A0A093GPI3_STRCA Loading...

Trimethyllysine dioxygenase, mitochondrial

Converts trimethyllysine (TML) into hydroxytrimethyllysine (HTML).

AlphaFold DB , UniProt , Accession A0A093GPI3, Species STRCA (Struthio camelus australis), Gene n/a, Length 421 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.2	Very low	27	Very low	232 Å²	232	170.5 Å²	170.5	100%	1.143	84%	0.842	S	S	*	*				0	126.4	0	-91.9	-179.8	-168.2	0	0	108.1
2	W	24.9	Very low	27.1	Very low	223 Å²	223	166.9 Å²	166.9	85%	0.845	84%	0.837	S	S	*	*			trans	75.9	94	162.5	-69.7	57.9	0	0	0	118.9
3	C	23.1	Very low	27.3	Very low	119 Å²	119	163.1 Å²	163.1	80%	0.804	83%	0.831	S	S	*	*			trans	-57.6	145	152.4	-75.2	0	0	0	0	111.5
4	W	27.4	Very low	27.2	Very low	214 Å²	214	161.2 Å²	161.2	81%	0.811	84%	0.837	S	S	*	*			trans	-132.5	122.6	146.8	-100.2	70.3	0	0	0	110.3	L6	W4-L6 HydrophobicContact CE3-CD1 4.1Å; W4-L6 HydrophobicContact CZ3-CD1 3.84Å
5	R	30.5	Very low	27.2	Very low	225 Å²	225	166.6 Å²	166.6	85%	0.849	84%	0.842	S	S	*	*			trans	-71.3	156.9	160.3	-70.1	177	169.4	-157.5	-3	108.5
6	L	28.2	Very low	27.1	Very low	150 Å²	150	166.9 Å²	166.9	79%	0.785	85%	0.846	S	S	*	*				-171	122.9	124.9	-99.2	160	0	0	0	111.2	W4	W4-L6 HydrophobicContact CE3-CD1 4.1Å; W4-L6 HydrophobicContact CZ3-CD1 3.84Å
7	T	28.8	Very low	27.2	Very low	137 Å²	137	164.3 Å²	164.3	84%	0.84	85%	0.847	S	S	*	*			trans	-90.8	151.3	163.9	31.1	0	0	0	0	110.2
8	G	26.3	Very low	27.1	Very low	64 Å²	64	168.7 Å²	168.7	66%	0.66	85%	0.851	S	S	*	*			trans	170.2	101.8	163.9	0	0	0	0	0	111.7
9	L	27.3	Very low	27.1	Very low	157 Å²	157	165.9 Å²	165.9	82%	0.822	85%	0.849	S	S	*	*				69.6	118.3	110.2	-66.4	160.5	0	0	0	112.8
10	F	27.8	Very low	27.1	Very low	197 Å²	197	164.4 Å²	164.4	86%	0.864	85%	0.847	S	S	*	*				-157.9	141.2	76.8	-94.7	-88.3	0	0	0	113.2
11	N	25.2	Very low	27.1	Very low	157 Å²	157	160.7 Å²	160.7	84%	0.84	84%	0.836	S	S	*	*			trans	-102.5	127.3	169.4	-130.1	-9.5	0	0	0	107.5
12	V	28.9	Very low	27.2	Very low	128 Å²	128	157.8 Å²	157.8	78%	0.776	82%	0.82	S	S	*	*			trans	-149.7	126.9	154.8	-176.5	0	0	0	0	109.5
13	P	29.6	Very low	27.3	Very low	117 Å²	117	158.3 Å²	158.3	76%	0.76	82%	0.821	S	S	*	*			trans	-95.6	150.7	173	36.2	-29	0	0	0	111.2
14	C	25.8	Very low	27.4	Very low	137 Å²	137	157.8 Å²	157.8	93%	0.926	82%	0.819	S	S	*	*			trans	-141.3	137.2	162.7	-145.1	0	0	0	0	113.2
15	R	26.6	Very low	27.3	Very low	242 Å²	242	152.5 Å²	152.5	91%	0.913	82%	0.821	S	S	*	*			trans	-83.9	155.4	-163.6	-76	176.6	170.7	-163.3	-2.6	113.5
16	L	26.5	Very low	27	Very low	171 Å²	171	152.6 Å²	152.6	90%	0.895	82%	0.822	S	S	*	*			trans	-49.6	143.8	161	-72.5	125.3	0	0	0	114.1
17	S	28.1	Very low	27	Very low	123 Å²	123	152.1 Å²	152.1	86%	0.86	82%	0.819	S	S	*	*			trans	-133.4	122.2	152	62.8	0	0	0	0	110.4
18	R	25.3	Very low	27.4	Very low	243 Å²	243	151.3 Å²	151.3	92%	0.917	82%	0.816	S	S	*	*			trans	-86.1	142.6	166.4	-81.8	177.5	168.3	180	-3.4	109.4
19	S	28	Very low	27.4	Very low	117 Å²	117	152 Å²	152	82%	0.818	82%	0.823	S	S	*	*			trans	-149.8	124.9	144.6	63	0	0	0	0	111.7
20	T	27.4	Very low	27.4	Very low	134 Å²	134	151.1 Å²	151.1	82%	0.822	83%	0.829	S	S	*	*			trans	-49.8	166.1	158.6	43.2	0	0	0	0	112.8
21	S	27.3	Very low	27.3	Very low	88 Å²	88	145.1 Å²	145.1	62%	0.615	82%	0.822	S	S	*	*			cis	179.9	166.7	0.6	42.6	0	0	0	0	108.2
22	H	27.7	Very low	27.5	Very low	171 Å²	171	146.5 Å²	146.5	79%	0.792	82%	0.821	S	S	*	*			trans	123.1	103	159.5	-68.8	-62.7	0	0	0	112.3
23	R	26.9	Very low	27.5	Very low	233 Å²	233	148.1 Å²	148.1	88%	0.879	82%	0.823	S	S	*	*				44.4	131.5	83.6	-76.1	-167.5	-175.1	-146.7	2.7	111.8
24	S	25.5	Very low	27.4	Very low	108 Å²	108	151.7 Å²	151.7	76%	0.755	83%	0.827	S	S	*	*			cis	174	148.1	7.4	43.4	0	0	0	0	105.7
25	A	26.4	Very low	27.4	Very low	103 Å²	103	150.3 Å²	150.3	85%	0.851	82%	0.819	S	S	*	*			trans	162.7	147.9	133.8	0	0	0	0	0	112
26	W	24.2	Very low	27.7	Very low	228 Å²	228	144 Å²	144	86%	0.864	82%	0.819	S	S	*	*			trans	-111	149	-166.5	-97.9	79.3	0	0	0	110.7
27	L	26.8	Very low	27.8	Very low	140 Å²	140	140.4 Å²	140.4	73%	0.733	81%	0.814	S	S	*	*			trans	85.3	164.3	151	-61.2	155.4	0	0	0	120.3
28	P	37.7	Very low	27.9	Very low	120 Å²	120	139.4 Å²	139.4	78%	0.779	81%	0.813	S	S	*	*			cis	-136.8	-176.3	-48	37.6	-21	0	0	0	111.9
29	G	26.7	Very low	28	Very low	78 Å²	78	131.7 Å²	131.7	80%	0.804	80%	0.801	S	S	*	*			trans	124.8	92.5	150.8	0	0	0	0	0	116.2
30	C	26.7	Very low	28.1	Very low	139 Å²	139	136.4 Å²	136.4	94%	0.939	80%	0.801	S	S	*	*			trans	-86.6	113.6	168.6	-163.9	0	0	0	0	109.1
31	G	26.6	Very low	28.1	Very low	71 Å²	71	140.9 Å²	140.9	73%	0.732	80%	0.803	S	S	*	*			trans	-118.6	116.8	172.4	0	0	0	0	0	110.1
32	K	29.4	Very low	28.2	Very low	185 Å²	185	144 Å²	144	80%	0.804	81%	0.807	S	S	*	*			trans	-71.5	130.3	173.8	-73.5	176.6	175.6	176.6	0	110.3
33	I	27.8	Very low	28.5	Very low	162 Å²	162	144.3 Å²	144.3	83%	0.831	81%	0.809	S	S	*	*			trans	-134.7	116.1	154.2	-59.9	-179.5	0	0	0	107.5
34	F	27.4	Very low	29	Very low	192 Å²	192	139.3 Å²	139.3	84%	0.842	81%	0.805	S	S	*	*			trans	-77.7	126.2	168.3	-83.6	-94.4	0	0	0	108.7
35	S	27.1	Very low	29.5	Very low	109 Å²	109	138.1 Å²	138.1	76%	0.762	80%	0.801	S	S	*	*			trans	-130.4	120.1	162.7	178.4	0	0	0	0	108.2	A37	S35-A37 PolarHBondContact O-N 2.9Å
36	A	31.9	Very low	30.2	Very low	108 Å²	108	138.9 Å²	138.9	89%	0.893	80%	0.798	S	S	*	*			trans	-75.7	117.8	178.9	0	0	0	0	0	109.7
