; G376-K380 WeakPolarHBondContact O-CG 3.39Å; G376-K380 PolarHBondContact O-N 3.39Å
377	A	89.9	Confident	90.3	Very high	55 Å²	55	64.1 Å²	64.1	46%	0.455	32%	0.32	S	S	.	.	H	α-helix	trans	-63.9	-46.1	174.8	0	0	0	0	0	112	Q373 Q374 L375 K380 V381	Q373-A377 PolarHBondContact O-N 3.06Å; Q374-A377 PolarHBondContact O-N 3.49Å; L375-A377 VanDerWaalsContact C-N 3.3Å; L375-A377 PolarHBondContact O-N 3.33Å; A377-K380 PolarHBondContact O-N 2.98Å; A377-V381 WeakPolarHBondContact O-CG2 3.46Å; A377-V381 PolarHBondContact O-N 2.63Å
378	G	90.4	Very high	90.1	Very high	23 Å²	23	68.7 Å²	68.7	24%	0.237	33%	0.329	C	S	.	.	H	α-helix	trans	-61.7	-46.5	176.4	0	0	0	0	0	112.7	Q374 L375 K380 V381 L382	Q374-G378 PolarHBondContact O-N 3.02Å; L375-G378 PolarHBondContact O-N 3.01Å; L375-G378 VanDerWaalsContact O-N 3.14Å; G378-K380 PolarHBondContact O-N 2.89Å; G378-V381 WeakPolarHBondContact O-CB 3.5Å; G378-V381 PolarHBondContact O-N 3.4Å; G378-L382 PolarHBondContact O-N 3.24Å; G378-L382 VanDerWaalsContact O-N 3.07Å
379	L	90.7	Very high	89.9	Confident	6 Å²	6	69.5 Å²	69.5	3%	0.031	33%	0.333	C	S	.	.	H	α-helix	trans	-63	-38.8	177.2	-65.5	-173.5	0	0	0	111.9	W327 H330 L375 V381 L382 F383	W327-L379 HydrophobicContact CD2-CD2 3.6Å; W327-L379 HydrophobicContact CE3-CB 4.42Å; W327-L379 HydrophobicContact CE3-CD2 3.67Å; W327-L379 HydrophobicContact CG-CD2 4.15Å; W327-L379 HydrophobicContact CH2-CB 3.69Å; W327-L379 HydrophobicContact CH2-CD1 4.21Å; W327-L379 HydrophobicContact CH2-CD2 4.13Å; W327-L379 HydrophobicContact CH2-CG 4.21Å; W327-L379 HydrophobicContact CZ2-CB 4.23Å; W327-L379 HydrophobicContact CZ2-CD1 3.88Å; W327-L379 HydrophobicContact CZ2-CD2 4.07Å; W327-L379 HydrophobicContact CZ2-CG 4.27Å; W327-L379 HydrophobicContact CZ3-CB 3.8Å; W327-L379 HydrophobicContact CZ3-CD2 3.94Å; W327-L379 HydrophobicContact CZ3-CG 4.36Å; W327-L379 WeakPolarHBondContact CZ3-O 3.45Å; H330-L379 HydrophobicContact CB-CD2 4.19Å; L375-L379 HydrophobicContact CD1-CD1 4.1Å; L375-L379 HydrophobicContact CD1-CD2 4.32Å; L375-L379 HydrophobicContact CD1-CG 4.03Å; L375-L379 HydrophobicContact CD2-CD1 4.4Å; L375-L379 HydrophobicContact CG-CD1 3.92Å; L375-L379 HydrophobicContact CG-CG 4.16Å; L375-L379 WeakPolarHBondContact O-CB 3.44Å; L375-L379 VanDerWaalsContact O-CG 3.3Å; L375-L379 WeakPolarHBondContact O-CG 3.4Å; L375-L379 PolarHBondContact O-N 3.45Å; L379-V381 VanDerWaalsContact C-N 3.33Å; L379-V381 PolarHBondContact O-N 2.98Å; L379-L382 HydrophobicContact CD2-CD1 4.45Å; L379-L382 PolarHBondContact O-N 2.85Å; L379-F383 WeakPolarHBondContact O-CB 3.33Å; L379-F383 PolarHBondContact O-N 3.17Å
380	K	90.1	Very high	89.8	Confident	127 Å²	127	67.1 Å²	67.1	55%	0.552	32%	0.322	S	S	*	.	H	α-helix	trans	-61.5	-38.1	174.3	-78.9	171.1	-176.4	175.7	0	112.6	G376 A377 G378 K384	G376-K380 WeakPolarHBondContact O-CB 3.39Å; G376-K380 WeakPolarHBondContact O-CG 3.39Å; G376-K380 PolarHBondContact O-N 3.39Å; A377-K380 PolarHBondContact O-N 2.98Å; G378-K380 PolarHBondContact O-N 2.89Å; K380-K384 WeakPolarHBondContact O-CG 3.37Å; K380-K384 PolarHBondContact O-N 3.22Å
381	V	90.7	Very high	89.5	Confident	99 Å²	99	69.3 Å²	69.3	60%	0.6	33%	0.326	S	S	*	.	H	α-helix	trans	-65.4	-47.1	175.3	173.5	0	0	0	0	110.5	A377 G378 L379 F383 K384 K385	A377-V381 WeakPolarHBondContact O-CG2 3.46Å; A377-V381 PolarHBondContact O-N 2.63Å; G378-V381 WeakPolarHBondContact O-CB 3.5Å; G378-V381 PolarHBondContact O-N 3.4Å; L379-V381 VanDerWaalsContact C-N 3.33Å; L379-V381 PolarHBondContact O-N 2.98Å; V381-F383 VanDerWaalsContact C-N 3.34Å; V381-F383 PolarHBondContact O-N 2.66Å; V381-K384 PolarHBondContact O-N 3.02Å; V381-K385 PolarHBondContact O-N 3.49Å
382	L	88.9	Confident	89.2	Confident	23 Å²	23	71.2 Å²	71.2	12%	0.12	33%	0.333	C	S	.	.	H	α-helix	trans	-60.2	-43.4	176	-67.9	179.8	0	0	0	111.6	I323 W327 G378 L379 K384 K385 T386	I323-L382 HydrophobicContact CG2-CB 4.23Å; I323-L382 HydrophobicContact CG2-CD2 4.38Å; W327-L382 HydrophobicContact CE3-CB 4.05Å; W327-L382 HydrophobicContact CE3-CD1 4.29Å; W327-L382 HydrophobicContact CZ3-CB 4.29Å; G378-L382 PolarHBondContact O-N 3.24Å; G378-L382 VanDerWaalsContact O-N 3.07Å; L379-L382 HydrophobicContact CD2-CD1 4.45Å; L379-L382 PolarHBondContact O-N 2.85Å; L382-K384 PolarHBondContact O-N 3.2Å; L382-K385 WeakPolarHBondContact O-CB 3.44Å; L382-K385 PolarHBondContact O-N 2.78Å; L382-K385 VanDerWaalsContact O-N 3.12Å; L382-T386 PolarHBondContact O-N 3.36Å; L382-T386 PolarHBondContact O-OG1 3.49Å
383	F	89.1	Confident	88.9	Confident	95 Å²	95	68.9 Å²	68.9	42%	0.417	32%	0.324	S	S	.	.	H	α-helix	trans	-61.2	-44.4	177.7	-174.5	-97.2	0	0	0	112.4	W327 L379 V381 K385 T386 H387	W327-F383 HydrophobicContact CZ3-CB 4.32Å; L379-F383 WeakPolarHBondContact O-CB 3.33Å; L379-F383 PolarHBondContact O-N 3.17Å; V381-F383 VanDerWaalsContact C-N 3.34Å; V381-F383 PolarHBondContact O-N 2.66Å; F383-K385 VanDerWaalsContact C-N 3.3Å; F383-K385 PolarHBondContact O-N 3.1Å; F383-T386 PolarHBondContact O-N 3.48Å; F383-H387 PolarHBondContact O-N 3.31Å
384	K	89.3	Confident	88.6	Confident	135 Å²	135	67.7 Å²	67.7	59%	0.587	32%	0.317	S	S	*	.	H	α-helix	trans	-60.7	-39.9	173.8	-74.8	178.8	-178.3	179.4	0	111.5	K380 V381 L382 H387 R388	K380-K384 WeakPolarHBondContact O-CG 3.37Å; K380-K384 PolarHBondContact O-N 3.22Å; V381-K384 PolarHBondContact O-N 3.02Å; L382-K384 PolarHBondContact O-N 3.2Å; K384-H387 PolarHBondContact O-N 3.29Å; K384-R388 WeakPolarHBondContact O-CG 3.45Å; K384-R388 PolarHBondContact O-N 3.01Å; K384-R388 VanDerWaalsContact O-N 3.14Å
385	K	90	Very high	88.2	Confident	104 Å²	104	69.3 Å²	69.3	45%	0.452	33%	0.329	S	S	.	.	H	α-helix	trans	-63.9	-47.5	175.8	-170.5	-178.7	177.3	-175.3	0	111.3	I323 V381 L382 F383 H387 R388 I389	I323-K385 HydrophobicContact CD1-CB 4.4Å; I323-K385 HydrophobicContact CD1-CD 3.84Å; I323-K385 HydrophobicContact CD1-CG 3.91Å; I323-K385 HydrophobicContact CG1-CD 4.34Å; V381-K385 PolarHBondContact O-N 3.49Å; L382-K385 WeakPolarHBondContact O-CB 3.44Å; L382-K385 PolarHBondContact O-N 2.78Å; L382-K385 VanDerWaalsContact O-N 3.12Å; F383-K385 VanDerWaalsContact C-N 3.3Å; F383-K385 PolarHBondContact O-N 3.1Å; K385-H387 VanDerWaalsContact C-N 3.34Å; K385-H387 PolarHBondContact O-N 3.15Å; K385-R388 WeakPolarHBondContact O-CB 3.2Å; K385-R388 PolarHBondContact O-N 3.03Å; K385-I389 HydrophobicContact CG-CD1 4.04Å; K385-I389 WeakPolarHBondContact O-CG1 3.47Å; K385-I389 PolarHBondContact O-N 3.41Å
386	T	88.8	Confident	87.5	Confident	4 Å²	4	70.4 Å²	70.4	3%	0.025	34%	0.335	C	S	.	.	H	α-helix	trans	-55.6	-48.1	174.5	-58.2	0	0	0	0	111.3	L320 I323 L382 F383 R388 I389 V390 L408	L320-T386 HydrophobicContact CD2-CG2 3.83Å; I323-T386 WeakPolarHBondContact CG2-OG1 3.4Å; L382-T386 PolarHBondContact O-N 3.36Å; L382-T386 PolarHBondContact O-OG1 3.49Å; F383-T386 PolarHBondContact O-N 3.48Å; T386-R388 VanDerWaalsContact C-N 3.3Å; T386-R388 PolarHBondContact O-N 3.34Å; T386-I389 PolarHBondContact O-N 3.18Å; T386-V390 HydrophobicContact CG2-CG2 4.21Å; T386-V390 WeakPolarHBondContact O-CB 3.5Å; T386-V390 VanDerWaalsContact O-CG2 3.3Å; T386-V390 WeakPolarHBondContact O-CG2 3.36Å; T386-V390 PolarHBondContact O-N 3.17Å; T386-L408 HydrophobicContact CG2-CD2 3.73Å
387	H	87.8	Confident	87.1	Confident	80 Å²	80	70.5 Å²	70.5	37%	0.37	33%	0.333	S	S	.	.	H	α-helix	trans	-62	-38	-179.7	-163.8	-32.7	0	0	0	112.1	F383 K384 K385 R391	F383-H387 PolarHBondContact O-N 3.31Å; K384-H387 PolarHBondContact O-N 3.29Å; K385-H387 VanDerWaalsContact C-N 3.34Å; K385-H387 PolarHBondContact O-N 3.15Å; H387-R391 VanDerWaalsContact CE1-CZ 3.49Å; H387-R391 PolarHBondContact CE1-NE 2.86Å; H387-R391 PolarHBondContact CE1-NH2 3.07Å; H387-R391 VanDerWaalsContact CE1-NH2 3.28Å; H387-R391 PolarHBondContact ND1-NE 3.27Å; H387-R391 WeakPolarHBondContact O-CG 3.33Å; H387-R391 PolarHBondContact O-N 3.44Å
388	R	88	Confident	86.6	Confident	152 Å²	152	74.1 Å²	74.1	57%	0.574	34%	0.339	S	S	*	.	H	α-helix	trans	-65	-44.9	175	-70.5	173.4	-171.5	170.6	2.1	111.6	K384 K385 T386 R391 R392	K384-R388 WeakPolarHBondContact O-CG 3.45Å; K384-R388 PolarHBondContact O-N 3.01Å; K384-R388 VanDerWaalsContact O-N 3.14Å; K385-R388 WeakPolarHBondContact O-CB 3.2Å; K385-R388 PolarHBondContact O-N 3.03Å; T386-R388 VanDerWaalsContact C-N 3.3Å; T386-R388 PolarHBondContact O-N 3.34Å; R388-R391 PolarHBondContact O-N 3.36Å; R388-R392 PolarHBondContact O-N 3.39Å
389	I	86.5	Confident	85.9	Confident	17 Å²	17	78.4 Å²	78.4	9%	0.087	35%	0.348	C	S	.	.	H	α-helix	trans	-63.8	-46.2	178.6	-68.9	164.4	0	0	0	110.6	M316 L320 I323 K385 T386 R391 R392 L393	M316-I389 HydrophobicContact CB-CG2 4.22Å; M316-I389 HydrophobicContact SD-CG1 4.45Å; M316-I389 HydrophobicContact SD-CG2 3.74Å; L320-I389 HydrophobicContact CD1-CG2 4.18Å; L320-I389 HydrophobicContact CD2-CB 4.05Å; L320-I389 HydrophobicContact CD2-CG2 3.67Å; L320-I389 HydrophobicContact CG-CG2 3.69Å; I323-I389 HydrophobicContact CD1-CD1 3.39Å; K385-I389 HydrophobicContact CG-CD1 4.04Å; K385-I389 WeakPolarHBondContact O-CG1 3.47Å; K385-I389 PolarHBondContact O-N 3.41Å; T386-I389 PolarHBondContact O-N 3.18Å; I389-R391 PolarHBondContact O-N 2.95Å; I389-R392 CarbonylContact O-C 3.55Å; I389-R392 PolarHBondContact O-N 3.04Å; I389-R392 VanDerWaalsContact O-N 3.09Å; I389-L393 WeakPolarHBondContact O-CB 3.49Å; I389-L393 PolarHBondContact O-N 2.87Å
390	V	88.1	Confident	85.4	Confident	13 Å²	13	79 Å²	79	8%	0.079	35%	0.353	C	S	.	.	H	α-helix	trans	-60.1	-43.7	177.4	170.6	0	0	0	0	111.2	L320 T386 R392 L393 F394 F406 L408	L320-V390 HydrophobicContact CD1-CG2 4.33Å; L320-V390 HydrophobicContact CD2-CG2 4.11Å; T386-V390 HydrophobicContact CG2-CG2 4.21Å; T386-V390 WeakPolarHBondContact O-CB 3.5Å; T386-V390 VanDerWaalsContact O-CG2 3.3Å; T386-V390 WeakPolarHBondContact O-CG2 3.36Å; T386-V390 PolarHBondContact O-N 3.17Å; V390-R392 VanDerWaalsContact C-N 3.32Å; V390-R392 PolarHBondContact O-N 3.5Å; V390-L393 PolarHBondContact O-N 3.37Å; V390-F394 HydrophobicContact CG1-CD2 3.61Å; V390-F394 HydrophobicContact CG1-CE2 3.42Å; V390-F394 VanDerWaalsContact CG1-CE2 3.42Å; V390-F394 WeakPolarHBondContact O-CD2 3.33Å; V390-F394 PolarHBondContact O-N 2.96Å; V390-F406 HydrophobicContact CG1-CE1 4.46Å; V390-F406 HydrophobicContact CG1-CE2 4.14Å; V390-F406 HydrophobicContact CG1-CZ 4.11Å; V390-F406 HydrophobicContact CG2-CD2 4.12Å; V390-F406 HydrophobicContact CG2-CE2 4.47Å; V390-F406 HydrophobicContact CG2-CG 4.39Å; V390-L408 HydrophobicContact CG2-CD2 4.4Å
391	R	86.3	Confident	84.5	Confident	156 Å²	156	80 Å²	80	59%	0.589	36%	0.359	S	S	*	.	H	α-helix	trans	-59.1	-43.1	173.7	-77.6	179.9	-175	167.7	11.1	111.9	H387 R388 I389 F394 N395	H387-R391 VanDerWaalsContact CE1-CZ 3.49Å; H387-R391 PolarHBondContact CE1-NE 2.86Å; H387-R391 PolarHBondContact CE1-NH2 3.07Å; H387-R391 VanDerWaalsContact CE1-NH2 3.28Å; H387-R391 PolarHBondContact ND1-NE 3.27Å; H387-R391 WeakPolarHBondContact O-CG 3.33Å; H387-R391 PolarHBondContact O-N 3.44Å; R388-R391 PolarHBondContact O-N 3.36Å; I389-R391 PolarHBondContact O-N 2.95Å; R391-F394 PolarHBondContact O-N 2.81Å; R391-N395 PolarHBondContact O-N 2.89Å
392	R	84.2	Confident	83.8	Confident	116 Å²	116	78.8 Å²	78.8	44%	0.438	34%	0.343	S	S	.	.	H	α-helix	trans	-66.4	-41	177.9	-170.6	164.4	165.6	-172	0.4	111.6	M316 R388 I389 V390 N395 L396	M316-R392 HydrophobicContact CE-CB 4.29Å; M316-R392 HydrophobicContact CE-CG 3.71Å; M316-R392 VanDerWaalsContact CE-CZ 3.43Å; R388-R392 PolarHBondContact O-N 3.39Å; I389-R392 CarbonylContact O-C 3.55Å; I389-R392 PolarHBondContact O-N 3.04Å; I389-R392 VanDerWaalsContact O-N 3.09Å; V390-R392 VanDerWaalsContact C-N 3.32Å; V390-R392 PolarHBondContact O-N 3.5Å; R392-N395 WeakPolarHBondContact O-CB 3.34Å; R392-N395 PolarHBondContact O-N 3.19Å; R392-L396 HydrophobicContact CG-CD1 4.46Å; R392-L396 WeakPolarHBondContact O-CG 3.3Å; R392-L396 PolarHBondContact O-N 3.39Å
393	L	85.4	Confident	83.1	Confident	0 Å²	0	85.6 Å²	85.6	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-60.3	-45.2	175	-175.1	65.9	0	0	0	111.4	I313 M316 L320 I389 V390 N395 L396 C397 P404	I313-L393 HydrophobicContact CB-CD1 4.49Å; I313-L393 HydrophobicContact CG1-CD1 4.42Å; I313-L393 HydrophobicContact CG2-CD1 4.06Å; M316-L393 HydrophobicContact CB-CD1 4.03Å; L320-L393 HydrophobicContact CD1-CD2 4.14Å; I389-L393 WeakPolarHBondContact O-CB 3.49Å; I389-L393 PolarHBondContact O-N 2.87Å; V390-L393 PolarHBondContact O-N 3.37Å; L393-N395 VanDerWaalsContact C-N 3.32Å; L393-N395 PolarHBondContact O-N 3.14Å; L393-L396 PolarHBondContact O-N 3.36Å; L393-C397 WeakPolarHBondContact O-CB 3.41Å; L393-C397 PolarHBondContact O-N 3.38Å; L393-C397 PolarHBondContact O-SG 3.3Å; L393-C397 VanDerWaalsContact O-SG 3.4Å; L393-P404 HydrophobicContact CD1-CB 4.43Å; L393-P404 HydrophobicContact CD2-CB 3.5Å; L393-P404 HydrophobicContact CG-CB 3.74Å
394	F	83.9	Confident	82.4	Confident	102 Å²	102	82.4 Å²	82.4	45%	0.447	36%	0.363	S	S	.	.	H	α-helix	trans	-62	-38.2	174	-83.4	-66	0	0	0	112.9	V390 R391 C397 K398 P404 F406	V390-F394 HydrophobicContact CG1-CD2 3.61Å; V390-F394 HydrophobicContact CG1-CE2 3.42Å; V390-F394 VanDerWaalsContact CG1-CE2 3.42Å; V390-F394 WeakPolarHBondContact O-CD2 3.33Å; V390-F394 PolarHBondContact O-N 2.96Å; R391-F394 PolarHBondContact O-N 2.81Å; F394-C397 PolarHBondContact O-N 3.33Å; F394-K398 PolarHBondContact O-N 3.46Å; F394-P404 HydrophobicContact CD1-CG 4.32Å; F394-P404 HydrophobicContact CE1-CG 4.03Å; F394-F406 AromaticContact CE2-CE1 3.79Å; F394-F406 HydrophobicContact CE2-CE1 3.79Å; F394-F406 AromaticContact CE2-CZ 3.77Å; F394-F406 HydrophobicContact CE2-CZ 3.77Å; F394-F406 AromaticContact CZ-CE1 3.57Å; F394-F406 HydrophobicContact CZ-CE1 3.57Å; F394-F406 AromaticContact CZ-CZ 3.75Å; F394-F406 HydrophobicContact CZ-CZ 3.75Å
395	N	81.9	Confident	81.6	Confident	122 Å²	122	86.3 Å²	86.3	65%	0.652	37%	0.374	S	S	*	.	H	α-helix	trans	-65.3	-41.2	175.2	-72.6	-17.6	0	0	0	111.9	R391 R392 L393 K398	R391-N395 PolarHBondContact O-N 2.89Å; R392-N395 WeakPolarHBondContact O-CB 3.34Å; R392-N395 PolarHBondContact O-N 3.19Å; L393-N395 VanDerWaalsContact C-N 3.32Å; L393-N395 PolarHBondContact O-N 3.14Å; N395-K398 WeakPolarHBondContact O-CB 3.28Å; N395-K398 PolarHBondContact O-N 3.02Å
396	L	78	Confident	80.8	Confident	39 Å²	39	84.8 Å²	84.8	20%	0.204	37%	0.368	C	S	.	.	H	α-helix	trans	-65.6	-39.1	175.5	-66.8	170.3	0	0	0	111.6	P309 D312 I313 M316 R392 L393 K398	P309-L396 HydrophobicContact CG-CB 4.3Å; P309-L396 HydrophobicContact CG-CD2 3.89Å; D312-L396 HydrophobicContact CB-CD1 4.19Å; I313-L396 HydrophobicContact CG1-CB 4.34Å; M316-L396 HydrophobicContact CG-CD1 4.3Å; R392-L396 HydrophobicContact CG-CD1 4.46Å; R392-L396 WeakPolarHBondContact O-CG 3.3Å; R392-L396 PolarHBondContact O-N 3.39Å; L393-L396 PolarHBondContact O-N 3.36Å; L396-K398 VanDerWaalsContact C-N 3.35Å; L396-K398 PolarHBondContact O-N 2.89Å
397	C	81.3	Confident	80.2	Confident	12 Å²	12	94.8 Å²	94.8	8%	0.081	41%	0.405	C	S	.	.	H	α-helix	trans	-82.2	-3.1	-179.9	-67.1	0	0	0	0	114.4	L393 F394 R399 C400	L393-C397 WeakPolarHBondContact O-CB 3.41Å; L393-C397 PolarHBondContact O-N 3.38Å; L393-C397 PolarHBondContact O-SG 3.3Å; L393-C397 VanDerWaalsContact O-SG 3.4Å; F394-C397 PolarHBondContact O-N 3.33Å; C397-R399 PolarHBondContact O-N 3.11Å; C397-C400 PolarHBondContact O-N 2.88Å
398	K	78.8	Confident	79.7	Confident	132 Å²	132	95.6 Å²	95.6	57%	0.574	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-34.4	-172.9	-174.8	-172.2	178.7	-163.9	0	113.9	D294 F394 N395 L396	D294-K398 IonicContact OD2-NZ 2.87Å; D294-K398 PolarHBondContact OD2-NZ 3.48Å; F394-K398 PolarHBondContact O-N 3.46Å; N395-K398 WeakPolarHBondContact O-CB 3.28Å; N395-K398 PolarHBondContact O-N 3.02Å; L396-K398 VanDerWaalsContact C-N 3.35Å; L396-K398 PolarHBondContact O-N 2.89Å
399	R	76.9	Confident	79.3	Confident	113 Å²	113	89.5 Å²	89.5	43%	0.426	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	14.7	-178.2	-56.8	-64.3	-171.6	178	1.2	112.6	D294 W296 N307 C397	D294-R399 IonicContact OD2-CZ 2.93Å; D294-R399 IonicContact OD2-NE 2.85Å; D294-R399 IonicContact OD2-NH2 2.67Å; D294-R399 PolarHBondContact OD2-NH2 3.1Å; W296-R399 HydrophobicContact CB-CG 4.43Å; N307-R399 HydrophobicContact CB-CB 4.16Å; C397-R399 PolarHBondContact O-N 3.11Å
400	C	78.7	Confident	78.9	Confident	19 Å²	19	97.5 Å²	97.5	13%	0.128	43%	0.426	C	S	.	.			trans	-102.8	146.4	-179.5	-173.1	0	0	0	0	110.4	C308 C397 R402	C308-C400 HydrophobicContact CB-CB 4.05Å; C308-C400 WeakPolarHBondContact CB-SG 3.37Å; C308-C400 WeakPolarHBondContact SG-CA 3.44Å; C308-C400 WeakPolarHBondContact SG-CB 3.5Å; C308-C400 CovalentContact SG-SG 2.02Å; C308-C400 PolarHBondContact SG-SG 3.2Å; C397-C400 PolarHBondContact O-N 2.88Å; C400-R402 VanDerWaalsContact C-N 3.31Å; C400-R402 WeakPolarHBondContact SG-CB 3.35Å; C400-R402 PolarHBondContact SG-N 3.48Å; C400-R402 VanDerWaalsContact SG-N 3.42Å
401	H	72.8	Confident	78.5	Confident	148 Å²	148	101.9 Å²	101.9	69%	0.685	45%	0.446	S	S	*	.	S	Bend	trans	-78.7	-18.5	174.9	-66	92.8	0	0	0	112.5	P304 Q403	P304-H401 PolarHBondContact O-ND1 3.31Å; H401-Q403 PolarHBondContact O-N 3.26Å
402	R	75.3	Confident	78.3	Confident	72 Å²	72	97.9 Å²	97.9	27%	0.272	43%	0.43	S	S	.	.	S	Bend	trans	-70.3	123.1	178.8	-172.8	173.7	169.8	171.4	-3.6	111.1	D310 E317 C400	D310-R402 IonicContact OD1-NH1 3.8Å; D310-R402 PolarHBondContact OD1-NH1 3.35Å; E317-R402 IonicContact OE1-NH2 2.87Å; E317-R402 IonicContact OE2-CZ 3.05Å; E317-R402 IonicContact OE2-NH2 3.85Å; E317-R402 PolarHBondContact OE2-NH2 3.1Å; C400-R402 VanDerWaalsContact C-N 3.31Å; C400-R402 WeakPolarHBondContact SG-CB 3.35Å; C400-R402 PolarHBondContact SG-N 3.48Å; C400-R402 VanDerWaalsContact SG-N 3.42Å
403	Q	74.1	Confident	78.4	Confident	166 Å²	166	95.3 Å²	95.3	78%	0.776	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-80.3	124.6	173.8	-67.4	-175.9	-0.1	0	0	110.2	H401 R405	H401-Q403 PolarHBondContact O-N 3.26Å; Q403-R405 PolarHBondContact O-N 2.98Å
404	P	73.6	Confident	78.5	Confident	28 Å²	28	98.3 Å²	98.3	18%	0.182	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-65.7	130	178.7	25.4	-32.3	0	0	0	110.5	L393 F394 F406	L393-P404 HydrophobicContact CD1-CB 4.43Å; L393-P404 HydrophobicContact CD2-CB 3.5Å; L393-P404 HydrophobicContact CG-CB 3.74Å; F394-P404 HydrophobicContact CD1-CG 4.32Å; F394-P404 HydrophobicContact CE1-CG 4.03Å; P404-F406 HydrophobicContact CB-CD1 4.42Å
405	R	73.5	Confident	78.6	Confident	217 Å²	217	96 Å²	96	82%	0.819	44%	0.443	S	S	*	.			trans	-99.4	111.4	176.8	-68.7	-177.3	178.7	174.9	1.2	109.3	Q403	Q403-R405 PolarHBondContact O-N 2.98Å
406	F	73.8	Confident	79	Confident	73 Å²	73	94.3 Å²	94.3	32%	0.32	43%	0.428	S	S	.	.			trans	-140.4	147.4	174.8	64.5	-84.5	0	0	0	111.1	L320 V390 F394 P404 L408	L320-F406 HydrophobicContact CD1-CB 3.87Å; V390-F406 HydrophobicContact CG1-CE1 4.46Å; V390-F406 HydrophobicContact CG1-CE2 4.14Å; V390-F406 HydrophobicContact CG1-CZ 4.11Å; V390-F406 HydrophobicContact CG2-CD2 4.12Å; V390-F406 HydrophobicContact CG2-CE2 4.47Å; V390-F406 HydrophobicContact CG2-CG 4.39Å; F394-F406 AromaticContact CE2-CE1 3.79Å; F394-F406 HydrophobicContact CE2-CE1 3.79Å; F394-F406 AromaticContact CE2-CZ 3.77Å; F394-F406 HydrophobicContact CE2-CZ 3.77Å; F394-F406 AromaticContact CZ-CE1 3.57Å; F394-F406 HydrophobicContact CZ-CE1 3.57Å; F394-F406 AromaticContact CZ-CZ 3.75Å; F394-F406 HydrophobicContact CZ-CZ 3.75Å; P404-F406 HydrophobicContact CB-CD1 4.42Å; F406-L408 HydrophobicContact CD2-CD2 4.41Å; F406-L408 HydrophobicContact CD2-CG 4.04Å; F406-L408 HydrophobicContact CE2-CD1 4.15Å; F406-L408 HydrophobicContact CE2-CG 4.01Å
407	R	75.4	Confident	79.5	Confident	214 Å²	214	92.5 Å²	92.5	81%	0.808	42%	0.418	S	S	*	.			trans	-116.2	120.3	168	-69.2	-176.1	-178.6	-178.8	1.6	107.4
408	L	77.5	Confident	79.9	Confident	97 Å²	97	94.5 Å²	94.5	51%	0.508	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-74.2	127.3	175	-72.7	166.6	0	0	0	108.6	T386 V390 F406 K410	T386-L408 HydrophobicContact CG2-CD2 3.73Å; V390-L408 HydrophobicContact CG2-CD2 4.4Å; F406-L408 HydrophobicContact CD2-CD2 4.41Å; F406-L408 HydrophobicContact CD2-CG 4.04Å; F406-L408 HydrophobicContact CE2-CD1 4.15Å; F406-L408 HydrophobicContact CE2-CG 4.01Å; L408-K410 PolarHBondContact O-N 3.04Å
409	P	78.4	Confident	80.3	Confident	23 Å²	23	91.4 Å²	91.4	15%	0.149	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-62.8	131.5	171.7	24.3	-29.5	0	0	0	108.9	W327	W327-P409 HydrophobicContact CD2-CB 3.58Å; W327-P409 HydrophobicContact CD2-CG 4.1Å; W327-P409 HydrophobicContact CE3-CB 3.9Å; W327-P409 HydrophobicContact CE3-CG 3.88Å; W327-P409 HydrophobicContact CG-CB 3.91Å; W327-P409 HydrophobicContact CH2-CB 4.46Å; W327-P409 HydrophobicContact CZ2-CB 4.18Å; W327-P409 HydrophobicContact CZ3-CB 4.33Å; W327-P409 HydrophobicContact CZ3-CG 4.17Å
410	K	79.9	Confident	80.9	Confident	186 Å²	186	88.4 Å²	88.4	81%	0.809	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-93.4	131.4	176.9	-170.5	177.8	177.2	-176.1	0	109	L408 R412	L408-K410 PolarHBondContact O-N 3.04Å; K410-R412 PolarHBondContact O-N 2.81Å
411	E	78.1	Confident	81.3	Confident	105 Å²	105	87.5 Å²	87.5	49%	0.491	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-63.7	131.6	172.5	-165.1	168.3	-171.5	0	0	110.2
412	R	83.4	Confident	82	Confident	71 Å²	71	80.5 Å²	80.5	27%	0.268	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-79.9	118	176.9	-71.8	170.1	172.2	-164.8	1.9	107.8	K410 Y416	K410-R412 PolarHBondContact O-N 2.81Å; R412-Y416 HydrophobicContact CB-CD1 3.71Å; R412-Y416 HydrophobicContact CB-CE1 4.37Å; R412-Y416 HydrophobicContact CB-CG 4.08Å; R412-Y416 HydrophobicContact CG-CD1 3.69Å; R412-Y416 HydrophobicContact CG-CE1 3.89Å; R412-Y416 HydrophobicContact CG-CG 4.07Å; R412-Y416 PolarHBondContact NH1-OH 3.47Å; R412-Y416 PolarHBondContact NH2-OH 3.32Å
413	S	86.4	Confident	82.6	Confident	63 Å²	63	77.2 Å²	77.2	44%	0.441	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-65	162.6	174.5	52.7	0	0	0	0	111.2	S415 Y416	S413-S415 PolarHBondContact O-N 3.03Å; S413-S415 PolarHBondContact OG-OG 3.12Å; S413-Y416 WeakPolarHBondContact O-CB 3.36Å; S413-Y416 PolarHBondContact O-N 3.42Å
414	L	86.6	Confident	83.2	Confident	62 Å²	62	71.9 Å²	71.9	33%	0.325	33%	0.329	S	S	.	.	H	α-helix	trans	-56.1	-38.4	172.6	-75.2	169.6	0	0	0	112.2	W362 Y372 Y416 W417 W418	W362-L414 HydrophobicContact CZ2-CD2 4.28Å; Y372-L414 HydrophobicContact CD1-CD2 4.1Å; Y372-L414 HydrophobicContact CE1-CD2 3.57Å; Y372-L414 HydrophobicContact CE1-CG 4.19Å; Y372-L414 HydrophobicContact CE2-CD2 4.13Å; L414-Y416 VanDerWaalsContact C-N 3.25Å; L414-Y416 PolarHBondContact O-N 3.27Å; L414-W417 PolarHBondContact O-N 2.89Å; L414-W418 HydrophobicContact CB-CH2 4Å; L414-W418 HydrophobicContact CB-CZ2 3.69Å; L414-W418 HydrophobicContact CD1-CZ2 4.33Å; L414-W418 HydrophobicContact CG-CZ2 4.48Å; L414-W418 PolarHBondContact O-N 3.28Å
415	S	87.1	Confident	83.7	Confident	54 Å²	54	72.9 Å²	72.9	38%	0.378	33%	0.332	S	S	.	.	H	α-helix	trans	-58.2	-34.7	174.9	56	0	0	0	0	113.7	S413 W417 N419	S413-S415 PolarHBondContact O-N 3.03Å; S413-S415 PolarHBondContact OG-OG 3.12Å; S415-W417 VanDerWaalsContact C-N 3.31Å; S415-W417 PolarHBondContact O-N 3.24Å; S415-N419 WeakPolarHBondContact O-CB 3.42Å; S415-N419 PolarHBondContact O-N 3.01Å; S415-N419 PolarHBondContact O-OD1 2.63Å
416	Y	88.7	Confident	84.2	Confident	87 Å²	87	63 Å²	63	34%	0.341	30%	0.295	S	S	.	.	H	α-helix	trans	-63.2	-40.9	174.6	172.1	-86.3	0	0	0	111.2	R412 S413 L414 N419 R420	R412-Y416 HydrophobicContact CB-CD1 3.71Å; R412-Y416 HydrophobicContact CB-CE1 4.37Å; R412-Y416 HydrophobicContact CB-CG 4.08Å; R412-Y416 HydrophobicContact CG-CD1 3.69Å; R412-Y416 HydrophobicContact CG-CE1 3.89Å; R412-Y416 HydrophobicContact CG-CG 4.07Å; R412-Y416 PolarHBondContact NH1-OH 3.47Å; R412-Y416 PolarHBondContact NH2-OH 3.32Å; S413-Y416 WeakPolarHBondContact O-CB 3.36Å; S413-Y416 PolarHBondContact O-N 3.42Å; L414-Y416 VanDerWaalsContact C-N 3.25Å; L414-Y416 PolarHBondContact O-N 3.27Å; Y416-N419 PolarHBondContact O-N 3.45Å; Y416-R420 HydrophobicContact CE1-CB 4.5Å; Y416-R420 WeakPolarHBondContact O-CB 3.07Å; Y416-R420 PolarHBondContact O-N 3.14Å
417	W	89.6	Confident	84.6	Confident	1 Å²	1	59.5 Å²	59.5	0%	0.004	28%	0.28	C	S	.	.	H	α-helix	trans	-71.8	-37.4	-179.6	-68.9	109.5	0	0	0	112.5	N331 F334 E335 F340 W362 Y372 L375 L414 S415 R420 I421	N331-W417 HydrophobicContact CB-CH2 4.21Å; N331-W417 HydrophobicContact CB-CZ2 4.44Å; N331-W417 WeakPolarHBondContact OD1-CZ2 3.47Å; F334-W417 HydrophobicContact CD1-CD2 4.31Å; F334-W417 HydrophobicContact CD1-CE3 4.08Å; F334-W417 AromaticContact CD1-CH2 3.63Å; F334-W417 HydrophobicContact CD1-CH2 3.63Å; F334-W417 AromaticContact CD1-CZ2 3.88Å; F334-W417 HydrophobicContact CD1-CZ2 3.88Å; F334-W417 AromaticContact CD1-CZ3 3.75Å; F334-W417 HydrophobicContact CD1-CZ3 3.75Å; F334-W417 HydrophobicContact CE1-CD2 4.06Å; F334-W417 HydrophobicContact CE1-CE3 4.02Å; F334-W417 HydrophobicContact CE1-CH2 4.34Å; F334-W417 HydrophobicContact CE1-CZ2 4.38Å; F334-W417 HydrophobicContact CE1-CZ3 4.17Å; E335-W417 HydrophobicContact CB-CZ3 4.37Å; F340-W417 HydrophobicContact CE2-CE3 4.3Å; W362-W417 HydrophobicContact CH2-CB 4.12Å; W362-W417 HydrophobicContact CZ3-CB 4.24Å; Y372-W417 AromaticContact CE2-CD1 3.8Å; Y372-W417 AromaticContact CE2-NE1 3.75Å; L375-W417 HydrophobicContact CD2-CZ2 4.02Å; L414-W417 PolarHBondContact O-N 2.89Å; S415-W417 VanDerWaalsContact C-N 3.31Å; S415-W417 PolarHBondContact O-N 3.24Å; W417-R420 WeakPolarHBondContact O-CB 3.29Å; W417-R420 PolarHBondContact O-N 3.46Å; W417-I421 WeakPolarHBondContact O-CG1 3.38Å; W417-I421 PolarHBondContact O-N 2.91Å
418	W	89.4	Confident	84.6	Confident	53 Å²	53	51.5 Å²	51.5	20%	0.201	26%	0.263	C	S	.	.	H	α-helix	trans	-63.5	-43.9	172.9	-55.4	-30.9	0	0	0	111.6	I358 S359 W362 L414 R420 I421 Q422	I358-W418 HydrophobicContact CG2-CB 4.18Å; I358-W418 HydrophobicContact CG2-CG 4.25Å; S359-W418 VanDerWaalsContact CB-CZ2 3.44Å; W362-W418 AromaticContact CD2-NE1 3.99Å; W362-W418 AromaticContact CG-NE1 3.93Å; L414-W418 HydrophobicContact CB-CH2 4Å; L414-W418 HydrophobicContact CB-CZ2 3.69Å; L414-W418 HydrophobicContact CD1-CZ2 4.33Å; L414-W418 HydrophobicContact CG-CZ2 4.48Å; L414-W418 PolarHBondContact O-N 3.28Å; W418-R420 VanDerWaalsContact C-N 3.27Å; W418-R420 PolarHBondContact O-N 3.32Å; W418-I421 WeakPolarHBondContact O-CB 3.36Å; W418-I421 PolarHBondContact O-N 3.48Å; W418-I421 VanDerWaalsContact O-N 3.17Å; W418-Q422 PolarHBondContact O-N 3.37Å
419	N	87.9	Confident	84.1	Confident	68 Å²	68	53.5 Å²	53.5	36%	0.364	27%	0.27	S	S	.	.	H	α-helix	trans	-65.7	-33.3	174.9	-65	3.7	0	0	0	111.5	S415 Y416 Q422 S423	S415-N419 WeakPolarHBondContact O-CB 3.42Å; S415-N419 PolarHBondContact O-N 3.01Å; S415-N419 PolarHBondContact O-OD1 2.63Å; Y416-N419 PolarHBondContact O-N 3.45Å; N419-Q422 PolarHBondContact O-N 3.18Å; N419-S423 WeakPolarHBondContact O-CB 3.21Å; N419-S423 PolarHBondContact O-N 3.29Å; N419-S423 PolarHBondContact O-OG 3.44Å
420	R	87.8	Confident	83.3	Confident	49 Å²	49	53.6 Å²	53.6	19%	0.185	27%	0.272	C	S	.	.	H	α-helix	trans	-65.8	-38.8	173.6	-176.6	57.6	172.4	-174.5	1.5	111.8	E335 Y416 W417 W418 S423 L424	E335-R420 IonicContact OE1-CZ 3Å; E335-R420 IonicContact OE1-NE 3.07Å; E335-R420 PolarHBondContact OE1-NE 2.82Å; E335-R420 IonicContact OE1-NH2 3.94Å; E335-R420 PolarHBondContact OE1-NH2 3.34Å; E335-R420 IonicContact OE2-NE 3.53Å; E335-R420 IonicContact OE2-NH2 3.77Å; Y416-R420 HydrophobicContact CE1-CB 4.5Å; Y416-R420 WeakPolarHBondContact O-CB 3.07Å; Y416-R420 PolarHBondContact O-N 3.14Å; W417-R420 WeakPolarHBondContact O-CB 3.29Å; W417-R420 PolarHBondContact O-N 3.46Å; W418-R420 VanDerWaalsContact C-N 3.27Å; W418-R420 PolarHBondContact O-N 3.32Å; R420-S423 WeakPolarHBondContact O-CB 3.49Å; R420-S423 PolarHBondContact O-N 2.82Å; R420-L424 WeakPolarHBondContact O-CG 3.35Å; R420-L424 PolarHBondContact O-N 3.41Å
421	I	88.8	Confident	82.4	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-62	-48.6	172.4	-72.6	166.8	0	0	0	110.2	F340 L343 L344 L347 I358 W362 W417 W418 S423 L424 L425	F340-I421 HydrophobicContact CE2-CD1 4.03Å; F340-I421 HydrophobicContact CE2-CG1 3.87Å; F340-I421 HydrophobicContact CZ-CD1 4.29Å; F340-I421 HydrophobicContact CZ-CG1 3.62Å; L343-I421 HydrophobicContact CD2-CD1 3.83Å; L344-I421 HydrophobicContact CD2-CB 4.38Å; L344-I421 HydrophobicContact CD2-CG1 4.24Å; L344-I421 HydrophobicContact CD2-CG2 3.82Å; L347-I421 HydrophobicContact CD1-CG2 3.6Å; I358-I421 HydrophobicContact CD1-CG2 4.03Å; I358-I421 HydrophobicContact CG1-CG2 4.49Å; I358-I421 HydrophobicContact CG2-CB 4.31Å; I358-I421 HydrophobicContact CG2-CD1 3.88Å; I358-I421 HydrophobicContact CG2-CG2 4.07Å; W362-I421 HydrophobicContact CE3-CD1 3.78Å; W362-I421 HydrophobicContact CZ3-CD1 3.73Å; W417-I421 WeakPolarHBondContact O-CG1 3.38Å; W417-I421 PolarHBondContact O-N 2.91Å; W418-I421 WeakPolarHBondContact O-CB 3.36Å; W418-I421 PolarHBondContact O-N 3.48Å; W418-I421 VanDerWaalsContact O-N 3.17Å; I421-S423 VanDerWaalsContact C-N 3.28Å; I421-S423 PolarHBondContact O-N 3.44Å; I421-L424 PolarHBondContact O-N 3.5Å; I421-L425 HydrophobicContact CG2-CD1 3.94Å; I421-L425 HydrophobicContact CG2-CG 4.43Å; I421-L425 WeakPolarHBondContact O-CG 3.42Å; I421-L425 PolarHBondContact O-N 2.79Å
