G7NEK4_MACMU Loading...

Actin-like protein 7A

Essential for normal spermatogenesis and male fertility. Required for normal sperm head morphology, acroplaxome formation, acrosome attachment, and acrosome granule stability. May anchor and stabilize acrosomal adherence to the acroplaxome at least in part by facilitating the presence of F-actin in the subacrosomal space. May play an important role in formation and fusion of Golgi-derived vesicles during acrosome biogenesis.

AlphaFold DB , UniProt , Accession G7NEK4, Species MACMU (Macaca mulatta, Rhesus macaque), Gene ACTL7A, Length 435 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.1	Very low	33.8	Very low	235 Å²	235	144.8 Å²	144.8	100%	1.158	85%	0.854	S	S	*	*				0	111.2	0	-134.5	179.7	-77.9	0	0	106.7
2	W	30.6	Very low	33.2	Very low	246 Å²	246	138.8 Å²	138.8	93%	0.932	85%	0.846	S	S	*	*			trans	43.4	102.4	172	-90.8	-64.3	0	0	0	121.7
3	A	33.9	Very low	33.4	Very low	88 Å²	88	138.1 Å²	138.1	73%	0.727	85%	0.845	S	S	*	*				-88.7	165.7	126.8	0	0	0	0	0	107.7
4	P	52.4	Low	33.3	Very low	111 Å²	111	135.4 Å²	135.4	72%	0.721	84%	0.844	S	S	*	*			cis	-151.4	-153.1	39.6	41.7	-15.9	0	0	0	111.7
5	P	42	Very low	33.2	Very low	122 Å²	122	140.3 Å²	140.3	79%	0.792	85%	0.848	S	S	*	*			cis	-139.5	171.7	2.4	36.7	-13.7	0	0	0	119.1
6	A	33.3	Very low	33.1	Very low	93 Å²	93	144.6 Å²	144.6	77%	0.769	85%	0.852	S	S	*	*			trans	-76.7	165.2	171.7	0	0	0	0	0	113.8
7	A	29.8	Very low	32.9	Very low	105 Å²	105	144.8 Å²	144.8	87%	0.868	86%	0.855	S	S	*	*			trans	-132.8	125.7	156.2	0	0	0	0	0	110
8	I	29.7	Very low	32.6	Very low	153 Å²	153	140.3 Å²	140.3	79%	0.785	84%	0.844	S	S	*	*			trans	-122.9	147.4	170.4	-64.2	173.8	0	0	0	107
9	M	30	Very low	32.4	Very low	188 Å²	188	141.6 Å²	141.6	93%	0.926	85%	0.846	S	S	*	*			trans	127.7	133.8	153.2	-71.2	-167.5	-124.8	0	0	112.1
10	G	26.9	Very low	32.3	Very low	75 Å²	75	144.7 Å²	144.7	77%	0.773	85%	0.851	S	S	*	*			cis	-172.3	178.5	10.7	0	0	0	0	0	114.3
11	D	29.5	Very low	32.4	Very low	177 Å²	177	142.3 Å²	142.3	95%	0.947	85%	0.848	S	S	*	*			trans	-78.9	147.5	-172	-81.5	-50.1	0	0	0	116.1
12	G	27	Very low	32.3	Very low	73 Å²	73	137 Å²	137	75%	0.753	83%	0.831	S	S	*	*			trans	98.1	164.2	131.6	0	0	0	0	0	118.9
13	P	36.6	Very low	32.3	Very low	129 Å²	129	134 Å²	134	84%	0.838	83%	0.832	S	S	*	*			cis	-131.5	163.9	-1.9	38.2	-20.5	0	0	0	115.7
14	A	31.4	Very low	32	Very low	100 Å²	100	138.1 Å²	138.1	83%	0.826	84%	0.837	S	S	*	*			trans	-72.3	144.6	164.9	0	0	0	0	0	112.4
15	K	31.3	Very low	31	Very low	210 Å²	210	139.7 Å²	139.7	91%	0.913	85%	0.845	S	S	*	*			trans	-128.2	122.7	161.3	-94	-175.2	176.4	178.2	0	110.5
16	K	31.4	Very low	30.3	Very low	208 Å²	208	142.6 Å²	142.6	90%	0.904	85%	0.847	S	S	*	*			trans	-81.7	134.9	165.2	-75.6	177.7	172	178.4	0	110.3
17	V	30.3	Very low	30	Very low	148 Å²	148	142.6 Å²	142.6	90%	0.897	85%	0.847	S	S	*	*			trans	-161	132.1	142.7	-172.3	0	0	0	0	103.5
18	G	27.6	Very low	29.8	Very low	65 Å²	65	146.1 Å²	146.1	67%	0.67	85%	0.851	S	S	*	*			cis	133.4	110.6	21.9	0	0	0	0	0	107
19	N	29	Very low	29.8	Very low	165 Å²	165	147.4 Å²	147.4	88%	0.882	85%	0.853	S	S	*	*			trans	39.3	122.4	161.3	-73.7	-8.3	0	0	0	121.8
20	Q	30.4	Very low	29.7	Very low	203 Å²	203	145.3 Å²	145.3	95%	0.949	85%	0.851	S	S	*	*				-160.5	144	123.8	-104.8	172.2	33.2	0	0	110.8
21	A	34.9	Very low	29.7	Very low	95 Å²	95	146.4 Å²	146.4	79%	0.785	85%	0.853	S	S	*	*			trans	-91	-168.1	-167.2	0	0	0	0	0	113.1
22	P	30.8	Very low	29.6	Very low	123 Å²	123	143.2 Å²	143.2	80%	0.799	85%	0.845	S	S	*	*	P	Polyproline II helix		-90.4	146.6	-123	33.4	-17	0	0	0	114.6
23	L	29.3	Very low	29.7	Very low	183 Å²	183	148 Å²	148	96%	0.958	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-88.3	128.5	170.7	-101.4	141.2	0	0	0	111.2
24	Q	29	Very low	29.3	Very low	174 Å²	174	152.3 Å²	152.3	81%	0.813	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-62.4	143.5	-174.4	-74.1	165.9	-31.9	0	0	113.6
25	T	30.1	Very low	29.2	Very low	145 Å²	145	155.2 Å²	155.2	89%	0.89	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-57.4	125.5	162.3	-20.4	0	0	0	0	110.1
26	Q	28	Very low	29	Very low	182 Å²	182	148.7 Å²	148.7	85%	0.85	85%	0.845	S	S	*	*			trans	-123.7	124	159.9	-86.8	-171.6	-10.4	0	0	110.1
27	A	27.1	Very low	29	Very low	93 Å²	93	145.1 Å²	145.1	77%	0.769	84%	0.843	S	S	*	*			trans	-68.1	132.6	177.3	0	0	0	0	0	110.8	Q29	A27-Q29 PolarHBondContact O-N 2.83Å
28	L	26.7	Very low	28.9	Very low	180 Å²	180	142.9 Å²	142.9	94%	0.942	84%	0.841	S	S	*	*			trans	-88.7	104.5	163.5	-99.1	132.6	0	0	0	108.4
29	Q	28.5	Very low	29.1	Very low	179 Å²	179	150 Å²	150	84%	0.836	85%	0.853	S	S	*	*			trans	-71.1	141.6	171.4	-79.4	177.9	-24	0	0	111.2	A27	A27-Q29 PolarHBondContact O-N 2.83Å
30	T	28.5	Very low	29.1	Very low	144 Å²	144	154.1 Å²	154.1	88%	0.883	86%	0.856	S	S	*	*			trans	-62.3	131.3	170.8	38.8	0	0	0	0	111.5
31	A	27	Very low	29.1	Very low	98 Å²	98	148.9 Å²	148.9	81%	0.81	85%	0.848	S	S	*	*			trans	-110.5	115.4	171.3	0	0	0	0	0	110.5
32	S	26.6	Very low	28.7	Very low	110 Å²	110	150.8 Å²	150.8	77%	0.769	85%	0.849	S	S	*	*			trans	-74	138	169.1	154.2	0	0	0	0	110.3
33	L	29.1	Very low	28.4	Very low	173 Å²	173	156.5 Å²	156.5	91%	0.906	86%	0.855	S	S	*	*			trans	-109.7	115.8	171.9	-88.5	149.9	0	0	0	109.9
34	R	27.9	Very low	28.3	Very low	220 Å²	220	154 Å²	154	83%	0.83	85%	0.848	S	S	*	*			trans	-132.7	131.4	158.4	-79.2	-167.5	-176	-165.5	1.9	109.7
35	D	30.6	Very low	28.1	Very low	162 Å²	162	157.3 Å²	157.3	87%	0.866	85%	0.852	S	S	*	*			trans	54.5	129	148.5	-57.5	-37.2	0	0	0	123.8
36	G	25.6	Very low	28	Very low	72 Å²	72	162.1 Å²	162.1	74%	0.742	85%	0.854	S	S	*	*			trans	-174.3	155.1	164.1	0	0	0	0	0	112.6
37	P	31.4	Very low	28	Very low	133 Å²	133	165 Å²	165	86%	0.864	86%	0.857	S	S	*	*				-113.4	166.5	-117.7	36.8	-29.9	0	0	0	118.2
38	A	28.4	Very low	28.1	Very low	102 Å²	102	165.9 Å²	165.9	84%	0.843	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-60.9	146.8	180	0	0	0	0	0	116
39	K	33.1	Very low	28.2	Very low	213 Å²	213	162.7 Å²	162.7	93%	0.926	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-97	124.6	167.3	-74.8	-176.5	177	178.5	0	111.1
40	R	29.5	Very low	28.4	Very low	252 Å²	252	163.2 Å²	163.2	95%	0.951	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-75.9	137.1	167.6	-82.1	174.4	165.7	172.6	-4.2	110.4
41	A	29.1	Very low	28.6	Very low	94 Å²	94	161.8 Å²	161.8	78%	0.777	85%	0.846	S	S	*	*			trans	-120.7	139.4	158.1	0	0	0	0	0	109.4
42	V	26.7	Very low	28.6	Very low	134 Å²	134	166 Å²	166	81%	0.812	85%	0.849	S	S	*	*			trans	-83.2	141.6	-164.8	171.2	0	0	0	0	111.5
43	W	24.4	Very low	29	Very low	244 Å²	244	169.4 Å²	169.4	92%	0.924	85%	0.853	S	S	*	*			trans	-74.6	131.7	173.9	-78.7	70.9	0	0	0	111.8
44	V	26.8	Very low	29.2	Very low	131 Å²	131	167.2 Å²	167.2	79%	0.794	85%	0.849	S	S	*	*			trans	-118.9	117.2	162.6	177.7	0	0	0	0	108.6
45	R	25.4	Very low	29.5	Very low	242 Å²	242	162.5 Å²	162.5	91%	0.913	85%	0.845	S	S	*	*			trans	-81.8	125.1	175.7	-125.1	178.1	178.4	178.4	-0.7	109
46	R	27.4	Very low	29.9	Very low	246 Å²	246	163.8 Å²	163.8	93%	0.928	85%	0.846	S	S	*	*			trans	-125.1	135.9	160.3	-110.3	-176.6	177.1	-179.4	-0.9	110
47	R	28	Very low	30.2	Very low	242 Å²	242	165.6 Å²	165.6	91%	0.913	85%	0.847	S	S	*	*			trans	-77	143.6	-172.3	-74.6	177.8	180	173.5	-0.8	112.4
48	S	30	Very low	30.3	Very low	112 Å²	112	168.5 Å²	168.5	78%	0.783	85%	0.846	S	S	*	*			trans	0.8	129.5	152.2	56.7	0	0	0	0	121
49	S	28.6	Very low	30.7	Very low	113 Å²	113	168.5 Å²	168.5	79%	0.79	85%	0.846	S	S	*	*			trans	-163.9	118.4	136.4	54.8	0	0	0	0	109.3
50	E	33.4	Very low	30.9	Very low	191 Å²	191	162.6 Å²	162.6	89%	0.893	84%	0.837	S	S	*	*			trans	-65.8	152.7	165.2	-71.4	179.4	160.5	0	0	110.2
51	P	31.6	Very low	31.5	Very low	113 Å²	113	160.2 Å²	160.2	73%	0.734	83%	0.833	S	S	*	*				-148.2	144.9	102.5	31.1	-11.5	0	0	0	116.8
52	Q	28.1	Very low	32	Very low	188 Å²	188	164.4 Å²	164.4	88%	0.879	84%	0.837	S	S	*	*			trans	54.8	128.4	143.9	-74.6	179.8	-33.8	0	0	122.4
53	E	33.9	Very low	32.7	Very low	181 Å²	181	169 Å²	169	85%	0.846	84%	0.839	S	S	*	*			trans	-57.9	153.6	168.9	-67.8	179.2	148.8	0	0	114.1
54	P	33.1	Very low	33.4	Very low	126 Å²	126	162.8 Å²	162.8	82%	0.818	83%	0.831	S	S	*	*			trans	-116.7	133.1	136.2	19.8	-2.4	0	0	0	111.8
55	T	33.4	Very low	34.1	Very low	122 Å²	122	166.3 Å²	166.3	75%	0.748	84%	0.836	S	S	*	*			trans	-56.2	146.6	171.1	36.6	0	0	0	0	114.7
56	E	40.6	Very low	35.2	Very low	189 Å²	189	162.5 Å²	162.5	88%	0.883	83%	0.828	S	S	*	*			trans	59.1	114.3	157	-65.8	-174.4	167.8	0	0	119.4
57	S	30.5	Very low	36.3	Very low	109 Å²	109	159 Å²	159	76%	0.762	82%	0.822	S	S	*	*				-169.4	139	112.5	67.3	0	0	0	0	113.7
58	K	34.2	Very low	37.8	Very low	195 Å²	195	154.4 Å²	154.4	85%	0.848	82%	0.82	S	S	*	*			trans	62.6	96.9	157.3	-64.9	179.5	-176.6	-180	0	116.8	A60	K58-A60 PolarHBondContact O-N 2.91Å
59	A	36.6	Very low	40.2	Very low	102 Å²	102	151.4 Å²	151.4	84%	0.843	80%	0.797	S	S	*	*			trans	-45.3	105.7	149.7	0	0	0	0	0	109.1	K61	A59-K61 PolarHBondContact O-N 2.74Å
60	A	37.1	Very low	43.1	Very low	89 Å²	89	152.3 Å²	152.3	74%	0.736	79%	0.787	S	S	*	*			trans	-57	114	161	0	0	0	0	0	105.6	K58 E62	K58-A60 PolarHBondContact O-N 2.91Å; A60-E62 VanDerWaalsContact C-N 3.27Å; A60-E62 PolarHBondContact O-N 3.06Å
61	K	41.9	Very low	46.1	Very low	202 Å²	202	143.8 Å²	143.8	88%	0.878	75%	0.75	S	S	*	*			trans	-55	102.8	163.6	-87.4	-179.4	172.9	179.9	0	105.6	A59 R63	A59-K61 PolarHBondContact O-N 2.74Å; K61-R63 PolarHBondContact O-N 2.98Å
62	E	39.9	Very low	49.3	Very low	182 Å²	182	138.4 Å²	138.4	85%	0.85	72%	0.715	S	S	*	*			trans	-52.2	115.2	163.9	-75.7	-173	149.7	0	0	105.6	A60	A60-E62 VanDerWaalsContact C-N 3.27Å; A60-E62 PolarHBondContact O-N 3.06Å
63	R	42	Very low	52.6	Low	229 Å²	229	129.6 Å²	129.6	86%	0.864	67%	0.674	S	S	*	*			trans	-53.9	129.9	167.1	-72.3	-179.2	177.5	-173.7	-2.2	105.2	K61 K65	K61-R63 PolarHBondContact O-N 2.98Å; R63-K65 PolarHBondContact O-N 3.07Å
64	P	38.4	Very low	55.7	Low	114 Å²	114	121 Å²	121	74%	0.74	63%	0.633	S	S	*	*			trans	-51.7	127.4	175.6	21.5	-30	0	0	0	106.5	Q66	P64-Q66 PolarHBondContact O-N 2.81Å
65	K	42	Very low	58.8	Low	206 Å²	206	115.1 Å²	115.1	90%	0.896	60%	0.595	S	S	*	*			trans	-56.6	98.9	170.2	-78.5	177.7	177.8	173.3	0	105	R63 E67	R63-K65 PolarHBondContact O-N 3.07Å; K65-E67 PolarHBondContact O-N 3Å
66	Q	48.2	Very low	61.7	Low	162 Å²	162	109.5 Å²	109.5	76%	0.757	56%	0.561	S	S	*	*			trans	-56.2	115.2	172.3	-87.3	179.5	-41.6	0	0	105	P64 V68	P64-Q66 PolarHBondContact O-N 2.81Å; Q66-V68 PolarHBondContact O-N 3.09Å; Q66-V68 VanDerWaalsContact O-N 3.09Å
67	E	50.1	Low	64.3	Low	173 Å²	173	101.2 Å²	101.2	81%	0.808	53%	0.526	S	S	*	.			trans	-53.5	120.7	170.4	-143.8	171.8	-178.1	0	0	105.8	K65 T69	K65-E67 PolarHBondContact O-N 3Å; E67-T69 PolarHBondContact O-N 2.85Å
68	V	59.2	Low	67.4	Low	144 Å²	144	96.5 Å²	96.5	87%	0.873	49%	0.493	S	S	*	.			trans	-73.9	88.5	-176.5	-178.5	0	0	0	0	106.8	Q66	Q66-V68 PolarHBondContact O-N 3.09Å; Q66-V68 VanDerWaalsContact O-N 3.09Å
69	T	80.6	Confident	70.2	Confident	49 Å²	49	87.4 Å²	87.4	30%	0.301	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-72.6	147.7	172.9	60	0	0	0	0	109.2	E67 E164	E67-T69 PolarHBondContact O-N 2.85Å; T69-E164 WeakPolarHBondContact CB-O 3.43Å; T69-E164 HydrophobicContact CG2-CB 4.3Å; T69-E164 PolarHBondContact OG1-O 2.53Å
70	K	90.9	Very high	73	Confident	132 Å²	132	86.1 Å²	86.1	57%	0.574	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-71.5	140.8	176.9	-66.6	-176.1	-179.5	-179.4	0	109.5	F85 H165	K70-F85 HydrophobicContact CB-CB 4.26Å; K70-F85 HydrophobicContact CB-CD1 3.99Å; K70-F85 HydrophobicContact CB-CG 4.44Å; K70-F85 HydrophobicContact CD-CB 4.4Å; K70-H165 PolarHBondContact O-ND1 3.32Å
71	A	96.4	Very high	75.8	Confident	13 Å²	13	81.9 Å²	81.9	11%	0.107	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-61.3	149.2	170.7	0	0	0	0	0	110.9	F85 A86 A166 A407 W416	A71-F85 WeakPolarHBondContact O-CA 3.37Å; A71-A86 HydrophobicContact CB-CB 4.2Å; A71-A86 WeakPolarHBondContact O-CB 3.4Å; A71-A86 PolarHBondContact O-N 3.34Å; A71-A166 CarbonylContact C-O 3.24Å; A71-A166 VanDerWaalsContact CA-O 3.25Å; A71-A166 WeakPolarHBondContact CA-O 3.42Å; A71-A166 HydrophobicContact CB-CB 4.22Å; A71-A407 HydrophobicContact CB-CB 4.34Å; A71-W416 HydrophobicContact CB-CH2 3.84Å; A71-W416 HydrophobicContact CB-CZ2 3.68Å
72	V	97.9	Very high	78.5	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	138.4	176	177.2	0	0	0	0	108.6	V74 C83 F85 F154 M158 I160 H165 A166 V167 L168	V72-V74 HydrophobicContact CG1-CG2 4.28Å; V72-C83 WeakPolarHBondContact CG1-SG 3.41Å; V72-F85 HydrophobicContact CG2-CD1 3.95Å; V72-F85 HydrophobicContact CG2-CE1 3.93Å; V72-F154 HydrophobicContact CG1-CE1 4.03Å; V72-M158 HydrophobicContact CG1-CE 4.24Å; V72-M158 HydrophobicContact CG1-SD 4.04Å; V72-M158 HydrophobicContact CG2-CE 4.29Å; V72-I160 HydrophobicContact CG2-CD1 3.72Å; V72-H165 HydrophobicContact CG2-CB 3.88Å; V72-A166 PolarHBondContact N-O 3.06Å; V72-V167 CarbonylContact O-C 3.57Å; V72-V167 WeakPolarHBondContact O-CA 3.48Å; V72-L168 PolarHBondContact O-N 3.11Å
73	V	98.6	Very high	81.2	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.012	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	124.1	178.3	179.6	0	0	0	0	108.6	C83 G84 A86 L168 W400 A407	V73-C83 VanDerWaalsContact O-CA 3.3Å; V73-C83 WeakPolarHBondContact O-CA 3.47Å; V73-C83 PolarHBondContact O-SG 3.32Å; V73-G84 PolarHBondContact N-O 3.23Å; V73-G84 PolarHBondContact O-N 3.08Å; V73-A86 HydrophobicContact CG2-CB 4.25Å; V73-L168 CarbonylContact C-O 3.51Å; V73-L168 WeakPolarHBondContact CA-O 3.32Å; V73-L168 HydrophobicContact CG1-CD2 4.1Å; V73-L168 HydrophobicContact CG2-CB 4.36Å; V73-W400 HydrophobicContact CB-CZ2 4.39Å; V73-W400 HydrophobicContact CG1-CG 4.33Å; V73-W400 PolarHBondContact O-NE1 3.48Å; V73-A407 HydrophobicContact CG2-CB 4.21Å
74	V	98.3	Very high	83.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	113.4	178.3	-174.5	0	0	0	0	109.2	V72 W150 L153 F154 V167 L168 V169 S170	V72-V74 HydrophobicContact CG1-CG2 4.28Å; V74-W150 HydrophobicContact CG1-CZ2 3.92Å; V74-L153 HydrophobicContact CG1-CD2 4.34Å; V74-F154 HydrophobicContact CG2-CE1 3.95Å; V74-F154 HydrophobicContact CG2-CZ 3.98Å; V74-V167 HydrophobicContact CG2-CG1 3.89Å; V74-L168 PolarHBondContact N-O 2.98Å; V74-V169 WeakPolarHBondContact O-CA 3.13Å; V74-S170 PolarHBondContact O-N 3.4Å
75	D	97.7	Very high	86.7	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.021	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	99.2	170.1	165.3	29.7	0	0	0	109.2	G77 C81 K82 S170 V399 W400	D75-G77 PolarHBondContact O-N 3Å; D75-C81 CarbonylContact O-C 3.43Å; D75-C81 WeakPolarHBondContact O-CA 3.48Å; D75-K82 HydrophobicContact CB-CB 4.24Å; D75-K82 PolarHBondContact N-O 2.69Å; D75-K82 PolarHBondContact O-N 3.15Å; D75-K82 IonicContact OD2-NZ 2.73Å; D75-K82 PolarHBondContact OD2-NZ 3.26Å; D75-S170 WeakPolarHBondContact CA-OG 3.41Å; D75-S170 PolarHBondContact OD1-OG 2.94Å; D75-V399 HydrophobicContact CB-CG1 4.18Å; D75-W400 HydrophobicContact CB-CB 4Å
76	L	95.8	Very high	89.3	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.021	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	88.2	178.4	-176.1	64.7	0	0	0	110.4	C81 T97 L135 I140 V146 W150	L76-C81 HydrophobicContact CD1-CB 4.16Å; L76-T97 HydrophobicContact CD1-CG2 4.13Å; L76-L135 HydrophobicContact CD1-CD1 4.38Å; L76-L135 HydrophobicContact CD2-CD1 4.24Å; L76-L135 HydrophobicContact CD2-CD2 4.37Å; L76-L135 HydrophobicContact CG-CD1 4.31Å; L76-L135 HydrophobicContact CG-CD2 4.07Å; L76-I140 HydrophobicContact CD2-CD1 3.82Å; L76-I140 HydrophobicContact CD2-CG1 4.17Å; L76-V146 HydrophobicContact CD2-CG1 3.74Å; L76-V146 HydrophobicContact CD2-CG2 4.21Å; L76-W150 HydrophobicContact CD2-CZ2 4.27Å
77	G	94.8	Very high	91.6	Very high	15 Å²	15	36.4 Å²	36.4	16%	0.155	20%	0.201	C	C	.	.			trans	-85.3	158.1	170.9	0	0	0	0	0	112.2	D75 G79 Y80 T97	D75-G77 PolarHBondContact O-N 3Å; G77-G79 PolarHBondContact O-N 3.15Å; G77-Y80 VanDerWaalsContact CA-O 3.31Å; G77-Y80 WeakPolarHBondContact CA-O 3.47Å; G77-Y80 PolarHBondContact N-O 3.18Å; G77-Y80 VanDerWaalsContact N-O 3.1Å; G77-T97 WeakPolarHBondContact O-CB 3.25Å; G77-T97 WeakPolarHBondContact O-CG2 3.5Å; G77-T97 PolarHBondContact O-OG1 2.83Å
78	T	94.2	Very high	93.8	Very high	10 Å²	10	31 Å²	31	6%	0.061	18%	0.177	C	C	.	.	S	Bend	trans	-64.1	-25.8	175.8	62.2	0	0	0	0	113.3	N133 L135 G138 H221 G222	T78-N133 PolarHBondContact O-ND2 2.94Å; T78-L135 HydrophobicContact CG2-CB 3.99Å; T78-L135 HydrophobicContact CG2-CD2 4.14Å; T78-G138 VanDerWaalsContact CG2-CA 3.42Å; T78-H221 WeakPolarHBondContact OG1-CB 3.36Å; T78-G222 WeakPolarHBondContact OG1-CA 3.49Å; T78-G222 PolarHBondContact OG1-N 3.23Å
79	G	93.9	Very high	95.4	Very high	4 Å²	4	28.8 Å²	28.8	4%	0.041	17%	0.166	C	C	.	.	S	Bend	trans	-98.6	-43	-179.5	0	0	0	0	0	113.9	G77 T97 H221	G77-G79 PolarHBondContact O-N 3.15Å; G79-T97 PolarHBondContact O-N 3.43Å; G79-T97 VanDerWaalsContact O-N 3.08Å; G79-H221 WeakPolarHBondContact CA-ND1 3.31Å
80	Y	95.3	Very high	96.1	Very high	75 Å²	75	33.5 Å²	33.5	29%	0.294	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	137.5	-176.2	-64.9	-79.1	0	0	0	109.5	G77 K94 I95 T97 K277	G77-Y80 VanDerWaalsContact CA-O 3.31Å; G77-Y80 WeakPolarHBondContact CA-O 3.47Å; G77-Y80 PolarHBondContact N-O 3.18Å; G77-Y80 VanDerWaalsContact N-O 3.1Å; Y80-K94 HydrophobicContact CD1-CG 4.07Å; Y80-K94 HydrophobicContact CG-CG 4.27Å; Y80-I95 CarbonylContact C-O 3.5Å; Y80-I95 WeakPolarHBondContact CA-O 3.45Å; Y80-T97 WeakPolarHBondContact CA-OG1 3.43Å; Y80-T97 PolarHBondContact N-OG1 3.44Å; Y80-K277 PolarHBondContact OH-NZ 3.21Å
81	C	96.7	Very high	96.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	126.5	164.6	-170	0	0	0	0	108.1	D75 L76 K94 I95 T97 I149	D75-C81 CarbonylContact O-C 3.43Å; D75-C81 WeakPolarHBondContact O-CA 3.48Å; L76-C81 HydrophobicContact CD1-CB 4.16Å; C81-K94 WeakPolarHBondContact O-CA 3.25Å; C81-I95 HydrophobicContact CB-CG1 3.95Å; C81-I95 PolarHBondContact N-O 2.93Å; C81-I95 PolarHBondContact O-N 3.19Å; C81-T97 PolarHBondContact N-OG1 3.43Å; C81-T97 VanDerWaalsContact N-OG1 3.17Å; C81-I149 HydrophobicContact CB-CG2 4.38Å
82	K	97.8	Very high	96.4	Very high	23 Å²	23	31 Å²	31	10%	0.1	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	136.1	-179.5	-57.4	172.4	-151.5	121	0	109.2	D75 P91 H93 K94 D396 W400	D75-K82 HydrophobicContact CB-CB 4.24Å; D75-K82 PolarHBondContact N-O 2.69Å; D75-K82 PolarHBondContact O-N 3.15Å; D75-K82 IonicContact OD2-NZ 2.73Å; D75-K82 PolarHBondContact OD2-NZ 3.26Å; K82-P91 HydrophobicContact CB-CB 4Å; K82-P91 HydrophobicContact CB-CG 4.33Å; K82-P91 HydrophobicContact CD-CG 4.43Å; K82-H93 WeakPolarHBondContact CA-O 3.24Å; K82-K94 HydrophobicContact CG-CG 4.14Å; K82-D396 WeakPolarHBondContact CE-O 3.44Å; K82-D396 PolarHBondContact NZ-O 3.26Å; K82-W400 HydrophobicContact CB-CB 4.41Å; K82-W400 HydrophobicContact CB-CG 4.32Å
83	C	97.5	Very high	96.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	152.3	-175.4	-158.6	0	0	0	0	113.6	V72 V73 T92 H93 L153 M158	V72-C83 WeakPolarHBondContact CG1-SG 3.41Å; V73-C83 VanDerWaalsContact O-CA 3.3Å; V73-C83 WeakPolarHBondContact O-CA 3.47Å; V73-C83 PolarHBondContact O-SG 3.32Å; C83-T92 PolarHBondContact O-N 2.81Å; C83-T92 PolarHBondContact O-OG1 2.99Å; C83-H93 PolarHBondContact N-O 2.73Å; C83-H93 PolarHBondContact O-N 3.46Å; C83-L153 HydrophobicContact CB-CD1 3.68Å; C83-L153 HydrophobicContact CB-CD2 3.51Å; C83-L153 HydrophobicContact CB-CG 3.82Å; C83-M158 HydrophobicContact CB-SD 4.07Å; C83-M158 PolarHBondContact SG-SD 3.22Å
84	G	97.9	Very high	96.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.1	179.4	169.6	0	0	0	0	0	113.3	V73 T92	V73-G84 PolarHBondContact N-O 3.23Å; V73-G84 PolarHBondContact O-N 3.08Å; G84-T92 WeakPolarHBondContact CA-OG1 3.5Å
85	F	97.7	Very high	96	Very high	58 Å²	58	38.3 Å²	38.3	25%	0.254	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	142.1	177.2	-61.9	-71	0	0	0	112.3	K70 A71 V72 L88 M158 I160 H165	K70-F85 HydrophobicContact CB-CB 4.26Å; K70-F85 HydrophobicContact CB-CD1 3.99Å; K70-F85 HydrophobicContact CB-CG 4.44Å; K70-F85 HydrophobicContact CD-CB 4.4Å; A71-F85 WeakPolarHBondContact O-CA 3.37Å; V72-F85 HydrophobicContact CG2-CD1 3.95Å; V72-F85 HydrophobicContact CG2-CE1 3.93Å; F85-L88 HydrophobicContact CB-CD1 4.13Å; F85-M158 HydrophobicContact CD1-CE 4.45Å; F85-M158 HydrophobicContact CD2-CE 4.22Å; F85-M158 HydrophobicContact CE1-CE 4.11Å; F85-M158 HydrophobicContact CE2-CE 3.88Å; F85-M158 HydrophobicContact CZ-CE 3.84Å; F85-I160 HydrophobicContact CE1-CG2 4.38Å; F85-I160 HydrophobicContact CZ-CG2 3.77Å; F85-H165 AromaticContact CE1-CE1 3.64Å; F85-H165 AromaticContact CE1-ND1 3.95Å
86	A	97.1	Very high	95.8	Very high	9 Å²	9	40 Å²	40	7%	0.074	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	148.7	172.5	0	0	0	0	0	112	A71 V73 L88 A407	A71-A86 HydrophobicContact CB-CB 4.2Å; A71-A86 WeakPolarHBondContact O-CB 3.4Å; A71-A86 PolarHBondContact O-N 3.34Å; V73-A86 HydrophobicContact CG2-CB 4.25Å; A86-L88 VanDerWaalsContact C-N 3.3Å; A86-A407 HydrophobicContact CB-CB 3.67Å
87	G	95.3	Very high	95.8	Very high	50 Å²	50	39.8 Å²	39.8	52%	0.515	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.8	-2.5	-176	0	0	0	0	0	114.9	S404	G87-S404 PolarHBondContact N-O 3.39Å; G87-S404 PolarHBondContact N-OG 2.89Å
88	L	96.2	Very high	95.7	Very high	60 Å²	60	41.3 Å²	41.3	31%	0.314	22%	0.22	S	C	.	.			trans	-87.3	148.1	170.9	-62.9	177.7	0	0	0	111	F85 A86 R90 T92 W400 S404	F85-L88 HydrophobicContact CB-CD1 4.13Å; A86-L88 VanDerWaalsContact C-N 3.3Å; L88-R90 VanDerWaalsContact C-N 3.33Å; L88-R90 PolarHBondContact O-N 3.3Å; L88-T92 HydrophobicContact CD1-CG2 3.5Å; L88-T92 VanDerWaalsContact CD1-CG2 3.5Å; L88-W400 HydrophobicContact CB-CH2 4.12Å; L88-W400 WeakPolarHBondContact O-CZ3 3.46Å; L88-S404 PolarHBondContact N-OG 3.25Å; L88-S404 PolarHBondContact O-OG 2.73Å
89	P	94.1	Very high	95.7	Very high	97 Å²	97	40.9 Å²	40.9	63%	0.63	22%	0.217	S	C	*	.	S	Bend	trans	-74.2	-22.9	-176.2	29.3	-35.6	0	0	0	113.6	T401	P89-T401 PolarHBondContact O-OG1 3.4Å
90	R	95.1	Very high	95.6	Very high	147 Å²	147	40.7 Å²	40.7	56%	0.555	22%	0.215	S	C	*	.	S	Bend	trans	-140.1	152.2	-175.7	-67.9	-176.7	-172.9	172.2	2.1	111	L88 T92 E394 W400	L88-R90 VanDerWaalsContact C-N 3.33Å; L88-R90 PolarHBondContact O-N 3.3Å; R90-T92 PolarHBondContact O-N 3.42Å; R90-E394 WeakPolarHBondContact CD-OE2 3.39Å; R90-E394 WeakPolarHBondContact CG-OE2 3.33Å; R90-E394 IonicContact CZ-OE1 3.5Å; R90-E394 IonicContact CZ-OE2 3.26Å; R90-E394 IonicContact NE-OE1 2.99Å; R90-E394 PolarHBondContact NE-OE1 3.14Å; R90-E394 IonicContact NE-OE2 2.81Å; R90-E394 PolarHBondContact NE-OE2 3.23Å; R90-E394 IonicContact NH2-OE1 2.61Å; R90-E394 PolarHBondContact NH2-OE1 2.61Å; R90-E394 IonicContact NH2-OE2 3.94Å; R90-W400 VanDerWaalsContact O-CH2 3.25Å; R90-W400 WeakPolarHBondContact O-CH2 3.45Å; R90-W400 VanDerWaalsContact O-CZ3 3.24Å; R90-W400 WeakPolarHBondContact O-CZ3 3.29Å
91	P	96.8	Very high	95.4	Very high	26 Å²	26	40.2 Å²	40.2	17%	0.169	22%	0.215	C	C	.	.			trans	-61.1	135.7	174.1	25	-32.5	0	0	0	109.7	K82 W400	K82-P91 HydrophobicContact CB-CB 4Å; K82-P91 HydrophobicContact CB-CG 4.33Å; K82-P91 HydrophobicContact CD-CG 4.43Å; P91-W400 HydrophobicContact CB-CD2 3.59Å; P91-W400 HydrophobicContact CB-CE3 3.96Å; P91-W400 HydrophobicContact CB-CG 3.88Å; P91-W400 HydrophobicContact CB-CZ2 4.36Å; P91-W400 VanDerWaalsContact CD-CE3 3.45Å; P91-W400 HydrophobicContact CG-CD2 4.23Å; P91-W400 HydrophobicContact CG-CE3 4.27Å; P91-W400 HydrophobicContact CG-CG 4.41Å
92	T	96.1	Very high	94.9	Very high	66 Å²	66	42.3 Å²	42.3	41%	0.405	23%	0.228	S	C	.	.	S	Bend	trans	-74.2	-32.5	177.3	48.2	0	0	0	0	112.4	C83 G84 L88 R90	C83-T92 PolarHBondContact O-N 2.81Å; C83-T92 PolarHBondContact O-OG1 2.99Å; G84-T92 WeakPolarHBondContact CA-OG1 3.5Å; L88-T92 HydrophobicContact CD1-CG2 3.5Å; L88-T92 VanDerWaalsContact CD1-CG2 3.5Å; R90-T92 PolarHBondContact O-N 3.42Å
93	H	96.3	Very high	93.6	Very high	49 Å²	49	50.2 Å²	50.2	23%	0.227	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	141.2	-175.3	-59.4	85.8	0	0	0	109.6	K82 C83 L153 E157	K82-H93 WeakPolarHBondContact CA-O 3.24Å; C83-H93 PolarHBondContact N-O 2.73Å; C83-H93 PolarHBondContact O-N 3.46Å; H93-L153 HydrophobicContact CB-CD1 4.22Å; H93-E157 IonicContact CD2-OE2 2.86Å; H93-E157 PolarHBondContact NE2-O 3.34Å
94	K	95.4	Very high	92	Very high	99 Å²	99	57.1 Å²	57.1	43%	0.43	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	111.7	177.1	179.1	176.2	-178.4	174.9	0	108.1	Y80 C81 K82 D396	Y80-K94 HydrophobicContact CD1-CG 4.07Å; Y80-K94 HydrophobicContact CG-CG 4.27Å; C81-K94 WeakPolarHBondContact O-CA 3.25Å; K82-K94 HydrophobicContact CG-CG 4.14Å; K94-D396 IonicContact NZ-OD2 3.25Å; K94-D396 PolarHBondContact NZ-OD2 3.49Å; K94-D396 VanDerWaalsContact NZ-OD2 3.15Å
95	I	95.2	Very high	90	Very high	9 Å²	9	66.3 Å²	66.3	5%	0.046	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	155	179.2	63.3	173.4	0	0	0	110.5	Y80 C81 V118 I149 Y152 L153 E157	Y80-I95 CarbonylContact C-O 3.5Å; Y80-I95 WeakPolarHBondContact CA-O 3.45Å; C81-I95 HydrophobicContact CB-CG1 3.95Å; C81-I95 PolarHBondContact N-O 2.93Å; C81-I95 PolarHBondContact O-N 3.19Å; I95-V118 HydrophobicContact CD1-CG1 4.2Å; I95-I149 HydrophobicContact CD1-CG2 3.9Å; I95-Y152 HydrophobicContact CD1-CD1 4.04Å; I95-Y152 HydrophobicContact CG2-CE1 4.47Å; I95-L153 HydrophobicContact CD1-CB 4.15Å; I95-L153 HydrophobicContact CD1-CD1 4.05Å; I95-L153 HydrophobicContact CG1-CD1 4.34Å; I95-E157 HydrophobicContact CG2-CG 3.88Å
96	S	93.9	Very high	87.6	Confident	39 Å²	39	67.9 Å²	67.9	27%	0.273	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	138.7	171.4	-174.4	0	0	0	0	109.9	M98	S96-M98 WeakPolarHBondContact OG-CB 3.37Å; S96-M98 PolarHBondContact OG-N 3.22Å
97	T	95.4	Very high	85.2	Confident	0 Å²	0	72 Å²	72	0%	0	38%	0.384	C	S	.	.	S	Bend	trans	-79.9	-8.9	171.6	-50	0	0	0	0	111.8	L76 G77 G79 Y80 C81 P134 L135 I149	L76-T97 HydrophobicContact CD1-CG2 4.13Å; G77-T97 WeakPolarHBondContact O-CB 3.25Å; G77-T97 WeakPolarHBondContact O-CG2 3.5Å; G77-T97 PolarHBondContact O-OG1 2.83Å; G79-T97 PolarHBondContact O-N 3.43Å; G79-T97 VanDerWaalsContact O-N 3.08Å; Y80-T97 WeakPolarHBondContact CA-OG1 3.43Å; Y80-T97 PolarHBondContact N-OG1 3.44Å; C81-T97 PolarHBondContact N-OG1 3.43Å; C81-T97 VanDerWaalsContact N-OG1 3.17Å; T97-P134 HydrophobicContact CG2-CG 4.24Å; T97-P134 WeakPolarHBondContact O-CD 3.22Å; T97-L135 HydrophobicContact CG2-CD1 3.75Å; T97-I149 HydrophobicContact CG2-CD1 4.17Å
98	M	92.9	Very high	83	Confident	47 Å²	47	77.9 Å²	77.9	23%	0.232	40%	0.396	C	S	.	.			trans	-72.5	135.2	171.1	-62.3	-65.3	-58.8	0	0	110.3	S96 L131 N133	S96-M98 WeakPolarHBondContact OG-CB 3.37Å; S96-M98 PolarHBondContact OG-N 3.22Å; M98-L131 HydrophobicContact CE-CB 3.7Å; M98-N133 HydrophobicContact CE-CB 4.32Å; M98-N133 HydrophobicContact SD-CB 3.52Å; M98-N133 VanDerWaalsContact SD-CB 3.52Å; M98-N133 PolarHBondContact SD-ND2 2.84Å; M98-N133 VanDerWaalsContact SD-ND2 3.4Å
99	V	93.9	Very high	80.5	Confident	0 Å²	0	82.5 Å²	82.5	0%	0	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	158.8	173.2	-56.2	0	0	0	0	110.7	K101 T116 F117 V118 L131 V132 T145 I149	V99-K101 HydrophobicContact CG2-CG 4.47Å; V99-T116 HydrophobicContact CB-CG2 3.83Å; V99-T116 HydrophobicContact CG1-CG2 4.03Å; V99-T116 HydrophobicContact CG2-CG2 4.12Å; V99-F117 WeakPolarHBondContact CA-O 3.5Å; V99-F117 WeakPolarHBondContact CB-O 3.35Å; V99-V118 HydrophobicContact CG1-CG2 3.98Å; V99-L131 CarbonylContact O-C 3.5Å; V99-L131 VanDerWaalsContact O-CA 3.3Å; V99-L131 WeakPolarHBondContact O-CA 3.24Å; V99-V132 HydrophobicContact CG2-CB 4.27Å; V99-V132 PolarHBondContact N-O 2.66Å; V99-V132 PolarHBondContact O-N 3.08Å; V99-T145 HydrophobicContact CB-CG2 4.12Å; V99-T145 HydrophobicContact CG1-CG2 3.64Å; V99-T145 HydrophobicContact CG2-CG2 3.42Å; V99-T145 VanDerWaalsContact CG2-CG2 3.42Å; V99-I149 HydrophobicContact CG1-CD1 3.75Å; V99-I149 HydrophobicContact CG1-CG1 3.63Å
100	G	92.3	Very high	78.6	Confident	0 Å²	0	81.4 Å²	81.4	0%	0	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.7	173.6	0	0	0	0	0	109.8	F117	G100-F117 PolarHBondContact N-O 2.79Å; G100-F117 PolarHBondContact O-N 3.24Å
101	K	89.4	Confident	76.8	Confident	65 Å²	65	78 Å²	78	28%	0.283	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	133.8	170.2	-62.1	-160.8	177.4	-172.3	0	109.3	V99 K130 V132 D142 T145	V99-K101 HydrophobicContact CG2-CG 4.47Å; K101-K130 PolarHBondContact N-O 2.95Å; K101-K130 PolarHBondContact O-N 2.87Å; K101-V132 HydrophobicContact CG-CG2 4.37Å; K101-D142 IonicContact NZ-OD2 3.87Å; K101-D142 PolarHBondContact NZ-OD2 2.83Å; K101-T145 PolarHBondContact NZ-OG1 3.39Å; K101-T145 VanDerWaalsContact NZ-OG1 3.07Å
102	P	86.2	Confident	75.2	Confident	44 Å²	44	84.9 Å²	84.9	29%	0.286	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	141.7	177.7	-25.5	33.9	0	0	0	112.6	M104 E115 F117 V127 L129	P102-M104 VanDerWaalsContact C-N 3.3Å; P102-M104 PolarHBondContact O-N 2.81Å; P102-E115 WeakPolarHBondContact CD-O 3.05Å; P102-F117 HydrophobicContact CG-CE2 3.95Å; P102-V127 HydrophobicContact CB-CG1 4.28Å; P102-L129 HydrophobicContact CG-CD2 4.3Å
103	Y	70.9	Confident	73.9	Confident	189 Å²	189	90.1 Å²	90.1	74%	0.741	47%	0.474	S	S	*	.	S	Bend	trans	-68.1	-25.9	-178.1	-164.1	-91.4	0	0	0	113.9	H128	Y103-H128 PolarHBondContact N-O 3.07Å
104	M	64.4	Low	72.9	Confident	145 Å²	145	92.9 Å²	92.9	71%	0.714	49%	0.485	S	S	*	.			trans	-104.2	109	178.1	-79.6	-169.9	171.4	0	0	111.5	P102 T106	P102-M104 VanDerWaalsContact C-N 3.3Å; P102-M104 PolarHBondContact O-N 2.81Å; M104-T106 PolarHBondContact O-N 2.96Å
105	E	55.5	Low	72.4	Confident	194 Å²	194	95.6 Å²	95.6	91%	0.907	50%	0.499	S	S	*	.			trans	-72.9	63.5	155.2	-72.3	177	176.9	0	0	109.4	A107	E105-A107 PolarHBondContact O-N 3.01Å
106	T	46.4	Very low	72.1	Confident	91 Å²	91	95.7 Å²	95.7	56%	0.558	50%	0.5	S	S	*	.			trans	-93.5	65.8	163.3	47.8	0	0	0	0	109.1	M104 K108	M104-T106 PolarHBondContact O-N 2.96Å; T106-K108 VanDerWaalsContact C-N 3.26Å; T106-K108 PolarHBondContact O-N 3.3Å
107	A	46.8	Very low	72.1	Confident	95 Å²	95	95.3 Å²	95.3	79%	0.785	49%	0.494	S	S	*	.			trans	-64.3	91.7	164.6	0	0	0	0	0	108.4	E105	E105-A107 PolarHBondContact O-N 3.01Å
108	K	49.8	Very low	72	Confident	173 Å²	173	95.5 Å²	95.5	75%	0.752	50%	0.495	S	S	*	.			trans	-80	132.3	149.8	-72.2	-172.9	179.4	-178.7	0	106.6	T106 G110 D111	T106-K108 VanDerWaalsContact C-N 3.26Å; T106-K108 PolarHBondContact O-N 3.3Å; K108-G110 PolarHBondContact O-N 3.02Å; K108-G110 VanDerWaalsContact O-N 3.12Å; K108-D111 PolarHBondContact O-N 3.49Å
109	T	43.3	Very low	71.9	Confident	157 Å²	157	93.9 Å²	93.9	96%	0.963	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48	116.8	175.9	-35.1	0	0	0	0	110.1
110	G	54.6	Low	71.6	Confident	75 Å²	75	99.9 Å²	99.9	77%	0.773	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.3	7.9	177.7	0	0	0	0	0	117.1	K108 N112	K108-G110 PolarHBondContact O-N 3.02Å; K108-G110 VanDerWaalsContact O-N 3.12Å; G110-N112 PolarHBondContact O-N 3.07Å
111	D	57.4	Low	71.4	Confident	75 Å²	75	102 Å²	102	40%	0.401	53%	0.528	S	S	.	.			trans	-84.6	108.7	176.4	-145.6	-2.9	0	0	0	110.8	K108 R113	K108-D111 PolarHBondContact O-N 3.49Å; D111-R113 VanDerWaalsContact CG-NE 3.34Å; D111-R113 PolarHBondContact O-N 3.28Å; D111-R113 WeakPolarHBondContact OD1-CG 3.18Å; D111-R113 IonicContact OD1-CZ 3.71Å; D111-R113 IonicContact OD1-NE 2.74Å; D111-R113 PolarHBondContact OD1-NE 2.92Å; D111-R113 VanDerWaalsContact OD1-NE 3.09Å; D111-R113 WeakPolarHBondContact OD2-CD 3.37Å; D111-R113 IonicContact OD2-CZ 3.16Å; D111-R113 IonicContact OD2-NE 3.32Å; D111-R113 PolarHBondContact OD2-NE 2.98Å; D111-R113 IonicContact OD2-NH1 2.72Å; D111-R113 IonicContact OD2-NH2 3.18Å
112	N	62.7	Low	71.3	Confident	170 Å²	170	100.7 Å²	100.7	91%	0.909	52%	0.524	S	S	*	.			trans	-75.8	34.6	177.2	-76.8	-11.9	0	0	0	112.6	G110	G110-N112 PolarHBondContact O-N 3.07Å
113	R	68.9	Low	71	Confident	176 Å²	176	105.1 Å²	105.1	66%	0.664	55%	0.546	S	S	*	.			trans	-80.2	138.4	-177.2	-73.3	178.1	-168.1	-178	-1	110.3	D111 E115	D111-R113 VanDerWaalsContact CG-NE 3.34Å; D111-R113 PolarHBondContact O-N 3.28Å; D111-R113 WeakPolarHBondContact OD1-CG 3.18Å; D111-R113 IonicContact OD1-CZ 3.71Å; D111-R113 IonicContact OD1-NE 2.74Å; D111-R113 PolarHBondContact OD1-NE 2.92Å; D111-R113 VanDerWaalsContact OD1-NE 3.09Å; D111-R113 WeakPolarHBondContact OD2-CD 3.37Å; D111-R113 IonicContact OD2-CZ 3.16Å; D111-R113 IonicContact OD2-NE 3.32Å; D111-R113 PolarHBondContact OD2-NE 2.98Å; D111-R113 IonicContact OD2-NH1 2.72Å; D111-R113 IonicContact OD2-NH2 3.18Å; R113-E115 PolarHBondContact O-N 2.94Å