37	A	29.6	Very low	31.3	Very low	96 Å²	96	137 Å²	137	79%	0.793	80%	0.798	S	S	*	*			trans	-121.5	127.2	168.8	0	0	0	0	0	109.2	S35 A39	S35-A37 PolarHBondContact O-N 2.9Å; A37-A39 PolarHBondContact O-N 3.49Å
38	A	29	Very low	32.5	Very low	102 Å²	102	134.9 Å²	134.9	84%	0.843	80%	0.795	S	S	*	*			trans	-54.5	120.5	-177	0	0	0	0	0	112	R40	A38-R40 PolarHBondContact O-N 3.28Å; A38-R40 VanDerWaalsContact O-N 3.09Å
39	A	28.8	Very low	33.5	Very low	82 Å²	82	134 Å²	134	68%	0.678	78%	0.783	S	S	*	*			trans	-70.1	104.1	173	0	0	0	0	0	109.4	A37 W41	A37-A39 PolarHBondContact O-N 3.49Å; A39-W41 PolarHBondContact O-N 3.23Å
40	R	28.3	Very low	35.6	Very low	215 Å²	215	138.2 Å²	138.2	81%	0.811	78%	0.78	S	S	*	*			trans	-66.2	115.1	159.8	-75.3	-179.3	176.6	-173.8	-1.5	107.1	A38 H42	A38-R40 PolarHBondContact O-N 3.28Å; A38-R40 VanDerWaalsContact O-N 3.09Å; R40-H42 VanDerWaalsContact C-N 3.3Å; R40-H42 PolarHBondContact O-N 3.09Å
41	W	28	Very low	38.4	Very low	229 Å²	229	133.4 Å²	133.4	87%	0.867	75%	0.747	S	S	*	*			trans	-66.4	92.7	169.9	-68.7	83.3	0	0	0	108.4	A39 H43	A39-W41 PolarHBondContact O-N 3.23Å; W41-H43 PolarHBondContact O-N 3.48Å
42	H	29.8	Very low	41.5	Very low	152 Å²	152	132.6 Å²	132.6	70%	0.704	73%	0.733	S	S	*	*			trans	-74.1	105.1	158.2	-75.5	-67.7	0	0	0	106.4	R40 T44	R40-H42 VanDerWaalsContact C-N 3.3Å; R40-H42 PolarHBondContact O-N 3.09Å; H42-T44 PolarHBondContact O-N 3.34Å
43	H	34.5	Very low	44.6	Very low	179 Å²	179	128.9 Å²	128.9	83%	0.829	71%	0.714	S	S	*	*			trans	-59.8	91	158.3	-75.9	-78.2	0	0	0	107.4	W41 A45	W41-H43 PolarHBondContact O-N 3.48Å; H43-A45 VanDerWaalsContact C-N 3.35Å; H43-A45 PolarHBondContact O-N 2.88Å; H43-A45 VanDerWaalsContact O-N 3.11Å
44	T	36	Very low	47.8	Very low	128 Å²	128	126.3 Å²	126.3	79%	0.785	70%	0.699	S	S	*	*			trans	-68.3	102.6	157.6	43.8	0	0	0	0	105.7	H42	H42-T44 PolarHBondContact O-N 3.34Å
45	A	35.7	Very low	51.1	Low	82 Å²	82	120.6 Å²	120.6	68%	0.678	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-48.1	137.5	159.6	0	0	0	0	0	107.7	H43 E47	H43-A45 VanDerWaalsContact C-N 3.35Å; H43-A45 PolarHBondContact O-N 2.88Å; H43-A45 VanDerWaalsContact O-N 3.11Å; A45-E47 PolarHBondContact O-N 2.88Å
46	P	41.9	Very low	54.3	Low	120 Å²	120	118.3 Å²	118.3	78%	0.779	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-55	132.7	172.3	-5.8	14.5	0	0	0	107.7	S48	P46-S48 PolarHBondContact O-N 2.88Å; P46-S48 VanDerWaalsContact O-N 3.11Å
47	E	48.4	Very low	57.1	Low	188 Å²	188	115.7 Å²	115.7	88%	0.879	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-47.5	124.1	170	-73.6	-177	141.7	0	0	108	A45 L49	A45-E47 PolarHBondContact O-N 2.88Å; E47-L49 PolarHBondContact O-N 2.77Å; E47-L49 VanDerWaalsContact O-N 3.09Å
48	S	52	Low	60	Low	96 Å²	96	116.1 Å²	116.1	67%	0.671	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-53.7	124	177.3	54.6	0	0	0	0	108.2	P46 K50	P46-S48 PolarHBondContact O-N 2.88Å; P46-S48 VanDerWaalsContact O-N 3.11Å; S48-K50 VanDerWaalsContact C-N 3.34Å; S48-K50 PolarHBondContact O-N 3.02Å
49	L	58.1	Low	63.3	Low	101 Å²	101	112.9 Å²	112.9	53%	0.529	59%	0.594	S	S	.	*			trans	-52.2	103.3	170.6	-81.2	153.6	0	0	0	106.7	E47 C51 Y64	E47-L49 PolarHBondContact O-N 2.77Å; E47-L49 VanDerWaalsContact O-N 3.09Å; L49-C51 PolarHBondContact O-N 2.74Å; L49-Y64 HydrophobicContact CB-CE2 4.42Å; L49-Y64 HydrophobicContact CD2-CE2 3.89Å
50	K	71.4	Confident	66.5	Low	167 Å²	167	109 Å²	109	73%	0.726	56%	0.561	S	S	*	*			trans	-72.1	74.4	-178	-72.8	-176.3	-177.8	173.1	0	108.8	S48	S48-K50 VanDerWaalsContact C-N 3.34Å; S48-K50 PolarHBondContact O-N 3.02Å
51	C	84	Confident	69.8	Low	38 Å²	38	100.6 Å²	100.6	26%	0.257	53%	0.532	S	S	.	.			trans	-80	119.5	169.7	-162.8	0	0	0	0	108.2	L49 R63 Y64 V111	L49-C51 PolarHBondContact O-N 2.74Å; C51-R63 VanDerWaalsContact CA-O 3.3Å; C51-R63 WeakPolarHBondContact CA-O 3.47Å; C51-Y64 HydrophobicContact CB-CD2 4.3Å; C51-V111 HydrophobicContact CB-CG1 4.37Å; C51-V111 WeakPolarHBondContact SG-CG1 3.49Å
52	A	91.4	Very high	73.1	Confident	53 Å²	53	89.7 Å²	89.7	44%	0.438	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	144.6	176.5	0	0	0	0	0	108.8	R63	A52-R63 HydrophobicContact CB-CB 4.43Å; A52-R63 PolarHBondContact N-O 2.79Å; A52-R63 PolarHBondContact O-N 3.29Å
53	W	94.5	Very high	76.1	Confident	107 Å²	107	87.6 Å²	87.6	41%	0.405	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	153.5	179.7	61.2	-91.4	0	0	0	111.4	L55 L60 E61 L62 V109 V111	W53-L55 HydrophobicContact CE3-CG 4.29Å; W53-L55 HydrophobicContact CZ3-CD1 4Å; W53-L55 HydrophobicContact CZ3-CG 3.88Å; W53-L60 HydrophobicContact CB-CD1 4.25Å; W53-L60 HydrophobicContact CE3-CD1 4.11Å; W53-E61 CarbonylContact C-O 3.52Å; W53-E61 WeakPolarHBondContact CA-O 3.3Å; W53-E61 WeakPolarHBondContact CB-O 3.37Å; W53-L62 HydrophobicContact CB-CD1 3.87Å; W53-V109 HydrophobicContact CD2-CG1 3.94Å; W53-V109 HydrophobicContact CE3-CB 4.27Å; W53-V109 HydrophobicContact CE3-CG1 3.99Å; W53-V109 HydrophobicContact CH2-CB 3.82Å; W53-V109 HydrophobicContact CH2-CG1 4.22Å; W53-V109 HydrophobicContact CZ2-CB 4.11Å; W53-V109 HydrophobicContact CZ2-CG1 4.15Å; W53-V109 WeakPolarHBondContact CZ2-O 3.16Å; W53-V109 HydrophobicContact CZ3-CB 3.9Å; W53-V109 HydrophobicContact CZ3-CG1 4.15Å; W53-V111 VanDerWaalsContact CD1-CG2 3.43Å; W53-V111 HydrophobicContact CG-CG2 4.17Å
54	Q	95.8	Very high	78.9	Confident	109 Å²	109	80.1 Å²	80.1	51%	0.509	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	137.1	176.5	-176.6	170.9	-15.3	0	0	109.6	E61	Q54-E61 PolarHBondContact N-O 3.26Å; Q54-E61 PolarHBondContact O-N 3.09Å