422	Q	87.6	Confident	81.8	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-58.3	-41	176	-69.6	179.8	-45.2	0	0	112.2	L353 I358 W418 N419 L424 L425 Y426 F436	L353-Q422 PolarHBondContact O-NE2 3.19Å; L353-Q422 VanDerWaalsContact O-NE2 3.08Å; I358-Q422 HydrophobicContact CD1-CG 3.27Å; W418-Q422 PolarHBondContact O-N 3.37Å; N419-Q422 PolarHBondContact O-N 3.18Å; Q422-L424 VanDerWaalsContact C-N 3.34Å; Q422-L424 PolarHBondContact O-N 2.78Å; Q422-L425 PolarHBondContact O-N 2.91Å; Q422-Y426 HydrophobicContact CB-CD2 4.26Å; Q422-Y426 HydrophobicContact CB-CE2 4.45Å; Q422-Y426 HydrophobicContact CG-CE2 4.48Å; Q422-Y426 WeakPolarHBondContact O-CD2 3.48Å; Q422-Y426 PolarHBondContact O-N 2.73Å; Q422-F436 HydrophobicContact CB-CB 4.14Å; Q422-F436 HydrophobicContact CB-CD1 3.89Å; Q422-F436 HydrophobicContact CB-CG 4.27Å; Q422-F436 HydrophobicContact CG-CD1 4.48Å
423	S	87.3	Confident	81	Confident	4 Å²	4	50.2 Å²	50.2	3%	0.028	27%	0.273	C	S	.	.	H	α-helix	trans	-59.6	-40.4	173.1	-85.9	0	0	0	0	113.5	N419 R420 I421 C427 G434 T435 F436	N419-S423 WeakPolarHBondContact O-CB 3.21Å; N419-S423 PolarHBondContact O-N 3.29Å; N419-S423 PolarHBondContact O-OG 3.44Å; R420-S423 WeakPolarHBondContact O-CB 3.49Å; R420-S423 PolarHBondContact O-N 2.82Å; I421-S423 VanDerWaalsContact C-N 3.28Å; I421-S423 PolarHBondContact O-N 3.44Å; S423-C427 CarbonylContact O-C 3.54Å; S423-C427 VanDerWaalsContact O-C 3.31Å; S423-C427 VanDerWaalsContact O-CA 3.24Å; S423-C427 WeakPolarHBondContact O-CA 3.34Å; S423-C427 VanDerWaalsContact O-CB 3.27Å; S423-C427 WeakPolarHBondContact O-CB 3.27Å; S423-C427 PolarHBondContact O-N 3.32Å; S423-G434 WeakPolarHBondContact CB-O 3.44Å; S423-G434 PolarHBondContact OG-O 3.08Å; S423-T435 WeakPolarHBondContact OG-CA 2.99Å; S423-F436 PolarHBondContact OG-N 3.22Å; S423-F436 VanDerWaalsContact OG-N 3.14Å
424	L	86.1	Confident	80.6	Confident	54 Å²	54	47.3 Å²	47.3	28%	0.283	25%	0.252	S	S	.	.	H	α-helix	trans	-72	-32	178.3	-70.3	171.4	0	0	0	112	F340 L344 R420 I421 Q422 P433	F340-L424 HydrophobicContact CE1-CD1 3.83Å; F340-L424 HydrophobicContact CZ-CD1 4.3Å; L344-L424 HydrophobicContact CD1-CD1 3.9Å; L344-L424 HydrophobicContact CD2-CB 4.48Å; R420-L424 WeakPolarHBondContact O-CG 3.35Å; R420-L424 PolarHBondContact O-N 3.41Å; I421-L424 PolarHBondContact O-N 3.5Å; Q422-L424 VanDerWaalsContact C-N 3.34Å; Q422-L424 PolarHBondContact O-N 2.78Å; L424-P433 HydrophobicContact CD2-CB 4.5Å
425	L	83.9	Confident	80.5	Confident	49 Å²	49	48.4 Å²	48.4	26%	0.257	26%	0.262	S	S	.	.	H	α-helix	trans	-74.5	-46	177	-67.4	171.4	0	0	0	112.4	L344 L347 L353 I421 Q422	L344-L425 HydrophobicContact CD2-CD2 4.49Å; L347-L425 HydrophobicContact CD1-CD1 4Å; L353-L425 HydrophobicContact CD1-CD1 4.44Å; I421-L425 HydrophobicContact CG2-CD1 3.94Å; I421-L425 HydrophobicContact CG2-CG 4.43Å; I421-L425 WeakPolarHBondContact O-CG 3.42Å; I421-L425 PolarHBondContact O-N 2.79Å; Q422-L425 PolarHBondContact O-N 2.91Å
426	Y	84.9	Confident	80.3	Confident	9 Å²	9	46.5 Å²	46.5	4%	0.035	25%	0.247	C	C	.	.	H	α-helix	trans	-109.6	-17.5	-167.6	-53.6	-48.2	0	0	0	114.4	F352 L353 Q422 F436 C443 G454 I456 P457	F352-Y426 HydrophobicContact CD2-CE1 4.39Å; F352-Y426 AromaticContact CD2-CE2 3.73Å; F352-Y426 HydrophobicContact CD2-CE2 3.73Å; F352-Y426 AromaticContact CD2-CZ 3.64Å; F352-Y426 HydrophobicContact CE2-CD2 4.16Å; F352-Y426 AromaticContact CE2-CE2 3.51Å; F352-Y426 HydrophobicContact CE2-CE2 3.51Å; F352-Y426 AromaticContact CE2-CZ 3.94Å; L353-Y426 PolarHBondContact N-OH 2.96Å; Q422-Y426 HydrophobicContact CB-CD2 4.26Å; Q422-Y426 HydrophobicContact CB-CE2 4.45Å; Q422-Y426 HydrophobicContact CG-CE2 4.48Å; Q422-Y426 WeakPolarHBondContact O-CD2 3.48Å; Q422-Y426 PolarHBondContact O-N 2.73Å; Y426-F436 HydrophobicContact CD2-CD1 4.24Å; Y426-F436 HydrophobicContact CD2-CD2 4.09Å; Y426-F436 HydrophobicContact CD2-CE1 4.14Å; Y426-F436 AromaticContact CD2-CE2 4Å; Y426-F436 HydrophobicContact CD2-CE2 4Å; Y426-F436 HydrophobicContact CD2-CG 4.21Å; Y426-F436 HydrophobicContact CD2-CZ 4.02Å; Y426-F436 HydrophobicContact CG-CD2 4.4Å; Y426-F436 HydrophobicContact CG-CE2 4.3Å; Y426-C443 PolarHBondContact O-SG 3.02Å; Y426-G454 WeakPolarHBondContact O-CA 3.13Å; Y426-G454 PolarHBondContact O-N 2.91Å; Y426-I456 HydrophobicContact CD1-CG1 4.46Å; Y426-I456 HydrophobicContact CG-CG1 4.47Å; Y426-P457 HydrophobicContact CE1-CG 4.34Å
427	C	82.1	Confident	80.1	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.249	C	C	.	.	S	Bend	trans	-123	30.2	-173.7	-48.9	0	0	0	0	113.5	S423 G434 C443 C452	S423-C427 CarbonylContact O-C 3.54Å; S423-C427 VanDerWaalsContact O-C 3.31Å; S423-C427 VanDerWaalsContact O-CA 3.24Å; S423-C427 WeakPolarHBondContact O-CA 3.34Å; S423-C427 VanDerWaalsContact O-CB 3.27Å; S423-C427 WeakPolarHBondContact O-CB 3.27Å; S423-C427 PolarHBondContact O-N 3.32Å; C427-G434 PolarHBondContact O-N 2.67Å; C427-G434 VanDerWaalsContact O-N 3.08Å; C427-C443 WeakPolarHBondContact CA-SG 3.24Å; C427-C443 HydrophobicContact CB-CB 3.73Å; C427-C443 WeakPolarHBondContact CB-SG 3.04Å; C427-C443 WeakPolarHBondContact SG-CB 3.47Å; C427-C443 CovalentContact SG-SG 2.03Å; C427-C443 PolarHBondContact SG-SG 3.21Å; C427-C452 CarbonylContact C-O 3.51Å; C427-C452 VanDerWaalsContact C-O 3.3Å; C427-C452 VanDerWaalsContact CA-O 3.22Å; C427-C452 WeakPolarHBondContact CA-O 3.32Å
428	G	74.2	Confident	79.7	Confident	45 Å²	45	49.3 Å²	49.3	46%	0.464	27%	0.265	S	S	.	.			trans	-108	7.9	-172.1	0	0	0	0	0	115.9	S430	G428-S430 VanDerWaalsContact C-N 3.28Å; G428-S430 PolarHBondContact O-N 2.76Å
429	E	68.5	Low	79.2	Confident	140 Å²	140	56.2 Å²	56.2	65%	0.654	30%	0.299	S	S	*	.	S	Bend	trans	-73.2	-21	-175	-135.6	179.4	-162.2	0	0	113
430	S	61.8	Low	78.6	Confident	25 Å²	25	56.2 Å²	56.2	18%	0.175	31%	0.305	C	S	.	.	S	Bend	trans	-102.2	162.9	172.8	70.2	0	0	0	0	112.1	G428 F432 C452	G428-S430 VanDerWaalsContact C-N 3.28Å; G428-S430 PolarHBondContact O-N 2.76Å; S430-F432 PolarHBondContact O-N 3.14Å; S430-F432 PolarHBondContact OG-O 2.85Å; S430-F432 VanDerWaalsContact OG-O 3.13Å; S430-C452 WeakPolarHBondContact OG-CB 3.45Å
431	T	61.4	Low	78.3	Confident	124 Å²	124	58.1 Å²	58.1	76%	0.761	32%	0.316	S	S	*	.	S	Bend	trans	-60.3	-13.1	-179.7	45.8	0	0	0	0	114.5
432	F	63.7	Low	78	Confident	121 Å²	121	59.8 Å²	59.8	53%	0.531	33%	0.327	S	S	.	.	S	Bend	trans	-120.1	121.2	176.8	-63.3	-76.7	0	0	0	110.8	S430 G434 P446	S430-F432 PolarHBondContact O-N 3.14Å; S430-F432 PolarHBondContact OG-O 2.85Å; S430-F432 VanDerWaalsContact OG-O 3.13Å; F432-G434 PolarHBondContact O-N 3.3Å; F432-P446 HydrophobicContact CB-CG 4.37Å
433	P	67.6	Low	77.8	Confident	46 Å²	46	60.5 Å²	60.5	30%	0.299	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-67.7	124.1	-178.8	25.1	-32.1	0	0	0	111.1	L424	L424-P433 HydrophobicContact CD2-CB 4.5Å
434	G	78.1	Confident	77.6	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.01	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-77.8	170.4	173.6	0	0	0	0	0	113.4	S423 C427 F432 T444	S423-G434 WeakPolarHBondContact CB-O 3.44Å; S423-G434 PolarHBondContact OG-O 3.08Å; C427-G434 PolarHBondContact O-N 2.67Å; C427-G434 VanDerWaalsContact O-N 3.08Å; F432-G434 PolarHBondContact O-N 3.3Å; G434-T444 CarbonylContact C-O 3.51Å; G434-T444 VanDerWaalsContact CA-O 3.29Å; G434-T444 WeakPolarHBondContact CA-O 3.22Å
435	T	82.9	Confident	77.3	Confident	86 Å²	86	62.7 Å²	62.7	53%	0.528	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	121.4	173	34.5	0	0	0	0	111.5	S423 T444	S423-T435 WeakPolarHBondContact OG-CA 2.99Å; T435-T444 WeakPolarHBondContact CB-OG1 3.38Å; T435-T444 PolarHBondContact N-O 2.03Å; T435-T444 PolarHBondContact O-N 3.27Å; T435-T444 PolarHBondContact O-OG1 3.19Å; T435-T444 PolarHBondContact OG1-O 2.83Å; T435-T444 PolarHBondContact OG1-OG1 3Å
436	F	84.3	Confident	76.6	Confident	14 Å²	14	63.3 Å²	63.3	6%	0.061	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	131.9	178.2	-172.7	-107.7	0	0	0	111.4	F352 Q422 S423 Y426 E438 I456	F352-F436 AromaticContact CE2-CE1 3.78Å; F352-F436 HydrophobicContact CE2-CE1 3.78Å; F352-F436 AromaticContact CE2-CZ 3.64Å; F352-F436 HydrophobicContact CE2-CZ 3.64Å; F352-F436 AromaticContact CZ-CE1 3.89Å; F352-F436 HydrophobicContact CZ-CE1 3.89Å; F352-F436 HydrophobicContact CZ-CZ 4.07Å; Q422-F436 HydrophobicContact CB-CB 4.14Å; Q422-F436 HydrophobicContact CB-CD1 3.89Å; Q422-F436 HydrophobicContact CB-CG 4.27Å; Q422-F436 HydrophobicContact CG-CD1 4.48Å; S423-F436 PolarHBondContact OG-N 3.22Å; S423-F436 VanDerWaalsContact OG-N 3.14Å; Y426-F436 HydrophobicContact CD2-CD1 4.24Å; Y426-F436 HydrophobicContact CD2-CD2 4.09Å; Y426-F436 HydrophobicContact CD2-CE1 4.14Å; Y426-F436 AromaticContact CD2-CE2 4Å; Y426-F436 HydrophobicContact CD2-CE2 4Å; Y426-F436 HydrophobicContact CD2-CG 4.21Å; Y426-F436 HydrophobicContact CD2-CZ 4.02Å; Y426-F436 HydrophobicContact CG-CD2 4.4Å; Y426-F436 HydrophobicContact CG-CE2 4.3Å; F436-E438 HydrophobicContact CE1-CB 4.27Å; F436-I456 HydrophobicContact CE2-CD1 3.8Å; F436-I456 HydrophobicContact CE2-CG1 4.46Å; F436-I456 HydrophobicContact CZ-CD1 4.48Å
437	L	83.5	Confident	75.4	Confident	75 Å²	75	72.9 Å²	72.9	39%	0.393	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	109.7	172.8	-77.8	151.7	0	0	0	109.5	Q439 S440 H441 S442 T444	L437-Q439 VanDerWaalsContact C-N 3.27Å; L437-Q439 PolarHBondContact O-N 3.41Å; L437-S440 VanDerWaalsContact CB-OG 3.28Å; L437-S440 WeakPolarHBondContact CB-OG 3.29Å; L437-S440 PolarHBondContact O-N 3.39Å; L437-H441 WeakPolarHBondContact O-CA 3.41Å; L437-H441 PolarHBondContact O-N 2.7Å; L437-S442 PolarHBondContact N-O 2.86Å; L437-S442 PolarHBondContact O-N 2.88Å; L437-T444 HydrophobicContact CD1-CG2 3.56Å
438	E	80.9	Confident	74.2	Confident	72 Å²	72	81.6 Å²	81.6	34%	0.336	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-24.4	-179	-168.1	169.4	-149.7	0	0	113.1	F352 N354 S355 F436 H441	F352-E438 HydrophobicContact CZ-CG 4.47Å; N354-E438 WeakPolarHBondContact CA-OE1 3.19Å; N354-E438 WeakPolarHBondContact CB-OE1 3.44Å; S355-E438 PolarHBondContact N-OE1 2.91Å; F436-E438 HydrophobicContact CE1-CB 4.27Å; E438-H441 PolarHBondContact O-CD2 3.05Å; E438-H441 PolarHBondContact O-NE2 2.75Å
439	Q	79.3	Confident	73.3	Confident	197 Å²	197	84.6 Å²	84.6	92%	0.921	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-34.1	178.1	-68.8	178.8	-12.2	0	0	113.3	L437	L437-Q439 VanDerWaalsContact C-N 3.27Å; L437-Q439 PolarHBondContact O-N 3.41Å
440	S	76.8	Confident	72.9	Confident	69 Å²	69	84.1 Å²	84.1	48%	0.483	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-0.3	-176	54.2	0	0	0	0	113	L437 S442	L437-S440 VanDerWaalsContact CB-OG 3.28Å; L437-S440 WeakPolarHBondContact CB-OG 3.29Å; L437-S440 PolarHBondContact O-N 3.39Å; S440-S442 WeakPolarHBondContact CB-OG 3.47Å; S440-S442 PolarHBondContact O-N 3.41Å; S440-S442 PolarHBondContact OG-OG 2.84Å
441	H	80.4	Confident	73.2	Confident	88 Å²	88	86.6 Å²	86.6	41%	0.407	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.3	46.7	-171.3	-67.9	-177.5	0	0	0	112	L437 E438 Q453 I456	L437-H441 WeakPolarHBondContact O-CA 3.41Å; L437-H441 PolarHBondContact O-N 2.7Å; E438-H441 PolarHBondContact O-CD2 3.05Å; E438-H441 PolarHBondContact O-NE2 2.75Å; H441-Q453 PolarHBondContact O-NE2 3.03Å; H441-I456 HydrophobicContact CB-CD1 4.4Å; H441-I456 WeakPolarHBondContact O-CD1 3.28Å
442	S	82	Confident	73.9	Confident	35 Å²	35	80.8 Å²	80.8	25%	0.245	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	152.5	-174.8	66.3	0	0	0	0	112.1	L437 S440	L437-S442 PolarHBondContact N-O 2.86Å; L437-S442 PolarHBondContact O-N 2.88Å; S440-S442 WeakPolarHBondContact CB-OG 3.47Å; S440-S442 PolarHBondContact O-N 3.41Å; S440-S442 PolarHBondContact OG-OG 2.84Å
443	C	84.8	Confident	74.6	Confident	17 Å²	17	79.1 Å²	79.1	12%	0.115	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	134.5	178.2	-66	0	0	0	0	110.6	Y426 C427 Q453	Y426-C443 PolarHBondContact O-SG 3.02Å; C427-C443 WeakPolarHBondContact CA-SG 3.24Å; C427-C443 HydrophobicContact CB-CB 3.73Å; C427-C443 WeakPolarHBondContact CB-SG 3.04Å; C427-C443 WeakPolarHBondContact SG-CB 3.47Å; C427-C443 CovalentContact SG-SG 2.03Å; C427-C443 PolarHBondContact SG-SG 3.21Å; C443-Q453 HydrophobicContact CB-CB 4.14Å
444	T	82.6	Confident	75	Confident	60 Å²	60	77.3 Å²	77.3	37%	0.368	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	115.1	169	37.4	0	0	0	0	109.2	G434 T435 L437	G434-T444 CarbonylContact C-O 3.51Å; G434-T444 VanDerWaalsContact CA-O 3.29Å; G434-T444 WeakPolarHBondContact CA-O 3.22Å; T435-T444 WeakPolarHBondContact CB-OG1 3.38Å; T435-T444 PolarHBondContact N-O 2.03Å; T435-T444 PolarHBondContact O-N 3.27Å; T435-T444 PolarHBondContact O-OG1 3.19Å; T435-T444 PolarHBondContact OG1-O 2.83Å; T435-T444 PolarHBondContact OG1-OG1 3Å; L437-T444 HydrophobicContact CD1-CG2 3.56Å
445	C	79.3	Confident	74.9	Confident	43 Å²	43	81.4 Å²	81.4	29%	0.291	45%	0.446	S	S	.	.			trans	-94.8	134.8	-174.6	-43.6	0	0	0	0	110.2	C452	C445-C452 WeakPolarHBondContact CA-SG 3.49Å; C445-C452 HydrophobicContact CB-CB 3.8Å; C445-C452 WeakPolarHBondContact CB-SG 3.45Å; C445-C452 VanDerWaalsContact SG-CA 3.56Å; C445-C452 WeakPolarHBondContact SG-CB 3.3Å; C445-C452 PolarHBondContact SG-N 3.33Å; C445-C452 CovalentContact SG-SG 2.02Å; C445-C452 PolarHBondContact SG-SG 2.84Å
446	P	69.8	Low	74.8	Confident	63 Å²	63	78.5 Å²	78.5	41%	0.409	43%	0.428	S	S	.	.	S	Bend	trans	-73.1	128.3	169.1	27.3	-28.8	0	0	0	109.7	F432	F432-P446 HydrophobicContact CB-CG 4.37Å
447	Y	60.5	Low	74.7	Confident	210 Å²	210	78.6 Å²	78.6	82%	0.824	43%	0.429	S	S	*	.	S	Bend	trans	76.8	154.4	-175.9	-59.6	-87.2	0	0	0	115.8	Q449	Y447-Q449 PolarHBondContact O-N 3.18Å
448	D	56	Low	74.5	Confident	183 Å²	183	75.4 Å²	75.4	98%	0.979	41%	0.413	S	S	*	.	S	Bend	trans	-60.4	48.7	-178.2	-76	-33.1	0	0	0	114.2
449	Q	55.3	Low	74.4	Confident	107 Å²	107	73.9 Å²	73.9	50%	0.5	41%	0.413	S	S	.	.			trans	-94.8	142.9	167.6	-71.8	-168	-10.7	0	0	110.3	Y447 S451	Y447-Q449 PolarHBondContact O-N 3.18Å; Q449-S451 PolarHBondContact O-N 3.42Å
450	S	60	Low	74.3	Confident	130 Å²	130	67.2 Å²	67.2	91%	0.909	38%	0.383	S	S	*	.	S	Bend	trans	-71.7	-19.8	-167	42.4	0	0	0	0	115.7
451	S	67.8	Low	74.1	Confident	78 Å²	78	65.7 Å²	65.7	55%	0.545	38%	0.378	S	S	.	.			trans	-173.9	127.7	168.8	52.9	0	0	0	0	112.1	Q449	Q449-S451 PolarHBondContact O-N 3.42Å
452	C	75.8	Confident	73.3	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.007	40%	0.401	C	S	.	.			trans	-104.8	10.9	166.2	63.7	0	0	0	0	112	C427 S430 C445	C427-C452 CarbonylContact C-O 3.51Å; C427-C452 VanDerWaalsContact C-O 3.3Å; C427-C452 VanDerWaalsContact CA-O 3.22Å; C427-C452 WeakPolarHBondContact CA-O 3.32Å; S430-C452 WeakPolarHBondContact OG-CB 3.45Å; C445-C452 WeakPolarHBondContact CA-SG 3.49Å; C445-C452 HydrophobicContact CB-CB 3.8Å; C445-C452 WeakPolarHBondContact CB-SG 3.45Å; C445-C452 VanDerWaalsContact SG-CA 3.56Å; C445-C452 WeakPolarHBondContact SG-CB 3.3Å; C445-C452 PolarHBondContact SG-N 3.33Å; C445-C452 CovalentContact SG-SG 2.02Å; C445-C452 PolarHBondContact SG-SG 2.84Å
453	Q	79.3	Confident	72.6	Confident	86 Å²	86	69.8 Å²	69.8	40%	0.402	40%	0.4	S	S	.	.			trans	-84.2	113.8	-175.3	179.1	166.9	-2.7	0	0	110.1	H441 C443 I456	H441-Q453 PolarHBondContact O-NE2 3.03Å; C443-Q453 HydrophobicContact CB-CB 4.14Å; Q453-I456 HydrophobicContact CG-CD1 4.42Å; Q453-I456 VanDerWaalsContact NE2-CD1 3.3Å
454	G	76	Confident	71.6	Confident	9 Å²	9	73 Å²	73	9%	0.093	42%	0.42	C	S	.	.			trans	-80.2	175.7	168.7	0	0	0	0	0	112.4	Y426 I456	Y426-G454 WeakPolarHBondContact O-CA 3.13Å; Y426-G454 PolarHBondContact O-N 2.91Å; G454-I456 PolarHBondContact O-N 3.04Å
455	P	75.9	Confident	70.8	Confident	86 Å²	86	71.2 Å²	71.2	56%	0.558	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-65.2	120.8	179.2	26.5	-33.2	0	0	0	110.9	P457 T475	P455-P457 WeakPolarHBondContact O-CD 3.25Å; P455-T475 HydrophobicContact CB-CG2 4.23Å
456	I	80.3	Confident	70.8	Confident	26 Å²	26	69.6 Å²	69.6	13%	0.133	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-94.4	118.2	177.8	-56.5	170.4	0	0	0	108.5	F352 Y426 F436 H441 Q453 G454 T475	F352-I456 HydrophobicContact CD2-CG2 3.78Å; F352-I456 HydrophobicContact CE2-CG2 4.24Å; Y426-I456 HydrophobicContact CD1-CG1 4.46Å; Y426-I456 HydrophobicContact CG-CG1 4.47Å; F436-I456 HydrophobicContact CE2-CD1 3.8Å; F436-I456 HydrophobicContact CE2-CG1 4.46Å; F436-I456 HydrophobicContact CZ-CD1 4.48Å; H441-I456 HydrophobicContact CB-CD1 4.4Å; H441-I456 WeakPolarHBondContact O-CD1 3.28Å; Q453-I456 HydrophobicContact CG-CD1 4.42Å; Q453-I456 VanDerWaalsContact NE2-CD1 3.3Å; G454-I456 PolarHBondContact O-N 3.04Å; I456-T475 WeakPolarHBondContact O-CG2 3.37Å
457	P	81.8	Confident	71.2	Confident	15 Å²	15	68.6 Å²	68.6	10%	0.097	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-66.3	169.7	179.3	-18.8	31.3	0	0	0	113.3	F352 Y426 P455 S474	F352-P457 WeakPolarHBondContact CB-O 3.43Å; Y426-P457 HydrophobicContact CE1-CG 4.34Å; P455-P457 WeakPolarHBondContact O-CD 3.25Å; P457-S474 CarbonylContact C-O 3.4Å; P457-S474 VanDerWaalsContact CA-O 3.29Å; P457-S474 WeakPolarHBondContact CA-O 3.17Å
458	C	79.8	Confident	72.1	Confident	9 Å²	9	63.9 Å²	63.9	6%	0.061	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-70.3	146	178.6	99.7	0	0	0	0	111.9	F352 C466 C469 S474	F352-C458 WeakPolarHBondContact CB-O 2.83Å; F352-C458 PolarHBondContact N-O 2.8Å; C458-C466 VanDerWaalsContact SG-CB 3.54Å; C458-C469 HydrophobicContact CB-CB 3.97Å; C458-C469 WeakPolarHBondContact CB-SG 3.47Å; C458-C469 PolarHBondContact O-SG 3.42Å; C458-C469 VanDerWaalsContact O-SG 3.37Å; C458-C469 WeakPolarHBondContact SG-CA 3.4Å; C458-C469 WeakPolarHBondContact SG-CB 3.04Å; C458-C469 CovalentContact SG-SG 2.02Å; C458-C469 PolarHBondContact SG-SG 3.31Å; C458-S474 PolarHBondContact N-O 2.98Å
459	A	78.8	Confident	73.4	Confident	40 Å²	40	55.6 Å²	55.6	33%	0.331	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-86.8	122.9	177.7	0	0	0	0	0	111.1	F352 C466	F352-A459 HydrophobicContact CB-CB 4.27Å; F352-A459 HydrophobicContact CD1-CB 4.13Å; A459-C466 WeakPolarHBondContact O-CB 3.46Å; A459-C466 PolarHBondContact O-N 2.94Å
460	L	78.4	Confident	74.6	Confident	56 Å²	56	51.5 Å²	51.5	29%	0.293	32%	0.324	S	S	.	.	B	Isolated β-bridge	trans	-91.4	137	172.5	-54.9	-176.9	0	0	0	110.2	R351 C466	R351-L460 HydrophobicContact CB-CD1 3.87Å; R351-L460 HydrophobicContact CB-CG 3.99Å; R351-L460 HydrophobicContact CG-CD1 4.49Å; L460-C466 VanDerWaalsContact CA-O 3.32Å; L460-C466 WeakPolarHBondContact CA-O 3.33Å; L460-C466 HydrophobicContact CD2-CB 3.91Å; L460-C466 VanDerWaalsContact CD2-O 3.27Å; L460-C466 WeakPolarHBondContact CD2-O 3.45Å
461	G	70.8	Confident	75.3	Confident	37 Å²	37	51.1 Å²	51.1	38%	0.381	32%	0.318	S	S	.	.			trans	175.2	-174	-178.5	0	0	0	0	0	111.6	N481	G461-N481 PolarHBondContact O-ND2 3.18Å
462	E	64.3	Low	75.6	Confident	189 Å²	189	55.2 Å²	55.2	88%	0.883	33%	0.334	S	S	*	.	S	Bend	trans	-87.8	151.1	176.5	-63.1	-177.7	170.5	0	0	111.6
463	G	68.5	Low	75.5	Confident	21 Å²	21	58.2 Å²	58.2	22%	0.216	35%	0.35	C	S	.	.	S	Bend	trans	81.4	-128.5	179.1	0	0	0	0	0	113.5	A465 N481 Y484	G463-A465 PolarHBondContact O-N 3.02Å; G463-A465 VanDerWaalsContact O-N 3.12Å; G463-N481 PolarHBondContact O-ND2 3.42Å; G463-Y484 VanDerWaalsContact C-CE2 3.43Å; G463-Y484 WeakPolarHBondContact O-CD2 3.42Å; G463-Y484 WeakPolarHBondContact O-CE2 3.34Å
464	P	63.6	Low	75.2	Confident	83 Å²	83	56.2 Å²	56.2	54%	0.539	35%	0.346	S	S	.	.	S	Bend	trans	-72	0.4	-177.3	32.1	-36.4	0	0	0	114.4	Y484 C491	P464-Y484 VanDerWaalsContact CA-CD1 3.46Å; P464-Y484 HydrophobicContact CB-CD1 4.09Å; P464-Y484 HydrophobicContact CB-CE1 3.68Å; P464-Y484 HydrophobicContact CG-CE1 4.42Å; P464-Y484 VanDerWaalsContact N-CE1 3.28Å; P464-C491 WeakPolarHBondContact O-CB 3.4Å
465	A	64.9	Low	75.2	Confident	23 Å²	23	58.8 Å²	58.8	19%	0.19	36%	0.359	C	S	.	.	S	Bend	trans	-78.3	160	173.6	0	0	0	0	0	111.3	G463 N481	G463-A465 PolarHBondContact O-N 3.02Å; G463-A465 VanDerWaalsContact O-N 3.12Å; A465-N481 PolarHBondContact O-ND2 3.45Å
466	C	79.1	Confident	75.3	Confident	10 Å²	10	61.7 Å²	61.7	7%	0.068	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	144	-178.9	-71.3	0	0	0	0	112	C458 A459 L460 C477	C458-C466 VanDerWaalsContact SG-CB 3.54Å; A459-C466 WeakPolarHBondContact O-CB 3.46Å; A459-C466 PolarHBondContact O-N 2.94Å; L460-C466 VanDerWaalsContact CA-O 3.32Å; L460-C466 WeakPolarHBondContact CA-O 3.33Å; L460-C466 HydrophobicContact CD2-CB 3.91Å; L460-C466 VanDerWaalsContact CD2-O 3.27Å; L460-C466 WeakPolarHBondContact CD2-O 3.45Å; C466-C477 WeakPolarHBondContact CA-SG 3.35Å; C466-C477 HydrophobicContact CB-CB 4.21Å; C466-C477 WeakPolarHBondContact CB-SG 3.41Å; C466-C477 WeakPolarHBondContact SG-CA 3.29Å; C466-C477 WeakPolarHBondContact SG-CB 3.03Å; C466-C477 CovalentContact SG-SG 2.01Å; C466-C477 PolarHBondContact SG-SG 2.99Å
467	A	78.9	Confident	75.4	Confident	41 Å²	41	60.7 Å²	60.7	34%	0.339	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-37.7	167	0	0	0	0	0	110.8	S479	A467-S479 WeakPolarHBondContact CB-O 3.43Å; A467-S479 PolarHBondContact N-O 2.98Å
468	H	80	Confident	75.2	Confident	111 Å²	111	62 Å²	62	51%	0.514	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	141.7	175.1	-156.6	67.3	0	0	0	111.4	G478 S479	H468-G478 WeakPolarHBondContact O-CA 2.97Å; H468-G478 PolarHBondContact O-N 3.24Å; H468-S479 VanDerWaalsContact CB-OG 3.25Å; H468-S479 WeakPolarHBondContact CB-OG 3.49Å; H468-S479 PolarHBondContact N-O 3.16Å; H468-S479 PolarHBondContact N-OG 3.05Å; H468-S479 PolarHBondContact O-N 2.77Å; H468-S479 VanDerWaalsContact O-N 3.12Å
469	C	82.4	Confident	75.1	Confident	9 Å²	9	64 Å²	64	6%	0.061	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	150.7	171.9	-56.4	0	0	0	0	110.7	D350 C458	D350-C469 PolarHBondContact O-SG 2.91Å; C458-C469 HydrophobicContact CB-CB 3.97Å; C458-C469 WeakPolarHBondContact CB-SG 3.47Å; C458-C469 PolarHBondContact O-SG 3.42Å; C458-C469 VanDerWaalsContact O-SG 3.37Å; C458-C469 WeakPolarHBondContact SG-CA 3.4Å; C458-C469 WeakPolarHBondContact SG-CB 3.04Å; C458-C469 CovalentContact SG-SG 2.02Å; C458-C469 PolarHBondContact SG-SG 3.31Å
470	A	80.1	Confident	75	Confident	21 Å²	21	63.3 Å²	63.3	17%	0.174	38%	0.377	C	S	.	.			trans	-71	133.3	179.3	0	0	0	0	0	110.6	D472 N473 R476	A470-D472 VanDerWaalsContact C-N 3.26Å; A470-D472 PolarHBondContact O-N 2.85Å; A470-N473 CarbonylContact O-C 3.57Å; A470-N473 PolarHBondContact O-N 3.08Å; A470-R476 HydrophobicContact CB-CB 4.44Å; A470-R476 PolarHBondContact N-O 3.13Å
471	P	74.4	Confident	75	Confident	122 Å²	122	62.3 Å²	62.3	79%	0.792	37%	0.372	S	S	*	.	S	Bend	trans	-66.9	-27.1	-179	26.5	-34.1	0	0	0	112.9
472	D	74.5	Confident	74.8	Confident	164 Å²	164	66.7 Å²	66.7	88%	0.877	39%	0.394	S	S	*	.	S	Bend	trans	-81.3	-27	-178.8	-59.5	-32.5	0	0	0	113.2	A470	A470-D472 VanDerWaalsContact C-N 3.26Å; A470-D472 PolarHBondContact O-N 2.85Å
473	N	74.1	Confident	74.7	Confident	65 Å²	65	59.7 Å²	59.7	35%	0.348	37%	0.372	S	S	.	.			trans	-153.7	102.3	178.2	-170.5	-14.2	0	0	0	109.8	A470 T475 R476	A470-N473 CarbonylContact O-C 3.57Å; A470-N473 PolarHBondContact O-N 3.08Å; N473-T475 VanDerWaalsContact CG-OG1 3.29Å; N473-T475 PolarHBondContact ND2-OG1 2.98Å; N473-T475 PolarHBondContact O-N 3.31Å; N473-T475 PolarHBondContact OD1-N 2.93Å; N473-T475 PolarHBondContact OD1-OG1 2.02Å; N473-R476 PolarHBondContact O-N 3.08Å
474	S	72.6	Confident	74.7	Confident	44 Å²	44	61.8 Å²	61.8	31%	0.308	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-19.1	-175	58.4	0	0	0	0	113.9	P457 C458 R476	P457-S474 CarbonylContact C-O 3.4Å; P457-S474 VanDerWaalsContact CA-O 3.29Å; P457-S474 WeakPolarHBondContact CA-O 3.17Å; C458-S474 PolarHBondContact N-O 2.98Å; S474-R476 VanDerWaalsContact C-N 3.26Å; S474-R476 PolarHBondContact O-N 3.3Å
475	T	76.6	Confident	75.2	Confident	62 Å²	62	61.2 Å²	61.2	38%	0.38	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-15.3	176.2	66.2	0	0	0	0	113.6	P455 I456 N473	P455-T475 HydrophobicContact CB-CG2 4.23Å; I456-T475 WeakPolarHBondContact O-CG2 3.37Å; N473-T475 VanDerWaalsContact CG-OG1 3.29Å; N473-T475 PolarHBondContact ND2-OG1 2.98Å; N473-T475 PolarHBondContact O-N 3.31Å; N473-T475 PolarHBondContact OD1-N 2.93Å; N473-T475 PolarHBondContact OD1-OG1 2.02Å
476	R	78.6	Confident	75.6	Confident	147 Å²	147	64.3 Å²	64.3	56%	0.555	38%	0.381	S	S	*	.	S	Bend	trans	-108.6	148.4	-177.5	-63.8	-176.9	-178.9	-177.8	-0.4	111.5	A470 N473 S474	A470-R476 HydrophobicContact CB-CB 4.44Å; A470-R476 PolarHBondContact N-O 3.13Å; N473-R476 PolarHBondContact O-N 3.08Å; S474-R476 VanDerWaalsContact C-N 3.26Å; S474-R476 PolarHBondContact O-N 3.3Å
477	C	80.6	Confident	75.1	Confident	6 Å²	6	65.1 Å²	65.1	4%	0.041	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	137	167.6	-147.3	0	0	0	0	111.3	C466 S479 L486 G489 C491	C466-C477 WeakPolarHBondContact CA-SG 3.35Å; C466-C477 HydrophobicContact CB-CB 4.21Å; C466-C477 WeakPolarHBondContact CB-SG 3.41Å; C466-C477 WeakPolarHBondContact SG-CA 3.29Å; C466-C477 WeakPolarHBondContact SG-CB 3.03Å; C466-C477 CovalentContact SG-SG 2.01Å; C466-C477 PolarHBondContact SG-SG 2.99Å; C477-S479 PolarHBondContact SG-O 2.87Å; C477-L486 HydrophobicContact CB-CD1 3.82Å; C477-L486 WeakPolarHBondContact O-CD1 3.32Å; C477-G489 WeakPolarHBondContact CB-O 3.44Å; C477-G489 PolarHBondContact N-O 2.79Å; C477-C491 PolarHBondContact SG-SG 3.38Å
478	G	77.6	Confident	74.6	Confident	41 Å²	41	71.8 Å²	71.8	42%	0.423	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	-32.9	171.8	0	0	0	0	0	113.3	H468	H468-G478 WeakPolarHBondContact O-CA 2.97Å; H468-G478 PolarHBondContact O-N 3.24Å
479	S	77.6	Confident	74	Confident	51 Å²	51	67 Å²	67	36%	0.357	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	151.5	173.7	61.2	0	0	0	0	111.7	A467 H468 C477	A467-S479 WeakPolarHBondContact CB-O 3.43Å; A467-S479 PolarHBondContact N-O 2.98Å; H468-S479 VanDerWaalsContact CB-OG 3.25Å; H468-S479 WeakPolarHBondContact CB-OG 3.49Å; H468-S479 PolarHBondContact N-O 3.16Å; H468-S479 PolarHBondContact N-OG 3.05Å; H468-S479 PolarHBondContact O-N 2.77Å; H468-S479 VanDerWaalsContact O-N 3.12Å; C477-S479 PolarHBondContact SG-O 2.87Å
480	C	78.6	Confident	73.4	Confident	27 Å²	27	71.9 Å²	71.9	18%	0.182	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	156.8	-177.6	-64.7	0	0	0	0	112.5	Y484 C491	C480-Y484 WeakPolarHBondContact CB-O 3.49Å; C480-C491 WeakPolarHBondContact CA-SG 3.48Å; C480-C491 HydrophobicContact CB-CB 3.88Å; C480-C491 WeakPolarHBondContact CB-SG 3.28Å; C480-C491 WeakPolarHBondContact SG-CA 3.32Å; C480-C491 WeakPolarHBondContact SG-CB 3.45Å; C480-C491 CovalentContact SG-SG 2.03Å; C480-C491 PolarHBondContact SG-SG 3.32Å
481	N	76.5	Confident	73	Confident	35 Å²	35	71.5 Å²	71.5	19%	0.187	42%	0.415	C	S	.	.			trans	-65.9	156.3	172.2	-67.4	-48.9	0	0	0	111.5	G461 G463 A465 G483 Y484	G461-N481 PolarHBondContact O-ND2 3.18Å; G463-N481 PolarHBondContact O-ND2 3.42Å; A465-N481 PolarHBondContact O-ND2 3.45Å; N481-G483 PolarHBondContact O-N 3.27Å; N481-Y484 WeakPolarHBondContact O-CB 3.33Å; N481-Y484 PolarHBondContact O-N 3.09Å; N481-Y484 VanDerWaalsContact O-N 3.09Å
482	P	66.8	Low	72.6	Confident	129 Å²	129	72 Å²	72	84%	0.838	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	132.4	175.9	20.3	-32.1	0	0	0	111.8
483	G	63.2	Low	71.8	Confident	41 Å²	41	67.1 Å²	67.1	42%	0.423	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.3	9.7	-174.2	0	0	0	0	0	115.1	N481 E494	N481-G483 PolarHBondContact O-N 3.27Å; G483-E494 VanDerWaalsContact O-CB 3.26Å; G483-E494 WeakPolarHBondContact O-CB 3.39Å; G483-E494 PolarHBondContact O-N 3.42Å
484	Y	68.3	Low	71.1	Confident	65 Å²	65	67.5 Å²	67.5	26%	0.255	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	136.3	177.3	-67	-103	0	0	0	110.3	G463 P464 C480 N481 R492 P493	G463-Y484 VanDerWaalsContact C-CE2 3.43Å; G463-Y484 WeakPolarHBondContact O-CD2 3.42Å; G463-Y484 WeakPolarHBondContact O-CE2 3.34Å; P464-Y484 VanDerWaalsContact CA-CD1 3.46Å; P464-Y484 HydrophobicContact CB-CD1 4.09Å; P464-Y484 HydrophobicContact CB-CE1 3.68Å; P464-Y484 HydrophobicContact CG-CE1 4.42Å; P464-Y484 VanDerWaalsContact N-CE1 3.28Å; C480-Y484 WeakPolarHBondContact CB-O 3.49Å; N481-Y484 WeakPolarHBondContact O-CB 3.33Å; N481-Y484 PolarHBondContact O-N 3.09Å; N481-Y484 VanDerWaalsContact O-N 3.09Å; Y484-R492 CarbonylContact C-O 3.35Å; Y484-R492 WeakPolarHBondContact CA-O 3.35Å; Y484-R492 WeakPolarHBondContact CB-O 3.45Å; Y484-R492 VanDerWaalsContact CD1-C 3.42Å; Y484-P493 HydrophobicContact CD1-CB 3.9Å; Y484-P493 HydrophobicContact CD1-CG 4.47Å; Y484-P493 HydrophobicContact CE1-CB 3.48Å; Y484-P493 VanDerWaalsContact CE1-CB 3.48Å; Y484-P493 HydrophobicContact CE1-CG 4Å