114	K	76.3	Confident	71	Confident	108 Å²	108	102.4 Å²	102.4	47%	0.47	54%	0.544	S	S	.	.			trans	-63.6	126	175.9	-164.1	179.7	-167	-173.1	0	110	T116 F117 E121	K114-T116 WeakPolarHBondContact CD-O 3.42Å; K114-T116 WeakPolarHBondContact CE-O 3.43Å; K114-T116 WeakPolarHBondContact CG-O 3.31Å; K114-F117 HydrophobicContact CB-CZ 4.16Å; K114-F117 HydrophobicContact CD-CE1 4.37Å; K114-F117 WeakPolarHBondContact O-CE2 3.44Å; K114-E121 IonicContact NZ-OE1 3.77Å; K114-E121 PolarHBondContact NZ-OE1 2.9Å; K114-E121 IonicContact NZ-OE2 3.43Å; K114-E121 PolarHBondContact NZ-OE2 2.82Å
115	E	83.4	Confident	71.1	Confident	155 Å²	155	97.3 Å²	97.3	72%	0.724	52%	0.521	S	S	*	.			trans	-90.8	-29.1	-175.1	-61	-173.9	164.7	0	0	113.1	P102 R113	P102-E115 WeakPolarHBondContact CD-O 3.05Å; R113-E115 PolarHBondContact O-N 2.94Å
116	T	90.6	Very high	72	Confident	12 Å²	12	96.7 Å²	96.7	7%	0.074	52%	0.524	C	S	.	.			trans	-122.4	127.8	-178.6	-52.5	0	0	0	0	110.8	V99 K114 V118 T145 D148	V99-T116 HydrophobicContact CB-CG2 3.83Å; V99-T116 HydrophobicContact CG1-CG2 4.03Å; V99-T116 HydrophobicContact CG2-CG2 4.12Å; K114-T116 WeakPolarHBondContact CD-O 3.42Å; K114-T116 WeakPolarHBondContact CE-O 3.43Å; K114-T116 WeakPolarHBondContact CG-O 3.31Å; T116-V118 HydrophobicContact CG2-CG2 3.94Å; T116-T145 HydrophobicContact CG2-CG2 4.35Å; T116-D148 WeakPolarHBondContact CB-OD2 3.46Å; T116-D148 HydrophobicContact CG2-CB 3.96Å; T116-D148 PolarHBondContact OG1-OD2 3.24Å
117	F	92.5	Very high	73.5	Confident	31 Å²	31	95.9 Å²	95.9	14%	0.136	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.8	174.1	-64.9	-97.5	0	0	0	109.6	V99 G100 P102 K114 E121 L122 T125 L129	V99-F117 WeakPolarHBondContact CA-O 3.5Å; V99-F117 WeakPolarHBondContact CB-O 3.35Å; G100-F117 PolarHBondContact N-O 2.79Å; G100-F117 PolarHBondContact O-N 3.24Å; P102-F117 HydrophobicContact CG-CE2 3.95Å; K114-F117 HydrophobicContact CB-CZ 4.16Å; K114-F117 HydrophobicContact CD-CE1 4.37Å; K114-F117 WeakPolarHBondContact O-CE2 3.44Å; F117-E121 HydrophobicContact CB-CB 4.3Å; F117-E121 HydrophobicContact CD1-CB 4.22Å; F117-L122 HydrophobicContact CB-CD2 4.01Å; F117-L122 VanDerWaalsContact O-CD2 3.29Å; F117-L122 WeakPolarHBondContact O-CD2 3.25Å; F117-T125 HydrophobicContact CD1-CG2 3.39Å; F117-T125 HydrophobicContact CE1-CG2 3.4Å; F117-T125 VanDerWaalsContact CE1-CG2 3.4Å; F117-T125 HydrophobicContact CG-CG2 4.21Å; F117-T125 HydrophobicContact CZ-CG2 4.23Å; F117-L129 HydrophobicContact CB-CD1 3.94Å; F117-L129 HydrophobicContact CD2-CD1 4.24Å; F117-L129 HydrophobicContact CD2-CD2 3.58Å; F117-L129 HydrophobicContact CE2-CD2 3.88Å; F117-L129 HydrophobicContact CG-CD1 4.02Å; F117-L129 HydrophobicContact CG-CD2 4.2Å
118	V	93.7	Very high	75.2	Confident	3 Å²	3	99.4 Å²	99.4	2%	0.018	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	145	-173	-174	0	0	0	0	110.8	I95 V99 T116 Q120 E121 I149 Y152	I95-V118 HydrophobicContact CD1-CG1 4.2Å; V99-V118 HydrophobicContact CG1-CG2 3.98Å; T116-V118 HydrophobicContact CG2-CG2 3.94Å; V118-Q120 PolarHBondContact O-N 2.87Å; V118-E121 PolarHBondContact N-OE2 3.5Å; V118-E121 VanDerWaalsContact N-OE2 3.08Å; V118-E121 VanDerWaalsContact O-CB 3.27Å; V118-E121 WeakPolarHBondContact O-CB 3.34Å; V118-E121 VanDerWaalsContact O-CG 3.3Å; V118-E121 WeakPolarHBondContact O-CG 3.47Å; V118-E121 PolarHBondContact O-N 2.76Å; V118-I149 HydrophobicContact CG1-CB 4.45Å; V118-I149 HydrophobicContact CG1-CG1 4.11Å; V118-I149 HydrophobicContact CG1-CG2 4.5Å; V118-I149 HydrophobicContact CG2-CG1 4.27Å; V118-Y152 HydrophobicContact CB-CD1 4.1Å; V118-Y152 HydrophobicContact CB-CD2 4.15Å; V118-Y152 HydrophobicContact CB-CG 3.8Å; V118-Y152 HydrophobicContact CG1-CD1 3.67Å; V118-Y152 HydrophobicContact CG1-CE1 4.32Å; V118-Y152 HydrophobicContact CG1-CG 3.83Å; V118-Y152 WeakPolarHBondContact O-CE2 3.32Å
119	G	90.6	Very high	77	Confident	14 Å²	14	93 Å²	93	14%	0.144	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	63.2	-126.5	169.7	0	0	0	0	0	113	E121 L122	G119-E121 PolarHBondContact O-N 3.46Å; G119-L122 WeakPolarHBondContact O-CB 3.38Å; G119-L122 WeakPolarHBondContact O-CG 3.46Å; G119-L122 PolarHBondContact O-N 3.2Å
120	Q	88.5	Confident	79.1	Confident	126 Å²	126	91.9 Å²	91.9	59%	0.589	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-66.9	-19.7	-177.7	-60.4	-170.6	-1.6	0	0	113.1	V118 L122 N123 Y152	V118-Q120 PolarHBondContact O-N 2.87Å; Q120-L122 PolarHBondContact O-N 2.94Å; Q120-N123 PolarHBondContact O-N 3.09Å; Q120-Y152 PolarHBondContact N-OH 3.19Å; Q120-Y152 VanDerWaalsContact N-OH 3.07Å
121	E	88.1	Confident	80.7	Confident	43 Å²	43	93.2 Å²	93.2	20%	0.201	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-63.9	-26.4	179.3	-57.3	176.4	159.4	0	0	112	K114 F117 V118 G119 N123 N124 T125 Y152	K114-E121 IonicContact NZ-OE1 3.77Å; K114-E121 PolarHBondContact NZ-OE1 2.9Å; K114-E121 IonicContact NZ-OE2 3.43Å; K114-E121 PolarHBondContact NZ-OE2 2.82Å; F117-E121 HydrophobicContact CB-CB 4.3Å; F117-E121 HydrophobicContact CD1-CB 4.22Å; V118-E121 PolarHBondContact N-OE2 3.5Å; V118-E121 VanDerWaalsContact N-OE2 3.08Å; V118-E121 VanDerWaalsContact O-CB 3.27Å; V118-E121 WeakPolarHBondContact O-CB 3.34Å; V118-E121 VanDerWaalsContact O-CG 3.3Å; V118-E121 WeakPolarHBondContact O-CG 3.47Å; V118-E121 PolarHBondContact O-N 2.76Å; G119-E121 PolarHBondContact O-N 3.46Å; E121-N123 PolarHBondContact O-N 2.75Å; E121-N124 PolarHBondContact O-N 3.42Å; E121-T125 VanDerWaalsContact O-CG2 3.3Å; E121-T125 WeakPolarHBondContact O-CG2 3.36Å; E121-Y152 HydrophobicContact CG-CE2 3.77Å
122	L	86.4	Confident	82.4	Confident	38 Å²	38	91.7 Å²	91.7	20%	0.199	46%	0.456	C	S	.	.	G	3₁₀ helix	trans	-60.4	-25.8	177.7	-61.2	176.6	0	0	0	113.5	F117 G119 Q120 L129 L131	F117-L122 HydrophobicContact CB-CD2 4.01Å; F117-L122 VanDerWaalsContact O-CD2 3.29Å; F117-L122 WeakPolarHBondContact O-CD2 3.25Å; G119-L122 WeakPolarHBondContact O-CB 3.38Å; G119-L122 WeakPolarHBondContact O-CG 3.46Å; G119-L122 PolarHBondContact O-N 3.2Å; Q120-L122 PolarHBondContact O-N 2.94Å; L122-L129 HydrophobicContact CD2-CD1 4.17Å; L122-L131 HydrophobicContact CD1-CD2 4.44Å; L122-L131 HydrophobicContact CD2-CD2 4.17Å
123	N	80.1	Confident	83.8	Confident	137 Å²	137	85.4 Å²	85.4	73%	0.733	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-93.1	-18.1	-178.1	-62.1	-32.5	0	0	0	112.7	Q120 E121	Q120-N123 PolarHBondContact O-N 3.09Å; E121-N123 PolarHBondContact O-N 2.75Å
124	N	71.2	Confident	85.1	Confident	132 Å²	132	77 Å²	77	71%	0.706	39%	0.391	S	S	*	.	S	Bend	trans	-110.3	29.1	-166.4	-71.3	-23.4	0	0	0	112.5	E121	E121-N124 PolarHBondContact O-N 3.42Å
125	T	66.3	Low	85.9	Confident	39 Å²	39	72.3 Å²	72.3	24%	0.239	37%	0.371	C	S	.	.			trans	-114.2	130.5	-175.7	49.5	0	0	0	0	112.8	F117 E121 V127 L129	F117-T125 HydrophobicContact CD1-CG2 3.39Å; F117-T125 HydrophobicContact CE1-CG2 3.4Å; F117-T125 VanDerWaalsContact CE1-CG2 3.4Å; F117-T125 HydrophobicContact CG-CG2 4.21Å; F117-T125 HydrophobicContact CZ-CG2 4.23Å; E121-T125 VanDerWaalsContact O-CG2 3.3Å; E121-T125 WeakPolarHBondContact O-CG2 3.36Å; T125-V127 PolarHBondContact O-N 3.26Å; T125-V127 VanDerWaalsContact O-N 3.15Å; T125-L129 HydrophobicContact CG2-CD1 4.16Å; T125-L129 WeakPolarHBondContact OG1-CD1 3.43Å
126	N	74.6	Confident	86.3	Confident	181 Å²	181	73.5 Å²	73.5	97%	0.968	37%	0.369	S	S	*	.	S	Bend	trans	-74.6	10.6	167.6	-63.6	-33	0	0	0	113
127	V	78.2	Confident	86.1	Confident	73 Å²	73	76.9 Å²	76.9	44%	0.442	38%	0.383	S	S	.	.	S	Bend	trans	-116.7	137.6	-173.3	-177.5	0	0	0	0	108.6	P102 T125 L129	P102-V127 HydrophobicContact CB-CG1 4.28Å; T125-V127 PolarHBondContact O-N 3.26Å; T125-V127 VanDerWaalsContact O-N 3.15Å; V127-L129 HydrophobicContact CG1-CD2 4.38Å; V127-L129 PolarHBondContact O-N 3.16Å
128	H	81.9	Confident	85.9	Confident	169 Å²	169	75.8 Å²	75.8	78%	0.782	38%	0.381	S	S	*	.			trans	-70.7	115.7	171	-75.8	-66.6	0	0	0	110.4	Y103	Y103-H128 PolarHBondContact N-O 3.07Å
129	L	86.9	Confident	85.7	Confident	39 Å²	39	77.4 Å²	77.4	20%	0.204	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	138.2	-179.5	-59.5	177.1	0	0	0	110.7	P102 F117 L122 T125 V127	P102-L129 HydrophobicContact CG-CD2 4.3Å; F117-L129 HydrophobicContact CB-CD1 3.94Å; F117-L129 HydrophobicContact CD2-CD1 4.24Å; F117-L129 HydrophobicContact CD2-CD2 3.58Å; F117-L129 HydrophobicContact CE2-CD2 3.88Å; F117-L129 HydrophobicContact CG-CD1 4.02Å; F117-L129 HydrophobicContact CG-CD2 4.2Å; L122-L129 HydrophobicContact CD2-CD1 4.17Å; T125-L129 HydrophobicContact CG2-CD1 4.16Å; T125-L129 WeakPolarHBondContact OG1-CD1 3.43Å; V127-L129 HydrophobicContact CG1-CD2 4.38Å; V127-L129 PolarHBondContact O-N 3.16Å
130	K	88.3	Confident	85.8	Confident	133 Å²	133	77.2 Å²	77.2	58%	0.578	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	124.5	164.4	-178.9	-178.7	178.8	-178.3	0	108.6	K101 V132	K101-K130 PolarHBondContact N-O 2.95Å; K101-K130 PolarHBondContact O-N 2.87Å; K130-V132 HydrophobicContact CG-CG2 4.44Å
131	L	89.4	Confident	86.1	Confident	103 Å²	103	75 Å²	75	54%	0.539	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	130.5	177.3	-60.8	179.8	0	0	0	111	M98 V99 L122	M98-L131 HydrophobicContact CE-CB 3.7Å; V99-L131 CarbonylContact O-C 3.5Å; V99-L131 VanDerWaalsContact O-CA 3.3Å; V99-L131 WeakPolarHBondContact O-CA 3.24Å; L122-L131 HydrophobicContact CD1-CD2 4.44Å; L122-L131 HydrophobicContact CD2-CD2 4.17Å
132	V	91.4	Very high	86.4	Confident	43 Å²	43	75 Å²	75	26%	0.261	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	140.5	-178.8	-178.1	0	0	0	0	109.4	V99 K101 K130	V99-V132 HydrophobicContact CG2-CB 4.27Å; V99-V132 PolarHBondContact N-O 2.66Å; V99-V132 PolarHBondContact O-N 3.08Å; K101-V132 HydrophobicContact CG-CG2 4.37Å; K130-V132 HydrophobicContact CG-CG2 4.44Å
133	N	93.6	Very high	86.8	Confident	39 Å²	39	75.8 Å²	75.8	21%	0.209	38%	0.381	C	S	.	.			trans	-103.8	122.7	170.9	-158.1	-44.4	0	0	0	109.5	T78 M98 L135	T78-N133 PolarHBondContact O-ND2 2.94Å; M98-N133 HydrophobicContact CE-CB 4.32Å; M98-N133 HydrophobicContact SD-CB 3.52Å; M98-N133 VanDerWaalsContact SD-CB 3.52Å; M98-N133 PolarHBondContact SD-ND2 2.84Å; M98-N133 VanDerWaalsContact SD-ND2 3.4Å; N133-L135 PolarHBondContact O-N 3.35Å; N133-L135 PolarHBondContact OD1-N 2.72Å; N133-L135 PolarHBondContact OD1-O 2.91Å
134	P	94.8	Very high	87.5	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	38%	0.378	C	S	.	.	S	Bend	trans	-76.2	-6	176.8	31.1	-33.8	0	0	0	113.4	T97 V141 D142 T145 V146 I149	T97-P134 HydrophobicContact CG2-CG 4.24Å; T97-P134 WeakPolarHBondContact O-CD 3.22Å; P134-V141 VanDerWaalsContact O-CG2 3.23Å; P134-V141 WeakPolarHBondContact O-CG2 3.37Å; P134-V141 PolarHBondContact O-N 3.27Å; P134-D142 HydrophobicContact CB-CB 4.06Å; P134-D142 PolarHBondContact O-N 3.5Å; P134-T145 HydrophobicContact CB-CG2 3.76Å; P134-T145 HydrophobicContact CG-CG2 3.83Å; P134-V146 HydrophobicContact CB-CG2 4.04Å; P134-V146 HydrophobicContact CG-CG2 4.14Å; P134-I149 HydrophobicContact CG-CD1 3.68Å
135	L	94.2	Very high	88.6	Confident	8 Å²	8	68.9 Å²	68.9	4%	0.042	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	135.9	174.1	-72.2	71.5	0	0	0	110.9	L76 T78 T97 N133 I139 I140 V146	L76-L135 HydrophobicContact CD1-CD1 4.38Å; L76-L135 HydrophobicContact CD2-CD1 4.24Å; L76-L135 HydrophobicContact CD2-CD2 4.37Å; L76-L135 HydrophobicContact CG-CD1 4.31Å; L76-L135 HydrophobicContact CG-CD2 4.07Å; T78-L135 HydrophobicContact CG2-CB 3.99Å; T78-L135 HydrophobicContact CG2-CD2 4.14Å; T97-L135 HydrophobicContact CG2-CD1 3.75Å; N133-L135 PolarHBondContact O-N 3.35Å; N133-L135 PolarHBondContact OD1-N 2.72Å; N133-L135 PolarHBondContact OD1-O 2.91Å; L135-I139 CarbonylContact C-O 3.55Å; L135-I139 VanDerWaalsContact CA-O 3.27Å; L135-I139 WeakPolarHBondContact CA-O 3.39Å; L135-I140 HydrophobicContact CD1-CG1 4.28Å; L135-I140 HydrophobicContact CG-CG1 4.06Å; L135-V146 HydrophobicContact CD1-CG2 4.07Å
136	R	90.6	Very high	90	Very high	181 Å²	181	67 Å²	67	68%	0.683	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	117.1	169.4	-66.5	-166.8	-179	-149.8	3.6	109.9	G138 I139 V141	R136-G138 PolarHBondContact O-N 2.88Å; R136-G138 VanDerWaalsContact O-N 3.15Å; R136-I139 PolarHBondContact N-O 2.95Å; R136-I139 PolarHBondContact O-N 3.29Å; R136-V141 HydrophobicContact CB-CG1 4.1Å; R136-V141 HydrophobicContact CG-CG1 4.1Å; R136-V141 HydrophobicContact CG-CG2 4.02Å
137	H	87.9	Confident	91.1	Very high	82 Å²	82	61.9 Å²	61.9	38%	0.38	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.8	43.4	-177.2	-49.2	137.5	0	0	0	113.5	I139 G222 V223 R241	H137-I139 VanDerWaalsContact C-N 3.34Å; H137-I139 PolarHBondContact O-N 3.27Å; H137-G222 WeakPolarHBondContact CA-O 3.26Å; H137-G222 PolarHBondContact CD2-O 3Å; H137-G222 VanDerWaalsContact CD2-O 3.28Å; H137-V223 HydrophobicContact CB-CB 4.47Å; H137-R241 PolarHBondContact O-NH2 3.04Å
138	G	86.6	Confident	91.9	Very high	8 Å²	8	61.4 Å²	61.4	8%	0.082	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	-10.8	179.1	0	0	0	0	0	115.3	T78 R136 P172	T78-G138 VanDerWaalsContact CG2-CA 3.42Å; R136-G138 PolarHBondContact O-N 2.88Å; R136-G138 VanDerWaalsContact O-N 3.15Å; G138-P172 WeakPolarHBondContact O-CG 3.38Å
139	I	90.7	Very high	92.6	Very high	37 Å²	37	53.4 Å²	53.4	19%	0.19	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	131.6	179.9	-52.5	-55.3	0	0	0	109.8	L135 R136 H137 V141	L135-I139 CarbonylContact C-O 3.55Å; L135-I139 VanDerWaalsContact CA-O 3.27Å; L135-I139 WeakPolarHBondContact CA-O 3.39Å; R136-I139 PolarHBondContact N-O 2.95Å; R136-I139 PolarHBondContact O-N 3.29Å; H137-I139 VanDerWaalsContact C-N 3.34Å; H137-I139 PolarHBondContact O-N 3.27Å; I139-V141 PolarHBondContact O-N 3.45Å
140	I	93.5	Very high	93	Very high	10 Å²	10	51.5 Å²	51.5	5%	0.051	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	126.3	174.3	-60.3	168.1	0	0	0	109	L76 L135 W143 V146 Y183	L76-I140 HydrophobicContact CD2-CD1 3.82Å; L76-I140 HydrophobicContact CD2-CG1 4.17Å; L135-I140 HydrophobicContact CD1-CG1 4.28Å; L135-I140 HydrophobicContact CG-CG1 4.06Å; I140-W143 HydrophobicContact CB-CD2 4.41Å; I140-W143 HydrophobicContact CB-CH2 4.43Å; I140-W143 HydrophobicContact CB-CZ2 4.05Å; I140-W143 HydrophobicContact CD1-CE3 4.04Å; I140-W143 HydrophobicContact CD1-CH2 3.48Å; I140-W143 VanDerWaalsContact CD1-CH2 3.48Å; I140-W143 HydrophobicContact CD1-CZ2 3.98Å; I140-W143 HydrophobicContact CD1-CZ3 3.51Å; I140-W143 HydrophobicContact CG2-CD2 3.66Å; I140-W143 HydrophobicContact CG2-CE3 4.09Å; I140-W143 HydrophobicContact CG2-CG 3.91Å; I140-W143 HydrophobicContact CG2-CZ2 4.21Å; I140-V146 HydrophobicContact CD1-CG1 4.47Å; I140-V146 HydrophobicContact CD1-CG2 4.33Å; I140-V146 HydrophobicContact CG1-CG2 4.21Å; I140-V146 HydrophobicContact CG2-CG2 3.71Å; I140-Y183 HydrophobicContact CD1-CE1 3.96Å; I140-Y183 HydrophobicContact CD1-CE2 4.46Å; I140-Y183 VanDerWaalsContact CD1-OH 3.24Å; I140-Y183 WeakPolarHBondContact CD1-OH 3.38Å
141	V	93.5	Very high	93.4	Very high	81 Å²	81	48.5 Å²	48.5	49%	0.491	24%	0.239	S	C	.	.	S	Bend	trans	-113.2	-18	176.5	-62.3	0	0	0	0	113.2	P134 R136 I139	P134-V141 VanDerWaalsContact O-CG2 3.23Å; P134-V141 WeakPolarHBondContact O-CG2 3.37Å; P134-V141 PolarHBondContact O-N 3.27Å; R136-V141 HydrophobicContact CB-CG1 4.1Å; R136-V141 HydrophobicContact CG-CG1 4.1Å; R136-V141 HydrophobicContact CG-CG2 4.02Å; I139-V141 PolarHBondContact O-N 3.45Å
142	D	94.7	Very high	93.7	Very high	41 Å²	41	44.5 Å²	44.5	22%	0.219	22%	0.217	C	C	.	.			trans	-135	96.2	-179.5	-176	-30	0	0	0	107.9	K101 P134 T145 V146	K101-D142 IonicContact NZ-OD2 3.87Å; K101-D142 PolarHBondContact NZ-OD2 2.83Å; P134-D142 HydrophobicContact CB-CB 4.06Å; P134-D142 PolarHBondContact O-N 3.5Å; D142-T145 VanDerWaalsContact OD1-CB 3.25Å; D142-T145 WeakPolarHBondContact OD1-CB 3.09Å; D142-T145 PolarHBondContact OD1-N 3.11Å; D142-T145 PolarHBondContact OD1-OG1 3.36Å; D142-T145 PolarHBondContact OD2-OG1 2.87Å; D142-V146 PolarHBondContact O-N 3.36Å
143	W	94.4	Very high	94	Very high	55 Å²	55	42.4 Å²	42.4	21%	0.208	21%	0.205	C	C	.	.	H	α-helix	trans	-73.7	-34.8	-175.1	-74.9	94.5	0	0	0	112.5	I140 T145 V146 Q147 N179 K182 Y183 M186	I140-W143 HydrophobicContact CB-CD2 4.41Å; I140-W143 HydrophobicContact CB-CH2 4.43Å; I140-W143 HydrophobicContact CB-CZ2 4.05Å; I140-W143 HydrophobicContact CD1-CE3 4.04Å; I140-W143 HydrophobicContact CD1-CH2 3.48Å; I140-W143 VanDerWaalsContact CD1-CH2 3.48Å; I140-W143 HydrophobicContact CD1-CZ2 3.98Å; I140-W143 HydrophobicContact CD1-CZ3 3.51Å; I140-W143 HydrophobicContact CG2-CD2 3.66Å; I140-W143 HydrophobicContact CG2-CE3 4.09Å; I140-W143 HydrophobicContact CG2-CG 3.91Å; I140-W143 HydrophobicContact CG2-CZ2 4.21Å; W143-T145 VanDerWaalsContact C-N 3.29Å; W143-T145 PolarHBondContact O-N 2.85Å; W143-V146 PolarHBondContact O-N 2.89Å; W143-V146 VanDerWaalsContact O-N 3.1Å; W143-Q147 PolarHBondContact O-N 2.92Å; W143-N179 HydrophobicContact CH2-CB 3.98Å; W143-N179 HydrophobicContact CZ2-CB 3.95Å; W143-K182 HydrophobicContact CD2-CB 3.91Å; W143-K182 HydrophobicContact CD2-CG 4.34Å; W143-K182 HydrophobicContact CE3-CB 3.93Å; W143-K182 HydrophobicContact CH2-CB 3.58Å; W143-K182 HydrophobicContact CZ2-CB 3.56Å; W143-K182 HydrophobicContact CZ2-CG 4.16Å; W143-K182 HydrophobicContact CZ3-CB 3.77Å; W143-Y183 HydrophobicContact CH2-CD1 4.31Å; W143-Y183 HydrophobicContact CH2-CD2 4.11Å; W143-Y183 HydrophobicContact CH2-CE1 4.26Å; W143-Y183 HydrophobicContact CH2-CE2 4.08Å; W143-Y183 HydrophobicContact CH2-CG 4.24Å; W143-Y183 AromaticContact CZ3-CD1 3.84Å; W143-Y183 HydrophobicContact CZ3-CD1 3.84Å; W143-Y183 HydrophobicContact CZ3-CD2 4.45Å; W143-Y183 AromaticContact CZ3-CE1 3.88Å; W143-Y183 HydrophobicContact CZ3-CE1 3.88Å; W143-Y183 HydrophobicContact CZ3-CE2 4.5Å; W143-Y183 HydrophobicContact CZ3-CG 4.14Å; W143-M186 HydrophobicContact CZ3-CE 4.45Å
144	D	94.4	Very high	94.1	Very high	123 Å²	123	40.6 Å²	40.6	66%	0.658	20%	0.195	S	C	*	.	H	α-helix	trans	-61.1	-43.4	177.4	-57.2	-36.7	0	0	0	110.2	V146 Q147 D148	D144-V146 VanDerWaalsContact C-N 3.34Å; D144-V146 PolarHBondContact O-N 2.9Å; D144-Q147 WeakPolarHBondContact O-CB 3.36Å; D144-Q147 PolarHBondContact O-N 2.87Å; D144-D148 PolarHBondContact O-N 2.78Å
145	T	94.9	Very high	94.1	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.012	22%	0.215	C	C	.	.	H	α-helix	trans	-66.3	-35.1	175.3	-58	0	0	0	0	112.2	V99 K101 T116 P134 D142 W143 Q147 D148 I149	V99-T145 HydrophobicContact CB-CG2 4.12Å; V99-T145 HydrophobicContact CG1-CG2 3.64Å; V99-T145 HydrophobicContact CG2-CG2 3.42Å; V99-T145 VanDerWaalsContact CG2-CG2 3.42Å; K101-T145 PolarHBondContact NZ-OG1 3.39Å; K101-T145 VanDerWaalsContact NZ-OG1 3.07Å; T116-T145 HydrophobicContact CG2-CG2 4.35Å; P134-T145 HydrophobicContact CB-CG2 3.76Å; P134-T145 HydrophobicContact CG-CG2 3.83Å; D142-T145 VanDerWaalsContact OD1-CB 3.25Å; D142-T145 WeakPolarHBondContact OD1-CB 3.09Å; D142-T145 PolarHBondContact OD1-N 3.11Å; D142-T145 PolarHBondContact OD1-OG1 3.36Å; D142-T145 PolarHBondContact OD2-OG1 2.87Å; W143-T145 VanDerWaalsContact C-N 3.29Å; W143-T145 PolarHBondContact O-N 2.85Å; T145-Q147 VanDerWaalsContact C-N 3.34Å; T145-D148 PolarHBondContact O-N 3.02Å; T145-I149 HydrophobicContact CG2-CD1 4.45Å; T145-I149 VanDerWaalsContact O-CG1 3.28Å; T145-I149 WeakPolarHBondContact O-CG1 3.45Å; T145-I149 PolarHBondContact O-N 3.01Å
146	V	96.1	Very high	94.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.6	-40.4	173.6	170.8	0	0	0	0	110.9	L76 P134 L135 I140 D142 W143 D144 D148 I149 W150 M186	L76-V146 HydrophobicContact CD2-CG1 3.74Å; L76-V146 HydrophobicContact CD2-CG2 4.21Å; P134-V146 HydrophobicContact CB-CG2 4.04Å; P134-V146 HydrophobicContact CG-CG2 4.14Å; L135-V146 HydrophobicContact CD1-CG2 4.07Å; I140-V146 HydrophobicContact CD1-CG1 4.47Å; I140-V146 HydrophobicContact CD1-CG2 4.33Å; I140-V146 HydrophobicContact CG1-CG2 4.21Å; I140-V146 HydrophobicContact CG2-CG2 3.71Å; D142-V146 PolarHBondContact O-N 3.36Å; W143-V146 PolarHBondContact O-N 2.89Å; W143-V146 VanDerWaalsContact O-N 3.1Å; D144-V146 VanDerWaalsContact C-N 3.34Å; D144-V146 PolarHBondContact O-N 2.9Å; V146-D148 VanDerWaalsContact C-N 3.35Å; V146-I149 WeakPolarHBondContact O-CB 3.45Å; V146-I149 PolarHBondContact O-N 2.9Å; V146-W150 HydrophobicContact CG1-CD2 4.47Å; V146-W150 HydrophobicContact CG1-CZ2 4.44Å; V146-W150 PolarHBondContact O-N 2.72Å; V146-M186 HydrophobicContact CG1-CE 4.22Å; V146-M186 HydrophobicContact CG1-SD 4.39Å
147	Q	96.4	Very high	94.3	Very high	73 Å²	73	44.2 Å²	44.2	34%	0.341	22%	0.215	S	C	.	.	H	α-helix	trans	-60.3	-44.6	174	-172.5	178	-53.2	0	0	111	W143 D144 T145 I149 W150 E151 M186 F191	W143-Q147 PolarHBondContact O-N 2.92Å; D144-Q147 WeakPolarHBondContact O-CB 3.36Å; D144-Q147 PolarHBondContact O-N 2.87Å; T145-Q147 VanDerWaalsContact C-N 3.34Å; Q147-I149 VanDerWaalsContact C-N 3.33Å; Q147-I149 PolarHBondContact O-N 2.74Å; Q147-W150 PolarHBondContact O-N 2.88Å; Q147-W150 VanDerWaalsContact O-N 3.15Å; Q147-E151 WeakPolarHBondContact O-CB 3.32Å; Q147-E151 PolarHBondContact O-N 3Å; Q147-M186 HydrophobicContact CB-CG 4.33Å; Q147-M186 HydrophobicContact CB-SD 3.75Å; Q147-M186 HydrophobicContact CG-CG 4.15Å; Q147-M186 HydrophobicContact CG-SD 4.17Å; Q147-F191 HydrophobicContact CG-CE2 4.06Å; Q147-F191 HydrophobicContact CG-CZ 3.88Å
148	D	95.6	Very high	94.6	Very high	63 Å²	63	41.1 Å²	41.1	34%	0.337	20%	0.201	S	C	.	.	H	α-helix	trans	-59.7	-40.9	174.7	-73.3	-24.7	0	0	0	112.4	T116 D144 T145 V146 W150 Y152	T116-D148 WeakPolarHBondContact CB-OD2 3.46Å; T116-D148 HydrophobicContact CG2-CB 3.96Å; T116-D148 PolarHBondContact OG1-OD2 3.24Å; D144-D148 PolarHBondContact O-N 2.78Å; T145-D148 PolarHBondContact O-N 3.02Å; V146-D148 VanDerWaalsContact C-N 3.35Å; D148-W150 VanDerWaalsContact C-N 3.33Å; D148-W150 PolarHBondContact O-N 2.83Å; D148-Y152 WeakPolarHBondContact O-CB 3.24Å; D148-Y152 PolarHBondContact O-N 2.88Å
149	I	96.5	Very high	95.1	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.8	-43.6	175.7	-68.6	167.1	0	0	0	110.6	C81 I95 T97 V99 V118 P134 T145 V146 Q147 L153	C81-I149 HydrophobicContact CB-CG2 4.38Å; I95-I149 HydrophobicContact CD1-CG2 3.9Å; T97-I149 HydrophobicContact CG2-CD1 4.17Å; V99-I149 HydrophobicContact CG1-CD1 3.75Å; V99-I149 HydrophobicContact CG1-CG1 3.63Å; V118-I149 HydrophobicContact CG1-CB 4.45Å; V118-I149 HydrophobicContact CG1-CG1 4.11Å; V118-I149 HydrophobicContact CG1-CG2 4.5Å; V118-I149 HydrophobicContact CG2-CG1 4.27Å; P134-I149 HydrophobicContact CG-CD1 3.68Å; T145-I149 HydrophobicContact CG2-CD1 4.45Å; T145-I149 VanDerWaalsContact O-CG1 3.28Å; T145-I149 WeakPolarHBondContact O-CG1 3.45Å; T145-I149 PolarHBondContact O-N 3.01Å; V146-I149 WeakPolarHBondContact O-CB 3.45Å; V146-I149 PolarHBondContact O-N 2.9Å; Q147-I149 VanDerWaalsContact C-N 3.33Å; Q147-I149 PolarHBondContact O-N 2.74Å; I149-L153 VanDerWaalsContact O-CB 3.23Å; I149-L153 WeakPolarHBondContact O-CB 3.34Å; I149-L153 PolarHBondContact O-N 3.11Å
150	W	96.7	Very high	95.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-73.4	-37.4	-177.9	-74	17.9	0	0	0	112.2	V74 L76 V146 Q147 D148 L153 F154 V169 Y183 M186 L187 F191	V74-W150 HydrophobicContact CG1-CZ2 3.92Å; L76-W150 HydrophobicContact CD2-CZ2 4.27Å; V146-W150 HydrophobicContact CG1-CD2 4.47Å; V146-W150 HydrophobicContact CG1-CZ2 4.44Å; V146-W150 PolarHBondContact O-N 2.72Å; Q147-W150 PolarHBondContact O-N 2.88Å; Q147-W150 VanDerWaalsContact O-N 3.15Å; D148-W150 VanDerWaalsContact C-N 3.33Å; D148-W150 PolarHBondContact O-N 2.83Å; W150-L153 PolarHBondContact O-N 2.85Å; W150-F154 HydrophobicContact CB-CD2 4.46Å; W150-F154 HydrophobicContact CB-CE2 4.16Å; W150-F154 HydrophobicContact CE3-CE2 4.45Å; W150-F154 WeakPolarHBondContact O-CB 3.43Å; W150-F154 VanDerWaalsContact O-CD2 3.25Å; W150-F154 WeakPolarHBondContact O-CD2 3.41Å; W150-F154 WeakPolarHBondContact O-CG 3.15Å; W150-F154 PolarHBondContact O-N 2.92Å; W150-V169 HydrophobicContact CH2-CB 4.33Å; W150-V169 HydrophobicContact CH2-CG1 3.73Å; W150-V169 HydrophobicContact CH2-CG2 3.56Å; W150-V169 HydrophobicContact CZ2-CG1 4.01Å; W150-V169 HydrophobicContact CZ2-CG2 4.41Å; W150-V169 HydrophobicContact CZ3-CG2 4.1Å; W150-Y183 AromaticContact CH2-CD1 3.53Å; W150-Y183 HydrophobicContact CH2-CD1 3.53Å; W150-Y183 AromaticContact CH2-CE1 3.46Å; W150-Y183 HydrophobicContact CH2-CE1 3.46Å; W150-Y183 VanDerWaalsContact CH2-CE1 3.46Å; W150-Y183 HydrophobicContact CZ2-CD1 4.3Å; W150-Y183 AromaticContact CZ2-CE1 3.76Å; W150-Y183 HydrophobicContact CZ2-CE1 3.76Å; W150-Y183 HydrophobicContact CZ3-CD1 4.22Å; W150-Y183 HydrophobicContact CZ3-CE1 4.48Å; W150-M186 HydrophobicContact CD2-CE 4.02Å; W150-M186 HydrophobicContact CE3-CE 3.4Å; W150-M186 HydrophobicContact CE3-SD 4.1Å; W150-M186 HydrophobicContact CH2-CE 3.62Å; W150-M186 HydrophobicContact CZ2-CE 4.21Å; W150-M186 HydrophobicContact CZ3-CE 3.18Å; W150-M186 HydrophobicContact CZ3-SD 4.42Å; W150-L187 HydrophobicContact CE3-CD2 4.14Å; W150-L187 HydrophobicContact CZ3-CD1 4.25Å; W150-L187 HydrophobicContact CZ3-CD2 3.71Å; W150-L187 HydrophobicContact CZ3-CG 3.93Å; W150-F191 HydrophobicContact CB-CE2 3.94Å; W150-F191 HydrophobicContact CB-CZ 3.74Å; W150-F191 HydrophobicContact CE3-CE2 4.1Å
151	E	96.1	Very high	95.4	Very high	69 Å²	69	49.1 Å²	49.1	32%	0.322	24%	0.237	S	C	.	.	H	α-helix	trans	-59.6	-46.6	172.1	177.8	70.3	175.6	0	0	110.6	Q147 R155 F191	Q147-E151 WeakPolarHBondContact O-CB 3.32Å; Q147-E151 PolarHBondContact O-N 3Å; E151-R155 WeakPolarHBondContact O-CB 3.33Å; E151-R155 PolarHBondContact O-N 2.87Å; E151-R155 WeakPolarHBondContact OE1-CD 3.2Å; E151-R155 IonicContact OE1-CZ 3.68Å; E151-R155 IonicContact OE1-NE 3.88Å; E151-R155 PolarHBondContact OE1-NE 2.84Å; E151-R155 IonicContact OE1-NH2 3.46Å; E151-R155 IonicContact OE2-CZ 3.92Å; E151-R155 IonicContact OE2-NE 3.65Å; E151-R155 PolarHBondContact OE2-NE 3.45Å; E151-R155 VanDerWaalsContact OE2-NE 3.08Å; E151-R155 IonicContact OE2-NH2 3.51Å; E151-F191 HydrophobicContact CB-CE1 4.11Å; E151-F191 HydrophobicContact CB-CZ 4.3Å; E151-F191 WeakPolarHBondContact OE2-CE1 3.34Å
152	Y	95.9	Very high	95.5	Very high	19 Å²	19	45.3 Å²	45.3	8%	0.075	21%	0.214	C	C	.	.	H	α-helix	trans	-60	-46.8	173.1	-179.3	-93.8	0	0	0	111.6	I95 V118 Q120 E121 D148 F154 Q156 E157	I95-Y152 HydrophobicContact CD1-CD1 4.04Å; I95-Y152 HydrophobicContact CG2-CE1 4.47Å; V118-Y152 HydrophobicContact CB-CD1 4.1Å; V118-Y152 HydrophobicContact CB-CD2 4.15Å; V118-Y152 HydrophobicContact CB-CG 3.8Å; V118-Y152 HydrophobicContact CG1-CD1 3.67Å; V118-Y152 HydrophobicContact CG1-CE1 4.32Å; V118-Y152 HydrophobicContact CG1-CG 3.83Å; V118-Y152 WeakPolarHBondContact O-CE2 3.32Å; Q120-Y152 PolarHBondContact N-OH 3.19Å; Q120-Y152 VanDerWaalsContact N-OH 3.07Å; E121-Y152 HydrophobicContact CG-CE2 3.77Å; D148-Y152 WeakPolarHBondContact O-CB 3.24Å; D148-Y152 PolarHBondContact O-N 2.88Å; Y152-F154 PolarHBondContact O-N 3.39Å; Y152-Q156 HydrophobicContact CD2-CB 3.83Å; Y152-Q156 HydrophobicContact CD2-CG 3.69Å; Y152-Q156 HydrophobicContact CE2-CB 3.81Å; Y152-Q156 HydrophobicContact CE2-CG 3.97Å; Y152-Q156 HydrophobicContact CG-CB 4.29Å; Y152-Q156 HydrophobicContact CG-CG 4.37Å; Y152-Q156 WeakPolarHBondContact O-CA 3.38Å; Y152-Q156 VanDerWaalsContact O-CB 3.24Å; Y152-Q156 WeakPolarHBondContact O-CB 3.43Å; Y152-Q156 PolarHBondContact O-N 2.81Å; Y152-E157 HydrophobicContact CD1-CG 3.95Å; Y152-E157 HydrophobicContact CE1-CG 3.51Å; Y152-E157 WeakPolarHBondContact CE1-OE1 3.43Å; Y152-E157 PolarHBondContact O-N 3.44Å; Y152-E157 VanDerWaalsContact O-N 3.16Å; Y152-E157 PolarHBondContact OH-OE1 2.88Å
153	L	96.3	Very high	95.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	22%	0.224	C	C	.	.	I	π-helix	trans	-62.1	-44.8	-178.9	-178.2	63.4	0	0	0	112.5	V74 C83 H93 I95 I149 W150 E157 M158	V74-L153 HydrophobicContact CG1-CD2 4.34Å; C83-L153 HydrophobicContact CB-CD1 3.68Å; C83-L153 HydrophobicContact CB-CD2 3.51Å; C83-L153 HydrophobicContact CB-CG 3.82Å; H93-L153 HydrophobicContact CB-CD1 4.22Å; I95-L153 HydrophobicContact CD1-CB 4.15Å; I95-L153 HydrophobicContact CD1-CD1 4.05Å; I95-L153 HydrophobicContact CG1-CD1 4.34Å; I149-L153 VanDerWaalsContact O-CB 3.23Å; I149-L153 WeakPolarHBondContact O-CB 3.34Å; I149-L153 PolarHBondContact O-N 3.11Å; W150-L153 PolarHBondContact O-N 2.85Å; L153-E157 HydrophobicContact CD1-CB 4.25Å; L153-E157 WeakPolarHBondContact O-CB 3.35Å; L153-M158 WeakPolarHBondContact O-CB 3.3Å; L153-M158 WeakPolarHBondContact O-CG 3.34Å; L153-M158 PolarHBondContact O-N 2.94Å
154	F	96.5	Very high	95.6	Very high	1 Å²	1	50.6 Å²	50.6	0%	0.004	24%	0.239	C	C	.	.	I	π-helix	trans	-74.1	-47.3	-179.6	-64.6	-37.5	0	0	0	112	V72 V74 W150 Y152 K159 I160 P162 V167 F191	V72-F154 HydrophobicContact CG1-CE1 4.03Å; V74-F154 HydrophobicContact CG2-CE1 3.95Å; V74-F154 HydrophobicContact CG2-CZ 3.98Å; W150-F154 HydrophobicContact CB-CD2 4.46Å; W150-F154 HydrophobicContact CB-CE2 4.16Å; W150-F154 HydrophobicContact CE3-CE2 4.45Å; W150-F154 WeakPolarHBondContact O-CB 3.43Å; W150-F154 VanDerWaalsContact O-CD2 3.25Å; W150-F154 WeakPolarHBondContact O-CD2 3.41Å; W150-F154 WeakPolarHBondContact O-CG 3.15Å; W150-F154 PolarHBondContact O-N 2.92Å; Y152-F154 PolarHBondContact O-N 3.39Å; F154-K159 WeakPolarHBondContact O-CA 3.27Å; F154-K159 PolarHBondContact O-N 2.97Å; F154-I160 HydrophobicContact CB-CG1 4.16Å; F154-I160 HydrophobicContact CD1-CD1 3.97Å; F154-I160 HydrophobicContact CD1-CG1 4.37Å; F154-I160 PolarHBondContact O-N 3.49Å; F154-P162 HydrophobicContact CD2-CB 4.02Å; F154-P162 HydrophobicContact CD2-CG 4.41Å; F154-P162 HydrophobicContact CE2-CB 4.39Å; F154-P162 HydrophobicContact CG-CB 4.44Å; F154-V167 HydrophobicContact CZ-CG1 4.45Å; F154-V167 HydrophobicContact CZ-CG2 4.44Å; F154-F191 HydrophobicContact CD2-CD1 4.18Å; F154-F191 HydrophobicContact CD2-CE1 4.12Å; F154-F191 HydrophobicContact CD2-CZ 4.47Å; F154-F191 HydrophobicContact CE2-CD1 4.46Å; F154-F191 HydrophobicContact CE2-CD2 4.45Å; F154-F191 HydrophobicContact CE2-CE2 4.49Å; F154-F191 HydrophobicContact CE2-CG 4.44Å
155	R	95.4	Very high	95.7	Very high	109 Å²	109	45.4 Å²	45.4	41%	0.411	21%	0.211	S	C	.	.	I	π-helix	trans	-87.3	-39	-171.8	-60.4	-162.2	-171.4	-94.2	0.3	114.2	E151	E151-R155 WeakPolarHBondContact O-CB 3.33Å; E151-R155 PolarHBondContact O-N 2.87Å; E151-R155 WeakPolarHBondContact OE1-CD 3.2Å; E151-R155 IonicContact OE1-CZ 3.68Å; E151-R155 IonicContact OE1-NE 3.88Å; E151-R155 PolarHBondContact OE1-NE 2.84Å; E151-R155 IonicContact OE1-NH2 3.46Å; E151-R155 IonicContact OE2-CZ 3.92Å; E151-R155 IonicContact OE2-NE 3.65Å; E151-R155 PolarHBondContact OE2-NE 3.45Å; E151-R155 VanDerWaalsContact OE2-NE 3.08Å; E151-R155 IonicContact OE2-NH2 3.51Å
156	Q	94.1	Very high	95.8	Very high	113 Å²	113	46.2 Å²	46.2	53%	0.528	22%	0.218	S	C	.	.	I	π-helix	trans	-93.4	-48.8	-174.2	-55	-57.1	-38.4	0	0	112.1	Y152	Y152-Q156 HydrophobicContact CD2-CB 3.83Å; Y152-Q156 HydrophobicContact CD2-CG 3.69Å; Y152-Q156 HydrophobicContact CE2-CB 3.81Å; Y152-Q156 HydrophobicContact CE2-CG 3.97Å; Y152-Q156 HydrophobicContact CG-CB 4.29Å; Y152-Q156 HydrophobicContact CG-CG 4.37Å; Y152-Q156 WeakPolarHBondContact O-CA 3.38Å; Y152-Q156 VanDerWaalsContact O-CB 3.24Å; Y152-Q156 WeakPolarHBondContact O-CB 3.43Å; Y152-Q156 PolarHBondContact O-N 2.81Å
157	E	94.4	Very high	95.9	Very high	42 Å²	42	46.2 Å²	46.2	20%	0.196	22%	0.218	C	C	.	.	I	π-helix	trans	-78.6	-62.4	-178.4	-68.1	-73.9	153.2	0	0	111	H93 I95 Y152 L153	H93-E157 IonicContact CD2-OE2 2.86Å; H93-E157 PolarHBondContact NE2-O 3.34Å; I95-E157 HydrophobicContact CG2-CG 3.88Å; Y152-E157 HydrophobicContact CD1-CG 3.95Å; Y152-E157 HydrophobicContact CE1-CG 3.51Å; Y152-E157 WeakPolarHBondContact CE1-OE1 3.43Å; Y152-E157 PolarHBondContact O-N 3.44Å; Y152-E157 VanDerWaalsContact O-N 3.16Å; Y152-E157 PolarHBondContact OH-OE1 2.88Å; L153-E157 HydrophobicContact CD1-CB 4.25Å; L153-E157 WeakPolarHBondContact O-CB 3.35Å