55	L	95.9	Very high	81.3	Confident	72 Å²	72	76.6 Å²	76.6	38%	0.377	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	129.7	172	-74.8	170	0	0	0	110	W53 L60 F73 P106 V109	W53-L55 HydrophobicContact CE3-CG 4.29Å; W53-L55 HydrophobicContact CZ3-CD1 4Å; W53-L55 HydrophobicContact CZ3-CG 3.88Å; L55-L60 HydrophobicContact CD2-CD1 3.81Å; L55-L60 HydrophobicContact CG-CD1 4.36Å; L55-F73 HydrophobicContact CD2-CE1 3.55Å; L55-F73 HydrophobicContact CD2-CZ 3.59Å; L55-P106 HydrophobicContact CD2-CG 4Å; L55-V109 HydrophobicContact CD1-CG2 3.97Å; L55-V109 HydrophobicContact CD2-CG2 3.97Å; L55-V109 HydrophobicContact CG-CG2 4.27Å
56	H	94.7	Very high	83.7	Confident	60 Å²	60	80.3 Å²	80.3	28%	0.278	43%	0.433	S	S	.	.			trans	-108.5	174.9	170	-64.2	-89.7	0	0	0	110	D58 H59	H56-D58 PolarHBondContact O-N 2.84Å; H56-H59 VanDerWaalsContact CB-CE1 3.47Å; H56-H59 WeakPolarHBondContact CB-CE1 3.42Å; H56-H59 WeakPolarHBondContact CB-O 3.44Å; H56-H59 AromaticContact CD2-CE1 3.83Å; H56-H59 AromaticContact CD2-NE2 3.48Å; H56-H59 PolarHBondContact CD2-NE2 3.11Å; H56-H59 AromaticContact CG-CE1 3.56Å; H56-H59 AromaticContact CG-NE2 3.72Å; H56-H59 PolarHBondContact N-O 3.11Å
57	G	90.9	Very high	86	Confident	53 Å²	53	76.6 Å²	76.6	55%	0.546	41%	0.408	S	S	.	.	S	Bend	trans	-60.3	-30.3	-177.2	0	0	0	0	0	113.5	K105	G57-K105 WeakPolarHBondContact O-CE 3.48Å; G57-K105 PolarHBondContact O-NZ 3.25Å
58	D	91.4	Very high	88.2	Confident	106 Å²	106	69.7 Å²	69.7	57%	0.567	38%	0.377	S	S	*	.	S	Bend	trans	-126.6	-13.3	-169.3	56.6	-13.3	0	0	0	114.1	H56	H56-D58 PolarHBondContact O-N 2.84Å
59	H	96.8	Very high	90.2	Very high	33 Å²	33	65.1 Å²	65.1	15%	0.153	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	165.2	-177.3	68.3	-79.3	0	0	0	114	H56 F71 F73	H56-H59 VanDerWaalsContact CB-CE1 3.47Å; H56-H59 WeakPolarHBondContact CB-CE1 3.42Å; H56-H59 WeakPolarHBondContact CB-O 3.44Å; H56-H59 AromaticContact CD2-CE1 3.83Å; H56-H59 AromaticContact CD2-NE2 3.48Å; H56-H59 PolarHBondContact CD2-NE2 3.11Å; H56-H59 AromaticContact CG-CE1 3.56Å; H56-H59 AromaticContact CG-NE2 3.72Å; H56-H59 PolarHBondContact N-O 3.11Å; H59-F71 CarbonylContact C-O 3.22Å; H59-F71 WeakPolarHBondContact CA-O 3.37Å; H59-F71 WeakPolarHBondContact CB-O 3.17Å; H59-F73 VanDerWaalsContact O-CZ 3.23Å; H59-F73 WeakPolarHBondContact O-CZ 3.5Å
60	L	97.5	Very high	92	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	124.5	164.6	178.9	69.3	0	0	0	109.2	W53 L55 F71 F73 L76 V109 L116 L118	W53-L60 HydrophobicContact CB-CD1 4.25Å; W53-L60 HydrophobicContact CE3-CD1 4.11Å; L55-L60 HydrophobicContact CD2-CD1 3.81Å; L55-L60 HydrophobicContact CG-CD1 4.36Å; L60-F71 PolarHBondContact N-O 3.3Å; L60-F71 PolarHBondContact O-N 2.88Å; L60-F73 HydrophobicContact CB-CE1 3.94Å; L60-L76 HydrophobicContact CB-CD1 4.04Å; L60-L76 HydrophobicContact CD2-CD1 4.09Å; L60-V109 HydrophobicContact CD1-CG1 4.34Å; L60-L116 HydrophobicContact CD2-CD1 4.01Å; L60-L116 HydrophobicContact CD2-CD2 3.6Å; L60-L116 HydrophobicContact CD2-CG 4.47Å; L60-L118 HydrophobicContact CD2-CD2 4.34Å
61	E	97.2	Very high	93.3	Very high	40 Å²	40	58.5 Å²	58.5	19%	0.187	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	126.2	165.7	-171	171.4	98	0	0	108.9	W53 Q54 L68 M69 R70	W53-E61 CarbonylContact C-O 3.52Å; W53-E61 WeakPolarHBondContact CA-O 3.3Å; W53-E61 WeakPolarHBondContact CB-O 3.37Å; Q54-E61 PolarHBondContact N-O 3.26Å; Q54-E61 PolarHBondContact O-N 3.09Å; E61-L68 HydrophobicContact CG-CD1 3.49Å; E61-L68 VanDerWaalsContact CG-CD1 3.49Å; E61-L68 HydrophobicContact CG-CG 4.11Å; E61-M69 WeakPolarHBondContact CA-O 3.43Å; E61-R70 IonicContact OE2-CZ 3.88Å; E61-R70 IonicContact OE2-NE 3.34Å; E61-R70 PolarHBondContact OE2-NE 2.84Å; E61-R70 IonicContact OE2-NH2 3.58Å
62	L	96.1	Very high	93.9	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	120.4	-178.2	179.5	68	0	0	0	109.9	W53 M69 F71 V111 L130 L133	W53-L62 HydrophobicContact CB-CD1 3.87Å; L62-M69 HydrophobicContact CB-CE 4.36Å; L62-M69 HydrophobicContact CD2-CE 3.81Å; L62-M69 HydrophobicContact CG-CE 3.96Å; L62-M69 PolarHBondContact N-O 2.76Å; L62-M69 PolarHBondContact O-N 3.12Å; L62-F71 HydrophobicContact CB-CD2 4.44Å; L62-F71 HydrophobicContact CB-CE2 4.34Å; L62-F71 HydrophobicContact CD2-CE2 4.21Å; L62-V111 HydrophobicContact CD1-CG2 4.47Å; L62-L130 HydrophobicContact CD1-CD2 4.49Å; L62-L130 HydrophobicContact CD2-CD2 3.85Å; L62-L133 HydrophobicContact CD2-CD1 3.59Å
63	R	94.3	Very high	94.2	Very high	107 Å²	107	58.5 Å²	58.5	40%	0.404	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	121.4	169.8	-174.7	175	-61.1	-79	-2.5	109.1	C51 A52 T67 L68	C51-R63 VanDerWaalsContact CA-O 3.3Å; C51-R63 WeakPolarHBondContact CA-O 3.47Å; A52-R63 HydrophobicContact CB-CB 4.43Å; A52-R63 PolarHBondContact N-O 2.79Å; A52-R63 PolarHBondContact O-N 3.29Å; R63-T67 WeakPolarHBondContact CA-O 3.21Å; R63-L68 HydrophobicContact CB-CD1 4.06Å