485	V	74.3	Confident	69.9	Low	71 Å²	71	70.6 Å²	70.6	43%	0.43	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	147.8	179.3	-69	0	0	0	0	111.8	A487 R492 E494	V485-A487 PolarHBondContact O-N 2.91Å; V485-R492 PolarHBondContact N-O 3.45Å; V485-R492 PolarHBondContact O-N 2.99Å; V485-E494 HydrophobicContact CG1-CB 4.28Å; V485-E494 HydrophobicContact CG1-CG 3.95Å
486	L	73.2	Confident	68.5	Low	88 Å²	88	68.8 Å²	68.8	46%	0.461	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	109.3	-176.2	-163.7	123.5	0	0	0	110.4	C477	C477-L486 HydrophobicContact CB-CD1 3.82Å; C477-L486 WeakPolarHBondContact O-CD1 3.32Å
487	A	68.3	Low	66.9	Low	28 Å²	28	68.2 Å²	68.2	23%	0.231	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	117.6	177.1	0	0	0	0	0	109.7	V485 G489 L490	V485-A487 PolarHBondContact O-N 2.91Å; A487-G489 PolarHBondContact O-N 3.29Å; A487-G489 VanDerWaalsContact O-N 3.12Å; A487-L490 PolarHBondContact N-O 2.88Å; A487-L490 PolarHBondContact O-N 2.76Å; A487-L490 VanDerWaalsContact O-O 3.13Å
488	Q	68.1	Low	65.4	Low	180 Å²	180	70.9 Å²	70.9	84%	0.841	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	33.1	177.7	-59.5	177.3	-7	0	0	114.3
489	G	67.9	Low	64.3	Low	12 Å²	12	69.5 Å²	69.5	12%	0.124	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	12.3	179.2	0	0	0	0	0	115.1	C477 A487	C477-G489 WeakPolarHBondContact CB-O 3.44Å; C477-G489 PolarHBondContact N-O 2.79Å; A487-G489 PolarHBondContact O-N 3.29Å; A487-G489 VanDerWaalsContact O-N 3.12Å
490	L	69.8	Low	63.2	Low	111 Å²	111	73.3 Å²	73.3	58%	0.581	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.6	142.5	171.7	-68.1	165.9	0	0	0	109.9	A487 R492	A487-L490 PolarHBondContact N-O 2.88Å; A487-L490 PolarHBondContact O-N 2.76Å; A487-L490 VanDerWaalsContact O-O 3.13Å; L490-R492 PolarHBondContact O-N 2.95Å
491	C	71.8	Confident	62.2	Low	12 Å²	12	76.5 Å²	76.5	8%	0.081	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	118.1	171.7	-66.7	0	0	0	0	109.7	P464 C477 C480	P464-C491 WeakPolarHBondContact O-CB 3.4Å; C477-C491 PolarHBondContact SG-SG 3.38Å; C480-C491 WeakPolarHBondContact CA-SG 3.48Å; C480-C491 HydrophobicContact CB-CB 3.88Å; C480-C491 WeakPolarHBondContact CB-SG 3.28Å; C480-C491 WeakPolarHBondContact SG-CA 3.32Å; C480-C491 WeakPolarHBondContact SG-CB 3.45Å; C480-C491 CovalentContact SG-SG 2.03Å; C480-C491 PolarHBondContact SG-SG 3.32Å
492	R	65.4	Low	61.3	Low	133 Å²	133	75.5 Å²	75.5	50%	0.502	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	142.8	170.1	-70.5	-173	176.1	152.6	2	108.6	Y484 V485 L490 E494	Y484-R492 CarbonylContact C-O 3.35Å; Y484-R492 WeakPolarHBondContact CA-O 3.35Å; Y484-R492 WeakPolarHBondContact CB-O 3.45Å; Y484-R492 VanDerWaalsContact CD1-C 3.42Å; V485-R492 PolarHBondContact N-O 3.45Å; V485-R492 PolarHBondContact O-N 2.99Å; L490-R492 PolarHBondContact O-N 2.95Å; R492-E494 PolarHBondContact O-N 3.31Å
493	P	58.3	Low	60.9	Low	62 Å²	62	69.6 Å²	69.6	40%	0.403	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.1	136.1	170.2	15.1	-21.9	0	0	0	107.7	Y484 V495	Y484-P493 HydrophobicContact CD1-CB 3.9Å; Y484-P493 HydrophobicContact CD1-CG 4.47Å; Y484-P493 HydrophobicContact CE1-CB 3.48Å; Y484-P493 VanDerWaalsContact CE1-CB 3.48Å; Y484-P493 HydrophobicContact CE1-CG 4Å; P493-V495 HydrophobicContact CB-CG2 3.74Å; P493-V495 HydrophobicContact CG-CG2 3.72Å; P493-V495 PolarHBondContact O-N 3.3Å
494	E	58.7	Low	60.6	Low	72 Å²	72	68.5 Å²	68.5	34%	0.336	36%	0.363	S	S	.	.			trans	-69.5	69.1	167.1	-163.8	172.6	-173.8	0	0	105.9	G483 V485 R492 A496	G483-E494 VanDerWaalsContact O-CB 3.26Å; G483-E494 WeakPolarHBondContact O-CB 3.39Å; G483-E494 PolarHBondContact O-N 3.42Å; V485-E494 HydrophobicContact CG1-CB 4.28Å; V485-E494 HydrophobicContact CG1-CG 3.95Å; R492-E494 PolarHBondContact O-N 3.31Å; E494-A496 PolarHBondContact O-N 3.02Å
495	V	47.7	Very low	60.2	Low	109 Å²	109	67 Å²	67	66%	0.661	36%	0.359	S	S	*	.			trans	-67.7	117.5	170.8	-174.8	0	0	0	0	103.5	P493 E497	P493-V495 HydrophobicContact CB-CG2 3.74Å; P493-V495 HydrophobicContact CG-CG2 3.72Å; P493-V495 PolarHBondContact O-N 3.3Å; V495-E497 PolarHBondContact O-N 3.48Å
496	A	46.6	Very low	59.2	Low	25 Å²	25	71.3 Å²	71.3	21%	0.207	38%	0.375	C	S	.	.			trans	-42.7	129.8	161.3	0	0	0	0	0	107.8	E494 S498 Q719	E494-A496 PolarHBondContact O-N 3.02Å; A496-S498 PolarHBondContact O-N 2.87Å; A496-Q719 HydrophobicContact CB-CG 3.61Å
497	E	46.7	Very low	58.5	Low	134 Å²	134	69.9 Å²	69.9	63%	0.626	37%	0.37	S	S	*	.			trans	-46.2	144.2	173.1	-73.8	-171.3	156.1	0	0	109.6	V495 L499	V495-E497 PolarHBondContact O-N 3.48Å; E497-L499 PolarHBondContact O-N 2.96Å
498	S	47.9	Very low	58	Low	63 Å²	63	75.6 Å²	75.6	44%	0.441	40%	0.396	S	S	.	.			trans	-45	121.1	-176	56.5	0	0	0	0	110.8	A496 E500 N501	A496-S498 PolarHBondContact O-N 2.87Å; S498-E500 PolarHBondContact O-N 2.71Å; S498-N501 PolarHBondContact O-N 3.24Å
499	L	54.6	Low	57.9	Low	12 Å²	12	68.9 Å²	68.9	6%	0.063	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-60.8	-6.3	177.5	-78.4	170	0	0	0	113.5	E497 N501 F502 L503 E722	E497-L499 PolarHBondContact O-N 2.96Å; L499-N501 PolarHBondContact O-N 3.44Å; L499-N501 VanDerWaalsContact O-N 3.17Å; L499-F502 HydrophobicContact CD2-CD2 3.84Å; L499-F502 HydrophobicContact CD2-CE2 4.48Å; L499-F502 PolarHBondContact O-N 3.14Å; L499-L503 PolarHBondContact O-N 2.89Å; L499-E722 HydrophobicContact CD1-CB 4.07Å; L499-E722 HydrophobicContact CD1-CG 3.57Å; L499-E722 VanDerWaalsContact CD1-OE1 3.31Å; L499-E722 WeakPolarHBondContact CD1-OE1 3.32Å
500	E	54	Low	58.2	Low	131 Å²	131	74.9 Å²	74.9	61%	0.612	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-51.1	-31	171.3	-66.4	-175.2	179.9	0	0	112.8	S498 F502	S498-E500 PolarHBondContact O-N 2.71Å; E500-F502 VanDerWaalsContact C-N 3.28Å; E500-F502 PolarHBondContact O-N 3.36Å
501	N	58.5	Low	58.4	Low	93 Å²	93	73.6 Å²	73.6	50%	0.497	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-68.8	-24	175.9	-67.9	-15	0	0	0	113.1	S498 L499	S498-N501 PolarHBondContact O-N 3.24Å; L499-N501 PolarHBondContact O-N 3.44Å; L499-N501 VanDerWaalsContact O-N 3.17Å
502	F	58	Low	58.6	Low	15 Å²	15	79.9 Å²	79.9	7%	0.066	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-46.4	-175.3	-52.5	-78.8	0	0	0	112.8	L499 E500 A696 I697 L700 L723	L499-F502 HydrophobicContact CD2-CD2 3.84Å; L499-F502 HydrophobicContact CD2-CE2 4.48Å; L499-F502 PolarHBondContact O-N 3.14Å; E500-F502 VanDerWaalsContact C-N 3.28Å; E500-F502 PolarHBondContact O-N 3.36Å; F502-A696 HydrophobicContact CD1-CB 3.52Å; F502-A696 HydrophobicContact CE1-CB 3.62Å; F502-A696 WeakPolarHBondContact CE1-O 3.43Å; F502-I697 HydrophobicContact CB-CG1 4.17Å; F502-I697 HydrophobicContact CD1-CG1 3.94Å; F502-I697 HydrophobicContact CG-CG1 4.47Å; F502-L700 HydrophobicContact CD1-CD1 3.77Å; F502-L700 HydrophobicContact CD2-CD1 4.46Å; F502-L700 HydrophobicContact CE1-CD1 3.27Å; F502-L700 HydrophobicContact CE1-CD2 4.46Å; F502-L700 HydrophobicContact CE1-CG 3.66Å; F502-L700 HydrophobicContact CE2-CD1 4.05Å; F502-L700 HydrophobicContact CG-CD1 4.35Å; F502-L700 HydrophobicContact CZ-CD1 3.43Å; F502-L700 VanDerWaalsContact CZ-CD1 3.43Å; F502-L700 HydrophobicContact CZ-CD2 4.16Å; F502-L700 HydrophobicContact CZ-CG 3.83Å; F502-L723 HydrophobicContact CB-CD1 3.96Å
503	L	57.4	Low	59.4	Low	5 Å²	5	78.1 Å²	78.1	3%	0.026	41%	0.414	C	S	.	.	B	Isolated β-bridge	trans	-159.2	99.1	-177.2	-144.2	149.5	0	0	0	110.7	L499 L505 F638 L690 F692 V727 L744	L499-L503 PolarHBondContact O-N 2.89Å; L503-L505 HydrophobicContact CD2-CD1 4.1Å; L503-L505 HydrophobicContact CD2-CD2 3.76Å; L503-L505 HydrophobicContact CD2-CG 3.64Å; L503-L505 PolarHBondContact O-N 3.06Å; L503-F638 HydrophobicContact CD2-CZ 4.34Å; L503-L690 HydrophobicContact CD2-CD1 3.89Å; L503-F692 HydrophobicContact CD1-CD2 3.77Å; L503-F692 HydrophobicContact CD1-CE2 4.11Å; L503-F692 HydrophobicContact CG-CD2 4.32Å; L503-V727 HydrophobicContact CD1-CG2 4.31Å; L503-L744 HydrophobicContact CD1-CD1 4.05Å
504	G	57.8	Low	60.3	Low	17 Å²	17	75.4 Å²	75.4	18%	0.175	40%	0.396	C	S	.	.			trans	-71.9	108.1	178.8	0	0	0	0	0	111.3	L690	G504-L690 WeakPolarHBondContact O-CD1 3.34Å; G504-L690 WeakPolarHBondContact O-CD2 3.21Å
505	L	59.3	Low	61.3	Low	34 Å²	34	75.9 Å²	75.9	18%	0.178	40%	0.397	C	S	.	.			trans	-102.7	-4.7	-176.5	-76.3	155.5	0	0	0	114.1	L503 T507 F638 L690 R726 L730	L503-L505 HydrophobicContact CD2-CD1 4.1Å; L503-L505 HydrophobicContact CD2-CD2 3.76Å; L503-L505 HydrophobicContact CD2-CG 3.64Å; L503-L505 PolarHBondContact O-N 3.06Å; L505-T507 PolarHBondContact O-N 3.16Å; L505-T507 VanDerWaalsContact O-N 3.11Å; L505-F638 HydrophobicContact CD2-CZ 4.35Å; L505-L690 HydrophobicContact CD2-CD1 3.8Å; L505-L690 HydrophobicContact CG-CD1 4.44Å; L505-R726 HydrophobicContact CD1-CB 3.67Å; L505-R726 HydrophobicContact CD1-CG 4.27Å; L505-L730 HydrophobicContact CD2-CD1 3.7Å
506	E	53.9	Low	62.9	Low	162 Å²	162	76.7 Å²	76.7	76%	0.757	39%	0.389	S	S	*	.			trans	-83.6	85.8	-175.2	-70.2	-168.4	169.6	0	0	112
507	T	58.5	Low	64.6	Low	58 Å²	58	75.9 Å²	75.9	36%	0.356	38%	0.381	S	S	.	.			trans	-135.5	100	159.7	28.3	0	0	0	0	109	L505 L509 Y688	L505-T507 PolarHBondContact O-N 3.16Å; L505-T507 VanDerWaalsContact O-N 3.11Å; T507-L509 PolarHBondContact O-N 3.08Å; T507-Y688 WeakPolarHBondContact OG1-CE2 3.2Å
508	D	56.3	Low	66.1	Low	148 Å²	148	70.7 Å²	70.7	79%	0.791	36%	0.358	S	S	*	.			trans	-91.8	76.5	177.6	-85.3	-13.1	0	0	0	110.6
509	L	66.1	Low	67.5	Low	38 Å²	38	74.4 Å²	74.4	20%	0.199	37%	0.368	C	S	.	.			trans	-77.6	118.5	165.1	-79.1	163.8	0	0	0	108.6	T507 E513 L517 L568 N633	T507-L509 PolarHBondContact O-N 3.08Å; L509-E513 HydrophobicContact CD2-CG 4.46Å; L509-L517 HydrophobicContact CD2-CD1 4.41Å; L509-L568 HydrophobicContact CD1-CD1 4.47Å; L509-N633 PolarHBondContact O-ND2 3.17Å
510	Q	74.4	Confident	68.7	Low	139 Å²	139	80 Å²	80	65%	0.65	39%	0.392	S	S	*	.			trans	-67.8	143.9	177.1	-64.8	-176.4	6	0	0	110.9	L512 E513 L514	Q510-L512 PolarHBondContact O-N 2.93Å; Q510-L512 VanDerWaalsContact O-N 3.09Å; Q510-E513 WeakPolarHBondContact O-CB 3.4Å; Q510-E513 PolarHBondContact O-N 3.37Å; Q510-L514 PolarHBondContact O-N 2.93Å
511	D	73.9	Confident	69.6	Low	83 Å²	83	78.6 Å²	78.6	44%	0.444	39%	0.385	S	S	.	.	H	α-helix	trans	-57.5	-30.7	-175.2	-73	-20.9	0	0	0	113.4	K515 G632 N633	D511-K515 PolarHBondContact O-N 3.47Å; D511-G632 WeakPolarHBondContact OD1-CA 3.5Å; D511-N633 PolarHBondContact OD1-N 3.33Å
512	L	77.4	Confident	70.6	Confident	145 Å²	145	75.8 Å²	75.8	76%	0.759	37%	0.37	S	S	*	.	H	α-helix	trans	-68.5	-41.8	174.5	-77.2	164.3	0	0	0	112.5	Q510 K515 Y516	Q510-L512 PolarHBondContact O-N 2.93Å; Q510-L512 VanDerWaalsContact O-N 3.09Å; L512-K515 PolarHBondContact O-N 3.31Å; L512-Y516 PolarHBondContact O-N 2.89Å; L512-Y516 VanDerWaalsContact O-N 3.14Å
513	E	81	Confident	71.6	Confident	96 Å²	96	79.4 Å²	79.4	45%	0.449	40%	0.397	S	S	.	.	H	α-helix	trans	-66.4	-42.9	176.3	-175.2	176.8	-170.5	0	0	110.3	L509 Q510 K515 Y516 L517	L509-E513 HydrophobicContact CD2-CG 4.46Å; Q510-E513 WeakPolarHBondContact O-CB 3.4Å; Q510-E513 PolarHBondContact O-N 3.37Å; E513-K515 PolarHBondContact O-N 3.33Å; E513-Y516 PolarHBondContact O-N 3.38Å; E513-L517 HydrophobicContact CG-CD1 4.13Å; E513-L517 HydrophobicContact CG-CG 4.46Å; E513-L517 VanDerWaalsContact O-CG 3.32Å; E513-L517 WeakPolarHBondContact O-CG 3.42Å; E513-L517 PolarHBondContact O-N 3.16Å
514	L	78	Confident	72.6	Confident	4 Å²	4	88 Å²	88	2%	0.021	43%	0.429	C	S	.	.	H	α-helix	trans	-57.5	-47.6	174.2	178.3	65.3	0	0	0	111.7	Q510 Y516 L517 L518 I525 L568	Q510-L514 PolarHBondContact O-N 2.93Å; L514-Y516 VanDerWaalsContact C-N 3.29Å; L514-Y516 PolarHBondContact O-N 3.17Å; L514-L517 PolarHBondContact O-N 3.08Å; L514-L518 HydrophobicContact CD1-CD1 4Å; L514-L518 HydrophobicContact CD1-CG 4.14Å; L514-L518 HydrophobicContact CD2-CD1 4.48Å; L514-L518 HydrophobicContact CG-CD1 3.83Å; L514-L518 HydrophobicContact CG-CG 4.38Å; L514-L518 WeakPolarHBondContact O-CB 3.24Å; L514-L518 VanDerWaalsContact O-CG 3.26Å; L514-L518 WeakPolarHBondContact O-CG 3.21Å; L514-L518 PolarHBondContact O-N 3.43Å; L514-I525 HydrophobicContact CD1-CD1 4.45Å; L514-L568 HydrophobicContact CD1-CB 4.17Å; L514-L568 HydrophobicContact CD1-CD1 3.81Å; L514-L568 HydrophobicContact CD2-CB 4.07Å; L514-L568 HydrophobicContact CD2-CD1 4.23Å
515	K	78.4	Confident	73.9	Confident	83 Å²	83	87.5 Å²	87.5	36%	0.361	42%	0.423	S	S	.	.	H	α-helix	trans	-60.7	-39.6	179.1	-170.5	163.4	-170.3	150.4	0	111.8	D511 L512 E513 Q519 E614	D511-K515 PolarHBondContact O-N 3.47Å; L512-K515 PolarHBondContact O-N 3.31Å; E513-K515 PolarHBondContact O-N 3.33Å; K515-Q519 WeakPolarHBondContact O-CG 3.27Å; K515-Q519 PolarHBondContact O-N 3Å; K515-E614 IonicContact NZ-OE1 2.81Å; K515-E614 PolarHBondContact NZ-OE1 3.13Å; K515-E614 IonicContact NZ-OE2 3.72Å
516	Y	82.3	Confident	75.1	Confident	125 Å²	125	89.5 Å²	89.5	49%	0.49	43%	0.431	S	S	.	.	H	α-helix	trans	-66.3	-43.7	176	175.6	-100.7	0	0	0	112.8	L512 E513 L514 Q519 K520	L512-Y516 PolarHBondContact O-N 2.89Å; L512-Y516 VanDerWaalsContact O-N 3.14Å; E513-Y516 PolarHBondContact O-N 3.38Å; L514-Y516 VanDerWaalsContact C-N 3.29Å; L514-Y516 PolarHBondContact O-N 3.17Å; Y516-Q519 PolarHBondContact O-N 3.03Å; Y516-K520 HydrophobicContact CE1-CD 4.02Å; Y516-K520 HydrophobicContact CE2-CD 4.21Å; Y516-K520 VanDerWaalsContact CZ-CE 3.49Å; Y516-K520 PolarHBondContact O-N 3.07Å; Y516-K520 VanDerWaalsContact O-N 3.14Å; Y516-K520 VanDerWaalsContact OH-CE 3.27Å; Y516-K520 WeakPolarHBondContact OH-CE 3.42Å; Y516-K520 PolarHBondContact OH-NZ 2.73Å
517	L	82.6	Confident	76.7	Confident	9 Å²	9	82 Å²	82	5%	0.047	40%	0.396	C	S	.	.	H	α-helix	trans	-65.7	-37.8	177.7	-67.2	174	0	0	0	112.1	L509 E513 L514 K520 Q521 D522 I525	L509-L517 HydrophobicContact CD2-CD1 4.41Å; E513-L517 HydrophobicContact CG-CD1 4.13Å; E513-L517 HydrophobicContact CG-CG 4.46Å; E513-L517 VanDerWaalsContact O-CG 3.32Å; E513-L517 WeakPolarHBondContact O-CG 3.42Å; E513-L517 PolarHBondContact O-N 3.16Å; L514-L517 PolarHBondContact O-N 3.08Å; L517-K520 CarbonylContact O-C 3.58Å; L517-K520 PolarHBondContact O-N 3.23Å; L517-Q521 PolarHBondContact O-N 2.68Å; L517-Q521 VanDerWaalsContact O-N 3.08Å; L517-D522 HydrophobicContact CB-CB 4.41Å; L517-D522 HydrophobicContact CD2-CB 4.06Å; L517-D522 PolarHBondContact O-N 3.26Å; L517-D522 VanDerWaalsContact O-N 3.15Å; L517-I525 HydrophobicContact CB-CD1 3.65Å; L517-I525 HydrophobicContact CB-CG1 4.28Å; L517-I525 HydrophobicContact CB-CG2 4.49Å; L517-I525 HydrophobicContact CD1-CG2 3.87Å
518	L	78.6	Confident	78	Confident	25 Å²	25	86.4 Å²	86.4	13%	0.131	41%	0.413	C	S	.	.	H	α-helix	trans	-66.2	-41.9	175.1	-72.3	170.4	0	0	0	112.2	L514 K520 Q521 I525 A569 T630 F686	L514-L518 HydrophobicContact CD1-CD1 4Å; L514-L518 HydrophobicContact CD1-CG 4.14Å; L514-L518 HydrophobicContact CD2-CD1 4.48Å; L514-L518 HydrophobicContact CG-CD1 3.83Å; L514-L518 HydrophobicContact CG-CG 4.38Å; L514-L518 WeakPolarHBondContact O-CB 3.24Å; L514-L518 VanDerWaalsContact O-CG 3.26Å; L514-L518 WeakPolarHBondContact O-CG 3.21Å; L514-L518 PolarHBondContact O-N 3.43Å; L518-K520 PolarHBondContact O-N 3.4Å; L518-Q521 PolarHBondContact O-N 3.2Å; L518-Q521 VanDerWaalsContact O-N 3.13Å; L518-I525 HydrophobicContact CD2-CD1 3.62Å; L518-I525 HydrophobicContact CG-CD1 3.85Å; L518-A569 HydrophobicContact CD1-CB 3.65Å; L518-A569 HydrophobicContact CD2-CB 3.72Å; L518-A569 HydrophobicContact CG-CB 4.38Å; L518-T630 HydrophobicContact CD1-CG2 3.66Å; L518-F686 HydrophobicContact CD2-CB 3.53Å; L518-F686 HydrophobicContact CD2-CD1 4.06Å; L518-F686 HydrophobicContact CD2-CD2 3.52Å; L518-F686 HydrophobicContact CD2-CE2 4.21Å; L518-F686 HydrophobicContact CD2-CG 3.43Å; L518-F686 VanDerWaalsContact CD2-CG 3.43Å
519	Q	77.2	Confident	79.4	Confident	141 Å²	141	80.5 Å²	80.5	66%	0.659	38%	0.383	S	S	*	.	H	α-helix	trans	-61.3	-33.1	174.2	-77.5	177.8	-5.5	0	0	112.4	K515 Y516	K515-Q519 WeakPolarHBondContact O-CG 3.27Å; K515-Q519 PolarHBondContact O-N 3Å; Y516-Q519 PolarHBondContact O-N 3.03Å
520	K	78.7	Confident	80.5	Confident	129 Å²	129	81.3 Å²	81.3	56%	0.561	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-3.8	177.1	-73.5	-161.8	165.9	-171.6	0	114.7	Y516 L517 L518 D522	Y516-K520 HydrophobicContact CE1-CD 4.02Å; Y516-K520 HydrophobicContact CE2-CD 4.21Å; Y516-K520 VanDerWaalsContact CZ-CE 3.49Å; Y516-K520 PolarHBondContact O-N 3.07Å; Y516-K520 VanDerWaalsContact O-N 3.14Å; Y516-K520 VanDerWaalsContact OH-CE 3.27Å; Y516-K520 WeakPolarHBondContact OH-CE 3.42Å; Y516-K520 PolarHBondContact OH-NZ 2.73Å; L517-K520 CarbonylContact O-C 3.58Å; L517-K520 PolarHBondContact O-N 3.23Å; L518-K520 PolarHBondContact O-N 3.4Å; K520-D522 PolarHBondContact O-N 2.95Å
521	Q	73.7	Confident	81.2	Confident	101 Å²	101	77 Å²	77	47%	0.472	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.7	47.3	-173.8	-62.3	-177.1	-6.1	0	0	111.8	L517 L518 S523	L517-Q521 PolarHBondContact O-N 2.68Å; L517-Q521 VanDerWaalsContact O-N 3.08Å; L518-Q521 PolarHBondContact O-N 3.2Å; L518-Q521 VanDerWaalsContact O-N 3.13Å; Q521-S523 PolarHBondContact O-N 3.03Å
522	D	79.5	Confident	81.9	Confident	34 Å²	34	76.6 Å²	76.6	18%	0.182	36%	0.363	C	S	.	.			trans	-68.1	126.9	-177.4	-164.6	-47.6	0	0	0	110.4	L517 K520 R524 I525	L517-D522 HydrophobicContact CB-CB 4.41Å; L517-D522 HydrophobicContact CD2-CB 4.06Å; L517-D522 PolarHBondContact O-N 3.26Å; L517-D522 VanDerWaalsContact O-N 3.15Å; K520-D522 PolarHBondContact O-N 2.95Å; D522-R524 PolarHBondContact O-N 3.4Å; D522-R524 VanDerWaalsContact O-N 3.13Å; D522-R524 VanDerWaalsContact OD1-CB 3.28Å; D522-R524 WeakPolarHBondContact OD1-CB 3.44Å; D522-R524 VanDerWaalsContact OD1-CG 3.23Å; D522-R524 WeakPolarHBondContact OD1-CG 3.49Å; D522-R524 IonicContact OD1-CZ 2.79Å; D522-R524 PolarHBondContact OD1-N 3.36Å; D522-R524 IonicContact OD1-NE 2.69Å; D522-R524 PolarHBondContact OD1-NE 2.91Å; D522-R524 IonicContact OD2-CZ 3.21Å; D522-R524 IonicContact OD2-NE 3.63Å; D522-R524 PolarHBondContact OD2-NE 2.93Å; D522-R524 VanDerWaalsContact OD2-NE 3.12Å; D522-R524 IonicContact OD2-NH2 3.08Å; D522-R524 PolarHBondContact OD2-NH2 3.25Å; D522-I525 WeakPolarHBondContact O-CG1 3.44Å; D522-I525 PolarHBondContact O-N 2.81Å
523	S	79.3	Confident	82.4	Confident	91 Å²	91	71 Å²	71	64%	0.636	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-65.7	-15	-177.8	58.1	0	0	0	0	113.5	Q521 I525 E526	Q521-S523 PolarHBondContact O-N 3.03Å; S523-I525 VanDerWaalsContact C-N 3.29Å; S523-I525 PolarHBondContact O-N 3.02Å; S523-E526 PolarHBondContact O-N 3.47Å
524	R	78.4	Confident	82.6	Confident	185 Å²	185	74.1 Å²	74.1	70%	0.698	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-67.5	-27.5	177.9	-67.2	179.9	-67.2	158.6	0.7	113.8	D522	D522-R524 PolarHBondContact O-N 3.4Å; D522-R524 VanDerWaalsContact O-N 3.13Å; D522-R524 VanDerWaalsContact OD1-CB 3.28Å; D522-R524 WeakPolarHBondContact OD1-CB 3.44Å; D522-R524 VanDerWaalsContact OD1-CG 3.23Å; D522-R524 WeakPolarHBondContact OD1-CG 3.49Å; D522-R524 IonicContact OD1-CZ 2.79Å; D522-R524 PolarHBondContact OD1-N 3.36Å; D522-R524 IonicContact OD1-NE 2.69Å; D522-R524 PolarHBondContact OD1-NE 2.91Å; D522-R524 IonicContact OD2-CZ 3.21Å; D522-R524 IonicContact OD2-NE 3.63Å; D522-R524 PolarHBondContact OD2-NE 2.93Å; D522-R524 VanDerWaalsContact OD2-NE 3.12Å; D522-R524 IonicContact OD2-NH2 3.08Å; D522-R524 PolarHBondContact OD2-NH2 3.25Å
525	I	83.6	Confident	82.7	Confident	8 Å²	8	76.2 Å²	76.2	4%	0.041	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-102.2	2.7	177.9	56.9	159.2	0	0	0	111.8	L514 L517 L518 D522 S523 F686 G687	L514-I525 HydrophobicContact CD1-CD1 4.45Å; L517-I525 HydrophobicContact CB-CD1 3.65Å; L517-I525 HydrophobicContact CB-CG1 4.28Å; L517-I525 HydrophobicContact CB-CG2 4.49Å; L517-I525 HydrophobicContact CD1-CG2 3.87Å; L518-I525 HydrophobicContact CD2-CD1 3.62Å; L518-I525 HydrophobicContact CG-CD1 3.85Å; D522-I525 WeakPolarHBondContact O-CG1 3.44Å; D522-I525 PolarHBondContact O-N 2.81Å; S523-I525 VanDerWaalsContact C-N 3.29Å; S523-I525 PolarHBondContact O-N 3.02Å; I525-F686 HydrophobicContact CD1-CB 4.39Å; I525-F686 HydrophobicContact CD1-CD1 3.99Å; I525-F686 HydrophobicContact CD1-CG 4.42Å; I525-F686 HydrophobicContact CG1-CD1 3.91Å; I525-F686 CarbonylContact O-C 3.53Å; I525-F686 WeakPolarHBondContact O-CA 3.48Å; I525-G687 CarbonylContact C-O 3.58Å; I525-G687 PolarHBondContact O-N 3.23Å
526	E	85.6	Confident	83.1	Confident	76 Å²	76	72.8 Å²	72.8	36%	0.355	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	124.2	176.7	-172.2	179.5	179.4	0	0	109.7	S523 Q684 F686	S523-E526 PolarHBondContact O-N 3.47Å; E526-Q684 VanDerWaalsContact CD-NE2 3.34Å; E526-Q684 PolarHBondContact OE1-NE2 3.31Å; E526-F686 HydrophobicContact CB-CD1 4.2Å; E526-F686 HydrophobicContact CB-CE1 4.13Å; E526-F686 HydrophobicContact CG-CE1 4.41Å
527	V	88	Confident	83.3	Confident	4 Å²	4	76.6 Å²	76.6	2%	0.024	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	118.8	172.1	-177	0	0	0	0	108.4	S529 S556 H565 F639 V685	V527-S529 PolarHBondContact O-N 2.94Å; V527-S556 VanDerWaalsContact CG1-OG 3.24Å; V527-S556 WeakPolarHBondContact CG1-OG 3.35Å; V527-H565 HydrophobicContact CG1-CB 4.11Å; V527-H565 WeakPolarHBondContact CG1-ND1 3.3Å; V527-F639 HydrophobicContact CB-CE1 4.42Å; V527-F639 HydrophobicContact CB-CZ 3.83Å; V527-F639 HydrophobicContact CG1-CE1 4.3Å; V527-F639 HydrophobicContact CG1-CZ 3.65Å; V527-F639 HydrophobicContact CG2-CE1 4.34Å; V527-F639 HydrophobicContact CG2-CZ 4.24Å; V527-V685 PolarHBondContact N-O 2.02Å
528	H	85.3	Confident	83.6	Confident	151 Å²	151	79.2 Å²	79.2	70%	0.699	38%	0.38	S	S	*	.			trans	-59.9	113.6	179.6	-172.9	74.5	0	0	0	110.9
529	S	86.4	Confident	84	Confident	24 Å²	24	80 Å²	80	17%	0.168	39%	0.394	C	S	.	.			trans	-128.5	144.4	178.9	58.7	0	0	0	0	111	V527 K555	V527-S529 PolarHBondContact O-N 2.94Å; S529-K555 WeakPolarHBondContact CA-O 3.02Å
530	I	87.4	Confident	84.6	Confident	55 Å²	55	75.5 Å²	75.5	28%	0.282	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	122.6	-179.9	-57.8	171.9	0	0	0	108.2	I532 L554 K555 K558 Y559	I530-I532 HydrophobicContact CG2-CG1 4.19Å; I530-L554 WeakPolarHBondContact O-CA 3.25Å; I530-K555 PolarHBondContact N-O 2.91Å; I530-K555 PolarHBondContact O-N 3.24Å; I530-K558 HydrophobicContact CD1-CB 3.85Å; I530-K558 HydrophobicContact CD1-CD 3.85Å; I530-K558 HydrophobicContact CD1-CG 4.49Å; I530-Y559 HydrophobicContact CD1-CE2 4.3Å
531	F	89.5	Confident	84.9	Confident	48 Å²	48	75 Å²	75	21%	0.211	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	128.8	172	177.7	-95.8	0	0	0	111.3	S533 M536 L538 L552 T553 L554 L683	F531-S533 VanDerWaalsContact CZ-CB 3.48Å; F531-M536 HydrophobicContact CE1-SD 4.25Å; F531-M536 HydrophobicContact CZ-SD 3.7Å; F531-L538 HydrophobicContact CB-CD1 3.82Å; F531-L538 HydrophobicContact CD1-CD1 4.05Å; F531-L538 HydrophobicContact CD1-CG 3.81Å; F531-L538 HydrophobicContact CD2-CD1 4.07Å; F531-L538 HydrophobicContact CD2-CD2 4.11Å; F531-L538 HydrophobicContact CD2-CG 4.09Å; F531-L538 HydrophobicContact CE1-CD2 4.42Å; F531-L538 HydrophobicContact CE1-CG 3.97Å; F531-L538 HydrophobicContact CE2-CD2 3.95Å; F531-L538 HydrophobicContact CE2-CG 4.22Å; F531-L538 HydrophobicContact CG-CD1 3.71Å; F531-L538 HydrophobicContact CG-CD2 4.4Å; F531-L538 HydrophobicContact CG-CG 3.87Å; F531-L538 HydrophobicContact CZ-CD2 4.12Å; F531-L538 HydrophobicContact CZ-CG 4.17Å; F531-L552 HydrophobicContact CE2-CB 3.99Å; F531-L552 HydrophobicContact CE2-CD2 3.93Å; F531-L552 HydrophobicContact CE2-CG 4.46Å; F531-L552 HydrophobicContact CZ-CD2 3.81Å; F531-T553 CarbonylContact C-O 3.58Å; F531-L554 HydrophobicContact CB-CD2 4.29Å; F531-L554 HydrophobicContact CD2-CD2 4.28Å; F531-L683 HydrophobicContact CD2-CD2 4.06Å; F531-L683 HydrophobicContact CE2-CD2 4.13Å
532	I	88.9	Confident	85.5	Confident	75 Å²	75	71.4 Å²	71.4	39%	0.385	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	116.7	178.7	-54.2	173.7	0	0	0	107.7	I530 T553 K555	I530-I532 HydrophobicContact CG2-CG1 4.19Å; I532-T553 PolarHBondContact N-O 3.04Å; I532-T553 WeakPolarHBondContact O-CA 3.22Å; I532-T553 WeakPolarHBondContact O-CB 3.35Å; I532-T553 PolarHBondContact O-N 3.5Å; I532-K555 HydrophobicContact CD1-CB 4.23Å
533	S	87.6	Confident	85.6	Confident	26 Å²	26	72.6 Å²	72.6	18%	0.182	36%	0.362	C	S	.	.			trans	-146.9	141	170	-175.5	0	0	0	0	109.8	F531 D535 L551	F531-S533 VanDerWaalsContact CZ-CB 3.48Å; S533-D535 PolarHBondContact OG-N 3.43Å; S533-L551 WeakPolarHBondContact CB-O 3.26Å; S533-L551 PolarHBondContact OG-O 3.18Å
534	N	84.6	Confident	85.4	Confident	163 Å²	163	68.3 Å²	68.3	87%	0.872	33%	0.332	S	S	*	.	S	Bend	trans	-87.4	-16	171.5	-68.6	-25.6	0	0	0	112
535	D	81.8	Confident	85	Confident	47 Å²	47	62.4 Å²	62.4	25%	0.251	32%	0.319	S	S	.	.	S	Bend	trans	-95.4	-31.9	-170.1	-58.2	-53.3	0	0	0	112	S533 R547 M550 L551	S533-D535 PolarHBondContact OG-N 3.43Å; D535-R547 VanDerWaalsContact OD1-CD 3.29Å; D535-R547 WeakPolarHBondContact OD1-CD 3.3Å; D535-R547 IonicContact OD1-CZ 3.35Å; D535-R547 IonicContact OD1-NE 3.21Å; D535-R547 IonicContact OD1-NH1 3.01Å; D535-R547 PolarHBondContact OD1-NH1 3.05Å; D535-M550 HydrophobicContact CB-CB 4.22Å; D535-M550 HydrophobicContact CB-CG 4.08Å; D535-M550 WeakPolarHBondContact OD2-CA 2.9Å; D535-L551 PolarHBondContact OD2-N 3.09Å
536	M	85.1	Confident	84.3	Confident	12 Å²	12	72.7 Å²	72.7	6%	0.059	36%	0.358	C	S	.	.			trans	-153.3	164.2	-176.5	75.2	81.6	58	0	0	113.8	F531 F542 L552 I680	F531-M536 HydrophobicContact CE1-SD 4.25Å; F531-M536 HydrophobicContact CZ-SD 3.7Å; M536-F542 HydrophobicContact CB-CD1 4.13Å; M536-F542 HydrophobicContact CB-CE1 4.49Å; M536-F542 HydrophobicContact CB-CG 4.32Å; M536-F542 HydrophobicContact CE-CD1 3.63Å; M536-F542 HydrophobicContact CE-CE1 3.5Å; M536-F542 HydrophobicContact CG-CD1 4.5Å; M536-F542 HydrophobicContact CG-CE1 4.37Å; M536-L552 HydrophobicContact CG-CD2 3.8Å; M536-L552 HydrophobicContact SD-CD2 4.13Å; M536-I680 HydrophobicContact CE-CB 3.89Å; M536-I680 HydrophobicContact CE-CD1 4.33Å; M536-I680 HydrophobicContact CE-CG1 4.29Å; M536-I680 HydrophobicContact SD-CD1 4.33Å
537	R	86.8	Confident	83.5	Confident	204 Å²	204	76 Å²	76	77%	0.77	37%	0.367	S	S	*	.			trans	-115.9	137.4	172.8	-63.2	-175.3	-179	-159.8	0.8	110.4	G539 S540	R537-G539 PolarHBondContact O-N 3.01Å; R537-S540 PolarHBondContact O-N 3.41Å; R537-S540 PolarHBondContact O-OG 2.81Å
538	L	89.3	Confident	82.4	Confident	64 Å²	64	82.5 Å²	82.5	34%	0.335	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	139.9	174	-64	176.7	0	0	0	110.7	F531 S540 I680 L683	F531-L538 HydrophobicContact CB-CD1 3.82Å; F531-L538 HydrophobicContact CD1-CD1 4.05Å; F531-L538 HydrophobicContact CD1-CG 3.81Å; F531-L538 HydrophobicContact CD2-CD1 4.07Å; F531-L538 HydrophobicContact CD2-CD2 4.11Å; F531-L538 HydrophobicContact CD2-CG 4.09Å; F531-L538 HydrophobicContact CE1-CD2 4.42Å; F531-L538 HydrophobicContact CE1-CG 3.97Å; F531-L538 HydrophobicContact CE2-CD2 3.95Å; F531-L538 HydrophobicContact CE2-CG 4.22Å; F531-L538 HydrophobicContact CG-CD1 3.71Å; F531-L538 HydrophobicContact CG-CD2 4.4Å; F531-L538 HydrophobicContact CG-CG 3.87Å; F531-L538 HydrophobicContact CZ-CD2 4.12Å; F531-L538 HydrophobicContact CZ-CG 4.17Å; L538-S540 VanDerWaalsContact C-N 3.32Å; L538-S540 PolarHBondContact O-N 2.89Å; L538-I680 WeakPolarHBondContact CA-O 3.29Å; L538-I680 HydrophobicContact CD2-CB 4.28Å; L538-I680 HydrophobicContact CD2-CG2 3.6Å; L538-L683 HydrophobicContact CD2-CB 4.36Å
539	G	87.3	Confident	81.8	Confident	41 Å²	41	82.4 Å²	82.4	42%	0.423	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	5.2	-179.4	0	0	0	0	0	115.6	R537 K679 I680	R537-G539 PolarHBondContact O-N 3.01Å; G539-K679 WeakPolarHBondContact O-CE 3.41Å; G539-I680 PolarHBondContact N-O 2.96Å
540	S	89.1	Confident	81.7	Confident	47 Å²	47	81.7 Å²	81.7	33%	0.329	38%	0.382	S	S	.	.			trans	-110.6	144.1	176.1	67.4	0	0	0	0	112.6	R537 L538	R537-S540 PolarHBondContact O-N 3.41Å; R537-S540 PolarHBondContact O-OG 2.81Å; L538-S540 VanDerWaalsContact C-N 3.32Å; L538-S540 PolarHBondContact O-N 2.89Å