158	M	94.9	Very high	96	Very high	18 Å²	18	42.8 Å²	42.8	9%	0.089	20%	0.202	C	C	.	.	I	π-helix	trans	-76.5	-27.6	-176.1	-71	-163.9	67.3	0	0	114.3	V72 C83 F85 L153 I160	V72-M158 HydrophobicContact CG1-CE 4.24Å; V72-M158 HydrophobicContact CG1-SD 4.04Å; V72-M158 HydrophobicContact CG2-CE 4.29Å; C83-M158 HydrophobicContact CB-SD 4.07Å; C83-M158 PolarHBondContact SG-SD 3.22Å; F85-M158 HydrophobicContact CD1-CE 4.45Å; F85-M158 HydrophobicContact CD2-CE 4.22Å; F85-M158 HydrophobicContact CE1-CE 4.11Å; F85-M158 HydrophobicContact CE2-CE 3.88Å; F85-M158 HydrophobicContact CZ-CE 3.84Å; L153-M158 WeakPolarHBondContact O-CB 3.3Å; L153-M158 WeakPolarHBondContact O-CG 3.34Å; L153-M158 PolarHBondContact O-N 2.94Å; M158-I160 HydrophobicContact CB-CD1 4.44Å; M158-I160 HydrophobicContact CB-CG1 4.05Å; M158-I160 HydrophobicContact CB-CG2 4.17Å; M158-I160 HydrophobicContact CE-CD1 4.08Å; M158-I160 HydrophobicContact CE-CG2 4.44Å; M158-I160 HydrophobicContact SD-CD1 4.21Å
159	K	96.2	Very high	96.1	Very high	174 Å²	174	39.8 Å²	39.8	76%	0.757	19%	0.186	S	C	*	.			trans	57.7	47.5	-176.1	-55	178.4	-178.7	177.8	0	112.9	F154	F154-K159 WeakPolarHBondContact O-CA 3.27Å; F154-K159 PolarHBondContact O-N 2.97Å
160	I	95.4	Very high	96.1	Very high	23 Å²	23	39.9 Å²	39.9	12%	0.118	19%	0.187	C	C	.	.			trans	-116.9	159.7	178.2	65.1	168.9	0	0	0	111.8	V72 F85 F154 M158	V72-I160 HydrophobicContact CG2-CD1 3.72Å; F85-I160 HydrophobicContact CE1-CG2 4.38Å; F85-I160 HydrophobicContact CZ-CG2 3.77Å; F154-I160 HydrophobicContact CB-CG1 4.16Å; F154-I160 HydrophobicContact CD1-CD1 3.97Å; F154-I160 HydrophobicContact CD1-CG1 4.37Å; F154-I160 PolarHBondContact O-N 3.49Å; M158-I160 HydrophobicContact CB-CD1 4.44Å; M158-I160 HydrophobicContact CB-CG1 4.05Å; M158-I160 HydrophobicContact CB-CG2 4.17Å; M158-I160 HydrophobicContact CE-CD1 4.08Å; M158-I160 HydrophobicContact CE-CG2 4.44Å; M158-I160 HydrophobicContact SD-CD1 4.21Å
161	A	95.8	Very high	95.9	Very high	25 Å²	25	39.9 Å²	39.9	21%	0.207	19%	0.187	C	C	.	.			trans	-93.4	107.7	167.7	0	0	0	0	0	109	E163 E164 H165	A161-E163 HydrophobicContact CB-CG 4.21Å; A161-E163 PolarHBondContact O-N 3.32Å; A161-E163 VanDerWaalsContact O-N 3.15Å; A161-E164 HydrophobicContact CB-CG 4.06Å; A161-E164 WeakPolarHBondContact O-CB 3.44Å; A161-E164 PolarHBondContact O-N 3.38Å; A161-H165 PolarHBondContact O-CD2 2.99Å; A161-H165 VanDerWaalsContact O-CD2 3.32Å
162	P	95.1	Very high	95.7	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.006	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-58.3	-28.7	-175.6	23.3	-33.8	0	0	0	113.6	F154 E164 H165 F191 T193	F154-P162 HydrophobicContact CD2-CB 4.02Å; F154-P162 HydrophobicContact CD2-CG 4.41Å; F154-P162 HydrophobicContact CE2-CB 4.39Å; F154-P162 HydrophobicContact CG-CB 4.44Å; P162-E164 PolarHBondContact O-N 2.89Å; P162-E164 VanDerWaalsContact O-N 3.11Å; P162-H165 PolarHBondContact O-N 2.9Å; P162-F191 HydrophobicContact CB-CB 4.13Å; P162-F191 HydrophobicContact CB-CD1 4.45Å; P162-F191 HydrophobicContact CG-CB 4.25Å; P162-F191 HydrophobicContact CG-CD1 4.02Å; P162-T193 HydrophobicContact CB-CG2 4.2Å
163	E	96.1	Very high	95.4	Very high	92 Å²	92	36.4 Å²	36.4	43%	0.43	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-60.8	-15.8	174.8	59.8	-93.9	-139.3	0	0	114.3	A161 N192 P194	A161-E163 HydrophobicContact CB-CG 4.21Å; A161-E163 PolarHBondContact O-N 3.32Å; A161-E163 VanDerWaalsContact O-N 3.15Å; E163-N192 WeakPolarHBondContact CA-O 3.3Å; E163-N192 HydrophobicContact CB-CB 4.17Å; E163-P194 WeakPolarHBondContact O-CD 3.28Å
164	E	95.8	Very high	95	Very high	115 Å²	115	39.7 Å²	39.7	54%	0.537	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-94	-11	177.2	-62.2	-176.8	167.9	0	0	112.8	T69 A161 P162	T69-E164 WeakPolarHBondContact CB-O 3.43Å; T69-E164 HydrophobicContact CG2-CB 4.3Å; T69-E164 PolarHBondContact OG1-O 2.53Å; A161-E164 HydrophobicContact CB-CG 4.06Å; A161-E164 WeakPolarHBondContact O-CB 3.44Å; A161-E164 PolarHBondContact O-N 3.38Å; P162-E164 PolarHBondContact O-N 2.89Å; P162-E164 VanDerWaalsContact O-N 3.11Å
165	H	96.3	Very high	94.6	Very high	15 Å²	15	40 Å²	40	7%	0.069	19%	0.192	C	C	.	.	S	Bend	trans	-126.2	132.2	-167.1	-65.8	-82.4	0	0	0	114.1	K70 V72 F85 A161 P162 P194	K70-H165 PolarHBondContact O-ND1 3.32Å; V72-H165 HydrophobicContact CG2-CB 3.88Å; F85-H165 AromaticContact CE1-CE1 3.64Å; F85-H165 AromaticContact CE1-ND1 3.95Å; A161-H165 PolarHBondContact O-CD2 2.99Å; A161-H165 VanDerWaalsContact O-CD2 3.32Å; P162-H165 PolarHBondContact O-N 2.9Å; H165-P194 VanDerWaalsContact O-CD 3.31Å; H165-P194 WeakPolarHBondContact O-CD 3.08Å
166	A	97	Very high	94.1	Very high	18 Å²	18	37.5 Å²	37.5	15%	0.149	19%	0.19	C	C	.	.			trans	-65.7	140.4	165.6	0	0	0	0	0	110.8	A71 V72 A195 W416	A71-A166 CarbonylContact C-O 3.24Å; A71-A166 VanDerWaalsContact CA-O 3.25Å; A71-A166 WeakPolarHBondContact CA-O 3.42Å; A71-A166 HydrophobicContact CB-CB 4.22Å; V72-A166 PolarHBondContact N-O 3.06Å; A166-A195 CarbonylContact C-O 3.52Å; A166-A195 VanDerWaalsContact CA-O 3.22Å; A166-A195 WeakPolarHBondContact CA-O 3.45Å; A166-A195 HydrophobicContact CB-CB 3.98Å; A166-W416 HydrophobicContact CB-CD2 4.36Å; A166-W416 HydrophobicContact CB-CE3 4.19Å; A166-W416 HydrophobicContact CB-CH2 4.1Å; A166-W416 HydrophobicContact CB-CZ2 4.26Å; A166-W416 HydrophobicContact CB-CZ3 4.08Å
167	V	98.1	Very high	93.6	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.006	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	119.6	-175.7	-175.7	0	0	0	0	112.1	V72 V74 F154 V169 L187 T193 A195 M196 H197	V72-V167 CarbonylContact O-C 3.57Å; V72-V167 WeakPolarHBondContact O-CA 3.48Å; V74-V167 HydrophobicContact CG2-CG1 3.89Å; F154-V167 HydrophobicContact CZ-CG1 4.45Å; F154-V167 HydrophobicContact CZ-CG2 4.44Å; V167-V169 HydrophobicContact CG1-CG2 3.96Å; V167-L187 HydrophobicContact CB-CD2 4.05Å; V167-L187 HydrophobicContact CG1-CD2 4.03Å; V167-L187 HydrophobicContact CG2-CD2 4.22Å; V167-T193 HydrophobicContact CG2-CG2 3.78Å; V167-A195 PolarHBondContact N-O 2.82Å; V167-M196 CarbonylContact O-C 3.55Å; V167-M196 WeakPolarHBondContact O-CA 3.23Å; V167-H197 PolarHBondContact O-N 3.49Å
168	L	98.2	Very high	93.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	125.1	167.6	-172.9	152.1	0	0	0	109.7	V72 V73 V74 H197 A199 L204 L406 A407 F412 W416	V72-L168 PolarHBondContact O-N 3.11Å; V73-L168 CarbonylContact C-O 3.51Å; V73-L168 WeakPolarHBondContact CA-O 3.32Å; V73-L168 HydrophobicContact CG1-CD2 4.1Å; V73-L168 HydrophobicContact CG2-CB 4.36Å; V74-L168 PolarHBondContact N-O 2.98Å; L168-H197 CarbonylContact C-O 3.58Å; L168-H197 WeakPolarHBondContact CA-O 3.25Å; L168-A199 HydrophobicContact CD2-CB 4.47Å; L168-L204 HydrophobicContact CD2-CD1 4.02Å; L168-L406 HydrophobicContact CD1-CD2 4.17Å; L168-A407 HydrophobicContact CD1-CB 4.09Å; L168-F412 HydrophobicContact CD1-CE1 4.16Å; L168-F412 HydrophobicContact CD1-CZ 3.87Å; L168-W416 HydrophobicContact CB-CH2 3.89Å; L168-W416 HydrophobicContact CB-CZ3 4.21Å
169	V	97.3	Very high	93	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	134.4	178.2	-176.9	0	0	0	0	110	V74 W150 V167 Y183 L187 H197 I198 A199	V74-V169 WeakPolarHBondContact O-CA 3.13Å; W150-V169 HydrophobicContact CH2-CB 4.33Å; W150-V169 HydrophobicContact CH2-CG1 3.73Å; W150-V169 HydrophobicContact CH2-CG2 3.56Å; W150-V169 HydrophobicContact CZ2-CG1 4.01Å; W150-V169 HydrophobicContact CZ2-CG2 4.41Å; W150-V169 HydrophobicContact CZ3-CG2 4.1Å; V167-V169 HydrophobicContact CG1-CG2 3.96Å; V169-Y183 HydrophobicContact CG1-CD1 4.17Å; V169-Y183 HydrophobicContact CG1-CE1 3.78Å; V169-Y183 HydrophobicContact CG1-CE2 4.46Å; V169-L187 HydrophobicContact CG2-CD1 3.8Å; V169-H197 PolarHBondContact N-O 3.15Å; V169-I198 WeakPolarHBondContact O-CA 3.5Å; V169-A199 PolarHBondContact O-N 2.94Å
170	S	95.7	Very high	92.6	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.014	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	136.8	168.9	81.7	0	0	0	0	111.1	V74 D75 A199 Q201	V74-S170 PolarHBondContact O-N 3.4Å; D75-S170 WeakPolarHBondContact CA-OG 3.41Å; D75-S170 PolarHBondContact OD1-OG 2.94Å; S170-A199 CarbonylContact C-O 3.53Å; S170-A199 WeakPolarHBondContact CA-O 3.38Å; S170-Q201 PolarHBondContact OG-NE2 3.25Å
171	D	93.9	Very high	92.5	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	143.3	178	-165.4	29.2	0	0	0	110.4	S175 I198 A199 Y200 Q201 F435	D171-S175 WeakPolarHBondContact OD1-CB 3.47Å; D171-S175 WeakPolarHBondContact OD2-CB 3.37Å; D171-S175 PolarHBondContact OD2-OG 3.33Å; D171-I198 HydrophobicContact CB-CG2 3.47Å; D171-I198 VanDerWaalsContact CB-CG2 3.47Å; D171-A199 PolarHBondContact N-O 3.11Å; D171-Y200 CarbonylContact O-C 3.59Å; D171-Y200 VanDerWaalsContact O-CA 3.27Å; D171-Y200 WeakPolarHBondContact O-CA 3.36Å; D171-Q201 PolarHBondContact O-N 2.96Å; D171-F435 HydrophobicContact CB-CZ 4.37Å
172	P	92.1	Very high	92.5	Very high	5 Å²	5	37.2 Å²	37.2	3%	0.032	19%	0.191	C	C	.	.			trans	-63	153.2	-178.6	-25.1	35.3	0	0	0	113.4	G138 L174 S175 Y225	G138-P172 WeakPolarHBondContact O-CG 3.38Å; P172-L174 PolarHBondContact O-N 3.25Å; P172-S175 WeakPolarHBondContact O-CB 3.3Å; P172-S175 PolarHBondContact O-N 3.18Å; P172-S175 VanDerWaalsContact O-N 3.14Å; P172-S175 PolarHBondContact O-OG 3.21Å; P172-Y225 HydrophobicContact CB-CE2 4.2Å
173	P	88.4	Confident	92.5	Very high	10 Å²	10	37.4 Å²	37.4	7%	0.065	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-24	-173.2	-25.9	34.8	0	0	0	116.3	S202 Y225 V227	P173-S202 WeakPolarHBondContact CG-OG 3.38Å; P173-Y225 HydrophobicContact CG-CD1 4.42Å; P173-Y225 HydrophobicContact CG-CG 4.32Å; P173-V227 HydrophobicContact CB-CG2 4.11Å; P173-V227 HydrophobicContact CG-CG2 3.78Å
174	L	87.8	Confident	92.5	Very high	68 Å²	68	33 Å²	33	36%	0.356	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.4	30.3	-177.9	-59	179.9	0	0	0	111.2	P172 Y225 P236 T239 R241	P172-L174 PolarHBondContact O-N 3.25Å; L174-Y225 HydrophobicContact CD1-CE1 4.25Å; L174-Y225 HydrophobicContact CG-CE1 4.34Å; L174-P236 HydrophobicContact CD2-CB 4.46Å; L174-T239 HydrophobicContact CD1-CG2 4.06Å; L174-T239 HydrophobicContact CD2-CG2 4.24Å; L174-T239 HydrophobicContact CG-CG2 4.11Å; L174-R241 HydrophobicContact CD1-CB 4.04Å
175	S	87.8	Confident	92.5	Very high	8 Å²	8	31.3 Å²	31.3	6%	0.056	16%	0.163	C	C	.	.			trans	-65	144.2	176.1	61.7	0	0	0	0	111.5	D171 P172	D171-S175 WeakPolarHBondContact OD1-CB 3.47Å; D171-S175 WeakPolarHBondContact OD2-CB 3.37Å; D171-S175 PolarHBondContact OD2-OG 3.33Å; P172-S175 WeakPolarHBondContact O-CB 3.3Å; P172-S175 PolarHBondContact O-N 3.18Å; P172-S175 VanDerWaalsContact O-N 3.14Å; P172-S175 PolarHBondContact O-OG 3.21Å
176	P	86.4	Confident	92.5	Very high	56 Å²	56	31 Å²	31	36%	0.364	16%	0.161	S	C	.	.			trans	-59.4	140.6	171	-24	33.6	0	0	0	111.7	T178 N179	P176-T178 PolarHBondContact O-N 3.32Å; P176-N179 VanDerWaalsContact O-CB 3.32Å; P176-N179 WeakPolarHBondContact O-CB 3.27Å; P176-N179 PolarHBondContact O-N 2.67Å
177	H	83.6	Confident	92.5	Very high	114 Å²	114	30.1 Å²	30.1	53%	0.528	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-30.2	178.4	-62	-37.5	0	0	0	113.3	N179 R180 Y431	H177-N179 PolarHBondContact O-N 3.17Å; H177-R180 PolarHBondContact CE1-NH2 3.09Å; H177-R180 PolarHBondContact ND1-NH1 2.95Å; H177-R180 PolarHBondContact ND1-NH2 2.91Å; H177-R180 VanDerWaalsContact O-CB 3.25Å; H177-R180 WeakPolarHBondContact O-CB 3.3Å; H177-R180 VanDerWaalsContact O-CG 3.31Å; H177-R180 WeakPolarHBondContact O-CG 3.14Å; H177-R180 PolarHBondContact O-N 3.17Å; H177-R180 VanDerWaalsContact O-N 3.07Å; H177-Y431 HydrophobicContact CB-CE1 4.37Å
178	T	87.1	Confident	92.5	Very high	90 Å²	90	30.1 Å²	30.1	55%	0.552	15%	0.154	S	C	*	.	H	α-helix	trans	-61.4	-25.6	176	51.6	0	0	0	0	113.2	P176 R180 E181 K182	P176-T178 PolarHBondContact O-N 3.32Å; T178-R180 PolarHBondContact O-N 3.15Å; T178-E181 PolarHBondContact O-N 3.08Å; T178-K182 PolarHBondContact O-N 3.31Å
179	N	89.6	Confident	92.4	Very high	10 Å²	10	35.3 Å²	35.3	5%	0.053	18%	0.179	C	C	.	.	H	α-helix	trans	-62	-28.5	175.9	-71.9	12	0	0	0	111.6	W143 P176 H177 K182 Y183	W143-N179 HydrophobicContact CH2-CB 3.98Å; W143-N179 HydrophobicContact CZ2-CB 3.95Å; P176-N179 VanDerWaalsContact O-CB 3.32Å; P176-N179 WeakPolarHBondContact O-CB 3.27Å; P176-N179 PolarHBondContact O-N 2.67Å; H177-N179 PolarHBondContact O-N 3.17Å; N179-K182 PolarHBondContact O-N 2.98Å; N179-Y183 HydrophobicContact CB-CD2 4.47Å; N179-Y183 HydrophobicContact CB-CE2 4.39Å; N179-Y183 WeakPolarHBondContact O-CD2 3.21Å; N179-Y183 PolarHBondContact O-N 3.38Å
180	R	87.9	Confident	92.3	Very high	16 Å²	16	37.5 Å²	37.5	6%	0.06	20%	0.196	C	C	.	.	H	α-helix	trans	-64.9	-44.5	-179.6	-59	171.8	-177.7	160.6	-6.4	111.4	H177 T178 K182 Y183 A184 I198 Y200 F435	H177-R180 PolarHBondContact CE1-NH2 3.09Å; H177-R180 PolarHBondContact ND1-NH1 2.95Å; H177-R180 PolarHBondContact ND1-NH2 2.91Å; H177-R180 VanDerWaalsContact O-CB 3.25Å; H177-R180 WeakPolarHBondContact O-CB 3.3Å; H177-R180 VanDerWaalsContact O-CG 3.31Å; H177-R180 WeakPolarHBondContact O-CG 3.14Å; H177-R180 PolarHBondContact O-N 3.17Å; H177-R180 VanDerWaalsContact O-N 3.07Å; T178-R180 PolarHBondContact O-N 3.15Å; R180-K182 VanDerWaalsContact C-N 3.34Å; R180-Y183 PolarHBondContact O-N 3.42Å; R180-A184 PolarHBondContact O-N 2.61Å; R180-I198 HydrophobicContact CB-CD1 4.04Å; R180-I198 HydrophobicContact CG-CD1 4.2Å; R180-Y200 PolarHBondContact NH2-OH 3.39Å; R180-Y200 VanDerWaalsContact NH2-OH 3.1Å; R180-F435 HydrophobicContact CG-CE2 4.16Å; R180-F435 VanDerWaalsContact CZ-CD2 3.49Å; R180-F435 VanDerWaalsContact NE-CD2 3.34Å; R180-F435 VanDerWaalsContact NH2-CD2 3.3Å
181	E	92.7	Very high	92.4	Very high	77 Å²	77	37.7 Å²	37.7	36%	0.36	20%	0.197	S	C	.	.	H	α-helix	trans	-65.5	-42.1	177.3	-59.4	-175	177.8	0	0	110.1	T178 Y183 A184 E185 P427 Y431	T178-E181 PolarHBondContact O-N 3.08Å; E181-Y183 PolarHBondContact O-N 3.26Å; E181-A184 WeakPolarHBondContact O-CB 3.45Å; E181-A184 PolarHBondContact O-N 3.43Å; E181-A184 VanDerWaalsContact O-N 3.11Å; E181-E185 WeakPolarHBondContact O-CB 3.49Å; E181-E185 PolarHBondContact O-N 3.47Å; E181-P427 HydrophobicContact CG-CB 3.88Å; E181-P427 HydrophobicContact CG-CG 4.31Å; E181-Y431 PolarHBondContact OE1-OH 3.09Å
182	K	95.1	Very high	92.6	Very high	83 Å²	83	40.9 Å²	40.9	36%	0.361	21%	0.214	S	C	.	.	H	α-helix	trans	-63.7	-39.2	176	-76.6	-72.8	168.1	-158.5	0	113.7	W143 T178 N179 R180 A184 E185 M186	W143-K182 HydrophobicContact CD2-CB 3.91Å; W143-K182 HydrophobicContact CD2-CG 4.34Å; W143-K182 HydrophobicContact CE3-CB 3.93Å; W143-K182 HydrophobicContact CH2-CB 3.58Å; W143-K182 HydrophobicContact CZ2-CB 3.56Å; W143-K182 HydrophobicContact CZ2-CG 4.16Å; W143-K182 HydrophobicContact CZ3-CB 3.77Å; T178-K182 PolarHBondContact O-N 3.31Å; N179-K182 PolarHBondContact O-N 2.98Å; R180-K182 VanDerWaalsContact C-N 3.34Å; K182-A184 VanDerWaalsContact C-N 3.31Å; K182-E185 WeakPolarHBondContact CD-OE2 3.49Å; K182-E185 WeakPolarHBondContact CE-OE2 3.49Å; K182-E185 IonicContact NZ-OE1 2.81Å; K182-E185 PolarHBondContact NZ-OE1 3.39Å; K182-E185 IonicContact NZ-OE2 3.82Å; K182-E185 PolarHBondContact NZ-OE2 3.03Å; K182-M186 WeakPolarHBondContact O-CB 3.42Å; K182-M186 PolarHBondContact O-N 3.13Å
183	Y	95.6	Very high	92.8	Very high	4 Å²	4	40.6 Å²	40.6	2%	0.016	21%	0.212	C	C	.	.	H	α-helix	trans	-62.6	-39.9	171.4	-79.9	-57.5	0	0	0	112	I140 W143 W150 V169 N179 R180 E181 M186 L187 I198	I140-Y183 HydrophobicContact CD1-CE1 3.96Å; I140-Y183 HydrophobicContact CD1-CE2 4.46Å; I140-Y183 VanDerWaalsContact CD1-OH 3.24Å; I140-Y183 WeakPolarHBondContact CD1-OH 3.38Å; W143-Y183 HydrophobicContact CH2-CD1 4.31Å; W143-Y183 HydrophobicContact CH2-CD2 4.11Å; W143-Y183 HydrophobicContact CH2-CE1 4.26Å; W143-Y183 HydrophobicContact CH2-CE2 4.08Å; W143-Y183 HydrophobicContact CH2-CG 4.24Å; W143-Y183 AromaticContact CZ3-CD1 3.84Å; W143-Y183 HydrophobicContact CZ3-CD1 3.84Å; W143-Y183 HydrophobicContact CZ3-CD2 4.45Å; W143-Y183 AromaticContact CZ3-CE1 3.88Å; W143-Y183 HydrophobicContact CZ3-CE1 3.88Å; W143-Y183 HydrophobicContact CZ3-CE2 4.5Å; W143-Y183 HydrophobicContact CZ3-CG 4.14Å; W150-Y183 AromaticContact CH2-CD1 3.53Å; W150-Y183 HydrophobicContact CH2-CD1 3.53Å; W150-Y183 AromaticContact CH2-CE1 3.46Å; W150-Y183 HydrophobicContact CH2-CE1 3.46Å; W150-Y183 VanDerWaalsContact CH2-CE1 3.46Å; W150-Y183 HydrophobicContact CZ2-CD1 4.3Å; W150-Y183 AromaticContact CZ2-CE1 3.76Å; W150-Y183 HydrophobicContact CZ2-CE1 3.76Å; W150-Y183 HydrophobicContact CZ3-CD1 4.22Å; W150-Y183 HydrophobicContact CZ3-CE1 4.48Å; V169-Y183 HydrophobicContact CG1-CD1 4.17Å; V169-Y183 HydrophobicContact CG1-CE1 3.78Å; V169-Y183 HydrophobicContact CG1-CE2 4.46Å; N179-Y183 HydrophobicContact CB-CD2 4.47Å; N179-Y183 HydrophobicContact CB-CE2 4.39Å; N179-Y183 WeakPolarHBondContact O-CD2 3.21Å; N179-Y183 PolarHBondContact O-N 3.38Å; R180-Y183 PolarHBondContact O-N 3.42Å; E181-Y183 PolarHBondContact O-N 3.26Å; Y183-M186 HydrophobicContact CD1-CE 3.83Å; Y183-M186 HydrophobicContact CE1-CE 4.27Å; Y183-L187 VanDerWaalsContact O-CB 3.27Å; Y183-L187 WeakPolarHBondContact O-CB 3.4Å; Y183-L187 WeakPolarHBondContact O-CG 3.47Å; Y183-L187 PolarHBondContact O-N 3.14Å; Y183-I198 HydrophobicContact CD2-CD1 4Å; Y183-I198 HydrophobicContact CG-CD1 4.33Å
184	A	95.7	Very high	93.2	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-69.2	-44.6	178.9	0	0	0	0	0	112.8	R180 E181 K182 M186 L187 F188 M196 Y422 L430	R180-A184 PolarHBondContact O-N 2.61Å; E181-A184 WeakPolarHBondContact O-CB 3.45Å; E181-A184 PolarHBondContact O-N 3.43Å; E181-A184 VanDerWaalsContact O-N 3.11Å; K182-A184 VanDerWaalsContact C-N 3.31Å; A184-M186 VanDerWaalsContact C-N 3.33Å; A184-M186 PolarHBondContact O-N 3.09Å; A184-L187 PolarHBondContact O-N 3.1Å; A184-F188 HydrophobicContact CB-CD2 4.03Å; A184-F188 HydrophobicContact CB-CE2 4.31Å; A184-F188 VanDerWaalsContact O-CB 3.28Å; A184-F188 WeakPolarHBondContact O-CB 3.35Å; A184-F188 PolarHBondContact O-N 3.05Å; A184-M196 VanDerWaalsContact CA-SD 3.55Å; A184-M196 HydrophobicContact CB-CE 4.4Å; A184-M196 HydrophobicContact CB-SD 3.82Å; A184-Y422 HydrophobicContact CB-CD2 4.12Å; A184-Y422 HydrophobicContact CB-CE2 3.72Å; A184-L430 HydrophobicContact CB-CD1 3.4Å; A184-L430 VanDerWaalsContact CB-CD1 3.4Å; A184-L430 HydrophobicContact CB-CD2 4.21Å; A184-L430 HydrophobicContact CB-CG 4.43Å
185	E	95.7	Very high	93.7	Very high	79 Å²	79	39 Å²	39	37%	0.369	21%	0.206	S	C	.	.	I	π-helix	trans	-52.8	-52.5	171.6	-176.5	-175.7	159.7	0	0	109.9	E181 K182 L187 E189 A190	E181-E185 WeakPolarHBondContact O-CB 3.49Å; E181-E185 PolarHBondContact O-N 3.47Å; K182-E185 WeakPolarHBondContact CD-OE2 3.49Å; K182-E185 WeakPolarHBondContact CE-OE2 3.49Å; K182-E185 IonicContact NZ-OE1 2.81Å; K182-E185 PolarHBondContact NZ-OE1 3.39Å; K182-E185 IonicContact NZ-OE2 3.82Å; K182-E185 PolarHBondContact NZ-OE2 3.03Å; E185-L187 PolarHBondContact O-N 3.47Å; E185-E189 WeakPolarHBondContact O-CA 3.22Å; E185-E189 WeakPolarHBondContact O-CB 3.35Å; E185-E189 PolarHBondContact O-N 3.01Å; E185-A190 PolarHBondContact O-N 3.46Å
186	M	96.4	Very high	94.1	Very high	8 Å²	8	38.6 Å²	38.6	4%	0.039	20%	0.204	C	C	.	.	I	π-helix	trans	-63.4	-46.6	179.7	-174.6	177	51.9	0	0	112.7	W143 V146 Q147 W150 K182 Y183 A184 A190 F191	W143-M186 HydrophobicContact CZ3-CE 4.45Å; V146-M186 HydrophobicContact CG1-CE 4.22Å; V146-M186 HydrophobicContact CG1-SD 4.39Å; Q147-M186 HydrophobicContact CB-CG 4.33Å; Q147-M186 HydrophobicContact CB-SD 3.75Å; Q147-M186 HydrophobicContact CG-CG 4.15Å; Q147-M186 HydrophobicContact CG-SD 4.17Å; W150-M186 HydrophobicContact CD2-CE 4.02Å; W150-M186 HydrophobicContact CE3-CE 3.4Å; W150-M186 HydrophobicContact CE3-SD 4.1Å; W150-M186 HydrophobicContact CH2-CE 3.62Å; W150-M186 HydrophobicContact CZ2-CE 4.21Å; W150-M186 HydrophobicContact CZ3-CE 3.18Å; W150-M186 HydrophobicContact CZ3-SD 4.42Å; K182-M186 WeakPolarHBondContact O-CB 3.42Å; K182-M186 PolarHBondContact O-N 3.13Å; Y183-M186 HydrophobicContact CD1-CE 3.83Å; Y183-M186 HydrophobicContact CE1-CE 4.27Å; A184-M186 VanDerWaalsContact C-N 3.33Å; A184-M186 PolarHBondContact O-N 3.09Å; M186-A190 WeakPolarHBondContact O-CB 3.35Å; M186-A190 PolarHBondContact O-N 3.24Å; M186-F191 HydrophobicContact CG-CD2 3.85Å; M186-F191 HydrophobicContact CG-CE2 3.56Å; M186-F191 VanDerWaalsContact O-CD2 3.25Å; M186-F191 WeakPolarHBondContact O-CD2 3.39Å; M186-F191 PolarHBondContact O-N 3.38Å; M186-F191 HydrophobicContact SD-CE2 4.03Å
187	L	97.4	Very high	94.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.188	C	C	.	.	I	π-helix	trans	-74.6	-39.2	-175.8	-76	170.8	0	0	0	113.7	W150 V167 V169 Y183 A184 E185 F191 N192 T193 M196	W150-L187 HydrophobicContact CE3-CD2 4.14Å; W150-L187 HydrophobicContact CZ3-CD1 4.25Å; W150-L187 HydrophobicContact CZ3-CD2 3.71Å; W150-L187 HydrophobicContact CZ3-CG 3.93Å; V167-L187 HydrophobicContact CB-CD2 4.05Å; V167-L187 HydrophobicContact CG1-CD2 4.03Å; V167-L187 HydrophobicContact CG2-CD2 4.22Å; V169-L187 HydrophobicContact CG2-CD1 3.8Å; Y183-L187 VanDerWaalsContact O-CB 3.27Å; Y183-L187 WeakPolarHBondContact O-CB 3.4Å; Y183-L187 WeakPolarHBondContact O-CG 3.47Å; Y183-L187 PolarHBondContact O-N 3.14Å; A184-L187 PolarHBondContact O-N 3.1Å; E185-L187 PolarHBondContact O-N 3.47Å; L187-F191 HydrophobicContact CD2-CD2 4.39Å; L187-F191 CarbonylContact O-C 3.57Å; L187-N192 PolarHBondContact O-N 2.94Å; L187-T193 HydrophobicContact CB-CG2 4.5Å; L187-T193 HydrophobicContact CD2-CG2 3.99Å; L187-T193 WeakPolarHBondContact O-CB 3.49Å; L187-T193 WeakPolarHBondContact O-CG2 3.15Å; L187-T193 PolarHBondContact O-N 3.23Å; L187-T193 PolarHBondContact O-OG1 2.96Å; L187-M196 HydrophobicContact CB-SD 4.1Å; L187-M196 HydrophobicContact CD1-CB 3.84Å; L187-M196 HydrophobicContact CD1-CE 3.62Å; L187-M196 HydrophobicContact CD1-CG 4.47Å; L187-M196 HydrophobicContact CD1-SD 3.84Å
188	F	97.7	Very high	95.2	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.009	16%	0.163	C	C	.	.	I	π-helix	trans	-89.7	-38.6	-177.3	-67.5	-46.1	0	0	0	113	A184 N192 T193 M196 V417 R419 Y422	A184-F188 HydrophobicContact CB-CD2 4.03Å; A184-F188 HydrophobicContact CB-CE2 4.31Å; A184-F188 VanDerWaalsContact O-CB 3.28Å; A184-F188 WeakPolarHBondContact O-CB 3.35Å; A184-F188 PolarHBondContact O-N 3.05Å; F188-N192 WeakPolarHBondContact O-CA 3.41Å; F188-T193 WeakPolarHBondContact CD1-O 3.47Å; F188-M196 HydrophobicContact CD2-SD 4.04Å; F188-M196 HydrophobicContact CE1-CB 4.44Å; F188-M196 HydrophobicContact CE1-CG 4.09Å; F188-M196 HydrophobicContact CE2-CG 3.78Å; F188-M196 HydrophobicContact CE2-SD 3.57Å; F188-M196 VanDerWaalsContact CE2-SD 3.57Å; F188-M196 HydrophobicContact CZ-CB 4.25Å; F188-M196 HydrophobicContact CZ-CG 3.46Å; F188-M196 VanDerWaalsContact CZ-CG 3.46Å; F188-M196 HydrophobicContact CZ-SD 3.87Å; F188-V417 HydrophobicContact CE2-CG1 4.39Å; F188-V417 HydrophobicContact CZ-CG1 4.27Å; F188-V417 WeakPolarHBondContact CZ-O 3.43Å; F188-R419 HydrophobicContact CB-CG 4.3Å; F188-R419 HydrophobicContact CD1-CB 3.62Å; F188-R419 HydrophobicContact CD1-CG 3.9Å; F188-R419 VanDerWaalsContact CE1-CA 3.49Å; F188-R419 HydrophobicContact CE1-CB 3.77Å; F188-R419 HydrophobicContact CG-CB 4.4Å; F188-R419 HydrophobicContact CG-CG 4.29Å; F188-Y422 HydrophobicContact CB-CD1 4.02Å; F188-Y422 HydrophobicContact CB-CE1 4.26Å; F188-Y422 AromaticContact CD2-CD1 3.51Å; F188-Y422 HydrophobicContact CD2-CD1 3.51Å; F188-Y422 HydrophobicContact CD2-CD2 4Å; F188-Y422 HydrophobicContact CD2-CE1 4.13Å; F188-Y422 AromaticContact CD2-CG 3.43Å; F188-Y422 HydrophobicContact CD2-CG 3.43Å; F188-Y422 VanDerWaalsContact CD2-CG 3.43Å; F188-Y422 HydrophobicContact CE2-CD1 4.28Å; F188-Y422 HydrophobicContact CE2-CD2 4.18Å; F188-Y422 AromaticContact CE2-CG 3.75Å; F188-Y422 HydrophobicContact CE2-CG 3.75Å; F188-Y422 HydrophobicContact CG-CD1 4.1Å; F188-Y422 HydrophobicContact CG-CG 4.39Å
189	E	96.4	Very high	95.6	Very high	109 Å²	109	26.6 Å²	26.6	51%	0.509	14%	0.137	S	C	.	.	I	π-helix	trans	-91.9	-46.9	-173.5	-50.4	178.2	-157.4	0	0	111.3	E185 Y422	E185-E189 WeakPolarHBondContact O-CA 3.22Å; E185-E189 WeakPolarHBondContact O-CB 3.35Å; E185-E189 PolarHBondContact O-N 3.01Å; E189-Y422 HydrophobicContact CG-CE1 4.35Å; E189-Y422 PolarHBondContact OE1-OH 2.99Å
190	A	96.4	Very high	95.8	Very high	45 Å²	45	27.4 Å²	27.4	37%	0.372	14%	0.139	S	C	.	.	I	π-helix	trans	-81.1	-51.8	179.1	0	0	0	0	0	112.3	E185 M186 N192	E185-A190 PolarHBondContact O-N 3.46Å; M186-A190 WeakPolarHBondContact O-CB 3.35Å; M186-A190 PolarHBondContact O-N 3.24Å; A190-N192 PolarHBondContact O-ND2 3.48Å
191	F	97.2	Very high	96.1	Very high	7 Å²	7	27.7 Å²	27.7	3%	0.031	14%	0.141	C	C	.	.	S	Bend	trans	-89.4	-7.4	-176.4	-68	-61.9	0	0	0	114.9	Q147 W150 E151 F154 P162 M186 L187 T193	Q147-F191 HydrophobicContact CG-CE2 4.06Å; Q147-F191 HydrophobicContact CG-CZ 3.88Å; W150-F191 HydrophobicContact CB-CE2 3.94Å; W150-F191 HydrophobicContact CB-CZ 3.74Å; W150-F191 HydrophobicContact CE3-CE2 4.1Å; E151-F191 HydrophobicContact CB-CE1 4.11Å; E151-F191 HydrophobicContact CB-CZ 4.3Å; E151-F191 WeakPolarHBondContact OE2-CE1 3.34Å; F154-F191 HydrophobicContact CD2-CD1 4.18Å; F154-F191 HydrophobicContact CD2-CE1 4.12Å; F154-F191 HydrophobicContact CD2-CZ 4.47Å; F154-F191 HydrophobicContact CE2-CD1 4.46Å; F154-F191 HydrophobicContact CE2-CD2 4.45Å; F154-F191 HydrophobicContact CE2-CE2 4.49Å; F154-F191 HydrophobicContact CE2-CG 4.44Å; P162-F191 HydrophobicContact CB-CB 4.13Å; P162-F191 HydrophobicContact CB-CD1 4.45Å; P162-F191 HydrophobicContact CG-CB 4.25Å; P162-F191 HydrophobicContact CG-CD1 4.02Å; M186-F191 HydrophobicContact CG-CD2 3.85Å; M186-F191 HydrophobicContact CG-CE2 3.56Å; M186-F191 VanDerWaalsContact O-CD2 3.25Å; M186-F191 WeakPolarHBondContact O-CD2 3.39Å; M186-F191 PolarHBondContact O-N 3.38Å; M186-F191 HydrophobicContact SD-CE2 4.03Å; L187-F191 HydrophobicContact CD2-CD2 4.39Å; L187-F191 CarbonylContact O-C 3.57Å; F191-T193 HydrophobicContact CB-CG2 3.98Å; F191-T193 PolarHBondContact O-N 3.47Å; F191-T193 VanDerWaalsContact O-N 3.09Å
192	N	97.3	Very high	96.3	Very high	67 Å²	67	24.1 Å²	24.1	36%	0.358	13%	0.125	S	C	.	.			trans	56.4	25.7	177	-68.2	-73.2	0	0	0	114.8	E163 L187 F188 A190 R419	E163-N192 WeakPolarHBondContact CA-O 3.3Å; E163-N192 HydrophobicContact CB-CB 4.17Å; L187-N192 PolarHBondContact O-N 2.94Å; F188-N192 WeakPolarHBondContact O-CA 3.41Å; A190-N192 PolarHBondContact O-ND2 3.48Å; N192-R419 VanDerWaalsContact OD1-CZ 3.23Å; N192-R419 PolarHBondContact OD1-NH1 3.27Å; N192-R419 PolarHBondContact OD1-NH2 3.31Å
193	T	97.2	Very high	96.3	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.112	C	C	.	.			trans	-60.6	144.1	-178.1	62	0	0	0	0	111.5	P162 V167 L187 F188 F191	P162-T193 HydrophobicContact CB-CG2 4.2Å; V167-T193 HydrophobicContact CG2-CG2 3.78Å; L187-T193 HydrophobicContact CB-CG2 4.5Å; L187-T193 HydrophobicContact CD2-CG2 3.99Å; L187-T193 WeakPolarHBondContact O-CB 3.49Å; L187-T193 WeakPolarHBondContact O-CG2 3.15Å; L187-T193 PolarHBondContact O-N 3.23Å; L187-T193 PolarHBondContact O-OG1 2.96Å; F188-T193 WeakPolarHBondContact CD1-O 3.47Å; F191-T193 HydrophobicContact CB-CG2 3.98Å; F191-T193 PolarHBondContact O-N 3.47Å; F191-T193 VanDerWaalsContact O-N 3.09Å
194	P	97	Very high	96.4	Very high	40 Å²	40	21.2 Å²	21.2	26%	0.26	11%	0.112	S	C	.	.	S	Bend	trans	-73.9	-28.7	-177	27.7	-34.9	0	0	0	112.9	E163 H165 R419	E163-P194 WeakPolarHBondContact O-CD 3.28Å; H165-P194 VanDerWaalsContact O-CD 3.31Å; H165-P194 WeakPolarHBondContact O-CD 3.08Å; P194-R419 PolarHBondContact O-N 3.01Å
195	A	97.1	Very high	96.4	Very high	4 Å²	4	21.2 Å²	21.2	3%	0.033	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	154.1	-180	0	0	0	0	0	111.3	A166 V167 W416 V417	A166-A195 CarbonylContact C-O 3.52Å; A166-A195 VanDerWaalsContact CA-O 3.22Å; A166-A195 WeakPolarHBondContact CA-O 3.45Å; A166-A195 HydrophobicContact CB-CB 3.98Å; V167-A195 PolarHBondContact N-O 2.82Å; A195-W416 HydrophobicContact CB-CB 4.19Å; A195-V417 CarbonylContact C-O 3.54Å; A195-V417 WeakPolarHBondContact CA-O 3.4Å; A195-V417 WeakPolarHBondContact CB-O 3.48Å
196	M	96.9	Very high	96.5	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	163	174.9	72.1	177.8	-79.8	0	0	112.7	V167 A184 L187 F188 I198 W416 V417 L430	V167-M196 CarbonylContact O-C 3.55Å; V167-M196 WeakPolarHBondContact O-CA 3.23Å; A184-M196 VanDerWaalsContact CA-SD 3.55Å; A184-M196 HydrophobicContact CB-CE 4.4Å; A184-M196 HydrophobicContact CB-SD 3.82Å; L187-M196 HydrophobicContact CB-SD 4.1Å; L187-M196 HydrophobicContact CD1-CB 3.84Å; L187-M196 HydrophobicContact CD1-CE 3.62Å; L187-M196 HydrophobicContact CD1-CG 4.47Å; L187-M196 HydrophobicContact CD1-SD 3.84Å; F188-M196 HydrophobicContact CD2-SD 4.04Å; F188-M196 HydrophobicContact CE1-CB 4.44Å; F188-M196 HydrophobicContact CE1-CG 4.09Å; F188-M196 HydrophobicContact CE2-CG 3.78Å; F188-M196 HydrophobicContact CE2-SD 3.57Å; F188-M196 VanDerWaalsContact CE2-SD 3.57Å; F188-M196 HydrophobicContact CZ-CB 4.25Å; F188-M196 HydrophobicContact CZ-CG 3.46Å; F188-M196 VanDerWaalsContact CZ-CG 3.46Å; F188-M196 HydrophobicContact CZ-SD 3.87Å; M196-I198 HydrophobicContact CE-CD1 3.68Å; M196-I198 HydrophobicContact CE-CG1 3.53Å; M196-W416 VanDerWaalsContact C-CE3 3.46Å; M196-V417 PolarHBondContact N-O 3.37Å; M196-V417 PolarHBondContact O-N 3.43Å; M196-L430 HydrophobicContact CE-CD2 4.31Å; M196-L430 HydrophobicContact CG-CD2 4.39Å; M196-L430 HydrophobicContact SD-CD2 4.11Å
197	H	96.9	Very high	96.4	Very high	7 Å²	7	20 Å²	20	3%	0.032	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	145.2	167.4	-167.3	94	0	0	0	110.3	V167 L168 V169 F412 L415 W416 R433	V167-H197 PolarHBondContact O-N 3.49Å; L168-H197 CarbonylContact C-O 3.58Å; L168-H197 WeakPolarHBondContact CA-O 3.25Å; V169-H197 PolarHBondContact N-O 3.15Å; H197-F412 HydrophobicContact CB-CE1 4.43Å; H197-F412 HydrophobicContact CB-CZ 3.9Å; H197-F412 AromaticContact CD2-CE2 3.91Å; H197-F412 AromaticContact CD2-CZ 3.51Å; H197-F412 AromaticContact CE1-CE2 3.9Å; H197-F412 AromaticContact CE1-CZ 3.98Å; H197-F412 AromaticContact CG-CZ 3.5Å; H197-F412 VanDerWaalsContact CG-CZ 3.5Å; H197-F412 AromaticContact ND1-CZ 3.81Å; H197-F412 AromaticContact NE2-CE2 3.72Å; H197-F412 AromaticContact NE2-CZ 3.82Å; H197-L415 PolarHBondContact ND1-O 3.4Å; H197-W416 HydrophobicContact CB-CE3 3.66Å; H197-W416 HydrophobicContact CB-CZ3 3.69Å; H197-R433 PolarHBondContact CE1-O 3.04Å
198	I	95.9	Very high	96.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	128.1	176.5	-47.8	174.8	0	0	0	108.3	V169 D171 R180 Y183 M196 C434 F435	V169-I198 WeakPolarHBondContact O-CA 3.5Å; D171-I198 HydrophobicContact CB-CG2 3.47Å; D171-I198 VanDerWaalsContact CB-CG2 3.47Å; R180-I198 HydrophobicContact CB-CD1 4.04Å; R180-I198 HydrophobicContact CG-CD1 4.2Å; Y183-I198 HydrophobicContact CD2-CD1 4Å; Y183-I198 HydrophobicContact CG-CD1 4.33Å; M196-I198 HydrophobicContact CE-CD1 3.68Å; M196-I198 HydrophobicContact CE-CG1 3.53Å; I198-C434 HydrophobicContact CB-CB 4.14Å; I198-C434 PolarHBondContact N-SG 3.18Å; I198-C434 VanDerWaalsContact N-SG 3.37Å; I198-F435 HydrophobicContact CB-CE2 4.21Å; I198-F435 HydrophobicContact CB-CZ 4.01Å; I198-F435 HydrophobicContact CG2-CE1 4.49Å; I198-F435 HydrophobicContact CG2-CE2 4.12Å; I198-F435 HydrophobicContact CG2-CZ 3.56Å
199	A	94.6	Very high	96.4	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.008	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	145.6	-179.7	0	0	0	0	0	111.8	L168 V169 S170 D171 Q201 L204 L406	L168-A199 HydrophobicContact CD2-CB 4.47Å; V169-A199 PolarHBondContact O-N 2.94Å; S170-A199 CarbonylContact C-O 3.53Å; S170-A199 WeakPolarHBondContact CA-O 3.38Å; D171-A199 PolarHBondContact N-O 3.11Å; A199-Q201 PolarHBondContact O-N 3.28Å; A199-L204 HydrophobicContact CB-CD1 4.06Å; A199-L204 HydrophobicContact CB-CD2 3.66Å; A199-L204 HydrophobicContact CB-CG 3.93Å; A199-L406 HydrophobicContact CB-CD2 4.4Å