64	Y	91.9	Very high	94.4	Very high	22 Å²	22	54.5 Å²	54.5	9%	0.086	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	129.8	173.3	-179.7	-111.8	0	0	0	109.4	L49 C51 N66 T67 L130 V134	L49-Y64 HydrophobicContact CB-CE2 4.42Å; L49-Y64 HydrophobicContact CD2-CE2 3.89Å; C51-Y64 HydrophobicContact CB-CD2 4.3Å; Y64-N66 PolarHBondContact O-N 2.75Å; Y64-T67 PolarHBondContact N-O 3.28Å; Y64-T67 PolarHBondContact O-N 3.25Å; Y64-L130 HydrophobicContact CD1-CB 3.85Å; Y64-L130 HydrophobicContact CD2-CB 3.98Å; Y64-L130 HydrophobicContact CD2-CD1 3.53Å; Y64-L130 HydrophobicContact CD2-CG 4.24Å; Y64-L130 HydrophobicContact CE1-CB 3.74Å; Y64-L130 HydrophobicContact CE2-CB 3.87Å; Y64-L130 HydrophobicContact CE2-CD1 3.43Å; Y64-L130 VanDerWaalsContact CE2-CD1 3.43Å; Y64-L130 HydrophobicContact CE2-CG 4.26Å; Y64-L130 HydrophobicContact CG-CB 3.95Å; Y64-L130 HydrophobicContact CG-CD1 4.28Å; Y64-V134 HydrophobicContact CD1-CG2 3.73Å; Y64-V134 HydrophobicContact CE1-CG2 4.47Å
65	A	87.1	Confident	94.4	Very high	54 Å²	54	52.6 Å²	52.6	45%	0.446	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	-122.3	-166	0	0	0	0	0	111
66	N	85.9	Confident	94.5	Very high	161 Å²	161	49.1 Å²	49.1	86%	0.861	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	7.2	-180	-67.2	-27.3	0	0	0	113.6	Y64	Y64-N66 PolarHBondContact O-N 2.75Å
67	T	90.1	Very high	94.6	Very high	41 Å²	41	47.4 Å²	47.4	25%	0.252	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	123.5	-175.5	-48.8	0	0	0	0	110.2	R63 Y64 M69 E139	R63-T67 WeakPolarHBondContact CA-O 3.21Å; Y64-T67 PolarHBondContact N-O 3.28Å; Y64-T67 PolarHBondContact O-N 3.25Å; T67-M69 HydrophobicContact CG2-CG 3.67Å; T67-M69 HydrophobicContact CG2-SD 4.42Å; T67-E139 HydrophobicContact CG2-CB 4.42Å
68	L	94.3	Very high	94.9	Very high	43 Å²	43	45.5 Å²	45.5	23%	0.225	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	120.5	166.3	-175.5	65.6	0	0	0	108	E61 R63 E139	E61-L68 HydrophobicContact CG-CD1 3.49Å; E61-L68 VanDerWaalsContact CG-CD1 3.49Å; E61-L68 HydrophobicContact CG-CG 4.11Å; R63-L68 HydrophobicContact CB-CD1 4.06Å; L68-E139 WeakPolarHBondContact O-CG 3.47Å
69	M	95.5	Very high	95.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	143.2	-175.7	-58.5	170.2	-76.2	0	0	110.1	E61 L62 T67 F71 L133 V134 E139	E61-M69 WeakPolarHBondContact CA-O 3.43Å; L62-M69 HydrophobicContact CB-CE 4.36Å; L62-M69 HydrophobicContact CD2-CE 3.81Å; L62-M69 HydrophobicContact CG-CE 3.96Å; L62-M69 PolarHBondContact N-O 2.76Å; L62-M69 PolarHBondContact O-N 3.12Å; T67-M69 HydrophobicContact CG2-CG 3.67Å; T67-M69 HydrophobicContact CG2-SD 4.42Å; M69-F71 HydrophobicContact CB-CD2 4.16Å; M69-F71 HydrophobicContact CB-CE2 3.4Å; M69-F71 VanDerWaalsContact CB-CE2 3.4Å; M69-F71 HydrophobicContact CB-CZ 3.77Å; M69-F71 HydrophobicContact CE-CE2 4.25Å; M69-F71 HydrophobicContact CG-CE2 4.25Å; M69-F71 HydrophobicContact CG-CZ 4.28Å; M69-F71 HydrophobicContact SD-CE2 3.92Å; M69-F71 HydrophobicContact SD-CZ 3.75Å; M69-L133 HydrophobicContact SD-CB 4.35Å; M69-V134 HydrophobicContact CE-CG2 3.96Å; M69-V134 VanDerWaalsContact SD-CA 3.52Å; M69-V134 HydrophobicContact SD-CB 4.27Å; M69-V134 HydrophobicContact SD-CG2 3.79Å; M69-E139 WeakPolarHBondContact CA-OE2 3.48Å
70	R	96.2	Very high	95.1	Very high	125 Å²	125	41 Å²	41	47%	0.472	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	127.9	172.4	-62.8	-174.3	-172.8	98.3	0.5	110	E61 E139	E61-R70 IonicContact OE2-CZ 3.88Å; E61-R70 IonicContact OE2-NE 3.34Å; E61-R70 PolarHBondContact OE2-NE 2.84Å; E61-R70 IonicContact OE2-NH2 3.58Å; R70-E139 PolarHBondContact N-OE2 3.47Å; R70-E139 IonicContact NH1-OE1 3.86Å
71	F	97.6	Very high	95.1	Very high	5 Å²	5	45.5 Å²	45.5	2%	0.022	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	118.8	-178.6	-64.4	-75.1	0	0	0	110.6	H59 L60 L62 M69 W75 L76 L133	H59-F71 CarbonylContact C-O 3.22Å; H59-F71 WeakPolarHBondContact CA-O 3.37Å; H59-F71 WeakPolarHBondContact CB-O 3.17Å; L60-F71 PolarHBondContact N-O 3.3Å; L60-F71 PolarHBondContact O-N 2.88Å; L62-F71 HydrophobicContact CB-CD2 4.44Å; L62-F71 HydrophobicContact CB-CE2 4.34Å; L62-F71 HydrophobicContact CD2-CE2 4.21Å; M69-F71 HydrophobicContact CB-CD2 4.16Å; M69-F71 HydrophobicContact CB-CE2 3.4Å; M69-F71 VanDerWaalsContact CB-CE2 3.4Å; M69-F71 HydrophobicContact CB-CZ 3.77Å; M69-F71 HydrophobicContact CE-CE2 4.25Å; M69-F71 HydrophobicContact CG-CE2 4.25Å; M69-F71 HydrophobicContact CG-CZ 4.28Å; M69-F71 HydrophobicContact SD-CE2 3.92Å; M69-F71 HydrophobicContact SD-CZ 3.75Å; F71-W75 AromaticContact CD1-CE3 3.78Å; F71-W75 HydrophobicContact CD1-CE3 3.78Å; F71-W75 HydrophobicContact CD1-CH2 4.2Å; F71-W75 AromaticContact CD1-CZ3 3.52Å; F71-W75 HydrophobicContact CD1-CZ3 3.52Å; F71-W75 HydrophobicContact CE1-CE3 4.46Å; F71-W75 HydrophobicContact CE1-CH2 4.07Å; F71-W75 AromaticContact CE1-CZ3 3.78Å; F71-W75 HydrophobicContact CE1-CZ3 3.78Å; F71-L76 HydrophobicContact CB-CD1 3.63Å; F71-L76 HydrophobicContact CB-CD2 3.9Å; F71-L76 HydrophobicContact CB-CG 3.72Å; F71-L76 HydrophobicContact CD1-CD2 4.33Å; F71-L76 HydrophobicContact CG-CD2 4.1Å; F71-L76 HydrophobicContact CG-CG 4.45Å; F71-L133 HydrophobicContact CD1-CD2 4.36Å; F71-L133 HydrophobicContact CE1-CB 4.47Å; F71-L133 HydrophobicContact CE1-CD2 3.84Å; F71-L133 HydrophobicContact CE2-CB 4.11Å; F71-L133 HydrophobicContact CE2-CD1 4.48Å; F71-L133 HydrophobicContact CE2-CD2 4.12Å; F71-L133 HydrophobicContact CE2-CG 4.46Å; F71-L133 HydrophobicContact CZ-CB 3.65Å; F71-L133 HydrophobicContact CZ-CD2 3.71Å; F71-L133 HydrophobicContact CZ-CG 4.19Å
72	D	97.4	Very high	95	Very high	83 Å²	83	45.2 Å²	45.2	44%	0.444	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	140.4	168.4	175.6	-85	0	0	0	110.6	V74 W75 L76	D72-V74 VanDerWaalsContact OD1-CA 3.26Å; D72-V74 WeakPolarHBondContact OD1-CA 3.23Å; D72-V74 WeakPolarHBondContact OD1-CB 3.36Å; D72-V74 PolarHBondContact OD1-N 3.4Å; D72-W75 HydrophobicContact CB-CB 3.98Å; D72-W75 WeakPolarHBondContact O-CB 3.33Å; D72-W75 PolarHBondContact O-N 2.89Å; D72-W75 PolarHBondContact OD1-N 3.04Å; D72-L76 WeakPolarHBondContact O-CG 3.37Å; D72-L76 PolarHBondContact O-N 2.84Å