541	W	86.8	Confident	81.7	Confident	118 Å²	118	81.7 Å²	81.7	45%	0.447	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	135	171.9	-70.8	100.2	0	0	0	109.6	C575 T577 Y677 M678 K679	W541-C575 HydrophobicContact CH2-CB 3.99Å; W541-C575 WeakPolarHBondContact CZ3-O 3.37Å; W541-T577 HydrophobicContact CE3-CG2 4.14Å; W541-T577 HydrophobicContact CH2-CG2 4.14Å; W541-T577 HydrophobicContact CZ3-CG2 3.75Å; W541-Y677 WeakPolarHBondContact CZ3-O 3.08Å; W541-M678 WeakPolarHBondContact CA-O 3.15Å; W541-K679 HydrophobicContact CD2-CB 3.56Å; W541-K679 HydrophobicContact CD2-CD 4.18Å; W541-K679 HydrophobicContact CD2-CG 4.4Å; W541-K679 HydrophobicContact CE3-CB 3.51Å; W541-K679 HydrophobicContact CG-CB 4.1Å; W541-K679 HydrophobicContact CG-CD 4.4Å; W541-K679 HydrophobicContact CH2-CB 4.16Å; W541-K679 HydrophobicContact CZ2-CB 4.22Å; W541-K679 HydrophobicContact CZ2-CD 4.15Å; W541-K679 HydrophobicContact CZ3-CB 3.81Å
542	F	85.4	Confident	81.8	Confident	27 Å²	27	79.4 Å²	79.4	12%	0.118	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	159.7	177.6	66.5	-85.4	0	0	0	110.5	M536 P544 M550 L646 M678 I680	M536-F542 HydrophobicContact CB-CD1 4.13Å; M536-F542 HydrophobicContact CB-CE1 4.49Å; M536-F542 HydrophobicContact CB-CG 4.32Å; M536-F542 HydrophobicContact CE-CD1 3.63Å; M536-F542 HydrophobicContact CE-CE1 3.5Å; M536-F542 HydrophobicContact CG-CD1 4.5Å; M536-F542 HydrophobicContact CG-CE1 4.37Å; F542-P544 HydrophobicContact CE2-CB 4.02Å; F542-P544 WeakPolarHBondContact O-CD 3.28Å; F542-M550 HydrophobicContact CD2-SD 3.88Å; F542-M550 HydrophobicContact CE2-CE 3.68Å; F542-M550 HydrophobicContact CE2-SD 3.37Å; F542-M550 WeakPolarHBondContact CE2-SD 3.44Å; F542-M550 HydrophobicContact CZ-CE 4.34Å; F542-M550 HydrophobicContact CZ-SD 4.2Å; F542-L646 HydrophobicContact CZ-CD2 4.43Å; F542-M678 WeakPolarHBondContact CD1-O 2.95Å; F542-M678 HydrophobicContact CE1-CB 4.24Å; F542-M678 HydrophobicContact CE1-CG 4.27Å; F542-M678 WeakPolarHBondContact CE1-O 3.36Å; F542-M678 HydrophobicContact CE2-CB 4.2Å; F542-M678 HydrophobicContact CE2-SD 4.42Å; F542-M678 HydrophobicContact CZ-CB 3.88Å; F542-M678 HydrophobicContact CZ-CG 3.9Å; F542-M678 HydrophobicContact CZ-SD 3.81Å; F542-M678 PolarHBondContact N-O 3.43Å; F542-M678 PolarHBondContact O-N 3.45Å; F542-I680 HydrophobicContact CE1-CD1 4.42Å; F542-I680 HydrophobicContact CE1-CG1 4.22Å; F542-I680 HydrophobicContact CZ-CD1 4.39Å; F542-I680 HydrophobicContact CZ-CG1 4.48Å
543	D	81.7	Confident	81.9	Confident	58 Å²	58	76.7 Å²	76.7	31%	0.31	36%	0.359	S	S	.	.			trans	-91.9	112.6	175.8	-173.6	-17.5	0	0	0	109.3	S545 W546 Y677	D543-S545 PolarHBondContact O-N 3.32Å; D543-S545 VanDerWaalsContact OD1-CB 3.26Å; D543-S545 WeakPolarHBondContact OD1-CB 3.37Å; D543-S545 PolarHBondContact OD1-N 3.33Å; D543-S545 PolarHBondContact OD1-OG 3.4Å; D543-S545 PolarHBondContact OD2-OG 3.4Å; D543-W546 PolarHBondContact O-N 2.97Å; D543-Y677 HydrophobicContact CB-CD1 4.16Å; D543-Y677 HydrophobicContact CB-CE1 4.03Å
544	P	75.6	Confident	82	Confident	1 Å²	1	75.5 Å²	75.5	1%	0.006	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-6.9	-178.1	32.2	-35	0	0	0	113	F542 W546 M550 L582 S648 M678	F542-P544 HydrophobicContact CE2-CB 4.02Å; F542-P544 WeakPolarHBondContact O-CD 3.28Å; P544-W546 VanDerWaalsContact C-N 3.33Å; P544-M550 HydrophobicContact CB-CE 3.97Å; P544-L582 HydrophobicContact CG-CD1 3.41Å; P544-L582 VanDerWaalsContact CG-CD1 3.41Å; P544-S648 PolarHBondContact O-OG 2.93Å; P544-M678 HydrophobicContact CG-CB 4.26Å
545	S	69.8	Low	82.3	Confident	62 Å²	62	70.4 Å²	70.4	43%	0.434	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-19.9	176.2	71.6	0	0	0	0	113.1	D543 R547	D543-S545 PolarHBondContact O-N 3.32Å; D543-S545 VanDerWaalsContact OD1-CB 3.26Å; D543-S545 WeakPolarHBondContact OD1-CB 3.37Å; D543-S545 PolarHBondContact OD1-N 3.33Å; D543-S545 PolarHBondContact OD1-OG 3.4Å; D543-S545 PolarHBondContact OD2-OG 3.4Å; S545-R547 VanDerWaalsContact C-N 3.28Å; S545-R547 PolarHBondContact O-N 3.21Å
546	W	67.8	Low	82.4	Confident	224 Å²	224	68.9 Å²	68.9	85%	0.848	31%	0.314	S	S	*	.	S	Bend	trans	-67.9	-25.9	-173.2	-170.7	17.7	0	0	0	113.4	D543 P544	D543-W546 PolarHBondContact O-N 2.97Å; P544-W546 VanDerWaalsContact C-N 3.33Å
547	R	68.5	Low	81.7	Confident	146 Å²	146	68.8 Å²	68.8	55%	0.551	31%	0.314	S	S	*	.			trans	-138.6	132.6	176.4	-73.1	-169.4	172.9	-155.6	-5.9	111.9	D535 S545 R549 M550	D535-R547 VanDerWaalsContact OD1-CD 3.29Å; D535-R547 WeakPolarHBondContact OD1-CD 3.3Å; D535-R547 IonicContact OD1-CZ 3.35Å; D535-R547 IonicContact OD1-NE 3.21Å; D535-R547 IonicContact OD1-NH1 3.01Å; D535-R547 PolarHBondContact OD1-NH1 3.05Å; S545-R547 VanDerWaalsContact C-N 3.28Å; S545-R547 PolarHBondContact O-N 3.21Å; R547-R549 PolarHBondContact O-N 3.33Å; R547-M550 HydrophobicContact CB-CG 4.43Å
548	K	66.1	Low	80.5	Confident	139 Å²	139	64.3 Å²	64.3	60%	0.604	30%	0.3	S	S	*	.	S	Bend	trans	-61	-27.4	179.9	-68.6	-174.3	176	-177	0	114.2	L666	K548-L666 WeakPolarHBondContact CE-O 3.49Å
549	R	71.9	Confident	78.9	Confident	150 Å²	150	69.7 Å²	69.7	57%	0.566	32%	0.317	S	S	*	.			trans	-145.8	119.3	179.6	-58.9	-176.4	-176	-177.2	-0.7	108.5	R547 Y645 R647	R547-R549 PolarHBondContact O-N 3.33Å; R549-Y645 HydrophobicContact CB-CD1 4.49Å; R549-R647 HydrophobicContact CG-CG 4.24Å; R549-R647 VanDerWaalsContact NE-CZ 3.28Å
550	M	84.4	Confident	77.7	Confident	8 Å²	8	74.5 Å²	74.5	4%	0.039	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	136.5	171.8	-65.9	170.8	-73.1	0	0	109	D535 F542 P544 R547 Y645 L646	D535-M550 HydrophobicContact CB-CB 4.22Å; D535-M550 HydrophobicContact CB-CG 4.08Å; D535-M550 WeakPolarHBondContact OD2-CA 2.9Å; F542-M550 HydrophobicContact CD2-SD 3.88Å; F542-M550 HydrophobicContact CE2-CE 3.68Å; F542-M550 HydrophobicContact CE2-SD 3.37Å; F542-M550 WeakPolarHBondContact CE2-SD 3.44Å; F542-M550 HydrophobicContact CZ-CE 4.34Å; F542-M550 HydrophobicContact CZ-SD 4.2Å; P544-M550 HydrophobicContact CB-CE 3.97Å; R547-M550 HydrophobicContact CB-CG 4.43Å; M550-Y645 WeakPolarHBondContact O-CA 3.17Å; M550-L646 HydrophobicContact CB-CB 4.45Å; M550-L646 HydrophobicContact CE-CB 4.33Å; M550-L646 HydrophobicContact CE-CD2 3.85Å; M550-L646 HydrophobicContact CE-CG 3.99Å; M550-L646 PolarHBondContact N-O 3.46Å; M550-L646 PolarHBondContact O-N 2.98Å
551	L	88.4	Confident	76.7	Confident	55 Å²	55	76.8 Å²	76.8	29%	0.288	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	120.1	178.9	178.2	60.6	0	0	0	110.1	S533 D535 H643 Y645	S533-L551 WeakPolarHBondContact CB-O 3.26Å; S533-L551 PolarHBondContact OG-O 3.18Å; D535-L551 PolarHBondContact OD2-N 3.09Å; L551-H643 HydrophobicContact CD1-CB 3.93Å; L551-Y645 HydrophobicContact CB-CE1 4.34Å; L551-Y645 HydrophobicContact CD1-CD1 4.27Å; L551-Y645 HydrophobicContact CD1-CD2 4.37Å; L551-Y645 HydrophobicContact CD1-CE1 3.9Å; L551-Y645 HydrophobicContact CD1-CE2 3.97Å
552	L	90.6	Very high	76.2	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.2	173.7	-48.2	173.4	0	0	0	107.4	F531 M536 V644 L646 I680 L683	F531-L552 HydrophobicContact CE2-CB 3.99Å; F531-L552 HydrophobicContact CE2-CD2 3.93Å; F531-L552 HydrophobicContact CE2-CG 4.46Å; F531-L552 HydrophobicContact CZ-CD2 3.81Å; M536-L552 HydrophobicContact CG-CD2 3.8Å; M536-L552 HydrophobicContact SD-CD2 4.13Å; L552-V644 HydrophobicContact CB-CB 4.2Å; L552-V644 PolarHBondContact N-O 2.83Å; L552-V644 PolarHBondContact O-N 3.28Å; L552-L646 HydrophobicContact CD1-CB 4.33Å; L552-L646 HydrophobicContact CD1-CD2 4.38Å; L552-I680 HydrophobicContact CD1-CD1 3.59Å; L552-I680 HydrophobicContact CD2-CD1 4.39Å; L552-L683 HydrophobicContact CB-CD2 4.24Å
553	T	90.9	Very high	76.1	Confident	18 Å²	18	74 Å²	74	11%	0.11	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	129.7	-179.6	-58.8	0	0	0	0	110.4	F531 I532 V642 H643	F531-T553 CarbonylContact C-O 3.58Å; I532-T553 PolarHBondContact N-O 3.04Å; I532-T553 WeakPolarHBondContact O-CA 3.22Å; I532-T553 WeakPolarHBondContact O-CB 3.35Å; I532-T553 PolarHBondContact O-N 3.5Å; T553-V642 CarbonylContact C-O 3.44Å; T553-V642 WeakPolarHBondContact CA-O 3.18Å; T553-H643 WeakPolarHBondContact CG2-ND1 3.38Å; T553-H643 PolarHBondContact OG1-ND1 2.88Å
554	L	91.1	Very high	76.4	Confident	1 Å²	1	71.2 Å²	71.2	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	130.7	168.1	-64	168.9	0	0	0	108.7	I530 F531 L570 T641 V642 L683 V685	I530-L554 WeakPolarHBondContact O-CA 3.25Å; F531-L554 HydrophobicContact CB-CD2 4.29Å; F531-L554 HydrophobicContact CD2-CD2 4.28Å; L554-L570 HydrophobicContact CD1-CD1 3.83Å; L554-T641 CarbonylContact O-C 3.31Å; L554-T641 WeakPolarHBondContact O-CA 3.46Å; L554-V642 HydrophobicContact CB-CB 4.33Å; L554-V642 PolarHBondContact N-O 3.29Å; L554-V642 PolarHBondContact O-N 3.28Å; L554-L683 HydrophobicContact CD1-CD1 3.87Å; L554-L683 HydrophobicContact CD1-CD2 3.79Å; L554-L683 HydrophobicContact CD1-CG 3.49Å; L554-L683 VanDerWaalsContact CD1-CG 3.49Å; L554-L683 HydrophobicContact CD2-CB 4.44Å; L554-L683 HydrophobicContact CD2-CD2 3.85Å; L554-L683 HydrophobicContact CD2-CG 3.82Å; L554-L683 HydrophobicContact CG-CD2 3.74Å; L554-L683 HydrophobicContact CG-CG 3.89Å; L554-V685 HydrophobicContact CB-CG2 4.38Å; L554-V685 HydrophobicContact CD1-CG2 3.39Å; L554-V685 HydrophobicContact CG-CG2 4.49Å
555	K	89.8	Confident	77	Confident	57 Å²	57	71.7 Å²	71.7	25%	0.248	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	118	176.7	-174.4	164.4	-176.7	170.8	0	111	S529 I530 I532 E640 T641	S529-K555 WeakPolarHBondContact CA-O 3.02Å; I530-K555 PolarHBondContact N-O 2.91Å; I530-K555 PolarHBondContact O-N 3.24Å; I532-K555 HydrophobicContact CD1-CB 4.23Å; K555-E640 WeakPolarHBondContact CA-O 3.41Å; K555-T641 HydrophobicContact CB-CG2 3.91Å; K555-T641 HydrophobicContact CD-CG2 3.93Å; K555-T641 HydrophobicContact CG-CG2 3.7Å
556	S	83.7	Confident	78	Confident	14 Å²	14	68.8 Å²	68.8	10%	0.098	31%	0.31	C	S	.	.	S	Bend	trans	-79.7	-42.8	-176.9	-163.4	0	0	0	0	112.7	V527 H565 E640	V527-S556 VanDerWaalsContact CG1-OG 3.24Å; V527-S556 WeakPolarHBondContact CG1-OG 3.35Å; S556-H565 VanDerWaalsContact CB-CD2 3.45Å; S556-H565 WeakPolarHBondContact CB-CD2 3.45Å; S556-H565 PolarHBondContact OG-CD2 3.13Å; S556-H565 PolarHBondContact OG-CE1 3.21Å; S556-H565 VanDerWaalsContact OG-CG 3.3Å; S556-H565 PolarHBondContact OG-NE2 3.31Å; S556-E640 PolarHBondContact N-O 2.66Å
557	N	70.1	Confident	79	Confident	10 Å²	10	58.2 Å²	58.2	5%	0.053	27%	0.27	C	S	.	.			trans	-114.8	66.6	-164.9	-160.8	-8.2	0	0	0	114	K560 L563 E640 R748	N557-K560 PolarHBondContact ND2-O 3.48Å; N557-K560 WeakPolarHBondContact OD1-CA 3.49Å; N557-K560 PolarHBondContact OD1-N 3.37Å; N557-K560 PolarHBondContact OD1-O 2.99Å; N557-L563 PolarHBondContact ND2-O 2.8Å; N557-E640 HydrophobicContact CB-CG 4.23Å; N557-R748 PolarHBondContact ND2-NH1 3.25Å; N557-R748 PolarHBondContact ND2-NH2 3.29Å
558	K	62.3	Low	80	Confident	110 Å²	110	51.3 Å²	51.3	48%	0.478	24%	0.244	S	C	.	.	S	Bend	trans	-80.6	-20.8	175.4	-164.3	176.1	176.4	-163.5	0	113.1	I530	I530-K558 HydrophobicContact CD1-CB 3.85Å; I530-K558 HydrophobicContact CD1-CD 3.85Å; I530-K558 HydrophobicContact CD1-CG 4.49Å
559	Y	56.2	Low	81.1	Confident	177 Å²	177	44.8 Å²	44.8	69%	0.694	22%	0.216	S	C	*	.	S	Bend	trans	-143.6	4	-168.1	-56.9	-72.7	0	0	0	116.4	I530	I530-Y559 HydrophobicContact CD1-CE2 4.3Å
560	K	61.4	Low	82	Confident	143 Å²	143	37.8 Å²	37.8	62%	0.622	19%	0.19	S	C	*	.			trans	-133.2	80	-175.9	-71	-170.5	178.6	-178	0	112.7	N557 G562 L563	N557-K560 PolarHBondContact ND2-O 3.48Å; N557-K560 WeakPolarHBondContact OD1-CA 3.49Å; N557-K560 PolarHBondContact OD1-N 3.37Å; N557-K560 PolarHBondContact OD1-O 2.99Å; K560-G562 PolarHBondContact O-N 2.76Å; K560-G562 VanDerWaalsContact O-N 3.1Å; K560-L563 HydrophobicContact CD-CD1 4.03Å; K560-L563 PolarHBondContact O-N 2.79Å
561	P	67.9	Low	82.3	Confident	95 Å²	95	37.5 Å²	37.5	62%	0.617	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-22.3	-175.5	26.3	-34.8	0	0	0	114.3	L563	P561-L563 VanDerWaalsContact C-N 3.25Å; P561-L563 PolarHBondContact O-N 2.96Å
562	G	76.8	Confident	82.4	Confident	35 Å²	35	35 Å²	35	36%	0.361	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	12.1	-179.2	0	0	0	0	0	115.8	K560 F692	K560-G562 PolarHBondContact O-N 2.76Å; K560-G562 VanDerWaalsContact O-N 3.1Å; G562-F692 CarbonylContact C-O 3.46Å; G562-F692 VanDerWaalsContact CA-O 3.23Å; G562-F692 WeakPolarHBondContact CA-O 3.3Å; G562-F692 PolarHBondContact O-N 2.82Å
563	L	84.1	Confident	82.4	Confident	50 Å²	50	36.3 Å²	36.3	26%	0.262	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	139.4	176	-66.7	173.3	0	0	0	111	N557 K560 P561 L690	N557-L563 PolarHBondContact ND2-O 2.8Å; K560-L563 HydrophobicContact CD-CD1 4.03Å; K560-L563 PolarHBondContact O-N 2.79Å; P561-L563 VanDerWaalsContact C-N 3.25Å; P561-L563 PolarHBondContact O-N 2.96Å; L563-L690 WeakPolarHBondContact CA-O 3.39Å; L563-L690 WeakPolarHBondContact CD2-O 3.38Å
564	V	87.2	Confident	82.3	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	140.2	170.7	173.2	0	0	0	0	108.2	F593 F638 L690 F692	V564-F593 HydrophobicContact CG1-CD1 4.45Å; V564-F593 HydrophobicContact CG1-CE1 3.75Å; V564-F593 HydrophobicContact CG2-CE1 4.47Å; V564-F638 HydrophobicContact CG1-CD1 3.26Å; V564-F638 HydrophobicContact CG1-CE1 3.41Å; V564-F638 VanDerWaalsContact CG1-CE1 3.41Å; V564-F638 HydrophobicContact CG1-CG 4.23Å; V564-F638 HydrophobicContact CG1-CZ 4.47Å; V564-L690 PolarHBondContact N-O 2.84Å; V564-L690 PolarHBondContact O-N 3.1Å; V564-F692 HydrophobicContact CB-CB 4.41Å; V564-F692 HydrophobicContact CG2-CB 3.68Å; V564-F692 HydrophobicContact CG2-CD1 4.22Å; V564-F692 HydrophobicContact CG2-CD2 4.09Å; V564-F692 HydrophobicContact CG2-CG 3.72Å
565	H	88.4	Confident	82.2	Confident	12 Å²	12	35.6 Å²	35.6	6%	0.056	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.2	-173.4	-50.5	-79.9	0	0	0	111.6	V527 S556 F638 F639 S689	V527-H565 HydrophobicContact CG1-CB 4.11Å; V527-H565 WeakPolarHBondContact CG1-ND1 3.3Å; S556-H565 VanDerWaalsContact CB-CD2 3.45Å; S556-H565 WeakPolarHBondContact CB-CD2 3.45Å; S556-H565 PolarHBondContact OG-CD2 3.13Å; S556-H565 PolarHBondContact OG-CE1 3.21Å; S556-H565 VanDerWaalsContact OG-CG 3.3Å; S556-H565 PolarHBondContact OG-NE2 3.31Å; H565-F638 WeakPolarHBondContact O-CA 3.35Å; H565-F639 HydrophobicContact CB-CD1 3.81Å; H565-F639 HydrophobicContact CB-CE1 3.39Å; H565-F639 HydrophobicContact CB-CZ 3.86Å; H565-F639 PolarHBondContact O-N 2.91Å; H565-S689 PolarHBondContact CE1-OG 3.44Å; H565-S689 PolarHBondContact ND1-OG 2.92Å
566	V	89.8	Confident	82	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.6	174.6	178.8	0	0	0	0	108.3	K636 T637 F638 G687 Y688 L690	V566-K636 HydrophobicContact CG1-CB 3.92Å; V566-K636 HydrophobicContact CG1-CD 4.27Å; V566-K636 HydrophobicContact CG1-CG 4.36Å; V566-T637 CarbonylContact C-O 3.58Å; V566-T637 WeakPolarHBondContact CA-O 3.23Å; V566-F638 HydrophobicContact CG2-CD1 3.82Å; V566-F638 HydrophobicContact CG2-CE1 3.76Å; V566-G687 WeakPolarHBondContact O-CA 3.31Å; V566-Y688 HydrophobicContact CB-CD2 4.12Å; V566-Y688 HydrophobicContact CB-CE1 4.13Å; V566-Y688 HydrophobicContact CB-CE2 3.71Å; V566-Y688 HydrophobicContact CG1-CE1 4.02Å; V566-Y688 HydrophobicContact CG1-CE2 4.28Å; V566-Y688 HydrophobicContact CG2-CD2 4.3Å; V566-Y688 HydrophobicContact CG2-CE2 3.66Å; V566-Y688 PolarHBondContact N-O 2.81Å; V566-Y688 PolarHBondContact O-N 2.84Å; V566-Y688 VanDerWaalsContact O-N 3.16Å; V566-L690 HydrophobicContact CG2-CD1 3.91Å; V566-L690 HydrophobicContact CG2-CG 4.38Å
567	M	89.6	Confident	82	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	128.8	178.1	-178.3	171.3	64.7	0	0	110	V590 L631 T637 F639 V642 V685	M567-V590 HydrophobicContact CE-CG1 4.25Å; M567-V590 HydrophobicContact CE-CG2 3.72Å; M567-L631 HydrophobicContact CE-CD1 3.74Å; M567-L631 HydrophobicContact CG-CD1 4.21Å; M567-T637 HydrophobicContact CB-CG2 4.48Å; M567-T637 HydrophobicContact CE-CG2 3.96Å; M567-T637 PolarHBondContact N-O 3.26Å; M567-T637 PolarHBondContact O-N 3.27Å; M567-F639 HydrophobicContact CB-CB 4.3Å; M567-F639 HydrophobicContact CB-CD1 3.5Å; M567-F639 VanDerWaalsContact CB-CD1 3.5Å; M567-F639 HydrophobicContact CB-CE1 3.98Å; M567-F639 HydrophobicContact CB-CG 4.04Å; M567-V642 HydrophobicContact SD-CG2 4.16Å; M567-V685 HydrophobicContact CB-CG1 4.16Å; M567-V685 HydrophobicContact CG-CG1 3.58Å; M567-V685 HydrophobicContact SD-CG1 3.82Å
568	L	89.2	Confident	82	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	-28.2	175.7	-65	-178.3	0	0	0	112.7	L509 L514 L631 G632 K636 F686 Y688	L509-L568 HydrophobicContact CD1-CD1 4.47Å; L514-L568 HydrophobicContact CD1-CB 4.17Å; L514-L568 HydrophobicContact CD1-CD1 3.81Å; L514-L568 HydrophobicContact CD2-CB 4.07Å; L514-L568 HydrophobicContact CD2-CD1 4.23Å; L568-L631 WeakPolarHBondContact O-CA 3.26Å; L568-L631 VanDerWaalsContact O-CB 3.27Å; L568-L631 WeakPolarHBondContact O-CB 3.4Å; L568-L631 PolarHBondContact O-N 2.99Å; L568-G632 PolarHBondContact O-N 3.41Å; L568-K636 HydrophobicContact CD2-CB 3.55Å; L568-K636 HydrophobicContact CD2-CD 4.14Å; L568-K636 HydrophobicContact CD2-CG 4.49Å; L568-F686 PolarHBondContact N-O 2.95Å; L568-Y688 HydrophobicContact CD1-CD1 3.82Å; L568-Y688 HydrophobicContact CD1-CE1 3.99Å; L568-Y688 HydrophobicContact CD2-CE1 4.19Å; L568-Y688 HydrophobicContact CG-CD1 4.29Å; L568-Y688 HydrophobicContact CG-CE1 4.22Å
569	A	89.5	Confident	82.3	Confident	2 Å²	2	43.1 Å²	43.1	2%	0.017	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	160.5	175.1	0	0	0	0	0	111.7	L518 I629 T630 F686	L518-A569 HydrophobicContact CD1-CB 3.65Å; L518-A569 HydrophobicContact CD2-CB 3.72Å; L518-A569 HydrophobicContact CG-CB 4.38Å; A569-I629 WeakPolarHBondContact CA-O 3.28Å; A569-I629 WeakPolarHBondContact CB-O 3.49Å; A569-T630 HydrophobicContact CB-CG2 4.36Å; A569-F686 HydrophobicContact CB-CB 4.18Å; A569-F686 PolarHBondContact N-O 2.68Å; A569-F686 PolarHBondContact O-N 2.84Å
570	L	91.5	Very high	83	Confident	4 Å²	4	35.3 Å²	35.3	2%	0.021	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	133.2	174	179.3	77.2	0	0	0	108.6	L554 I588 W613 T628 I629 V644 L683 V685	L554-L570 HydrophobicContact CD1-CD1 3.83Å; L570-I588 HydrophobicContact CD2-CD1 3.48Å; L570-I588 VanDerWaalsContact CD2-CD1 3.48Å; L570-I588 HydrophobicContact CD2-CG1 4.32Å; L570-W613 HydrophobicContact CD2-CH2 4.11Å; L570-T628 WeakPolarHBondContact O-CA 3.39Å; L570-I629 HydrophobicContact CB-CG2 3.78Å; L570-I629 PolarHBondContact N-O 3.18Å; L570-I629 PolarHBondContact O-N 2.68Å; L570-V644 HydrophobicContact CD2-CG2 4.31Å; L570-L683 HydrophobicContact CD1-CD1 3.92Å; L570-L683 HydrophobicContact CG-CD1 4.41Å; L570-V685 HydrophobicContact CD1-CG2 3.86Å
571	S	90.3	Very high	83.5	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.014	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	136.4	178.7	-175.3	0	0	0	0	111.2	W627 T628 L683 Q684	S571-W627 CarbonylContact C-O 3.6Å; S571-W627 WeakPolarHBondContact CA-O 3.35Å; S571-T628 WeakPolarHBondContact OG-CG2 3.49Å; S571-L683 WeakPolarHBondContact O-CA 3.03Å; S571-L683 WeakPolarHBondContact O-CD1 3.41Å; S571-Q684 PolarHBondContact N-O 2.89Å; S571-Q684 PolarHBondContact O-N 3.47Å
572	L	90.4	Very high	83.8	Confident	2 Å²	2	27 Å²	27	1%	0.01	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	126.2	178.4	-179.2	75.2	0	0	0	109.3	I574 M586 W627 I680 T682 L683	L572-I574 HydrophobicContact CD2-CD1 3.59Å; L572-I574 HydrophobicContact CD2-CG1 3.64Å; L572-I574 HydrophobicContact CG-CD1 4.28Å; L572-I574 HydrophobicContact CG-CG1 3.78Å; L572-M586 HydrophobicContact CD2-SD 3.44Å; L572-M586 WeakPolarHBondContact CD2-SD 3.22Å; L572-W627 PolarHBondContact N-O 3.49Å; L572-W627 PolarHBondContact O-N 3.25Å; L572-I680 HydrophobicContact CD1-CD1 4.44Å; L572-I680 HydrophobicContact CD1-CG2 3.36Å; L572-I680 HydrophobicContact CG-CG2 4.34Å; L572-T682 WeakPolarHBondContact CA-O 3.4Å; L572-L683 HydrophobicContact CB-CD1 4.05Å; L572-L683 HydrophobicContact CD1-CB 3.74Å; L572-L683 HydrophobicContact CD1-CD1 3.63Å; L572-L683 HydrophobicContact CD1-CD2 4.3Å; L572-L683 HydrophobicContact CD1-CG 4.03Å; L572-L683 HydrophobicContact CG-CD1 4.4Å
573	Q	90.4	Very high	83.8	Confident	27 Å²	27	28 Å²	28	13%	0.126	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	112.3	173.2	-175	175.7	47.5	0	0	110.3	N626 I680 N681 T682	Q573-N626 VanDerWaalsContact CB-OD1 3.27Å; Q573-N626 WeakPolarHBondContact CB-OD1 3.32Å; Q573-N626 WeakPolarHBondContact CG-OD1 3.47Å; Q573-N626 PolarHBondContact NE2-OD1 2.94Å; Q573-I680 WeakPolarHBondContact O-CA 3.06Å; Q573-N681 HydrophobicContact CB-CB 4.13Å; Q573-N681 HydrophobicContact CG-CB 4.07Å; Q573-N681 PolarHBondContact O-N 3.35Å; Q573-N681 PolarHBondContact OE1-ND2 3.23Å; Q573-T682 VanDerWaalsContact CB-OG1 3.31Å; Q573-T682 WeakPolarHBondContact CB-OG1 3.38Å; Q573-T682 PolarHBondContact N-O 2.86Å
574	I	89.4	Confident	83.7	Confident	3 Å²	3	25.9 Å²	25.9	2%	0.015	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	129.8	178.6	-51.3	179.3	0	0	0	109.5	L572 P584 C624 Q625 M678 K679	L572-I574 HydrophobicContact CD2-CD1 3.59Å; L572-I574 HydrophobicContact CD2-CG1 3.64Å; L572-I574 HydrophobicContact CG-CD1 4.28Å; L572-I574 HydrophobicContact CG-CG1 3.78Å; I574-P584 HydrophobicContact CD1-CB 3.81Å; I574-P584 HydrophobicContact CD1-CG 3.71Å; I574-C624 CarbonylContact O-C 3.58Å; I574-C624 WeakPolarHBondContact O-CA 3.37Å; I574-Q625 PolarHBondContact N-O 3.02Å; I574-Q625 PolarHBondContact O-N 2.88Å; I574-M678 HydrophobicContact CG2-CE 4.43Å; I574-M678 HydrophobicContact CG2-CG 3.64Å; I574-M678 HydrophobicContact CG2-SD 3.86Å; I574-K679 CarbonylContact C-O 3.58Å
575	C	88.3	Confident	83.5	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.014	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	134.9	173.3	-63.6	0	0	0	0	110.6	W541 C624 M678 K679 N681	W541-C575 HydrophobicContact CH2-CB 3.99Å; W541-C575 WeakPolarHBondContact CZ3-O 3.37Å; C575-C624 HydrophobicContact CB-CB 4.12Å; C575-C624 WeakPolarHBondContact CB-SG 3.29Å; C575-C624 WeakPolarHBondContact SG-CB 3.35Å; C575-C624 CovalentContact SG-SG 2.04Å; C575-C624 PolarHBondContact SG-SG 3.01Å; C575-M678 CarbonylContact O-C 3.55Å; C575-M678 WeakPolarHBondContact O-CA 3.25Å; C575-K679 HydrophobicContact CB-CB 4.17Å; C575-K679 PolarHBondContact N-O 3.27Å; C575-K679 PolarHBondContact O-N 3.44Å; C575-N681 PolarHBondContact SG-ND2 3.28Å
576	L	85.7	Confident	83.4	Confident	15 Å²	15	29.1 Å²	29.1	8%	0.079	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	150.6	175.5	-62.9	170.9	0	0	0	110.5	Q623 M678	L576-Q623 PolarHBondContact N-O 3.22Å; L576-M678 HydrophobicContact CD2-CB 4.08Å; L576-M678 HydrophobicContact CD2-CE 3.86Å; L576-M678 HydrophobicContact CD2-CG 3.94Å
577	T	83.3	Confident	83.3	Confident	40 Å²	40	30.2 Å²	30.2	25%	0.245	16%	0.163	C	C	.	.			trans	-68.5	147.3	171.6	46	0	0	0	0	111.3	W541 N579 S580 G676 Y677	W541-T577 HydrophobicContact CE3-CG2 4.14Å; W541-T577 HydrophobicContact CH2-CG2 4.14Å; W541-T577 HydrophobicContact CZ3-CG2 3.75Å; T577-N579 PolarHBondContact O-N 3.18Å; T577-S580 WeakPolarHBondContact O-CB 3.49Å; T577-S580 PolarHBondContact O-N 2.68Å; T577-G676 VanDerWaalsContact OG1-CA 3.29Å; T577-G676 WeakPolarHBondContact OG1-CA 3.39Å; T577-Y677 HydrophobicContact CG2-CD2 4.36Å; T577-Y677 PolarHBondContact N-O 2.84Å; T577-Y677 PolarHBondContact OG1-N 3.27Å; T577-Y677 PolarHBondContact OG1-O 2.93Å
578	K	69.9	Low	83.4	Confident	141 Å²	141	30.1 Å²	30.1	61%	0.613	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	125.4	177.1	-64.8	-173.4	-176	-178.3	0	108.9	A621	K578-A621 WeakPolarHBondContact CE-O 3.06Å; K578-A621 PolarHBondContact NZ-O 3.44Å
579	N	68.6	Low	83.5	Confident	153 Å²	153	33.2 Å²	33.2	82%	0.818	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.9	16.9	-173.1	-53.8	-17.7	0	0	0	116.7	T577 T581	T577-N579 PolarHBondContact O-N 3.18Å; N579-T581 PolarHBondContact O-N 2.98Å
580	S	70.9	Confident	83.6	Confident	12 Å²	12	33.1 Å²	33.1	8%	0.084	17%	0.173	C	C	.	.			trans	-67	133.2	169.4	-175.8	0	0	0	0	111.4	T577 L582 L675	T577-S580 WeakPolarHBondContact O-CB 3.49Å; T577-S580 PolarHBondContact O-N 2.68Å; S580-L582 VanDerWaalsContact C-N 3.27Å; S580-L582 WeakPolarHBondContact OG-CB 3.01Å; S580-L582 PolarHBondContact OG-N 2.95Å; S580-L675 WeakPolarHBondContact CA-O 3.18Å; S580-L675 PolarHBondContact OG-O 3.26Å
581	T	72.3	Confident	83.6	Confident	62 Å²	62	32.9 Å²	32.9	38%	0.38	17%	0.172	S	C	.	.			trans	-90.4	8.4	173.1	51.4	0	0	0	0	112	N579 I650 K651 L675	N579-T581 PolarHBondContact O-N 2.98Å; T581-I650 CarbonylContact O-C 3.53Å; T581-I650 WeakPolarHBondContact O-CA 3.34Å; T581-K651 PolarHBondContact O-N 3.17Å; T581-L675 PolarHBondContact N-O 2.02Å
582	L	75.3	Confident	83.6	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.01	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	136.5	-174.3	-62.6	163.4	0	0	0	112	P544 S580 R649 L675 G676	P544-L582 HydrophobicContact CG-CD1 3.41Å; P544-L582 VanDerWaalsContact CG-CD1 3.41Å; S580-L582 VanDerWaalsContact C-N 3.27Å; S580-L582 WeakPolarHBondContact OG-CB 3.01Å; S580-L582 PolarHBondContact OG-N 2.95Å; L582-R649 CarbonylContact C-O 3.56Å; L582-R649 VanDerWaalsContact CA-O 3.29Å; L582-R649 WeakPolarHBondContact CA-O 3.36Å; L582-L675 HydrophobicContact CD1-CB 3.95Å; L582-L675 VanDerWaalsContact CD1-O 3.26Å; L582-L675 WeakPolarHBondContact CD1-O 2.95Å; L582-L675 HydrophobicContact CD2-CB 3.98Å; L582-L675 HydrophobicContact CD2-CD1 4.44Å; L582-L675 HydrophobicContact CG-CB 4Å; L582-L675 WeakPolarHBondContact CG-O 3.48Å; L582-G676 WeakPolarHBondContact CD1-O 3.46Å
583	E	76.4	Confident	83.5	Confident	55 Å²	55	32.9 Å²	32.9	26%	0.257	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.1	167.5	-175.2	165.7	-159.1	0	0	109.8	R615 R649 K651	E583-R615 IonicContact OE1-CZ 2.76Å; E583-R615 IonicContact OE1-NH1 3.57Å; E583-R615 PolarHBondContact OE1-NH1 3.34Å; E583-R615 IonicContact OE1-NH2 3.61Å; E583-R615 PolarHBondContact OE1-NH2 2.79Å; E583-R615 VanDerWaalsContact OE1-NH2 3.07Å; E583-R649 PolarHBondContact N-O 2.69Å; E583-R649 PolarHBondContact O-N 3.42Å; E583-K651 HydrophobicContact CB-CG 4.19Å
584	P	81.4	Confident	83.1	Confident	7 Å²	7	31.9 Å²	31.9	5%	0.045	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	130.7	175.7	28.6	-31.6	0	0	0	110.9	I574 W627 L646 M678	I574-P584 HydrophobicContact CD1-CB 3.81Å; I574-P584 HydrophobicContact CD1-CG 3.71Å; P584-W627 HydrophobicContact CG-CH2 4Å; P584-W627 HydrophobicContact CG-CZ2 3.61Å; P584-L646 HydrophobicContact CB-CD1 3.75Å; P584-M678 HydrophobicContact CB-CE 3.88Å; P584-M678 HydrophobicContact CG-CE 4.45Å
585	V	82.8	Confident	82.6	Confident	61 Å²	61	33.9 Å²	33.9	37%	0.37	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	128.5	172.2	-178.1	0	0	0	0	108.4	R647 R649	V585-R647 PolarHBondContact N-O 2.92Å; V585-R647 PolarHBondContact O-N 3.37Å; V585-R649 HydrophobicContact CG2-CB 4.27Å
586	M	86.2	Confident	82.3	Confident	18 Å²	18	36 Å²	36	9%	0.089	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	129.5	-173.7	-65.1	172.7	-77.9	0	0	110.8	L572 W613 W627 V644 Y645 L646	L572-M586 HydrophobicContact CD2-SD 3.44Å; L572-M586 WeakPolarHBondContact CD2-SD 3.22Å; M586-W613 HydrophobicContact CB-CZ2 4.04Å; M586-W613 HydrophobicContact CE-CD2 3.84Å; M586-W613 VanDerWaalsContact CE-CE2 3.49Å; M586-W613 HydrophobicContact CE-CE3 4.18Å; M586-W613 HydrophobicContact CE-CG 4.43Å; M586-W613 HydrophobicContact CE-CH2 3.85Å; M586-W613 HydrophobicContact CE-CZ2 3.49Å; M586-W613 VanDerWaalsContact CE-CZ2 3.49Å; M586-W613 HydrophobicContact CE-CZ3 4.2Å; M586-W613 HydrophobicContact SD-CH2 3.86Å; M586-W613 HydrophobicContact SD-CZ2 3.73Å; M586-W627 HydrophobicContact CE-CB 4.27Å; M586-W627 HydrophobicContact CE-CD2 3.71Å; M586-W627 HydrophobicContact CE-CE3 3.14Å; M586-W627 HydrophobicContact CE-CG 4.22Å; M586-W627 HydrophobicContact CE-CH2 4.46Å; M586-W627 HydrophobicContact CE-CZ3 3.57Å; M586-V644 HydrophobicContact CB-CG1 4.26Å; M586-V644 HydrophobicContact CG-CG1 4.29Å; M586-Y645 WeakPolarHBondContact CA-O 3.15Å; M586-L646 HydrophobicContact CG-CD1 3.8Å
587	A	88.8	Confident	82.1	Confident	23 Å²	23	38.7 Å²	38.7	19%	0.19	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	121.9	168.9	0	0	0	0	0	108.8	Y589 F602 Y645	A587-Y589 HydrophobicContact CB-CE2 4.27Å; A587-F602 HydrophobicContact CB-CE2 3.97Å; A587-Y645 PolarHBondContact N-O 3.27Å; A587-Y645 PolarHBondContact O-N 3.39Å
588	I	91	Very high	82.1	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	128.8	-172.9	-61.8	168.7	0	0	0	109.3	L570 V590 M603 W613 V642 H643 V644	L570-I588 HydrophobicContact CD2-CD1 3.48Å; L570-I588 VanDerWaalsContact CD2-CD1 3.48Å; L570-I588 HydrophobicContact CD2-CG1 4.32Å; I588-V590 HydrophobicContact CG2-CG2 3.93Å; I588-M603 HydrophobicContact CB-CB 4.09Å; I588-M603 HydrophobicContact CB-CE 3.93Å; I588-M603 HydrophobicContact CD1-CE 3.29Å; I588-M603 HydrophobicContact CG1-CE 4.15Å; I588-M603 HydrophobicContact CG2-CB 4.31Å; I588-M603 HydrophobicContact CG2-CE 4.13Å; I588-M603 HydrophobicContact CG2-SD 4.43Å; I588-M603 PolarHBondContact O-N 2.9Å; I588-W613 HydrophobicContact CD1-CH2 3.7Å; I588-W613 HydrophobicContact CD1-CZ2 3.39Å; I588-W613 HydrophobicContact CG1-CZ2 4.42Å; I588-V642 HydrophobicContact CG2-CG1 3.82Å; I588-H643 WeakPolarHBondContact CA-O 3.43Å; I588-V644 HydrophobicContact CG1-CG1 4.27Å; I588-V644 HydrophobicContact CG1-CG2 4.29Å