200	Y	94.1	Very high	96.3	Very high	27 Å²	27	20.4 Å²	20.4	11%	0.106	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	133.9	-178.9	-69.5	-49	0	0	0	111	D171 R180 S202 R203 L204 P234 F435	D171-Y200 CarbonylContact O-C 3.59Å; D171-Y200 VanDerWaalsContact O-CA 3.27Å; D171-Y200 WeakPolarHBondContact O-CA 3.36Å; R180-Y200 PolarHBondContact NH2-OH 3.39Å; R180-Y200 VanDerWaalsContact NH2-OH 3.1Å; Y200-S202 VanDerWaalsContact C-N 3.32Å; Y200-S202 PolarHBondContact O-N 3.42Å; Y200-R203 WeakPolarHBondContact O-CB 3.44Å; Y200-R203 PolarHBondContact O-N 3.43Å; Y200-L204 WeakPolarHBondContact O-CG 3.47Å; Y200-L204 PolarHBondContact O-N 2.91Å; Y200-P234 HydrophobicContact CD2-CG 3.89Å; Y200-P234 HydrophobicContact CE2-CG 4.14Å; Y200-F435 AromaticContact CD1-CD1 3.7Å; Y200-F435 HydrophobicContact CD1-CD1 3.7Å; Y200-F435 AromaticContact CD1-CE1 3.15Å; Y200-F435 HydrophobicContact CD1-CE1 3.15Å; Y200-F435 AromaticContact CD1-CZ 3.87Å; Y200-F435 HydrophobicContact CD1-CZ 3.87Å; Y200-F435 AromaticContact CD2-CD1 3.3Å; Y200-F435 HydrophobicContact CD2-CD1 3.3Å; Y200-F435 AromaticContact CD2-CE1 3.65Å; Y200-F435 HydrophobicContact CD2-CE1 3.65Å; Y200-F435 HydrophobicContact CD2-CG 4.32Å; Y200-F435 AromaticContact CE1-CD1 3.45Å; Y200-F435 HydrophobicContact CE1-CD1 3.45Å; Y200-F435 VanDerWaalsContact CE1-CD1 3.45Å; Y200-F435 HydrophobicContact CE1-CD2 4.49Å; Y200-F435 AromaticContact CE1-CE1 3.11Å; Y200-F435 HydrophobicContact CE1-CE1 3.11Å; Y200-F435 HydrophobicContact CE1-CE2 4.28Å; Y200-F435 HydrophobicContact CE1-CG 4.1Å; Y200-F435 AromaticContact CE1-CZ 3.57Å; Y200-F435 HydrophobicContact CE1-CZ 3.57Å; Y200-F435 HydrophobicContact CE2-CB 3.92Å; Y200-F435 AromaticContact CE2-CD1 3.05Å; Y200-F435 HydrophobicContact CE2-CD1 3.05Å; Y200-F435 AromaticContact CE2-CE1 3.65Å; Y200-F435 HydrophobicContact CE2-CE1 3.65Å; Y200-F435 AromaticContact CE2-CG 3.65Å; Y200-F435 HydrophobicContact CE2-CG 3.65Å; Y200-F435 AromaticContact CG-CD1 3.62Å; Y200-F435 HydrophobicContact CG-CD1 3.62Å; Y200-F435 AromaticContact CG-CE1 3.4Å; Y200-F435 HydrophobicContact CG-CE1 3.4Å; Y200-F435 HydrophobicContact CG-CZ 4.5Å; Y200-F435 AromaticContact CZ-CD1 3.09Å; Y200-F435 AromaticContact CZ-CE1 3.36Å; Y200-F435 AromaticContact CZ-CG 3.48Å; Y200-F435 VanDerWaalsContact CZ-CG 3.48Å; Y200-F435 AromaticContact CZ-CZ 3.99Å; Y200-F435 WeakPolarHBondContact OH-CG 3.43Å
201	Q	95.8	Very high	96.2	Very high	22 Å²	22	23.9 Å²	23.9	10%	0.103	13%	0.128	C	C	.	.	H	α-helix	trans	-49.1	-50.3	-179.9	-73.4	175.8	-27	0	0	112.4	S170 D171 A199 R203 L204 S205 V399	S170-Q201 PolarHBondContact OG-NE2 3.25Å; D171-Q201 PolarHBondContact O-N 2.96Å; A199-Q201 PolarHBondContact O-N 3.28Å; Q201-R203 VanDerWaalsContact C-N 3.33Å; Q201-R203 PolarHBondContact O-N 3.34Å; Q201-L204 WeakPolarHBondContact O-CB 3.25Å; Q201-L204 PolarHBondContact O-N 3.24Å; Q201-L204 VanDerWaalsContact O-N 3.15Å; Q201-S205 PolarHBondContact O-N 3.17Å; Q201-S205 PolarHBondContact O-OG 3.45Å; Q201-V399 HydrophobicContact CB-CG1 4.11Å; Q201-V399 HydrophobicContact CB-CG2 4.06Å; Q201-V399 HydrophobicContact CG-CG1 3.92Å; Q201-V399 HydrophobicContact CG-CG2 4.48Å
202	S	95.8	Very high	96.1	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.014	15%	0.153	C	C	.	.	H	α-helix	trans	-67.9	-30.7	-178	-40.8	0	0	0	0	113.7	P173 Y200 M206 E218 V227 I229	P173-S202 WeakPolarHBondContact CG-OG 3.38Å; Y200-S202 VanDerWaalsContact C-N 3.32Å; Y200-S202 PolarHBondContact O-N 3.42Å; S202-M206 WeakPolarHBondContact O-CB 3.5Å; S202-M206 PolarHBondContact O-N 2.98Å; S202-E218 WeakPolarHBondContact CA-OE1 3.49Å; S202-E218 WeakPolarHBondContact CA-OE2 3.35Å; S202-E218 WeakPolarHBondContact CB-OE2 3.09Å; S202-E218 PolarHBondContact N-OE2 3.33Å; S202-E218 PolarHBondContact OG-OE2 3.03Å; S202-V227 WeakPolarHBondContact OG-CG2 3.42Å; S202-I229 WeakPolarHBondContact O-CD1 3.33Å
203	R	95.4	Very high	96	Very high	26 Å²	26	26 Å²	26	10%	0.098	15%	0.146	C	C	.	.	H	α-helix	trans	-66	-44.5	173.2	-177.6	-172.9	-78.5	165.7	-2.6	110	Y200 Q201 M206 Y207 G232 P234 F435	Y200-R203 WeakPolarHBondContact O-CB 3.44Å; Y200-R203 PolarHBondContact O-N 3.43Å; Q201-R203 VanDerWaalsContact C-N 3.33Å; Q201-R203 PolarHBondContact O-N 3.34Å; R203-M206 PolarHBondContact O-N 2.99Å; R203-Y207 HydrophobicContact CG-CE1 4.45Å; R203-Y207 HydrophobicContact CG-CE2 3.85Å; R203-Y207 PolarHBondContact O-N 3.14Å; R203-Y207 VanDerWaalsContact O-N 3.13Å; R203-G232 PolarHBondContact NE-O 2.9Å; R203-G232 PolarHBondContact NH2-O 2.71Å; R203-P234 VanDerWaalsContact NH2-CD 3.35Å; R203-F435 PolarHBondContact NH1-OXT 3.15Å; R203-F435 PolarHBondContact NH2-OXT 3Å
204	L	97	Very high	96	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.4	-48.1	176.1	-60	-178.6	0	0	0	111.2	L168 A199 Y200 Q201 M206 Y207 S208 V399 G402 L406	L168-L204 HydrophobicContact CD2-CD1 4.02Å; A199-L204 HydrophobicContact CB-CD1 4.06Å; A199-L204 HydrophobicContact CB-CD2 3.66Å; A199-L204 HydrophobicContact CB-CG 3.93Å; Y200-L204 WeakPolarHBondContact O-CG 3.47Å; Y200-L204 PolarHBondContact O-N 2.91Å; Q201-L204 WeakPolarHBondContact O-CB 3.25Å; Q201-L204 PolarHBondContact O-N 3.24Å; Q201-L204 VanDerWaalsContact O-N 3.15Å; L204-M206 PolarHBondContact O-N 2.76Å; L204-Y207 WeakPolarHBondContact O-CB 3.27Å; L204-Y207 PolarHBondContact O-N 2.78Å; L204-S208 PolarHBondContact O-N 3.1Å; L204-S208 VanDerWaalsContact O-N 3.1Å; L204-V399 HydrophobicContact CB-CG1 4.35Å; L204-V399 VanDerWaalsContact CB-O 3.3Å; L204-V399 WeakPolarHBondContact CB-O 3.4Å; L204-V399 HydrophobicContact CD1-CG1 4.11Å; L204-G402 VanDerWaalsContact O-CA 3.22Å; L204-G402 WeakPolarHBondContact O-CA 3.21Å; L204-L406 HydrophobicContact CD2-CB 4.44Å; L204-L406 HydrophobicContact CD2-CD2 3.66Å
205	S	97.1	Very high	96.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-52.1	-45.7	174.6	-73.5	0	0	0	0	111.6	Q201 Y207 S208 Y209 E218 V399	Q201-S205 PolarHBondContact O-N 3.17Å; Q201-S205 PolarHBondContact O-OG 3.45Å; S205-Y207 VanDerWaalsContact C-N 3.34Å; S205-Y207 PolarHBondContact O-N 2.88Å; S205-S208 WeakPolarHBondContact O-CB 3.14Å; S205-S208 PolarHBondContact O-N 3.27Å; S205-S208 VanDerWaalsContact O-N 3.09Å; S205-S208 PolarHBondContact O-OG 3.11Å; S205-Y209 WeakPolarHBondContact O-CD2 3.31Å; S205-E218 WeakPolarHBondContact CB-OE1 3.38Å; S205-E218 PolarHBondContact OG-OE1 3.17Å; S205-V399 WeakPolarHBondContact OG-CG2 3.38Å; S205-V399 PolarHBondContact OG-N 3.4Å
206	M	96.3	Very high	96.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.4	-37.4	178.4	-177.5	-104.6	-77.3	0	0	113.2	S202 R203 L204 S208 Y209 R211 T212 V216 I229 L359	S202-M206 WeakPolarHBondContact O-CB 3.5Å; S202-M206 PolarHBondContact O-N 2.98Å; R203-M206 PolarHBondContact O-N 2.99Å; L204-M206 PolarHBondContact O-N 2.76Å; M206-S208 VanDerWaalsContact C-N 3.31Å; M206-S208 PolarHBondContact O-N 3.04Å; M206-Y209 WeakPolarHBondContact O-CB 3.37Å; M206-Y209 PolarHBondContact O-N 2.88Å; M206-Y209 VanDerWaalsContact O-N 3.14Å; M206-R211 HydrophobicContact CG-CB 4.15Å; M206-R211 PolarHBondContact O-N 2.83Å; M206-R211 HydrophobicContact SD-CB 4.34Å; M206-T212 WeakPolarHBondContact CE-O 3.42Å; M206-T212 WeakPolarHBondContact SD-CA 3.46Å; M206-V216 HydrophobicContact CB-CG2 3.94Å; M206-I229 HydrophobicContact CB-CD1 4.19Å; M206-I229 HydrophobicContact CE-CB 3.65Å; M206-I229 HydrophobicContact CE-CD1 3.89Å; M206-I229 HydrophobicContact CE-CG1 4.37Å; M206-I229 HydrophobicContact CE-CG2 3.11Å; M206-L359 HydrophobicContact CB-CD1 4.2Å; M206-L359 HydrophobicContact CG-CD1 3.85Å
207	Y	95.8	Very high	96.2	Very high	61 Å²	61	23.9 Å²	23.9	24%	0.239	13%	0.132	C	C	.	.	H	α-helix	trans	-65	-31.9	173	-65	-23.7	0	0	0	113.4	R203 L204 S205 Y209 G210 L406	R203-Y207 HydrophobicContact CG-CE1 4.45Å; R203-Y207 HydrophobicContact CG-CE2 3.85Å; R203-Y207 PolarHBondContact O-N 3.14Å; R203-Y207 VanDerWaalsContact O-N 3.13Å; L204-Y207 WeakPolarHBondContact O-CB 3.27Å; L204-Y207 PolarHBondContact O-N 2.78Å; S205-Y207 VanDerWaalsContact C-N 3.34Å; S205-Y207 PolarHBondContact O-N 2.88Å; Y207-Y209 PolarHBondContact O-N 3.43Å; Y207-G210 PolarHBondContact O-N 2.93Å; Y207-L406 HydrophobicContact CD2-CB 4.39Å; Y207-L406 HydrophobicContact CD2-CD1 4.29Å; Y207-L406 HydrophobicContact CD2-CD2 4.39Å; Y207-L406 HydrophobicContact CE2-CD1 3.88Å; Y207-L406 HydrophobicContact CE2-CD2 4.11Å; Y207-L406 HydrophobicContact CE2-CG 4.47Å
208	S	96.8	Very high	96.2	Very high	19 Å²	19	24.1 Å²	24.1	13%	0.133	13%	0.133	C	C	.	.	H	α-helix	trans	-63.3	-26.2	174.1	78.6	0	0	0	0	113.2	L204 S205 M206 G210 L392 A398	L204-S208 PolarHBondContact O-N 3.1Å; L204-S208 VanDerWaalsContact O-N 3.1Å; S205-S208 WeakPolarHBondContact O-CB 3.14Å; S205-S208 PolarHBondContact O-N 3.27Å; S205-S208 VanDerWaalsContact O-N 3.09Å; S205-S208 PolarHBondContact O-OG 3.11Å; M206-S208 VanDerWaalsContact C-N 3.31Å; M206-S208 PolarHBondContact O-N 3.04Å; S208-G210 VanDerWaalsContact C-N 3.31Å; S208-L392 WeakPolarHBondContact O-CD1 3.4Å; S208-A398 WeakPolarHBondContact CB-O 3.47Å; S208-A398 WeakPolarHBondContact OG-CB 3.2Å
209	Y	96.5	Very high	96.3	Very high	32 Å²	32	24.1 Å²	24.1	13%	0.125	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-1.5	174.2	-78.6	-102.1	0	0	0	113.3	S205 M206 Y207 R211 L359 L360 C361 N390 V391 L392	S205-Y209 WeakPolarHBondContact O-CD2 3.31Å; M206-Y209 WeakPolarHBondContact O-CB 3.37Å; M206-Y209 PolarHBondContact O-N 2.88Å; M206-Y209 VanDerWaalsContact O-N 3.14Å; Y207-Y209 PolarHBondContact O-N 3.43Å; Y209-R211 VanDerWaalsContact C-N 3.25Å; Y209-R211 PolarHBondContact O-N 2.87Å; Y209-L359 HydrophobicContact CD1-CB 4.46Å; Y209-L359 HydrophobicContact CD1-CD2 3.77Å; Y209-L359 HydrophobicContact CD1-CG 4.48Å; Y209-L359 HydrophobicContact CD2-CB 4.4Å; Y209-L359 HydrophobicContact CD2-CD1 4.34Å; Y209-L359 HydrophobicContact CE1-CB 4.43Å; Y209-L359 HydrophobicContact CE1-CD2 4.28Å; Y209-L359 HydrophobicContact CE2-CB 4.41Å; Y209-L359 HydrophobicContact CG-CB 4.44Å; Y209-L359 HydrophobicContact CG-CD1 4.05Å; Y209-L359 HydrophobicContact CG-CD2 4.09Å; Y209-L359 HydrophobicContact CG-CG 4.42Å; Y209-L360 PolarHBondContact OH-O 3.46Å; Y209-C361 WeakPolarHBondContact CE2-SG 3.37Å; Y209-N390 HydrophobicContact CE1-CB 4.43Å; Y209-V391 WeakPolarHBondContact OH-CA 3.44Å; Y209-L392 HydrophobicContact CD1-CD1 4.08Å; Y209-L392 HydrophobicContact CD1-CD2 4.5Å; Y209-L392 HydrophobicContact CD1-CG 3.83Å; Y209-L392 HydrophobicContact CD2-CD1 3.68Å; Y209-L392 HydrophobicContact CD2-CG 4.23Å; Y209-L392 HydrophobicContact CE1-CB 4.28Å; Y209-L392 HydrophobicContact CE1-CD1 4.12Å; Y209-L392 HydrophobicContact CE1-CG 3.57Å; Y209-L392 HydrophobicContact CE2-CB 4.47Å; Y209-L392 HydrophobicContact CE2-CD1 3.7Å; Y209-L392 HydrophobicContact CE2-CG 3.98Å; Y209-L392 HydrophobicContact CG-CD1 3.87Å; Y209-L392 HydrophobicContact CG-CG 4.16Å; Y209-L392 PolarHBondContact OH-N 3.43Å
210	G	95.1	Very high	96.4	Very high	69 Å²	69	25.3 Å²	25.3	71%	0.711	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.9	28.9	-176.6	0	0	0	0	0	113.3	Y207 S208	Y207-G210 PolarHBondContact O-N 2.93Å; S208-G210 VanDerWaalsContact C-N 3.31Å
211	R	95.4	Very high	96.5	Very high	118 Å²	118	26.5 Å²	26.5	45%	0.445	15%	0.151	S	C	.	.			trans	-109.6	166.5	177	-58.6	-63.7	-175.4	165.3	3.9	110	M206 Y209 L359	M206-R211 HydrophobicContact CG-CB 4.15Å; M206-R211 PolarHBondContact O-N 2.83Å; M206-R211 HydrophobicContact SD-CB 4.34Å; Y209-R211 VanDerWaalsContact C-N 3.25Å; Y209-R211 PolarHBondContact O-N 2.87Å; R211-L359 HydrophobicContact CB-CD1 4.4Å; R211-L359 HydrophobicContact CG-CD1 4.37Å
212	T	93.6	Very high	96.5	Very high	89 Å²	89	25.6 Å²	25.6	55%	0.546	15%	0.148	S	C	.	.	S	Bend	trans	-123.1	-16.5	170.1	53	0	0	0	0	112.4	M206 E231 G232	M206-T212 WeakPolarHBondContact CE-O 3.42Å; M206-T212 WeakPolarHBondContact SD-CA 3.46Å; T212-E231 CarbonylContact O-C 3.48Å; T212-E231 PolarHBondContact O-N 3.42Å; T212-G232 PolarHBondContact O-N 2.9Å
213	S	96	Very high	96.5	Very high	29 Å²	29	26 Å²	26	20%	0.203	15%	0.151	C	C	.	.	S	Bend	trans	-133.3	143.8	174.6	-58	0	0	0	0	109.6	I229 E231	S213-I229 CarbonylContact C-O 3.5Å; S213-I229 VanDerWaalsContact CA-O 3.27Å; S213-I229 WeakPolarHBondContact CA-O 3.28Å; S213-E231 PolarHBondContact OG-N 3.28Å
214	G	97.2	Very high	96.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.8	166.1	180	0	0	0	0	0	112.6	I229 L354 N357	G214-I229 PolarHBondContact N-O 2.67Å; G214-I229 PolarHBondContact O-N 3.28Å; G214-L354 VanDerWaalsContact C-CD2 3.41Å; G214-N357 CarbonylContact C-O 3.59Å; G214-N357 VanDerWaalsContact CA-O 3.3Å; G214-N357 WeakPolarHBondContact CA-O 3.36Å
215	L	98.3	Very high	96.7	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	107.9	174.7	-175.2	72.4	0	0	0	108.7	V226 P228 T339 L343 L354 N357 I358 L359	L215-V226 HydrophobicContact CD1-CG1 3.67Å; L215-V226 HydrophobicContact CD2-CG1 4.13Å; L215-V226 HydrophobicContact CG-CG1 3.97Å; L215-P228 HydrophobicContact CD1-CB 3.82Å; L215-P228 HydrophobicContact CD1-CG 4.42Å; L215-T339 HydrophobicContact CD2-CG2 3.48Å; L215-T339 VanDerWaalsContact CD2-CG2 3.48Å; L215-L343 HydrophobicContact CD2-CD1 3.92Å; L215-L343 HydrophobicContact CD2-CD2 3.89Å; L215-L343 HydrophobicContact CD2-CG 3.71Å; L215-L354 HydrophobicContact CB-CB 4.37Å; L215-N357 PolarHBondContact N-O 3.11Å; L215-I358 HydrophobicContact CB-CG1 4.33Å; L215-I358 HydrophobicContact CD2-CG1 4.22Å; L215-I358 HydrophobicContact CD2-CG2 4.45Å; L215-I358 CarbonylContact O-C 3.59Å; L215-I358 WeakPolarHBondContact O-CA 3.48Å; L215-L359 PolarHBondContact O-N 3.17Å
216	V	98.4	Very high	96.7	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	119.4	179.8	-166.8	0	0	0	0	109.3	M206 E218 V226 V227 I229 L359	M206-V216 HydrophobicContact CB-CG2 3.94Å; V216-E218 HydrophobicContact CB-CG 4.45Å; V216-E218 HydrophobicContact CG1-CG 3.41Å; V216-E218 VanDerWaalsContact CG1-CG 3.41Å; V216-V226 CarbonylContact O-C 3.57Å; V216-V226 WeakPolarHBondContact O-CA 3.5Å; V216-V227 PolarHBondContact N-O 3.1Å; V216-V227 PolarHBondContact O-N 2.71Å; V216-I229 HydrophobicContact CG2-CD1 3.73Å; V216-I229 HydrophobicContact CG2-CG1 4.32Å; V216-L359 WeakPolarHBondContact CA-O 3.39Å
217	V	98.4	Very high	96.8	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	102.2	172.9	-178.4	0	0	0	0	107.5	Y225 V226 L335 T339 I358 L359 L360 C361 L374	V217-Y225 CarbonylContact C-O 3.59Å; V217-Y225 WeakPolarHBondContact CA-O 3.39Å; V217-V226 HydrophobicContact CG1-CG2 4.43Å; V217-V226 HydrophobicContact CG2-CG1 4.45Å; V217-V226 HydrophobicContact CG2-CG2 4.41Å; V217-L335 HydrophobicContact CG1-CD1 3.83Å; V217-L335 HydrophobicContact CG1-CD2 3.99Å; V217-L335 HydrophobicContact CG1-CG 4.03Å; V217-T339 HydrophobicContact CG2-CG2 4.07Å; V217-I358 HydrophobicContact CG2-CG2 3.75Å; V217-L359 PolarHBondContact N-O 2.75Å; V217-L360 HydrophobicContact CB-CD1 4.12Å; V217-L360 HydrophobicContact CG1-CD1 3.95Å; V217-L360 WeakPolarHBondContact O-CA 3.46Å; V217-C361 PolarHBondContact O-N 2.74Å; V217-L374 HydrophobicContact CG1-CD2 4.4Å
218	E	97.3	Very high	96.9	Very high	12 Å²	12	22.1 Å²	22.1	6%	0.056	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	124.7	-177.2	-53.8	-162.8	120.8	0	0	110.7	S202 S205 V216 S224 Y225 C361	S202-E218 WeakPolarHBondContact CA-OE1 3.49Å; S202-E218 WeakPolarHBondContact CA-OE2 3.35Å; S202-E218 WeakPolarHBondContact CB-OE2 3.09Å; S202-E218 PolarHBondContact N-OE2 3.33Å; S202-E218 PolarHBondContact OG-OE2 3.03Å; S205-E218 WeakPolarHBondContact CB-OE1 3.38Å; S205-E218 PolarHBondContact OG-OE1 3.17Å; V216-E218 HydrophobicContact CB-CG 4.45Å; V216-E218 HydrophobicContact CG1-CG 3.41Å; V216-E218 VanDerWaalsContact CG1-CG 3.41Å; E218-S224 CarbonylContact O-C 3.6Å; E218-S224 WeakPolarHBondContact O-CA 3.48Å; E218-S224 WeakPolarHBondContact O-CB 3.29Å; E218-Y225 PolarHBondContact N-O 2.88Å; E218-Y225 PolarHBondContact O-N 3.08Å; E218-C361 CarbonylContact C-O 3.56Å; E218-C361 VanDerWaalsContact CA-O 3.3Å; E218-C361 WeakPolarHBondContact CA-O 3.36Å; E218-C361 HydrophobicContact CG-CB 4.12Å
219	V	98.1	Very high	96.9	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	98.4	174.5	-168.8	0	0	0	0	108.4	S224 F322 L335 C361 G362 G363 S364 T365 F370	V219-S224 WeakPolarHBondContact CG1-OG 3.38Å; V219-F322 HydrophobicContact CG1-CD1 4.2Å; V219-F322 HydrophobicContact CG1-CE1 3.61Å; V219-F322 HydrophobicContact CG1-CZ 4.04Å; V219-L335 HydrophobicContact CG2-CD1 4.23Å; V219-L335 HydrophobicContact CG2-CD2 3.63Å; V219-C361 PolarHBondContact N-O 2.98Å; V219-G362 CarbonylContact O-C 3.53Å; V219-G362 VanDerWaalsContact O-C 3.26Å; V219-G362 WeakPolarHBondContact O-CA 3.45Å; V219-G363 PolarHBondContact O-N 2.92Å; V219-S364 PolarHBondContact O-N 2.98Å; V219-S364 VanDerWaalsContact O-N 3.13Å; V219-T365 HydrophobicContact CB-CG2 3.6Å; V219-T365 HydrophobicContact CG2-CG2 3.68Å; V219-F370 HydrophobicContact CG2-CZ 4.06Å
220	G	96.6	Very high	96.8	Very high	25 Å²	25	24.1 Å²	24.1	26%	0.258	14%	0.14	S	C	.	.			trans	-83.6	-156.9	-176.8	0	0	0	0	0	113.3	V223 G246 S364	G220-V223 PolarHBondContact N-O 3.39Å; G220-G246 PolarHBondContact O-N 2.86Å; G220-S364 PolarHBondContact O-OG 3.09Å
221	H	96.3	Very high	96.7	Very high	52 Å²	52	26.3 Å²	26.3	24%	0.241	13%	0.132	C	C	.	.	S	Bend	trans	-78.8	-52.3	169.2	179.7	150.3	0	0	0	109.9	T78 G79 A245 G246 S247	T78-H221 WeakPolarHBondContact OG1-CB 3.36Å; G79-H221 WeakPolarHBondContact CA-ND1 3.31Å; H221-A245 CarbonylContact O-C 3.52Å; H221-A245 WeakPolarHBondContact O-CB 3.12Å; H221-G246 CarbonylContact O-C 3.54Å; H221-G246 WeakPolarHBondContact O-CA 3.27Å; H221-G246 PolarHBondContact O-N 2.75Å; H221-S247 VanDerWaalsContact CD2-CB 3.41Å; H221-S247 WeakPolarHBondContact CD2-CB 3.27Å; H221-S247 WeakPolarHBondContact NE2-CB 3.11Å; H221-S247 PolarHBondContact O-N 2.72Å; H221-S247 PolarHBondContact O-OG 3.21Å
222	G	95.3	Very high	96.4	Very high	4 Å²	4	21.1 Å²	21.1	4%	0.041	12%	0.116	C	C	.	.	S	Bend	trans	-110.7	-5.7	-170.7	0	0	0	0	0	116	T78 H137	T78-G222 WeakPolarHBondContact OG1-CA 3.49Å; T78-G222 PolarHBondContact OG1-N 3.23Å; H137-G222 WeakPolarHBondContact CA-O 3.26Å; H137-G222 PolarHBondContact CD2-O 3Å; H137-G222 VanDerWaalsContact CD2-O 3.28Å
223	V	96.2	Very high	96.3	Very high	11 Å²	11	24.3 Å²	24.3	7%	0.067	12%	0.119	C	C	.	.			trans	-153.8	152.5	-179.7	62.1	0	0	0	0	110	H137 G220 Y225 R241 L242	H137-V223 HydrophobicContact CB-CB 4.47Å; G220-V223 PolarHBondContact N-O 3.39Å; V223-Y225 HydrophobicContact CB-CE2 4.24Å; V223-Y225 HydrophobicContact CG1-CD2 4.2Å; V223-Y225 HydrophobicContact CG1-CE2 3.53Å; V223-Y225 HydrophobicContact CG2-CD2 4.21Å; V223-Y225 HydrophobicContact CG2-CE1 4.41Å; V223-Y225 HydrophobicContact CG2-CE2 3.64Å; V223-R241 HydrophobicContact CG2-CG 4.15Å; V223-L242 WeakPolarHBondContact CG2-O 3.5Å
224	S	97.7	Very high	96.2	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	143.1	171.4	-47.2	0	0	0	0	111.1	E218 V219 L242 Y244	E218-S224 CarbonylContact O-C 3.6Å; E218-S224 WeakPolarHBondContact O-CA 3.48Å; E218-S224 WeakPolarHBondContact O-CB 3.29Å; V219-S224 WeakPolarHBondContact CG1-OG 3.38Å; S224-L242 PolarHBondContact N-O 3.02Å; S224-L242 PolarHBondContact O-N 2.93Å; S224-Y244 PolarHBondContact OG-O 3.2Å
225	Y	97.8	Very high	96.1	Very high	4 Å²	4	26 Å²	26	2%	0.016	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	147.1	-179.8	-70.3	-77.8	0	0	0	111.6	P172 P173 L174 V217 E218 V223 T239 G240 R241	P172-Y225 HydrophobicContact CB-CE2 4.2Å; P173-Y225 HydrophobicContact CG-CD1 4.42Å; P173-Y225 HydrophobicContact CG-CG 4.32Å; L174-Y225 HydrophobicContact CD1-CE1 4.25Å; L174-Y225 HydrophobicContact CG-CE1 4.34Å; V217-Y225 CarbonylContact C-O 3.59Å; V217-Y225 WeakPolarHBondContact CA-O 3.39Å; E218-Y225 PolarHBondContact N-O 2.88Å; E218-Y225 PolarHBondContact O-N 3.08Å; V223-Y225 HydrophobicContact CB-CE2 4.24Å; V223-Y225 HydrophobicContact CG1-CD2 4.2Å; V223-Y225 HydrophobicContact CG1-CE2 3.53Å; V223-Y225 HydrophobicContact CG2-CD2 4.21Å; V223-Y225 HydrophobicContact CG2-CE1 4.41Å; V223-Y225 HydrophobicContact CG2-CE2 3.64Å; Y225-T239 HydrophobicContact CD1-CG2 4.4Å; Y225-G240 CarbonylContact C-O 3.26Å; Y225-G240 WeakPolarHBondContact CA-O 3.15Å; Y225-R241 HydrophobicContact CD1-CB 4.06Å; Y225-R241 HydrophobicContact CD1-CG 4.23Å; Y225-R241 HydrophobicContact CE1-CB 3.86Å; Y225-R241 HydrophobicContact CE1-CG 3.7Å; Y225-R241 PolarHBondContact OH-NH1 2.88Å
226	V	98.4	Very high	95.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	107.9	164.8	179	0	0	0	0	107.3	L215 V216 V217 T239 G240 L335 Q338 C342	L215-V226 HydrophobicContact CD1-CG1 3.67Å; L215-V226 HydrophobicContact CD2-CG1 4.13Å; L215-V226 HydrophobicContact CG-CG1 3.97Å; V216-V226 CarbonylContact O-C 3.57Å; V216-V226 WeakPolarHBondContact O-CA 3.5Å; V217-V226 HydrophobicContact CG1-CG2 4.43Å; V217-V226 HydrophobicContact CG2-CG1 4.45Å; V217-V226 HydrophobicContact CG2-CG2 4.41Å; V226-T239 CarbonylContact O-C 3.56Å; V226-T239 WeakPolarHBondContact O-CA 3.44Å; V226-G240 PolarHBondContact N-O 2.9Å; V226-G240 PolarHBondContact O-N 3.43Å; V226-L335 HydrophobicContact CG2-CD1 4.31Å; V226-Q338 HydrophobicContact CG2-CG 4.06Å; V226-C342 HydrophobicContact CG1-CB 3.82Å
227	V	97.9	Very high	95.5	Very high	1 Å²	1	35 Å²	35	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	108.1	-172.1	-169.7	0	0	0	0	110	P173 S202 V216 I229 P234 T239	P173-V227 HydrophobicContact CB-CG2 4.11Å; P173-V227 HydrophobicContact CG-CG2 3.78Å; S202-V227 WeakPolarHBondContact OG-CG2 3.42Å; V216-V227 PolarHBondContact N-O 3.1Å; V216-V227 PolarHBondContact O-N 2.71Å; V227-I229 HydrophobicContact CG1-CD1 4.36Å; V227-I229 HydrophobicContact CG1-CG1 3.9Å; V227-P234 HydrophobicContact CG1-CB 4Å; V227-T239 HydrophobicContact CG2-CG2 3.91Å
228	P	97.6	Very high	95.4	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	129.2	167.6	28.4	-31	0	0	0	109.4	L215 L235 I238 L354	L215-P228 HydrophobicContact CD1-CB 3.82Å; L215-P228 HydrophobicContact CD1-CG 4.42Å; P228-L235 HydrophobicContact CB-CD1 4.29Å; P228-L235 HydrophobicContact CG-CB 4.12Å; P228-L235 HydrophobicContact CG-CD1 4.38Å; P228-L235 PolarHBondContact O-N 3.3Å; P228-I238 HydrophobicContact CG-CB 3.83Å; P228-I238 HydrophobicContact CG-CG2 3.72Å; P228-L354 HydrophobicContact CB-CD1 3.68Å
229	I	96.8	Very high	95.4	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	131.6	176.7	-48.9	179	0	0	0	108.4	S202 M206 S213 G214 V216 V227 Y233 P234	S202-I229 WeakPolarHBondContact O-CD1 3.33Å; M206-I229 HydrophobicContact CB-CD1 4.19Å; M206-I229 HydrophobicContact CE-CB 3.65Å; M206-I229 HydrophobicContact CE-CD1 3.89Å; M206-I229 HydrophobicContact CE-CG1 4.37Å; M206-I229 HydrophobicContact CE-CG2 3.11Å; S213-I229 CarbonylContact C-O 3.5Å; S213-I229 VanDerWaalsContact CA-O 3.27Å; S213-I229 WeakPolarHBondContact CA-O 3.28Å; G214-I229 PolarHBondContact N-O 2.67Å; G214-I229 PolarHBondContact O-N 3.28Å; V216-I229 HydrophobicContact CG2-CD1 3.73Å; V216-I229 HydrophobicContact CG2-CG1 4.32Å; V227-I229 HydrophobicContact CG1-CD1 4.36Å; V227-I229 HydrophobicContact CG1-CG1 3.9Å; I229-Y233 WeakPolarHBondContact CA-O 3.44Å; I229-Y233 WeakPolarHBondContact CG2-O 3.48Å; I229-P234 HydrophobicContact CG1-CB 4.3Å
230	Y	95.1	Very high	95.3	Very high	92 Å²	92	36.4 Å²	36.4	36%	0.361	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	122.5	178.1	-175	-99.5	0	0	0	109.5	G232 Y233 L350	Y230-G232 PolarHBondContact O-N 3.16Å; Y230-G232 VanDerWaalsContact O-N 3.17Å; Y230-Y233 PolarHBondContact N-O 3.28Å; Y230-Y233 WeakPolarHBondContact O-CB 3.39Å; Y230-Y233 PolarHBondContact O-N 2.92Å; Y230-L350 HydrophobicContact CD2-CD1 3.33Å; Y230-L350 HydrophobicContact CE2-CD1 4.08Å; Y230-L350 HydrophobicContact CG-CD1 3.85Å
231	E	92.8	Very high	95.3	Very high	116 Å²	116	38.2 Å²	38.2	54%	0.542	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	38.2	179.9	-64.5	179.3	-174.9	0	0	113.5	T212 S213 Y233	T212-E231 CarbonylContact O-C 3.48Å; T212-E231 PolarHBondContact O-N 3.42Å; S213-E231 PolarHBondContact OG-N 3.28Å; E231-Y233 VanDerWaalsContact C-N 3.29Å; E231-Y233 VanDerWaalsContact O-CD2 3.26Å; E231-Y233 WeakPolarHBondContact O-CD2 3.31Å; E231-Y233 WeakPolarHBondContact O-CE2 3.32Å; E231-Y233 PolarHBondContact O-N 3.37Å
232	G	89.8	Confident	95.4	Very high	9 Å²	9	35.8 Å²	35.8	9%	0.093	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	-9	-178.4	0	0	0	0	0	114.8	R203 T212 Y230 P234	R203-G232 PolarHBondContact NE-O 2.9Å; R203-G232 PolarHBondContact NH2-O 2.71Å; T212-G232 PolarHBondContact O-N 2.9Å; Y230-G232 PolarHBondContact O-N 3.16Å; Y230-G232 VanDerWaalsContact O-N 3.17Å; G232-P234 WeakPolarHBondContact O-CD 3.43Å
233	Y	91.2	Very high	95.4	Very high	155 Å²	155	38.3 Å²	38.3	61%	0.608	20%	0.196	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-97	113.1	-179.4	-61.3	-80.5	0	0	0	111.1	I229 Y230 E231	I229-Y233 WeakPolarHBondContact CA-O 3.44Å; I229-Y233 WeakPolarHBondContact CG2-O 3.48Å; Y230-Y233 PolarHBondContact N-O 3.28Å; Y230-Y233 WeakPolarHBondContact O-CB 3.39Å; Y230-Y233 PolarHBondContact O-N 2.92Å; E231-Y233 VanDerWaalsContact C-N 3.29Å; E231-Y233 VanDerWaalsContact O-CD2 3.26Å; E231-Y233 WeakPolarHBondContact O-CD2 3.31Å; E231-Y233 WeakPolarHBondContact O-CE2 3.32Å; E231-Y233 PolarHBondContact O-N 3.37Å
234	P	93.3	Very high	95.4	Very high	20 Å²	20	37.8 Å²	37.8	13%	0.13	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	154.6	170.7	29.7	-33.9	0	0	0	109.2	Y200 R203 V227 I229 G232 P236	Y200-P234 HydrophobicContact CD2-CG 3.89Å; Y200-P234 HydrophobicContact CE2-CG 4.14Å; R203-P234 VanDerWaalsContact NH2-CD 3.35Å; V227-P234 HydrophobicContact CG1-CB 4Å; I229-P234 HydrophobicContact CG1-CB 4.3Å; G232-P234 WeakPolarHBondContact O-CD 3.43Å; P234-P236 VanDerWaalsContact O-CD 3.24Å; P234-P236 WeakPolarHBondContact O-CD 3.47Å
235	L	94.4	Very high	95.4	Very high	46 Å²	46	37.8 Å²	37.8	24%	0.241	19%	0.193	C	C	.	.			trans	-110.6	86.9	176.6	-49.4	173.5	0	0	0	110.1	P228 S237 I238 T239 L350	P228-L235 HydrophobicContact CB-CD1 4.29Å; P228-L235 HydrophobicContact CG-CB 4.12Å; P228-L235 HydrophobicContact CG-CD1 4.38Å; P228-L235 PolarHBondContact O-N 3.3Å; L235-S237 VanDerWaalsContact C-N 3.26Å; L235-S237 PolarHBondContact O-N 3.12Å; L235-I238 HydrophobicContact CB-CB 4.43Å; L235-I238 HydrophobicContact CB-CD1 4.31Å; L235-I238 HydrophobicContact CD1-CD1 4.02Å; L235-I238 PolarHBondContact O-N 2.88Å; L235-T239 PolarHBondContact O-N 3.17Å; L235-T239 VanDerWaalsContact O-N 3.12Å; L235-T239 PolarHBondContact O-OG1 2.87Å; L235-L350 HydrophobicContact CD1-CD2 3.59Å
236	P	92.4	Very high	95.3	Very high	79 Å²	79	37.6 Å²	37.6	51%	0.513	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-32.2	-172.4	-25.4	34.8	0	0	0	114.3	L174 P234 I238 T239	L174-P236 HydrophobicContact CD2-CB 4.46Å; P234-P236 VanDerWaalsContact O-CD 3.24Å; P234-P236 WeakPolarHBondContact O-CD 3.47Å; P236-I238 PolarHBondContact O-N 3.21Å; P236-T239 PolarHBondContact O-N 3.46Å
237	S	92.9	Very high	95.2	Very high	109 Å²	109	39.2 Å²	39.2	76%	0.762	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-21.3	178.8	54.3	0	0	0	0	113.5	L235	L235-S237 VanDerWaalsContact C-N 3.26Å; L235-S237 PolarHBondContact O-N 3.12Å
238	I	95.6	Very high	95.2	Very high	21 Å²	21	41 Å²	41	11%	0.108	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-24.3	-178.7	-56.9	175.7	0	0	0	111.4	P228 L235 P236 G240 C342 K345	P228-I238 HydrophobicContact CG-CB 3.83Å; P228-I238 HydrophobicContact CG-CG2 3.72Å; L235-I238 HydrophobicContact CB-CB 4.43Å; L235-I238 HydrophobicContact CB-CD1 4.31Å; L235-I238 HydrophobicContact CD1-CD1 4.02Å; L235-I238 PolarHBondContact O-N 2.88Å; P236-I238 PolarHBondContact O-N 3.21Å; I238-G240 PolarHBondContact O-N 2.8Å; I238-C342 HydrophobicContact CG2-CB 4.14Å; I238-C342 WeakPolarHBondContact CG2-O 3.42Å; I238-C342 PolarHBondContact O-SG 2.78Å; I238-K345 HydrophobicContact CG1-CB 4.24Å; I238-K345 HydrophobicContact CG2-CB 3.8Å; I238-K345 HydrophobicContact CG2-CD 4.3Å
239	T	96.9	Very high	95.2	Very high	18 Å²	18	41.1 Å²	41.1	11%	0.11	21%	0.214	C	C	.	.			trans	-48.3	126.8	-179.8	-66.2	0	0	0	0	112.6	L174 Y225 V226 V227 L235 P236	L174-T239 HydrophobicContact CD1-CG2 4.06Å; L174-T239 HydrophobicContact CD2-CG2 4.24Å; L174-T239 HydrophobicContact CG-CG2 4.11Å; Y225-T239 HydrophobicContact CD1-CG2 4.4Å; V226-T239 CarbonylContact O-C 3.56Å; V226-T239 WeakPolarHBondContact O-CA 3.44Å; V227-T239 HydrophobicContact CG2-CG2 3.91Å; L235-T239 PolarHBondContact O-N 3.17Å; L235-T239 VanDerWaalsContact O-N 3.12Å; L235-T239 PolarHBondContact O-OG1 2.87Å; P236-T239 PolarHBondContact O-N 3.46Å
240	G	97.1	Very high	95.3	Very high	2 Å²	2	41.3 Å²	41.3	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	133.2	172.4	0	0	0	0	0	111.3	Y225 V226 I238 C342	Y225-G240 CarbonylContact C-O 3.26Å; Y225-G240 WeakPolarHBondContact CA-O 3.15Å; V226-G240 PolarHBondContact N-O 2.9Å; V226-G240 PolarHBondContact O-N 3.43Å; I238-G240 PolarHBondContact O-N 2.8Å; G240-C342 PolarHBondContact N-SG 3.12Å; G240-C342 VanDerWaalsContact N-SG 3.44Å
241	R	96.5	Very high	95.3	Very high	63 Å²	63	39 Å²	39	24%	0.238	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	135.1	170.7	177.2	179.6	168.7	126.4	4.8	109.5	H137 L174 V223 Y225 D243	H137-R241 PolarHBondContact O-NH2 3.04Å; L174-R241 HydrophobicContact CD1-CB 4.04Å; V223-R241 HydrophobicContact CG2-CG 4.15Å; Y225-R241 HydrophobicContact CD1-CB 4.06Å; Y225-R241 HydrophobicContact CD1-CG 4.23Å; Y225-R241 HydrophobicContact CE1-CB 3.86Å; Y225-R241 HydrophobicContact CE1-CG 3.7Å; Y225-R241 PolarHBondContact OH-NH1 2.88Å; R241-D243 IonicContact CZ-OD1 2.76Å; R241-D243 IonicContact NE-OD1 3.28Å; R241-D243 PolarHBondContact NE-OD1 2.95Å; R241-D243 IonicContact NH2-OD1 2.67Å; R241-D243 PolarHBondContact NH2-OD1 2.64Å
242	L	97.1	Very high	95.6	Very high	1 Å²	1	36 Å²	36	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	123.1	177.8	-59.7	165.3	0	0	0	107.8	V223 S224 Y244 Q332 L333 L335 Q338	V223-L242 WeakPolarHBondContact CG2-O 3.5Å; S224-L242 PolarHBondContact N-O 3.02Å; S224-L242 PolarHBondContact O-N 2.93Å; L242-Y244 HydrophobicContact CB-CD1 4.15Å; L242-Y244 HydrophobicContact CB-CE1 3.82Å; L242-Y244 HydrophobicContact CD1-CE1 4.34Å; L242-Y244 HydrophobicContact CD1-CE2 4.41Å; L242-Y244 WeakPolarHBondContact CD1-OH 3.43Å; L242-Y244 HydrophobicContact CD2-CE1 3.88Å; L242-Y244 HydrophobicContact CG-CE1 4.22Å; L242-Y244 PolarHBondContact O-N 3.33Å; L242-Y244 VanDerWaalsContact O-N 3.12Å; L242-Q332 HydrophobicContact CD2-CB 4.2Å; L242-L333 WeakPolarHBondContact CD2-O 3.43Å; L242-L335 HydrophobicContact CD1-CD1 3.67Å; L242-Q338 HydrophobicContact CD1-CB 3.97Å; L242-Q338 HydrophobicContact CD1-CG 4Å; L242-Q338 HydrophobicContact CD2-CB 4.17Å; L242-Q338 HydrophobicContact CD2-CG 4.01Å; L242-Q338 HydrophobicContact CG-CB 4.43Å; L242-Q338 HydrophobicContact CG-CG 4.07Å
243	D	95.1	Very high	96	Very high	57 Å²	57	35.6 Å²	35.6	31%	0.305	20%	0.195	S	C	.	.	S	Bend	trans	-90.5	44.8	-178.3	-58.9	-57.6	0	0	0	110.1	R241 Q332	R241-D243 IonicContact CZ-OD1 2.76Å; R241-D243 IonicContact NE-OD1 3.28Å; R241-D243 PolarHBondContact NE-OD1 2.95Å; R241-D243 IonicContact NH2-OD1 2.67Å; R241-D243 PolarHBondContact NH2-OD1 2.64Å; D243-Q332 PolarHBondContact OD2-NE2 3.46Å
244	Y	96.8	Very high	96.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.168	C	C	.	.			trans	-142	142.1	167.1	62.2	-100.6	0	0	0	109.1	S224 L242 D248 M321 F322 P325 I328 Q332 L333 G334 L335	S224-Y244 PolarHBondContact OG-O 3.2Å; L242-Y244 HydrophobicContact CB-CD1 4.15Å; L242-Y244 HydrophobicContact CB-CE1 3.82Å; L242-Y244 HydrophobicContact CD1-CE1 4.34Å; L242-Y244 HydrophobicContact CD1-CE2 4.41Å; L242-Y244 WeakPolarHBondContact CD1-OH 3.43Å; L242-Y244 HydrophobicContact CD2-CE1 3.88Å; L242-Y244 HydrophobicContact CG-CE1 4.22Å; L242-Y244 PolarHBondContact O-N 3.33Å; L242-Y244 VanDerWaalsContact O-N 3.12Å; Y244-D248 WeakPolarHBondContact CA-OD2 3.14Å; Y244-M321 HydrophobicContact CD2-CE 3.89Å; Y244-M321 HydrophobicContact CG-CE 4.22Å; Y244-F322 HydrophobicContact CD2-CD1 4.09Å; Y244-F322 HydrophobicContact CE2-CD1 4.06Å; Y244-P325 HydrophobicContact CD1-CB 4.2Å; Y244-P325 HydrophobicContact CD1-CG 4.31Å; Y244-P325 HydrophobicContact CE1-CB 3.86Å; Y244-P325 HydrophobicContact CE1-CG 3.52Å; Y244-P325 HydrophobicContact CE2-CG 4.38Å; Y244-I328 HydrophobicContact CG-CD1 4.37Å; Y244-Q332 HydrophobicContact CD1-CB 4.46Å; Y244-Q332 HydrophobicContact CE1-CB 4.1Å; Y244-L333 WeakPolarHBondContact CE1-O 3.47Å; Y244-L333 PolarHBondContact OH-O 2.87Å; Y244-G334 VanDerWaalsContact OH-C 3.29Å; Y244-G334 WeakPolarHBondContact OH-CA 3.5Å; Y244-L335 PolarHBondContact OH-N 2.88Å
245	A	97.3	Very high	96.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	-159.2	-146	-178	0	0	0	0	0	111.5	H221 D248 L249	H221-A245 CarbonylContact O-C 3.52Å; H221-A245 WeakPolarHBondContact O-CB 3.12Å; A245-D248 PolarHBondContact N-OD2 3.24Å; A245-D248 PolarHBondContact O-N 2.89Å; A245-L249 PolarHBondContact O-N 2.82Å; A245-L249 VanDerWaalsContact O-N 3.15Å
246	G	97.3	Very high	96.5	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66.1	-31.5	-178.6	0	0	0	0	0	115.8	G220 H221 L249 T250 K276 S364	G220-G246 PolarHBondContact O-N 2.86Å; H221-G246 CarbonylContact O-C 3.54Å; H221-G246 WeakPolarHBondContact O-CA 3.27Å; H221-G246 PolarHBondContact O-N 2.75Å; G246-L249 PolarHBondContact O-N 3.12Å; G246-T250 PolarHBondContact O-N 3.18Å; G246-T250 PolarHBondContact O-OG1 2.86Å; G246-K276 PolarHBondContact O-NZ 3.12Å; G246-S364 WeakPolarHBondContact CA-OG 3.34Å; G246-S364 PolarHBondContact N-OG 2.9Å