73	F	97.8	Very high	94.9	Very high	8 Å²	8	49.9 Å²	49.9	4%	0.035	26%	0.258	C	S	.	.	H	α-helix	trans	-68.4	-35.6	-176.8	-63	-51.4	0	0	0	113	L55 H59 L60 W75 L76 R77 I104 K105 P106 W120	L55-F73 HydrophobicContact CD2-CE1 3.55Å; L55-F73 HydrophobicContact CD2-CZ 3.59Å; H59-F73 VanDerWaalsContact O-CZ 3.23Å; H59-F73 WeakPolarHBondContact O-CZ 3.5Å; L60-F73 HydrophobicContact CB-CE1 3.94Å; F73-W75 VanDerWaalsContact C-N 3.34Å; F73-L76 HydrophobicContact CD1-CD1 4.34Å; F73-L76 PolarHBondContact O-N 3.04Å; F73-R77 PolarHBondContact O-N 2.97Å; F73-I104 HydrophobicContact CB-CG2 4.34Å; F73-I104 WeakPolarHBondContact CB-O 3.16Å; F73-K105 HydrophobicContact CD2-CG 4.01Å; F73-K105 HydrophobicContact CE2-CG 4.14Å; F73-P106 VanDerWaalsContact CD1-CD 3.49Å; F73-P106 HydrophobicContact CD1-CG 4.11Å; F73-P106 HydrophobicContact CE1-CG 3.89Å; F73-W120 HydrophobicContact CB-CH2 4.48Å; F73-W120 HydrophobicContact CB-CZ3 4.33Å; F73-W120 WeakPolarHBondContact O-CH2 3.39Å
74	V	97.2	Very high	94.9	Very high	22 Å²	22	48.6 Å²	48.6	13%	0.133	27%	0.265	C	S	.	.	H	α-helix	trans	-63.7	-45.2	173.8	-175.7	0	0	0	0	108.9	D72 L76 R77 D78 V100 L102 I104	D72-V74 VanDerWaalsContact OD1-CA 3.26Å; D72-V74 WeakPolarHBondContact OD1-CA 3.23Å; D72-V74 WeakPolarHBondContact OD1-CB 3.36Å; D72-V74 PolarHBondContact OD1-N 3.4Å; V74-L76 VanDerWaalsContact C-N 3.33Å; V74-L76 PolarHBondContact O-N 3.2Å; V74-R77 PolarHBondContact O-N 2.96Å; V74-R77 VanDerWaalsContact O-N 3.1Å; V74-D78 WeakPolarHBondContact O-CB 3.42Å; V74-D78 PolarHBondContact O-N 3.06Å; V74-V100 HydrophobicContact CG1-CB 4.39Å; V74-V100 HydrophobicContact CG1-CG1 3.85Å; V74-L102 HydrophobicContact CG1-CD2 3.88Å; V74-L102 HydrophobicContact CG2-CB 4.5Å; V74-L102 HydrophobicContact CG2-CD2 4.07Å; V74-I104 HydrophobicContact CG2-CG2 4.27Å
75	W	97.2	Very high	95	Very high	69 Å²	69	47.7 Å²	47.7	26%	0.261	26%	0.262	S	S	.	.	H	α-helix	trans	-57.4	-45.9	175.9	-173.6	95	0	0	0	112	F71 D72 F73 R77 D78 H79 W132 L133 N136	F71-W75 AromaticContact CD1-CE3 3.78Å; F71-W75 HydrophobicContact CD1-CE3 3.78Å; F71-W75 HydrophobicContact CD1-CH2 4.2Å; F71-W75 AromaticContact CD1-CZ3 3.52Å; F71-W75 HydrophobicContact CD1-CZ3 3.52Å; F71-W75 HydrophobicContact CE1-CE3 4.46Å; F71-W75 HydrophobicContact CE1-CH2 4.07Å; F71-W75 AromaticContact CE1-CZ3 3.78Å; F71-W75 HydrophobicContact CE1-CZ3 3.78Å; D72-W75 HydrophobicContact CB-CB 3.98Å; D72-W75 WeakPolarHBondContact O-CB 3.33Å; D72-W75 PolarHBondContact O-N 2.89Å; D72-W75 PolarHBondContact OD1-N 3.04Å; F73-W75 VanDerWaalsContact C-N 3.34Å; W75-R77 VanDerWaalsContact C-N 3.3Å; W75-R77 PolarHBondContact O-N 3.24Å; W75-D78 PolarHBondContact O-N 2.98Å; W75-H79 AromaticContact CD1-CE1 3.48Å; W75-H79 VanDerWaalsContact CD1-CE1 3.48Å; W75-H79 AromaticContact CD1-ND1 3.54Å; W75-H79 AromaticContact CD2-ND1 3.75Å; W75-H79 AromaticContact CE2-CE1 3.98Å; W75-H79 AromaticContact CE2-CG 3.96Å; W75-H79 AromaticContact CE2-ND1 3.64Å; W75-H79 AromaticContact CG-ND1 3.69Å; W75-H79 AromaticContact NE1-CE1 3.38Å; W75-H79 PolarHBondContact NE1-CE1 3.39Å; W75-H79 AromaticContact NE1-ND1 3.49Å; W75-H79 PolarHBondContact NE1-ND1 3.27Å; W75-H79 AromaticContact NE1-NE2 3.93Å; W75-H79 WeakPolarHBondContact O-CB 3.43Å; W75-H79 PolarHBondContact O-N 3.15Å; W75-H79 PolarHBondContact O-ND1 2.92Å; W75-W132 AromaticContact CH2-CH2 3.66Å; W75-W132 HydrophobicContact CH2-CH2 3.66Å; W75-W132 AromaticContact CH2-CZ3 3.58Å; W75-W132 HydrophobicContact CH2-CZ3 3.58Å; W75-W132 HydrophobicContact CZ2-CH2 4.27Å; W75-W132 HydrophobicContact CZ3-CH2 4.39Å; W75-W132 HydrophobicContact CZ3-CZ3 4.06Å; W75-L133 HydrophobicContact CZ3-CD2 4.29Å; W75-N136 HydrophobicContact CH2-CB 4.08Å; W75-N136 HydrophobicContact CZ2-CB 4.23Å
76	L	97.5	Very high	95.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.8	-32.9	176.7	-73.3	166.7	0	0	0	112.7	L60 F71 D72 F73 V74 L116 L118 W120 Y128 L133	L60-L76 HydrophobicContact CB-CD1 4.04Å; L60-L76 HydrophobicContact CD2-CD1 4.09Å; F71-L76 HydrophobicContact CB-CD1 3.63Å; F71-L76 HydrophobicContact CB-CD2 3.9Å; F71-L76 HydrophobicContact CB-CG 3.72Å; F71-L76 HydrophobicContact CD1-CD2 4.33Å; F71-L76 HydrophobicContact CG-CD2 4.1Å; F71-L76 HydrophobicContact CG-CG 4.45Å; D72-L76 WeakPolarHBondContact O-CG 3.37Å; D72-L76 PolarHBondContact O-N 2.84Å; F73-L76 HydrophobicContact CD1-CD1 4.34Å; F73-L76 PolarHBondContact O-N 3.04Å; V74-L76 VanDerWaalsContact C-N 3.33Å; V74-L76 PolarHBondContact O-N 3.2Å; L76-L116 HydrophobicContact CD2-CD2 4.48Å; L76-L118 HydrophobicContact CB-CD1 3.79Å; L76-L118 HydrophobicContact CD1-CD1 3.79Å; L76-L118 HydrophobicContact CD2-CD1 4.05Å; L76-L118 HydrophobicContact CG-CD1 4.09Å; L76-W120 HydrophobicContact CB-CH2 3.95Å; L76-W120 HydrophobicContact CB-CZ2 4.06Å; L76-Y128 HydrophobicContact CB-CE2 4.28Å; L76-Y128 HydrophobicContact CD2-CD2 3.93Å; L76-Y128 HydrophobicContact CD2-CE2 3.58Å; L76-Y128 WeakPolarHBondContact O-CE2 3.3Å; L76-Y128 PolarHBondContact O-OH 3.31Å; L76-L133 HydrophobicContact CD2-CD2 4.24Å