589	Y	91.9	Very high	82.9	Confident	65 Å²	65	35.5 Å²	35.5	26%	0.255	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	130	171.6	-64.5	-98.6	0	0	0	109	A587 H597 W601 F602 H643 Y645	A587-Y589 HydrophobicContact CB-CE2 4.27Å; Y589-H597 AromaticContact CD1-NE2 3.98Å; Y589-H597 AromaticContact CD2-NE2 3.76Å; Y589-H597 AromaticContact CG-NE2 3.7Å; Y589-W601 CarbonylContact C-O 3.49Å; Y589-W601 VanDerWaalsContact CA-O 3.25Å; Y589-W601 WeakPolarHBondContact CA-O 3.25Å; Y589-F602 HydrophobicContact CD1-CB 3.99Å; Y589-F602 HydrophobicContact CD1-CD2 4.23Å; Y589-F602 HydrophobicContact CD2-CD2 4.4Å; Y589-F602 HydrophobicContact CE1-CB 3.72Å; Y589-F602 AromaticContact CE1-CD2 3.73Å; Y589-F602 HydrophobicContact CE1-CD2 3.73Å; Y589-F602 HydrophobicContact CE1-CG 4.15Å; Y589-F602 AromaticContact CE2-CD2 3.93Å; Y589-F602 HydrophobicContact CE2-CD2 3.93Å; Y589-F602 HydrophobicContact CE2-CE2 4.44Å; Y589-F602 AromaticContact CZ-CD2 3.57Å; Y589-H643 PolarHBondContact N-O 2.95Å; Y589-H643 PolarHBondContact O-N 2.92Å; Y589-Y645 AromaticContact CD2-CD2 3.57Å; Y589-Y645 HydrophobicContact CD2-CD2 3.57Å; Y589-Y645 AromaticContact CD2-CE2 3.65Å; Y589-Y645 HydrophobicContact CD2-CE2 3.65Å; Y589-Y645 AromaticContact CE2-CD2 3.63Å; Y589-Y645 HydrophobicContact CE2-CD2 3.63Å; Y589-Y645 AromaticContact CE2-CE2 3.85Å; Y589-Y645 HydrophobicContact CE2-CE2 3.85Å
590	V	91.7	Very high	83.9	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	127.3	-176.1	-177.5	0	0	0	0	108.9	M567 I588 S600 W601 F639 V642	M567-V590 HydrophobicContact CE-CG1 4.25Å; M567-V590 HydrophobicContact CE-CG2 3.72Å; I588-V590 HydrophobicContact CG2-CG2 3.93Å; V590-S600 WeakPolarHBondContact O-CA 3.33Å; V590-W601 HydrophobicContact CB-CZ2 3.88Å; V590-W601 HydrophobicContact CG1-CZ2 4.38Å; V590-W601 HydrophobicContact CG2-CZ2 4.01Å; V590-W601 PolarHBondContact N-O 2.85Å; V590-W601 PolarHBondContact O-N 3.23Å; V590-W601 PolarHBondContact O-NE1 3.22Å; V590-F639 HydrophobicContact CG1-CB 3.8Å; V590-V642 HydrophobicContact CG1-CG2 4.48Å; V590-V642 HydrophobicContact CG2-CG1 4.45Å
591	N	91.5	Very high	84.8	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	122.8	170.3	-168.2	-47.2	0	0	0	109.2	F593 G594 S596 E599 S600 E640 T641	N591-F593 PolarHBondContact OD1-N 3.17Å; N591-F593 VanDerWaalsContact OD1-N 3.14Å; N591-G594 WeakPolarHBondContact OD1-CA 3.11Å; N591-G594 PolarHBondContact OD1-N 2.02Å; N591-S596 PolarHBondContact ND2-N 2.04Å; N591-S596 PolarHBondContact ND2-O 3.44Å; N591-E599 PolarHBondContact ND2-O 3.12Å; N591-S600 WeakPolarHBondContact CB-OG 3.31Å; N591-E640 PolarHBondContact O-N 2.92Å; N591-T641 VanDerWaalsContact CB-OG1 3.27Å; N591-T641 WeakPolarHBondContact CB-OG1 3.3Å; N591-T641 PolarHBondContact N-O 3.41Å; N591-T641 PolarHBondContact O-N 2.87Å
592	P	89.6	Confident	85.6	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	-73.2	-34.6	-174.9	27.7	-34	0	0	0	114.7	F638 F639 E640 L740 L781	P592-F638 HydrophobicContact CB-CB 3.72Å; P592-F639 CarbonylContact O-C 3.3Å; P592-E640 PolarHBondContact O-N 2.79Å; P592-L740 HydrophobicContact CB-CD2 4.31Å; P592-L740 HydrophobicContact CG-CD2 3.81Å; P592-L781 HydrophobicContact CG-CD2 3.89Å
593	F	88.1	Confident	86.2	Confident	3 Å²	3	30.7 Å²	30.7	1%	0.013	18%	0.179	C	C	.	.	S	Bend	trans	-140.6	9.4	-169.3	-56	-65.4	0	0	0	115	V564 N591 F638 E640 L740 C743 L744 H747 R748	V564-F593 HydrophobicContact CG1-CD1 4.45Å; V564-F593 HydrophobicContact CG1-CE1 3.75Å; V564-F593 HydrophobicContact CG2-CE1 4.47Å; N591-F593 PolarHBondContact OD1-N 3.17Å; N591-F593 VanDerWaalsContact OD1-N 3.14Å; F593-F638 HydrophobicContact CE1-CB 4.19Å; F593-F638 HydrophobicContact CE1-CD1 4.33Å; F593-F638 HydrophobicContact CE1-CD2 4.36Å; F593-F638 HydrophobicContact CE1-CG 4.05Å; F593-F638 HydrophobicContact CE2-CD2 4.48Å; F593-F638 HydrophobicContact CZ-CB 4.01Å; F593-F638 HydrophobicContact CZ-CD1 4.41Å; F593-F638 AromaticContact CZ-CD2 3.66Å; F593-F638 HydrophobicContact CZ-CD2 3.66Å; F593-F638 HydrophobicContact CZ-CE2 4.19Å; F593-F638 AromaticContact CZ-CG 3.77Å; F593-F638 HydrophobicContact CZ-CG 3.77Å; F593-E640 VanDerWaalsContact CA-OE2 3.29Å; F593-E640 WeakPolarHBondContact CA-OE2 3.47Å; F593-L740 HydrophobicContact CE2-CB 4.17Å; F593-L740 WeakPolarHBondContact CE2-O 3.41Å; F593-C743 HydrophobicContact CD2-CB 3.8Å; F593-C743 HydrophobicContact CE2-CB 4.44Å; F593-L744 HydrophobicContact CD2-CB 4.05Å; F593-L744 HydrophobicContact CE1-CB 4.34Å; F593-L744 HydrophobicContact CE1-CD1 3.87Å; F593-L744 HydrophobicContact CE1-CG 4.36Å; F593-L744 HydrophobicContact CE2-CB 3.81Å; F593-L744 HydrophobicContact CE2-CD1 4.49Å; F593-L744 HydrophobicContact CG-CB 4.42Å; F593-L744 HydrophobicContact CZ-CB 3.97Å; F593-L744 HydrophobicContact CZ-CD1 3.8Å; F593-L744 HydrophobicContact CZ-CG 4.35Å; F593-H747 HydrophobicContact CB-CB 4.11Å; F593-H747 WeakPolarHBondContact O-CB 3.38Å; F593-R748 HydrophobicContact CB-CG 4.48Å; F593-R748 HydrophobicContact CD1-CG 4.17Å
594	G	83.1	Confident	86.7	Confident	7 Å²	7	29.1 Å²	29.1	7%	0.072	17%	0.173	C	C	.	.			trans	-143.3	-166.1	-175.7	0	0	0	0	0	112.8	N591 E640 T641	N591-G594 WeakPolarHBondContact OD1-CA 3.11Å; N591-G594 PolarHBondContact OD1-N 2.02Å; G594-E640 PolarHBondContact N-OE2 3.42Å; G594-T641 WeakPolarHBondContact O-CG2 3.5Å; G594-T641 PolarHBondContact O-OG1 3Å
595	G	78.1	Confident	86.8	Confident	45 Å²	45	30.1 Å²	30.1	46%	0.464	18%	0.18	S	C	.	.			trans	-125.9	4.9	178.5	0	0	0	0	0	114.5	T641	G595-T641 WeakPolarHBondContact CA-OG1 3.23Å
596	S	82.5	Confident	86.2	Confident	46 Å²	46	33 Å²	33	32%	0.322	19%	0.193	S	C	.	.			trans	-87	132	-177.4	-171.9	0	0	0	0	110.9	N591 S598 E599 S600	N591-S596 PolarHBondContact ND2-N 2.04Å; N591-S596 PolarHBondContact ND2-O 3.44Å; S596-S598 VanDerWaalsContact C-N 3.26Å; S596-S598 PolarHBondContact O-N 3.42Å; S596-S598 PolarHBondContact OG-N 2.94Å; S596-S598 PolarHBondContact OG-OG 3.01Å; S596-E599 PolarHBondContact O-N 3.19Å; S596-S600 PolarHBondContact O-OG 3.2Å
597	H	80.6	Confident	85.9	Confident	71 Å²	71	38 Å²	38	33%	0.329	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-63.5	-32.2	172.2	-177.2	-86.7	0	0	0	112.2	Y589 E599 S600 Y645	Y589-H597 AromaticContact CD1-NE2 3.98Å; Y589-H597 AromaticContact CD2-NE2 3.76Å; Y589-H597 AromaticContact CG-NE2 3.7Å; H597-E599 VanDerWaalsContact C-N 3.25Å; H597-E599 PolarHBondContact O-N 3.07Å; H597-S600 WeakPolarHBondContact O-CB 3.42Å; H597-S600 PolarHBondContact O-N 2.73Å; H597-S600 PolarHBondContact O-OG 2.83Å; H597-Y645 AromaticContact CD2-CE2 3.6Å; H597-Y645 AromaticContact CD2-CZ 3.77Å; H597-Y645 PolarHBondContact CD2-OH 3.31Å; H597-Y645 AromaticContact NE2-CE2 3.15Å; H597-Y645 WeakPolarHBondContact NE2-CE2 3.14Å; H597-Y645 AromaticContact NE2-CZ 3.52Å; H597-Y645 PolarHBondContact NE2-OH 3.42Å; H597-Y645 VanDerWaalsContact NE2-OH 3.12Å
598	S	83.5	Confident	85.3	Confident	97 Å²	97	41.2 Å²	41.2	68%	0.678	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-69	-23.4	-179	62.1	0	0	0	0	113.8	S596	S596-S598 VanDerWaalsContact C-N 3.26Å; S596-S598 PolarHBondContact O-N 3.42Å; S596-S598 PolarHBondContact OG-N 2.94Å; S596-S598 PolarHBondContact OG-OG 3.01Å
599	E	87.4	Confident	84.6	Confident	18 Å²	18	44.6 Å²	44.6	8%	0.084	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-103.9	22.4	179.3	-61	173.8	144.9	0	0	110.9	N591 S596 H597 H747	N591-E599 PolarHBondContact ND2-O 3.12Å; S596-E599 PolarHBondContact O-N 3.19Å; H597-E599 VanDerWaalsContact C-N 3.25Å; H597-E599 PolarHBondContact O-N 3.07Å; E599-H747 IonicContact OE1-CE1 3.12Å; E599-H747 IonicContact OE1-NE2 2.72Å; E599-H747 IonicContact OE2-CE1 3.77Å; E599-H747 PolarHBondContact OE2-CE1 3.2Å; E599-H747 IonicContact OE2-NE2 3.15Å; E599-H747 PolarHBondContact OE2-NE2 3.16Å
600	S	88.7	Confident	84.2	Confident	14 Å²	14	42.3 Å²	42.3	10%	0.098	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-102.5	141.1	176.8	-55.4	0	0	0	0	110.2	V590 N591 S596 H597	V590-S600 WeakPolarHBondContact O-CA 3.33Å; N591-S600 WeakPolarHBondContact CB-OG 3.31Å; S596-S600 PolarHBondContact O-OG 3.2Å; H597-S600 WeakPolarHBondContact O-CB 3.42Å; H597-S600 PolarHBondContact O-N 2.73Å; H597-S600 PolarHBondContact O-OG 2.83Å
601	W	89.4	Confident	83.9	Confident	19 Å²	19	43.5 Å²	43.5	7%	0.072	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	150.8	171.9	66.4	-87	0	0	0	110.2	Y589 V590 M603 T637 P732 L738 L781	Y589-W601 CarbonylContact C-O 3.49Å; Y589-W601 VanDerWaalsContact CA-O 3.25Å; Y589-W601 WeakPolarHBondContact CA-O 3.25Å; V590-W601 HydrophobicContact CB-CZ2 3.88Å; V590-W601 HydrophobicContact CG1-CZ2 4.38Å; V590-W601 HydrophobicContact CG2-CZ2 4.01Å; V590-W601 PolarHBondContact N-O 2.85Å; V590-W601 PolarHBondContact O-N 3.23Å; V590-W601 PolarHBondContact O-NE1 3.22Å; W601-M603 HydrophobicContact CH2-CB 4.18Å; W601-M603 HydrophobicContact CH2-CG 3.99Å; W601-M603 HydrophobicContact CZ3-CB 4Å; W601-M603 HydrophobicContact CZ3-CG 4.09Å; W601-T637 HydrophobicContact CZ2-CG2 3.73Å; W601-P732 HydrophobicContact CB-CG 4.32Å; W601-P732 HydrophobicContact CD2-CB 3.46Å; W601-P732 VanDerWaalsContact CD2-CB 3.46Å; W601-P732 HydrophobicContact CD2-CG 3.46Å; W601-P732 VanDerWaalsContact CD2-CG 3.46Å; W601-P732 HydrophobicContact CE3-CB 3.4Å; W601-P732 HydrophobicContact CE3-CG 3.8Å; W601-P732 HydrophobicContact CG-CB 4.21Å; W601-P732 HydrophobicContact CG-CG 3.66Å; W601-P732 HydrophobicContact CH2-CB 3.61Å; W601-P732 HydrophobicContact CZ2-CB 3.64Å; W601-P732 HydrophobicContact CZ2-CG 4.35Å; W601-P732 HydrophobicContact CZ3-CB 3.45Å; W601-P732 VanDerWaalsContact CZ3-CB 3.45Å; W601-P732 HydrophobicContact CZ3-CG 4.36Å; W601-L738 HydrophobicContact CB-CD1 3.83Å; W601-L738 HydrophobicContact CG-CD1 4.24Å; W601-L781 HydrophobicContact CB-CD1 4.26Å
602	F	88.8	Confident	83.6	Confident	93 Å²	93	47.4 Å²	47.4	41%	0.408	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	130.4	-179.5	174.9	-107.1	0	0	0	111.1	A587 Y589 P604	A587-F602 HydrophobicContact CB-CE2 3.97Å; Y589-F602 HydrophobicContact CD1-CB 3.99Å; Y589-F602 HydrophobicContact CD1-CD2 4.23Å; Y589-F602 HydrophobicContact CD2-CD2 4.4Å; Y589-F602 HydrophobicContact CE1-CB 3.72Å; Y589-F602 AromaticContact CE1-CD2 3.73Å; Y589-F602 HydrophobicContact CE1-CD2 3.73Å; Y589-F602 HydrophobicContact CE1-CG 4.15Å; Y589-F602 AromaticContact CE2-CD2 3.93Å; Y589-F602 HydrophobicContact CE2-CD2 3.93Å; Y589-F602 HydrophobicContact CE2-CE2 4.44Å; Y589-F602 AromaticContact CZ-CD2 3.57Å; F602-P604 WeakPolarHBondContact O-CD 3.25Å
603	M	89.4	Confident	83.5	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.01	30%	0.3	C	S	.	.			trans	-82.8	115.6	178.4	-164.8	169.7	77.2	0	0	111.2	I588 W601 V605 F610 I629 L631	I588-M603 HydrophobicContact CB-CB 4.09Å; I588-M603 HydrophobicContact CB-CE 3.93Å; I588-M603 HydrophobicContact CD1-CE 3.29Å; I588-M603 HydrophobicContact CG1-CE 4.15Å; I588-M603 HydrophobicContact CG2-CB 4.31Å; I588-M603 HydrophobicContact CG2-CE 4.13Å; I588-M603 HydrophobicContact CG2-SD 4.43Å; I588-M603 PolarHBondContact O-N 2.9Å; W601-M603 HydrophobicContact CH2-CB 4.18Å; W601-M603 HydrophobicContact CH2-CG 3.99Å; W601-M603 HydrophobicContact CZ3-CB 4Å; W601-M603 HydrophobicContact CZ3-CG 4.09Å; M603-V605 VanDerWaalsContact C-N 3.25Å; M603-V605 HydrophobicContact CE-CG2 3.5Å; M603-V605 HydrophobicContact CG-CG2 4.28Å; M603-V605 PolarHBondContact O-N 3.46Å; M603-F610 HydrophobicContact CE-CE1 4.42Å; M603-F610 HydrophobicContact CG-CE1 3.4Å; M603-F610 HydrophobicContact CG-CZ 3.4Å; M603-F610 VanDerWaalsContact CG-CZ 3.4Å; M603-F610 HydrophobicContact SD-CE1 3.93Å; M603-F610 HydrophobicContact SD-CZ 3.88Å; M603-I629 HydrophobicContact CE-CD1 3.38Å; M603-I629 HydrophobicContact CE-CG2 4.19Å; M603-I629 HydrophobicContact SD-CD1 4.3Å; M603-L631 HydrophobicContact SD-CD2 4.16Å
604	P	86.4	Confident	83.4	Confident	21 Å²	21	52.3 Å²	52.3	14%	0.136	32%	0.317	C	S	.	.			trans	-83.5	66.9	-172.2	36.5	-36.9	0	0	0	111.2	F602 N606 E607 F610	F602-P604 WeakPolarHBondContact O-CD 3.25Å; P604-N606 PolarHBondContact O-N 2.87Å; P604-E607 HydrophobicContact CB-CB 4.1Å; P604-E607 HydrophobicContact CB-CG 4.29Å; P604-E607 PolarHBondContact O-N 3.44Å; P604-F610 HydrophobicContact CG-CD1 4.49Å; P604-F610 HydrophobicContact CG-CD2 4.18Å; P604-F610 HydrophobicContact CG-CG 4.15Å; P604-F610 WeakPolarHBondContact O-CB 3.36Å; P604-F610 VanDerWaalsContact O-CD1 3.3Å; P604-F610 WeakPolarHBondContact O-CD1 3.34Å
605	V	82.6	Confident	83.6	Confident	29 Å²	29	58 Å²	58	18%	0.176	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	132.1	178.7	-172.8	0	0	0	0	109.8	M603 E607 I629	M603-V605 VanDerWaalsContact C-N 3.25Å; M603-V605 HydrophobicContact CE-CG2 3.5Å; M603-V605 HydrophobicContact CG-CG2 4.28Å; M603-V605 PolarHBondContact O-N 3.46Å; V605-E607 VanDerWaalsContact C-N 3.28Å; V605-E607 PolarHBondContact O-N 2.87Å; V605-I629 HydrophobicContact CG1-CD1 4.33Å; V605-I629 HydrophobicContact CG2-CD1 3.98Å
606	N	71.9	Confident	83.9	Confident	121 Å²	121	59.2 Å²	59.2	65%	0.647	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	19.4	-179	-162.5	22.4	0	0	0	115.1	P604	P604-N606 PolarHBondContact O-N 2.87Å
607	E	78.3	Confident	83.8	Confident	124 Å²	124	63 Å²	63	58%	0.579	35%	0.351	S	S	*	.	S	Bend	trans	-107.2	124.7	171.1	-61.9	-175.8	-178.2	0	0	111.8	P604 V605 S609 F610	P604-E607 HydrophobicContact CB-CB 4.1Å; P604-E607 HydrophobicContact CB-CG 4.29Å; P604-E607 PolarHBondContact O-N 3.44Å; V605-E607 VanDerWaalsContact C-N 3.28Å; V605-E607 PolarHBondContact O-N 2.87Å; E607-S609 PolarHBondContact O-N 3.16Å; E607-F610 VanDerWaalsContact O-CB 3.28Å; E607-F610 WeakPolarHBondContact O-CB 3.23Å; E607-F610 PolarHBondContact O-N 3.33Å
608	G	76.1	Confident	83.4	Confident	89 Å²	89	62.6 Å²	62.6	92%	0.918	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	-123.5	173.9	0	0	0	0	0	113.6
609	S	77.3	Confident	82.4	Confident	72 Å²	72	63 Å²	63	50%	0.503	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	14.6	178.1	64.7	0	0	0	0	113.6	E607 W635	E607-S609 PolarHBondContact O-N 3.16Å; S609-W635 WeakPolarHBondContact OG-CZ2 3.45Å
610	F	84	Confident	81	Confident	17 Å²	17	67.4 Å²	67.4	8%	0.075	39%	0.387	C	S	.	.	S	Bend	trans	-79.3	145.5	-179.2	-159.5	-95.7	0	0	0	111	M603 P604 E607 I629 L631 W635 P733	M603-F610 HydrophobicContact CE-CE1 4.42Å; M603-F610 HydrophobicContact CG-CE1 3.4Å; M603-F610 HydrophobicContact CG-CZ 3.4Å; M603-F610 VanDerWaalsContact CG-CZ 3.4Å; M603-F610 HydrophobicContact SD-CE1 3.93Å; M603-F610 HydrophobicContact SD-CZ 3.88Å; P604-F610 HydrophobicContact CG-CD1 4.49Å; P604-F610 HydrophobicContact CG-CD2 4.18Å; P604-F610 HydrophobicContact CG-CG 4.15Å; P604-F610 WeakPolarHBondContact O-CB 3.36Å; P604-F610 VanDerWaalsContact O-CD1 3.3Å; P604-F610 WeakPolarHBondContact O-CD1 3.34Å; E607-F610 VanDerWaalsContact O-CB 3.28Å; E607-F610 WeakPolarHBondContact O-CB 3.23Å; E607-F610 PolarHBondContact O-N 3.33Å; F610-I629 HydrophobicContact CE1-CD1 4.08Å; F610-L631 HydrophobicContact CE1-CD2 4.02Å; F610-L631 HydrophobicContact CE2-CD2 4.32Å; F610-L631 HydrophobicContact CZ-CD2 3.53Å; F610-W635 HydrophobicContact CD2-CD2 4.19Å; F610-W635 HydrophobicContact CD2-CG 4.34Å; F610-W635 HydrophobicContact CE2-CB 4.13Å; F610-W635 HydrophobicContact CE2-CD2 4.36Å; F610-W635 HydrophobicContact CE2-CG 4.18Å; F610-P733 HydrophobicContact CD2-CG 3.65Å; F610-P733 HydrophobicContact CE2-CG 3.55Å
611	P	84.9	Confident	79.4	Confident	26 Å²	26	70.3 Å²	70.3	17%	0.169	41%	0.412	C	S	.	.			trans	-62.5	146.3	-178.4	-21.1	32.8	0	0	0	113.2	I629 T630 L631	P611-I629 HydrophobicContact CB-CD1 4.49Å; P611-I629 HydrophobicContact CB-CG1 4.07Å; P611-T630 WeakPolarHBondContact CB-O 3.21Å; P611-T630 WeakPolarHBondContact CG-O 3.24Å; P611-L631 HydrophobicContact CG-CD2 4.44Å
612	D	84.9	Confident	77.9	Confident	81 Å²	81	71 Å²	71	43%	0.433	42%	0.421	S	S	.	.			trans	-105.7	170.7	172.2	-164.7	16.6	0	0	0	111.4	E614	D612-E614 PolarHBondContact O-N 3.03Å
613	W	87.6	Confident	77.3	Confident	29 Å²	29	71 Å²	71	11%	0.11	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-70.5	116.8	179.3	-69	101.9	0	0	0	112.6	L570 M586 I588 W627 I629	L570-W613 HydrophobicContact CD2-CH2 4.11Å; M586-W613 HydrophobicContact CB-CZ2 4.04Å; M586-W613 HydrophobicContact CE-CD2 3.84Å; M586-W613 VanDerWaalsContact CE-CE2 3.49Å; M586-W613 HydrophobicContact CE-CE3 4.18Å; M586-W613 HydrophobicContact CE-CG 4.43Å; M586-W613 HydrophobicContact CE-CH2 3.85Å; M586-W613 HydrophobicContact CE-CZ2 3.49Å; M586-W613 VanDerWaalsContact CE-CZ2 3.49Å; M586-W613 HydrophobicContact CE-CZ3 4.2Å; M586-W613 HydrophobicContact SD-CH2 3.86Å; M586-W613 HydrophobicContact SD-CZ2 3.73Å; I588-W613 HydrophobicContact CD1-CH2 3.7Å; I588-W613 HydrophobicContact CD1-CZ2 3.39Å; I588-W613 HydrophobicContact CG1-CZ2 4.42Å; W613-W627 HydrophobicContact CB-CE3 3.81Å; W613-W627 HydrophobicContact CB-CZ3 4.29Å; W613-W627 AromaticContact CD2-CE3 3.98Å; W613-W627 HydrophobicContact CD2-CE3 3.98Å; W613-W627 HydrophobicContact CE3-CB 3.75Å; W613-W627 HydrophobicContact CE3-CE3 4.31Å; W613-W627 AromaticContact CG-CE3 3.78Å; W613-W627 HydrophobicContact CG-CE3 3.78Å; W613-W627 HydrophobicContact CG-CZ3 4.24Å; W613-W627 HydrophobicContact CZ3-CB 3.98Å; W613-I629 HydrophobicContact CD2-CB 4.31Å; W613-I629 HydrophobicContact CE3-CB 3.95Å; W613-I629 HydrophobicContact CE3-CG2 4.31Å; W613-I629 HydrophobicContact CH2-CG2 4.14Å; W613-I629 HydrophobicContact CZ3-CB 4.1Å; W613-I629 HydrophobicContact CZ3-CG2 3.95Å
614	E	86.8	Confident	77.1	Confident	78 Å²	78	71.3 Å²	71.3	36%	0.364	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	120.9	166.1	-66.3	-174.4	169.5	0	0	109.1	K515 D612 T628	K515-E614 IonicContact NZ-OE1 2.81Å; K515-E614 PolarHBondContact NZ-OE1 3.13Å; K515-E614 IonicContact NZ-OE2 3.72Å; D612-E614 PolarHBondContact O-N 3.03Å; E614-T628 PolarHBondContact N-O 3.05Å; E614-T628 PolarHBondContact O-N 3.34Å; E614-T628 PolarHBondContact O-OG1 2.9Å
615	R	86.9	Confident	77.1	Confident	125 Å²	125	72.8 Å²	72.8	47%	0.472	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	120.6	179.7	-56.3	-179.3	-167.2	-176	0.5	110.1	E583 N626 W627	E583-R615 IonicContact OE1-CZ 2.76Å; E583-R615 IonicContact OE1-NH1 3.57Å; E583-R615 PolarHBondContact OE1-NH1 3.34Å; E583-R615 IonicContact OE1-NH2 3.61Å; E583-R615 PolarHBondContact OE1-NH2 2.79Å; E583-R615 VanDerWaalsContact OE1-NH2 3.07Å; R615-N626 WeakPolarHBondContact CA-O 3.26Å; R615-W627 HydrophobicContact CG-CD2 4.06Å; R615-W627 HydrophobicContact CG-CE3 4.22Å; R615-W627 HydrophobicContact CG-CZ2 4.4Å
616	T	83.8	Confident	77.4	Confident	71 Å²	71	72.2 Å²	72.2	44%	0.436	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	132.6	175.9	53.5	0	0	0	0	111.3	Q625 N626	T616-Q625 CarbonylContact O-C 3.49Å; T616-Q625 WeakPolarHBondContact O-CA 3.38Å; T616-N626 PolarHBondContact N-O 3.36Å; T616-N626 PolarHBondContact O-N 3.39Å; T616-N626 WeakPolarHBondContact OG1-CB 3.13Å
617	N	80.5	Confident	78.2	Confident	127 Å²	127	66.7 Å²	66.7	68%	0.679	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83	129	-179.7	-64.7	-40	0	0	0	110	Q625	N617-Q625 WeakPolarHBondContact OD1-CG 3.23Å; N617-Q625 PolarHBondContact OD1-NE2 3.46Å; N617-Q625 VanDerWaalsContact OD1-NE2 3.14Å
618	V	72.3	Confident	78.8	Confident	62 Å²	62	62.3 Å²	62.3	38%	0.376	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	-36.3	-175	-175.6	0	0	0	0	112.5	C624 N626	V618-C624 PolarHBondContact N-O 3.36Å; V618-N626 HydrophobicContact CG2-CB 4.23Å; V618-N626 VanDerWaalsContact CG2-CG 3.41Å; V618-N626 VanDerWaalsContact CG2-ND2 3.27Å; V618-N626 WeakPolarHBondContact CG2-ND2 3.2Å; V618-N626 WeakPolarHBondContact CG2-OD1 3.43Å
619	D	63	Low	79.4	Confident	106 Å²	106	58.1 Å²	58.1	57%	0.567	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.5	144.6	-178.7	-85.4	-41.7	0	0	0	112.1
620	A	56.5	Low	80	Confident	110 Å²	110	56.4 Å²	56.4	91%	0.909	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-16.2	175.6	0	0	0	0	0	113.5
621	A	55.3	Low	80	Confident	74 Å²	74	55.9 Å²	55.9	61%	0.612	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-29.1	-172.3	0	0	0	0	0	114.3	K578	K578-A621 WeakPolarHBondContact CE-O 3.06Å; K578-A621 PolarHBondContact NZ-O 3.44Å
622	A	59.4	Low	79.8	Confident	33 Å²	33	55.1 Å²	55.1	27%	0.273	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.3	136	166.1	0	0	0	0	0	105.9	C624	A622-C624 PolarHBondContact O-N 2.83Å
623	Q	74.6	Confident	79.6	Confident	95 Å²	95	53.5 Å²	53.5	44%	0.444	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	71.7	-178.9	-68.7	-179.5	-0.5	0	0	109.6	L576	L576-Q623 PolarHBondContact N-O 3.22Å
624	C	85.9	Confident	79.2	Confident	8 Å²	8	60.3 Å²	60.3	5%	0.054	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	123.8	-179	-66.3	0	0	0	0	109.8	I574 C575 V618 A622	I574-C624 CarbonylContact O-C 3.58Å; I574-C624 WeakPolarHBondContact O-CA 3.37Å; C575-C624 HydrophobicContact CB-CB 4.12Å; C575-C624 WeakPolarHBondContact CB-SG 3.29Å; C575-C624 WeakPolarHBondContact SG-CB 3.35Å; C575-C624 CovalentContact SG-SG 2.04Å; C575-C624 PolarHBondContact SG-SG 3.01Å; V618-C624 PolarHBondContact N-O 3.36Å; A622-C624 PolarHBondContact O-N 2.83Å
625	Q	86.8	Confident	79.1	Confident	52 Å²	52	59 Å²	59	24%	0.243	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	132.6	-179.1	-62.5	-173	-32.1	0	0	109.6	I574 T616 N617	I574-Q625 PolarHBondContact N-O 3.02Å; I574-Q625 PolarHBondContact O-N 2.88Å; T616-Q625 CarbonylContact O-C 3.49Å; T616-Q625 WeakPolarHBondContact O-CA 3.38Å; N617-Q625 WeakPolarHBondContact OD1-CG 3.23Å; N617-Q625 PolarHBondContact OD1-NE2 3.46Å; N617-Q625 VanDerWaalsContact OD1-NE2 3.14Å
626	N	88.6	Confident	79.1	Confident	17 Å²	17	54.8 Å²	54.8	9%	0.091	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	123.5	164.4	-73.5	-13.5	0	0	0	108.2	Q573 R615 T616 V618	Q573-N626 VanDerWaalsContact CB-OD1 3.27Å; Q573-N626 WeakPolarHBondContact CB-OD1 3.32Å; Q573-N626 WeakPolarHBondContact CG-OD1 3.47Å; Q573-N626 PolarHBondContact NE2-OD1 2.94Å; R615-N626 WeakPolarHBondContact CA-O 3.26Å; T616-N626 PolarHBondContact N-O 3.36Å; T616-N626 PolarHBondContact O-N 3.39Å; T616-N626 WeakPolarHBondContact OG1-CB 3.13Å; V618-N626 HydrophobicContact CG2-CB 4.23Å; V618-N626 VanDerWaalsContact CG2-CG 3.41Å; V618-N626 VanDerWaalsContact CG2-ND2 3.27Å; V618-N626 WeakPolarHBondContact CG2-ND2 3.2Å; V618-N626 WeakPolarHBondContact CG2-OD1 3.43Å
627	W	89.7	Confident	79.4	Confident	5 Å²	5	51.4 Å²	51.4	2%	0.019	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	110.7	174.8	-70.5	63.5	0	0	0	107.3	S571 L572 P584 M586 W613 R615	S571-W627 CarbonylContact C-O 3.6Å; S571-W627 WeakPolarHBondContact CA-O 3.35Å; L572-W627 PolarHBondContact N-O 3.49Å; L572-W627 PolarHBondContact O-N 3.25Å; P584-W627 HydrophobicContact CG-CH2 4Å; P584-W627 HydrophobicContact CG-CZ2 3.61Å; M586-W627 HydrophobicContact CE-CB 4.27Å; M586-W627 HydrophobicContact CE-CD2 3.71Å; M586-W627 HydrophobicContact CE-CE3 3.14Å; M586-W627 HydrophobicContact CE-CG 4.22Å; M586-W627 HydrophobicContact CE-CH2 4.46Å; M586-W627 HydrophobicContact CE-CZ3 3.57Å; W613-W627 HydrophobicContact CB-CE3 3.81Å; W613-W627 HydrophobicContact CB-CZ3 4.29Å; W613-W627 AromaticContact CD2-CE3 3.98Å; W613-W627 HydrophobicContact CD2-CE3 3.98Å; W613-W627 HydrophobicContact CE3-CB 3.75Å; W613-W627 HydrophobicContact CE3-CE3 4.31Å; W613-W627 AromaticContact CG-CE3 3.78Å; W613-W627 HydrophobicContact CG-CE3 3.78Å; W613-W627 HydrophobicContact CG-CZ3 4.24Å; W613-W627 HydrophobicContact CZ3-CB 3.98Å; R615-W627 HydrophobicContact CG-CD2 4.06Å; R615-W627 HydrophobicContact CG-CE3 4.22Å; R615-W627 HydrophobicContact CG-CZ2 4.4Å
628	T	89.2	Confident	79.9	Confident	32 Å²	32	45.4 Å²	45.4	20%	0.196	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	125.7	-178.2	48.3	0	0	0	0	110	L570 S571 E614	L570-T628 WeakPolarHBondContact O-CA 3.39Å; S571-T628 WeakPolarHBondContact OG-CG2 3.49Å; E614-T628 PolarHBondContact N-O 3.05Å; E614-T628 PolarHBondContact O-N 3.34Å; E614-T628 PolarHBondContact O-OG1 2.9Å
629	I	90	Very high	80.8	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.5	168.8	-169.3	-179.7	0	0	0	109.3	A569 L570 M603 V605 F610 P611 W613 L631	A569-I629 WeakPolarHBondContact CA-O 3.28Å; A569-I629 WeakPolarHBondContact CB-O 3.49Å; L570-I629 HydrophobicContact CB-CG2 3.78Å; L570-I629 PolarHBondContact N-O 3.18Å; L570-I629 PolarHBondContact O-N 2.68Å; M603-I629 HydrophobicContact CE-CD1 3.38Å; M603-I629 HydrophobicContact CE-CG2 4.19Å; M603-I629 HydrophobicContact SD-CD1 4.3Å; V605-I629 HydrophobicContact CG1-CD1 4.33Å; V605-I629 HydrophobicContact CG2-CD1 3.98Å; F610-I629 HydrophobicContact CE1-CD1 4.08Å; P611-I629 HydrophobicContact CB-CD1 4.49Å; P611-I629 HydrophobicContact CB-CG1 4.07Å; W613-I629 HydrophobicContact CD2-CB 4.31Å; W613-I629 HydrophobicContact CE3-CB 3.95Å; W613-I629 HydrophobicContact CE3-CG2 4.31Å; W613-I629 HydrophobicContact CH2-CG2 4.14Å; W613-I629 HydrophobicContact CZ3-CB 4.1Å; W613-I629 HydrophobicContact CZ3-CG2 3.95Å; I629-L631 HydrophobicContact CD1-CD2 4.47Å
630	T	88.4	Confident	82	Confident	36 Å²	36	38 Å²	38	22%	0.221	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	114.1	-176	60.8	0	0	0	0	110.2	L518 A569 P611	L518-T630 HydrophobicContact CD1-CG2 3.66Å; A569-T630 HydrophobicContact CB-CG2 4.36Å; P611-T630 WeakPolarHBondContact CB-O 3.21Å; P611-T630 WeakPolarHBondContact CG-O 3.24Å
631	L	86.1	Confident	83.7	Confident	6 Å²	6	32.9 Å²	32.9	3%	0.031	17%	0.173	C	C	.	.			trans	-85.1	-32	-178.1	-59	178.4	0	0	0	112	M567 L568 M603 F610 P611 I629 W635	M567-L631 HydrophobicContact CE-CD1 3.74Å; M567-L631 HydrophobicContact CG-CD1 4.21Å; L568-L631 WeakPolarHBondContact O-CA 3.26Å; L568-L631 VanDerWaalsContact O-CB 3.27Å; L568-L631 WeakPolarHBondContact O-CB 3.4Å; L568-L631 PolarHBondContact O-N 2.99Å; M603-L631 HydrophobicContact SD-CD2 4.16Å; F610-L631 HydrophobicContact CE1-CD2 4.02Å; F610-L631 HydrophobicContact CE2-CD2 4.32Å; F610-L631 HydrophobicContact CZ-CD2 3.53Å; P611-L631 HydrophobicContact CG-CD2 4.44Å; I629-L631 HydrophobicContact CD1-CD2 4.47Å; L631-W635 HydrophobicContact CB-CB 4Å; L631-W635 HydrophobicContact CD2-CB 4.29Å; L631-W635 WeakPolarHBondContact O-CB 3.23Å; L631-W635 PolarHBondContact O-N 3.28Å
632	G	80.1	Confident	85.5	Confident	10 Å²	10	29.4 Å²	29.4	10%	0.103	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	-168.7	-176.5	0	0	0	0	0	112.9	D511 L568 R634 K636	D511-G632 WeakPolarHBondContact OD1-CA 3.5Å; L568-G632 PolarHBondContact O-N 3.41Å; G632-R634 VanDerWaalsContact C-N 3.25Å; G632-R634 PolarHBondContact O-N 2.77Å; G632-K636 WeakPolarHBondContact O-CB 3.5Å; G632-K636 PolarHBondContact O-N 3.11Å
633	N	80.4	Confident	87.1	Confident	47 Å²	47	28.3 Å²	28.3	25%	0.251	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-22.6	176.5	-79.6	-26.2	0	0	0	113.6	L509 D511	L509-N633 PolarHBondContact O-ND2 3.17Å; D511-N633 PolarHBondContact OD1-N 3.33Å
634	R	79.3	Confident	87.9	Confident	172 Å²	172	23.9 Å²	23.9	65%	0.649	11%	0.112	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-36.4	-178.1	-172.2	176.8	178.6	-177.2	-1.5	112.8	G632	G632-R634 VanDerWaalsContact C-N 3.25Å; G632-R634 PolarHBondContact O-N 2.77Å
635	W	84.6	Confident	88	Confident	50 Å²	50	25.5 Å²	25.5	19%	0.189	12%	0.117	C	C	.	.	S	Bend	trans	-119.4	17.7	-173.4	-49.8	115.5	0	0	0	113.4	S609 F610 L631 P733	S609-W635 WeakPolarHBondContact OG-CZ2 3.45Å; F610-W635 HydrophobicContact CD2-CD2 4.19Å; F610-W635 HydrophobicContact CD2-CG 4.34Å; F610-W635 HydrophobicContact CE2-CB 4.13Å; F610-W635 HydrophobicContact CE2-CD2 4.36Å; F610-W635 HydrophobicContact CE2-CG 4.18Å; L631-W635 HydrophobicContact CB-CB 4Å; L631-W635 HydrophobicContact CD2-CB 4.29Å; L631-W635 WeakPolarHBondContact O-CB 3.23Å; L631-W635 PolarHBondContact O-N 3.28Å; W635-P733 HydrophobicContact CE3-CB 3.86Å; W635-P733 HydrophobicContact CE3-CG 3.73Å; W635-P733 HydrophobicContact CH2-CB 4.43Å; W635-P733 HydrophobicContact CZ3-CB 3.56Å; W635-P733 HydrophobicContact CZ3-CG 3.97Å
636	K	87.3	Confident	88	Confident	36 Å²	36	23.1 Å²	23.1	16%	0.157	11%	0.106	C	C	.	.			trans	-64.4	143.4	178.2	65.9	180	175.9	-175.6	0	111.7	V566 L568 G632 Y688 L730	V566-K636 HydrophobicContact CG1-CB 3.92Å; V566-K636 HydrophobicContact CG1-CD 4.27Å; V566-K636 HydrophobicContact CG1-CG 4.36Å; L568-K636 HydrophobicContact CD2-CB 3.55Å; L568-K636 HydrophobicContact CD2-CD 4.14Å; L568-K636 HydrophobicContact CD2-CG 4.49Å; G632-K636 WeakPolarHBondContact O-CB 3.5Å; G632-K636 PolarHBondContact O-N 3.11Å; K636-Y688 PolarHBondContact NZ-OH 3.03Å; K636-L730 HydrophobicContact CD-CD2 4.21Å; K636-L730 HydrophobicContact CG-CD2 3.85Å