247	S	96	Very high	96.7	Very high	34 Å²	34	24.7 Å²	24.7	24%	0.238	15%	0.15	C	C	.	.	H	α-helix	trans	-63.9	-45.8	175.1	34.8	0	0	0	0	110.8	H221 L249 T250 A251	H221-S247 VanDerWaalsContact CD2-CB 3.41Å; H221-S247 WeakPolarHBondContact CD2-CB 3.27Å; H221-S247 WeakPolarHBondContact NE2-CB 3.11Å; H221-S247 PolarHBondContact O-N 2.72Å; H221-S247 PolarHBondContact O-OG 3.21Å; S247-L249 VanDerWaalsContact C-N 3.29Å; S247-L249 PolarHBondContact O-N 2.86Å; S247-T250 WeakPolarHBondContact O-CB 3.19Å; S247-T250 PolarHBondContact O-N 3.4Å; S247-T250 VanDerWaalsContact O-N 3.15Å; S247-A251 PolarHBondContact O-N 2.67Å
248	D	97.4	Very high	96.9	Very high	40 Å²	40	22.3 Å²	22.3	21%	0.214	13%	0.129	C	C	.	.	H	α-helix	trans	-67.3	-36.3	-178.7	-53	-79.9	0	0	0	110.4	Y244 A245 A251 Y252 M321 I328	Y244-D248 WeakPolarHBondContact CA-OD2 3.14Å; A245-D248 PolarHBondContact N-OD2 3.24Å; A245-D248 PolarHBondContact O-N 2.89Å; D248-A251 PolarHBondContact O-N 2.91Å; D248-Y252 VanDerWaalsContact O-CB 3.3Å; D248-Y252 WeakPolarHBondContact O-CB 3.44Å; D248-Y252 PolarHBondContact O-N 3.15Å; D248-M321 HydrophobicContact CB-CE 3.7Å; D248-M321 HydrophobicContact CB-SD 4.26Å; D248-I328 HydrophobicContact CB-CD1 4.17Å
249	L	97.9	Very high	96.8	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-62.9	-43.4	171.4	-169.4	152.2	0	0	0	111.7	A245 G246 S247 Y252 L253 K276 C318 M321 F322 L367	A245-L249 PolarHBondContact O-N 2.82Å; A245-L249 VanDerWaalsContact O-N 3.15Å; G246-L249 PolarHBondContact O-N 3.12Å; S247-L249 VanDerWaalsContact C-N 3.29Å; S247-L249 PolarHBondContact O-N 2.86Å; L249-Y252 PolarHBondContact O-N 2.55Å; L249-L253 VanDerWaalsContact O-CB 3.25Å; L249-L253 WeakPolarHBondContact O-CB 3.33Å; L249-L253 PolarHBondContact O-N 3.4Å; L249-K276 HydrophobicContact CD2-CB 4.42Å; L249-K276 HydrophobicContact CD2-CD 3.33Å; L249-K276 HydrophobicContact CD2-CG 3.54Å; L249-K276 HydrophobicContact CG-CD 4.43Å; L249-C318 HydrophobicContact CD2-CB 4.23Å; L249-C318 HydrophobicContact CG-CB 4.37Å; L249-M321 WeakPolarHBondContact CA-SD 3.25Å; L249-M321 HydrophobicContact CB-SD 3.71Å; L249-M321 HydrophobicContact CG-SD 4.28Å; L249-M321 PolarHBondContact N-SD 2.93Å; L249-F322 HydrophobicContact CB-CZ 4.28Å; L249-F322 HydrophobicContact CD1-CD2 4.05Å; L249-F322 HydrophobicContact CD1-CE2 3.21Å; L249-F322 HydrophobicContact CD1-CZ 3.63Å; L249-L367 HydrophobicContact CD1-CD1 3.94Å
250	T	97.6	Very high	96.6	Very high	4 Å²	4	28 Å²	28	3%	0.025	18%	0.175	C	C	.	.	H	α-helix	trans	-63.6	-42.7	176.8	-56.5	0	0	0	0	111.1	G246 S247 Y252 L253 L254 M269 V272 E273 K276	G246-T250 PolarHBondContact O-N 3.18Å; G246-T250 PolarHBondContact O-OG1 2.86Å; S247-T250 WeakPolarHBondContact O-CB 3.19Å; S247-T250 PolarHBondContact O-N 3.4Å; S247-T250 VanDerWaalsContact O-N 3.15Å; T250-Y252 VanDerWaalsContact C-N 3.35Å; T250-Y252 PolarHBondContact O-N 3.36Å; T250-L253 PolarHBondContact O-N 3.47Å; T250-L254 PolarHBondContact O-N 3.27Å; T250-M269 HydrophobicContact CG2-SD 3.8Å; T250-V272 HydrophobicContact CG2-CB 3.95Å; T250-V272 HydrophobicContact CG2-CG1 3.79Å; T250-E273 HydrophobicContact CG2-CB 4.13Å; T250-E273 PolarHBondContact OG1-OE2 3.08Å; T250-K276 WeakPolarHBondContact OG1-CD 3.45Å; T250-K276 WeakPolarHBondContact OG1-CE 3.47Å; T250-K276 PolarHBondContact OG1-NZ 2.9Å
251	A	96.9	Very high	96.3	Very high	45 Å²	45	31 Å²	31	37%	0.372	21%	0.206	S	C	.	.	H	α-helix	trans	-63.6	-39.5	175.4	0	0	0	0	0	112.5	S247 D248 L254 G255 M269	S247-A251 PolarHBondContact O-N 2.67Å; D248-A251 PolarHBondContact O-N 2.91Å; A251-L254 WeakPolarHBondContact O-CB 3.44Å; A251-G255 PolarHBondContact O-N 3.14Å; A251-M269 HydrophobicContact CB-CE 3.8Å
252	Y	97.9	Very high	96.1	Very high	51 Å²	51	29.6 Å²	29.6	20%	0.2	20%	0.203	C	C	.	.	H	α-helix	trans	-69.3	-42.7	176.7	-177.7	-136.7	0	0	0	111.6	D248 L249 T250 L254 G255 L256 C318 M321 L327 I328	D248-Y252 VanDerWaalsContact O-CB 3.3Å; D248-Y252 WeakPolarHBondContact O-CB 3.44Å; D248-Y252 PolarHBondContact O-N 3.15Å; L249-Y252 PolarHBondContact O-N 2.55Å; T250-Y252 VanDerWaalsContact C-N 3.35Å; T250-Y252 PolarHBondContact O-N 3.36Å; Y252-L254 VanDerWaalsContact C-N 3.32Å; Y252-L254 PolarHBondContact O-N 3.05Å; Y252-G255 PolarHBondContact O-N 3.03Å; Y252-G255 VanDerWaalsContact O-N 3.11Å; Y252-L256 HydrophobicContact CD1-CD1 4.24Å; Y252-L256 HydrophobicContact CD2-CG 4.41Å; Y252-L256 HydrophobicContact CE1-CD1 3.87Å; Y252-L256 HydrophobicContact CE1-CG 4.48Å; Y252-L256 HydrophobicContact CE2-CD1 4.34Å; Y252-L256 HydrophobicContact CE2-CD2 4.07Å; Y252-L256 HydrophobicContact CE2-CG 4.07Å; Y252-L256 PolarHBondContact O-N 3.25Å; Y252-C318 HydrophobicContact CD1-CB 4.38Å; Y252-C318 WeakPolarHBondContact CD1-O 3.39Å; Y252-M321 HydrophobicContact CD1-CB 4.23Å; Y252-M321 HydrophobicContact CD1-CG 4.5Å; Y252-L327 HydrophobicContact CE1-CB 4.34Å; Y252-L327 HydrophobicContact CE1-CD1 4.5Å; Y252-I328 HydrophobicContact CD1-CG2 4.2Å; Y252-I328 HydrophobicContact CD2-CG2 4.16Å; Y252-I328 HydrophobicContact CG-CG2 3.8Å
253	L	98	Very high	95.7	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-58.8	-43	174.9	178.5	60.8	0	0	0	111.3	L249 T250 G255 L256 L257 V272 I275 K276 E314 C318	L249-L253 VanDerWaalsContact O-CB 3.25Å; L249-L253 WeakPolarHBondContact O-CB 3.33Å; L249-L253 PolarHBondContact O-N 3.4Å; T250-L253 PolarHBondContact O-N 3.47Å; L253-G255 VanDerWaalsContact C-N 3.29Å; L253-G255 PolarHBondContact O-N 2.89Å; L253-L256 PolarHBondContact O-N 3.34Å; L253-L256 VanDerWaalsContact O-N 3.13Å; L253-L257 HydrophobicContact CD1-CD1 4.29Å; L253-L257 HydrophobicContact CD1-CD2 4.37Å; L253-L257 HydrophobicContact CD1-CG 4.03Å; L253-L257 HydrophobicContact CG-CD1 3.97Å; L253-L257 HydrophobicContact CG-CG 4.19Å; L253-L257 WeakPolarHBondContact O-CB 3.31Å; L253-L257 VanDerWaalsContact O-CG 3.27Å; L253-L257 WeakPolarHBondContact O-CG 3.09Å; L253-L257 PolarHBondContact O-N 3.34Å; L253-V272 HydrophobicContact CB-CG1 4.06Å; L253-V272 HydrophobicContact CD2-CG1 3.79Å; L253-V272 HydrophobicContact CG-CG1 3.83Å; L253-I275 HydrophobicContact CD2-CG2 4.24Å; L253-K276 HydrophobicContact CD2-CB 3.93Å; L253-E314 HydrophobicContact CD1-CB 4.14Å; L253-C318 HydrophobicContact CB-CB 4.04Å; L253-C318 HydrophobicContact CD1-CB 4.01Å
254	L	97.3	Very high	95.6	Very high	7 Å²	7	36.3 Å²	36.3	4%	0.037	23%	0.232	C	C	.	.	H	α-helix	trans	-52.8	-47.8	173.2	178.5	77.3	0	0	0	111.4	T250 A251 Y252 L256 L257 N258 F264 M269 V272	T250-L254 PolarHBondContact O-N 3.27Å; A251-L254 WeakPolarHBondContact O-CB 3.44Å; Y252-L254 VanDerWaalsContact C-N 3.32Å; Y252-L254 PolarHBondContact O-N 3.05Å; L254-L256 PolarHBondContact O-N 3.14Å; L254-L257 PolarHBondContact O-N 3.38Å; L254-N258 PolarHBondContact O-N 3.39Å; L254-F264 HydrophobicContact CD1-CB 3.26Å; L254-F264 HydrophobicContact CD1-CG 4.29Å; L254-M269 HydrophobicContact CD2-CE 4.49Å; L254-M269 HydrophobicContact CD2-SD 4.4Å; L254-V272 HydrophobicContact CB-CG1 4.33Å; L254-V272 HydrophobicContact CD1-CG2 3.76Å
255	G	96.7	Very high	95.4	Very high	35 Å²	35	39.8 Å²	39.8	36%	0.361	25%	0.254	S	S	.	.	H	α-helix	trans	-62.1	-40.8	177.1	0	0	0	0	0	113.4	A251 Y252 L253 S259	A251-G255 PolarHBondContact O-N 3.14Å; Y252-G255 PolarHBondContact O-N 3.03Å; Y252-G255 VanDerWaalsContact O-N 3.11Å; L253-G255 VanDerWaalsContact C-N 3.29Å; L253-G255 PolarHBondContact O-N 2.89Å; G255-S259 WeakPolarHBondContact O-CB 3.21Å; G255-S259 PolarHBondContact O-N 2.81Å; G255-S259 PolarHBondContact O-OG 3.28Å
256	L	96.8	Very high	94.9	Very high	29 Å²	29	45.9 Å²	45.9	15%	0.152	28%	0.282	C	S	.	.	H	α-helix	trans	-66.4	-44.7	176.4	-67.2	177.1	0	0	0	112	Y252 L253 L254 N258 S259 A260 E314 L317 C318	Y252-L256 HydrophobicContact CD1-CD1 4.24Å; Y252-L256 HydrophobicContact CD2-CG 4.41Å; Y252-L256 HydrophobicContact CE1-CD1 3.87Å; Y252-L256 HydrophobicContact CE1-CG 4.48Å; Y252-L256 HydrophobicContact CE2-CD1 4.34Å; Y252-L256 HydrophobicContact CE2-CD2 4.07Å; Y252-L256 HydrophobicContact CE2-CG 4.07Å; Y252-L256 PolarHBondContact O-N 3.25Å; L253-L256 PolarHBondContact O-N 3.34Å; L253-L256 VanDerWaalsContact O-N 3.13Å; L254-L256 PolarHBondContact O-N 3.14Å; L256-N258 VanDerWaalsContact C-N 3.29Å; L256-N258 PolarHBondContact O-N 2.56Å; L256-S259 PolarHBondContact O-N 3.34Å; L256-A260 PolarHBondContact O-N 3.24Å; L256-E314 HydrophobicContact CB-CB 4.07Å; L256-E314 HydrophobicContact CB-CG 4.02Å; L256-L317 HydrophobicContact CD1-CB 4.11Å; L256-C318 HydrophobicContact CD1-CB 3.91Å
257	L	96.2	Very high	94.3	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-60.3	-41.2	177.2	-69.2	173.4	0	0	0	111.6	L253 L254 A260 N262 F264 V272 I275 L311 E314	L253-L257 HydrophobicContact CD1-CD1 4.29Å; L253-L257 HydrophobicContact CD1-CD2 4.37Å; L253-L257 HydrophobicContact CD1-CG 4.03Å; L253-L257 HydrophobicContact CG-CD1 3.97Å; L253-L257 HydrophobicContact CG-CG 4.19Å; L253-L257 WeakPolarHBondContact O-CB 3.31Å; L253-L257 VanDerWaalsContact O-CG 3.27Å; L253-L257 WeakPolarHBondContact O-CG 3.09Å; L253-L257 PolarHBondContact O-N 3.34Å; L254-L257 PolarHBondContact O-N 3.38Å; L257-A260 WeakPolarHBondContact O-CB 3.25Å; L257-A260 PolarHBondContact O-N 2.89Å; L257-N262 HydrophobicContact CB-CB 4.49Å; L257-N262 VanDerWaalsContact O-CB 3.32Å; L257-N262 WeakPolarHBondContact O-CB 3.24Å; L257-N262 PolarHBondContact O-N 2.53Å; L257-N262 VanDerWaalsContact O-N 3.1Å; L257-N262 PolarHBondContact O-ND2 3.32Å; L257-F264 HydrophobicContact CB-CD2 4.01Å; L257-F264 HydrophobicContact CB-CE2 4.25Å; L257-F264 HydrophobicContact CD1-CD2 4.08Å; L257-F264 HydrophobicContact CD1-CE2 3.93Å; L257-V272 HydrophobicContact CD1-CG1 4.1Å; L257-V272 HydrophobicContact CD1-CG2 4.3Å; L257-I275 HydrophobicContact CD1-CD1 4.23Å; L257-L311 HydrophobicContact CD2-CD2 3.32Å; L257-E314 HydrophobicContact CD2-CB 4.36Å; L257-E314 HydrophobicContact CD2-CG 4.45Å
258	N	95.6	Very high	94	Very high	60 Å²	60	54.9 Å²	54.9	32%	0.321	33%	0.325	S	S	.	.	H	α-helix	trans	-69.6	-37.4	177.4	-71	-2.6	0	0	0	112.1	L254 L256 A260 G261 N262 F264	L254-N258 PolarHBondContact O-N 3.39Å; L256-N258 VanDerWaalsContact C-N 3.29Å; L256-N258 PolarHBondContact O-N 2.56Å; N258-A260 PolarHBondContact O-N 3.07Å; N258-G261 PolarHBondContact O-N 3.31Å; N258-N262 VanDerWaalsContact CA-O 3.28Å; N258-N262 WeakPolarHBondContact CA-O 3.32Å; N258-N262 PolarHBondContact OD1-O 2.99Å; N258-F264 PolarHBondContact ND2-O 2.93Å; N258-F264 PolarHBondContact OD1-N 3.37Å
259	S	94.8	Very high	93.7	Very high	107 Å²	107	55.4 Å²	55.4	75%	0.748	33%	0.327	S	S	*	.	H	α-helix	trans	-64.5	-27.7	173.5	-56.6	0	0	0	0	112.5	G255 L256 G261	G255-S259 WeakPolarHBondContact O-CB 3.21Å; G255-S259 PolarHBondContact O-N 2.81Å; G255-S259 PolarHBondContact O-OG 3.28Å; L256-S259 PolarHBondContact O-N 3.34Å; S259-G261 PolarHBondContact O-N 3.23Å
260	A	91.9	Very high	93.3	Very high	52 Å²	52	58 Å²	58	43%	0.43	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	2.5	174.7	0	0	0	0	0	113.9	L256 L257 N258 E314	L256-A260 PolarHBondContact O-N 3.24Å; L257-A260 WeakPolarHBondContact O-CB 3.25Å; L257-A260 PolarHBondContact O-N 2.89Å; N258-A260 PolarHBondContact O-N 3.07Å; A260-E314 HydrophobicContact CB-CG 4.24Å; A260-E314 WeakPolarHBondContact CB-OE1 3.25Å
261	G	91.5	Very high	93.2	Very high	65 Å²	65	59.4 Å²	59.4	67%	0.67	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.7	10.2	176.2	0	0	0	0	0	115.2	N258 S259	N258-G261 PolarHBondContact O-N 3.31Å; S259-G261 PolarHBondContact O-N 3.23Å
262	N	91.1	Very high	93.1	Very high	33 Å²	33	57.2 Å²	57.2	18%	0.176	34%	0.343	C	S	.	.			trans	-83.3	164.9	166.9	-56.7	-80.6	0	0	0	110.6	L257 N258 F264	L257-N262 HydrophobicContact CB-CB 4.49Å; L257-N262 VanDerWaalsContact O-CB 3.32Å; L257-N262 WeakPolarHBondContact O-CB 3.24Å; L257-N262 PolarHBondContact O-N 2.53Å; L257-N262 VanDerWaalsContact O-N 3.1Å; L257-N262 PolarHBondContact O-ND2 3.32Å; N258-N262 VanDerWaalsContact CA-O 3.28Å; N258-N262 WeakPolarHBondContact CA-O 3.32Å; N258-N262 PolarHBondContact OD1-O 2.99Å; N262-F264 HydrophobicContact CB-CD2 3.81Å; N262-F264 HydrophobicContact CB-CE2 3.76Å
263	E	90.3	Very high	93	Very high	183 Å²	183	56 Å²	56	86%	0.855	34%	0.34	S	S	*	.			trans	-128.3	64.5	-178	-66.1	-176.7	168.3	0	0	110.6
264	F	93.2	Very high	92.9	Very high	15 Å²	15	58.2 Å²	58.2	7%	0.066	35%	0.351	C	S	.	.			trans	-86	137.5	176	-70	-74.8	0	0	0	111.8	L254 L257 N258 N262 Q268 I271 V272 I275 L303 I309	L254-F264 HydrophobicContact CD1-CB 3.26Å; L254-F264 HydrophobicContact CD1-CG 4.29Å; L257-F264 HydrophobicContact CB-CD2 4.01Å; L257-F264 HydrophobicContact CB-CE2 4.25Å; L257-F264 HydrophobicContact CD1-CD2 4.08Å; L257-F264 HydrophobicContact CD1-CE2 3.93Å; N258-F264 PolarHBondContact ND2-O 2.93Å; N258-F264 PolarHBondContact OD1-N 3.37Å; N262-F264 HydrophobicContact CB-CD2 3.81Å; N262-F264 HydrophobicContact CB-CE2 3.76Å; F264-Q268 HydrophobicContact CD1-CB 4.19Å; F264-I271 HydrophobicContact CE1-CG2 4.17Å; F264-V272 HydrophobicContact CB-CG2 4.5Å; F264-V272 HydrophobicContact CD1-CG2 4.4Å; F264-V272 HydrophobicContact CG-CG2 4.3Å; F264-I275 HydrophobicContact CZ-CD1 4.1Å; F264-L303 HydrophobicContact CE1-CD2 3.88Å; F264-L303 HydrophobicContact CZ-CD2 3.85Å; F264-I309 HydrophobicContact CE2-CD1 4.05Å; F264-I309 HydrophobicContact CZ-CD1 3.81Å
265	T	91.4	Very high	92.9	Very high	74 Å²	74	58 Å²	58	45%	0.454	35%	0.35	S	S	.	.			trans	-99.1	169.8	173.6	67.5	0	0	0	0	111.9	D267 Q268	T265-D267 PolarHBondContact O-N 3.42Å; T265-Q268 VanDerWaalsContact N-OE1 3.09Å; T265-Q268 PolarHBondContact O-N 3.18Å; T265-Q268 VanDerWaalsContact O-N 3.1Å
266	Q	87.1	Confident	92.9	Very high	127 Å²	127	56.9 Å²	56.9	59%	0.593	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-62	-30.9	177.2	-68.4	-65.4	-34.5	0	0	112.8	Q268 M269	Q266-Q268 PolarHBondContact O-N 3.23Å; Q266-M269 WeakPolarHBondContact O-CB 3.49Å; Q266-M269 WeakPolarHBondContact O-CG 3.38Å; Q266-M269 PolarHBondContact O-N 3.3Å
267	D	85.5	Confident	92.9	Very high	155 Å²	155	60.4 Å²	60.4	83%	0.829	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-67.7	-20.2	177.7	-58.2	-37.5	0	0	0	112.1	T265 M269	T265-D267 PolarHBondContact O-N 3.42Å; D267-M269 VanDerWaalsContact C-N 3.34Å
268	Q	88.9	Confident	92.9	Very high	68 Å²	68	67.2 Å²	67.2	32%	0.318	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-92.8	12.9	178.5	-64.8	175.4	-44.6	0	0	113.3	F264 T265 Q266 G270 I271 V272	F264-Q268 HydrophobicContact CD1-CB 4.19Å; T265-Q268 VanDerWaalsContact N-OE1 3.09Å; T265-Q268 PolarHBondContact O-N 3.18Å; T265-Q268 VanDerWaalsContact O-N 3.1Å; Q266-Q268 PolarHBondContact O-N 3.23Å; Q268-G270 PolarHBondContact O-N 3.42Å; Q268-G270 VanDerWaalsContact O-N 3.12Å; Q268-I271 HydrophobicContact CB-CD1 4.21Å; Q268-I271 HydrophobicContact CG-CD1 4.25Å; Q268-I271 WeakPolarHBondContact O-CB 3.49Å; Q268-I271 PolarHBondContact O-N 2.77Å; Q268-V272 PolarHBondContact O-N 2.67Å
269	M	90.6	Very high	92.9	Very high	51 Å²	51	64.7 Å²	64.7	25%	0.251	37%	0.366	S	S	.	.	H	α-helix	trans	-53.1	-33.2	176.4	-86.3	-73.7	-141.6	0	0	113.4	T250 A251 L254 Q266 D267 I271 V272 E273	T250-M269 HydrophobicContact CG2-SD 3.8Å; A251-M269 HydrophobicContact CB-CE 3.8Å; L254-M269 HydrophobicContact CD2-CE 4.49Å; L254-M269 HydrophobicContact CD2-SD 4.4Å; Q266-M269 WeakPolarHBondContact O-CB 3.49Å; Q266-M269 WeakPolarHBondContact O-CG 3.38Å; Q266-M269 PolarHBondContact O-N 3.3Å; D267-M269 VanDerWaalsContact C-N 3.34Å; M269-I271 VanDerWaalsContact C-N 3.29Å; M269-I271 PolarHBondContact O-N 3.25Å; M269-V272 PolarHBondContact O-N 2.76Å; M269-E273 WeakPolarHBondContact O-CB 3.14Å; M269-E273 PolarHBondContact O-N 2.92Å
270	G	90.8	Very high	93	Very high	56 Å²	56	60 Å²	60	58%	0.577	33%	0.333	S	S	*	.	H	α-helix	trans	-62.1	-33.8	175.3	0	0	0	0	0	113.6	Q268 D274	Q268-G270 PolarHBondContact O-N 3.42Å; Q268-G270 VanDerWaalsContact O-N 3.12Å; G270-D274 PolarHBondContact O-N 3.25Å
271	I	93.9	Very high	93.3	Very high	33 Å²	33	59.1 Å²	59.1	17%	0.169	32%	0.32	C	S	.	.	H	α-helix	trans	-72.3	-44.2	176.4	-57.2	175.5	0	0	0	109.8	F264 Q268 M269 E273 D274 I275 Y301 L303 P304	F264-I271 HydrophobicContact CE1-CG2 4.17Å; Q268-I271 HydrophobicContact CB-CD1 4.21Å; Q268-I271 HydrophobicContact CG-CD1 4.25Å; Q268-I271 WeakPolarHBondContact O-CB 3.49Å; Q268-I271 PolarHBondContact O-N 2.77Å; M269-I271 VanDerWaalsContact C-N 3.29Å; M269-I271 PolarHBondContact O-N 3.25Å; I271-E273 VanDerWaalsContact C-N 3.28Å; I271-E273 PolarHBondContact O-N 3.25Å; I271-D274 WeakPolarHBondContact O-CB 3.42Å; I271-D274 PolarHBondContact O-N 3.41Å; I271-D274 VanDerWaalsContact O-N 3.08Å; I271-I275 HydrophobicContact CG2-CD1 4.26Å; I271-I275 WeakPolarHBondContact O-CG1 3.11Å; I271-I275 PolarHBondContact O-N 2.93Å; I271-Y301 HydrophobicContact CG2-CE1 4.49Å; I271-L303 HydrophobicContact CG2-CD2 3.71Å; I271-P304 HydrophobicContact CD1-CG 4.01Å; I271-P304 HydrophobicContact CG1-CG 4.16Å
272	V	96.5	Very high	93.6	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.2	-36	178	-176	0	0	0	0	111.4	T250 L253 L254 L257 F264 Q268 M269 D274 I275 K276	T250-V272 HydrophobicContact CG2-CB 3.95Å; T250-V272 HydrophobicContact CG2-CG1 3.79Å; L253-V272 HydrophobicContact CB-CG1 4.06Å; L253-V272 HydrophobicContact CD2-CG1 3.79Å; L253-V272 HydrophobicContact CG-CG1 3.83Å; L254-V272 HydrophobicContact CB-CG1 4.33Å; L254-V272 HydrophobicContact CD1-CG2 3.76Å; L257-V272 HydrophobicContact CD1-CG1 4.1Å; L257-V272 HydrophobicContact CD1-CG2 4.3Å; F264-V272 HydrophobicContact CB-CG2 4.5Å; F264-V272 HydrophobicContact CD1-CG2 4.4Å; F264-V272 HydrophobicContact CG-CG2 4.3Å; Q268-V272 PolarHBondContact O-N 2.67Å; M269-V272 PolarHBondContact O-N 2.76Å; V272-D274 VanDerWaalsContact C-N 3.3Å; V272-D274 PolarHBondContact O-N 2.71Å; V272-I275 PolarHBondContact O-N 2.93Å; V272-K276 WeakPolarHBondContact O-CB 3.45Å; V272-K276 PolarHBondContact O-N 2.83Å
273	E	95.1	Very high	93.9	Very high	25 Å²	25	54.7 Å²	54.7	12%	0.117	28%	0.281	C	S	.	.	H	α-helix	trans	-61.7	-37	172.5	-178.5	69.3	-157	0	0	112.1	T250 M269 I271 K276 K277	T250-E273 HydrophobicContact CG2-CB 4.13Å; T250-E273 PolarHBondContact OG1-OE2 3.08Å; M269-E273 WeakPolarHBondContact O-CB 3.14Å; M269-E273 PolarHBondContact O-N 2.92Å; I271-E273 VanDerWaalsContact C-N 3.28Å; I271-E273 PolarHBondContact O-N 3.25Å; E273-K276 WeakPolarHBondContact O-CB 3.04Å; E273-K276 WeakPolarHBondContact OE1-CE 3.42Å; E273-K276 IonicContact OE1-NZ 2.86Å; E273-K276 PolarHBondContact OE1-NZ 2.94Å; E273-K276 VanDerWaalsContact OE2-CE 3.3Å; E273-K276 WeakPolarHBondContact OE2-CE 3.44Å; E273-K276 IonicContact OE2-NZ 2.91Å; E273-K276 PolarHBondContact OE2-NZ 2.82Å; E273-K277 WeakPolarHBondContact O-CG 3.46Å; E273-K277 PolarHBondContact O-N 3.07Å; E273-K277 WeakPolarHBondContact OE1-CE 3.46Å; E273-K277 IonicContact OE1-NZ 2.67Å; E273-K277 PolarHBondContact OE1-NZ 2.78Å
274	D	95.8	Very high	94.2	Very high	47 Å²	47	50.2 Å²	50.2	25%	0.251	26%	0.262	S	S	.	.	H	α-helix	trans	-72.5	-42.4	176	-166.2	52.1	0	0	0	111.7	G270 I271 V272 K276 K277 K278 Y301	G270-D274 PolarHBondContact O-N 3.25Å; I271-D274 WeakPolarHBondContact O-CB 3.42Å; I271-D274 PolarHBondContact O-N 3.41Å; I271-D274 VanDerWaalsContact O-N 3.08Å; V272-D274 VanDerWaalsContact C-N 3.3Å; V272-D274 PolarHBondContact O-N 2.71Å; D274-K276 VanDerWaalsContact C-N 3.32Å; D274-K276 PolarHBondContact O-N 3.39Å; D274-K277 PolarHBondContact O-N 2.92Å; D274-K278 WeakPolarHBondContact O-CB 3.36Å; D274-K278 PolarHBondContact O-N 2.95Å; D274-K278 WeakPolarHBondContact OD1-CE 3.45Å; D274-K278 IonicContact OD1-NZ 3.88Å; D274-K278 PolarHBondContact OD1-NZ 2.88Å; D274-K278 WeakPolarHBondContact OD2-CD 3.2Å; D274-K278 VanDerWaalsContact OD2-CE 3.27Å; D274-K278 WeakPolarHBondContact OD2-CE 3.3Å; D274-K278 IonicContact OD2-NZ 3.01Å; D274-K278 PolarHBondContact OD2-NZ 2.78Å; D274-Y301 PolarHBondContact OD2-OH 3.4Å
275	I	96.9	Very high	94.3	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-55.7	-49	171.4	-67.8	169.2	0	0	0	109.8	L253 L257 F264 I271 V272 K277 K278 C279 Y301 I309 L311	L253-I275 HydrophobicContact CD2-CG2 4.24Å; L257-I275 HydrophobicContact CD1-CD1 4.23Å; F264-I275 HydrophobicContact CZ-CD1 4.1Å; I271-I275 HydrophobicContact CG2-CD1 4.26Å; I271-I275 WeakPolarHBondContact O-CG1 3.11Å; I271-I275 PolarHBondContact O-N 2.93Å; V272-I275 PolarHBondContact O-N 2.93Å; I275-K277 VanDerWaalsContact C-N 3.31Å; I275-K277 PolarHBondContact O-N 2.87Å; I275-K278 PolarHBondContact O-N 2.92Å; I275-C279 HydrophobicContact CG2-CB 4.1Å; I275-C279 WeakPolarHBondContact O-CA 3.11Å; I275-C279 WeakPolarHBondContact O-CB 3.4Å; I275-C279 PolarHBondContact O-N 3.25Å; I275-Y301 HydrophobicContact CD1-CD1 4.21Å; I275-Y301 HydrophobicContact CD1-CE1 4.17Å; I275-Y301 HydrophobicContact CG1-CD1 3.93Å; I275-Y301 HydrophobicContact CG1-CD2 4.25Å; I275-Y301 HydrophobicContact CG1-CE1 3.69Å; I275-Y301 HydrophobicContact CG1-CE2 4.01Å; I275-Y301 HydrophobicContact CG1-CG 4.2Å; I275-I309 HydrophobicContact CD1-CD1 3.98Å; I275-L311 HydrophobicContact CG2-CD1 3.55Å; I275-L311 HydrophobicContact CG2-CD2 4.39Å
276	K	97.5	Very high	94.4	Very high	13 Å²	13	49.4 Å²	49.4	6%	0.057	26%	0.257	C	S	.	.	H	α-helix	trans	-50.7	-50.8	176.2	173.7	-174.5	69	-177.5	0	111.5	G246 L249 T250 L253 V272 E273 D274 C280 L367	G246-K276 PolarHBondContact O-NZ 3.12Å; L249-K276 HydrophobicContact CD2-CB 4.42Å; L249-K276 HydrophobicContact CD2-CD 3.33Å; L249-K276 HydrophobicContact CD2-CG 3.54Å; L249-K276 HydrophobicContact CG-CD 4.43Å; T250-K276 WeakPolarHBondContact OG1-CD 3.45Å; T250-K276 WeakPolarHBondContact OG1-CE 3.47Å; T250-K276 PolarHBondContact OG1-NZ 2.9Å; L253-K276 HydrophobicContact CD2-CB 3.93Å; V272-K276 WeakPolarHBondContact O-CB 3.45Å; V272-K276 PolarHBondContact O-N 2.83Å; E273-K276 WeakPolarHBondContact O-CB 3.04Å; E273-K276 WeakPolarHBondContact OE1-CE 3.42Å; E273-K276 IonicContact OE1-NZ 2.86Å; E273-K276 PolarHBondContact OE1-NZ 2.94Å; E273-K276 VanDerWaalsContact OE2-CE 3.3Å; E273-K276 WeakPolarHBondContact OE2-CE 3.44Å; E273-K276 IonicContact OE2-NZ 2.91Å; E273-K276 PolarHBondContact OE2-NZ 2.82Å; D274-K276 VanDerWaalsContact C-N 3.32Å; D274-K276 PolarHBondContact O-N 3.39Å; K276-C280 VanDerWaalsContact O-CB 3.25Å; K276-C280 WeakPolarHBondContact O-CB 3.25Å; K276-C280 PolarHBondContact O-N 3.37Å; K276-L367 HydrophobicContact CG-CD2 4.49Å
277	K	95.8	Very high	94.7	Very high	102 Å²	102	47.6 Å²	47.6	44%	0.443	26%	0.255	S	S	.	.	H	α-helix	trans	-69.8	-38	-174.6	-71	169	-173.3	158.9	0	113.1	Y80 E273 D274 I275	Y80-K277 PolarHBondContact OH-NZ 3.21Å; E273-K277 WeakPolarHBondContact O-CG 3.46Å; E273-K277 PolarHBondContact O-N 3.07Å; E273-K277 WeakPolarHBondContact OE1-CE 3.46Å; E273-K277 IonicContact OE1-NZ 2.67Å; E273-K277 PolarHBondContact OE1-NZ 2.78Å; D274-K277 PolarHBondContact O-N 2.92Å; I275-K277 VanDerWaalsContact C-N 3.31Å; I275-K277 PolarHBondContact O-N 2.87Å
278	K	95.9	Very high	95.1	Very high	143 Å²	143	44.8 Å²	44.8	62%	0.622	24%	0.237	S	C	*	.	H	α-helix	trans	-88.3	-32.8	-173.9	-69.7	176.1	178	167.4	0	113.3	D274 I275 Y301	D274-K278 WeakPolarHBondContact O-CB 3.36Å; D274-K278 PolarHBondContact O-N 2.95Å; D274-K278 WeakPolarHBondContact OD1-CE 3.45Å; D274-K278 IonicContact OD1-NZ 3.88Å; D274-K278 PolarHBondContact OD1-NZ 2.88Å; D274-K278 WeakPolarHBondContact OD2-CD 3.2Å; D274-K278 VanDerWaalsContact OD2-CE 3.27Å; D274-K278 WeakPolarHBondContact OD2-CE 3.3Å; D274-K278 IonicContact OD2-NZ 3.01Å; D274-K278 PolarHBondContact OD2-NZ 2.78Å; I275-K278 PolarHBondContact O-N 2.92Å; K278-Y301 HydrophobicContact CD-CE2 4.24Å
279	C	96.1	Very high	95.3	Very high	8 Å²	8	43.6 Å²	43.6	5%	0.054	23%	0.231	C	C	.	.	H	α-helix	trans	-113.9	-31.5	-164.5	-59.2	0	0	0	0	113.6	I275 I299 L311 R315	I275-C279 HydrophobicContact CG2-CB 4.1Å; I275-C279 WeakPolarHBondContact O-CA 3.11Å; I275-C279 WeakPolarHBondContact O-CB 3.4Å; I275-C279 PolarHBondContact O-N 3.25Å; C279-I299 HydrophobicContact CB-CD1 3.65Å; C279-I299 VanDerWaalsContact SG-CD1 3.59Å; C279-L311 HydrophobicContact CB-CD1 3.89Å; C279-R315 PolarHBondContact O-NE 3.01Å; C279-R315 PolarHBondContact O-NH2 2.81Å
280	C	97.5	Very high	95.4	Very high	7 Å²	7	46.3 Å²	46.3	5%	0.047	24%	0.241	C	C	.	.			trans	-82.5	155	-173.6	-65.6	0	0	0	0	112.8	K276 R315 L367	K276-C280 VanDerWaalsContact O-CB 3.25Å; K276-C280 WeakPolarHBondContact O-CB 3.25Å; K276-C280 PolarHBondContact O-N 3.37Å; C280-R315 WeakPolarHBondContact CA-O 3.3Å; C280-R315 WeakPolarHBondContact CB-O 3.25Å; C280-R315 PolarHBondContact SG-O 2.78Å; C280-R315 VanDerWaalsContact SG-O 3.4Å; C280-L367 HydrophobicContact CB-CD2 4.01Å
281	F	97.6	Very high	95.6	Very high	34 Å²	34	50.1 Å²	50.1	15%	0.149	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-150.4	169.1	178.1	65	-84.2	0	0	0	110.3	E289 R315 F316 S319 S368	F281-E289 HydrophobicContact CE2-CG 4.45Å; F281-R315 HydrophobicContact CD1-CB 4.3Å; F281-R315 HydrophobicContact CE1-CB 4.11Å; F281-R315 PolarHBondContact N-O 3Å; F281-R315 VanDerWaalsContact N-O 3.08Å; F281-F316 HydrophobicContact CD1-CB 4.36Å; F281-F316 HydrophobicContact CD2-CB 4.05Å; F281-F316 HydrophobicContact CE1-CB 4Å; F281-F316 HydrophobicContact CE1-CD1 4.33Å; F281-F316 HydrophobicContact CE2-CB 3.68Å; F281-F316 HydrophobicContact CE2-CD1 4.48Å; F281-F316 HydrophobicContact CE2-CG 4.35Å; F281-F316 HydrophobicContact CG-CB 4.38Å; F281-F316 HydrophobicContact CZ-CB 3.66Å; F281-F316 AromaticContact CZ-CD1 3.83Å; F281-F316 HydrophobicContact CZ-CD1 3.83Å; F281-F316 HydrophobicContact CZ-CG 4.1Å; F281-F316 WeakPolarHBondContact O-CA 3.39Å; F281-S319 PolarHBondContact O-OG 2.96Å; F281-S368 WeakPolarHBondContact CB-OG 3.33Å
282	V	98.3	Very high	95.4	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.024	25%	0.246	C	C	.	.			trans	-103	117.2	175.2	-172	0	0	0	0	109.1	S319 F323 L367 S368 F370 R373	V282-S319 WeakPolarHBondContact CA-OG 3.12Å; V282-F323 HydrophobicContact CG1-CE2 3.8Å; V282-F323 HydrophobicContact CG1-CZ 4.42Å; V282-L367 HydrophobicContact CG2-CB 3.85Å; V282-L367 HydrophobicContact CG2-CD1 4.27Å; V282-S368 PolarHBondContact N-O 3.36Å; V282-F370 HydrophobicContact CB-CB 4.42Å; V282-F370 HydrophobicContact CG2-CB 3.74Å; V282-F370 HydrophobicContact CG2-CD2 3.68Å; V282-F370 HydrophobicContact CG2-CG 4.05Å; V282-R373 HydrophobicContact CG1-CB 3.64Å; V282-R373 HydrophobicContact CG1-CG 3.78Å
283	A	97.1	Very high	95.1	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.008	27%	0.267	C	S	.	.			trans	-70	141.2	175	0	0	0	0	0	110.8	E289 F316 R373	A283-E289 HydrophobicContact CB-CB 3.98Å; A283-E289 HydrophobicContact CB-CG 3.95Å; A283-F316 HydrophobicContact CB-CB 4.14Å; A283-F316 HydrophobicContact CB-CD2 3.94Å; A283-F316 HydrophobicContact CB-CG 4.29Å; A283-R373 WeakPolarHBondContact O-CD 3.38Å; A283-R373 PolarHBondContact O-NH1 3.33Å
284	L	96.7	Very high	94.6	Very high	89 Å²	89	57.1 Å²	57.1	47%	0.466	29%	0.285	S	S	.	.	S	Bend	trans	-71.6	-36.3	174.4	-173.4	66.9	0	0	0	111.4	N372 R373 K376	L284-N372 HydrophobicContact CD1-CB 4.34Å; L284-R373 WeakPolarHBondContact O-CD 3.46Å; L284-K376 HydrophobicContact CD1-CB 3.93Å; L284-K376 HydrophobicContact CD1-CD 3.6Å; L284-K376 HydrophobicContact CD1-CG 4.38Å; L284-K376 HydrophobicContact CD2-CD 4.5Å; L284-K376 HydrophobicContact CG-CD 3.76Å; L284-K376 PolarHBondContact O-NZ 3.02Å
285	D	95.5	Very high	94.1	Very high	55 Å²	55	59.6 Å²	59.6	29%	0.294	31%	0.306	S	S	.	.			trans	-140.1	104.2	171.4	-162.2	-51.5	0	0	0	109.5	T287 E288 E289 K376	D285-T287 PolarHBondContact O-N 2.92Å; D285-T287 WeakPolarHBondContact OD1-CB 3.46Å; D285-T287 PolarHBondContact OD1-N 3.19Å; D285-E288 HydrophobicContact CB-CB 4.07Å; D285-E288 HydrophobicContact CB-CG 4.04Å; D285-E288 PolarHBondContact O-N 2.99Å; D285-E288 PolarHBondContact OD1-N 2.76Å; D285-E289 WeakPolarHBondContact O-CB 3.3Å; D285-E289 PolarHBondContact O-N 3.36Å; D285-K376 IonicContact OD2-NZ 3.28Å; D285-K376 PolarHBondContact OD2-NZ 3.4Å
286	P	93	Very high	93.6	Very high	18 Å²	18	66.2 Å²	66.2	12%	0.117	34%	0.337	C	S	.	.	H	α-helix	trans	-64.5	-24.4	-176	-18.2	30.3	0	0	0	113.1	K290 E320	P286-K290 VanDerWaalsContact O-CG 3.24Å; P286-K290 WeakPolarHBondContact O-CG 3.46Å; P286-K290 PolarHBondContact O-N 3.09Å; P286-E320 HydrophobicContact CB-CG 4.04Å; P286-E320 HydrophobicContact CG-CG 3.8Å; P286-E320 WeakPolarHBondContact CG-OE1 3.38Å; P286-E320 WeakPolarHBondContact CG-OE2 3.28Å
287	T	93.8	Very high	92.9	Very high	89 Å²	89	66.2 Å²	66.2	55%	0.546	34%	0.337	S	S	.	.	H	α-helix	trans	-76.4	-42	-179.8	-56.6	0	0	0	0	110.2	D285	D285-T287 PolarHBondContact O-N 2.92Å; D285-T287 WeakPolarHBondContact OD1-CB 3.46Å; D285-T287 PolarHBondContact OD1-N 3.19Å
288	E	93.7	Very high	92.7	Very high	96 Å²	96	63.7 Å²	63.7	45%	0.449	33%	0.33	S	S	.	.	H	α-helix	trans	-70.7	-38.8	173.7	-59.3	-51.9	124.8	0	0	111.5	D285 K290 K291	D285-E288 HydrophobicContact CB-CB 4.07Å; D285-E288 HydrophobicContact CB-CG 4.04Å; D285-E288 PolarHBondContact O-N 2.99Å; D285-E288 PolarHBondContact OD1-N 2.76Å; E288-K290 PolarHBondContact O-N 3.46Å; E288-K291 WeakPolarHBondContact O-CB 3.46Å; E288-K291 PolarHBondContact O-N 2.92Å; E288-K291 WeakPolarHBondContact OE1-CE 3.47Å; E288-K291 IonicContact OE1-NZ 2.93Å; E288-K291 PolarHBondContact OE1-NZ 2.87Å; E288-K291 IonicContact OE2-NZ 3.11Å; E288-K291 PolarHBondContact OE2-NZ 2.96Å
289	E	94.2	Very high	92.6	Very high	43 Å²	43	59.3 Å²	59.3	20%	0.201	31%	0.313	C	S	.	.	H	α-helix	trans	-59.4	-35.6	178.4	-157.4	67.7	-117.8	0	0	112.4	F281 A283 D285 K291 V292 H297 F316	F281-E289 HydrophobicContact CE2-CG 4.45Å; A283-E289 HydrophobicContact CB-CB 3.98Å; A283-E289 HydrophobicContact CB-CG 3.95Å; D285-E289 WeakPolarHBondContact O-CB 3.3Å; D285-E289 PolarHBondContact O-N 3.36Å; E289-K291 PolarHBondContact O-N 2.89Å; E289-V292 WeakPolarHBondContact O-CB 3.46Å; E289-V292 PolarHBondContact O-N 3.42Å; E289-H297 PolarHBondContact O-NE2 2.91Å; E289-H297 IonicContact OE1-CE1 3.15Å; E289-H297 PolarHBondContact OE1-CE1 3.47Å; E289-H297 IonicContact OE1-NE2 3.09Å; E289-H297 PolarHBondContact OE1-NE2 2.8Å; E289-H297 VanDerWaalsContact OE1-NE2 3.11Å; E289-F316 HydrophobicContact CB-CD2 4.18Å; E289-F316 HydrophobicContact CB-CE1 4.45Å; E289-F316 HydrophobicContact CB-CE2 3.79Å; E289-F316 HydrophobicContact CB-CZ 3.94Å; E289-F316 HydrophobicContact CG-CD1 3.9Å; E289-F316 HydrophobicContact CG-CD2 3.97Å; E289-F316 HydrophobicContact CG-CE1 3.78Å; E289-F316 HydrophobicContact CG-CE2 3.88Å; E289-F316 HydrophobicContact CG-CG 3.99Å; E289-F316 HydrophobicContact CG-CZ 3.78Å
290	K	92.9	Very high	92.5	Very high	107 Å²	107	67.3 Å²	67.3	47%	0.465	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-23.2	175.1	-79.1	172.9	-177.7	-174.4	0	114.4	P286 E288 V292 F316 L317	P286-K290 VanDerWaalsContact O-CG 3.24Å; P286-K290 WeakPolarHBondContact O-CG 3.46Å; P286-K290 PolarHBondContact O-N 3.09Å; E288-K290 PolarHBondContact O-N 3.46Å; K290-V292 VanDerWaalsContact C-N 3.33Å; K290-F316 HydrophobicContact CG-CE2 4.15Å; K290-F316 HydrophobicContact CG-CZ 4Å; K290-L317 VanDerWaalsContact CE-CD2 3.45Å
291	K	93.1	Very high	92.4	Very high	136 Å²	136	68.1 Å²	68.1	59%	0.591	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-19.1	-179.8	-60.1	176.8	-167.3	166.3	0	112	E288 E289	E288-K291 WeakPolarHBondContact O-CB 3.46Å; E288-K291 PolarHBondContact O-N 2.92Å; E288-K291 WeakPolarHBondContact OE1-CE 3.47Å; E288-K291 IonicContact OE1-NZ 2.93Å; E288-K291 PolarHBondContact OE1-NZ 2.87Å; E288-K291 IonicContact OE2-NZ 3.11Å; E288-K291 PolarHBondContact OE2-NZ 2.96Å; E289-K291 PolarHBondContact O-N 2.89Å
292	V	90.9	Very high	92.3	Very high	41 Å²	41	70.5 Å²	70.5	25%	0.248	36%	0.362	C	S	.	.	S	Bend	trans	-63.2	137	175.8	178.9	0	0	0	0	109.1	E289 K290 L294 E296 H297	E289-V292 WeakPolarHBondContact O-CB 3.46Å; E289-V292 PolarHBondContact O-N 3.42Å; K290-V292 VanDerWaalsContact C-N 3.33Å; V292-L294 PolarHBondContact O-N 3.19Å; V292-E296 HydrophobicContact CG1-CB 3.96Å; V292-H297 WeakPolarHBondContact CB-NE2 3.25Å; V292-H297 WeakPolarHBondContact CG1-NE2 3.36Å
293	P	89.4	Confident	92	Very high	68 Å²	68	71.3 Å²	71.3	44%	0.442	37%	0.366	S	S	.	.			trans	-54.1	136.7	179.3	-26.6	35.3	0	0	0	112.5	S295 E296	P293-S295 PolarHBondContact O-N 2.81Å; P293-S295 VanDerWaalsContact O-N 3.09Å; P293-E296 PolarHBondContact O-N 2.99Å