77	R	97.3	Very high	96	Very high	24 Å²	24	41.6 Å²	41.6	9%	0.091	22%	0.22	C	C	.	.	H	α-helix	trans	-77.4	-39.6	176	-178.7	62.8	-178.1	79	0	112.1	F73 V74 W75 C80 L95 V100 I104 W120 D122	F73-R77 PolarHBondContact O-N 2.97Å; V74-R77 PolarHBondContact O-N 2.96Å; V74-R77 VanDerWaalsContact O-N 3.1Å; W75-R77 VanDerWaalsContact C-N 3.3Å; W75-R77 PolarHBondContact O-N 3.24Å; R77-C80 WeakPolarHBondContact O-CB 3.41Å; R77-L95 WeakPolarHBondContact O-CD2 3.43Å; R77-V100 HydrophobicContact CB-CG1 3.95Å; R77-V100 HydrophobicContact CG-CG1 3.7Å; R77-V100 HydrophobicContact CG-CG2 4.13Å; R77-I104 HydrophobicContact CB-CD1 4.26Å; R77-I104 HydrophobicContact CB-CG2 4.42Å; R77-I104 HydrophobicContact CG-CD1 3.81Å; R77-W120 HydrophobicContact CB-CH2 4.03Å; R77-W120 HydrophobicContact CB-CZ2 3.81Å; R77-W120 HydrophobicContact CB-CZ3 4.5Å; R77-D122 IonicContact NH2-OD2 3.15Å
78	D	96.9	Very high	96.3	Very high	12 Å²	12	44.5 Å²	44.5	6%	0.064	24%	0.238	C	C	.	.	H	α-helix	trans	-68.7	-37.7	-176.3	-174.2	52.3	0	0	0	112.3	V74 W75 C80 R93 T97	V74-D78 WeakPolarHBondContact O-CB 3.42Å; V74-D78 PolarHBondContact O-N 3.06Å; W75-D78 PolarHBondContact O-N 2.98Å; D78-C80 VanDerWaalsContact C-N 3.29Å; D78-C80 PolarHBondContact O-N 2.96Å; D78-R93 IonicContact OD1-CZ 2.87Å; D78-R93 IonicContact OD1-NH1 3.42Å; D78-R93 IonicContact OD1-NH2 3.77Å; D78-R93 IonicContact OD2-CZ 3.54Å; D78-R93 IonicContact OD2-NH1 3.73Å; D78-R93 PolarHBondContact OD2-NH1 2.79Å; D78-T97 WeakPolarHBondContact OD1-CA 3.4Å; D78-T97 VanDerWaalsContact OD1-CB 3.28Å; D78-T97 WeakPolarHBondContact OD1-CB 3.42Å; D78-T97 WeakPolarHBondContact OD1-CG2 3.34Å; D78-T97 PolarHBondContact OD1-OG1 3.47Å
79	H	96.6	Very high	96.3	Very high	43 Å²	43	51.7 Å²	51.7	20%	0.199	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	14.2	-177.6	-65.7	80.5	0	0	0	114	W75 R81 Y128 W132	W75-H79 AromaticContact CD1-CE1 3.48Å; W75-H79 VanDerWaalsContact CD1-CE1 3.48Å; W75-H79 AromaticContact CD1-ND1 3.54Å; W75-H79 AromaticContact CD2-ND1 3.75Å; W75-H79 AromaticContact CE2-CE1 3.98Å; W75-H79 AromaticContact CE2-CG 3.96Å; W75-H79 AromaticContact CE2-ND1 3.64Å; W75-H79 AromaticContact CG-ND1 3.69Å; W75-H79 AromaticContact NE1-CE1 3.38Å; W75-H79 PolarHBondContact NE1-CE1 3.39Å; W75-H79 AromaticContact NE1-ND1 3.49Å; W75-H79 PolarHBondContact NE1-ND1 3.27Å; W75-H79 AromaticContact NE1-NE2 3.93Å; W75-H79 WeakPolarHBondContact O-CB 3.43Å; W75-H79 PolarHBondContact O-N 3.15Å; W75-H79 PolarHBondContact O-ND1 2.92Å; H79-R81 PolarHBondContact O-N 3.14Å; H79-Y128 WeakPolarHBondContact O-CE1 3.44Å; H79-Y128 PolarHBondContact O-OH 3.33Å; H79-Y128 VanDerWaalsContact O-OH 3.13Å; H79-W132 HydrophobicContact CB-CH2 4.21Å
80	C	96.7	Very high	96.3	Very high	3 Å²	3	54.8 Å²	54.8	2%	0.02	29%	0.287	C	S	.	.			trans	-56.7	131.8	-178.9	-179.5	0	0	0	0	111.1	R77 D78 S82 C85 H124 T126 Y128	R77-C80 WeakPolarHBondContact O-CB 3.41Å; D78-C80 VanDerWaalsContact C-N 3.29Å; D78-C80 PolarHBondContact O-N 2.96Å; C80-S82 PolarHBondContact SG-OG 3.29Å; C80-C85 HydrophobicContact CB-CB 3.8Å; C80-C85 VanDerWaalsContact O-CB 3.23Å; C80-C85 WeakPolarHBondContact O-CB 3.18Å; C80-H124 PolarHBondContact SG-NE2 3.17Å; C80-T126 HydrophobicContact CB-CG2 3.9Å; C80-T126 PolarHBondContact SG-OG1 2.84Å; C80-Y128 WeakPolarHBondContact CA-OH 3.08Å; C80-Y128 PolarHBondContact N-OH 2.96Å
81	R	95.7	Very high	96.3	Very high	94 Å²	94	54.2 Å²	54.2	36%	0.355	29%	0.293	S	S	.	.			trans	-99.6	16.5	-178.4	-58.4	-60.4	-178.6	142	-2.5	114.2	H79 Y86	H79-R81 PolarHBondContact O-N 3.14Å; R81-Y86 PolarHBondContact NH1-OH 3.35Å
82	S	95	Very high	96.2	Very high	34 Å²	34	59.9 Å²	59.9	24%	0.238	32%	0.319	C	S	.	.	S	Bend	trans	-68.5	158.2	172.6	69.1	0	0	0	0	111	C80 S84 C85 Y86 H124	C80-S82 PolarHBondContact SG-OG 3.29Å; S82-S84 PolarHBondContact O-N 2.99Å; S82-S84 VanDerWaalsContact O-N 3.12Å; S82-S84 PolarHBondContact OG-OG 2.56Å; S82-C85 PolarHBondContact O-N 3.16Å; S82-C85 PolarHBondContact OG-SG 3.3Å; S82-Y86 PolarHBondContact O-N 3.14Å; S82-H124 PolarHBondContact OG-CE1 2.82Å; S82-H124 VanDerWaalsContact OG-CE1 3.23Å; S82-H124 PolarHBondContact OG-NE2 2.95Å
83	A	94.5	Very high	96.1	Very high	97 Å²	97	61.6 Å²	61.6	80%	0.802	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-25.5	-176.9	0	0	0	0	0	114.2
84	S	94	Very high	96	Very high	81 Å²	81	64.5 Å²	64.5	57%	0.566	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-20.9	175.3	63.1	0	0	0	0	113.4	S82 H124	S82-S84 PolarHBondContact O-N 2.99Å; S82-S84 VanDerWaalsContact O-N 3.12Å; S82-S84 PolarHBondContact OG-OG 2.56Å; S84-H124 PolarHBondContact OG-CE1 2.91Å
85	C	95.7	Very high	95.9	Very high	2 Å²	2	64.6 Å²	64.6	1%	0.014	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-19.5	-175.9	-59.7	0	0	0	0	112.9	C80 S82 S94 L95	C80-C85 HydrophobicContact CB-CB 3.8Å; C80-C85 VanDerWaalsContact O-CB 3.23Å; C80-C85 WeakPolarHBondContact O-CB 3.18Å; S82-C85 PolarHBondContact O-N 3.16Å; S82-C85 PolarHBondContact OG-SG 3.3Å; C85-S94 PolarHBondContact O-N 3.37Å; C85-L95 HydrophobicContact CB-CB 4.12Å; C85-L95 PolarHBondContact O-N 2.99Å
86	Y	96.9	Very high	95.8	Very high	26 Å²	26	66 Å²	66	10%	0.102	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	129.8	-175.5	-174.7	-100.8	0	0	0	111.9	R81 S82 T88 N91 Q92 R93	R81-Y86 PolarHBondContact NH1-OH 3.35Å; S82-Y86 PolarHBondContact O-N 3.14Å; Y86-T88 HydrophobicContact CD1-CG2 3.84Å; Y86-T88 HydrophobicContact CE1-CG2 4.11Å; Y86-T88 PolarHBondContact O-N 3.35Å; Y86-N91 VanDerWaalsContact CE2-C 3.43Å; Y86-N91 WeakPolarHBondContact CE2-O 3.42Å; Y86-N91 VanDerWaalsContact CZ-C 3.42Å; Y86-N91 VanDerWaalsContact CZ-CA 3.41Å; Y86-N91 VanDerWaalsContact OH-C 3.31Å; Y86-N91 WeakPolarHBondContact OH-CA 3.46Å; Y86-N91 WeakPolarHBondContact OH-CB 3.5Å; Y86-N91 PolarHBondContact OH-O 2.88Å; Y86-N91 PolarHBondContact OH-OD1 3.02Å; Y86-Q92 VanDerWaalsContact CD2-O 3.22Å; Y86-Q92 WeakPolarHBondContact CD2-O 3.46Å; Y86-R93 HydrophobicContact CD2-CG 4.44Å