637	T	89.3	Confident	87.7	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.006	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	153	-173.6	177.9	0	0	0	0	110.6	V566 M567 W601	V566-T637 CarbonylContact C-O 3.58Å; V566-T637 WeakPolarHBondContact CA-O 3.23Å; M567-T637 HydrophobicContact CB-CG2 4.48Å; M567-T637 HydrophobicContact CE-CG2 3.96Å; M567-T637 PolarHBondContact N-O 3.26Å; M567-T637 PolarHBondContact O-N 3.27Å; W601-T637 HydrophobicContact CZ2-CG2 3.73Å
638	F	90.8	Very high	86.9	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	146.5	167.9	-69.5	-64.1	0	0	0	111.5	L503 L505 V564 H565 V566 P592 F593 L690 V727 L730 L740	L503-F638 HydrophobicContact CD2-CZ 4.34Å; L505-F638 HydrophobicContact CD2-CZ 4.35Å; V564-F638 HydrophobicContact CG1-CD1 3.26Å; V564-F638 HydrophobicContact CG1-CE1 3.41Å; V564-F638 VanDerWaalsContact CG1-CE1 3.41Å; V564-F638 HydrophobicContact CG1-CG 4.23Å; V564-F638 HydrophobicContact CG1-CZ 4.47Å; H565-F638 WeakPolarHBondContact O-CA 3.35Å; V566-F638 HydrophobicContact CG2-CD1 3.82Å; V566-F638 HydrophobicContact CG2-CE1 3.76Å; P592-F638 HydrophobicContact CB-CB 3.72Å; F593-F638 HydrophobicContact CE1-CB 4.19Å; F593-F638 HydrophobicContact CE1-CD1 4.33Å; F593-F638 HydrophobicContact CE1-CD2 4.36Å; F593-F638 HydrophobicContact CE1-CG 4.05Å; F593-F638 HydrophobicContact CE2-CD2 4.48Å; F593-F638 HydrophobicContact CZ-CB 4.01Å; F593-F638 HydrophobicContact CZ-CD1 4.41Å; F593-F638 AromaticContact CZ-CD2 3.66Å; F593-F638 HydrophobicContact CZ-CD2 3.66Å; F593-F638 HydrophobicContact CZ-CE2 4.19Å; F593-F638 AromaticContact CZ-CG 3.77Å; F593-F638 HydrophobicContact CZ-CG 3.77Å; F638-L690 HydrophobicContact CE1-CD1 4.23Å; F638-V727 HydrophobicContact CE2-CG1 4.1Å; F638-L730 HydrophobicContact CD2-CB 4.11Å; F638-L730 HydrophobicContact CD2-CD1 4.16Å; F638-L730 HydrophobicContact CE1-CD1 4.13Å; F638-L730 HydrophobicContact CE2-CB 3.95Å; F638-L730 HydrophobicContact CE2-CD1 3.42Å; F638-L730 VanDerWaalsContact CE2-CD1 3.42Å; F638-L730 HydrophobicContact CE2-CG 4.28Å; F638-L730 HydrophobicContact CZ-CD1 3.42Å; F638-L730 VanDerWaalsContact CZ-CD1 3.42Å; F638-L740 HydrophobicContact CD2-CD1 4.09Å
639	F	90.9	Very high	86.1	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	144.3	170.1	83.6	-75.2	0	0	0	111.9	V527 H565 M567 V590 P592 V642 V685	V527-F639 HydrophobicContact CB-CE1 4.42Å; V527-F639 HydrophobicContact CB-CZ 3.83Å; V527-F639 HydrophobicContact CG1-CE1 4.3Å; V527-F639 HydrophobicContact CG1-CZ 3.65Å; V527-F639 HydrophobicContact CG2-CE1 4.34Å; V527-F639 HydrophobicContact CG2-CZ 4.24Å; H565-F639 HydrophobicContact CB-CD1 3.81Å; H565-F639 HydrophobicContact CB-CE1 3.39Å; H565-F639 HydrophobicContact CB-CZ 3.86Å; H565-F639 PolarHBondContact O-N 2.91Å; M567-F639 HydrophobicContact CB-CB 4.3Å; M567-F639 HydrophobicContact CB-CD1 3.5Å; M567-F639 VanDerWaalsContact CB-CD1 3.5Å; M567-F639 HydrophobicContact CB-CE1 3.98Å; M567-F639 HydrophobicContact CB-CG 4.04Å; V590-F639 HydrophobicContact CG1-CB 3.8Å; P592-F639 CarbonylContact O-C 3.3Å; F639-V642 HydrophobicContact CB-CG2 4.28Å; F639-V642 HydrophobicContact CD2-CG2 3.85Å; F639-V642 HydrophobicContact CG-CG2 4.38Å; F639-V685 HydrophobicContact CD1-CG1 4.48Å; F639-V685 HydrophobicContact CD2-CG1 4.36Å; F639-V685 HydrophobicContact CE1-CG1 3.87Å; F639-V685 HydrophobicContact CE2-CB 4.05Å; F639-V685 HydrophobicContact CE2-CG1 3.76Å; F639-V685 HydrophobicContact CE2-CG2 4.07Å; F639-V685 HydrophobicContact CZ-CB 3.95Å; F639-V685 HydrophobicContact CZ-CG1 3.46Å; F639-V685 VanDerWaalsContact CZ-CG1 3.46Å; F639-V685 HydrophobicContact CZ-CG2 4.48Å
640	E	90.1	Very high	85	Confident	13 Å²	13	32.5 Å²	32.5	6%	0.061	14%	0.144	C	C	.	.	S	Bend	trans	-124.9	-40.4	165.1	176.4	161.5	-172.5	0	0	110.9	K555 S556 N557 N591 P592 F593 G594 R748	K555-E640 WeakPolarHBondContact CA-O 3.41Å; S556-E640 PolarHBondContact N-O 2.66Å; N557-E640 HydrophobicContact CB-CG 4.23Å; N591-E640 PolarHBondContact O-N 2.92Å; P592-E640 PolarHBondContact O-N 2.79Å; F593-E640 VanDerWaalsContact CA-OE2 3.29Å; F593-E640 WeakPolarHBondContact CA-OE2 3.47Å; G594-E640 PolarHBondContact N-OE2 3.42Å; E640-R748 VanDerWaalsContact CD-NH1 3.27Å; E640-R748 IonicContact OE1-CZ 2.87Å; E640-R748 IonicContact OE1-NH1 2.75Å; E640-R748 PolarHBondContact OE1-NH1 2.85Å; E640-R748 IonicContact OE1-NH2 3.97Å; E640-R748 IonicContact OE2-CZ 3.9Å; E640-R748 IonicContact OE2-NE 3.05Å; E640-R748 IonicContact OE2-NH1 2.7Å; E640-R748 PolarHBondContact OE2-NH1 2.88Å; E640-R748 IonicContact OE2-NH2 3.36Å; E640-R748 PolarHBondContact OE2-NH2 2.82Å
641	T	91.1	Very high	83.8	Confident	3 Å²	3	36.2 Å²	36.2	2%	0.018	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	137.6	170.4	51.5	0	0	0	0	111.9	L554 K555 N591 G594 G595	L554-T641 CarbonylContact O-C 3.31Å; L554-T641 WeakPolarHBondContact O-CA 3.46Å; K555-T641 HydrophobicContact CB-CG2 3.91Å; K555-T641 HydrophobicContact CD-CG2 3.93Å; K555-T641 HydrophobicContact CG-CG2 3.7Å; N591-T641 VanDerWaalsContact CB-OG1 3.27Å; N591-T641 WeakPolarHBondContact CB-OG1 3.3Å; N591-T641 PolarHBondContact N-O 3.41Å; N591-T641 PolarHBondContact O-N 2.87Å; G594-T641 WeakPolarHBondContact O-CG2 3.5Å; G594-T641 PolarHBondContact O-OG1 3Å; G595-T641 WeakPolarHBondContact CA-OG1 3.23Å
642	V	93.1	Very high	82.3	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	117.3	172.9	-177.9	0	0	0	0	107.5	T553 L554 M567 I588 V590 F639 V644 V685	T553-V642 CarbonylContact C-O 3.44Å; T553-V642 WeakPolarHBondContact CA-O 3.18Å; L554-V642 HydrophobicContact CB-CB 4.33Å; L554-V642 PolarHBondContact N-O 3.29Å; L554-V642 PolarHBondContact O-N 3.28Å; M567-V642 HydrophobicContact SD-CG2 4.16Å; I588-V642 HydrophobicContact CG2-CG1 3.82Å; V590-V642 HydrophobicContact CG1-CG2 4.48Å; V590-V642 HydrophobicContact CG2-CG1 4.45Å; F639-V642 HydrophobicContact CB-CG2 4.28Å; F639-V642 HydrophobicContact CD2-CG2 3.85Å; F639-V642 HydrophobicContact CG-CG2 4.38Å; V642-V644 HydrophobicContact CG1-CG2 4.09Å; V642-V685 HydrophobicContact CG2-CG2 4.5Å
643	H	92.2	Very high	80.8	Confident	11 Å²	11	47.6 Å²	47.6	5%	0.051	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	115.1	176.4	-61.4	-63	0	0	0	109.1	L551 T553 I588 Y589 Y645	L551-H643 HydrophobicContact CD1-CB 3.93Å; T553-H643 WeakPolarHBondContact CG2-ND1 3.38Å; T553-H643 PolarHBondContact OG1-ND1 2.88Å; I588-H643 WeakPolarHBondContact CA-O 3.43Å; Y589-H643 PolarHBondContact N-O 2.95Å; Y589-H643 PolarHBondContact O-N 2.92Å; H643-Y645 HydrophobicContact CB-CE2 4.48Å
644	V	91.6	Very high	78.9	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	111.5	176.4	-172.3	0	0	0	0	108.2	L552 L570 M586 I588 V642	L552-V644 HydrophobicContact CB-CB 4.2Å; L552-V644 PolarHBondContact N-O 2.83Å; L552-V644 PolarHBondContact O-N 3.28Å; L570-V644 HydrophobicContact CD2-CG2 4.31Å; M586-V644 HydrophobicContact CB-CG1 4.26Å; M586-V644 HydrophobicContact CG-CG1 4.29Å; I588-V644 HydrophobicContact CG1-CG1 4.27Å; I588-V644 HydrophobicContact CG1-CG2 4.29Å; V642-V644 HydrophobicContact CG1-CG2 4.09Å
645	Y	89.3	Confident	77.1	Confident	43 Å²	43	51.6 Å²	51.6	17%	0.169	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	112.2	169.6	-73	-84.9	0	0	0	109.3	R549 M550 L551 M586 A587 Y589 H597 H643	R549-Y645 HydrophobicContact CB-CD1 4.49Å; M550-Y645 WeakPolarHBondContact O-CA 3.17Å; L551-Y645 HydrophobicContact CB-CE1 4.34Å; L551-Y645 HydrophobicContact CD1-CD1 4.27Å; L551-Y645 HydrophobicContact CD1-CD2 4.37Å; L551-Y645 HydrophobicContact CD1-CE1 3.9Å; L551-Y645 HydrophobicContact CD1-CE2 3.97Å; M586-Y645 WeakPolarHBondContact CA-O 3.15Å; A587-Y645 PolarHBondContact N-O 3.27Å; A587-Y645 PolarHBondContact O-N 3.39Å; Y589-Y645 AromaticContact CD2-CD2 3.57Å; Y589-Y645 HydrophobicContact CD2-CD2 3.57Å; Y589-Y645 AromaticContact CD2-CE2 3.65Å; Y589-Y645 HydrophobicContact CD2-CE2 3.65Å; Y589-Y645 AromaticContact CE2-CD2 3.63Å; Y589-Y645 HydrophobicContact CE2-CD2 3.63Å; Y589-Y645 AromaticContact CE2-CE2 3.85Å; Y589-Y645 HydrophobicContact CE2-CE2 3.85Å; H597-Y645 AromaticContact CD2-CE2 3.6Å; H597-Y645 AromaticContact CD2-CZ 3.77Å; H597-Y645 PolarHBondContact CD2-OH 3.31Å; H597-Y645 AromaticContact NE2-CE2 3.15Å; H597-Y645 WeakPolarHBondContact NE2-CE2 3.14Å; H597-Y645 AromaticContact NE2-CZ 3.52Å; H597-Y645 PolarHBondContact NE2-OH 3.42Å; H597-Y645 VanDerWaalsContact NE2-OH 3.12Å; H643-Y645 HydrophobicContact CB-CE2 4.48Å
646	L	86.3	Confident	75	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	126.5	174.8	-175.3	64.3	0	0	0	109.5	F542 M550 L552 P584 M586 M678 I680	F542-L646 HydrophobicContact CZ-CD2 4.43Å; M550-L646 HydrophobicContact CB-CB 4.45Å; M550-L646 HydrophobicContact CE-CB 4.33Å; M550-L646 HydrophobicContact CE-CD2 3.85Å; M550-L646 HydrophobicContact CE-CG 3.99Å; M550-L646 PolarHBondContact N-O 3.46Å; M550-L646 PolarHBondContact O-N 2.98Å; L552-L646 HydrophobicContact CD1-CB 4.33Å; L552-L646 HydrophobicContact CD1-CD2 4.38Å; P584-L646 HydrophobicContact CB-CD1 3.75Å; M586-L646 HydrophobicContact CG-CD1 3.8Å; L646-M678 HydrophobicContact CD2-SD 3.83Å; L646-I680 HydrophobicContact CD2-CD1 3.81Å
647	R	81.9	Confident	72.7	Confident	54 Å²	54	56.9 Å²	56.9	20%	0.204	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	150	169.2	-58.1	-170.7	-168.8	165.8	10.9	108.6	R549 V585	R549-R647 HydrophobicContact CG-CG 4.24Å; R549-R647 VanDerWaalsContact NE-CZ 3.28Å; V585-R647 PolarHBondContact N-O 2.92Å; V585-R647 PolarHBondContact O-N 3.37Å
648	S	72.7	Confident	70.2	Confident	20 Å²	20	64.8 Å²	64.8	14%	0.14	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	138	173.1	59.7	0	0	0	0	109.6	P544	P544-S648 PolarHBondContact O-OG 2.93Å
649	R	72.3	Confident	67.7	Low	109 Å²	109	70 Å²	70	41%	0.411	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	145.2	174.7	-168.1	-175	-178.3	175.1	5	109.5	L582 E583 V585 E659	L582-R649 CarbonylContact C-O 3.56Å; L582-R649 VanDerWaalsContact CA-O 3.29Å; L582-R649 WeakPolarHBondContact CA-O 3.36Å; E583-R649 PolarHBondContact N-O 2.69Å; E583-R649 PolarHBondContact O-N 3.42Å; V585-R649 HydrophobicContact CG2-CB 4.27Å; R649-E659 IonicContact CZ-OE1 3.76Å; R649-E659 VanDerWaalsContact CZ-OE1 3.31Å; R649-E659 IonicContact CZ-OE2 3.28Å; R649-E659 IonicContact NH1-OE1 3.96Å; R649-E659 PolarHBondContact NH1-OE1 3.47Å; R649-E659 IonicContact NH1-OE2 3.16Å; R649-E659 PolarHBondContact NH1-OE2 3.38Å; R649-E659 IonicContact NH2-OE1 3.34Å; R649-E659 PolarHBondContact NH2-OE1 3.01Å; R649-E659 IonicContact NH2-OE2 2.72Å; R649-E659 PolarHBondContact NH2-OE2 2.85Å
650	I	68.3	Low	64.9	Low	69 Å²	69	76 Å²	76	35%	0.354	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	127.9	169.7	-55.9	171.9	0	0	0	108	T581 S652 L666 L675	T581-I650 CarbonylContact O-C 3.53Å; T581-I650 WeakPolarHBondContact O-CA 3.34Å; I650-S652 PolarHBondContact O-N 3.3Å; I650-S652 VanDerWaalsContact O-N 3.15Å; I650-L666 HydrophobicContact CD1-CD2 4.05Å; I650-L675 HydrophobicContact CD1-CD1 4.48Å; I650-L675 HydrophobicContact CD1-CD2 3.94Å; I650-L675 HydrophobicContact CG1-CD2 4.17Å
651	K	63.5	Low	62.5	Low	114 Å²	114	82.3 Å²	82.3	50%	0.496	44%	0.44	S	S	.	.			trans	-60.4	113.9	173.1	-72.1	-178.6	178.3	179.5	0	109.1	T581 E583	T581-K651 PolarHBondContact O-N 3.17Å; E583-K651 HydrophobicContact CB-CG 4.19Å
652	S	54.3	Low	59.8	Low	79 Å²	79	92.7 Å²	92.7	55%	0.552	48%	0.481	S	S	*	.			trans	-65.9	139.3	168.8	171.8	0	0	0	0	109.4	I650 D654	I650-S652 PolarHBondContact O-N 3.3Å; I650-S652 VanDerWaalsContact O-N 3.15Å; S652-D654 VanDerWaalsContact C-N 3.32Å; S652-D654 PolarHBondContact OG-N 2.53Å; S652-D654 PolarHBondContact OG-O 2.86Å
653	L	47.7	Very low	57.5	Low	176 Å²	176	100.3 Å²	100.3	92%	0.921	51%	0.511	S	S	*	.	S	Bend	trans	-84.7	-2.9	174.9	-94.2	134.2	0	0	0	113.2
654	D	40.4	Very low	54.9	Low	124 Å²	124	108.3 Å²	108.3	66%	0.663	55%	0.548	S	S	*	.			trans	-113.6	110.2	-178.8	-73.3	-33.8	0	0	0	111.8	S652 S656	S652-D654 VanDerWaalsContact C-N 3.32Å; S652-D654 PolarHBondContact OG-N 2.53Å; S652-D654 PolarHBondContact OG-O 2.86Å; D654-S656 PolarHBondContact O-N 3.25Å
655	D	41.9	Very low	52.4	Low	180 Å²	180	112.1 Å²	112.1	96%	0.963	57%	0.573	S	S	*	*			trans	-82.7	26.8	-178.6	-124.1	-0.9	0	0	0	112.8
656	S	41.1	Very low	50.4	Low	106 Å²	106	114.1 Å²	114.1	74%	0.741	59%	0.586	S	S	*	*			trans	-131.5	36.6	-165.9	71.4	0	0	0	0	117.1	D654	D654-S656 PolarHBondContact O-N 3.25Å
657	S	37.7	Very low	48.5	Very low	91 Å²	91	121.8 Å²	121.8	64%	0.636	62%	0.622	S	S	*	*	S	Bend	trans	-145	128.9	162.2	61.7	0	0	0	0	112.7	E659	S657-E659 PolarHBondContact O-N 2.98Å
658	N	37.3	Very low	47	Very low	167 Å²	167	128.8 Å²	128.8	89%	0.893	66%	0.659	S	S	*	*			trans	-53	104.9	167.6	-77.2	-30.6	0	0	0	109.9	T660	N658-T660 PolarHBondContact O-N 3.49Å
659	E	37.4	Very low	45.9	Very low	110 Å²	110	133 Å²	133	51%	0.514	68%	0.684	S	S	.	*			trans	-75.7	92.2	179	-66	-172.8	164.3	0	0	110.8	R649 S657 I661	R649-E659 IonicContact CZ-OE1 3.76Å; R649-E659 VanDerWaalsContact CZ-OE1 3.31Å; R649-E659 IonicContact CZ-OE2 3.28Å; R649-E659 IonicContact NH1-OE1 3.96Å; R649-E659 PolarHBondContact NH1-OE1 3.47Å; R649-E659 IonicContact NH1-OE2 3.16Å; R649-E659 PolarHBondContact NH1-OE2 3.38Å; R649-E659 IonicContact NH2-OE1 3.34Å; R649-E659 PolarHBondContact NH2-OE1 3.01Å; R649-E659 IonicContact NH2-OE2 2.72Å; R649-E659 PolarHBondContact NH2-OE2 2.85Å; S657-E659 PolarHBondContact O-N 2.98Å; E659-I661 PolarHBondContact O-N 2.84Å
660	T	33.8	Very low	44.7	Very low	124 Å²	124	133 Å²	133	76%	0.761	69%	0.692	S	S	*	*			trans	-63.9	129	154.5	49.8	0	0	0	0	108.7	N658 Y662	N658-T660 PolarHBondContact O-N 3.49Å; T660-Y662 VanDerWaalsContact C-N 3.28Å; T660-Y662 PolarHBondContact O-N 3.28Å
661	I	39.7	Very low	43.9	Very low	146 Å²	146	136.6 Å²	136.6	75%	0.749	72%	0.72	S	S	*	*			trans	-57.7	81.9	-178.7	-55.5	165.7	0	0	0	110.5	E659 Y663	E659-I661 PolarHBondContact O-N 2.84Å; I661-Y663 HydrophobicContact CG2-CD2 3.89Å; I661-Y663 HydrophobicContact CG2-CE2 3.36Å
662	Y	34.1	Very low	43.2	Very low	221 Å²	221	135.9 Å²	135.9	87%	0.867	73%	0.73	S	S	*	*			trans	-119.4	102.7	165.1	-137	-92.2	0	0	0	107.1	T660 E664	T660-Y662 VanDerWaalsContact C-N 3.28Å; T660-Y662 PolarHBondContact O-N 3.28Å; Y662-E664 PolarHBondContact O-N 3.46Å
663	Y	44.3	Very low	43.4	Very low	161 Å²	161	139.1 Å²	139.1	63%	0.631	73%	0.734	S	S	*	*			trans	-73.9	94.1	-179.9	-71.7	-84.6	0	0	0	109.2	I661	I661-Y663 HydrophobicContact CG2-CD2 3.89Å; I661-Y663 HydrophobicContact CG2-CE2 3.36Å
664	E	37.5	Very low	44.1	Very low	178 Å²	178	136.5 Å²	136.5	83%	0.832	72%	0.721	S	S	*	*			trans	-68.3	126.4	170.7	-156.3	167.2	-154.5	0	0	109.1	Y662 L666	Y662-E664 PolarHBondContact O-N 3.46Å; E664-L666 PolarHBondContact O-N 2.88Å
665	P	39.3	Very low	45.4	Very low	81 Å²	81	132.3 Å²	132.3	53%	0.526	70%	0.698	S	S	.	*			trans	-62.1	132.3	178.5	-17.7	29.7	0	0	0	109.9	E667	P665-E667 VanDerWaalsContact C-N 3.28Å; P665-E667 PolarHBondContact O-N 3.01Å
666	L	47.3	Very low	47	Very low	86 Å²	86	124 Å²	124	45%	0.45	66%	0.655	S	S	.	*			trans	-58.9	98	159.4	-68.3	167.1	0	0	0	107	K548 I650 E664	K548-L666 WeakPolarHBondContact CE-O 3.49Å; I650-L666 HydrophobicContact CD1-CD2 4.05Å; E664-L666 PolarHBondContact O-N 2.88Å
667	E	47.2	Very low	49	Very low	161 Å²	161	123.9 Å²	123.9	75%	0.752	64%	0.639	S	S	*	*			trans	-69.3	151.1	163.3	-70.7	-167.2	159.7	0	0	108.5	P665 T669	P665-E667 VanDerWaalsContact C-N 3.28Å; P665-E667 PolarHBondContact O-N 3.01Å; E667-T669 VanDerWaalsContact C-N 3.31Å; E667-T669 PolarHBondContact O-N 3.42Å
668	M	50.4	Low	51.3	Low	201 Å²	201	119.6 Å²	119.6	99%	0.99	61%	0.609	S	S	*	*			trans	-60.8	89	-179.5	-79.5	-172.1	63.3	0	0	110.7
669	T	49.3	Very low	53.7	Low	109 Å²	109	114 Å²	114	67%	0.669	58%	0.577	S	S	*	*			trans	-103.1	119.5	171.3	45.9	0	0	0	0	110.7	E667	E667-T669 VanDerWaalsContact C-N 3.31Å; E667-T669 PolarHBondContact O-N 3.42Å
670	D	45.7	Very low	56.2	Low	108 Å²	108	108.8 Å²	108.8	58%	0.578	55%	0.552	S	S	*	*			trans	31.6	114.5	167.6	-73.9	-28	0	0	0	119.3	S672 K673	D670-S672 PolarHBondContact O-N 3.01Å; D670-K673 PolarHBondContact O-N 3.01Å
671	P	52.3	Low	58.9	Low	145 Å²	145	104.9 Å²	104.9	94%	0.942	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	2.8	173.6	27.1	-33.2	0	0	0	114.5
672	S	48.9	Very low	61.2	Low	99 Å²	99	100.1 Å²	100.1	69%	0.692	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-11.7	178.4	61.9	0	0	0	0	114	D670 N674	D670-S672 PolarHBondContact O-N 3.01Å; S672-N674 PolarHBondContact O-N 3.35Å
673	K	58.4	Low	63.9	Low	148 Å²	148	90.1 Å²	90.1	64%	0.643	47%	0.466	S	S	*	.			trans	-91.9	97.5	174.6	-72.4	-175.4	-179.5	177.1	0	110.1	D670 L675	D670-K673 PolarHBondContact O-N 3.01Å; K673-L675 PolarHBondContact O-N 2.74Å
674	N	61.4	Low	66	Low	121 Å²	121	84.4 Å²	84.4	65%	0.647	45%	0.445	S	S	*	.			trans	-70.9	92.9	174.9	-155.6	-3.8	0	0	0	109.6	S672 G676	S672-N674 PolarHBondContact O-N 3.35Å; N674-G676 PolarHBondContact O-N 2.73Å
675	L	69.1	Low	68.6	Low	36 Å²	36	75.9 Å²	75.9	19%	0.188	41%	0.406	C	S	.	.			trans	-68.1	-15.6	-178.9	-62.7	172.5	0	0	0	112.5	S580 T581 L582 I650 K673	S580-L675 WeakPolarHBondContact CA-O 3.18Å; S580-L675 PolarHBondContact OG-O 3.26Å; T581-L675 PolarHBondContact N-O 2.02Å; L582-L675 HydrophobicContact CD1-CB 3.95Å; L582-L675 VanDerWaalsContact CD1-O 3.26Å; L582-L675 WeakPolarHBondContact CD1-O 2.95Å; L582-L675 HydrophobicContact CD2-CB 3.98Å; L582-L675 HydrophobicContact CD2-CD1 4.44Å; L582-L675 HydrophobicContact CG-CB 4Å; L582-L675 WeakPolarHBondContact CG-O 3.48Å; I650-L675 HydrophobicContact CD1-CD1 4.48Å; I650-L675 HydrophobicContact CD1-CD2 3.94Å; I650-L675 HydrophobicContact CG1-CD2 4.17Å; K673-L675 PolarHBondContact O-N 2.74Å
676	G	75.1	Confident	71	Confident	6 Å²	6	72.3 Å²	72.3	6%	0.062	38%	0.382	C	S	.	.			trans	102.9	151.1	178.1	0	0	0	0	0	112.5	T577 L582 N674	T577-G676 VanDerWaalsContact OG1-CA 3.29Å; T577-G676 WeakPolarHBondContact OG1-CA 3.39Å; L582-G676 WeakPolarHBondContact CD1-O 3.46Å; N674-G676 PolarHBondContact O-N 2.73Å
677	Y	83.8	Confident	73	Confident	103 Å²	103	68.4 Å²	68.4	40%	0.404	36%	0.362	S	S	.	.			trans	-86.4	150.8	175.5	-62.2	-86.3	0	0	0	111	W541 D543 T577	W541-Y677 WeakPolarHBondContact CZ3-O 3.08Å; D543-Y677 HydrophobicContact CB-CD1 4.16Å; D543-Y677 HydrophobicContact CB-CE1 4.03Å; T577-Y677 HydrophobicContact CG2-CD2 4.36Å; T577-Y677 PolarHBondContact N-O 2.84Å; T577-Y677 PolarHBondContact OG1-N 3.27Å; T577-Y677 PolarHBondContact OG1-O 2.93Å
678	M	85.8	Confident	74.8	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	146.5	174.3	-173.4	-176.9	-69.2	0	0	109.6	W541 F542 P544 I574 C575 L576 P584 L646	W541-M678 WeakPolarHBondContact CA-O 3.15Å; F542-M678 WeakPolarHBondContact CD1-O 2.95Å; F542-M678 HydrophobicContact CE1-CB 4.24Å; F542-M678 HydrophobicContact CE1-CG 4.27Å; F542-M678 WeakPolarHBondContact CE1-O 3.36Å; F542-M678 HydrophobicContact CE2-CB 4.2Å; F542-M678 HydrophobicContact CE2-SD 4.42Å; F542-M678 HydrophobicContact CZ-CB 3.88Å; F542-M678 HydrophobicContact CZ-CG 3.9Å; F542-M678 HydrophobicContact CZ-SD 3.81Å; F542-M678 PolarHBondContact N-O 3.43Å; F542-M678 PolarHBondContact O-N 3.45Å; P544-M678 HydrophobicContact CG-CB 4.26Å; I574-M678 HydrophobicContact CG2-CE 4.43Å; I574-M678 HydrophobicContact CG2-CG 3.64Å; I574-M678 HydrophobicContact CG2-SD 3.86Å; C575-M678 CarbonylContact O-C 3.55Å; C575-M678 WeakPolarHBondContact O-CA 3.25Å; L576-M678 HydrophobicContact CD2-CB 4.08Å; L576-M678 HydrophobicContact CD2-CE 3.86Å; L576-M678 HydrophobicContact CD2-CG 3.94Å; P584-M678 HydrophobicContact CB-CE 3.88Å; P584-M678 HydrophobicContact CG-CE 4.45Å; L646-M678 HydrophobicContact CD2-SD 3.83Å
679	K	88.1	Confident	76.5	Confident	50 Å²	50	55.1 Å²	55.1	22%	0.217	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	131.2	173.5	173.5	-173.8	-167.5	-165.5	0	109	G539 W541 I574 C575 N681	G539-K679 WeakPolarHBondContact O-CE 3.41Å; W541-K679 HydrophobicContact CD2-CB 3.56Å; W541-K679 HydrophobicContact CD2-CD 4.18Å; W541-K679 HydrophobicContact CD2-CG 4.4Å; W541-K679 HydrophobicContact CE3-CB 3.51Å; W541-K679 HydrophobicContact CG-CB 4.1Å; W541-K679 HydrophobicContact CG-CD 4.4Å; W541-K679 HydrophobicContact CH2-CB 4.16Å; W541-K679 HydrophobicContact CZ2-CB 4.22Å; W541-K679 HydrophobicContact CZ2-CD 4.15Å; W541-K679 HydrophobicContact CZ3-CB 3.81Å; I574-K679 CarbonylContact C-O 3.58Å; C575-K679 HydrophobicContact CB-CB 4.17Å; C575-K679 PolarHBondContact N-O 3.27Å; C575-K679 PolarHBondContact O-N 3.44Å; K679-N681 VanDerWaalsContact CD-OD1 3.28Å; K679-N681 WeakPolarHBondContact CD-OD1 3.5Å; K679-N681 WeakPolarHBondContact CE-OD1 3.24Å; K679-N681 PolarHBondContact NZ-OD1 3.39Å
680	I	89.7	Confident	78.2	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	116.5	171.1	-60.9	172.3	0	0	0	107.3	M536 L538 G539 F542 L552 L572 Q573 L646	M536-I680 HydrophobicContact CE-CB 3.89Å; M536-I680 HydrophobicContact CE-CD1 4.33Å; M536-I680 HydrophobicContact CE-CG1 4.29Å; M536-I680 HydrophobicContact SD-CD1 4.33Å; L538-I680 WeakPolarHBondContact CA-O 3.29Å; L538-I680 HydrophobicContact CD2-CB 4.28Å; L538-I680 HydrophobicContact CD2-CG2 3.6Å; G539-I680 PolarHBondContact N-O 2.96Å; F542-I680 HydrophobicContact CE1-CD1 4.42Å; F542-I680 HydrophobicContact CE1-CG1 4.22Å; F542-I680 HydrophobicContact CZ-CD1 4.39Å; F542-I680 HydrophobicContact CZ-CG1 4.48Å; L552-I680 HydrophobicContact CD1-CD1 3.59Å; L552-I680 HydrophobicContact CD2-CD1 4.39Å; L572-I680 HydrophobicContact CD1-CD1 4.44Å; L572-I680 HydrophobicContact CD1-CG2 3.36Å; L572-I680 HydrophobicContact CG-CG2 4.34Å; Q573-I680 WeakPolarHBondContact O-CA 3.06Å; L646-I680 HydrophobicContact CD2-CD1 3.81Å
681	N	88.9	Confident	80	Confident	42 Å²	42	48.8 Å²	48.8	23%	0.225	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	-52.5	-179.1	-77.2	-12.5	0	0	0	111.3	Q573 C575 K679	Q573-N681 HydrophobicContact CB-CB 4.13Å; Q573-N681 HydrophobicContact CG-CB 4.07Å; Q573-N681 PolarHBondContact O-N 3.35Å; Q573-N681 PolarHBondContact OE1-ND2 3.23Å; C575-N681 PolarHBondContact SG-ND2 3.28Å; K679-N681 VanDerWaalsContact CD-OD1 3.28Å; K679-N681 WeakPolarHBondContact CD-OD1 3.5Å; K679-N681 WeakPolarHBondContact CE-OD1 3.24Å; K679-N681 PolarHBondContact NZ-OD1 3.39Å
682	T	89	Confident	81.6	Confident	47 Å²	47	42.2 Å²	42.2	29%	0.288	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	145.4	-174.5	59.3	0	0	0	0	110.1	L572 Q573	L572-T682 WeakPolarHBondContact CA-O 3.4Å; Q573-T682 VanDerWaalsContact CB-OG1 3.31Å; Q573-T682 WeakPolarHBondContact CB-OG1 3.38Å; Q573-T682 PolarHBondContact N-O 2.86Å
683	L	90.3	Very high	83.4	Confident	11 Å²	11	40.8 Å²	40.8	6%	0.058	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	113.7	170.6	176	53.3	0	0	0	107.3	F531 L538 L552 L554 L570 S571 L572	F531-L683 HydrophobicContact CD2-CD2 4.06Å; F531-L683 HydrophobicContact CE2-CD2 4.13Å; L538-L683 HydrophobicContact CD2-CB 4.36Å; L552-L683 HydrophobicContact CB-CD2 4.24Å; L554-L683 HydrophobicContact CD1-CD1 3.87Å; L554-L683 HydrophobicContact CD1-CD2 3.79Å; L554-L683 HydrophobicContact CD1-CG 3.49Å; L554-L683 VanDerWaalsContact CD1-CG 3.49Å; L554-L683 HydrophobicContact CD2-CB 4.44Å; L554-L683 HydrophobicContact CD2-CD2 3.85Å; L554-L683 HydrophobicContact CD2-CG 3.82Å; L554-L683 HydrophobicContact CG-CD2 3.74Å; L554-L683 HydrophobicContact CG-CG 3.89Å; L570-L683 HydrophobicContact CD1-CD1 3.92Å; L570-L683 HydrophobicContact CG-CD1 4.41Å; S571-L683 WeakPolarHBondContact O-CA 3.03Å; S571-L683 WeakPolarHBondContact O-CD1 3.41Å; L572-L683 HydrophobicContact CB-CD1 4.05Å; L572-L683 HydrophobicContact CD1-CB 3.74Å; L572-L683 HydrophobicContact CD1-CD1 3.63Å; L572-L683 HydrophobicContact CD1-CD2 4.3Å; L572-L683 HydrophobicContact CD1-CG 4.03Å; L572-L683 HydrophobicContact CG-CD1 4.4Å
684	Q	89.6	Confident	84.6	Confident	40 Å²	40	35 Å²	35	19%	0.187	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	141.8	-170.1	-71.8	174.5	-45.3	0	0	111	E526 S571 F686	E526-Q684 VanDerWaalsContact CD-NE2 3.34Å; E526-Q684 PolarHBondContact OE1-NE2 3.31Å; S571-Q684 PolarHBondContact N-O 2.89Å; S571-Q684 PolarHBondContact O-N 3.47Å; Q684-F686 HydrophobicContact CB-CE2 4.2Å; Q684-F686 HydrophobicContact CB-CZ 4.24Å
685	V	91.4	Very high	85.6	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	131.3	171.6	-169.2	0	0	0	0	108.6	V527 L554 M567 L570 F639 V642	V527-V685 PolarHBondContact N-O 2.02Å; L554-V685 HydrophobicContact CB-CG2 4.38Å; L554-V685 HydrophobicContact CD1-CG2 3.39Å; L554-V685 HydrophobicContact CG-CG2 4.49Å; M567-V685 HydrophobicContact CB-CG1 4.16Å; M567-V685 HydrophobicContact CG-CG1 3.58Å; M567-V685 HydrophobicContact SD-CG1 3.82Å; L570-V685 HydrophobicContact CD1-CG2 3.86Å; F639-V685 HydrophobicContact CD1-CG1 4.48Å; F639-V685 HydrophobicContact CD2-CG1 4.36Å; F639-V685 HydrophobicContact CE1-CG1 3.87Å; F639-V685 HydrophobicContact CE2-CB 4.05Å; F639-V685 HydrophobicContact CE2-CG1 3.76Å; F639-V685 HydrophobicContact CE2-CG2 4.07Å; F639-V685 HydrophobicContact CZ-CB 3.95Å; F639-V685 HydrophobicContact CZ-CG1 3.46Å; F639-V685 VanDerWaalsContact CZ-CG1 3.46Å; F639-V685 HydrophobicContact CZ-CG2 4.48Å; V642-V685 HydrophobicContact CG2-CG2 4.5Å
686	F	89.6	Confident	86.3	Confident	6 Å²	6	32.6 Å²	32.6	3%	0.026	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	141.2	175.3	-62.3	-78.9	0	0	0	110.7	L518 I525 E526 L568 A569 Q684	L518-F686 HydrophobicContact CD2-CB 3.53Å; L518-F686 HydrophobicContact CD2-CD1 4.06Å; L518-F686 HydrophobicContact CD2-CD2 3.52Å; L518-F686 HydrophobicContact CD2-CE2 4.21Å; L518-F686 HydrophobicContact CD2-CG 3.43Å; L518-F686 VanDerWaalsContact CD2-CG 3.43Å; I525-F686 HydrophobicContact CD1-CB 4.39Å; I525-F686 HydrophobicContact CD1-CD1 3.99Å; I525-F686 HydrophobicContact CD1-CG 4.42Å; I525-F686 HydrophobicContact CG1-CD1 3.91Å; I525-F686 CarbonylContact O-C 3.53Å; I525-F686 WeakPolarHBondContact O-CA 3.48Å; E526-F686 HydrophobicContact CB-CD1 4.2Å; E526-F686 HydrophobicContact CB-CE1 4.13Å; E526-F686 HydrophobicContact CG-CE1 4.41Å; L568-F686 PolarHBondContact N-O 2.95Å; A569-F686 HydrophobicContact CB-CB 4.18Å; A569-F686 PolarHBondContact N-O 2.68Å; A569-F686 PolarHBondContact O-N 2.84Å; Q684-F686 HydrophobicContact CB-CE2 4.2Å; Q684-F686 HydrophobicContact CB-CZ 4.24Å
687	G	88.4	Confident	86.8	Confident	3 Å²	3	32.3 Å²	32.3	3%	0.031	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.2	-154.7	-173.2	0	0	0	0	0	112.6	I525 V566	I525-G687 CarbonylContact C-O 3.58Å; I525-G687 PolarHBondContact O-N 3.23Å; V566-G687 WeakPolarHBondContact O-CA 3.31Å
688	Y	86	Confident	86.8	Confident	26 Å²	26	31.7 Å²	31.7	10%	0.102	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	159.1	179.5	56.4	-96.4	0	0	0	111.5	T507 V566 L568 K636 L690	T507-Y688 WeakPolarHBondContact OG1-CE2 3.2Å; V566-Y688 HydrophobicContact CB-CD2 4.12Å; V566-Y688 HydrophobicContact CB-CE1 4.13Å; V566-Y688 HydrophobicContact CB-CE2 3.71Å; V566-Y688 HydrophobicContact CG1-CE1 4.02Å; V566-Y688 HydrophobicContact CG1-CE2 4.28Å; V566-Y688 HydrophobicContact CG2-CD2 4.3Å; V566-Y688 HydrophobicContact CG2-CE2 3.66Å; V566-Y688 PolarHBondContact N-O 2.81Å; V566-Y688 PolarHBondContact O-N 2.84Å; V566-Y688 VanDerWaalsContact O-N 3.16Å; L568-Y688 HydrophobicContact CD1-CD1 3.82Å; L568-Y688 HydrophobicContact CD1-CE1 3.99Å; L568-Y688 HydrophobicContact CD2-CE1 4.19Å; L568-Y688 HydrophobicContact CG-CD1 4.29Å; L568-Y688 HydrophobicContact CG-CE1 4.22Å; K636-Y688 PolarHBondContact NZ-OH 3.03Å; Y688-L690 HydrophobicContact CD2-CD2 3.5Å; Y688-L690 HydrophobicContact CD2-CG 3.95Å; Y688-L690 HydrophobicContact CE2-CD1 4.05Å; Y688-L690 HydrophobicContact CE2-CD2 3.47Å; Y688-L690 VanDerWaalsContact CE2-CD2 3.47Å; Y688-L690 HydrophobicContact CE2-CG 3.82Å
689	S	85.8	Confident	86.7	Confident	57 Å²	57	35.1 Å²	35.1	40%	0.399	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	132.5	179.4	-53.4	0	0	0	0	109.6	H565	H565-S689 PolarHBondContact CE1-OG 3.44Å; H565-S689 PolarHBondContact ND1-OG 2.92Å