294	L	85.7	Confident	91.7	Very high	97 Å²	97	76.3 Å²	76.3	51%	0.508	40%	0.398	S	S	.	.	H	α-helix	trans	-54.2	-34.8	-179.6	-63.4	173	0	0	0	112.3	V292 E296 H297 T298 C312 Q313	V292-L294 PolarHBondContact O-N 3.19Å; L294-E296 PolarHBondContact O-N 2.95Å; L294-H297 CarbonylContact O-C 3.53Å; L294-H297 PolarHBondContact O-N 2.83Å; L294-T298 WeakPolarHBondContact O-CB 3.24Å; L294-T298 PolarHBondContact O-N 2.79Å; L294-T298 PolarHBondContact O-OG1 2.86Å; L294-C312 WeakPolarHBondContact CD2-SG 3.38Å; L294-Q313 HydrophobicContact CD2-CG 3.83Å
295	S	85.2	Confident	91.4	Very high	98 Å²	98	77.8 Å²	77.8	69%	0.685	41%	0.407	S	S	*	.	H	α-helix	trans	-59.4	-29.2	178.6	51.6	0	0	0	0	114.2	P293	P293-S295 PolarHBondContact O-N 2.81Å; P293-S295 VanDerWaalsContact O-N 3.09Å
296	E	85.3	Confident	91.2	Very high	141 Å²	141	77.7 Å²	77.7	66%	0.659	42%	0.418	S	S	*	.	H	α-helix	trans	-80.4	-26.4	177.5	-65	-179.9	-141.8	0	0	111.7	V292 P293 L294	V292-E296 HydrophobicContact CG1-CB 3.96Å; P293-E296 PolarHBondContact O-N 2.99Å; L294-E296 PolarHBondContact O-N 2.95Å
297	H	82.9	Confident	91.1	Very high	13 Å²	13	83.2 Å²	83.2	6%	0.06	44%	0.44	C	S	.	.	H	α-helix	trans	-90.3	-23.7	178.2	-79.6	-54.3	0	0	0	114	E289 V292 L294 I299 R315	E289-H297 PolarHBondContact O-NE2 2.91Å; E289-H297 IonicContact OE1-CE1 3.15Å; E289-H297 PolarHBondContact OE1-CE1 3.47Å; E289-H297 IonicContact OE1-NE2 3.09Å; E289-H297 PolarHBondContact OE1-NE2 2.8Å; E289-H297 VanDerWaalsContact OE1-NE2 3.11Å; V292-H297 WeakPolarHBondContact CB-NE2 3.25Å; V292-H297 WeakPolarHBondContact CG1-NE2 3.36Å; L294-H297 CarbonylContact O-C 3.53Å; L294-H297 PolarHBondContact O-N 2.83Å; H297-I299 PolarHBondContact O-N 3.23Å; H297-R315 PolarHBondContact O-NH1 3.24Å
298	T	91.1	Very high	91.1	Very high	49 Å²	49	84.2 Å²	84.2	30%	0.301	44%	0.439	S	S	.	.			trans	-68.2	120.6	-176.5	-64.6	0	0	0	0	110.9	L294 Q310 L311	L294-T298 WeakPolarHBondContact O-CB 3.24Å; L294-T298 PolarHBondContact O-N 2.79Å; L294-T298 PolarHBondContact O-OG1 2.86Å; T298-Q310 HydrophobicContact CG2-CB 4.2Å; T298-Q310 HydrophobicContact CG2-CG 4.38Å; T298-L311 CarbonylContact C-O 3.56Å; T298-L311 VanDerWaalsContact CA-O 3.28Å; T298-L311 WeakPolarHBondContact CA-O 3.07Å
299	I	93.9	Very high	91.2	Very high	51 Å²	51	80.1 Å²	80.1	26%	0.262	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	153.7	168.3	63.8	168.6	0	0	0	109.9	C279 H297 L311	C279-I299 HydrophobicContact CB-CD1 3.65Å; C279-I299 VanDerWaalsContact SG-CD1 3.59Å; H297-I299 PolarHBondContact O-N 3.23Å; I299-L311 HydrophobicContact CD1-CD1 4.37Å; I299-L311 HydrophobicContact CG1-CB 3.93Å; I299-L311 HydrophobicContact CG1-CD1 4.47Å; I299-L311 PolarHBondContact N-O 2.8Å; I299-L311 PolarHBondContact O-N 2.58Å
300	R	94.3	Very high	91.2	Very high	177 Å²	177	84.3 Å²	84.3	67%	0.668	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	135.5	173.3	-60.2	-176.3	-171.3	-176.2	3.4	109.5	E308 I309	R300-E308 IonicContact NH1-OE2 3.16Å; R300-I309 WeakPolarHBondContact CA-O 3.09Å
301	Y	95.3	Very high	91.2	Very high	24 Å²	24	79.2 Å²	79.2	9%	0.094	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	129.8	176.2	-178.5	-87.1	0	0	0	109.5	I271 D274 I275 K278 L303 E308 I309 L311	I271-Y301 HydrophobicContact CG2-CE1 4.49Å; D274-Y301 PolarHBondContact OD2-OH 3.4Å; I275-Y301 HydrophobicContact CD1-CD1 4.21Å; I275-Y301 HydrophobicContact CD1-CE1 4.17Å; I275-Y301 HydrophobicContact CG1-CD1 3.93Å; I275-Y301 HydrophobicContact CG1-CD2 4.25Å; I275-Y301 HydrophobicContact CG1-CE1 3.69Å; I275-Y301 HydrophobicContact CG1-CE2 4.01Å; I275-Y301 HydrophobicContact CG1-CG 4.2Å; K278-Y301 HydrophobicContact CD-CE2 4.24Å; Y301-L303 HydrophobicContact CD1-CD2 4.13Å; Y301-L303 HydrophobicContact CE1-CD2 4.01Å; Y301-E308 WeakPolarHBondContact O-CA 3.47Å; Y301-I309 HydrophobicContact CD1-CD1 4.37Å; Y301-I309 HydrophobicContact CD1-CG1 4.22Å; Y301-I309 PolarHBondContact N-O 3.1Å; Y301-I309 PolarHBondContact O-N 3.45Å; Y301-L311 HydrophobicContact CG-CD1 4.35Å
302	V	95.3	Very high	91.3	Very high	84 Å²	84	73.6 Å²	73.6	51%	0.509	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	119.8	179.9	-174.9	0	0	0	0	108.7	E308	V302-E308 HydrophobicContact CG2-CG 4.13Å
303	L	93.7	Very high	91.4	Very high	20 Å²	20	74.1 Å²	74.1	11%	0.105	40%	0.395	C	S	.	.			trans	-73.6	162.7	175.8	-66.4	174.7	0	0	0	111.4	F264 I271 Y301 D305 G306 K307 I309	F264-L303 HydrophobicContact CE1-CD2 3.88Å; F264-L303 HydrophobicContact CZ-CD2 3.85Å; I271-L303 HydrophobicContact CG2-CD2 3.71Å; Y301-L303 HydrophobicContact CD1-CD2 4.13Å; Y301-L303 HydrophobicContact CE1-CD2 4.01Å; L303-D305 WeakPolarHBondContact CB-OD1 3.3Å; L303-D305 PolarHBondContact O-N 3.08Å; L303-D305 VanDerWaalsContact O-N 3.16Å; L303-G306 WeakPolarHBondContact O-CA 3.48Å; L303-G306 PolarHBondContact O-N 2.78Å; L303-K307 VanDerWaalsContact CB-O 3.3Å; L303-K307 WeakPolarHBondContact CB-O 3.41Å; L303-K307 HydrophobicContact CD1-CB 4.15Å; L303-K307 HydrophobicContact CD1-CD 4.4Å; L303-K307 HydrophobicContact CD1-CG 4.4Å; L303-K307 WeakPolarHBondContact CG-O 3.12Å; L303-K307 PolarHBondContact N-O 3.01Å; L303-I309 HydrophobicContact CD1-CG2 3.76Å; L303-I309 HydrophobicContact CD2-CD1 4.34Å; L303-I309 HydrophobicContact CG-CG2 4.27Å
304	P	90	Very high	91.7	Very high	106 Å²	106	72.5 Å²	72.5	69%	0.688	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-24.6	178.9	-25.4	35.5	0	0	0	114.8	I271 G306	I271-P304 HydrophobicContact CD1-CG 4.01Å; I271-P304 HydrophobicContact CG1-CG 4.16Å; P304-G306 VanDerWaalsContact C-N 3.25Å
305	D	89.6	Confident	92.2	Very high	121 Å²	121	69.7 Å²	69.7	65%	0.647	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-0.6	175	64.5	-3.1	0	0	0	113.2	L303 K307	L303-D305 WeakPolarHBondContact CB-OD1 3.3Å; L303-D305 PolarHBondContact O-N 3.08Å; L303-D305 VanDerWaalsContact O-N 3.16Å; D305-K307 VanDerWaalsContact C-N 3.34Å; D305-K307 VanDerWaalsContact OD1-CB 3.25Å; D305-K307 WeakPolarHBondContact OD1-CB 3.21Å; D305-K307 PolarHBondContact OD1-N 3.13Å
306	G	91.3	Very high	92.7	Very high	52 Å²	52	65 Å²	65	54%	0.536	33%	0.331	S	S	.	.	S	Bend	trans	85.8	-3.4	-177	0	0	0	0	0	114.6	L303 P304	L303-G306 WeakPolarHBondContact O-CA 3.48Å; L303-G306 PolarHBondContact O-N 2.78Å; P304-G306 VanDerWaalsContact C-N 3.25Å
307	K	92.5	Very high	93.2	Very high	134 Å²	134	59.9 Å²	59.9	58%	0.583	31%	0.308	S	S	*	.			trans	-71.9	135.8	177.7	-178.4	178.8	176.4	-176.8	0	110.5	L303 D305	L303-K307 VanDerWaalsContact CB-O 3.3Å; L303-K307 WeakPolarHBondContact CB-O 3.41Å; L303-K307 HydrophobicContact CD1-CB 4.15Å; L303-K307 HydrophobicContact CD1-CD 4.4Å; L303-K307 HydrophobicContact CD1-CG 4.4Å; L303-K307 WeakPolarHBondContact CG-O 3.12Å; L303-K307 PolarHBondContact N-O 3.01Å; D305-K307 VanDerWaalsContact C-N 3.34Å; D305-K307 VanDerWaalsContact OD1-CB 3.25Å; D305-K307 WeakPolarHBondContact OD1-CB 3.21Å; D305-K307 PolarHBondContact OD1-N 3.13Å
308	E	94.1	Very high	93.9	Very high	110 Å²	110	59.3 Å²	59.3	51%	0.514	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	135.7	173.6	-69.2	-172.1	-177.4	0	0	111.3	R300 Y301 V302	R300-E308 IonicContact NH1-OE2 3.16Å; Y301-E308 WeakPolarHBondContact O-CA 3.47Å; V302-E308 HydrophobicContact CG2-CG 4.13Å
309	I	94.3	Very high	94.2	Very high	10 Å²	10	57 Å²	57	5%	0.051	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	152.8	168.4	62.8	163.4	0	0	0	110.5	F264 I275 R300 Y301 L303 L311	F264-I309 HydrophobicContact CE2-CD1 4.05Å; F264-I309 HydrophobicContact CZ-CD1 3.81Å; I275-I309 HydrophobicContact CD1-CD1 3.98Å; R300-I309 WeakPolarHBondContact CA-O 3.09Å; Y301-I309 HydrophobicContact CD1-CD1 4.37Å; Y301-I309 HydrophobicContact CD1-CG1 4.22Å; Y301-I309 PolarHBondContact N-O 3.1Å; Y301-I309 PolarHBondContact O-N 3.45Å; L303-I309 HydrophobicContact CD1-CG2 3.76Å; L303-I309 HydrophobicContact CD2-CD1 4.34Å; L303-I309 HydrophobicContact CG-CG2 4.27Å; I309-L311 HydrophobicContact CD1-CD2 3.74Å; I309-L311 HydrophobicContact CD1-CG 4.29Å; I309-L311 HydrophobicContact CG1-CD2 4.43Å
310	Q	93.8	Very high	94.4	Very high	131 Å²	131	55.4 Å²	55.4	61%	0.612	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.5	128.3	174.6	-66.1	-174.4	4.7	0	0	109.6	T298	T298-Q310 HydrophobicContact CG2-CB 4.2Å; T298-Q310 HydrophobicContact CG2-CG 4.38Å
311	L	94.5	Very high	94.6	Very high	1 Å²	1	47 Å²	47	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	134.7	178.1	-58.5	175.9	0	0	0	108.6	L257 I275 C279 T298 I299 Y301 I309 R315	L257-L311 HydrophobicContact CD2-CD2 3.32Å; I275-L311 HydrophobicContact CG2-CD1 3.55Å; I275-L311 HydrophobicContact CG2-CD2 4.39Å; C279-L311 HydrophobicContact CB-CD1 3.89Å; T298-L311 CarbonylContact C-O 3.56Å; T298-L311 VanDerWaalsContact CA-O 3.28Å; T298-L311 WeakPolarHBondContact CA-O 3.07Å; I299-L311 HydrophobicContact CD1-CD1 4.37Å; I299-L311 HydrophobicContact CG1-CB 3.93Å; I299-L311 HydrophobicContact CG1-CD1 4.47Å; I299-L311 PolarHBondContact N-O 2.8Å; I299-L311 PolarHBondContact O-N 2.58Å; Y301-L311 HydrophobicContact CG-CD1 4.35Å; I309-L311 HydrophobicContact CD1-CD2 3.74Å; I309-L311 HydrophobicContact CD1-CG 4.29Å; I309-L311 HydrophobicContact CG1-CD2 4.43Å; L311-R315 HydrophobicContact CB-CG 3.97Å
312	C	93.6	Very high	94.7	Very high	17 Å²	17	45.8 Å²	45.8	12%	0.115	25%	0.246	C	C	.	.			trans	-133.6	-108.1	-176.9	-166.3	0	0	0	0	110.7	L294 E314 R315	L294-C312 WeakPolarHBondContact CD2-SG 3.38Å; C312-E314 VanDerWaalsContact C-N 3.29Å; C312-E314 VanDerWaalsContact C-OE2 3.27Å; C312-E314 WeakPolarHBondContact CA-OE2 3.33Å; C312-E314 PolarHBondContact N-OE2 2.97Å; C312-E314 PolarHBondContact O-N 3.06Å; C312-R315 WeakPolarHBondContact O-CB 3.1Å; C312-R315 WeakPolarHBondContact O-CD 3.44Å; C312-R315 VanDerWaalsContact O-CG 3.25Å; C312-R315 WeakPolarHBondContact O-CG 3.13Å; C312-R315 PolarHBondContact O-N 3.29Å
313	Q	94.7	Very high	94.8	Very high	52 Å²	52	42.5 Å²	42.5	24%	0.243	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-24.2	-172	-62.3	-173.7	-16.6	0	0	113.3	L294 R315 F316 L317	L294-Q313 HydrophobicContact CD2-CG 3.83Å; Q313-R315 PolarHBondContact O-N 3.24Å; Q313-R315 VanDerWaalsContact O-N 3.08Å; Q313-F316 HydrophobicContact CB-CE1 3.95Å; Q313-F316 HydrophobicContact CB-CZ 4.13Å; Q313-F316 HydrophobicContact CG-CE1 4.13Å; Q313-F316 HydrophobicContact CG-CZ 4.28Å; Q313-F316 WeakPolarHBondContact O-CD1 3.16Å; Q313-F316 PolarHBondContact O-N 3.08Å; Q313-L317 HydrophobicContact CB-CD1 3.82Å; Q313-L317 HydrophobicContact CB-CG 4.37Å; Q313-L317 WeakPolarHBondContact O-CB 3.12Å; Q313-L317 VanDerWaalsContact O-CG 3.24Å; Q313-L317 WeakPolarHBondContact O-CG 3.43Å; Q313-L317 PolarHBondContact O-N 3.14Å
314	E	95	Very high	95	Very high	34 Å²	34	47.3 Å²	47.3	16%	0.159	25%	0.245	C	C	.	.	H	α-helix	trans	-57.2	-28.8	179.4	-49.1	71.1	-150.5	0	0	111.1	L253 L256 L257 A260 C312 F316 C318	L253-E314 HydrophobicContact CD1-CB 4.14Å; L256-E314 HydrophobicContact CB-CB 4.07Å; L256-E314 HydrophobicContact CB-CG 4.02Å; L257-E314 HydrophobicContact CD2-CB 4.36Å; L257-E314 HydrophobicContact CD2-CG 4.45Å; A260-E314 HydrophobicContact CB-CG 4.24Å; A260-E314 WeakPolarHBondContact CB-OE1 3.25Å; C312-E314 VanDerWaalsContact C-N 3.29Å; C312-E314 VanDerWaalsContact C-OE2 3.27Å; C312-E314 WeakPolarHBondContact CA-OE2 3.33Å; C312-E314 PolarHBondContact N-OE2 2.97Å; C312-E314 PolarHBondContact O-N 3.06Å; E314-F316 VanDerWaalsContact C-N 3.31Å; E314-F316 PolarHBondContact O-N 3.27Å; E314-C318 WeakPolarHBondContact O-CB 3.35Å; E314-C318 PolarHBondContact O-N 3.23Å; E314-C318 PolarHBondContact O-SG 2.8Å
315	R	95.8	Very high	95.4	Very high	38 Å²	38	42.5 Å²	42.5	14%	0.143	21%	0.214	C	C	.	.	H	α-helix	trans	-59	-37.5	-179.3	-64.3	172.9	60.7	-148.8	-6.3	113.4	C279 C280 F281 H297 L311 C312 Q313	C279-R315 PolarHBondContact O-NE 3.01Å; C279-R315 PolarHBondContact O-NH2 2.81Å; C280-R315 WeakPolarHBondContact CA-O 3.3Å; C280-R315 WeakPolarHBondContact CB-O 3.25Å; C280-R315 PolarHBondContact SG-O 2.78Å; C280-R315 VanDerWaalsContact SG-O 3.4Å; F281-R315 HydrophobicContact CD1-CB 4.3Å; F281-R315 HydrophobicContact CE1-CB 4.11Å; F281-R315 PolarHBondContact N-O 3Å; F281-R315 VanDerWaalsContact N-O 3.08Å; H297-R315 PolarHBondContact O-NH1 3.24Å; L311-R315 HydrophobicContact CB-CG 3.97Å; C312-R315 WeakPolarHBondContact O-CB 3.1Å; C312-R315 WeakPolarHBondContact O-CD 3.44Å; C312-R315 VanDerWaalsContact O-CG 3.25Å; C312-R315 WeakPolarHBondContact O-CG 3.13Å; C312-R315 PolarHBondContact O-N 3.29Å; Q313-R315 PolarHBondContact O-N 3.24Å; Q313-R315 VanDerWaalsContact O-N 3.08Å
316	F	96.1	Very high	95.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-106.3	-31	178.6	68.3	-95.4	0	0	0	112.8	F281 A283 E289 K290 Q313 E314 C318 S319	F281-F316 HydrophobicContact CD1-CB 4.36Å; F281-F316 HydrophobicContact CD2-CB 4.05Å; F281-F316 HydrophobicContact CE1-CB 4Å; F281-F316 HydrophobicContact CE1-CD1 4.33Å; F281-F316 HydrophobicContact CE2-CB 3.68Å; F281-F316 HydrophobicContact CE2-CD1 4.48Å; F281-F316 HydrophobicContact CE2-CG 4.35Å; F281-F316 HydrophobicContact CG-CB 4.38Å; F281-F316 HydrophobicContact CZ-CB 3.66Å; F281-F316 AromaticContact CZ-CD1 3.83Å; F281-F316 HydrophobicContact CZ-CD1 3.83Å; F281-F316 HydrophobicContact CZ-CG 4.1Å; F281-F316 WeakPolarHBondContact O-CA 3.39Å; A283-F316 HydrophobicContact CB-CB 4.14Å; A283-F316 HydrophobicContact CB-CD2 3.94Å; A283-F316 HydrophobicContact CB-CG 4.29Å; E289-F316 HydrophobicContact CB-CD2 4.18Å; E289-F316 HydrophobicContact CB-CE1 4.45Å; E289-F316 HydrophobicContact CB-CE2 3.79Å; E289-F316 HydrophobicContact CB-CZ 3.94Å; E289-F316 HydrophobicContact CG-CD1 3.9Å; E289-F316 HydrophobicContact CG-CD2 3.97Å; E289-F316 HydrophobicContact CG-CE1 3.78Å; E289-F316 HydrophobicContact CG-CE2 3.88Å; E289-F316 HydrophobicContact CG-CG 3.99Å; E289-F316 HydrophobicContact CG-CZ 3.78Å; K290-F316 HydrophobicContact CG-CE2 4.15Å; K290-F316 HydrophobicContact CG-CZ 4Å; Q313-F316 HydrophobicContact CB-CE1 3.95Å; Q313-F316 HydrophobicContact CB-CZ 4.13Å; Q313-F316 HydrophobicContact CG-CE1 4.13Å; Q313-F316 HydrophobicContact CG-CZ 4.28Å; Q313-F316 WeakPolarHBondContact O-CD1 3.16Å; Q313-F316 PolarHBondContact O-N 3.08Å; E314-F316 VanDerWaalsContact C-N 3.31Å; E314-F316 PolarHBondContact O-N 3.27Å; F316-C318 VanDerWaalsContact C-N 3.28Å; F316-C318 PolarHBondContact O-N 3.32Å; F316-S319 PolarHBondContact O-N 2.69Å; F316-S319 PolarHBondContact O-OG 3.15Å
317	L	96.6	Very high	96	Very high	34 Å²	34	40.9 Å²	40.9	18%	0.178	20%	0.198	C	C	.	.	H	α-helix	trans	-60.4	-35.6	178.7	-75.9	179.2	0	0	0	113.4	L256 K290 Q313 S319 E320	L256-L317 HydrophobicContact CD1-CB 4.11Å; K290-L317 VanDerWaalsContact CE-CD2 3.45Å; Q313-L317 HydrophobicContact CB-CD1 3.82Å; Q313-L317 HydrophobicContact CB-CG 4.37Å; Q313-L317 WeakPolarHBondContact O-CB 3.12Å; Q313-L317 VanDerWaalsContact O-CG 3.24Å; Q313-L317 WeakPolarHBondContact O-CG 3.43Å; Q313-L317 PolarHBondContact O-N 3.14Å; L317-S319 PolarHBondContact O-N 3.03Å; L317-E320 WeakPolarHBondContact O-CB 3.41Å; L317-E320 PolarHBondContact O-N 2.83Å
318	C	97.1	Very high	96.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-59.6	-36.5	178.9	64.9	0	0	0	0	111.9	L249 Y252 L253 L256 E314 F316 E320 M321	L249-C318 HydrophobicContact CD2-CB 4.23Å; L249-C318 HydrophobicContact CG-CB 4.37Å; Y252-C318 HydrophobicContact CD1-CB 4.38Å; Y252-C318 WeakPolarHBondContact CD1-O 3.39Å; L253-C318 HydrophobicContact CB-CB 4.04Å; L253-C318 HydrophobicContact CD1-CB 4.01Å; L256-C318 HydrophobicContact CD1-CB 3.91Å; E314-C318 WeakPolarHBondContact O-CB 3.35Å; E314-C318 PolarHBondContact O-N 3.23Å; E314-C318 PolarHBondContact O-SG 2.8Å; F316-C318 VanDerWaalsContact C-N 3.28Å; F316-C318 PolarHBondContact O-N 3.32Å; C318-E320 VanDerWaalsContact C-N 3.25Å; C318-E320 PolarHBondContact O-N 3.25Å; C318-M321 VanDerWaalsContact O-CG 3.3Å; C318-M321 WeakPolarHBondContact O-CG 3.43Å
319	S	97.2	Very high	96.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-72.5	-17.2	-175.9	73.8	0	0	0	0	114.1	F281 V282 F316 L317 M321 F322	F281-S319 PolarHBondContact O-OG 2.96Å; V282-S319 WeakPolarHBondContact CA-OG 3.12Å; F316-S319 PolarHBondContact O-N 2.69Å; F316-S319 PolarHBondContact O-OG 3.15Å; L317-S319 PolarHBondContact O-N 3.03Å; S319-M321 PolarHBondContact O-N 2.76Å; S319-M321 VanDerWaalsContact O-N 3.11Å; S319-F322 WeakPolarHBondContact O-CD2 3.14Å; S319-F322 PolarHBondContact O-N 3.44Å; S319-F322 VanDerWaalsContact O-N 3.13Å
320	E	97.8	Very high	96.3	Very high	18 Å²	18	41.5 Å²	41.5	8%	0.084	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-62.7	-20.7	178.9	-72.1	-50.6	116.7	0	0	113.2	P286 L317 C318 F322 F323 K324 L327 R373	P286-E320 HydrophobicContact CB-CG 4.04Å; P286-E320 HydrophobicContact CG-CG 3.8Å; P286-E320 WeakPolarHBondContact CG-OE1 3.38Å; P286-E320 WeakPolarHBondContact CG-OE2 3.28Å; L317-E320 WeakPolarHBondContact O-CB 3.41Å; L317-E320 PolarHBondContact O-N 2.83Å; C318-E320 VanDerWaalsContact C-N 3.25Å; C318-E320 PolarHBondContact O-N 3.25Å; E320-F322 PolarHBondContact O-N 3.02Å; E320-F322 VanDerWaalsContact O-N 3.13Å; E320-F323 PolarHBondContact O-N 3.18Å; E320-K324 PolarHBondContact O-N 2.92Å; E320-L327 HydrophobicContact CB-CD1 3.64Å; E320-R373 IonicContact OE1-CZ 3.72Å; E320-R373 IonicContact OE1-NH1 2.71Å; E320-R373 PolarHBondContact OE1-NH1 2.86Å; E320-R373 IonicContact OE1-NH2 2.7Å; E320-R373 IonicContact OE2-CZ 3.58Å; E320-R373 IonicContact OE2-NH1 2.77Å; E320-R373 PolarHBondContact OE2-NH1 3.36Å; E320-R373 IonicContact OE2-NH2 2.95Å; E320-R373 PolarHBondContact OE2-NH2 2.81Å
321	M	97.6	Very high	96.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-57.7	-27.4	175.4	68.8	162.5	-90.6	0	0	113.4	Y244 D248 L249 Y252 C318 S319 F323 K324 P325 I328	Y244-M321 HydrophobicContact CD2-CE 3.89Å; Y244-M321 HydrophobicContact CG-CE 4.22Å; D248-M321 HydrophobicContact CB-CE 3.7Å; D248-M321 HydrophobicContact CB-SD 4.26Å; L249-M321 WeakPolarHBondContact CA-SD 3.25Å; L249-M321 HydrophobicContact CB-SD 3.71Å; L249-M321 HydrophobicContact CG-SD 4.28Å; L249-M321 PolarHBondContact N-SD 2.93Å; Y252-M321 HydrophobicContact CD1-CB 4.23Å; Y252-M321 HydrophobicContact CD1-CG 4.5Å; C318-M321 VanDerWaalsContact O-CG 3.3Å; C318-M321 WeakPolarHBondContact O-CG 3.43Å; S319-M321 PolarHBondContact O-N 2.76Å; S319-M321 VanDerWaalsContact O-N 3.11Å; M321-F323 VanDerWaalsContact C-N 3.27Å; M321-F323 PolarHBondContact O-N 2.85Å; M321-K324 CarbonylContact O-C 3.58Å; M321-P325 VanDerWaalsContact O-CA 3.31Å; M321-P325 WeakPolarHBondContact O-CA 3.34Å; M321-I328 HydrophobicContact CB-CG2 3.91Å; M321-I328 HydrophobicContact CE-CD1 3.6Å; M321-I328 HydrophobicContact CE-CG1 4.5Å; M321-I328 HydrophobicContact SD-CD1 4.38Å; M321-I328 HydrophobicContact SD-CG2 3.88Å
322	F	98.3	Very high	96.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-69.5	-27.6	178	-67	-56.5	0	0	0	112.4	V219 Y244 L249 S319 E320 L335 L367 F370	V219-F322 HydrophobicContact CG1-CD1 4.2Å; V219-F322 HydrophobicContact CG1-CE1 3.61Å; V219-F322 HydrophobicContact CG1-CZ 4.04Å; Y244-F322 HydrophobicContact CD2-CD1 4.09Å; Y244-F322 HydrophobicContact CE2-CD1 4.06Å; L249-F322 HydrophobicContact CB-CZ 4.28Å; L249-F322 HydrophobicContact CD1-CD2 4.05Å; L249-F322 HydrophobicContact CD1-CE2 3.21Å; L249-F322 HydrophobicContact CD1-CZ 3.63Å; S319-F322 WeakPolarHBondContact O-CD2 3.14Å; S319-F322 PolarHBondContact O-N 3.44Å; S319-F322 VanDerWaalsContact O-N 3.13Å; E320-F322 PolarHBondContact O-N 3.02Å; E320-F322 VanDerWaalsContact O-N 3.13Å; F322-L335 WeakPolarHBondContact O-CB 3.41Å; F322-L335 PolarHBondContact O-N 3.3Å; F322-L367 HydrophobicContact CE2-CD1 4.18Å; F322-F370 HydrophobicContact CD2-CD2 4.42Å; F322-F370 AromaticContact CD2-CE2 3.58Å; F322-F370 HydrophobicContact CD2-CE2 3.58Å; F322-F370 HydrophobicContact CD2-CZ 4.36Å; F322-F370 AromaticContact CE2-CE2 3.81Å; F322-F370 HydrophobicContact CE2-CE2 3.81Å; F322-F370 HydrophobicContact CG-CE2 4.09Å; F322-F370 HydrophobicContact CG-CZ 4.44Å
323	F	98.1	Very high	96.7	Very high	14 Å²	14	50 Å²	50	6%	0.061	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-27.4	179.2	-56.4	-84.2	0	0	0	111.1	V282 E320 M321 H336 R373 L374 E377	V282-F323 HydrophobicContact CG1-CE2 3.8Å; V282-F323 HydrophobicContact CG1-CZ 4.42Å; E320-F323 PolarHBondContact O-N 3.18Å; M321-F323 VanDerWaalsContact C-N 3.27Å; M321-F323 PolarHBondContact O-N 2.85Å; F323-H336 HydrophobicContact CD1-CB 4.24Å; F323-H336 AromaticContact CD1-ND1 3.56Å; F323-H336 HydrophobicContact CE1-CB 4.46Å; F323-H336 PolarHBondContact O-CE1 3.25Å; F323-H336 VanDerWaalsContact O-CE1 3.22Å; F323-R373 HydrophobicContact CD1-CG 4.38Å; F323-R373 HydrophobicContact CD2-CG 4.21Å; F323-R373 HydrophobicContact CE1-CG 3.8Å; F323-R373 HydrophobicContact CE2-CB 4.46Å; F323-R373 HydrophobicContact CE2-CG 3.61Å; F323-R373 HydrophobicContact CZ-CB 4.07Å; F323-R373 HydrophobicContact CZ-CG 3.39Å; F323-L374 HydrophobicContact CE1-CD1 4.39Å; F323-E377 HydrophobicContact CD1-CG 3.88Å; F323-E377 HydrophobicContact CE1-CG 4.06Å
324	K	97.5	Very high	96.9	Very high	121 Å²	121	47.7 Å²	47.7	53%	0.526	24%	0.237	S	C	.	.			trans	-131.5	76.4	179.7	-160.2	175.4	-173	177.3	0	111.1	E320 M321 S326 L327	E320-K324 PolarHBondContact O-N 2.92Å; M321-K324 CarbonylContact O-C 3.58Å; K324-S326 PolarHBondContact O-N 2.92Å; K324-L327 HydrophobicContact CB-CD1 4.19Å; K324-L327 HydrophobicContact CB-CG 4.32Å; K324-L327 HydrophobicContact CD-CG 4.49Å; K324-L327 HydrophobicContact CG-CG 4.4Å; K324-L327 WeakPolarHBondContact O-CB 3.3Å; K324-L327 WeakPolarHBondContact O-CG 3.39Å; K324-L327 PolarHBondContact O-N 3.05Å
325	P	97.4	Very high	97.1	Very high	6 Å²	6	46.1 Å²	46.1	4%	0.039	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-61.6	-17	-176.1	-24.7	35.7	0	0	0	114.6	Y244 M321 L327 I328 S330	Y244-P325 HydrophobicContact CD1-CB 4.2Å; Y244-P325 HydrophobicContact CD1-CG 4.31Å; Y244-P325 HydrophobicContact CE1-CB 3.86Å; Y244-P325 HydrophobicContact CE1-CG 3.52Å; Y244-P325 HydrophobicContact CE2-CG 4.38Å; M321-P325 VanDerWaalsContact O-CA 3.31Å; M321-P325 WeakPolarHBondContact O-CA 3.34Å; P325-L327 PolarHBondContact O-N 3.5Å; P325-L327 VanDerWaalsContact O-N 3.09Å; P325-I328 WeakPolarHBondContact O-CG1 3.48Å; P325-I328 PolarHBondContact O-N 3.45Å; P325-S330 CarbonylContact C-O 3.51Å; P325-S330 PolarHBondContact O-N 2.7Å; P325-S330 VanDerWaalsContact O-N 3.11Å
326	S	97.2	Very high	97.2	Very high	72 Å²	72	45.3 Å²	45.3	50%	0.503	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-57.9	-23.1	172.9	69	0	0	0	0	113.1	K324 I328 K329 S330	K324-S326 PolarHBondContact O-N 2.92Å; S326-I328 PolarHBondContact O-N 2.59Å; S326-K329 PolarHBondContact O-N 2.98Å; S326-S330 PolarHBondContact N-O 2.98Å
327	L	96.4	Very high	97.3	Very high	67 Å²	67	47.4 Å²	47.4	35%	0.351	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-62.3	-31.5	175.3	-66.4	174.9	0	0	0	112.8	Y252 E320 K324 P325	Y252-L327 HydrophobicContact CE1-CB 4.34Å; Y252-L327 HydrophobicContact CE1-CD1 4.5Å; E320-L327 HydrophobicContact CB-CD1 3.64Å; K324-L327 HydrophobicContact CB-CD1 4.19Å; K324-L327 HydrophobicContact CB-CG 4.32Å; K324-L327 HydrophobicContact CD-CG 4.49Å; K324-L327 HydrophobicContact CG-CG 4.4Å; K324-L327 WeakPolarHBondContact O-CB 3.3Å; K324-L327 WeakPolarHBondContact O-CG 3.39Å; K324-L327 PolarHBondContact O-N 3.05Å; P325-L327 PolarHBondContact O-N 3.5Å; P325-L327 VanDerWaalsContact O-N 3.09Å
328	I	96.4	Very high	97.3	Very high	45 Å²	45	46.8 Å²	46.8	23%	0.231	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-100.4	19.1	174	61.2	161.2	0	0	0	112	Y244 D248 Y252 M321 P325 S326 S330	Y244-I328 HydrophobicContact CG-CD1 4.37Å; D248-I328 HydrophobicContact CB-CD1 4.17Å; Y252-I328 HydrophobicContact CD1-CG2 4.2Å; Y252-I328 HydrophobicContact CD2-CG2 4.16Å; Y252-I328 HydrophobicContact CG-CG2 3.8Å; M321-I328 HydrophobicContact CB-CG2 3.91Å; M321-I328 HydrophobicContact CE-CD1 3.6Å; M321-I328 HydrophobicContact CE-CG1 4.5Å; M321-I328 HydrophobicContact SD-CD1 4.38Å; M321-I328 HydrophobicContact SD-CG2 3.88Å; P325-I328 WeakPolarHBondContact O-CG1 3.48Å; P325-I328 PolarHBondContact O-N 3.45Å; S326-I328 PolarHBondContact O-N 2.59Å; I328-S330 PolarHBondContact O-N 3.18Å
329	K	96	Very high	97.4	Very high	196 Å²	196	46.8 Å²	46.8	85%	0.852	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.5	20.2	-177.6	-50.2	174.9	-177.1	175	0	114	S326	S326-K329 PolarHBondContact O-N 2.98Å
330	S	95.4	Very high	97.4	Very high	25 Å²	25	47.2 Å²	47.2	18%	0.175	24%	0.239	C	C	.	.			trans	-82.5	139.1	172.3	-179.5	0	0	0	0	110.5	P325 S326 I328 Q332	P325-S330 CarbonylContact C-O 3.51Å; P325-S330 PolarHBondContact O-N 2.7Å; P325-S330 VanDerWaalsContact O-N 3.11Å; S326-S330 PolarHBondContact N-O 2.98Å; I328-S330 PolarHBondContact O-N 3.18Å; S330-Q332 PolarHBondContact OG-N 2.84Å
331	M	96	Very high	97.4	Very high	188 Å²	188	48.1 Å²	48.1	93%	0.926	25%	0.247	S	C	*	.			trans	-91.4	-0.9	175	-61.3	-62	-69.1	0	0	112.6
332	Q	96.8	Very high	97.4	Very high	63 Å²	63	48.1 Å²	48.1	29%	0.294	25%	0.247	S	C	.	.	S	Bend	trans	-73.3	159.7	178.6	-69.6	179.3	-54.6	0	0	111.7	L242 D243 Y244 S330	L242-Q332 HydrophobicContact CD2-CB 4.2Å; D243-Q332 PolarHBondContact OD2-NE2 3.46Å; Y244-Q332 HydrophobicContact CD1-CB 4.46Å; Y244-Q332 HydrophobicContact CE1-CB 4.1Å; S330-Q332 PolarHBondContact OG-N 2.84Å
333	L	97.9	Very high	97.3	Very high	76 Å²	76	48.1 Å²	48.1	40%	0.398	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-65.1	149.3	176.6	-63.6	-178.2	0	0	0	111.4	L242 Y244 T337 Q338	L242-L333 WeakPolarHBondContact CD2-O 3.43Å; Y244-L333 WeakPolarHBondContact CE1-O 3.47Å; Y244-L333 PolarHBondContact OH-O 2.87Å; L333-T337 HydrophobicContact CD1-CG2 4.29Å; L333-T337 HydrophobicContact CD2-CG2 4.14Å; L333-Q338 HydrophobicContact CB-CB 4.32Å
334	G	98.3	Very high	97.1	Very high	5 Å²	5	52 Å²	52	5%	0.052	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-63.1	155.3	166.7	0	0	0	0	0	111.3	Y244 H336 T337 Q338	Y244-G334 VanDerWaalsContact OH-C 3.29Å; Y244-G334 WeakPolarHBondContact OH-CA 3.5Å; G334-H336 VanDerWaalsContact C-N 3.34Å; G334-H336 PolarHBondContact O-N 3.29Å; G334-T337 PolarHBondContact O-N 3.21Å; G334-T337 VanDerWaalsContact O-N 3.09Å; G334-Q338 PolarHBondContact O-N 3.31Å
335	L	98.4	Very high	97.1	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-57.5	-45.3	-173.7	-174.7	67.6	0	0	0	112.5	V217 V219 V226 L242 Y244 F322 Q338 T339 F370	V217-L335 HydrophobicContact CG1-CD1 3.83Å; V217-L335 HydrophobicContact CG1-CD2 3.99Å; V217-L335 HydrophobicContact CG1-CG 4.03Å; V219-L335 HydrophobicContact CG2-CD1 4.23Å; V219-L335 HydrophobicContact CG2-CD2 3.63Å; V226-L335 HydrophobicContact CG2-CD1 4.31Å; L242-L335 HydrophobicContact CD1-CD1 3.67Å; Y244-L335 PolarHBondContact OH-N 2.88Å; F322-L335 WeakPolarHBondContact O-CB 3.41Å; F322-L335 PolarHBondContact O-N 3.3Å; L335-Q338 PolarHBondContact O-N 3.38Å; L335-T339 WeakPolarHBondContact O-CB 3.36Å; L335-T339 PolarHBondContact O-N 3.46Å; L335-T339 PolarHBondContact O-OG1 3.46Å; L335-F370 HydrophobicContact CD2-CE1 3.78Å; L335-F370 HydrophobicContact CD2-CZ 3.55Å
336	H	98.2	Very high	96.9	Very high	22 Å²	22	52.1 Å²	52.1	10%	0.102	27%	0.27	C	S	.	.	H	α-helix	trans	-60.2	-46.5	175.1	65.4	-63	0	0	0	112	F323 G334 Q338 T339 V340 L374 E377 M381	F323-H336 HydrophobicContact CD1-CB 4.24Å; F323-H336 AromaticContact CD1-ND1 3.56Å; F323-H336 HydrophobicContact CE1-CB 4.46Å; F323-H336 PolarHBondContact O-CE1 3.25Å; F323-H336 VanDerWaalsContact O-CE1 3.22Å; G334-H336 VanDerWaalsContact C-N 3.34Å; G334-H336 PolarHBondContact O-N 3.29Å; H336-Q338 PolarHBondContact O-N 3.36Å; H336-T339 WeakPolarHBondContact O-CB 3.27Å; H336-T339 PolarHBondContact O-N 3.44Å; H336-V340 PolarHBondContact O-N 3.1Å; H336-L374 HydrophobicContact CB-CD1 3.97Å; H336-E377 HydrophobicContact CB-CB 3.63Å; H336-E377 HydrophobicContact CB-CG 4.26Å; H336-E377 IonicContact CD2-OE2 2.63Å; H336-M381 VanDerWaalsContact CD2-SD 3.52Å
337	T	98.1	Very high	96.8	Very high	43 Å²	43	55 Å²	55	26%	0.264	28%	0.28	S	S	.	.	H	α-helix	trans	-64.1	-41.4	176.8	-42.7	0	0	0	0	112.2	L333 G334 T339 V340 S341 M381	L333-T337 HydrophobicContact CD1-CG2 4.29Å; L333-T337 HydrophobicContact CD2-CG2 4.14Å; G334-T337 PolarHBondContact O-N 3.21Å; G334-T337 VanDerWaalsContact O-N 3.09Å; T337-T339 VanDerWaalsContact C-N 3.31Å; T337-T339 PolarHBondContact O-N 2.9Å; T337-V340 PolarHBondContact O-N 2.89Å; T337-S341 WeakPolarHBondContact O-CB 3.23Å; T337-S341 PolarHBondContact O-N 3.46Å; T337-M381 HydrophobicContact CG2-CE 4.26Å
338	Q	98.3	Very high	96.6	Very high	22 Å²	22	59.3 Å²	59.3	10%	0.103	30%	0.301	C	S	.	.	H	α-helix	trans	-63.3	-39.6	175.4	-175.7	61.1	41.3	0	0	111.3	V226 L242 L333 G334 L335 H336 S341 C342	V226-Q338 HydrophobicContact CG2-CG 4.06Å; L242-Q338 HydrophobicContact CD1-CB 3.97Å; L242-Q338 HydrophobicContact CD1-CG 4Å; L242-Q338 HydrophobicContact CD2-CB 4.17Å; L242-Q338 HydrophobicContact CD2-CG 4.01Å; L242-Q338 HydrophobicContact CG-CB 4.43Å; L242-Q338 HydrophobicContact CG-CG 4.07Å; L333-Q338 HydrophobicContact CB-CB 4.32Å; G334-Q338 PolarHBondContact O-N 3.31Å; L335-Q338 PolarHBondContact O-N 3.38Å; H336-Q338 PolarHBondContact O-N 3.36Å; Q338-S341 WeakPolarHBondContact O-CB 3.12Å; Q338-S341 PolarHBondContact O-N 3.47Å; Q338-C342 PolarHBondContact NE2-SG 2.93Å; Q338-C342 PolarHBondContact O-N 3.49Å; Q338-C342 PolarHBondContact O-SG 3.39Å; Q338-C342 VanDerWaalsContact O-SG 3.4Å
339	T	98.3	Very high	96.3	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-59.7	-49	176.7	-57.1	0	0	0	0	111.1	L215 V217 L335 H336 T337 C342 L343 L378	L215-T339 HydrophobicContact CD2-CG2 3.48Å; L215-T339 VanDerWaalsContact CD2-CG2 3.48Å; V217-T339 HydrophobicContact CG2-CG2 4.07Å; L335-T339 WeakPolarHBondContact O-CB 3.36Å; L335-T339 PolarHBondContact O-N 3.46Å; L335-T339 PolarHBondContact O-OG1 3.46Å; H336-T339 WeakPolarHBondContact O-CB 3.27Å; H336-T339 PolarHBondContact O-N 3.44Å; T337-T339 VanDerWaalsContact C-N 3.31Å; T337-T339 PolarHBondContact O-N 2.9Å; T339-C342 PolarHBondContact O-N 3.37Å; T339-L343 HydrophobicContact CG2-CD1 4.43Å; T339-L343 WeakPolarHBondContact O-CG 3.45Å; T339-L343 PolarHBondContact O-N 3.39Å; T339-L343 VanDerWaalsContact O-N 3.09Å; T339-L378 HydrophobicContact CG2-CD1 4.28Å; T339-L378 HydrophobicContact CG2-CD2 3.88Å
340	V	97.5	Very high	96.2	Very high	9 Å²	9	52 Å²	52	6%	0.055	28%	0.28	C	S	.	.	H	α-helix	trans	-66	-37.7	176	175.7	0	0	0	0	111.8	H336 T337 C342 L343 N344 L378 M381	H336-V340 PolarHBondContact O-N 3.1Å; T337-V340 PolarHBondContact O-N 2.89Å; V340-C342 PolarHBondContact O-N 3.15Å; V340-L343 PolarHBondContact O-N 3.32Å; V340-N344 WeakPolarHBondContact CG1-ND2 3.39Å; V340-N344 WeakPolarHBondContact O-CB 3.19Å; V340-N344 VanDerWaalsContact O-CG 3.28Å; V340-N344 PolarHBondContact O-N 2.81Å; V340-N344 PolarHBondContact O-ND2 3.08Å; V340-L378 HydrophobicContact CG2-CD2 3.66Å; V340-M381 HydrophobicContact CB-CE 3.89Å; V340-M381 HydrophobicContact CB-SD 4.42Å; V340-M381 HydrophobicContact CG1-CE 4.05Å; V340-M381 HydrophobicContact CG2-CB 4.06Å; V340-M381 HydrophobicContact CG2-CE 3.92Å; V340-M381 HydrophobicContact CG2-SD 3.83Å
341	S	97.4	Very high	96.2	Very high	36 Å²	36	52.8 Å²	52.8	25%	0.252	28%	0.281	S	S	.	.	H	α-helix	trans	-60.2	-44.3	176.1	-177.4	0	0	0	0	111.9	T337 Q338 N344 K345	T337-S341 WeakPolarHBondContact O-CB 3.23Å; T337-S341 PolarHBondContact O-N 3.46Å; Q338-S341 WeakPolarHBondContact O-CB 3.12Å; Q338-S341 PolarHBondContact O-N 3.47Å; S341-N344 PolarHBondContact O-N 2.95Å; S341-K345 WeakPolarHBondContact O-CG 3.3Å; S341-K345 PolarHBondContact O-N 3.48Å
342	C	96.8	Very high	96.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.4	-46.3	173.8	-69.7	0	0	0	0	111.5	V226 I238 G240 Q338 T339 V340 N344 K345	V226-C342 HydrophobicContact CG1-CB 3.82Å; I238-C342 HydrophobicContact CG2-CB 4.14Å; I238-C342 WeakPolarHBondContact CG2-O 3.42Å; I238-C342 PolarHBondContact O-SG 2.78Å; G240-C342 PolarHBondContact N-SG 3.12Å; G240-C342 VanDerWaalsContact N-SG 3.44Å; Q338-C342 PolarHBondContact NE2-SG 2.93Å; Q338-C342 PolarHBondContact O-N 3.49Å; Q338-C342 PolarHBondContact O-SG 3.39Å; Q338-C342 VanDerWaalsContact O-SG 3.4Å; T339-C342 PolarHBondContact O-N 3.37Å; V340-C342 PolarHBondContact O-N 3.15Å; C342-N344 VanDerWaalsContact C-N 3.32Å; C342-N344 PolarHBondContact O-N 3.46Å; C342-K345 PolarHBondContact O-N 3.06Å