87	N	96.3	Very high	95.7	Very high	61 Å²	61	68.5 Å²	68.5	33%	0.326	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	104.2	173.6	-174.4	-22.1	0	0	0	109.9	K89 T90 N91 Q92	N87-K89 PolarHBondContact O-N 2.62Å; N87-K89 WeakPolarHBondContact OD1-CB 3.39Å; N87-K89 PolarHBondContact OD1-N 3.14Å; N87-T90 WeakPolarHBondContact CB-OG1 3.42Å; N87-T90 PolarHBondContact ND2-OG1 2.9Å; N87-T90 PolarHBondContact O-N 3.25Å; N87-T90 PolarHBondContact OD1-N 2.96Å; N87-N91 WeakPolarHBondContact O-CA 3.34Å; N87-N91 PolarHBondContact O-N 3.2Å; N87-Q92 PolarHBondContact N-O 3.3Å; N87-Q92 PolarHBondContact O-N 3.25Å
88	T	95.2	Very high	95.6	Very high	103 Å²	103	71.7 Å²	71.7	63%	0.632	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-16.8	-179.8	54.3	0	0	0	0	114.1	Y86	Y86-T88 HydrophobicContact CD1-CG2 3.84Å; Y86-T88 HydrophobicContact CE1-CG2 4.11Å; Y86-T88 PolarHBondContact O-N 3.35Å
89	K	95.8	Very high	95.5	Very high	193 Å²	193	74.9 Å²	74.9	84%	0.839	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-37.6	176.3	-62.2	-176.5	178.4	-179.2	0	112.1	N87	N87-K89 PolarHBondContact O-N 2.62Å; N87-K89 WeakPolarHBondContact OD1-CB 3.39Å; N87-K89 PolarHBondContact OD1-N 3.14Å
90	T	95.6	Very high	95.5	Very high	66 Å²	66	73.3 Å²	73.3	41%	0.405	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-8.3	-178.5	64.1	0	0	0	0	113.3	N87 Q92	N87-T90 WeakPolarHBondContact CB-OG1 3.42Å; N87-T90 PolarHBondContact ND2-OG1 2.9Å; N87-T90 PolarHBondContact O-N 3.25Å; N87-T90 PolarHBondContact OD1-N 2.96Å; T90-Q92 PolarHBondContact O-N 2.74Å; T90-Q92 WeakPolarHBondContact OG1-CB 3.36Å; T90-Q92 PolarHBondContact OG1-OE1 2.91Å; T90-Q92 VanDerWaalsContact OG1-OE1 3.11Å
91	N	95.1	Very high	95.4	Very high	112 Å²	112	78.3 Å²	78.3	60%	0.599	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	31.4	-171.9	-66.9	-55.2	0	0	0	114.7	Y86 N87	Y86-N91 VanDerWaalsContact CE2-C 3.43Å; Y86-N91 WeakPolarHBondContact CE2-O 3.42Å; Y86-N91 VanDerWaalsContact CZ-C 3.42Å; Y86-N91 VanDerWaalsContact CZ-CA 3.41Å; Y86-N91 VanDerWaalsContact OH-C 3.31Å; Y86-N91 WeakPolarHBondContact OH-CA 3.46Å; Y86-N91 WeakPolarHBondContact OH-CB 3.5Å; Y86-N91 PolarHBondContact OH-O 2.88Å; Y86-N91 PolarHBondContact OH-OD1 3.02Å; N87-N91 WeakPolarHBondContact O-CA 3.34Å; N87-N91 PolarHBondContact O-N 3.2Å
92	Q	96.3	Very high	95.4	Very high	124 Å²	124	80.7 Å²	80.7	58%	0.579	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.4	147.4	-177.7	-67.6	168.3	-26.7	0	0	111.5	Y86 N87 T90	Y86-Q92 VanDerWaalsContact CD2-O 3.22Å; Y86-Q92 WeakPolarHBondContact CD2-O 3.46Å; N87-Q92 PolarHBondContact N-O 3.3Å; N87-Q92 PolarHBondContact O-N 3.25Å; T90-Q92 PolarHBondContact O-N 2.74Å; T90-Q92 WeakPolarHBondContact OG1-CB 3.36Å; T90-Q92 PolarHBondContact OG1-OE1 2.91Å; T90-Q92 VanDerWaalsContact OG1-OE1 3.11Å
93	R	95.4	Very high	95.5	Very high	119 Å²	119	81.4 Å²	81.4	45%	0.449	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	141.4	171	-54.3	-170.9	-41.5	171.4	19.3	109.6	D78 Y86 T97	D78-R93 IonicContact OD1-CZ 2.87Å; D78-R93 IonicContact OD1-NH1 3.42Å; D78-R93 IonicContact OD1-NH2 3.77Å; D78-R93 IonicContact OD2-CZ 3.54Å; D78-R93 IonicContact OD2-NH1 3.73Å; D78-R93 PolarHBondContact OD2-NH1 2.79Å; Y86-R93 HydrophobicContact CD2-CG 4.44Å; R93-T97 PolarHBondContact NH2-OG1 3.25Å
94	S	95.9	Very high	95.6	Very high	69 Å²	69	77.5 Å²	77.5	48%	0.483	44%	0.44	S	S	.	.			trans	-110.3	-22.1	176.1	-51.7	0	0	0	0	112.3	C85	C85-S94 PolarHBondContact O-N 3.37Å
95	L	94.6	Very high	95.7	Very high	25 Å²	25	79 Å²	79	13%	0.131	44%	0.436	C	S	.	.	S	Bend	trans	-69.9	131	177.6	-177.8	71.7	0	0	0	110.2	R77 C85 T97 V100	R77-L95 WeakPolarHBondContact O-CD2 3.43Å; C85-L95 HydrophobicContact CB-CB 4.12Å; C85-L95 PolarHBondContact O-N 2.99Å; L95-T97 PolarHBondContact O-N 3.43Å; L95-V100 HydrophobicContact CD2-CG2 3.79Å; L95-V100 HydrophobicContact CG-CG2 4.31Å
96	D	94.6	Very high	95.8	Very high	99 Å²	99	79.6 Å²	79.6	53%	0.529	44%	0.44	S	S	.	.			trans	-74.5	110.6	167.1	175.1	14	0	0	0	109.5	A98 S99	D96-A98 PolarHBondContact O-N 3.04Å; D96-A98 WeakPolarHBondContact OD1-CB 3.49Å; D96-A98 PolarHBondContact OD1-N 2.86Å; D96-S99 WeakPolarHBondContact O-CB 3.43Å; D96-S99 PolarHBondContact O-N 3.24Å; D96-S99 PolarHBondContact O-OG 2.85Å
97	T	95.1	Very high	95.8	Very high	51 Å²	51	85.7 Å²	85.7	31%	0.313	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-55.6	-36.9	178.6	-58.3	0	0	0	0	112.4	D78 R93 L95 S99 V100	D78-T97 WeakPolarHBondContact OD1-CA 3.4Å; D78-T97 VanDerWaalsContact OD1-CB 3.28Å; D78-T97 WeakPolarHBondContact OD1-CB 3.42Å; D78-T97 WeakPolarHBondContact OD1-CG2 3.34Å; D78-T97 PolarHBondContact OD1-OG1 3.47Å; R93-T97 PolarHBondContact NH2-OG1 3.25Å; L95-T97 PolarHBondContact O-N 3.43Å; T97-S99 PolarHBondContact O-N 3.12Å; T97-V100 WeakPolarHBondContact O-CB 3.12Å; T97-V100 PolarHBondContact O-N 3.07Å; T97-V100 VanDerWaalsContact O-N 3.11Å