690	L	85.3	Confident	86.4	Confident	7 Å²	7	33 Å²	33	4%	0.037	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	137.1	178.7	-60.3	-177.1	0	0	0	110.1	L503 G504 L505 L563 V564 V566 F638 Y688 F692	L503-L690 HydrophobicContact CD2-CD1 3.89Å; G504-L690 WeakPolarHBondContact O-CD1 3.34Å; G504-L690 WeakPolarHBondContact O-CD2 3.21Å; L505-L690 HydrophobicContact CD2-CD1 3.8Å; L505-L690 HydrophobicContact CG-CD1 4.44Å; L563-L690 WeakPolarHBondContact CA-O 3.39Å; L563-L690 WeakPolarHBondContact CD2-O 3.38Å; V564-L690 PolarHBondContact N-O 2.84Å; V564-L690 PolarHBondContact O-N 3.1Å; V566-L690 HydrophobicContact CG2-CD1 3.91Å; V566-L690 HydrophobicContact CG2-CG 4.38Å; F638-L690 HydrophobicContact CE1-CD1 4.23Å; Y688-L690 HydrophobicContact CD2-CD2 3.5Å; Y688-L690 HydrophobicContact CD2-CG 3.95Å; Y688-L690 HydrophobicContact CE2-CD1 4.05Å; Y688-L690 HydrophobicContact CE2-CD2 3.47Å; Y688-L690 VanDerWaalsContact CE2-CD2 3.47Å; Y688-L690 HydrophobicContact CE2-CG 3.82Å; L690-F692 PolarHBondContact O-N 3.11Å
691	P	84.2	Confident	86.2	Confident	77 Å²	77	33.7 Å²	33.7	50%	0.5	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	134.8	169.7	29.3	-32.8	0	0	0	109.1
692	F	85.7	Confident	85.8	Confident	7 Å²	7	35.7 Å²	35.7	3%	0.031	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-133.3	115.1	179.3	176.6	-104.4	0	0	0	108.8	L503 G562 V564 L690 P694 I697 L744 R748 L749	L503-F692 HydrophobicContact CD1-CD2 3.77Å; L503-F692 HydrophobicContact CD1-CE2 4.11Å; L503-F692 HydrophobicContact CG-CD2 4.32Å; G562-F692 CarbonylContact C-O 3.46Å; G562-F692 VanDerWaalsContact CA-O 3.23Å; G562-F692 WeakPolarHBondContact CA-O 3.3Å; G562-F692 PolarHBondContact O-N 2.82Å; V564-F692 HydrophobicContact CB-CB 4.41Å; V564-F692 HydrophobicContact CG2-CB 3.68Å; V564-F692 HydrophobicContact CG2-CD1 4.22Å; V564-F692 HydrophobicContact CG2-CD2 4.09Å; V564-F692 HydrophobicContact CG2-CG 3.72Å; L690-F692 PolarHBondContact O-N 3.11Å; F692-P694 HydrophobicContact CE1-CB 3.87Å; F692-P694 VanDerWaalsContact O-CD 3.27Å; F692-P694 WeakPolarHBondContact O-CD 3.48Å; F692-I697 HydrophobicContact CD2-CD1 4.39Å; F692-I697 HydrophobicContact CE2-CD1 3.47Å; F692-I697 VanDerWaalsContact CE2-CD1 3.47Å; F692-I697 HydrophobicContact CZ-CD1 3.94Å; F692-L744 HydrophobicContact CE2-CD1 4Å; F692-L744 HydrophobicContact CE2-CD2 3.91Å; F692-L744 HydrophobicContact CE2-CG 4.22Å; F692-L744 HydrophobicContact CZ-CD2 3.95Å; F692-L744 HydrophobicContact CZ-CG 4.3Å; F692-R748 HydrophobicContact CE1-CB 3.67Å; F692-R748 HydrophobicContact CE1-CG 4.2Å; F692-R748 HydrophobicContact CZ-CB 3.88Å; F692-L749 HydrophobicContact CE1-CD1 4.47Å; F692-L749 HydrophobicContact CZ-CD1 3.71Å
693	D	85.1	Confident	85.4	Confident	69 Å²	69	34.8 Å²	34.8	37%	0.369	19%	0.187	S	C	.	.			trans	-99	102	176.5	-167.5	-21.7	0	0	0	110	D695 A696	D693-D695 VanDerWaalsContact C-N 3.27Å; D693-D695 PolarHBondContact O-N 2.99Å; D693-D695 PolarHBondContact OD1-N 3.42Å; D693-A696 HydrophobicContact CB-CB 3.94Å; D693-A696 PolarHBondContact OD1-N 2.89Å
694	P	84.2	Confident	84.9	Confident	26 Å²	26	35.1 Å²	35.1	17%	0.169	19%	0.189	C	C	.	.	H	α-helix	trans	-68.2	-27.1	178.7	28.3	-34.1	0	0	0	112.8	F692 R698	F692-P694 HydrophobicContact CE1-CB 3.87Å; F692-P694 VanDerWaalsContact O-CD 3.27Å; F692-P694 WeakPolarHBondContact O-CD 3.48Å; P694-R698 VanDerWaalsContact O-CG 3.3Å; P694-R698 WeakPolarHBondContact O-CG 3.45Å; P694-R698 PolarHBondContact O-N 3.23Å
695	D	83.6	Confident	84.2	Confident	89 Å²	89	36.3 Å²	36.3	48%	0.476	20%	0.197	S	C	.	.	H	α-helix	trans	-80.8	-37.6	-173.6	-64.9	-34.6	0	0	0	110.2	D693 I697 R698 D699	D693-D695 VanDerWaalsContact C-N 3.27Å; D693-D695 PolarHBondContact O-N 2.99Å; D693-D695 PolarHBondContact OD1-N 3.42Å; D695-I697 VanDerWaalsContact C-N 3.34Å; D695-I697 PolarHBondContact O-N 2.95Å; D695-R698 WeakPolarHBondContact O-CB 3.08Å; D695-R698 PolarHBondContact O-N 3.13Å; D695-R698 VanDerWaalsContact O-N 3.09Å; D695-R698 IonicContact OD1-NH1 3.7Å; D695-R698 PolarHBondContact OD1-NH1 2.95Å; D695-D699 PolarHBondContact O-N 2.95Å
696	A	82.8	Confident	83.3	Confident	18 Å²	18	43.5 Å²	43.5	15%	0.149	23%	0.225	C	C	.	.	H	α-helix	trans	-58.9	-42	172.1	0	0	0	0	0	112.8	F502 D693 D699 L700	F502-A696 HydrophobicContact CD1-CB 3.52Å; F502-A696 HydrophobicContact CE1-CB 3.62Å; F502-A696 WeakPolarHBondContact CE1-O 3.43Å; D693-A696 HydrophobicContact CB-CB 3.94Å; D693-A696 PolarHBondContact OD1-N 2.89Å; A696-D699 PolarHBondContact O-N 2.81Å; A696-L700 PolarHBondContact O-N 3.21Å; A696-L700 VanDerWaalsContact O-N 3.14Å
697	I	84.8	Confident	82	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-70.4	-33.3	176.6	-58.3	176.1	0	0	0	111	F502 F692 D695 D699 L700 I701 L723 L745 L749	F502-I697 HydrophobicContact CB-CG1 4.17Å; F502-I697 HydrophobicContact CD1-CG1 3.94Å; F502-I697 HydrophobicContact CG-CG1 4.47Å; F692-I697 HydrophobicContact CD2-CD1 4.39Å; F692-I697 HydrophobicContact CE2-CD1 3.47Å; F692-I697 VanDerWaalsContact CE2-CD1 3.47Å; F692-I697 HydrophobicContact CZ-CD1 3.94Å; D695-I697 VanDerWaalsContact C-N 3.34Å; D695-I697 PolarHBondContact O-N 2.95Å; I697-D699 VanDerWaalsContact C-N 3.35Å; I697-L700 PolarHBondContact O-N 3.32Å; I697-I701 HydrophobicContact CG2-CD1 4.23Å; I697-I701 WeakPolarHBondContact O-CG1 3.48Å; I697-I701 PolarHBondContact O-N 3.02Å; I697-I701 VanDerWaalsContact O-N 3.08Å; I697-L723 HydrophobicContact CD1-CD1 3.88Å; I697-L723 HydrophobicContact CG1-CD1 4.15Å; I697-L745 HydrophobicContact CG2-CD2 4.42Å; I697-L749 HydrophobicContact CB-CD2 3.96Å; I697-L749 HydrophobicContact CG2-CD1 4.37Å; I697-L749 HydrophobicContact CG2-CD2 3.58Å
698	R	85.3	Confident	80.4	Confident	91 Å²	91	55.9 Å²	55.9	34%	0.343	28%	0.277	S	S	.	.	H	α-helix	trans	-64.4	-40.5	173	-77.5	172.2	176.7	153.8	-1.5	111.6	P694 D695 L700 I701 L702 L749	P694-R698 VanDerWaalsContact O-CG 3.3Å; P694-R698 WeakPolarHBondContact O-CG 3.45Å; P694-R698 PolarHBondContact O-N 3.23Å; D695-R698 WeakPolarHBondContact O-CB 3.08Å; D695-R698 PolarHBondContact O-N 3.13Å; D695-R698 VanDerWaalsContact O-N 3.09Å; D695-R698 IonicContact OD1-NH1 3.7Å; D695-R698 PolarHBondContact OD1-NH1 2.95Å; R698-L700 VanDerWaalsContact C-N 3.34Å; R698-L700 PolarHBondContact O-N 2.79Å; R698-I701 PolarHBondContact O-N 3.17Å; R698-I701 VanDerWaalsContact O-N 3.12Å; R698-L702 WeakPolarHBondContact O-CG 3Å; R698-L702 PolarHBondContact O-N 3.3Å; R698-L749 HydrophobicContact CG-CD2 3.93Å; R698-L749 HydrophobicContact CG-CG 4.46Å; R698-L749 PolarHBondContact NH2-O 2.97Å
699	D	83	Confident	78.8	Confident	72 Å²	72	59.9 Å²	59.9	39%	0.385	31%	0.305	S	S	.	.	H	α-helix	trans	-62.5	-41.3	176.4	-72.2	-15.6	0	0	0	111.3	D695 A696 I697 I701 L702 Q703	D695-D699 PolarHBondContact O-N 2.95Å; A696-D699 PolarHBondContact O-N 2.81Å; I697-D699 VanDerWaalsContact C-N 3.35Å; D699-I701 VanDerWaalsContact C-N 3.3Å; D699-I701 PolarHBondContact O-N 3.22Å; D699-L702 PolarHBondContact O-N 3.43Å; D699-Q703 WeakPolarHBondContact O-CG 3.35Å; D699-Q703 PolarHBondContact O-N 3.34Å
700	L	81	Confident	77.2	Confident	6 Å²	6	62.5 Å²	62.5	3%	0.031	31%	0.311	C	S	.	.	H	α-helix	trans	-59.6	-39.4	171.5	-75.7	175.4	0	0	0	113	F502 A696 I697 R698 Q703 A716 Q719 L720	F502-L700 HydrophobicContact CD1-CD1 3.77Å; F502-L700 HydrophobicContact CD2-CD1 4.46Å; F502-L700 HydrophobicContact CE1-CD1 3.27Å; F502-L700 HydrophobicContact CE1-CD2 4.46Å; F502-L700 HydrophobicContact CE1-CG 3.66Å; F502-L700 HydrophobicContact CE2-CD1 4.05Å; F502-L700 HydrophobicContact CG-CD1 4.35Å; F502-L700 HydrophobicContact CZ-CD1 3.43Å; F502-L700 VanDerWaalsContact CZ-CD1 3.43Å; F502-L700 HydrophobicContact CZ-CD2 4.16Å; F502-L700 HydrophobicContact CZ-CG 3.83Å; A696-L700 PolarHBondContact O-N 3.21Å; A696-L700 VanDerWaalsContact O-N 3.14Å; I697-L700 PolarHBondContact O-N 3.32Å; R698-L700 VanDerWaalsContact C-N 3.34Å; R698-L700 PolarHBondContact O-N 2.79Å; L700-Q703 WeakPolarHBondContact O-CB 3.5Å; L700-Q703 PolarHBondContact O-N 2.78Å; L700-A716 HydrophobicContact CD2-CB 4.42Å; L700-Q719 HydrophobicContact CD1-CB 4.36Å; L700-Q719 HydrophobicContact CD2-CB 4.45Å; L700-L720 HydrophobicContact CB-CD2 4.48Å
701	I	85.4	Confident	76	Confident	13 Å²	13	64 Å²	64	7%	0.067	33%	0.327	C	S	.	.	H	α-helix	trans	-69.8	-38.7	176.9	-66.6	167	0	0	0	110.4	I697 R698 D699 Q703 L704 L745 L749 L751 I759	I697-I701 HydrophobicContact CG2-CD1 4.23Å; I697-I701 WeakPolarHBondContact O-CG1 3.48Å; I697-I701 PolarHBondContact O-N 3.02Å; I697-I701 VanDerWaalsContact O-N 3.08Å; R698-I701 PolarHBondContact O-N 3.17Å; R698-I701 VanDerWaalsContact O-N 3.12Å; D699-I701 VanDerWaalsContact C-N 3.3Å; D699-I701 PolarHBondContact O-N 3.22Å; I701-Q703 VanDerWaalsContact C-N 3.29Å; I701-Q703 PolarHBondContact O-N 3.34Å; I701-L704 VanDerWaalsContact O-CB 3.27Å; I701-L704 WeakPolarHBondContact O-CB 3.33Å; I701-L704 PolarHBondContact O-N 3.43Å; I701-L704 VanDerWaalsContact O-N 3.09Å; I701-L745 HydrophobicContact CD1-CD2 4.1Å; I701-L749 HydrophobicContact CD1-CD2 3.78Å; I701-L751 HydrophobicContact CD1-CD1 3.74Å; I701-I759 HydrophobicContact CD1-CD1 3.88Å; I701-I759 HydrophobicContact CG1-CD1 4.13Å; I701-I759 HydrophobicContact CG2-CD1 3.92Å; I701-I759 HydrophobicContact CG2-CG1 4.49Å
702	L	81.9	Confident	75.2	Confident	85 Å²	85	63 Å²	63	45%	0.445	32%	0.322	S	S	.	.	H	α-helix	trans	-63.8	-34	175.6	-72.9	171.9	0	0	0	112.2	R698 D699 L704 D705 Y706	R698-L702 WeakPolarHBondContact O-CG 3Å; R698-L702 PolarHBondContact O-N 3.3Å; D699-L702 PolarHBondContact O-N 3.43Å; L702-L704 PolarHBondContact O-N 3.48Å; L702-D705 PolarHBondContact O-N 3.09Å; L702-Y706 PolarHBondContact O-N 2.84Å
703	Q	79.3	Confident	74.7	Confident	27 Å²	27	66.9 Å²	66.9	13%	0.126	34%	0.341	C	S	.	.	H	α-helix	trans	-61.2	-27.2	173.2	-73.4	172.6	14.9	0	0	113	D699 L700 I701 D705 Y706 P707 Q710 A716	D699-Q703 WeakPolarHBondContact O-CG 3.35Å; D699-Q703 PolarHBondContact O-N 3.34Å; L700-Q703 WeakPolarHBondContact O-CB 3.5Å; L700-Q703 PolarHBondContact O-N 2.78Å; I701-Q703 VanDerWaalsContact C-N 3.29Å; I701-Q703 PolarHBondContact O-N 3.34Å; Q703-D705 VanDerWaalsContact C-N 3.34Å; Q703-Y706 CarbonylContact O-C 3.6Å; Q703-P707 WeakPolarHBondContact O-CA 3.48Å; Q703-Q710 HydrophobicContact CG-CB 3.72Å; Q703-Q710 PolarHBondContact NE2-O 2.81Å; Q703-A716 HydrophobicContact CB-CB 4.07Å
704	L	79.9	Confident	74.3	Confident	19 Å²	19	67.9 Å²	67.9	10%	0.099	35%	0.346	C	S	.	.	H	α-helix	trans	-69.2	-34.3	173.2	-58.2	178	0	0	0	112.4	I701 L702 Q713 A716 L717 L720	I701-L704 VanDerWaalsContact O-CB 3.27Å; I701-L704 WeakPolarHBondContact O-CB 3.33Å; I701-L704 PolarHBondContact O-N 3.43Å; I701-L704 VanDerWaalsContact O-N 3.09Å; L702-L704 PolarHBondContact O-N 3.48Å; L704-Q713 HydrophobicContact CD2-CG 4.41Å; L704-A716 HydrophobicContact CD2-CB 4.11Å; L704-L717 HydrophobicContact CD1-CD2 4.43Å; L704-L717 HydrophobicContact CD2-CD1 4.41Å; L704-L717 HydrophobicContact CD2-CD2 3.55Å; L704-L717 HydrophobicContact CD2-CG 3.55Å; L704-L720 HydrophobicContact CD1-CD1 3.68Å; L704-L720 HydrophobicContact CD2-CD1 4.46Å; L704-L720 HydrophobicContact CG-CD1 4.28Å
705	D	75.9	Confident	74	Confident	65 Å²	65	67.8 Å²	67.8	35%	0.348	35%	0.346	S	S	.	.	H	α-helix	trans	-86.2	-30.5	-178.8	-72.5	-38.4	0	0	0	112	L702 Q703 R758	L702-D705 PolarHBondContact O-N 3.09Å; Q703-D705 VanDerWaalsContact C-N 3.34Å; D705-R758 VanDerWaalsContact CG-NH2 3.35Å; D705-R758 IonicContact OD1-CZ 3.31Å; D705-R758 IonicContact OD1-NH1 3.65Å; D705-R758 PolarHBondContact OD1-NH1 3.16Å; D705-R758 IonicContact OD1-NH2 3.31Å; D705-R758 PolarHBondContact OD1-NH2 3.38Å; D705-R758 VanDerWaalsContact OD1-NH2 3.08Å; D705-R758 IonicContact OD2-CZ 2.65Å; D705-R758 IonicContact OD2-NH1 3.49Å; D705-R758 IonicContact OD2-NH2 2.61Å; D705-R758 PolarHBondContact OD2-NH2 2.84Å
706	Y	72.8	Confident	73.8	Confident	151 Å²	151	63.6 Å²	63.6	59%	0.592	32%	0.323	S	S	*	.			trans	-133.3	73.2	-177.1	-59	-76.7	0	0	0	112.2	L702 Q703 Y708 T709	L702-Y706 PolarHBondContact O-N 2.84Å; Q703-Y706 CarbonylContact O-C 3.6Å; Y706-Y708 PolarHBondContact O-N 2.81Å; Y706-T709 PolarHBondContact O-OG1 2.93Å
707	P	61.2	Low	74	Confident	42 Å²	42	63.2 Å²	63.2	27%	0.273	32%	0.319	S	S	.	.	H	α-helix	trans	-66.8	-11.7	-175.6	25.6	-34.5	0	0	0	114.6	Q703 Q713	Q703-P707 WeakPolarHBondContact O-CA 3.48Å; P707-Q713 HydrophobicContact CB-CB 4.2Å
708	Y	55.6	Low	73.9	Confident	226 Å²	226	66.2 Å²	66.2	89%	0.886	33%	0.334	S	S	*	.	H	α-helix	trans	-83.3	-10.3	-175.5	-62	-75.2	0	0	0	114.7	Y706	Y706-Y708 PolarHBondContact O-N 2.81Å
709	T	52.4	Low	73.7	Confident	110 Å²	110	62.6 Å²	62.6	68%	0.675	32%	0.322	S	S	*	.	H	α-helix	trans	-110.4	-23.3	-169.2	51.7	0	0	0	0	114.9	Y706	Y706-T709 PolarHBondContact O-OG1 2.93Å
710	Q	52.4	Low	73.9	Confident	113 Å²	113	59.2 Å²	59.2	53%	0.528	30%	0.303	S	S	.	.	H	α-helix	trans	-146.3	7.6	-169	-72.5	-167.9	-6.9	0	0	117.6	Q703	Q703-Q710 HydrophobicContact CG-CB 3.72Å; Q703-Q710 PolarHBondContact NE2-O 2.81Å
711	G	59.9	Low	74.2	Confident	37 Å²	37	59.5 Å²	59.5	38%	0.381	31%	0.305	S	S	.	.	S	Bend	trans	152.9	175.5	176.7	0	0	0	0	0	113.6
712	S	67.4	Low	74.1	Confident	56 Å²	56	62.1 Å²	62.1	39%	0.392	32%	0.317	S	S	.	.			trans	-74.7	138.6	172.5	63.5	0	0	0	0	110.7	D714 S715 A716	S712-D714 PolarHBondContact O-N 2.87Å; S712-S715 PolarHBondContact O-N 2.84Å; S712-S715 PolarHBondContact O-OG 2.75Å; S712-S715 VanDerWaalsContact OG-CB 3.28Å; S712-S715 WeakPolarHBondContact OG-CB 3.44Å; S712-S715 PolarHBondContact OG-N 3.34Å; S712-S715 PolarHBondContact OG-OG 2.66Å; S712-S715 VanDerWaalsContact OG-OG 3.07Å; S712-A716 PolarHBondContact O-N 3.23Å
713	Q	74.8	Confident	74.3	Confident	90 Å²	90	58.2 Å²	58.2	42%	0.421	30%	0.297	S	S	.	.	H	α-helix	trans	-57.2	-35.7	178.5	-170.6	178.4	12	0	0	112.2	L704 P707 L717	L704-Q713 HydrophobicContact CD2-CG 4.41Å; P707-Q713 HydrophobicContact CB-CB 4.2Å; Q713-L717 HydrophobicContact CG-CD1 4.15Å; Q713-L717 WeakPolarHBondContact O-CG 3.42Å; Q713-L717 PolarHBondContact O-N 2.64Å; Q713-L717 VanDerWaalsContact O-N 3.1Å
714	D	77.1	Confident	74.7	Confident	90 Å²	90	58.3 Å²	58.3	48%	0.481	30%	0.296	S	S	.	.	H	α-helix	trans	-69.7	-34.1	-178.7	-65.6	-22.7	0	0	0	112.3	S712 L717 L718 F766	S712-D714 PolarHBondContact O-N 2.87Å; D714-L717 PolarHBondContact O-N 2.99Å; D714-L718 WeakPolarHBondContact O-CG 3.31Å; D714-L718 PolarHBondContact O-N 2.92Å; D714-F766 HydrophobicContact CB-CE2 3.8Å; D714-F766 HydrophobicContact CB-CZ 4.09Å; D714-F766 WeakPolarHBondContact OD1-CE2 3.36Å
715	S	78	Confident	74.9	Confident	24 Å²	24	59.6 Å²	59.6	17%	0.168	30%	0.302	C	S	.	.	H	α-helix	trans	-71.7	-38.8	177.4	71.2	0	0	0	0	112	S712 L718 Q719	S712-S715 PolarHBondContact O-N 2.84Å; S712-S715 PolarHBondContact O-OG 2.75Å; S712-S715 VanDerWaalsContact OG-CB 3.28Å; S712-S715 WeakPolarHBondContact OG-CB 3.44Å; S712-S715 PolarHBondContact OG-N 3.34Å; S712-S715 PolarHBondContact OG-OG 2.66Å; S712-S715 VanDerWaalsContact OG-OG 3.07Å; S715-L718 PolarHBondContact O-N 3.47Å; S715-Q719 WeakPolarHBondContact O-CG 3.41Å; S715-Q719 PolarHBondContact O-N 3.31Å
716	A	79.9	Confident	75.3	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-63.1	-41.1	173.2	0	0	0	0	0	111.8	L700 Q703 L704 S712 Q719 L720	L700-A716 HydrophobicContact CD2-CB 4.42Å; Q703-A716 HydrophobicContact CB-CB 4.07Å; L704-A716 HydrophobicContact CD2-CB 4.11Å; S712-A716 PolarHBondContact O-N 3.23Å; A716-Q719 PolarHBondContact O-N 3.4Å; A716-L720 WeakPolarHBondContact O-CG 3.27Å; A716-L720 PolarHBondContact O-N 3.48Å
717	L	85	Confident	76	Confident	10 Å²	10	53.4 Å²	53.4	5%	0.052	27%	0.273	C	S	.	.	H	α-helix	trans	-65.3	-40.7	176.1	-74.3	166.8	0	0	0	112.3	L704 Q713 D714 L720 I721 L763 F766	L704-L717 HydrophobicContact CD1-CD2 4.43Å; L704-L717 HydrophobicContact CD2-CD1 4.41Å; L704-L717 HydrophobicContact CD2-CD2 3.55Å; L704-L717 HydrophobicContact CD2-CG 3.55Å; Q713-L717 HydrophobicContact CG-CD1 4.15Å; Q713-L717 WeakPolarHBondContact O-CG 3.42Å; Q713-L717 PolarHBondContact O-N 2.64Å; Q713-L717 VanDerWaalsContact O-N 3.1Å; D714-L717 PolarHBondContact O-N 2.99Å; L717-L720 PolarHBondContact O-N 3.42Å; L717-I721 WeakPolarHBondContact O-CG1 3.41Å; L717-I721 PolarHBondContact O-N 3.48Å; L717-L763 HydrophobicContact CD2-CD2 3.91Å; L717-F766 HydrophobicContact CB-CB 4.39Å; L717-F766 HydrophobicContact CB-CD1 3.86Å; L717-F766 HydrophobicContact CB-CD2 4.16Å; L717-F766 HydrophobicContact CB-CE1 4.14Å; L717-F766 HydrophobicContact CB-CE2 4.42Å; L717-F766 HydrophobicContact CB-CG 3.86Å; L717-F766 HydrophobicContact CB-CZ 4.41Å; L717-F766 HydrophobicContact CD1-CB 4.01Å; L717-F766 HydrophobicContact CD1-CD2 3.69Å; L717-F766 HydrophobicContact CD1-CE2 4.37Å; L717-F766 HydrophobicContact CD1-CG 3.89Å; L717-F766 HydrophobicContact CG-CG 4.41Å
718	L	83.4	Confident	77.4	Confident	63 Å²	63	51.4 Å²	51.4	33%	0.33	26%	0.261	S	S	.	.	H	α-helix	trans	-60.4	-46.2	174.3	-78.3	167.6	0	0	0	111.8	D714 S715 L720 I721 E722 F766 L770	D714-L718 WeakPolarHBondContact O-CG 3.31Å; D714-L718 PolarHBondContact O-N 2.92Å; S715-L718 PolarHBondContact O-N 3.47Å; L718-L720 PolarHBondContact O-N 3.22Å; L718-I721 PolarHBondContact O-N 3.03Å; L718-E722 PolarHBondContact O-N 2.91Å; L718-F766 HydrophobicContact CD1-CZ 4.41Å; L718-F766 HydrophobicContact CD2-CE1 3.66Å; L718-F766 HydrophobicContact CD2-CZ 4.16Å; L718-F766 HydrophobicContact CG-CE1 3.64Å; L718-F766 HydrophobicContact CG-CZ 3.82Å; L718-L770 HydrophobicContact CD2-CD1 4.11Å; L718-L770 HydrophobicContact CD2-CD2 4.21Å
719	Q	81.4	Confident	78.7	Confident	16 Å²	16	47.4 Å²	47.4	8%	0.075	25%	0.25	C	C	.	.	H	α-helix	trans	-61.3	-42.5	178.2	-72.8	-178.4	37.2	0	0	112.4	A496 L700 S715 A716 E722 L723	A496-Q719 HydrophobicContact CB-CG 3.61Å; L700-Q719 HydrophobicContact CD1-CB 4.36Å; L700-Q719 HydrophobicContact CD2-CB 4.45Å; S715-Q719 WeakPolarHBondContact O-CG 3.41Å; S715-Q719 PolarHBondContact O-N 3.31Å; A716-Q719 PolarHBondContact O-N 3.4Å; Q719-E722 PolarHBondContact O-N 3.05Å; Q719-L723 WeakPolarHBondContact O-CB 3.46Å; Q719-L723 PolarHBondContact O-N 3.48Å
720	L	87	Confident	80.3	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.5	-33.5	177.7	-72.2	170.9	0	0	0	112.9	L700 L704 A716 L717 L718 R724 F741 L763	L700-L720 HydrophobicContact CB-CD2 4.48Å; L704-L720 HydrophobicContact CD1-CD1 3.68Å; L704-L720 HydrophobicContact CD2-CD1 4.46Å; L704-L720 HydrophobicContact CG-CD1 4.28Å; A716-L720 WeakPolarHBondContact O-CG 3.27Å; A716-L720 PolarHBondContact O-N 3.48Å; L717-L720 PolarHBondContact O-N 3.42Å; L718-L720 PolarHBondContact O-N 3.22Å; L720-R724 VanDerWaalsContact O-CB 3.31Å; L720-R724 WeakPolarHBondContact O-CB 3.22Å; L720-R724 PolarHBondContact O-N 3.38Å; L720-F741 HydrophobicContact CD2-CZ 4.32Å; L720-L763 HydrophobicContact CB-CD1 4.39Å; L720-L763 HydrophobicContact CB-CD2 3.54Å; L720-L763 HydrophobicContact CD1-CD2 4.45Å
721	I	86.4	Confident	81.9	Confident	13 Å²	13	38.4 Å²	38.4	7%	0.067	20%	0.203	C	C	.	.	H	α-helix	trans	-63.9	-47.1	172.1	-74.2	177.6	0	0	0	110.3	L717 L718 L723 R724 D725 L763 F766 N767 L770	L717-I721 WeakPolarHBondContact O-CG1 3.41Å; L717-I721 PolarHBondContact O-N 3.48Å; L718-I721 PolarHBondContact O-N 3.03Å; I721-L723 PolarHBondContact O-N 3.15Å; I721-R724 WeakPolarHBondContact O-CB 3.26Å; I721-R724 PolarHBondContact O-N 3.12Å; I721-D725 PolarHBondContact O-N 3.13Å; I721-L763 HydrophobicContact CG1-CB 4.38Å; I721-L763 HydrophobicContact CG1-CD2 3.77Å; I721-F766 HydrophobicContact CD1-CD1 3.65Å; I721-F766 HydrophobicContact CD1-CE1 4.3Å; I721-N767 HydrophobicContact CD1-CB 3.93Å; I721-L770 HydrophobicContact CD1-CD1 4.33Å
722	E	84.3	Confident	82.6	Confident	67 Å²	67	37.1 Å²	37.1	31%	0.313	19%	0.187	S	C	.	.	H	α-helix	trans	-63	-42.9	179.4	-165.4	-175.8	167.4	0	0	111.5	L499 L718 Q719 R724 D725 R726	L499-E722 HydrophobicContact CD1-CB 4.07Å; L499-E722 HydrophobicContact CD1-CG 3.57Å; L499-E722 VanDerWaalsContact CD1-OE1 3.31Å; L499-E722 WeakPolarHBondContact CD1-OE1 3.32Å; L718-E722 PolarHBondContact O-N 2.91Å; Q719-E722 PolarHBondContact O-N 3.05Å; E722-R724 PolarHBondContact O-N 3.34Å; E722-D725 PolarHBondContact O-N 3.45Å; E722-R726 WeakPolarHBondContact O-CG 3.34Å; E722-R726 PolarHBondContact O-N 3.31Å; E722-R726 IonicContact OE1-CZ 2.76Å; E722-R726 VanDerWaalsContact OE1-CZ 3.28Å; E722-R726 IonicContact OE1-NE 3.11Å; E722-R726 PolarHBondContact OE1-NE 3.26Å; E722-R726 VanDerWaalsContact OE1-NE 3.16Å; E722-R726 IonicContact OE1-NH2 3.27Å; E722-R726 PolarHBondContact OE1-NH2 3.21Å
723	L	86.4	Confident	82.7	Confident	4 Å²	4	36.6 Å²	36.6	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-61.5	-45.7	176.5	-157.1	156	0	0	0	111.2	F502 I697 Q719 I721 D725 R726 V727 F741	F502-L723 HydrophobicContact CB-CD1 3.96Å; I697-L723 HydrophobicContact CD1-CD1 3.88Å; I697-L723 HydrophobicContact CG1-CD1 4.15Å; Q719-L723 WeakPolarHBondContact O-CB 3.46Å; Q719-L723 PolarHBondContact O-N 3.48Å; I721-L723 PolarHBondContact O-N 3.15Å; L723-D725 VanDerWaalsContact C-N 3.33Å; L723-D725 PolarHBondContact O-N 2.92Å; L723-R726 PolarHBondContact O-N 3.47Å; L723-V727 HydrophobicContact CD2-CG2 3.66Å; L723-V727 WeakPolarHBondContact O-CB 3.35Å; L723-V727 VanDerWaalsContact O-CG2 3.29Å; L723-V727 WeakPolarHBondContact O-CG2 3.17Å; L723-V727 PolarHBondContact O-N 3.07Å; L723-F741 HydrophobicContact CB-CE2 4.45Å; L723-F741 HydrophobicContact CD2-CD2 3.77Å; L723-F741 HydrophobicContact CD2-CE2 3.57Å
724	R	87.3	Confident	82.5	Confident	29 Å²	29	35.3 Å²	35.3	11%	0.109	19%	0.193	C	C	.	.	H	α-helix	trans	-55.9	-49	175.6	177.9	-162.9	72.1	-169.3	-1.7	111.1	L720 I721 E722 V727 N728 F741	L720-R724 VanDerWaalsContact O-CB 3.31Å; L720-R724 WeakPolarHBondContact O-CB 3.22Å; L720-R724 PolarHBondContact O-N 3.38Å; I721-R724 WeakPolarHBondContact O-CB 3.26Å; I721-R724 PolarHBondContact O-N 3.12Å; E722-R724 PolarHBondContact O-N 3.34Å; R724-V727 PolarHBondContact O-N 2.84Å; R724-N728 VanDerWaalsContact O-CB 3.27Å; R724-N728 WeakPolarHBondContact O-CB 3.34Å; R724-N728 PolarHBondContact O-N 3.34Å; R724-F741 HydrophobicContact CB-CB 4.27Å; R724-F741 HydrophobicContact CB-CD1 3.84Å; R724-F741 HydrophobicContact CB-CD2 4.1Å; R724-F741 HydrophobicContact CB-CE1 4.14Å; R724-F741 HydrophobicContact CB-CE2 4.39Å; R724-F741 HydrophobicContact CB-CG 3.81Å; R724-F741 HydrophobicContact CB-CZ 4.41Å; R724-F741 HydrophobicContact CG-CB 3.94Å; R724-F741 HydrophobicContact CG-CD1 3.79Å; R724-F741 HydrophobicContact CG-CE1 4.46Å; R724-F741 HydrophobicContact CG-CG 3.89Å
725	D	84.8	Confident	82.2	Confident	45 Å²	45	41.5 Å²	41.5	24%	0.241	22%	0.216	C	C	.	.	H	α-helix	trans	-68.7	-40.3	-174.2	-69.4	-17.9	0	0	0	111.8	I721 E722 L723 Q729 Y776	I721-D725 PolarHBondContact O-N 3.13Å; E722-D725 PolarHBondContact O-N 3.45Å; L723-D725 VanDerWaalsContact C-N 3.33Å; L723-D725 PolarHBondContact O-N 2.92Å; D725-Q729 WeakPolarHBondContact O-CB 3.29Å; D725-Q729 PolarHBondContact O-N 2.95Å; D725-Y776 PolarHBondContact OD1-OH 3.47Å
726	R	84.8	Confident	82.3	Confident	85 Å²	85	43.5 Å²	43.5	32%	0.321	23%	0.227	S	C	.	.	H	α-helix	trans	-64.8	-43.2	173.8	-71.8	-172.3	-175.2	-151.9	1.4	112.8	L505 E722 L723 Q729	L505-R726 HydrophobicContact CD1-CB 3.67Å; L505-R726 HydrophobicContact CD1-CG 4.27Å; E722-R726 WeakPolarHBondContact O-CG 3.34Å; E722-R726 PolarHBondContact O-N 3.31Å; E722-R726 IonicContact OE1-CZ 2.76Å; E722-R726 VanDerWaalsContact OE1-CZ 3.28Å; E722-R726 IonicContact OE1-NE 3.11Å; E722-R726 PolarHBondContact OE1-NE 3.26Å; E722-R726 VanDerWaalsContact OE1-NE 3.16Å; E722-R726 IonicContact OE1-NH2 3.27Å; E722-R726 PolarHBondContact OE1-NH2 3.21Å; L723-R726 PolarHBondContact O-N 3.47Å; R726-Q729 PolarHBondContact O-N 3.26Å
727	V	87.4	Confident	82.6	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.006	25%	0.248	C	C	.	.	H	α-helix	trans	-66.3	-44.1	178.6	169.5	0	0	0	0	111.1	L503 F638 L723 R724 Q729 L730 L740 F741 L744	L503-V727 HydrophobicContact CD1-CG2 4.31Å; F638-V727 HydrophobicContact CE2-CG1 4.1Å; L723-V727 HydrophobicContact CD2-CG2 3.66Å; L723-V727 WeakPolarHBondContact O-CB 3.35Å; L723-V727 VanDerWaalsContact O-CG2 3.29Å; L723-V727 WeakPolarHBondContact O-CG2 3.17Å; L723-V727 PolarHBondContact O-N 3.07Å; R724-V727 PolarHBondContact O-N 2.84Å; V727-Q729 VanDerWaalsContact C-N 3.3Å; V727-Q729 PolarHBondContact O-N 3.49Å; V727-L730 PolarHBondContact O-N 2.78Å; V727-L740 HydrophobicContact CG1-CB 3.78Å; V727-F741 HydrophobicContact CG1-CB 4.31Å; V727-L744 HydrophobicContact CG2-CD1 4.36Å
728	N	88.8	Confident	82.7	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-74.3	-18.7	-180	-72.3	-14.5	0	0	0	113.1	R724 L730 S731 D739 L740 F741 Y776	R724-N728 VanDerWaalsContact O-CB 3.27Å; R724-N728 WeakPolarHBondContact O-CB 3.34Å; R724-N728 PolarHBondContact O-N 3.34Å; N728-L730 PolarHBondContact O-N 3.21Å; N728-S731 WeakPolarHBondContact O-CB 2.99Å; N728-S731 PolarHBondContact O-N 3.4Å; N728-S731 VanDerWaalsContact O-N 3.08Å; N728-S731 PolarHBondContact O-OG 2.9Å; N728-D739 PolarHBondContact ND2-OD1 2.99Å; N728-L740 PolarHBondContact OD1-N 3.49Å; N728-F741 PolarHBondContact OD1-N 2.93Å; N728-Y776 HydrophobicContact CB-CE2 4.17Å; N728-Y776 WeakPolarHBondContact CB-OH 3.35Å
729	Q	84.4	Confident	83	Confident	141 Å²	141	47.7 Å²	47.7	66%	0.659	24%	0.241	S	C	*	.	H	α-helix	trans	-64.5	-27.3	171.1	-170.1	173	14	0	0	112.4	D725 R726 V727 S731	D725-Q729 WeakPolarHBondContact O-CB 3.29Å; D725-Q729 PolarHBondContact O-N 2.95Å; R726-Q729 PolarHBondContact O-N 3.26Å; V727-Q729 VanDerWaalsContact C-N 3.3Å; V727-Q729 PolarHBondContact O-N 3.49Å; Q729-S731 PolarHBondContact O-N 3.33Å
730	L	85.6	Confident	83.4	Confident	18 Å²	18	46.9 Å²	46.9	9%	0.094	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	13.9	173.5	-61.6	175.5	0	0	0	113	L505 K636 F638 V727 N728	L505-L730 HydrophobicContact CD2-CD1 3.7Å; K636-L730 HydrophobicContact CD-CD2 4.21Å; K636-L730 HydrophobicContact CG-CD2 3.85Å; F638-L730 HydrophobicContact CD2-CB 4.11Å; F638-L730 HydrophobicContact CD2-CD1 4.16Å; F638-L730 HydrophobicContact CE1-CD1 4.13Å; F638-L730 HydrophobicContact CE2-CB 3.95Å; F638-L730 HydrophobicContact CE2-CD1 3.42Å; F638-L730 VanDerWaalsContact CE2-CD1 3.42Å; F638-L730 HydrophobicContact CE2-CG 4.28Å; F638-L730 HydrophobicContact CZ-CD1 3.42Å; F638-L730 VanDerWaalsContact CZ-CD1 3.42Å; V727-L730 PolarHBondContact O-N 2.78Å; N728-L730 PolarHBondContact O-N 3.21Å
731	S	85.3	Confident	83.5	Confident	17 Å²	17	47 Å²	47	12%	0.119	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-66.3	144.3	173	60.8	0	0	0	0	111.3	N728 Q729 R737	N728-S731 WeakPolarHBondContact O-CB 2.99Å; N728-S731 PolarHBondContact O-N 3.4Å; N728-S731 VanDerWaalsContact O-N 3.08Å; N728-S731 PolarHBondContact O-OG 2.9Å; Q729-S731 PolarHBondContact O-N 3.33Å; S731-R737 WeakPolarHBondContact OG-CB 3.37Å; S731-R737 WeakPolarHBondContact OG-CG 3.43Å
732	P	75.7	Confident	83.7	Confident	9 Å²	9	47 Å²	47	6%	0.058	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-64.9	159.6	-179	29	-38.1	0	0	0	112.2	W601 G734 L738	W601-P732 HydrophobicContact CB-CG 4.32Å; W601-P732 HydrophobicContact CD2-CB 3.46Å; W601-P732 VanDerWaalsContact CD2-CB 3.46Å; W601-P732 HydrophobicContact CD2-CG 3.46Å; W601-P732 VanDerWaalsContact CD2-CG 3.46Å; W601-P732 HydrophobicContact CE3-CB 3.4Å; W601-P732 HydrophobicContact CE3-CG 3.8Å; W601-P732 HydrophobicContact CG-CB 4.21Å; W601-P732 HydrophobicContact CG-CG 3.66Å; W601-P732 HydrophobicContact CH2-CB 3.61Å; W601-P732 HydrophobicContact CZ2-CB 3.64Å; W601-P732 HydrophobicContact CZ2-CG 4.35Å; W601-P732 HydrophobicContact CZ3-CB 3.45Å; W601-P732 VanDerWaalsContact CZ3-CB 3.45Å; W601-P732 HydrophobicContact CZ3-CG 4.36Å; P732-G734 PolarHBondContact O-N 2.79Å; P732-L738 HydrophobicContact CG-CD1 3.44Å; P732-L738 VanDerWaalsContact CG-CD1 3.44Å; P732-L738 HydrophobicContact CG-CG 4.16Å
733	P	69.1	Low	83.9	Confident	46 Å²	46	43.8 Å²	43.8	30%	0.299	22%	0.224	S	C	.	.	S	Bend	trans	-59.9	128.6	178	19.3	-27.8	0	0	0	112.3	F610 W635	F610-P733 HydrophobicContact CD2-CG 3.65Å; F610-P733 HydrophobicContact CE2-CG 3.55Å; W635-P733 HydrophobicContact CE3-CB 3.86Å; W635-P733 HydrophobicContact CE3-CG 3.73Å; W635-P733 HydrophobicContact CH2-CB 4.43Å; W635-P733 HydrophobicContact CZ3-CB 3.56Å; W635-P733 HydrophobicContact CZ3-CG 3.97Å
734	G	70.4	Confident	84.1	Confident	62 Å²	62	43.6 Å²	43.6	64%	0.639	22%	0.223	S	C	*	.	S	Bend	trans	-170.5	170.1	177	0	0	0	0	0	111.3	P732 V736	P732-G734 PolarHBondContact O-N 2.79Å; G734-V736 PolarHBondContact O-N 3.06Å
735	K	70.3	Confident	84.2	Confident	221 Å²	221	42.2 Å²	42.2	96%	0.961	22%	0.217	S	C	*	.	S	Bend	trans	-61.5	-30.2	176.2	-68.1	-176.4	-179.7	179.6	0	112.4
736	V	81.4	Confident	84.4	Confident	66 Å²	66	43.5 Å²	43.5	40%	0.4	22%	0.219	S	C	.	.	S	Bend	trans	-131.3	137	179.7	-172.5	0	0	0	0	107.5	G734 E777	G734-V736 PolarHBondContact O-N 3.06Å; V736-E777 HydrophobicContact CG1-CB 4.4Å; V736-E777 WeakPolarHBondContact CG1-O 3.21Å
737	R	85.2	Confident	84.5	Confident	118 Å²	118	42 Å²	42	45%	0.445	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	139.1	177.2	-72.1	-175.4	-177.5	163.1	-0.1	110.2	S731 Y776 T778 G779	S731-R737 WeakPolarHBondContact OG-CB 3.37Å; S731-R737 WeakPolarHBondContact OG-CG 3.43Å; R737-Y776 HydrophobicContact CB-CD2 4.26Å; R737-Y776 HydrophobicContact CB-CE2 4.39Å; R737-T778 CarbonylContact O-C 3.59Å; R737-T778 WeakPolarHBondContact O-CA 3.27Å; R737-T778 WeakPolarHBondContact O-CB 3.42Å; R737-G779 PolarHBondContact O-N 3.15Å