343	L	96.1	Very high	95.9	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-61	-38	178	-75.3	168.4	0	0	0	113	L215 T339 V340 K345 C346 K351 L354 M355 I358	L215-L343 HydrophobicContact CD2-CD1 3.92Å; L215-L343 HydrophobicContact CD2-CD2 3.89Å; L215-L343 HydrophobicContact CD2-CG 3.71Å; T339-L343 HydrophobicContact CG2-CD1 4.43Å; T339-L343 WeakPolarHBondContact O-CG 3.45Å; T339-L343 PolarHBondContact O-N 3.39Å; T339-L343 VanDerWaalsContact O-N 3.09Å; V340-L343 PolarHBondContact O-N 3.32Å; L343-K345 VanDerWaalsContact C-N 3.26Å; L343-K345 PolarHBondContact O-N 3.5Å; L343-C346 WeakPolarHBondContact O-CB 3.26Å; L343-C346 PolarHBondContact O-N 2.82Å; L343-K351 HydrophobicContact CB-CG 4.3Å; L343-L354 HydrophobicContact CD2-CB 3.67Å; L343-L354 HydrophobicContact CD2-CD1 4.38Å; L343-M355 HydrophobicContact CD1-CE 4.06Å; L343-M355 HydrophobicContact CD1-CG 3.85Å; L343-M355 HydrophobicContact CD2-CG 4.09Å; L343-I358 HydrophobicContact CD1-CD1 4.39Å
344	N	95.5	Very high	95.8	Very high	95 Å²	95	49 Å²	49	51%	0.508	25%	0.254	S	S	.	.	H	α-helix	trans	-74.2	-15.4	179.9	-73.6	-20.2	0	0	0	113.8	V340 S341 C342 K351	V340-N344 WeakPolarHBondContact CG1-ND2 3.39Å; V340-N344 WeakPolarHBondContact O-CB 3.19Å; V340-N344 VanDerWaalsContact O-CG 3.28Å; V340-N344 PolarHBondContact O-N 2.81Å; V340-N344 PolarHBondContact O-ND2 3.08Å; S341-N344 PolarHBondContact O-N 2.95Å; C342-N344 VanDerWaalsContact C-N 3.32Å; C342-N344 PolarHBondContact O-N 3.46Å; N344-K351 PolarHBondContact OD1-NZ 3.12Å
345	K	96.4	Very high	95.6	Very high	118 Å²	118	49 Å²	49	51%	0.513	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-12.2	171.5	-69.9	173	-176.8	-176.7	0	112.6	I238 S341 C342 L343	I238-K345 HydrophobicContact CG1-CB 4.24Å; I238-K345 HydrophobicContact CG2-CB 3.8Å; I238-K345 HydrophobicContact CG2-CD 4.3Å; S341-K345 WeakPolarHBondContact O-CG 3.3Å; S341-K345 PolarHBondContact O-N 3.48Å; C342-K345 PolarHBondContact O-N 3.06Å; L343-K345 VanDerWaalsContact C-N 3.26Å; L343-K345 PolarHBondContact O-N 3.5Å
346	C	94.3	Very high	95.4	Very high	12 Å²	12	50.4 Å²	50.4	8%	0.081	27%	0.267	C	S	.	.	S	Bend	trans	-81.4	151.8	174.4	-63.6	0	0	0	0	111	L343 L350 K351	L343-C346 WeakPolarHBondContact O-CB 3.26Å; L343-C346 PolarHBondContact O-N 2.82Å; C346-L350 HydrophobicContact CB-CB 4.33Å; C346-L350 HydrophobicContact CB-CD2 3.92Å; C346-L350 HydrophobicContact CB-CG 4.1Å; C346-K351 HydrophobicContact CB-CB 4.25Å
347	D	93.4	Very high	95.3	Very high	133 Å²	133	51.2 Å²	51.2	71%	0.711	27%	0.272	S	S	*	.			trans	-59.8	152.2	169	-64.5	-36.2	0	0	0	111.3	A349 L350 K351	D347-A349 VanDerWaalsContact C-N 3.28Å; D347-A349 PolarHBondContact O-N 3.41Å; D347-L350 PolarHBondContact O-N 3.33Å; D347-L350 VanDerWaalsContact O-N 3.08Å; D347-K351 WeakPolarHBondContact O-CB 3.47Å; D347-K351 PolarHBondContact O-N 3.02Å
348	I	92.3	Very high	95.3	Very high	156 Å²	156	49.1 Å²	49.1	80%	0.8	26%	0.259	S	S	*	.	H	α-helix	trans	-54.7	-42.6	-171.9	-61.8	171.4	0	0	0	112.3	R352	I348-R352 PolarHBondContact O-N 3.24Å
349	A	91.6	Very high	95.3	Very high	63 Å²	63	48.1 Å²	48.1	52%	0.521	25%	0.254	S	S	.	.	H	α-helix	trans	-63.4	-49.8	178.9	0	0	0	0	0	111.4	D347 R352 D353	D347-A349 VanDerWaalsContact C-N 3.28Å; D347-A349 PolarHBondContact O-N 3.41Å; A349-R352 PolarHBondContact O-N 2.85Å; A349-D353 PolarHBondContact O-N 2.97Å
350	L	93.9	Very high	95.3	Very high	25 Å²	25	48.1 Å²	48.1	13%	0.131	25%	0.254	C	S	.	.	H	α-helix	trans	-62.6	-45	178.4	177.3	62.6	0	0	0	111.4	Y230 L235 C346 D347 R352 D353 L354	Y230-L350 HydrophobicContact CD2-CD1 3.33Å; Y230-L350 HydrophobicContact CE2-CD1 4.08Å; Y230-L350 HydrophobicContact CG-CD1 3.85Å; L235-L350 HydrophobicContact CD1-CD2 3.59Å; C346-L350 HydrophobicContact CB-CB 4.33Å; C346-L350 HydrophobicContact CB-CD2 3.92Å; C346-L350 HydrophobicContact CB-CG 4.1Å; D347-L350 PolarHBondContact O-N 3.33Å; D347-L350 VanDerWaalsContact O-N 3.08Å; L350-R352 VanDerWaalsContact C-N 3.3Å; L350-R352 PolarHBondContact O-N 3.42Å; L350-D353 PolarHBondContact O-N 3.03Å; L350-D353 VanDerWaalsContact O-N 3.15Å; L350-L354 HydrophobicContact CD1-CD1 3.91Å; L350-L354 HydrophobicContact CD1-CD2 4.11Å; L350-L354 HydrophobicContact CD1-CG 3.77Å; L350-L354 HydrophobicContact CD2-CD1 4.24Å; L350-L354 HydrophobicContact CG-CD1 3.73Å; L350-L354 HydrophobicContact CG-CG 4.01Å; L350-L354 WeakPolarHBondContact O-CB 3.3Å; L350-L354 VanDerWaalsContact O-CG 3.26Å; L350-L354 WeakPolarHBondContact O-CG 3.49Å; L350-L354 PolarHBondContact O-N 3.16Å
351	K	95.2	Very high	95.3	Very high	42 Å²	42	47.7 Å²	47.7	18%	0.183	25%	0.252	C	S	.	.	H	α-helix	trans	-53.7	-47.4	178.5	175.9	179.7	171.2	-179.4	0	111.4	L343 N344 C346 D347 D353 L354 M355 D385	L343-K351 HydrophobicContact CB-CG 4.3Å; N344-K351 PolarHBondContact OD1-NZ 3.12Å; C346-K351 HydrophobicContact CB-CB 4.25Å; D347-K351 WeakPolarHBondContact O-CB 3.47Å; D347-K351 PolarHBondContact O-N 3.02Å; K351-D353 VanDerWaalsContact C-N 3.34Å; K351-D353 PolarHBondContact O-N 3.39Å; K351-L354 PolarHBondContact O-N 2.7Å; K351-M355 HydrophobicContact CD-CE 4.42Å; K351-M355 HydrophobicContact CG-CE 4.32Å; K351-M355 HydrophobicContact CG-CG 4.44Å; K351-M355 HydrophobicContact CG-SD 3.99Å; K351-M355 WeakPolarHBondContact O-CB 3.26Å; K351-M355 VanDerWaalsContact O-CG 3.3Å; K351-M355 WeakPolarHBondContact O-CG 3.25Å; K351-M355 PolarHBondContact O-N 3.18Å; K351-D385 IonicContact NZ-OD2 3.75Å
352	R	92.6	Very high	95.2	Very high	173 Å²	173	46.6 Å²	46.6	65%	0.653	25%	0.247	S	C	*	.	H	α-helix	trans	-60.6	-44.1	179.6	-174.6	-175.6	64.2	178.4	-2.5	111.6	I348 A349 L350 M355 G356	I348-R352 PolarHBondContact O-N 3.24Å; A349-R352 PolarHBondContact O-N 2.85Å; L350-R352 VanDerWaalsContact C-N 3.3Å; L350-R352 PolarHBondContact O-N 3.42Å; R352-M355 PolarHBondContact O-N 3.41Å; R352-G356 PolarHBondContact O-N 2.85Å
353	D	92.6	Very high	95.2	Very high	73 Å²	73	48.5 Å²	48.5	39%	0.39	27%	0.266	S	S	.	.	H	α-helix	trans	-69.2	-38.4	-178.9	-65.3	-4.2	0	0	0	111.6	A349 L350 K351 N357	A349-D353 PolarHBondContact O-N 2.97Å; L350-D353 PolarHBondContact O-N 3.03Å; L350-D353 VanDerWaalsContact O-N 3.15Å; K351-D353 VanDerWaalsContact C-N 3.34Å; K351-D353 PolarHBondContact O-N 3.39Å; D353-N357 PolarHBondContact O-ND2 3.36Å
354	L	95.7	Very high	95.2	Very high	2 Å²	2	49 Å²	49	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-70.1	-35.5	176.5	-66.8	-176.5	0	0	0	112.6	G214 L215 P228 L343 L350 K351 G356 N357 I358	G214-L354 VanDerWaalsContact C-CD2 3.41Å; L215-L354 HydrophobicContact CB-CB 4.37Å; P228-L354 HydrophobicContact CB-CD1 3.68Å; L343-L354 HydrophobicContact CD2-CB 3.67Å; L343-L354 HydrophobicContact CD2-CD1 4.38Å; L350-L354 HydrophobicContact CD1-CD1 3.91Å; L350-L354 HydrophobicContact CD1-CD2 4.11Å; L350-L354 HydrophobicContact CD1-CG 3.77Å; L350-L354 HydrophobicContact CD2-CD1 4.24Å; L350-L354 HydrophobicContact CG-CD1 3.73Å; L350-L354 HydrophobicContact CG-CG 4.01Å; L350-L354 WeakPolarHBondContact O-CB 3.3Å; L350-L354 VanDerWaalsContact O-CG 3.26Å; L350-L354 WeakPolarHBondContact O-CG 3.49Å; L350-L354 PolarHBondContact O-N 3.16Å; K351-L354 PolarHBondContact O-N 2.7Å; L354-G356 VanDerWaalsContact C-N 3.3Å; L354-G356 PolarHBondContact O-N 3.01Å; L354-N357 CarbonylContact O-C 3.58Å; L354-N357 VanDerWaalsContact O-C 3.24Å; L354-N357 PolarHBondContact O-N 2.86Å; L354-I358 WeakPolarHBondContact O-CG1 3.35Å; L354-I358 PolarHBondContact O-N 2.93Å
355	M	94.9	Very high	95.3	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.02	25%	0.246	C	C	.	.	H	α-helix	trans	-61.2	-37.3	177.5	-83.7	177	152.6	0	0	112.5	L343 K351 R352 N357 C382 D385 P387 Q388	L343-M355 HydrophobicContact CD1-CE 4.06Å; L343-M355 HydrophobicContact CD1-CG 3.85Å; L343-M355 HydrophobicContact CD2-CG 4.09Å; K351-M355 HydrophobicContact CD-CE 4.42Å; K351-M355 HydrophobicContact CG-CE 4.32Å; K351-M355 HydrophobicContact CG-CG 4.44Å; K351-M355 HydrophobicContact CG-SD 3.99Å; K351-M355 WeakPolarHBondContact O-CB 3.26Å; K351-M355 VanDerWaalsContact O-CG 3.3Å; K351-M355 WeakPolarHBondContact O-CG 3.25Å; K351-M355 PolarHBondContact O-N 3.18Å; R352-M355 PolarHBondContact O-N 3.41Å; M355-N357 PolarHBondContact O-N 2.84Å; M355-C382 HydrophobicContact CE-CB 3.91Å; M355-D385 HydrophobicContact CE-CB 3.87Å; M355-D385 VanDerWaalsContact CE-OD2 3.3Å; M355-D385 WeakPolarHBondContact CE-OD2 3.43Å; M355-D385 HydrophobicContact SD-CB 3.39Å; M355-D385 WeakPolarHBondContact SD-CB 3.49Å; M355-P387 CarbonylContact O-C 3.41Å; M355-P387 VanDerWaalsContact O-CA 3.3Å; M355-P387 WeakPolarHBondContact O-CA 3.28Å; M355-Q388 PolarHBondContact O-N 2.98Å
356	G	94.3	Very high	95.4	Very high	29 Å²	29	42.6 Å²	42.6	30%	0.299	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-9	173.9	0	0	0	0	0	114.5	R352 L354	R352-G356 PolarHBondContact O-N 2.85Å; L354-G356 VanDerWaalsContact C-N 3.3Å; L354-G356 PolarHBondContact O-N 3.01Å
357	N	95.7	Very high	95.5	Very high	39 Å²	39	42.7 Å²	42.7	21%	0.209	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.2	52.2	-171.1	-65.2	-69.3	0	0	0	111.7	G214 L215 D353 L354 M355	G214-N357 CarbonylContact C-O 3.59Å; G214-N357 VanDerWaalsContact CA-O 3.3Å; G214-N357 WeakPolarHBondContact CA-O 3.36Å; L215-N357 PolarHBondContact N-O 3.11Å; D353-N357 PolarHBondContact O-ND2 3.36Å; L354-N357 CarbonylContact O-C 3.58Å; L354-N357 VanDerWaalsContact O-C 3.24Å; L354-N357 PolarHBondContact O-N 2.86Å; M355-N357 PolarHBondContact O-N 2.84Å
358	I	98.3	Very high	95.7	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	116.2	173.8	-55	176	0	0	0	107.9	L215 V217 L343 L354 L378 P387 Q388 V389 N390	L215-I358 HydrophobicContact CB-CG1 4.33Å; L215-I358 HydrophobicContact CD2-CG1 4.22Å; L215-I358 HydrophobicContact CD2-CG2 4.45Å; L215-I358 CarbonylContact O-C 3.59Å; L215-I358 WeakPolarHBondContact O-CA 3.48Å; V217-I358 HydrophobicContact CG2-CG2 3.75Å; L343-I358 HydrophobicContact CD1-CD1 4.39Å; L354-I358 WeakPolarHBondContact O-CG1 3.35Å; L354-I358 PolarHBondContact O-N 2.93Å; I358-L378 HydrophobicContact CD1-CD1 3.66Å; I358-P387 HydrophobicContact CD1-CB 4.05Å; I358-Q388 WeakPolarHBondContact CB-O 3.3Å; I358-Q388 PolarHBondContact N-O 3.41Å; I358-Q388 VanDerWaalsContact N-O 3.09Å; I358-V389 HydrophobicContact CG2-CG2 4.43Å; I358-N390 PolarHBondContact O-N 3.48Å
359	L	98.3	Very high	96	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	115.8	-174	-50	-178.5	0	0	0	109.7	M206 Y209 R211 L215 V216 V217 N390	M206-L359 HydrophobicContact CB-CD1 4.2Å; M206-L359 HydrophobicContact CG-CD1 3.85Å; Y209-L359 HydrophobicContact CD1-CB 4.46Å; Y209-L359 HydrophobicContact CD1-CD2 3.77Å; Y209-L359 HydrophobicContact CD1-CG 4.48Å; Y209-L359 HydrophobicContact CD2-CB 4.4Å; Y209-L359 HydrophobicContact CD2-CD1 4.34Å; Y209-L359 HydrophobicContact CE1-CB 4.43Å; Y209-L359 HydrophobicContact CE1-CD2 4.28Å; Y209-L359 HydrophobicContact CE2-CB 4.41Å; Y209-L359 HydrophobicContact CG-CB 4.44Å; Y209-L359 HydrophobicContact CG-CD1 4.05Å; Y209-L359 HydrophobicContact CG-CD2 4.09Å; Y209-L359 HydrophobicContact CG-CG 4.42Å; R211-L359 HydrophobicContact CB-CD1 4.4Å; R211-L359 HydrophobicContact CG-CD1 4.37Å; L215-L359 PolarHBondContact O-N 3.17Å; V216-L359 WeakPolarHBondContact CA-O 3.39Å; V217-L359 PolarHBondContact N-O 2.75Å; L359-N390 HydrophobicContact CD2-CB 3.93Å
360	L	98.2	Very high	96.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	122.1	-176.3	-176.5	70.1	0	0	0	111.2	Y209 V217 T365 F370 P371 L374 V389 N390 V391 R395	Y209-L360 PolarHBondContact OH-O 3.46Å; V217-L360 HydrophobicContact CB-CD1 4.12Å; V217-L360 HydrophobicContact CG1-CD1 3.95Å; V217-L360 WeakPolarHBondContact O-CA 3.46Å; L360-T365 HydrophobicContact CD1-CG2 3.52Å; L360-T365 HydrophobicContact CD2-CG2 4.35Å; L360-T365 HydrophobicContact CG-CG2 3.73Å; L360-F370 HydrophobicContact CD1-CD1 4.27Å; L360-F370 HydrophobicContact CD1-CE1 3.93Å; L360-F370 HydrophobicContact CD2-CD1 3.79Å; L360-F370 HydrophobicContact CD2-CE1 4.3Å; L360-P371 HydrophobicContact CD2-CB 4.13Å; L360-P371 HydrophobicContact CD2-CG 3.93Å; L360-L374 HydrophobicContact CD1-CD2 3.89Å; L360-V389 HydrophobicContact CB-CG1 4.15Å; L360-V389 HydrophobicContact CD2-CG1 4.38Å; L360-N390 PolarHBondContact N-O 2.96Å; L360-V391 HydrophobicContact CB-CG1 3.95Å; L360-V391 HydrophobicContact CD2-CG1 3.91Å; L360-V391 HydrophobicContact CG-CG1 4.47Å; L360-R395 VanDerWaalsContact O-CD 3.32Å; L360-R395 WeakPolarHBondContact O-CD 3.44Å
361	C	97.4	Very high	96.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	163	-173.5	-48.1	0	0	0	0	112.8	Y209 V217 E218 V219 T365 A398	Y209-C361 WeakPolarHBondContact CE2-SG 3.37Å; V217-C361 PolarHBondContact O-N 2.74Å; E218-C361 CarbonylContact C-O 3.56Å; E218-C361 VanDerWaalsContact CA-O 3.3Å; E218-C361 WeakPolarHBondContact CA-O 3.36Å; E218-C361 HydrophobicContact CG-CB 4.12Å; V219-C361 PolarHBondContact N-O 2.98Å; C361-T365 WeakPolarHBondContact O-CG2 3.49Å; C361-A398 HydrophobicContact CB-CB 4.29Å
362	G	96.3	Very high	96.7	Very high	14 Å²	14	33.9 Å²	33.9	14%	0.144	20%	0.2	C	C	.	.	S	Bend	trans	96.8	153.8	175	0	0	0	0	0	113.9	V219 S364 T365 R395	V219-G362 CarbonylContact O-C 3.53Å; V219-G362 VanDerWaalsContact O-C 3.26Å; V219-G362 WeakPolarHBondContact O-CA 3.45Å; G362-S364 VanDerWaalsContact C-N 3.34Å; G362-S364 PolarHBondContact O-N 3.12Å; G362-T365 WeakPolarHBondContact O-CB 3.37Å; G362-T365 PolarHBondContact O-N 2.89Å; G362-T365 VanDerWaalsContact O-N 3.14Å; G362-T365 PolarHBondContact O-OG1 3.04Å; G362-R395 PolarHBondContact N-O 3.21Å
363	G	95.8	Very high	96.9	Very high	40 Å²	40	26.3 Å²	26.3	41%	0.412	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-62.9	-32.4	-168.2	0	0	0	0	0	115	V219 T365 M366	V219-G363 PolarHBondContact O-N 2.92Å; G363-T365 PolarHBondContact O-N 3.23Å; G363-M366 WeakPolarHBondContact O-CB 3.5Å; G363-M366 WeakPolarHBondContact O-CG 3.43Å; G363-M366 PolarHBondContact O-N 3.31Å; G363-M366 VanDerWaalsContact O-N 3.14Å
364	S	97.2	Very high	97.2	Very high	12 Å²	12	22.8 Å²	22.8	8%	0.084	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-72.9	-21.6	-179.8	-63.1	0	0	0	0	112.5	V219 G220 G246 G362 M366	V219-S364 PolarHBondContact O-N 2.98Å; V219-S364 VanDerWaalsContact O-N 3.13Å; G220-S364 PolarHBondContact O-OG 3.09Å; G246-S364 WeakPolarHBondContact CA-OG 3.34Å; G246-S364 PolarHBondContact N-OG 2.9Å; G362-S364 VanDerWaalsContact C-N 3.34Å; G362-S364 PolarHBondContact O-N 3.12Å; S364-M366 PolarHBondContact O-N 3.32Å
365	T	97.9	Very high	97.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-73.6	-5.9	173.2	76.4	0	0	0	0	112.9	V219 L360 C361 G362 G363 L367 F370 R395	V219-T365 HydrophobicContact CB-CG2 3.6Å; V219-T365 HydrophobicContact CG2-CG2 3.68Å; L360-T365 HydrophobicContact CD1-CG2 3.52Å; L360-T365 HydrophobicContact CD2-CG2 4.35Å; L360-T365 HydrophobicContact CG-CG2 3.73Å; C361-T365 WeakPolarHBondContact O-CG2 3.49Å; G362-T365 WeakPolarHBondContact O-CB 3.37Å; G362-T365 PolarHBondContact O-N 2.89Å; G362-T365 VanDerWaalsContact O-N 3.14Å; G362-T365 PolarHBondContact O-OG1 3.04Å; G363-T365 PolarHBondContact O-N 3.23Å; T365-L367 VanDerWaalsContact C-N 3.25Å; T365-L367 PolarHBondContact O-N 2.84Å; T365-F370 HydrophobicContact CG2-CE1 4.33Å; T365-F370 HydrophobicContact CG2-CZ 4.44Å; T365-R395 PolarHBondContact O-NE 3.09Å; T365-R395 PolarHBondContact O-NH2 2.94Å; T365-R395 VanDerWaalsContact OG1-CD 3.31Å; T365-R395 WeakPolarHBondContact OG1-CD 3.35Å; T365-R395 PolarHBondContact OG1-NE 3.19Å; T365-R395 VanDerWaalsContact OG1-NE 3.12Å
366	M	97.6	Very high	97.5	Very high	78 Å²	78	28.5 Å²	28.5	38%	0.384	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-74.6	-12.7	176.4	-64.2	-60.9	-70.7	0	0	113.5	G363 S364 S368 P393 R395 D396	G363-M366 WeakPolarHBondContact O-CB 3.5Å; G363-M366 WeakPolarHBondContact O-CG 3.43Å; G363-M366 PolarHBondContact O-N 3.31Å; G363-M366 VanDerWaalsContact O-N 3.14Å; S364-M366 PolarHBondContact O-N 3.32Å; M366-S368 PolarHBondContact O-N 3.18Å; M366-P393 WeakPolarHBondContact CE-O 3.17Å; M366-R395 HydrophobicContact SD-CG 3.47Å; M366-R395 WeakPolarHBondContact SD-CG 3.4Å; M366-R395 VanDerWaalsContact SD-CZ 3.53Å; M366-D396 HydrophobicContact CG-CB 3.89Å; M366-D396 HydrophobicContact SD-CB 4.33Å
367	L	97.4	Very high	97.6	Very high	14 Å²	14	29 Å²	29	7%	0.073	17%	0.173	C	C	.	.	S	Bend	trans	-55	132.4	171.9	-67.8	173.3	0	0	0	109.8	L249 K276 C280 V282 F322 T365 F370	L249-L367 HydrophobicContact CD1-CD1 3.94Å; K276-L367 HydrophobicContact CG-CD2 4.49Å; C280-L367 HydrophobicContact CB-CD2 4.01Å; V282-L367 HydrophobicContact CG2-CB 3.85Å; V282-L367 HydrophobicContact CG2-CD1 4.27Å; F322-L367 HydrophobicContact CE2-CD1 4.18Å; T365-L367 VanDerWaalsContact C-N 3.25Å; T365-L367 PolarHBondContact O-N 2.84Å; L367-F370 HydrophobicContact CB-CD2 4.5Å; L367-F370 VanDerWaalsContact O-CB 3.25Å; L367-F370 WeakPolarHBondContact O-CB 3.38Å; L367-F370 PolarHBondContact O-N 3.4Å
368	S	97.3	Very high	97.7	Very high	75 Å²	75	27.3 Å²	27.3	52%	0.524	16%	0.164	S	C	.	.	B	Isolated β-bridge	trans	-62	142.8	179.7	55.9	0	0	0	0	110.2	F281 V282 M366 F370	F281-S368 WeakPolarHBondContact CB-OG 3.33Å; V282-S368 PolarHBondContact N-O 3.36Å; M366-S368 PolarHBondContact O-N 3.18Å; S368-F370 PolarHBondContact O-N 3.3Å
369	G	97.6	Very high	97.7	Very high	26 Å²	26	29.8 Å²	29.8	27%	0.268	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	-13.3	-176.3	0	0	0	0	0	115.8	N372 R373	G369-N372 PolarHBondContact O-N 3.49Å; G369-R373 PolarHBondContact O-N 3.18Å
370	F	98.5	Very high	97.6	Very high	0 Å²	0	34 Å²	34	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-53.9	-49.4	-178.8	-162.2	-64.5	0	0	0	113.2	V219 V282 F322 L335 L360 T365 L367 S368 N372 R373 L374	V219-F370 HydrophobicContact CG2-CZ 4.06Å; V282-F370 HydrophobicContact CB-CB 4.42Å; V282-F370 HydrophobicContact CG2-CB 3.74Å; V282-F370 HydrophobicContact CG2-CD2 3.68Å; V282-F370 HydrophobicContact CG2-CG 4.05Å; F322-F370 HydrophobicContact CD2-CD2 4.42Å; F322-F370 AromaticContact CD2-CE2 3.58Å; F322-F370 HydrophobicContact CD2-CE2 3.58Å; F322-F370 HydrophobicContact CD2-CZ 4.36Å; F322-F370 AromaticContact CE2-CE2 3.81Å; F322-F370 HydrophobicContact CE2-CE2 3.81Å; F322-F370 HydrophobicContact CG-CE2 4.09Å; F322-F370 HydrophobicContact CG-CZ 4.44Å; L335-F370 HydrophobicContact CD2-CE1 3.78Å; L335-F370 HydrophobicContact CD2-CZ 3.55Å; L360-F370 HydrophobicContact CD1-CD1 4.27Å; L360-F370 HydrophobicContact CD1-CE1 3.93Å; L360-F370 HydrophobicContact CD2-CD1 3.79Å; L360-F370 HydrophobicContact CD2-CE1 4.3Å; T365-F370 HydrophobicContact CG2-CE1 4.33Å; T365-F370 HydrophobicContact CG2-CZ 4.44Å; L367-F370 HydrophobicContact CB-CD2 4.5Å; L367-F370 VanDerWaalsContact O-CB 3.25Å; L367-F370 WeakPolarHBondContact O-CB 3.38Å; L367-F370 PolarHBondContact O-N 3.4Å; S368-F370 PolarHBondContact O-N 3.3Å; F370-N372 VanDerWaalsContact C-N 3.34Å; F370-N372 PolarHBondContact O-N 2.87Å; F370-R373 PolarHBondContact O-N 2.92Å; F370-L374 PolarHBondContact O-N 3.38Å
371	P	98.1	Very high	97.5	Very high	21 Å²	21	37.6 Å²	37.6	14%	0.136	23%	0.228	C	C	.	.	H	α-helix	trans	-63.4	-40.8	-178.9	-19.7	33.5	0	0	0	112.1	L360 L374 Q375 V389 V391	L360-P371 HydrophobicContact CD2-CB 4.13Å; L360-P371 HydrophobicContact CD2-CG 3.93Å; P371-L374 PolarHBondContact O-N 3.15Å; P371-Q375 VanDerWaalsContact O-CB 3.26Å; P371-Q375 WeakPolarHBondContact O-CB 3.25Å; P371-Q375 PolarHBondContact O-N 3.48Å; P371-V389 HydrophobicContact CB-CG1 4.41Å; P371-V391 HydrophobicContact CB-CG1 3.77Å; P371-V391 HydrophobicContact CG-CG1 3.68Å
372	N	98.1	Very high	97.3	Very high	112 Å²	112	38.1 Å²	38.1	60%	0.599	23%	0.232	S	C	*	.	H	α-helix	trans	-66.5	-42.3	-178.6	-62.3	-13.8	0	0	0	111.4	L284 G369 F370 Q375 K376	L284-N372 HydrophobicContact CD1-CB 4.34Å; G369-N372 PolarHBondContact O-N 3.49Å; F370-N372 VanDerWaalsContact C-N 3.34Å; F370-N372 PolarHBondContact O-N 2.87Å; N372-Q375 PolarHBondContact O-N 3.28Å; N372-K376 WeakPolarHBondContact O-CB 3.44Å; N372-K376 PolarHBondContact O-N 2.78Å
373	R	98.3	Very high	97	Very high	13 Å²	13	42.3 Å²	42.3	5%	0.049	26%	0.256	C	S	.	.	H	α-helix	trans	-63.5	-48.4	175.2	178	58.6	176.6	-71.2	-8	111.1	V282 A283 L284 E320 F323 G369 F370 Q375 K376 E377	V282-R373 HydrophobicContact CG1-CB 3.64Å; V282-R373 HydrophobicContact CG1-CG 3.78Å; A283-R373 WeakPolarHBondContact O-CD 3.38Å; A283-R373 PolarHBondContact O-NH1 3.33Å; L284-R373 WeakPolarHBondContact O-CD 3.46Å; E320-R373 IonicContact OE1-CZ 3.72Å; E320-R373 IonicContact OE1-NH1 2.71Å; E320-R373 PolarHBondContact OE1-NH1 2.86Å; E320-R373 IonicContact OE1-NH2 2.7Å; E320-R373 IonicContact OE2-CZ 3.58Å; E320-R373 IonicContact OE2-NH1 2.77Å; E320-R373 PolarHBondContact OE2-NH1 3.36Å; E320-R373 IonicContact OE2-NH2 2.95Å; E320-R373 PolarHBondContact OE2-NH2 2.81Å; F323-R373 HydrophobicContact CD1-CG 4.38Å; F323-R373 HydrophobicContact CD2-CG 4.21Å; F323-R373 HydrophobicContact CE1-CG 3.8Å; F323-R373 HydrophobicContact CE2-CB 4.46Å; F323-R373 HydrophobicContact CE2-CG 3.61Å; F323-R373 HydrophobicContact CZ-CB 4.07Å; F323-R373 HydrophobicContact CZ-CG 3.39Å; G369-R373 PolarHBondContact O-N 3.18Å; F370-R373 PolarHBondContact O-N 2.92Å; R373-Q375 VanDerWaalsContact C-N 3.32Å; R373-Q375 PolarHBondContact O-N 3.15Å; R373-K376 PolarHBondContact O-N 3.13Å; R373-E377 IonicContact CZ-OE1 3.42Å; R373-E377 IonicContact NE-OE1 3.87Å; R373-E377 PolarHBondContact NE-OE1 3.39Å; R373-E377 IonicContact NH2-OE1 2.77Å; R373-E377 PolarHBondContact NH2-OE1 3.48Å; R373-E377 WeakPolarHBondContact O-CG 3.47Å; R373-E377 PolarHBondContact O-N 2.86Å
374	L	98.4	Very high	96.7	Very high	0 Å²	0	48 Å²	48	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60	-43.7	177.5	-177.7	61.5	0	0	0	111.5	V217 F323 H336 L360 F370 P371 K376 E377 L378 V389	V217-L374 HydrophobicContact CG1-CD2 4.4Å; F323-L374 HydrophobicContact CE1-CD1 4.39Å; H336-L374 HydrophobicContact CB-CD1 3.97Å; L360-L374 HydrophobicContact CD1-CD2 3.89Å; F370-L374 PolarHBondContact O-N 3.38Å; P371-L374 PolarHBondContact O-N 3.15Å; L374-K376 PolarHBondContact O-N 3.35Å; L374-E377 PolarHBondContact O-N 3.33Å; L374-L378 HydrophobicContact CD1-CD1 4.15Å; L374-L378 HydrophobicContact CD1-CG 4.15Å; L374-L378 HydrophobicContact CG-CD1 3.97Å; L374-L378 HydrophobicContact CG-CG 4.37Å; L374-L378 VanDerWaalsContact O-CG 3.25Å; L374-L378 WeakPolarHBondContact O-CG 3.43Å; L374-L378 PolarHBondContact O-N 2.83Å; L374-V389 HydrophobicContact CD2-CG1 4.4Å; L374-V389 HydrophobicContact CD2-CG2 4.37Å; L374-V389 HydrophobicContact CG-CG2 4.26Å
375	Q	98.3	Very high	96.3	Very high	41 Å²	41	50.2 Å²	50.2	19%	0.192	29%	0.288	C	S	.	.	H	α-helix	trans	-58.3	-47	175.8	-178.8	63.4	67.9	0	0	111.9	P371 N372 R373 E377 L378 S379 P387 V389	P371-Q375 VanDerWaalsContact O-CB 3.26Å; P371-Q375 WeakPolarHBondContact O-CB 3.25Å; P371-Q375 PolarHBondContact O-N 3.48Å; N372-Q375 PolarHBondContact O-N 3.28Å; R373-Q375 VanDerWaalsContact C-N 3.32Å; R373-Q375 PolarHBondContact O-N 3.15Å; Q375-E377 PolarHBondContact O-N 3.48Å; Q375-L378 PolarHBondContact O-N 3.37Å; Q375-S379 PolarHBondContact NE2-OG 3.26Å; Q375-S379 WeakPolarHBondContact O-CB 3.3Å; Q375-S379 PolarHBondContact O-N 2.89Å; Q375-S379 PolarHBondContact O-OG 3Å; Q375-S379 VanDerWaalsContact O-OG 3.12Å; Q375-P387 PolarHBondContact NE2-O 3.1Å; Q375-P387 PolarHBondContact OE1-O 2.83Å; Q375-V389 HydrophobicContact CB-CB 4.41Å; Q375-V389 HydrophobicContact CB-CG2 4.16Å
376	K	97.8	Very high	96	Very high	84 Å²	84	55.5 Å²	55.5	37%	0.365	32%	0.32	S	S	.	.	H	α-helix	trans	-58.7	-47.6	176.8	176.8	-177.9	169	-170.6	0	111.6	L284 D285 N372 R373 L374 S379 S380	L284-K376 HydrophobicContact CD1-CB 3.93Å; L284-K376 HydrophobicContact CD1-CD 3.6Å; L284-K376 HydrophobicContact CD1-CG 4.38Å; L284-K376 HydrophobicContact CD2-CD 4.5Å; L284-K376 HydrophobicContact CG-CD 3.76Å; L284-K376 PolarHBondContact O-NZ 3.02Å; D285-K376 IonicContact OD2-NZ 3.28Å; D285-K376 PolarHBondContact OD2-NZ 3.4Å; N372-K376 WeakPolarHBondContact O-CB 3.44Å; N372-K376 PolarHBondContact O-N 2.78Å; R373-K376 PolarHBondContact O-N 3.13Å; L374-K376 PolarHBondContact O-N 3.35Å; K376-S379 PolarHBondContact O-N 3.3Å; K376-S380 WeakPolarHBondContact O-CB 3.5Å; K376-S380 PolarHBondContact O-N 3.33Å
377	E	98.1	Very high	95.9	Very high	41 Å²	41	51.9 Å²	51.9	19%	0.192	30%	0.303	C	S	.	.	H	α-helix	trans	-62	-45.5	179.7	-66.1	-69.4	176.7	0	0	111.4	F323 H336 R373 L374 Q375 S380 M381	F323-E377 HydrophobicContact CD1-CG 3.88Å; F323-E377 HydrophobicContact CE1-CG 4.06Å; H336-E377 HydrophobicContact CB-CB 3.63Å; H336-E377 HydrophobicContact CB-CG 4.26Å; H336-E377 IonicContact CD2-OE2 2.63Å; R373-E377 IonicContact CZ-OE1 3.42Å; R373-E377 IonicContact NE-OE1 3.87Å; R373-E377 PolarHBondContact NE-OE1 3.39Å; R373-E377 IonicContact NH2-OE1 2.77Å; R373-E377 PolarHBondContact NH2-OE1 3.48Å; R373-E377 WeakPolarHBondContact O-CG 3.47Å; R373-E377 PolarHBondContact O-N 2.86Å; L374-E377 PolarHBondContact O-N 3.33Å; Q375-E377 PolarHBondContact O-N 3.48Å; E377-S380 WeakPolarHBondContact O-CB 3.32Å; E377-S380 PolarHBondContact O-N 2.93Å; E377-M381 WeakPolarHBondContact O-CG 3.27Å; E377-M381 PolarHBondContact O-N 3.19Å
378	L	97.9	Very high	95.9	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-65.6	-43.8	179.3	-66.4	175.9	0	0	0	112.3	T339 V340 I358 L374 Q375 S380 M381 C382 P387 V389	T339-L378 HydrophobicContact CG2-CD1 4.28Å; T339-L378 HydrophobicContact CG2-CD2 3.88Å; V340-L378 HydrophobicContact CG2-CD2 3.66Å; I358-L378 HydrophobicContact CD1-CD1 3.66Å; L374-L378 HydrophobicContact CD1-CD1 4.15Å; L374-L378 HydrophobicContact CD1-CG 4.15Å; L374-L378 HydrophobicContact CG-CD1 3.97Å; L374-L378 HydrophobicContact CG-CG 4.37Å; L374-L378 VanDerWaalsContact O-CG 3.25Å; L374-L378 WeakPolarHBondContact O-CG 3.43Å; L374-L378 PolarHBondContact O-N 2.83Å; Q375-L378 PolarHBondContact O-N 3.37Å; L378-S380 VanDerWaalsContact C-N 3.27Å; L378-S380 PolarHBondContact O-N 3.18Å; L378-M381 PolarHBondContact O-N 2.94Å; L378-C382 PolarHBondContact O-N 2.88Å; L378-P387 HydrophobicContact CB-CB 4.02Å; L378-P387 HydrophobicContact CB-CG 3.91Å; L378-V389 HydrophobicContact CD1-CG2 3.81Å
379	S	97.1	Very high	95.9	Very high	52 Å²	52	53.2 Å²	53.2	36%	0.364	30%	0.302	S	S	.	.	H	α-helix	trans	-63.2	-34.1	175.9	-67.3	0	0	0	0	112.4	Q375 K376 C382	Q375-S379 PolarHBondContact NE2-OG 3.26Å; Q375-S379 WeakPolarHBondContact O-CB 3.3Å; Q375-S379 PolarHBondContact O-N 2.89Å; Q375-S379 PolarHBondContact O-OG 3Å; Q375-S379 VanDerWaalsContact O-OG 3.12Å; K376-S379 PolarHBondContact O-N 3.3Å; S379-C382 CarbonylContact O-C 3.58Å
380	S	96.5	Very high	96	Very high	89 Å²	89	54.4 Å²	54.4	62%	0.622	30%	0.302	S	S	*	.	H	α-helix	trans	-68.7	-43.5	174.7	-174.9	0	0	0	0	112.1	K376 E377 L378	K376-S380 WeakPolarHBondContact O-CB 3.5Å; K376-S380 PolarHBondContact O-N 3.33Å; E377-S380 WeakPolarHBondContact O-CB 3.32Å; E377-S380 PolarHBondContact O-N 2.93Å; L378-S380 VanDerWaalsContact C-N 3.27Å; L378-S380 PolarHBondContact O-N 3.18Å
381	M	96.3	Very high	95.9	Very high	76 Å²	76	57.4 Å²	57.4	37%	0.374	32%	0.32	S	S	.	.	H	α-helix	trans	-73.5	-26.1	-179.5	-69.9	-174.9	73.6	0	0	113.7	H336 T337 V340 E377 L378	H336-M381 VanDerWaalsContact CD2-SD 3.52Å; T337-M381 HydrophobicContact CG2-CE 4.26Å; V340-M381 HydrophobicContact CB-CE 3.89Å; V340-M381 HydrophobicContact CB-SD 4.42Å; V340-M381 HydrophobicContact CG1-CE 4.05Å; V340-M381 HydrophobicContact CG2-CB 4.06Å; V340-M381 HydrophobicContact CG2-CE 3.92Å; V340-M381 HydrophobicContact CG2-SD 3.83Å; E377-M381 WeakPolarHBondContact O-CG 3.27Å; E377-M381 PolarHBondContact O-N 3.19Å; L378-M381 PolarHBondContact O-N 2.94Å
382	C	93.5	Very high	95.8	Very high	10 Å²	10	59 Å²	59	7%	0.068	33%	0.328	C	S	.	.			trans	-128.5	69.5	-176.9	-57.1	0	0	0	0	110.9	M355 L378 S379 N384 D385	M355-C382 HydrophobicContact CE-CB 3.91Å; L378-C382 PolarHBondContact O-N 2.88Å; S379-C382 CarbonylContact O-C 3.58Å; C382-N384 VanDerWaalsContact C-N 3.27Å; C382-N384 PolarHBondContact O-N 3.16Å; C382-D385 HydrophobicContact CB-CB 4.05Å; C382-D385 PolarHBondContact O-N 3.29Å; C382-D385 VanDerWaalsContact O-N 3.16Å
383	P	88.8	Confident	95.6	Very high	102 Å²	102	58.7 Å²	58.7	66%	0.662	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-22.3	-172.3	27.8	-36.1	0	0	0	114.1
384	N	89.6	Confident	95.3	Very high	160 Å²	160	61.4 Å²	61.4	86%	0.856	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-10.5	177.8	-63.8	-31.2	0	0	0	112.9	C382	C382-N384 VanDerWaalsContact C-N 3.27Å; C382-N384 PolarHBondContact O-N 3.16Å
385	D	89.8	Confident	95.2	Very high	58 Å²	58	62.6 Å²	62.6	31%	0.31	35%	0.349	S	S	.	.	S	Bend	trans	-108.2	162.3	178.1	-61.2	-54.4	0	0	0	109.1	K351 M355 C382 P387	K351-D385 IonicContact NZ-OD2 3.75Å; M355-D385 HydrophobicContact CE-CB 3.87Å; M355-D385 VanDerWaalsContact CE-OD2 3.3Å; M355-D385 WeakPolarHBondContact CE-OD2 3.43Å; M355-D385 HydrophobicContact SD-CB 3.39Å; M355-D385 WeakPolarHBondContact SD-CB 3.49Å; C382-D385 HydrophobicContact CB-CB 4.05Å; C382-D385 PolarHBondContact O-N 3.29Å; C382-D385 VanDerWaalsContact O-N 3.16Å; D385-P387 VanDerWaalsContact C-CD 3.42Å; D385-P387 WeakPolarHBondContact O-CD 3.39Å
386	T	90.9	Very high	95.1	Very high	111 Å²	111	62.5 Å²	62.5	68%	0.681	35%	0.35	S	S	*	.			trans	-114.8	73.8	177.3	56.3	0	0	0	0	110	Q388	T386-Q388 PolarHBondContact O-N 3.3Å
387	P	95.9	Very high	95.1	Very high	2 Å²	2	59 Å²	59	1%	0.013	34%	0.336	C	S	.	.			trans	-61.3	138.9	178	26.3	-33	0	0	0	109.9	M355 I358 Q375 L378 D385	M355-P387 CarbonylContact O-C 3.41Å; M355-P387 VanDerWaalsContact O-CA 3.3Å; M355-P387 WeakPolarHBondContact O-CA 3.28Å; I358-P387 HydrophobicContact CD1-CB 4.05Å; Q375-P387 PolarHBondContact NE2-O 3.1Å; Q375-P387 PolarHBondContact OE1-O 2.83Å; L378-P387 HydrophobicContact CB-CB 4.02Å; L378-P387 HydrophobicContact CB-CG 3.91Å; D385-P387 VanDerWaalsContact C-CD 3.42Å; D385-P387 WeakPolarHBondContact O-CD 3.39Å
388	Q	97.3	Very high	95	Very high	97 Å²	97	57.1 Å²	57.1	45%	0.453	33%	0.328	S	S	.	.			trans	-127.2	110.2	178.7	-65.2	-62.5	-55.9	0	0	109.7	M355 I358 T386 N390	M355-Q388 PolarHBondContact O-N 2.98Å; I358-Q388 WeakPolarHBondContact CB-O 3.3Å; I358-Q388 PolarHBondContact N-O 3.41Å; I358-Q388 VanDerWaalsContact N-O 3.09Å; T386-Q388 PolarHBondContact O-N 3.3Å; Q388-N390 PolarHBondContact O-ND2 3.29Å
389	V	98.2	Very high	95	Very high	21 Å²	21	57.9 Å²	57.9	13%	0.127	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	110.6	174.3	-179.3	0	0	0	0	109	I358 L360 P371 L374 Q375 L378	I358-V389 HydrophobicContact CG2-CG2 4.43Å; L360-V389 HydrophobicContact CB-CG1 4.15Å; L360-V389 HydrophobicContact CD2-CG1 4.38Å; P371-V389 HydrophobicContact CB-CG1 4.41Å; L374-V389 HydrophobicContact CD2-CG1 4.4Å; L374-V389 HydrophobicContact CD2-CG2 4.37Å; L374-V389 HydrophobicContact CG-CG2 4.26Å; Q375-V389 HydrophobicContact CB-CB 4.41Å; Q375-V389 HydrophobicContact CB-CG2 4.16Å; L378-V389 HydrophobicContact CD1-CG2 3.81Å
390	N	97.9	Very high	95.1	Very high	51 Å²	51	55.4 Å²	55.4	27%	0.273	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	137.8	178.2	-60.4	-83.6	0	0	0	110	Y209 I358 L359 L360 Q388	Y209-N390 HydrophobicContact CE1-CB 4.43Å; I358-N390 PolarHBondContact O-N 3.48Å; L359-N390 HydrophobicContact CD2-CB 3.93Å; L360-N390 PolarHBondContact N-O 2.96Å; Q388-N390 PolarHBondContact O-ND2 3.29Å
391	V	97.4	Very high	95.2	Very high	63 Å²	63	52.3 Å²	52.3	38%	0.382	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	142.7	-178.6	-70.2	0	0	0	0	111.6	Y209 L360 P371	Y209-V391 WeakPolarHBondContact OH-CA 3.44Å; L360-V391 HydrophobicContact CB-CG1 3.95Å; L360-V391 HydrophobicContact CD2-CG1 3.91Å; L360-V391 HydrophobicContact CG-CG1 4.47Å; P371-V391 HydrophobicContact CB-CG1 3.77Å; P371-V391 HydrophobicContact CG-CG1 3.68Å
392	L	96.3	Very high	95.2	Very high	55 Å²	55	48.7 Å²	48.7	29%	0.288	27%	0.274	S	S	.	.			trans	-97.8	149.4	162.5	-70	173.4	0	0	0	110.7	S208 Y209 E394 R395	S208-L392 WeakPolarHBondContact O-CD1 3.4Å; Y209-L392 HydrophobicContact CD1-CD1 4.08Å; Y209-L392 HydrophobicContact CD1-CD2 4.5Å; Y209-L392 HydrophobicContact CD1-CG 3.83Å; Y209-L392 HydrophobicContact CD2-CD1 3.68Å; Y209-L392 HydrophobicContact CD2-CG 4.23Å; Y209-L392 HydrophobicContact CE1-CB 4.28Å; Y209-L392 HydrophobicContact CE1-CD1 4.12Å; Y209-L392 HydrophobicContact CE1-CG 3.57Å; Y209-L392 HydrophobicContact CE2-CB 4.47Å; Y209-L392 HydrophobicContact CE2-CD1 3.7Å; Y209-L392 HydrophobicContact CE2-CG 3.98Å; Y209-L392 HydrophobicContact CG-CD1 3.87Å; Y209-L392 HydrophobicContact CG-CG 4.16Å; Y209-L392 PolarHBondContact OH-N 3.43Å; L392-E394 VanDerWaalsContact C-N 3.26Å; L392-E394 PolarHBondContact O-N 2.87Å; L392-R395 HydrophobicContact CB-CB 4.34Å; L392-R395 WeakPolarHBondContact O-CB 3.45Å; L392-R395 WeakPolarHBondContact O-CG 3.4Å; L392-R395 PolarHBondContact O-N 3.41Å; L392-R395 PolarHBondContact O-NH1 3.48Å
393	P	94.4	Very high	95.4	Very high	104 Å²	104	48.2 Å²	48.2	68%	0.675	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-36.2	171.7	-25.6	35.2	0	0	0	113.1	M366	M366-P393 WeakPolarHBondContact CE-O 3.17Å
394	E	92.3	Very high	95.9	Very high	70 Å²	70	43.4 Å²	43.4	33%	0.327	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	30	-174.9	-63.6	172.8	-152.1	0	0	112.8	R90 L392 D396 S397 A398	R90-E394 WeakPolarHBondContact CD-OE2 3.39Å; R90-E394 WeakPolarHBondContact CG-OE2 3.33Å; R90-E394 IonicContact CZ-OE1 3.5Å; R90-E394 IonicContact CZ-OE2 3.26Å; R90-E394 IonicContact NE-OE1 2.99Å; R90-E394 PolarHBondContact NE-OE1 3.14Å; R90-E394 IonicContact NE-OE2 2.81Å; R90-E394 PolarHBondContact NE-OE2 3.23Å; R90-E394 IonicContact NH2-OE1 2.61Å; R90-E394 PolarHBondContact NH2-OE1 2.61Å; R90-E394 IonicContact NH2-OE2 3.94Å; L392-E394 VanDerWaalsContact C-N 3.26Å; L392-E394 PolarHBondContact O-N 2.87Å; E394-D396 PolarHBondContact O-N 3.25Å; E394-S397 PolarHBondContact O-N 3.37Å; E394-A398 PolarHBondContact O-N 3.43Å
395	R	95.9	Very high	96.2	Very high	25 Å²	25	39 Å²	39	9%	0.094	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-9.2	-173.4	66.8	-176.7	173	-76.4	1	115	L360 G362 T365 M366 L392 S397	L360-R395 VanDerWaalsContact O-CD 3.32Å; L360-R395 WeakPolarHBondContact O-CD 3.44Å; G362-R395 PolarHBondContact N-O 3.21Å; T365-R395 PolarHBondContact O-NE 3.09Å; T365-R395 PolarHBondContact O-NH2 2.94Å; T365-R395 VanDerWaalsContact OG1-CD 3.31Å; T365-R395 WeakPolarHBondContact OG1-CD 3.35Å; T365-R395 PolarHBondContact OG1-NE 3.19Å; T365-R395 VanDerWaalsContact OG1-NE 3.12Å; M366-R395 HydrophobicContact SD-CG 3.47Å; M366-R395 WeakPolarHBondContact SD-CG 3.4Å; M366-R395 VanDerWaalsContact SD-CZ 3.53Å; L392-R395 HydrophobicContact CB-CB 4.34Å; L392-R395 WeakPolarHBondContact O-CB 3.45Å; L392-R395 WeakPolarHBondContact O-CG 3.4Å; L392-R395 PolarHBondContact O-N 3.41Å; L392-R395 PolarHBondContact O-NH1 3.48Å; R395-S397 VanDerWaalsContact C-N 3.26Å
396	D	95.6	Very high	96.5	Very high	39 Å²	39	37.2 Å²	37.2	21%	0.209	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-22.6	171.1	77.6	-49.6	0	0	0	112.8	K82 K94 M366 E394	K82-D396 WeakPolarHBondContact CE-O 3.44Å; K82-D396 PolarHBondContact NZ-O 3.26Å; K94-D396 IonicContact NZ-OD2 3.25Å; K94-D396 PolarHBondContact NZ-OD2 3.49Å; K94-D396 VanDerWaalsContact NZ-OD2 3.15Å; M366-D396 HydrophobicContact CG-CB 3.89Å; M366-D396 HydrophobicContact SD-CB 4.33Å; E394-D396 PolarHBondContact O-N 3.25Å
397	S	96.8	Very high	96.8	Very high	11 Å²	11	32 Å²	32	8%	0.077	18%	0.175	C	C	.	.	S	Bend	trans	-112.1	8.2	178.9	-56.7	0	0	0	0	112.8	E394 R395 V399 W400 T401	E394-S397 PolarHBondContact O-N 3.37Å; R395-S397 VanDerWaalsContact C-N 3.26Å; S397-V399 VanDerWaalsContact C-N 3.31Å; S397-V399 PolarHBondContact O-N 3.4Å; S397-W400 PolarHBondContact O-N 3.07Å; S397-T401 PolarHBondContact O-N 2.89Å; S397-T401 PolarHBondContact O-OG1 2.94Å
398	A	97.6	Very high	96.8	Very high	2 Å²	2	35 Å²	35	2%	0.017	20%	0.195	C	C	.	.	H	α-helix	trans	-50.1	-46	-177.7	0	0	0	0	0	113.6	S208 C361 E394 W400 T401 G402	S208-A398 WeakPolarHBondContact CB-O 3.47Å; S208-A398 WeakPolarHBondContact OG-CB 3.2Å; C361-A398 HydrophobicContact CB-CB 4.29Å; E394-A398 PolarHBondContact O-N 3.43Å; A398-W400 PolarHBondContact O-N 3.23Å; A398-T401 PolarHBondContact O-N 3.26Å; A398-G402 PolarHBondContact O-N 3.45Å
399	V	97.9	Very high	96.6	Very high	17 Å²	17	34.4 Å²	34.4	10%	0.103	20%	0.195	C	C	.	.	H	α-helix	trans	-54.8	-53.3	175.8	175.8	0	0	0	0	110.8	D75 Q201 L204 S205 S397 G402 G403	D75-V399 HydrophobicContact CB-CG1 4.18Å; Q201-V399 HydrophobicContact CB-CG1 4.11Å; Q201-V399 HydrophobicContact CB-CG2 4.06Å; Q201-V399 HydrophobicContact CG-CG1 3.92Å; Q201-V399 HydrophobicContact CG-CG2 4.48Å; L204-V399 HydrophobicContact CB-CG1 4.35Å; L204-V399 VanDerWaalsContact CB-O 3.3Å; L204-V399 WeakPolarHBondContact CB-O 3.4Å; L204-V399 HydrophobicContact CD1-CG1 4.11Å; S205-V399 WeakPolarHBondContact OG-CG2 3.38Å; S205-V399 PolarHBondContact OG-N 3.4Å; S397-V399 VanDerWaalsContact C-N 3.31Å; S397-V399 PolarHBondContact O-N 3.4Å; V399-G402 PolarHBondContact O-N 3.44Å; V399-G403 PolarHBondContact O-N 3.3Å
400	W	98.4	Very high	96.3	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.9	-44.9	-178.9	-173.9	91.9	0	0	0	111.5	V73 D75 K82 L88 R90 P91 S397 A398 G402 G403 S404	V73-W400 HydrophobicContact CB-CZ2 4.39Å; V73-W400 HydrophobicContact CG1-CG 4.33Å; V73-W400 PolarHBondContact O-NE1 3.48Å; D75-W400 HydrophobicContact CB-CB 4Å; K82-W400 HydrophobicContact CB-CB 4.41Å; K82-W400 HydrophobicContact CB-CG 4.32Å; L88-W400 HydrophobicContact CB-CH2 4.12Å; L88-W400 WeakPolarHBondContact O-CZ3 3.46Å; R90-W400 VanDerWaalsContact O-CH2 3.25Å; R90-W400 WeakPolarHBondContact O-CH2 3.45Å; R90-W400 VanDerWaalsContact O-CZ3 3.24Å; R90-W400 WeakPolarHBondContact O-CZ3 3.29Å; P91-W400 HydrophobicContact CB-CD2 3.59Å; P91-W400 HydrophobicContact CB-CE3 3.96Å; P91-W400 HydrophobicContact CB-CG 3.88Å; P91-W400 HydrophobicContact CB-CZ2 4.36Å; P91-W400 VanDerWaalsContact CD-CE3 3.45Å; P91-W400 HydrophobicContact CG-CD2 4.23Å; P91-W400 HydrophobicContact CG-CE3 4.27Å; P91-W400 HydrophobicContact CG-CG 4.41Å; S397-W400 PolarHBondContact O-N 3.07Å; A398-W400 PolarHBondContact O-N 3.23Å; W400-G402 VanDerWaalsContact C-N 3.31Å; W400-G402 PolarHBondContact O-N 3.19Å; W400-G403 PolarHBondContact O-N 3.27Å; W400-G403 VanDerWaalsContact O-N 3.11Å; W400-S404 PolarHBondContact O-N 3.27Å
401	T	98.2	Very high	96	Very high	24 Å²	24	42.8 Å²	42.8	15%	0.147	25%	0.249	C	C	.	.	H	α-helix	trans	-60.7	-41.3	178.4	-60.9	0	0	0	0	111.2	P89 S397 A398 S404 I405	P89-T401 PolarHBondContact O-OG1 3.4Å; S397-T401 PolarHBondContact O-N 2.89Å; S397-T401 PolarHBondContact O-OG1 2.94Å; A398-T401 PolarHBondContact O-N 3.26Å; T401-S404 WeakPolarHBondContact O-CB 3.4Å; T401-S404 PolarHBondContact O-N 3.2Å; T401-I405 HydrophobicContact CG2-CD1 4.18Å; T401-I405 WeakPolarHBondContact O-CG1 3.38Å; T401-I405 PolarHBondContact O-N 2.81Å
402	G	97.8	Very high	95.7	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.3	-41.4	173	0	0	0	0	0	113.7	L204 A398 V399 W400 I405 L406	L204-G402 VanDerWaalsContact O-CA 3.22Å; L204-G402 WeakPolarHBondContact O-CA 3.21Å; A398-G402 PolarHBondContact O-N 3.45Å; V399-G402 PolarHBondContact O-N 3.44Å; W400-G402 VanDerWaalsContact C-N 3.31Å; W400-G402 PolarHBondContact O-N 3.19Å; G402-I405 PolarHBondContact O-N 3.18Å; G402-L406 VanDerWaalsContact O-CB 3.32Å; G402-L406 WeakPolarHBondContact O-CB 3.24Å; G402-L406 PolarHBondContact O-N 3.09Å
403	G	97.8	Very high	95.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.3	-41.6	173.1	0	0	0	0	0	112.6	V399 W400 L406 A407	V399-G403 PolarHBondContact O-N 3.3Å; W400-G403 PolarHBondContact O-N 3.27Å; W400-G403 VanDerWaalsContact O-N 3.11Å; G403-L406 PolarHBondContact O-N 3.32Å; G403-A407 VanDerWaalsContact O-CB 3.29Å; G403-A407 WeakPolarHBondContact O-CB 3.48Å; G403-A407 PolarHBondContact O-N 2.8Å
404	S	98.1	Very high	95.4	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.014	24%	0.235	C	C	.	.	H	α-helix	trans	-61.9	-43.2	176.3	179.9	0	0	0	0	112	G87 L88 W400 T401 S408	G87-S404 PolarHBondContact N-O 3.39Å; G87-S404 PolarHBondContact N-OG 2.89Å; L88-S404 PolarHBondContact N-OG 3.25Å; L88-S404 PolarHBondContact O-OG 2.73Å; W400-S404 PolarHBondContact O-N 3.27Å; T401-S404 WeakPolarHBondContact O-CB 3.4Å; T401-S404 PolarHBondContact O-N 3.2Å; S404-S408 WeakPolarHBondContact O-CB 3.36Å; S404-S408 PolarHBondContact O-N 3.07Å; S404-S408 PolarHBondContact O-OG 3.3Å
405	I	97	Very high	95.5	Very high	67 Å²	67	41.4 Å²	41.4	34%	0.344	24%	0.238	S	C	.	.	H	α-helix	trans	-61.7	-56.4	173.3	-67.2	163.7	0	0	0	109.3	T401 G402 A407 S408 L409	T401-I405 HydrophobicContact CG2-CD1 4.18Å; T401-I405 WeakPolarHBondContact O-CG1 3.38Å; T401-I405 PolarHBondContact O-N 2.81Å; G402-I405 PolarHBondContact O-N 3.18Å; I405-A407 PolarHBondContact O-N 2.86Å; I405-S408 PolarHBondContact O-N 3.38Å; I405-S408 VanDerWaalsContact O-N 3.08Å; I405-S408 PolarHBondContact O-OG 3.33Å; I405-L409 WeakPolarHBondContact O-CG 3.39Å; I405-L409 PolarHBondContact O-N 2.96Å
406	L	96.1	Very high	95.5	Very high	20 Å²	20	40.6 Å²	40.6	11%	0.105	24%	0.235	C	C	.	.	H	α-helix	trans	-56.2	-50.2	-175.1	-177.2	63.1	0	0	0	112.4	L168 A199 L204 Y207 G402 G403 S408 L409 F412	L168-L406 HydrophobicContact CD1-CD2 4.17Å; A199-L406 HydrophobicContact CB-CD2 4.4Å; L204-L406 HydrophobicContact CD2-CB 4.44Å; L204-L406 HydrophobicContact CD2-CD2 3.66Å; Y207-L406 HydrophobicContact CD2-CB 4.39Å; Y207-L406 HydrophobicContact CD2-CD1 4.29Å; Y207-L406 HydrophobicContact CD2-CD2 4.39Å; Y207-L406 HydrophobicContact CE2-CD1 3.88Å; Y207-L406 HydrophobicContact CE2-CD2 4.11Å; Y207-L406 HydrophobicContact CE2-CG 4.47Å; G402-L406 VanDerWaalsContact O-CB 3.32Å; G402-L406 WeakPolarHBondContact O-CB 3.24Å; G402-L406 PolarHBondContact O-N 3.09Å; G403-L406 PolarHBondContact O-N 3.32Å; L406-S408 PolarHBondContact O-N 2.82Å; L406-L409 HydrophobicContact CD1-CD1 4.36Å; L406-L409 WeakPolarHBondContact O-CB 3.31Å; L406-L409 PolarHBondContact O-N 3.25Å; L406-L409 VanDerWaalsContact O-N 3.15Å; L406-F412 HydrophobicContact CD1-CD2 3.51Å; L406-F412 HydrophobicContact CD1-CE2 3.95Å; L406-F412 HydrophobicContact CD1-CG 4.2Å; L406-F412 HydrophobicContact CD2-CD2 4.16Å; L406-F412 HydrophobicContact CD2-CE2 3.71Å; L406-F412 HydrophobicContact CD2-CZ 4.24Å; L406-F412 HydrophobicContact CG-CD2 3.56Å; L406-F412 HydrophobicContact CG-CE2 3.59Å; L406-F412 HydrophobicContact CG-CG 4.14Å; L406-F412 HydrophobicContact CG-CZ 4.15Å; L406-F412 VanDerWaalsContact O-CB 3.24Å; L406-F412 WeakPolarHBondContact O-CB 3.13Å; L406-F412 WeakPolarHBondContact O-CG 3.18Å
407	A	96.4	Very high	95.6	Very high	3 Å²	3	38.8 Å²	38.8	3%	0.025	23%	0.225	C	C	.	.	H	α-helix	trans	-65.7	-21.5	-179	0	0	0	0	0	113.5	A71 V73 A86 L168 G403 I405 Q413 W416	A71-A407 HydrophobicContact CB-CB 4.34Å; V73-A407 HydrophobicContact CG2-CB 4.21Å; A86-A407 HydrophobicContact CB-CB 3.67Å; L168-A407 HydrophobicContact CD1-CB 4.09Å; G403-A407 VanDerWaalsContact O-CB 3.29Å; G403-A407 WeakPolarHBondContact O-CB 3.48Å; G403-A407 PolarHBondContact O-N 2.8Å; I405-A407 PolarHBondContact O-N 2.86Å; A407-Q413 PolarHBondContact O-NE2 3.13Å; A407-W416 HydrophobicContact CB-CH2 4.31Å; A407-W416 HydrophobicContact CB-CZ2 4.07Å
408	S	94.8	Very high	95.6	Very high	63 Å²	63	41.8 Å²	41.8	44%	0.441	24%	0.238	S	C	.	.	H	α-helix	trans	-84.8	-10.9	177.3	75.4	0	0	0	0	114.1	S404 I405 L406	S404-S408 WeakPolarHBondContact O-CB 3.36Å; S404-S408 PolarHBondContact O-N 3.07Å; S404-S408 PolarHBondContact O-OG 3.3Å; I405-S408 PolarHBondContact O-N 3.38Å; I405-S408 VanDerWaalsContact O-N 3.08Å; I405-S408 PolarHBondContact O-OG 3.33Å; L406-S408 PolarHBondContact O-N 2.82Å
409	L	94	Very high	95.5	Very high	85 Å²	85	45 Å²	45	45%	0.445	25%	0.249	S	C	.	.			trans	-74.7	135.7	-178.5	-61.9	176.3	0	0	0	111.5	I405 L406 G411 F412 Q413	I405-L409 WeakPolarHBondContact O-CG 3.39Å; I405-L409 PolarHBondContact O-N 2.96Å; L406-L409 HydrophobicContact CD1-CD1 4.36Å; L406-L409 WeakPolarHBondContact O-CB 3.31Å; L406-L409 PolarHBondContact O-N 3.25Å; L406-L409 VanDerWaalsContact O-N 3.15Å; L409-G411 VanDerWaalsContact C-N 3.31Å; L409-G411 PolarHBondContact O-N 3.01Å; L409-F412 HydrophobicContact CB-CB 4Å; L409-F412 WeakPolarHBondContact O-CB 3.45Å; L409-F412 PolarHBondContact O-N 3.13Å; L409-F412 VanDerWaalsContact O-N 3.14Å; L409-Q413 PolarHBondContact O-NE2 3.42Å
410	Q	91.4	Very high	95.5	Very high	181 Å²	181	50 Å²	50	85%	0.846	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-62.5	-39.5	173.3	-71.4	-176.2	-6.5	0	0	111.8	F412 Q413	Q410-F412 PolarHBondContact O-N 3.28Å; Q410-Q413 WeakPolarHBondContact O-CG 3.42Å; Q410-Q413 PolarHBondContact O-N 2.76Å
411	G	91.3	Very high	95.3	Very high	67 Å²	67	51 Å²	51	69%	0.691	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-65.8	-14.3	176.6	0	0	0	0	0	114.2	L409 P414	L409-G411 VanDerWaalsContact C-N 3.31Å; L409-G411 PolarHBondContact O-N 3.01Å; G411-P414 WeakPolarHBondContact O-CD 3.24Å
412	F	92.3	Very high	95.2	Very high	5 Å²	5	51.3 Å²	51.3	2%	0.022	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-86.1	-20.9	177.2	-176.5	-101.4	0	0	0	113	L168 H197 L406 L409 Q410 P414 L415 W416	L168-F412 HydrophobicContact CD1-CE1 4.16Å; L168-F412 HydrophobicContact CD1-CZ 3.87Å; H197-F412 HydrophobicContact CB-CE1 4.43Å; H197-F412 HydrophobicContact CB-CZ 3.9Å; H197-F412 AromaticContact CD2-CE2 3.91Å; H197-F412 AromaticContact CD2-CZ 3.51Å; H197-F412 AromaticContact CE1-CE2 3.9Å; H197-F412 AromaticContact CE1-CZ 3.98Å; H197-F412 AromaticContact CG-CZ 3.5Å; H197-F412 VanDerWaalsContact CG-CZ 3.5Å; H197-F412 AromaticContact ND1-CZ 3.81Å; H197-F412 AromaticContact NE2-CE2 3.72Å; H197-F412 AromaticContact NE2-CZ 3.82Å; L406-F412 HydrophobicContact CD1-CD2 3.51Å; L406-F412 HydrophobicContact CD1-CE2 3.95Å; L406-F412 HydrophobicContact CD1-CG 4.2Å; L406-F412 HydrophobicContact CD2-CD2 4.16Å; L406-F412 HydrophobicContact CD2-CE2 3.71Å; L406-F412 HydrophobicContact CD2-CZ 4.24Å; L406-F412 HydrophobicContact CG-CD2 3.56Å; L406-F412 HydrophobicContact CG-CE2 3.59Å; L406-F412 HydrophobicContact CG-CG 4.14Å; L406-F412 HydrophobicContact CG-CZ 4.15Å; L406-F412 VanDerWaalsContact O-CB 3.24Å; L406-F412 WeakPolarHBondContact O-CB 3.13Å; L406-F412 WeakPolarHBondContact O-CG 3.18Å; L409-F412 HydrophobicContact CB-CB 4Å; L409-F412 WeakPolarHBondContact O-CB 3.45Å; L409-F412 PolarHBondContact O-N 3.13Å; L409-F412 VanDerWaalsContact O-N 3.14Å; Q410-F412 PolarHBondContact O-N 3.28Å; F412-P414 VanDerWaalsContact C-N 3.3Å; F412-P414 VanDerWaalsContact O-N 3.16Å; F412-L415 HydrophobicContact CD2-CB 4.14Å; F412-L415 HydrophobicContact CD2-CD1 3.74Å; F412-L415 HydrophobicContact CD2-CG 4.46Å; F412-L415 HydrophobicContact CE2-CB 4.06Å; F412-L415 HydrophobicContact CE2-CD1 4.06Å; F412-L415 WeakPolarHBondContact O-CB 3.33Å; F412-L415 PolarHBondContact O-N 2.61Å; F412-W416 AromaticContact CD1-CE2 3.94Å; F412-W416 HydrophobicContact CD1-CZ2 4.11Å; F412-W416 AromaticContact CD1-NE1 3.92Å; F412-W416 HydrophobicContact CE1-CD2 4.04Å; F412-W416 AromaticContact CE1-CE2 3.6Å; F412-W416 HydrophobicContact CE1-CE3 4.43Å; F412-W416 HydrophobicContact CE1-CH2 4.07Å; F412-W416 AromaticContact CE1-CZ2 3.62Å; F412-W416 HydrophobicContact CE1-CZ2 3.62Å; F412-W416 HydrophobicContact CE1-CZ3 4.44Å
413	Q	91.2	Very high	95.1	Very high	93 Å²	93	57.2 Å²	57.2	44%	0.435	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-54.4	-36.3	-176.4	-58	-55.3	-49.7	0	0	114.6	A407 L409 Q410 L415 W416	A407-Q413 PolarHBondContact O-NE2 3.13Å; L409-Q413 PolarHBondContact O-NE2 3.42Å; Q410-Q413 WeakPolarHBondContact O-CG 3.42Å; Q410-Q413 PolarHBondContact O-N 2.76Å; Q413-L415 PolarHBondContact O-N 3.11Å; Q413-W416 VanDerWaalsContact O-CD1 3.24Å
414	P	92.8	Very high	95.1	Very high	92 Å²	92	63.9 Å²	63.9	60%	0.597	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-69.1	-11.1	175.6	-20.3	34.2	0	0	0	115.2	G411 F412	G411-P414 WeakPolarHBondContact O-CD 3.24Å; F412-P414 VanDerWaalsContact C-N 3.3Å; F412-P414 VanDerWaalsContact O-N 3.16Å
415	L	94.6	Very high	94.9	Very high	73 Å²	73	68.2 Å²	68.2	38%	0.382	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-92.9	-8.9	-176.7	-61	178.2	0	0	0	113.3	H197 F412 Q413	H197-L415 PolarHBondContact ND1-O 3.4Å; F412-L415 HydrophobicContact CD2-CB 4.14Å; F412-L415 HydrophobicContact CD2-CD1 3.74Å; F412-L415 HydrophobicContact CD2-CG 4.46Å; F412-L415 HydrophobicContact CE2-CB 4.06Å; F412-L415 HydrophobicContact CE2-CD1 4.06Å; F412-L415 WeakPolarHBondContact O-CB 3.33Å; F412-L415 PolarHBondContact O-N 2.61Å; Q413-L415 PolarHBondContact O-N 3.11Å
416	W	96.3	Very high	94.7	Very high	8 Å²	8	66.1 Å²	66.1	3%	0.03	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-60.6	139.8	169.7	-68.5	116.7	0	0	0	110.3	A71 A166 L168 A195 M196 H197 A407 F412 Q413 R433	A71-W416 HydrophobicContact CB-CH2 3.84Å; A71-W416 HydrophobicContact CB-CZ2 3.68Å; A166-W416 HydrophobicContact CB-CD2 4.36Å; A166-W416 HydrophobicContact CB-CE3 4.19Å; A166-W416 HydrophobicContact CB-CH2 4.1Å; A166-W416 HydrophobicContact CB-CZ2 4.26Å; A166-W416 HydrophobicContact CB-CZ3 4.08Å; L168-W416 HydrophobicContact CB-CH2 3.89Å; L168-W416 HydrophobicContact CB-CZ3 4.21Å; A195-W416 HydrophobicContact CB-CB 4.19Å; M196-W416 VanDerWaalsContact C-CE3 3.46Å; H197-W416 HydrophobicContact CB-CE3 3.66Å; H197-W416 HydrophobicContact CB-CZ3 3.69Å; A407-W416 HydrophobicContact CB-CH2 4.31Å; A407-W416 HydrophobicContact CB-CZ2 4.07Å; F412-W416 AromaticContact CD1-CE2 3.94Å; F412-W416 HydrophobicContact CD1-CZ2 4.11Å; F412-W416 AromaticContact CD1-NE1 3.92Å; F412-W416 HydrophobicContact CE1-CD2 4.04Å; F412-W416 AromaticContact CE1-CE2 3.6Å; F412-W416 HydrophobicContact CE1-CE3 4.43Å; F412-W416 HydrophobicContact CE1-CH2 4.07Å; F412-W416 AromaticContact CE1-CZ2 3.62Å; F412-W416 HydrophobicContact CE1-CZ2 3.62Å; F412-W416 HydrophobicContact CE1-CZ3 4.44Å; Q413-W416 VanDerWaalsContact O-CD1 3.24Å; W416-R433 PolarHBondContact O-NH1 3.02Å
417	V	96.9	Very high	94.4	Very high	1 Å²	1	67.1 Å²	67.1	1%	0.006	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	121.1	167	179.6	0	0	0	0	106.6	F188 A195 M196 F429 L430 R433	F188-V417 HydrophobicContact CE2-CG1 4.39Å; F188-V417 HydrophobicContact CZ-CG1 4.27Å; F188-V417 WeakPolarHBondContact CZ-O 3.43Å; A195-V417 CarbonylContact C-O 3.54Å; A195-V417 WeakPolarHBondContact CA-O 3.4Å; A195-V417 WeakPolarHBondContact CB-O 3.48Å; M196-V417 PolarHBondContact N-O 3.37Å; M196-V417 PolarHBondContact O-N 3.43Å; V417-F429 HydrophobicContact CG1-CB 3.95Å; V417-F429 HydrophobicContact CG2-CB 4.23Å; V417-L430 HydrophobicContact CB-CD2 4.18Å; V417-L430 HydrophobicContact CG1-CD2 3.98Å; V417-L430 HydrophobicContact CG2-CD2 4.18Å; V417-R433 HydrophobicContact CG2-CB 4.04Å
418	H	96.8	Very high	94.2	Very high	74 Å²	74	72.4 Å²	72.4	34%	0.343	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	150.1	-179.9	-67.4	-79.5	0	0	0	111.2	F420 E421 Y422	H418-F420 VanDerWaalsContact C-N 3.3Å; H418-F420 HydrophobicContact CB-CD1 3.52Å; H418-F420 HydrophobicContact CB-CE1 3.33Å; H418-F420 HydrophobicContact CB-CZ 4.22Å; H418-F420 AromaticContact CG-CE1 3.76Å; H418-F420 PolarHBondContact O-N 3.34Å; H418-E421 HydrophobicContact CB-CG 4.19Å; H418-E421 IonicContact CD2-OE2 3.6Å; H418-E421 IonicContact CG-OE2 3.98Å; H418-E421 PolarHBondContact N-OE2 3.44Å; H418-E421 WeakPolarHBondContact O-CB 3.3Å; H418-E421 PolarHBondContact O-N 3.01Å; H418-Y422 PolarHBondContact O-N 3.08Å
419	R	96.6	Very high	94	Very high	70 Å²	70	70.8 Å²	70.8	26%	0.264	36%	0.362	S	S	.	.	H	α-helix	trans	-53.8	-44.6	179	-179.4	178.6	169.7	162.2	12.2	113	F188 N192 P194 E421 Y422 E423	F188-R419 HydrophobicContact CB-CG 4.3Å; F188-R419 HydrophobicContact CD1-CB 3.62Å; F188-R419 HydrophobicContact CD1-CG 3.9Å; F188-R419 VanDerWaalsContact CE1-CA 3.49Å; F188-R419 HydrophobicContact CE1-CB 3.77Å; F188-R419 HydrophobicContact CG-CB 4.4Å; F188-R419 HydrophobicContact CG-CG 4.29Å; N192-R419 VanDerWaalsContact OD1-CZ 3.23Å; N192-R419 PolarHBondContact OD1-NH1 3.27Å; N192-R419 PolarHBondContact OD1-NH2 3.31Å; P194-R419 PolarHBondContact O-N 3.01Å; R419-E421 VanDerWaalsContact C-N 3.25Å; R419-E421 PolarHBondContact O-N 3.32Å; R419-Y422 WeakPolarHBondContact O-CB 3.43Å; R419-Y422 PolarHBondContact O-N 3.2Å; R419-Y422 VanDerWaalsContact O-N 3.11Å; R419-E423 HydrophobicContact CG-CG 4.33Å; R419-E423 IonicContact CZ-OE1 3.35Å; R419-E423 IonicContact NE-OE1 2.76Å; R419-E423 PolarHBondContact NE-OE1 3.22Å; R419-E423 IonicContact NH2-OE1 2.92Å; R419-E423 PolarHBondContact NH2-OE1 2.79Å; R419-E423 WeakPolarHBondContact O-CG 3.48Å; R419-E423 PolarHBondContact O-N 3.4Å
420	F	96.2	Very high	93.9	Very high	121 Å²	121	66.7 Å²	66.7	53%	0.531	34%	0.341	S	S	.	.	H	α-helix	trans	-63	-32.7	179.6	77.3	-92.7	0	0	0	112.4	H418 Y422 E423 E424	H418-F420 VanDerWaalsContact C-N 3.3Å; H418-F420 HydrophobicContact CB-CD1 3.52Å; H418-F420 HydrophobicContact CB-CE1 3.33Å; H418-F420 HydrophobicContact CB-CZ 4.22Å; H418-F420 AromaticContact CG-CE1 3.76Å; H418-F420 PolarHBondContact O-N 3.34Å; F420-Y422 VanDerWaalsContact C-N 3.34Å; F420-E423 PolarHBondContact O-N 3.11Å; F420-E424 WeakPolarHBondContact O-CB 3.07Å; F420-E424 PolarHBondContact O-N 3.43Å; F420-E424 VanDerWaalsContact O-N 3.07Å
421	E	95.9	Very high	93.8	Very high	21 Å²	21	62.7 Å²	62.7	10%	0.098	32%	0.319	C	S	.	.	H	α-helix	trans	-68.9	-38.1	176.8	-63	177	121.7	0	0	110.6	H418 R419 H425 F429 R433	H418-E421 HydrophobicContact CB-CG 4.19Å; H418-E421 IonicContact CD2-OE2 3.6Å; H418-E421 IonicContact CG-OE2 3.98Å; H418-E421 PolarHBondContact N-OE2 3.44Å; H418-E421 WeakPolarHBondContact O-CB 3.3Å; H418-E421 PolarHBondContact O-N 3.01Å; R419-E421 VanDerWaalsContact C-N 3.25Å; R419-E421 PolarHBondContact O-N 3.32Å; E421-H425 WeakPolarHBondContact O-CB 3.34Å; E421-H425 PolarHBondContact O-N 2.98Å; E421-F429 HydrophobicContact CB-CD2 3.73Å; E421-F429 HydrophobicContact CB-CE2 4.07Å; E421-F429 HydrophobicContact CB-CG 4.4Å; E421-F429 HydrophobicContact CG-CD2 4.48Å; E421-R433 VanDerWaalsContact CD-NH1 3.27Å; E421-R433 IonicContact OE1-CZ 3.08Å; E421-R433 VanDerWaalsContact OE1-CZ 3.32Å; E421-R433 IonicContact OE1-NH1 2.72Å; E421-R433 PolarHBondContact OE1-NH1 3.47Å; E421-R433 IonicContact OE1-NH2 3.74Å; E421-R433 PolarHBondContact OE1-NH2 3.11Å; E421-R433 IonicContact OE2-CZ 3.94Å; E421-R433 IonicContact OE2-NH1 2.66Å; E421-R433 PolarHBondContact OE2-NH1 3.03Å; E421-R433 IonicContact OE2-NH2 3.69Å
422	Y	95.9	Very high	93.7	Very high	32 Å²	32	68.1 Å²	68.1	13%	0.125	32%	0.318	C	S	.	.	H	α-helix	trans	-68.1	-43.1	174.4	174.4	-98.1	0	0	0	112.1	A184 F188 E189 H418 R419 F420 E424 G426 L430	A184-Y422 HydrophobicContact CB-CD2 4.12Å; A184-Y422 HydrophobicContact CB-CE2 3.72Å; F188-Y422 HydrophobicContact CB-CD1 4.02Å; F188-Y422 HydrophobicContact CB-CE1 4.26Å; F188-Y422 AromaticContact CD2-CD1 3.51Å; F188-Y422 HydrophobicContact CD2-CD1 3.51Å; F188-Y422 HydrophobicContact CD2-CD2 4Å; F188-Y422 HydrophobicContact CD2-CE1 4.13Å; F188-Y422 AromaticContact CD2-CG 3.43Å; F188-Y422 HydrophobicContact CD2-CG 3.43Å; F188-Y422 VanDerWaalsContact CD2-CG 3.43Å; F188-Y422 HydrophobicContact CE2-CD1 4.28Å; F188-Y422 HydrophobicContact CE2-CD2 4.18Å; F188-Y422 AromaticContact CE2-CG 3.75Å; F188-Y422 HydrophobicContact CE2-CG 3.75Å; F188-Y422 HydrophobicContact CG-CD1 4.1Å; F188-Y422 HydrophobicContact CG-CG 4.39Å; E189-Y422 HydrophobicContact CG-CE1 4.35Å; E189-Y422 PolarHBondContact OE1-OH 2.99Å; H418-Y422 PolarHBondContact O-N 3.08Å; R419-Y422 WeakPolarHBondContact O-CB 3.43Å; R419-Y422 PolarHBondContact O-N 3.2Å; R419-Y422 VanDerWaalsContact O-N 3.11Å; F420-Y422 VanDerWaalsContact C-N 3.34Å; Y422-E424 VanDerWaalsContact C-N 3.3Å; Y422-E424 PolarHBondContact O-N 3.32Å; Y422-G426 WeakPolarHBondContact CD2-O 3.35Å; Y422-G426 WeakPolarHBondContact O-CA 3.46Å; Y422-G426 PolarHBondContact O-N 3.06Å; Y422-L430 HydrophobicContact CD2-CD1 4.3Å; Y422-L430 HydrophobicContact CE2-CD1 4.36Å
423	E	95.4	Very high	93.6	Very high	123 Å²	123	70.5 Å²	70.5	58%	0.575	33%	0.327	S	S	*	.	H	α-helix	trans	-63.3	-35.7	177.6	-71.9	173.1	171.6	0	0	112.3	R419 F420	R419-E423 HydrophobicContact CG-CG 4.33Å; R419-E423 IonicContact CZ-OE1 3.35Å; R419-E423 IonicContact NE-OE1 2.76Å; R419-E423 PolarHBondContact NE-OE1 3.22Å; R419-E423 IonicContact NH2-OE1 2.92Å; R419-E423 PolarHBondContact NH2-OE1 2.79Å; R419-E423 WeakPolarHBondContact O-CG 3.48Å; R419-E423 PolarHBondContact O-N 3.4Å; F420-E423 PolarHBondContact O-N 3.11Å
424	E	96.4	Very high	93.2	Very high	140 Å²	140	66.1 Å²	66.1	65%	0.654	31%	0.307	S	S	*	.	H	α-helix	trans	-85.3	-37.5	-178.4	-172	-178.6	-175.2	0	0	113.2	F420 Y422	F420-E424 WeakPolarHBondContact O-CB 3.07Å; F420-E424 PolarHBondContact O-N 3.43Å; F420-E424 VanDerWaalsContact O-N 3.07Å; Y422-E424 VanDerWaalsContact C-N 3.3Å; Y422-E424 PolarHBondContact O-N 3.32Å
425	H	94.7	Very high	92.2	Very high	93 Å²	93	64.6 Å²	64.6	43%	0.431	29%	0.291	S	S	.	.	H	α-helix	trans	-119.6	5.4	-170.8	-57.9	81.4	0	0	0	114.1	E421 F428 F429	E421-H425 WeakPolarHBondContact O-CB 3.34Å; E421-H425 PolarHBondContact O-N 2.98Å; H425-F428 HydrophobicContact CB-CB 4.4Å; H425-F428 WeakPolarHBondContact O-CB 3.32Å; H425-F429 HydrophobicContact CB-CD2 4.04Å; H425-F429 HydrophobicContact CB-CE2 3.86Å; H425-F429 AromaticContact CG-CE2 3.65Å; H425-F429 AromaticContact ND1-CE2 3.69Å
426	G	92.4	Very high	92	Very high	24 Å²	24	64.2 Å²	64.2	25%	0.247	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	-142.7	-174.6	0	0	0	0	0	112.2	Y422 F428	Y422-G426 WeakPolarHBondContact CD2-O 3.35Å; Y422-G426 WeakPolarHBondContact O-CA 3.46Å; Y422-G426 PolarHBondContact O-N 3.06Å; G426-F428 PolarHBondContact O-N 2.85Å; G426-F428 VanDerWaalsContact O-N 3.14Å
427	P	91.2	Very high	91.8	Very high	40 Å²	40	67.1 Å²	67.1	26%	0.26	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	2.5	-173.3	33.1	-37.2	0	0	0	114.3	E181 F429 L430 Y431	E181-P427 HydrophobicContact CG-CB 3.88Å; E181-P427 HydrophobicContact CG-CG 4.31Å; P427-F429 VanDerWaalsContact C-N 3.34Å; P427-F429 PolarHBondContact O-N 2.77Å; P427-L430 HydrophobicContact CB-CD1 3.81Å; P427-L430 VanDerWaalsContact O-CB 3.25Å; P427-L430 WeakPolarHBondContact O-CB 3.4Å; P427-L430 PolarHBondContact O-N 3.32Å; P427-Y431 HydrophobicContact CB-CD2 4.3Å; P427-Y431 HydrophobicContact CB-CE2 3.77Å; P427-Y431 HydrophobicContact CG-CE2 3.99Å; P427-Y431 WeakPolarHBondContact O-CD2 3.44Å; P427-Y431 PolarHBondContact O-N 3.22Å
428	F	91.6	Very high	91.5	Very high	114 Å²	114	70.8 Å²	70.8	50%	0.5	32%	0.316	S	S	.	.	H	α-helix	trans	-52.8	-46.9	-173.5	176.5	-100.5	0	0	0	113.4	H425 G426 L430 Y431 R432	H425-F428 HydrophobicContact CB-CB 4.4Å; H425-F428 WeakPolarHBondContact O-CB 3.32Å; G426-F428 PolarHBondContact O-N 2.85Å; G426-F428 VanDerWaalsContact O-N 3.14Å; F428-L430 VanDerWaalsContact C-N 3.3Å; F428-L430 PolarHBondContact O-N 2.97Å; F428-Y431 PolarHBondContact O-N 3.32Å; F428-R432 PolarHBondContact O-N 2.86Å
429	F	91	Very high	91.2	Very high	29 Å²	29	70.6 Å²	70.6	13%	0.127	32%	0.315	C	S	.	.	H	α-helix	trans	-71.7	-24.1	-179.6	-72.6	-73.3	0	0	0	113.4	V417 E421 H425 P427 R432 R433	V417-F429 HydrophobicContact CG1-CB 3.95Å; V417-F429 HydrophobicContact CG2-CB 4.23Å; E421-F429 HydrophobicContact CB-CD2 3.73Å; E421-F429 HydrophobicContact CB-CE2 4.07Å; E421-F429 HydrophobicContact CB-CG 4.4Å; E421-F429 HydrophobicContact CG-CD2 4.48Å; H425-F429 HydrophobicContact CB-CD2 4.04Å; H425-F429 HydrophobicContact CB-CE2 3.86Å; H425-F429 AromaticContact CG-CE2 3.65Å; H425-F429 AromaticContact ND1-CE2 3.69Å; P427-F429 VanDerWaalsContact C-N 3.34Å; P427-F429 PolarHBondContact O-N 2.77Å; F429-R432 PolarHBondContact O-N 2.63Å; F429-R433 WeakPolarHBondContact O-CB 3.48Å; F429-R433 PolarHBondContact O-N 3.06Å
430	L	90.9	Very high	90.9	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62	-47.2	172.8	-56.1	169.7	0	0	0	109.7	A184 M196 V417 Y422 P427 F428 R432 C434	A184-L430 HydrophobicContact CB-CD1 3.4Å; A184-L430 VanDerWaalsContact CB-CD1 3.4Å; A184-L430 HydrophobicContact CB-CD2 4.21Å; A184-L430 HydrophobicContact CB-CG 4.43Å; M196-L430 HydrophobicContact CE-CD2 4.31Å; M196-L430 HydrophobicContact CG-CD2 4.39Å; M196-L430 HydrophobicContact SD-CD2 4.11Å; V417-L430 HydrophobicContact CB-CD2 4.18Å; V417-L430 HydrophobicContact CG1-CD2 3.98Å; V417-L430 HydrophobicContact CG2-CD2 4.18Å; Y422-L430 HydrophobicContact CD2-CD1 4.3Å; Y422-L430 HydrophobicContact CE2-CD1 4.36Å; P427-L430 HydrophobicContact CB-CD1 3.81Å; P427-L430 VanDerWaalsContact O-CB 3.25Å; P427-L430 WeakPolarHBondContact O-CB 3.4Å; P427-L430 PolarHBondContact O-N 3.32Å; F428-L430 VanDerWaalsContact C-N 3.3Å; F428-L430 PolarHBondContact O-N 2.97Å; L430-R432 PolarHBondContact O-N 3.02Å; L430-C434 WeakPolarHBondContact O-CA 3.38Å; L430-C434 WeakPolarHBondContact O-CB 3.33Å; L430-C434 PolarHBondContact O-N 3.24Å
431	Y	89.8	Confident	90.5	Very high	97 Å²	97	67.3 Å²	67.3	38%	0.38	30%	0.304	S	S	.	.	H	α-helix	trans	-67.1	-23.5	-179.6	-66.6	-64.8	0	0	0	114.3	H177 E181 P427 F428	H177-Y431 HydrophobicContact CB-CE1 4.37Å; E181-Y431 PolarHBondContact OE1-OH 3.09Å; P427-Y431 HydrophobicContact CB-CD2 4.3Å; P427-Y431 HydrophobicContact CB-CE2 3.77Å; P427-Y431 HydrophobicContact CG-CE2 3.99Å; P427-Y431 WeakPolarHBondContact O-CD2 3.44Å; P427-Y431 PolarHBondContact O-N 3.22Å; F428-Y431 PolarHBondContact O-N 3.32Å
432	R	88.6	Confident	90.2	Very high	180 Å²	180	70.6 Å²	70.6	68%	0.679	32%	0.318	S	S	*	.	H	α-helix	trans	-93.1	-35.8	-177	-172.1	177	178.3	-173.4	0	113.3	F428 F429 L430	F428-R432 PolarHBondContact O-N 2.86Å; F429-R432 PolarHBondContact O-N 2.63Å; L430-R432 PolarHBondContact O-N 3.02Å
433	R	90.6	Very high	89.7	Confident	55 Å²	55	73.5 Å²	73.5	21%	0.208	33%	0.333	C	S	.	.	H	α-helix	trans	-103.9	-35	-174.5	-62.6	-172.4	-171.9	150.2	10.7	112.6	H197 W416 V417 E421 F429 F435	H197-R433 PolarHBondContact CE1-O 3.04Å; W416-R433 PolarHBondContact O-NH1 3.02Å; V417-R433 HydrophobicContact CG2-CB 4.04Å; E421-R433 VanDerWaalsContact CD-NH1 3.27Å; E421-R433 IonicContact OE1-CZ 3.08Å; E421-R433 VanDerWaalsContact OE1-CZ 3.32Å; E421-R433 IonicContact OE1-NH1 2.72Å; E421-R433 PolarHBondContact OE1-NH1 3.47Å; E421-R433 IonicContact OE1-NH2 3.74Å; E421-R433 PolarHBondContact OE1-NH2 3.11Å; E421-R433 IonicContact OE2-CZ 3.94Å; E421-R433 IonicContact OE2-NH1 2.66Å; E421-R433 PolarHBondContact OE2-NH1 3.03Å; E421-R433 IonicContact OE2-NH2 3.69Å; F429-R433 WeakPolarHBondContact O-CB 3.48Å; F429-R433 PolarHBondContact O-N 3.06Å; R433-F435 PolarHBondContact O-N 3.39Å
434	C	83.4	Confident	89.2	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.007	31%	0.313	C	S	.	.			trans	-84.2	109.8	170.8	-52.6	0	0	0	0	107	I198 L430	I198-C434 HydrophobicContact CB-CB 4.14Å; I198-C434 PolarHBondContact N-SG 3.18Å; I198-C434 VanDerWaalsContact N-SG 3.37Å; L430-C434 WeakPolarHBondContact O-CA 3.38Å; L430-C434 WeakPolarHBondContact O-CB 3.33Å; L430-C434 PolarHBondContact O-N 3.24Å
435	F	70.4	Confident	88.6	Confident	60 Å²	60	63 Å²	63	26%	0.263	28%	0.282	S	S	.	.			trans	106.4	0	170	-53	-63.2	0	0	0	119.3	D171 R180 I198 Y200 R203 R433	D171-F435 HydrophobicContact CB-CZ 4.37Å; R180-F435 HydrophobicContact CG-CE2 4.16Å; R180-F435 VanDerWaalsContact CZ-CD2 3.49Å; R180-F435 VanDerWaalsContact NE-CD2 3.34Å; R180-F435 VanDerWaalsContact NH2-CD2 3.3Å; I198-F435 HydrophobicContact CB-CE2 4.21Å; I198-F435 HydrophobicContact CB-CZ 4.01Å; I198-F435 HydrophobicContact CG2-CE1 4.49Å; I198-F435 HydrophobicContact CG2-CE2 4.12Å; I198-F435 HydrophobicContact CG2-CZ 3.56Å; Y200-F435 AromaticContact CD1-CD1 3.7Å; Y200-F435 HydrophobicContact CD1-CD1 3.7Å; Y200-F435 AromaticContact CD1-CE1 3.15Å; Y200-F435 HydrophobicContact CD1-CE1 3.15Å; Y200-F435 AromaticContact CD1-CZ 3.87Å; Y200-F435 HydrophobicContact CD1-CZ 3.87Å; Y200-F435 AromaticContact CD2-CD1 3.3Å; Y200-F435 HydrophobicContact CD2-CD1 3.3Å; Y200-F435 AromaticContact CD2-CE1 3.65Å; Y200-F435 HydrophobicContact CD2-CE1 3.65Å; Y200-F435 HydrophobicContact CD2-CG 4.32Å; Y200-F435 AromaticContact CE1-CD1 3.45Å; Y200-F435 HydrophobicContact CE1-CD1 3.45Å; Y200-F435 VanDerWaalsContact CE1-CD1 3.45Å; Y200-F435 HydrophobicContact CE1-CD2 4.49Å; Y200-F435 AromaticContact CE1-CE1 3.11Å; Y200-F435 HydrophobicContact CE1-CE1 3.11Å; Y200-F435 HydrophobicContact CE1-CE2 4.28Å; Y200-F435 HydrophobicContact CE1-CG 4.1Å; Y200-F435 AromaticContact CE1-CZ 3.57Å; Y200-F435 HydrophobicContact CE1-CZ 3.57Å; Y200-F435 HydrophobicContact CE2-CB 3.92Å; Y200-F435 AromaticContact CE2-CD1 3.05Å; Y200-F435 HydrophobicContact CE2-CD1 3.05Å; Y200-F435 AromaticContact CE2-CE1 3.65Å; Y200-F435 HydrophobicContact CE2-CE1 3.65Å; Y200-F435 AromaticContact CE2-CG 3.65Å; Y200-F435 HydrophobicContact CE2-CG 3.65Å; Y200-F435 AromaticContact CG-CD1 3.62Å; Y200-F435 HydrophobicContact CG-CD1 3.62Å; Y200-F435 AromaticContact CG-CE1 3.4Å; Y200-F435 HydrophobicContact CG-CE1 3.4Å; Y200-F435 HydrophobicContact CG-CZ 4.5Å; Y200-F435 AromaticContact CZ-CD1 3.09Å; Y200-F435 AromaticContact CZ-CE1 3.36Å; Y200-F435 AromaticContact CZ-CG 3.48Å; Y200-F435 VanDerWaalsContact CZ-CG 3.48Å; Y200-F435 AromaticContact CZ-CZ 3.99Å; Y200-F435 WeakPolarHBondContact OH-CG 3.43Å; R203-F435 PolarHBondContact NH1-OXT 3.15Å; R203-F435 PolarHBondContact NH2-OXT 3Å; R433-F435 PolarHBondContact O-N 3.39Å

Retrieved 435 of 435 residues in 78.5 ms (Link to these results)

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