738	L	87.7	Confident	84.4	Confident	32 Å²	32	43.4 Å²	43.4	17%	0.168	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	142.2	175.8	-60.9	-178.9	0	0	0	111	W601 P732 L740 G779 L781	W601-L738 HydrophobicContact CB-CD1 3.83Å; W601-L738 HydrophobicContact CG-CD1 4.24Å; P732-L738 HydrophobicContact CG-CD1 3.44Å; P732-L738 VanDerWaalsContact CG-CD1 3.44Å; P732-L738 HydrophobicContact CG-CG 4.16Å; L738-L740 VanDerWaalsContact C-N 3.26Å; L738-L740 HydrophobicContact CB-CD2 4.2Å; L738-L740 PolarHBondContact O-N 3Å; L738-G779 WeakPolarHBondContact CA-O 3.31Å; L738-L781 HydrophobicContact CB-CB 4.41Å; L738-L781 HydrophobicContact CD1-CB 4.36Å; L738-L781 HydrophobicContact CD1-CD1 4.15Å; L738-L781 HydrophobicContact CD1-CD2 4.03Å; L738-L781 HydrophobicContact CD1-CG 4.4Å
739	D	88.8	Confident	84.3	Confident	10 Å²	10	43.4 Å²	43.4	5%	0.053	22%	0.221	C	C	.	.			trans	-79.4	73.9	176.5	-170.7	16.6	0	0	0	111.7	N728 F741 S742 Q760 G779	N728-D739 PolarHBondContact ND2-OD1 2.99Å; D739-F741 VanDerWaalsContact C-N 3.29Å; D739-F741 PolarHBondContact O-N 3.13Å; D739-S742 VanDerWaalsContact CG-OG 3.23Å; D739-S742 PolarHBondContact OD1-N 3.39Å; D739-S742 PolarHBondContact OD1-OG 3.23Å; D739-S742 WeakPolarHBondContact OD2-CB 3.3Å; D739-S742 PolarHBondContact OD2-OG 3.26Å; D739-Q760 PolarHBondContact OD2-NE2 3.04Å; D739-G779 PolarHBondContact N-O 3.15Å
740	L	89.7	Confident	84.4	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.6	-31.2	178.4	-65.8	-164.2	0	0	0	112.3	P592 F593 F638 V727 N728 L738 S742 C743 L744 L781	P592-L740 HydrophobicContact CB-CD2 4.31Å; P592-L740 HydrophobicContact CG-CD2 3.81Å; F593-L740 HydrophobicContact CE2-CB 4.17Å; F593-L740 WeakPolarHBondContact CE2-O 3.41Å; F638-L740 HydrophobicContact CD2-CD1 4.09Å; V727-L740 HydrophobicContact CG1-CB 3.78Å; N728-L740 PolarHBondContact OD1-N 3.49Å; L738-L740 VanDerWaalsContact C-N 3.26Å; L738-L740 HydrophobicContact CB-CD2 4.2Å; L738-L740 PolarHBondContact O-N 3Å; L740-S742 PolarHBondContact O-N 3.1Å; L740-C743 WeakPolarHBondContact O-CB 3.36Å; L740-C743 PolarHBondContact O-N 3.04Å; L740-L744 PolarHBondContact O-N 3.08Å; L740-L781 HydrophobicContact CD2-CD2 3.94Å
741	F	90.5	Very high	84.5	Confident	1 Å²	1	45.4 Å²	45.4	0%	0.004	23%	0.227	C	C	.	.	H	α-helix	trans	-61.1	-44.9	178.8	179.3	-109.9	0	0	0	112.2	L720 L723 R724 V727 N728 D739 C743 L744 L745 L763	L720-F741 HydrophobicContact CD2-CZ 4.32Å; L723-F741 HydrophobicContact CB-CE2 4.45Å; L723-F741 HydrophobicContact CD2-CD2 3.77Å; L723-F741 HydrophobicContact CD2-CE2 3.57Å; R724-F741 HydrophobicContact CB-CB 4.27Å; R724-F741 HydrophobicContact CB-CD1 3.84Å; R724-F741 HydrophobicContact CB-CD2 4.1Å; R724-F741 HydrophobicContact CB-CE1 4.14Å; R724-F741 HydrophobicContact CB-CE2 4.39Å; R724-F741 HydrophobicContact CB-CG 3.81Å; R724-F741 HydrophobicContact CB-CZ 4.41Å; R724-F741 HydrophobicContact CG-CB 3.94Å; R724-F741 HydrophobicContact CG-CD1 3.79Å; R724-F741 HydrophobicContact CG-CE1 4.46Å; R724-F741 HydrophobicContact CG-CG 3.89Å; V727-F741 HydrophobicContact CG1-CB 4.31Å; N728-F741 PolarHBondContact OD1-N 2.93Å; D739-F741 VanDerWaalsContact C-N 3.29Å; D739-F741 PolarHBondContact O-N 3.13Å; F741-C743 VanDerWaalsContact C-N 3.33Å; F741-C743 PolarHBondContact O-N 3.21Å; F741-L744 WeakPolarHBondContact O-CB 3.16Å; F741-L744 PolarHBondContact O-N 2.88Å; F741-L744 VanDerWaalsContact O-N 3.16Å; F741-L745 HydrophobicContact CD1-CD1 4.11Å; F741-L745 HydrophobicContact CE1-CD1 3.57Å; F741-L745 HydrophobicContact CE1-CG 4.21Å; F741-L745 HydrophobicContact CE2-CD2 4.39Å; F741-L745 HydrophobicContact CE2-CG 4.4Å; F741-L745 HydrophobicContact CZ-CD1 3.84Å; F741-L745 HydrophobicContact CZ-CD2 4.21Å; F741-L745 HydrophobicContact CZ-CG 4.14Å; F741-L745 WeakPolarHBondContact O-CG 3.34Å; F741-L745 PolarHBondContact O-N 2.87Å; F741-L763 HydrophobicContact CE1-CD1 3.94Å
742	S	89.8	Confident	84.7	Confident	13 Å²	13	46.7 Å²	46.7	9%	0.091	24%	0.239	C	C	.	.	H	α-helix	trans	-64.4	-37.6	175.7	-64	0	0	0	0	113	D739 L740 L744 L745 R746 Q760	D739-S742 VanDerWaalsContact CG-OG 3.23Å; D739-S742 PolarHBondContact OD1-N 3.39Å; D739-S742 PolarHBondContact OD1-OG 3.23Å; D739-S742 WeakPolarHBondContact OD2-CB 3.3Å; D739-S742 PolarHBondContact OD2-OG 3.26Å; L740-S742 PolarHBondContact O-N 3.1Å; S742-L744 VanDerWaalsContact C-N 3.33Å; S742-L745 PolarHBondContact O-N 3.48Å; S742-R746 WeakPolarHBondContact O-CB 3.24Å; S742-R746 PolarHBondContact O-N 2.81Å; S742-Q760 PolarHBondContact OG-NE2 3.36Å
743	C	89.1	Confident	85.2	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-42.7	172.5	-70.5	0	0	0	0	111.5	F593 L740 F741 R746 H747 C782	F593-C743 HydrophobicContact CD2-CB 3.8Å; F593-C743 HydrophobicContact CE2-CB 4.44Å; L740-C743 WeakPolarHBondContact O-CB 3.36Å; L740-C743 PolarHBondContact O-N 3.04Å; F741-C743 VanDerWaalsContact C-N 3.33Å; F741-C743 PolarHBondContact O-N 3.21Å; C743-R746 PolarHBondContact O-N 2.91Å; C743-H747 PolarHBondContact O-CD2 3.34Å; C743-H747 VanDerWaalsContact O-CD2 3.25Å; C743-H747 PolarHBondContact O-N 3.29Å; C743-C782 HydrophobicContact CB-CB 3.98Å; C743-C782 WeakPolarHBondContact CB-SG 3.49Å; C743-C782 WeakPolarHBondContact SG-CB 3.34Å; C743-C782 PolarHBondContact SG-N 2.9Å; C743-C782 VanDerWaalsContact SG-N 3.38Å; C743-C782 CovalentContact SG-SG 2.03Å; C743-C782 PolarHBondContact SG-SG 2.92Å
744	L	89.8	Confident	86.1	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.5	-48.1	176.9	-178.7	149.1	0	0	0	110.7	L503 F593 F692 V727 L740 F741 S742 R746 R748 L749	L503-L744 HydrophobicContact CD1-CD1 4.05Å; F593-L744 HydrophobicContact CD2-CB 4.05Å; F593-L744 HydrophobicContact CE1-CB 4.34Å; F593-L744 HydrophobicContact CE1-CD1 3.87Å; F593-L744 HydrophobicContact CE1-CG 4.36Å; F593-L744 HydrophobicContact CE2-CB 3.81Å; F593-L744 HydrophobicContact CE2-CD1 4.49Å; F593-L744 HydrophobicContact CG-CB 4.42Å; F593-L744 HydrophobicContact CZ-CB 3.97Å; F593-L744 HydrophobicContact CZ-CD1 3.8Å; F593-L744 HydrophobicContact CZ-CG 4.35Å; F692-L744 HydrophobicContact CE2-CD1 4Å; F692-L744 HydrophobicContact CE2-CD2 3.91Å; F692-L744 HydrophobicContact CE2-CG 4.22Å; F692-L744 HydrophobicContact CZ-CD2 3.95Å; F692-L744 HydrophobicContact CZ-CG 4.3Å; V727-L744 HydrophobicContact CG2-CD1 4.36Å; L740-L744 PolarHBondContact O-N 3.08Å; F741-L744 WeakPolarHBondContact O-CB 3.16Å; F741-L744 PolarHBondContact O-N 2.88Å; F741-L744 VanDerWaalsContact O-N 3.16Å; S742-L744 VanDerWaalsContact C-N 3.33Å; L744-R746 VanDerWaalsContact C-N 3.34Å; L744-R746 PolarHBondContact O-N 3.1Å; L744-R748 HydrophobicContact CG-CB 4.47Å; L744-R748 WeakPolarHBondContact O-CA 3.46Å; L744-R748 VanDerWaalsContact O-CB 3.26Å; L744-R748 WeakPolarHBondContact O-CB 3.47Å; L744-R748 PolarHBondContact O-N 3.18Å; L744-L749 HydrophobicContact CD2-CD1 3.78Å; L744-L749 PolarHBondContact O-N 3.07Å
745	L	89.6	Confident	86.9	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-43.5	176.5	-69	-176.1	0	0	0	112.5	I697 I701 F741 S742 L749 K750 L751 V756 I759	I697-L745 HydrophobicContact CG2-CD2 4.42Å; I701-L745 HydrophobicContact CD1-CD2 4.1Å; F741-L745 HydrophobicContact CD1-CD1 4.11Å; F741-L745 HydrophobicContact CE1-CD1 3.57Å; F741-L745 HydrophobicContact CE1-CG 4.21Å; F741-L745 HydrophobicContact CE2-CD2 4.39Å; F741-L745 HydrophobicContact CE2-CG 4.4Å; F741-L745 HydrophobicContact CZ-CD1 3.84Å; F741-L745 HydrophobicContact CZ-CD2 4.21Å; F741-L745 HydrophobicContact CZ-CG 4.14Å; F741-L745 WeakPolarHBondContact O-CG 3.34Å; F741-L745 PolarHBondContact O-N 2.87Å; S742-L745 PolarHBondContact O-N 3.48Å; L745-L749 HydrophobicContact CD2-CD1 4.16Å; L745-L749 HydrophobicContact CD2-CD2 3.99Å; L745-L749 VanDerWaalsContact O-CB 3.31Å; L745-L749 WeakPolarHBondContact O-CB 3.1Å; L745-L749 PolarHBondContact O-N 3.32Å; L745-K750 PolarHBondContact O-N 3.03Å; L745-L751 HydrophobicContact CB-CD1 4.21Å; L745-L751 HydrophobicContact CD2-CD1 4.23Å; L745-L751 PolarHBondContact O-N 3.1Å; L745-V756 HydrophobicContact CB-CG2 3.99Å; L745-V756 HydrophobicContact CD1-CG1 4.39Å; L745-I759 HydrophobicContact CD1-CD1 4.35Å; L745-I759 HydrophobicContact CD1-CG2 4.37Å
746	R	88.4	Confident	87.8	Confident	73 Å²	73	44 Å²	44	28%	0.275	22%	0.215	S	C	.	.	H	α-helix	trans	-70	-49.4	-179	-177.3	175.7	170.6	79.6	-13	112.7	S742 C743 L744 K750 N753 S783	S742-R746 WeakPolarHBondContact O-CB 3.24Å; S742-R746 PolarHBondContact O-N 2.81Å; C743-R746 PolarHBondContact O-N 2.91Å; L744-R746 VanDerWaalsContact C-N 3.34Å; L744-R746 PolarHBondContact O-N 3.1Å; R746-K750 WeakPolarHBondContact O-CA 3.27Å; R746-K750 PolarHBondContact O-N 3Å; R746-N753 PolarHBondContact NH1-ND2 2.74Å; R746-N753 VanDerWaalsContact NH1-ND2 3.17Å; R746-N753 PolarHBondContact NH1-OD1 2.88Å; R746-S783 PolarHBondContact NE-O 3.33Å; R746-S783 PolarHBondContact NH2-O 3.19Å
747	H	87	Confident	88	Confident	52 Å²	52	42.4 Å²	42.4	24%	0.241	21%	0.213	C	C	.	.	H	α-helix	trans	-91.4	-36.1	-171.2	-63.9	-74.5	0	0	0	113.8	F593 E599 C743	F593-H747 HydrophobicContact CB-CB 4.11Å; F593-H747 WeakPolarHBondContact O-CB 3.38Å; E599-H747 IonicContact OE1-CE1 3.12Å; E599-H747 IonicContact OE1-NE2 2.72Å; E599-H747 IonicContact OE2-CE1 3.77Å; E599-H747 PolarHBondContact OE2-CE1 3.2Å; E599-H747 IonicContact OE2-NE2 3.15Å; E599-H747 PolarHBondContact OE2-NE2 3.16Å; C743-H747 PolarHBondContact O-CD2 3.34Å; C743-H747 VanDerWaalsContact O-CD2 3.25Å; C743-H747 PolarHBondContact O-N 3.29Å
748	R	85.6	Confident	88.2	Confident	31 Å²	31	41.8 Å²	41.8	12%	0.117	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-46.1	179.7	-69.1	-64	-165.5	-138.8	-8.7	112.6	N557 F593 E640 F692 L744 K750	N557-R748 PolarHBondContact ND2-NH1 3.25Å; N557-R748 PolarHBondContact ND2-NH2 3.29Å; F593-R748 HydrophobicContact CB-CG 4.48Å; F593-R748 HydrophobicContact CD1-CG 4.17Å; E640-R748 VanDerWaalsContact CD-NH1 3.27Å; E640-R748 IonicContact OE1-CZ 2.87Å; E640-R748 IonicContact OE1-NH1 2.75Å; E640-R748 PolarHBondContact OE1-NH1 2.85Å; E640-R748 IonicContact OE1-NH2 3.97Å; E640-R748 IonicContact OE2-CZ 3.9Å; E640-R748 IonicContact OE2-NE 3.05Å; E640-R748 IonicContact OE2-NH1 2.7Å; E640-R748 PolarHBondContact OE2-NH1 2.88Å; E640-R748 IonicContact OE2-NH2 3.36Å; E640-R748 PolarHBondContact OE2-NH2 2.82Å; F692-R748 HydrophobicContact CE1-CB 3.67Å; F692-R748 HydrophobicContact CE1-CG 4.2Å; F692-R748 HydrophobicContact CZ-CB 3.88Å; L744-R748 HydrophobicContact CG-CB 4.47Å; L744-R748 WeakPolarHBondContact O-CA 3.46Å; L744-R748 VanDerWaalsContact O-CB 3.26Å; L744-R748 WeakPolarHBondContact O-CB 3.47Å; L744-R748 PolarHBondContact O-N 3.18Å; R748-K750 VanDerWaalsContact C-N 3.35Å
749	L	87	Confident	88.3	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.01	20%	0.203	C	C	.	.	S	Bend	trans	-82.9	-14.4	177.3	-77.5	79.9	0	0	0	113.2	F692 I697 R698 I701 L744 L745 L751	F692-L749 HydrophobicContact CE1-CD1 4.47Å; F692-L749 HydrophobicContact CZ-CD1 3.71Å; I697-L749 HydrophobicContact CB-CD2 3.96Å; I697-L749 HydrophobicContact CG2-CD1 4.37Å; I697-L749 HydrophobicContact CG2-CD2 3.58Å; R698-L749 HydrophobicContact CG-CD2 3.93Å; R698-L749 HydrophobicContact CG-CG 4.46Å; R698-L749 PolarHBondContact NH2-O 2.97Å; I701-L749 HydrophobicContact CD1-CD2 3.78Å; L744-L749 HydrophobicContact CD2-CD1 3.78Å; L744-L749 PolarHBondContact O-N 3.07Å; L745-L749 HydrophobicContact CD2-CD1 4.16Å; L745-L749 HydrophobicContact CD2-CD2 3.99Å; L745-L749 VanDerWaalsContact O-CB 3.31Å; L745-L749 WeakPolarHBondContact O-CB 3.1Å; L745-L749 PolarHBondContact O-N 3.32Å; L749-L751 VanDerWaalsContact C-N 3.31Å; L749-L751 HydrophobicContact CB-CD1 4.29Å; L749-L751 HydrophobicContact CB-CG 3.89Å; L749-L751 HydrophobicContact CD2-CD1 4.35Å
750	K	86.9	Confident	88.2	Confident	173 Å²	173	41.7 Å²	41.7	75%	0.752	21%	0.209	S	C	*	.			trans	63.1	32.7	-177.3	-56.6	-178.5	-180	176.6	0	113.5	L745 R746 R748	L745-K750 PolarHBondContact O-N 3.03Å; R746-K750 WeakPolarHBondContact O-CA 3.27Å; R746-K750 PolarHBondContact O-N 3Å; R748-K750 VanDerWaalsContact C-N 3.35Å
751	L	87.8	Confident	88.1	Confident	27 Å²	27	44.9 Å²	44.9	14%	0.141	23%	0.231	C	C	.	.			trans	-75.6	149.2	177.7	-60.6	-178.3	0	0	0	111.9	I701 L745 L749 E755 V756 I759	I701-L751 HydrophobicContact CD1-CD1 3.74Å; L745-L751 HydrophobicContact CB-CD1 4.21Å; L745-L751 HydrophobicContact CD2-CD1 4.23Å; L745-L751 PolarHBondContact O-N 3.1Å; L749-L751 VanDerWaalsContact C-N 3.31Å; L749-L751 HydrophobicContact CB-CD1 4.29Å; L749-L751 HydrophobicContact CB-CG 3.89Å; L749-L751 HydrophobicContact CD2-CD1 4.35Å; L751-E755 HydrophobicContact CB-CB 4.47Å; L751-V756 HydrophobicContact CB-CG2 3.9Å; L751-I759 HydrophobicContact CD1-CD1 3.92Å
752	A	88.1	Confident	88	Confident	44 Å²	44	47 Å²	47	36%	0.364	25%	0.246	S	C	.	.			trans	-77.8	157.1	176.7	0	0	0	0	0	111.6	N754 E755 V756	A752-N754 VanDerWaalsContact C-N 3.27Å; A752-N754 WeakPolarHBondContact CB-OD1 3.15Å; A752-N754 PolarHBondContact O-N 3.15Å; A752-E755 HydrophobicContact CB-CG 4.41Å; A752-E755 PolarHBondContact N-OE2 3.08Å; A752-E755 WeakPolarHBondContact O-CB 3.35Å; A752-E755 PolarHBondContact O-N 3.15Å; A752-V756 PolarHBondContact O-N 3.5Å
753	N	86.6	Confident	87.8	Confident	75 Å²	75	46.4 Å²	46.4	40%	0.401	24%	0.242	S	C	.	.	H	α-helix	trans	-60.7	-34.3	-175.4	-86.8	-13.2	0	0	0	114.1	R746 G757 S783	R746-N753 PolarHBondContact NH1-ND2 2.74Å; R746-N753 VanDerWaalsContact NH1-ND2 3.17Å; R746-N753 PolarHBondContact NH1-OD1 2.88Å; N753-G757 PolarHBondContact O-N 3.28Å; N753-S783 PolarHBondContact ND2-OXT 2.9Å; N753-S783 PolarHBondContact OD1-OXT 3Å
754	N	88	Confident	87.7	Confident	120 Å²	120	52.6 Å²	52.6	64%	0.642	27%	0.265	S	S	*	.	H	α-helix	trans	-65.2	-40.9	174.3	58	-26.2	0	0	0	111.9	A752 G757 R758	A752-N754 VanDerWaalsContact C-N 3.27Å; A752-N754 WeakPolarHBondContact CB-OD1 3.15Å; A752-N754 PolarHBondContact O-N 3.15Å; N754-G757 PolarHBondContact O-N 2.98Å; N754-R758 WeakPolarHBondContact O-CB 3.48Å; N754-R758 PolarHBondContact O-N 2.82Å
755	E	88.1	Confident	87.4	Confident	77 Å²	77	55.3 Å²	55.3	36%	0.36	29%	0.287	S	S	.	.	H	α-helix	trans	-67.5	-44.9	178.2	-63.7	176.2	143.7	0	0	111.3	L751 A752 G757 R758 I759	L751-E755 HydrophobicContact CB-CB 4.47Å; A752-E755 HydrophobicContact CB-CG 4.41Å; A752-E755 PolarHBondContact N-OE2 3.08Å; A752-E755 WeakPolarHBondContact O-CB 3.35Å; A752-E755 PolarHBondContact O-N 3.15Å; E755-G757 VanDerWaalsContact C-N 3.35Å; E755-G757 PolarHBondContact O-N 3.1Å; E755-R758 WeakPolarHBondContact O-CB 3.31Å; E755-R758 PolarHBondContact O-N 3.38Å; E755-I759 WeakPolarHBondContact O-CG1 3.41Å; E755-I759 PolarHBondContact O-N 2.87Å
756	V	88.6	Confident	87.1	Confident	9 Å²	9	56.3 Å²	56.3	6%	0.055	29%	0.292	C	S	.	.	H	α-helix	trans	-60.5	-46.2	175.5	178.3	0	0	0	0	110.4	L745 L751 A752 R758 I759 Q760	L745-V756 HydrophobicContact CB-CG2 3.99Å; L745-V756 HydrophobicContact CD1-CG1 4.39Å; L751-V756 HydrophobicContact CB-CG2 3.9Å; A752-V756 PolarHBondContact O-N 3.5Å; V756-R758 VanDerWaalsContact C-N 3.32Å; V756-R758 PolarHBondContact O-N 2.83Å; V756-I759 PolarHBondContact O-N 3.01Å; V756-Q760 WeakPolarHBondContact O-CG 3.46Å; V756-Q760 PolarHBondContact O-N 3.46Å
757	G	86.5	Confident	86.8	Confident	34 Å²	34	53.2 Å²	53.2	35%	0.351	28%	0.281	S	S	.	.	H	α-helix	trans	-60.3	-39.6	176.3	0	0	0	0	0	113.2	N753 N754 E755 Q760 S761	N753-G757 PolarHBondContact O-N 3.28Å; N754-G757 PolarHBondContact O-N 2.98Å; E755-G757 VanDerWaalsContact C-N 3.35Å; E755-G757 PolarHBondContact O-N 3.1Å; G757-Q760 PolarHBondContact O-N 3.44Å; G757-S761 PolarHBondContact O-N 3.5Å
758	R	89.4	Confident	86.5	Confident	104 Å²	104	54.7 Å²	54.7	39%	0.392	30%	0.297	S	S	.	.	H	α-helix	trans	-61.3	-50.7	174	-176.8	-176.7	69.5	150.1	5.9	111.1	D705 N754 E755 V756 Q760 S761 S762	D705-R758 VanDerWaalsContact CG-NH2 3.35Å; D705-R758 IonicContact OD1-CZ 3.31Å; D705-R758 IonicContact OD1-NH1 3.65Å; D705-R758 PolarHBondContact OD1-NH1 3.16Å; D705-R758 IonicContact OD1-NH2 3.31Å; D705-R758 PolarHBondContact OD1-NH2 3.38Å; D705-R758 VanDerWaalsContact OD1-NH2 3.08Å; D705-R758 IonicContact OD2-CZ 2.65Å; D705-R758 IonicContact OD2-NH1 3.49Å; D705-R758 IonicContact OD2-NH2 2.61Å; D705-R758 PolarHBondContact OD2-NH2 2.84Å; N754-R758 WeakPolarHBondContact O-CB 3.48Å; N754-R758 PolarHBondContact O-N 2.82Å; E755-R758 WeakPolarHBondContact O-CB 3.31Å; E755-R758 PolarHBondContact O-N 3.38Å; V756-R758 VanDerWaalsContact C-N 3.32Å; V756-R758 PolarHBondContact O-N 2.83Å; R758-Q760 VanDerWaalsContact C-N 3.34Å; R758-Q760 PolarHBondContact O-N 3.02Å; R758-S761 PolarHBondContact O-N 3.34Å; R758-S761 VanDerWaalsContact O-N 3.13Å; R758-S761 PolarHBondContact O-OG 3.37Å; R758-S762 PolarHBondContact O-N 3.32Å; R758-S762 PolarHBondContact O-OG 3.3Å
759	I	88.8	Confident	86.2	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-58.4	-46.9	178.9	-66.1	163.3	0	0	0	110.3	I701 L745 L751 E755 V756 S761 S762 L763	I701-I759 HydrophobicContact CD1-CD1 3.88Å; I701-I759 HydrophobicContact CG1-CD1 4.13Å; I701-I759 HydrophobicContact CG2-CD1 3.92Å; I701-I759 HydrophobicContact CG2-CG1 4.49Å; L745-I759 HydrophobicContact CD1-CD1 4.35Å; L745-I759 HydrophobicContact CD1-CG2 4.37Å; L751-I759 HydrophobicContact CD1-CD1 3.92Å; E755-I759 WeakPolarHBondContact O-CG1 3.41Å; E755-I759 PolarHBondContact O-N 2.87Å; V756-I759 PolarHBondContact O-N 3.01Å; I759-S761 VanDerWaalsContact C-N 3.31Å; I759-S761 PolarHBondContact O-N 3Å; I759-S762 PolarHBondContact O-N 3.25Å; I759-L763 HydrophobicContact CG2-CD1 3.92Å; I759-L763 HydrophobicContact CG2-CG 4.3Å; I759-L763 VanDerWaalsContact O-CG 3.31Å; I759-L763 WeakPolarHBondContact O-CG 3.46Å; I759-L763 PolarHBondContact O-N 2.87Å
760	Q	87.4	Confident	85.7	Confident	39 Å²	39	63.7 Å²	63.7	18%	0.182	34%	0.339	C	S	.	.	H	α-helix	trans	-58	-42.3	176.5	-72.2	-167.2	-42.8	0	0	112.8	D739 S742 V756 G757 R758 L763 R764	D739-Q760 PolarHBondContact OD2-NE2 3.04Å; S742-Q760 PolarHBondContact OG-NE2 3.36Å; V756-Q760 WeakPolarHBondContact O-CG 3.46Å; V756-Q760 PolarHBondContact O-N 3.46Å; G757-Q760 PolarHBondContact O-N 3.44Å; R758-Q760 VanDerWaalsContact C-N 3.34Å; R758-Q760 PolarHBondContact O-N 3.02Å; Q760-L763 PolarHBondContact O-N 3.5Å; Q760-R764 WeakPolarHBondContact O-CG 3.31Å; Q760-R764 PolarHBondContact O-N 2.81Å
761	S	87.3	Confident	84	Confident	67 Å²	67	61.4 Å²	61.4	47%	0.469	34%	0.342	S	S	.	.	H	α-helix	trans	-64.5	-41.3	178.2	72.2	0	0	0	0	112.2	G757 R758 I759 R764 A765	G757-S761 PolarHBondContact O-N 3.5Å; R758-S761 PolarHBondContact O-N 3.34Å; R758-S761 VanDerWaalsContact O-N 3.13Å; R758-S761 PolarHBondContact O-OG 3.37Å; I759-S761 VanDerWaalsContact C-N 3.31Å; I759-S761 PolarHBondContact O-N 3Å; S761-R764 PolarHBondContact O-N 3.27Å; S761-A765 WeakPolarHBondContact O-CB 3.47Å; S761-A765 PolarHBondContact O-N 2.91Å
762	S	87.4	Confident	82.4	Confident	45 Å²	45	67.1 Å²	67.1	32%	0.315	37%	0.373	S	S	.	.	H	α-helix	trans	-63.9	-42.9	175.5	-60.3	0	0	0	0	111.9	R758 I759 A765 F766	R758-S762 PolarHBondContact O-N 3.32Å; R758-S762 PolarHBondContact O-OG 3.3Å; I759-S762 PolarHBondContact O-N 3.25Å; S762-A765 PolarHBondContact O-N 3.45Å; S762-F766 WeakPolarHBondContact O-CB 3.49Å; S762-F766 PolarHBondContact O-N 3.3Å
763	L	87.2	Confident	81.2	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.005	38%	0.377	C	S	.	.	H	α-helix	trans	-64.6	-41.3	177.4	-65.8	172.9	0	0	0	111.9	L717 L720 I721 F741 I759 Q760 F766 N767	L717-L763 HydrophobicContact CD2-CD2 3.91Å; L720-L763 HydrophobicContact CB-CD1 4.39Å; L720-L763 HydrophobicContact CB-CD2 3.54Å; L720-L763 HydrophobicContact CD1-CD2 4.45Å; I721-L763 HydrophobicContact CG1-CB 4.38Å; I721-L763 HydrophobicContact CG1-CD2 3.77Å; F741-L763 HydrophobicContact CE1-CD1 3.94Å; I759-L763 HydrophobicContact CG2-CD1 3.92Å; I759-L763 HydrophobicContact CG2-CG 4.3Å; I759-L763 VanDerWaalsContact O-CG 3.31Å; I759-L763 WeakPolarHBondContact O-CG 3.46Å; I759-L763 PolarHBondContact O-N 2.87Å; Q760-L763 PolarHBondContact O-N 3.5Å; L763-F766 PolarHBondContact O-N 3.06Å; L763-N767 VanDerWaalsContact O-CB 3.24Å; L763-N767 WeakPolarHBondContact O-CB 3.5Å; L763-N767 PolarHBondContact O-N 2.9Å
764	R	85.2	Confident	79.9	Confident	130 Å²	130	69.9 Å²	69.9	49%	0.491	39%	0.389	S	S	.	.	H	α-helix	trans	-64.3	-45.9	175.2	-73	-177	-171.3	158	3.5	111.9	Q760 S761 F766 N767 S768	Q760-R764 WeakPolarHBondContact O-CG 3.31Å; Q760-R764 PolarHBondContact O-N 2.81Å; S761-R764 PolarHBondContact O-N 3.27Å; R764-F766 VanDerWaalsContact C-N 3.3Å; R764-F766 PolarHBondContact O-N 3.46Å; R764-N767 PolarHBondContact O-N 2.67Å; R764-S768 PolarHBondContact O-N 3.3Å; R764-S768 VanDerWaalsContact O-N 3.09Å
765	A	84.9	Confident	78.9	Confident	56 Å²	56	69.9 Å²	69.9	46%	0.463	39%	0.385	S	S	.	.	H	α-helix	trans	-60.4	-41.1	178.3	0	0	0	0	0	111.8	S761 S762 S768	S761-A765 WeakPolarHBondContact O-CB 3.47Å; S761-A765 PolarHBondContact O-N 2.91Å; S762-A765 PolarHBondContact O-N 3.45Å; A765-S768 PolarHBondContact O-OG 2.96Å
766	F	83.4	Confident	78	Confident	21 Å²	21	68.6 Å²	68.6	9%	0.092	38%	0.377	C	S	.	.	H	α-helix	trans	-71.5	-44.1	176.9	-175.4	-96.1	0	0	0	112.7	D714 L717 L718 I721 S762 L763 R764 S768 K769 L770	D714-F766 HydrophobicContact CB-CE2 3.8Å; D714-F766 HydrophobicContact CB-CZ 4.09Å; D714-F766 WeakPolarHBondContact OD1-CE2 3.36Å; L717-F766 HydrophobicContact CB-CB 4.39Å; L717-F766 HydrophobicContact CB-CD1 3.86Å; L717-F766 HydrophobicContact CB-CD2 4.16Å; L717-F766 HydrophobicContact CB-CE1 4.14Å; L717-F766 HydrophobicContact CB-CE2 4.42Å; L717-F766 HydrophobicContact CB-CG 3.86Å; L717-F766 HydrophobicContact CB-CZ 4.41Å; L717-F766 HydrophobicContact CD1-CB 4.01Å; L717-F766 HydrophobicContact CD1-CD2 3.69Å; L717-F766 HydrophobicContact CD1-CE2 4.37Å; L717-F766 HydrophobicContact CD1-CG 3.89Å; L717-F766 HydrophobicContact CG-CG 4.41Å; L718-F766 HydrophobicContact CD1-CZ 4.41Å; L718-F766 HydrophobicContact CD2-CE1 3.66Å; L718-F766 HydrophobicContact CD2-CZ 4.16Å; L718-F766 HydrophobicContact CG-CE1 3.64Å; L718-F766 HydrophobicContact CG-CZ 3.82Å; I721-F766 HydrophobicContact CD1-CD1 3.65Å; I721-F766 HydrophobicContact CD1-CE1 4.3Å; S762-F766 WeakPolarHBondContact O-CB 3.49Å; S762-F766 PolarHBondContact O-N 3.3Å; L763-F766 PolarHBondContact O-N 3.06Å; R764-F766 VanDerWaalsContact C-N 3.3Å; R764-F766 PolarHBondContact O-N 3.46Å; F766-S768 PolarHBondContact O-N 3.43Å; F766-K769 WeakPolarHBondContact O-CB 3.47Å; F766-K769 PolarHBondContact O-N 3.37Å; F766-L770 HydrophobicContact CD1-CD1 4.32Å; F766-L770 HydrophobicContact CE1-CD1 4.05Å; F766-L770 HydrophobicContact CE1-CD2 4.07Å; F766-L770 HydrophobicContact CE1-CG 4.25Å; F766-L770 HydrophobicContact CZ-CD2 4.3Å
767	N	81.5	Confident	77.4	Confident	8 Å²	8	76.3 Å²	76.3	4%	0.043	41%	0.413	C	S	.	.	H	α-helix	trans	-57.5	-38	178.5	-164.5	34.5	0	0	0	112	I721 L763 R764 K769 L770	I721-N767 HydrophobicContact CD1-CB 3.93Å; L763-N767 VanDerWaalsContact O-CB 3.24Å; L763-N767 WeakPolarHBondContact O-CB 3.5Å; L763-N767 PolarHBondContact O-N 2.9Å; R764-N767 PolarHBondContact O-N 2.67Å; N767-K769 PolarHBondContact O-N 3.35Å; N767-K769 VanDerWaalsContact O-N 3.13Å; N767-L770 PolarHBondContact O-N 3.29Å; N767-L770 VanDerWaalsContact O-N 3.08Å
768	S	81	Confident	77.2	Confident	83 Å²	83	76.7 Å²	76.7	58%	0.58	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-18.3	177.1	74.6	0	0	0	0	114.8	R764 A765 F766	R764-S768 PolarHBondContact O-N 3.3Å; R764-S768 VanDerWaalsContact O-N 3.09Å; A765-S768 PolarHBondContact O-OG 2.96Å; F766-S768 PolarHBondContact O-N 3.43Å
769	K	79.4	Confident	76.9	Confident	169 Å²	169	72.7 Å²	72.7	74%	0.735	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-9.9	178.1	-61.8	178	-179	178.3	0	113.2	F766 N767	F766-K769 WeakPolarHBondContact O-CB 3.47Å; F766-K769 PolarHBondContact O-N 3.37Å; N767-K769 PolarHBondContact O-N 3.35Å; N767-K769 VanDerWaalsContact O-N 3.13Å
770	L	76.4	Confident	76.6	Confident	53 Å²	53	81.3 Å²	81.3	28%	0.277	44%	0.437	S	S	.	.	S	Bend	trans	-82.7	148	-177.3	-65.6	174.2	0	0	0	111.6	L718 I721 F766 N767 N772 P773	L718-L770 HydrophobicContact CD2-CD1 4.11Å; L718-L770 HydrophobicContact CD2-CD2 4.21Å; I721-L770 HydrophobicContact CD1-CD1 4.33Å; F766-L770 HydrophobicContact CD1-CD1 4.32Å; F766-L770 HydrophobicContact CE1-CD1 4.05Å; F766-L770 HydrophobicContact CE1-CD2 4.07Å; F766-L770 HydrophobicContact CE1-CG 4.25Å; F766-L770 HydrophobicContact CZ-CD2 4.3Å; N767-L770 PolarHBondContact O-N 3.29Å; N767-L770 VanDerWaalsContact O-N 3.08Å; L770-N772 PolarHBondContact O-N 3.19Å; L770-P773 WeakPolarHBondContact O-CD 3.2Å
771	P	50.4	Low	76.4	Confident	126 Å²	126	80.6 Å²	80.6	82%	0.818	43%	0.434	S	S	*	.	S	Bend	trans	-71.3	10.1	-171.6	24.7	-32	0	0	0	116.7
772	N	54.3	Low	76	Confident	146 Å²	146	78.2 Å²	78.2	78%	0.781	42%	0.417	S	S	*	.	S	Bend	trans	-167	80.6	168.6	-92.4	-36	0	0	0	108.9	L770 V774	L770-N772 PolarHBondContact O-N 3.19Å; N772-V774 PolarHBondContact O-N 2.99Å; N772-V774 VanDerWaalsContact O-N 3.07Å
773	P	62.8	Low	74.9	Confident	70 Å²	70	81.1 Å²	81.1	46%	0.455	44%	0.438	S	S	.	.			trans	-70.6	109.1	-178.1	27.6	-31.3	0	0	0	109.8	L770 E775	L770-P773 WeakPolarHBondContact O-CD 3.2Å; P773-E775 PolarHBondContact O-N 3.48Å
774	V	60.1	Low	74.3	Confident	108 Å²	108	85.2 Å²	85.2	66%	0.655	46%	0.46	S	S	*	.			trans	-83.5	92.5	167.2	-175	0	0	0	0	106.9	N772	N772-V774 PolarHBondContact O-N 2.99Å; N772-V774 VanDerWaalsContact O-N 3.07Å
775	E	65.8	Low	73.7	Confident	119 Å²	119	82.8 Å²	82.8	56%	0.556	46%	0.458	S	S	*	.			trans	-105.8	123.3	175	-153.9	165.7	-158.8	0	0	109.3	P773	P773-E775 PolarHBondContact O-N 3.48Å
776	Y	69.9	Low	73.1	Confident	50 Å²	50	84.3 Å²	84.3	20%	0.196	46%	0.458	C	S	.	.			trans	-117.4	137.6	173.5	52.4	-85	0	0	0	108.4	D725 N728 R737 T778	D725-Y776 PolarHBondContact OD1-OH 3.47Å; N728-Y776 HydrophobicContact CB-CE2 4.17Å; N728-Y776 WeakPolarHBondContact CB-OH 3.35Å; R737-Y776 HydrophobicContact CB-CD2 4.26Å; R737-Y776 HydrophobicContact CB-CE2 4.39Å; Y776-T778 HydrophobicContact CD2-CG2 3.59Å; Y776-T778 HydrophobicContact CE2-CG2 3.4Å; Y776-T778 PolarHBondContact O-N 3.36Å
777	E	75.9	Confident	72.5	Confident	172 Å²	172	88 Å²	88	80%	0.804	48%	0.479	S	S	*	.			trans	-64.6	133.3	173.4	-70	-172.3	166.2	0	0	109.6	V736	V736-E777 HydrophobicContact CG1-CB 4.4Å; V736-E777 WeakPolarHBondContact CG1-O 3.21Å
778	T	82	Confident	71.9	Confident	41 Å²	41	93 Å²	93	25%	0.252	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	137.9	175.3	56.3	0	0	0	0	111.5	R737 Y776	R737-T778 CarbonylContact O-C 3.59Å; R737-T778 WeakPolarHBondContact O-CA 3.27Å; R737-T778 WeakPolarHBondContact O-CB 3.42Å; Y776-T778 HydrophobicContact CD2-CG2 3.59Å; Y776-T778 HydrophobicContact CE2-CG2 3.4Å; Y776-T778 PolarHBondContact O-N 3.36Å
779	G	83.3	Confident	71.3	Confident	21 Å²	21	93.7 Å²	93.7	22%	0.216	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	138.4	172.2	0	0	0	0	0	110.8	R737 L738 D739 L781	R737-G779 PolarHBondContact O-N 3.15Å; L738-G779 WeakPolarHBondContact CA-O 3.31Å; D739-G779 PolarHBondContact N-O 3.15Å; G779-L781 PolarHBondContact O-N 2.95Å
780	K	82.4	Confident	70.7	Confident	183 Å²	183	88.3 Å²	88.3	80%	0.796	49%	0.485	S	S	*	.			trans	-74.5	123.1	175.8	-65.7	-173.5	178.7	-174.7	0	110.3
781	L	82.9	Confident	70.3	Confident	24 Å²	24	91 Å²	91	13%	0.126	50%	0.501	C	S	.	.			trans	-100.1	-44.7	171.3	-179.7	64.3	0	0	0	111.7	P592 W601 L738 L740 G779	P592-L781 HydrophobicContact CG-CD2 3.89Å; W601-L781 HydrophobicContact CB-CD1 4.26Å; L738-L781 HydrophobicContact CB-CB 4.41Å; L738-L781 HydrophobicContact CD1-CB 4.36Å; L738-L781 HydrophobicContact CD1-CD1 4.15Å; L738-L781 HydrophobicContact CD1-CD2 4.03Å; L738-L781 HydrophobicContact CD1-CG 4.4Å; L740-L781 HydrophobicContact CD2-CD2 3.94Å; G779-L781 PolarHBondContact O-N 2.95Å
782	C	80.2	Confident	71.9	Confident	16 Å²	16	88.1 Å²	88.1	11%	0.108	47%	0.474	C	S	.	.			trans	-103.3	138.7	176.2	-48.2	0	0	0	0	109.8	C743	C743-C782 HydrophobicContact CB-CB 3.98Å; C743-C782 WeakPolarHBondContact CB-SG 3.49Å; C743-C782 WeakPolarHBondContact SG-CB 3.34Å; C743-C782 PolarHBondContact SG-N 2.9Å; C743-C782 VanDerWaalsContact SG-N 3.38Å; C743-C782 CovalentContact SG-SG 2.03Å; C743-C782 PolarHBondContact SG-SG 2.92Å
783	S	63.4	Low	73.5	Confident	107 Å²	107	82.8 Å²	82.8	75%	0.748	45%	0.446	S	S	*	.			trans	-116.8	0	-175.1	61.1	0	0	0	0	112.4	R746 N753	R746-S783 PolarHBondContact NE-O 3.33Å; R746-S783 PolarHBondContact NH2-O 3.19Å; N753-S783 PolarHBondContact ND2-OXT 2.9Å; N753-S783 PolarHBondContact OD1-OXT 3Å

Retrieved 783 of 783 residues in 334.3 ms (Link to these results)

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