98	A	95.8	Very high	95.9	Very high	91 Å²	91	85.1 Å²	85.1	75%	0.752	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-69.2	-20.1	-178.3	0	0	0	0	0	112.7	D96 V100	D96-A98 PolarHBondContact O-N 3.04Å; D96-A98 WeakPolarHBondContact OD1-CB 3.49Å; D96-A98 PolarHBondContact OD1-N 2.86Å; A98-V100 VanDerWaalsContact C-N 3.3Å
99	S	94.6	Very high	95.9	Very high	79 Å²	79	81.1 Å²	81.1	55%	0.552	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-78.7	-12.8	175.1	77	0	0	0	0	113.6	D96 T97 D101	D96-S99 WeakPolarHBondContact O-CB 3.43Å; D96-S99 PolarHBondContact O-N 3.24Å; D96-S99 PolarHBondContact O-OG 2.85Å; T97-S99 PolarHBondContact O-N 3.12Å; S99-D101 PolarHBondContact O-N 3.39Å
100	V	96	Very high	95.9	Very high	11 Å²	11	77.9 Å²	77.9	7%	0.067	43%	0.429	C	S	.	.	S	Bend	trans	-75.7	122.1	178.2	-177.7	0	0	0	0	109.2	V74 R77 L95 T97 A98 L102 I104	V74-V100 HydrophobicContact CG1-CB 4.39Å; V74-V100 HydrophobicContact CG1-CG1 3.85Å; R77-V100 HydrophobicContact CB-CG1 3.95Å; R77-V100 HydrophobicContact CG-CG1 3.7Å; R77-V100 HydrophobicContact CG-CG2 4.13Å; L95-V100 HydrophobicContact CD2-CG2 3.79Å; L95-V100 HydrophobicContact CG-CG2 4.31Å; T97-V100 WeakPolarHBondContact O-CB 3.12Å; T97-V100 PolarHBondContact O-N 3.07Å; T97-V100 VanDerWaalsContact O-N 3.11Å; A98-V100 VanDerWaalsContact C-N 3.3Å; V100-L102 PolarHBondContact O-N 2.89Å; V100-I104 HydrophobicContact CG1-CG2 4.18Å
101	D	95.8	Very high	95.9	Very high	107 Å²	107	76.3 Å²	76.3	57%	0.572	42%	0.419	S	S	*	.			trans	-59.3	121.6	171.8	176.7	9.8	0	0	0	110.4	S99 G103 I104	S99-D101 PolarHBondContact O-N 3.39Å; D101-G103 PolarHBondContact O-N 2.79Å; D101-G103 PolarHBondContact OD1-N 3.03Å; D101-I104 HydrophobicContact CB-CB 4.29Å; D101-I104 WeakPolarHBondContact O-CB 3.26Å; D101-I104 WeakPolarHBondContact O-CG2 3.16Å; D101-I104 PolarHBondContact O-N 2.98Å
102	L	96.2	Very high	95.7	Very high	145 Å²	145	73.8 Å²	73.8	76%	0.759	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-15.2	179.9	-60.1	-177.4	0	0	0	113.1	V74 V100	V74-L102 HydrophobicContact CG1-CD2 3.88Å; V74-L102 HydrophobicContact CG2-CB 4.5Å; V74-L102 HydrophobicContact CG2-CD2 4.07Å; V100-L102 PolarHBondContact O-N 2.89Å
103	G	95.9	Very high	95.2	Very high	48 Å²	48	75.5 Å²	75.5	50%	0.495	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	5.1	171	0	0	0	0	0	114.2	D101 K105	D101-G103 PolarHBondContact O-N 2.79Å; D101-G103 PolarHBondContact OD1-N 3.03Å; G103-K105 PolarHBondContact O-N 3.47Å
104	I	96.5	Very high	95.1	Very high	16 Å²	16	73.9 Å²	73.9	8%	0.082	42%	0.417	C	S	.	.			trans	-59.6	135.8	-172.6	-162.8	175.2	0	0	0	111.9	F73 V74 R77 V100 D101 W120 P121	F73-I104 HydrophobicContact CB-CG2 4.34Å; F73-I104 WeakPolarHBondContact CB-O 3.16Å; V74-I104 HydrophobicContact CG2-CG2 4.27Å; R77-I104 HydrophobicContact CB-CD1 4.26Å; R77-I104 HydrophobicContact CB-CG2 4.42Å; R77-I104 HydrophobicContact CG-CD1 3.81Å; V100-I104 HydrophobicContact CG1-CG2 4.18Å; D101-I104 HydrophobicContact CB-CB 4.29Å; D101-I104 WeakPolarHBondContact O-CB 3.26Å; D101-I104 WeakPolarHBondContact O-CG2 3.16Å; D101-I104 PolarHBondContact O-N 2.98Å; I104-W120 HydrophobicContact CD1-CB 4.34Å; I104-W120 HydrophobicContact CD1-CD2 3.95Å; I104-W120 HydrophobicContact CD1-CE3 3.57Å; I104-W120 HydrophobicContact CD1-CG 4.29Å; I104-W120 HydrophobicContact CD1-CZ3 4.17Å; I104-W120 HydrophobicContact CG1-CE3 3.69Å; I104-W120 HydrophobicContact CG1-CZ3 4.1Å; I104-W120 HydrophobicContact CG2-CZ3 4.31Å; I104-P121 HydrophobicContact CG1-CG 4.3Å
105	K	97.4	Very high	95.2	Very high	111 Å²	111	71.7 Å²	71.7	48%	0.483	40%	0.401	S	S	.	.			trans	-134.4	143	173.6	-59.9	-176.1	-168.2	-168	0	109.9	G57 F73 G103 K107 P121	G57-K105 WeakPolarHBondContact O-CE 3.48Å; G57-K105 PolarHBondContact O-NZ 3.25Å; F73-K105 HydrophobicContact CD2-CG 4.01Å; F73-K105 HydrophobicContact CE2-CG 4.14Å; G103-K105 PolarHBondContact O-N 3.47Å; K105-K107 PolarHBondContact O-N 3.3Å; K105-P121 WeakPolarHBondContact O-CD 3.4Å; K105-P121 WeakPolarHBondContact O-CG 3.15Å
106	P	97.3	Very high	95.3	Very high	15 Å²	15	70.5 Å²	70.5	10%	0.097	40%	0.395	C	S	.	.			trans	-65.2	134.1	174.8	28.2	-33.7	0	0	0	110	L55 F73 A108 V109 L118 T119 W120	L55-P106 HydrophobicContact CD2-CG 4Å; F73-P106 VanDerWaalsContact CD1-CD 3.49Å; F73-P106 HydrophobicContact CD1-CG 4.11Å; F73-P106 HydrophobicContact CE1-CG 3.89Å; P106-A108 VanDerWaalsContact C-N 3.31Å; P106-V109 HydrophobicContact CB-CG2 3.9Å; P106-V109 HydrophobicContact CG-CG2 3.67Å; P106-L118 HydrophobicContact CB-CB 4.46Å; P106-L118 HydrophobicContact CB-CD2 4.19Å; P106-L118 HydrophobicContact CG-CD2 4.32Å; P106-T119 CarbonylContact C-O 3.58Å; P106-T119 WeakPolarHBondContact CA-O 3.46Å; P106-W120 HydrophobicContact CB-CE3 4.3Å; P106-W120 HydrophobicContact CB-CZ3 4.23Å
107	K	97.3	Very high	95.5	Very high	154 Å²	154	66.7 Å²	66.7	67%	0.67	37%	0.374	S	S	*	.	S	Bend	trans	-69.7	-31.3	168.2	-78.1	-177.8	169.4	165.1	0	111.8	K105 T119 P121	K105-K107 PolarHBondContact O-N 3.3Å; K107-T119 PolarHBondContact N-O 3.04Å; K107-P121 PolarHBondContact NZ-O 3.23Å
108	A	96.8	Very high	95.6	Very high	49 Å²	49	64.3 Å²	64.3	41%	0.405	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	144	177	0	0	0	0	0	110.8	P106 T119	P106-A108 VanDerWaalsContact C-N 3.31Å; A108-T119 PolarHBondContact N-O 2.96Å; A108-T119 PolarHBondContact O-N 3.13Å
109	V	96.9	Very high	95.7	Very high	19 Å²	19	62.2 Å²	62.2	12%	0.115	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	131.4	172.7	-178.4	0	0	0	0	108.1	W53 L55 L60 P106 L116 F117 L118	W53-V109 HydrophobicContact CD2-CG1 3.94Å; W53-V109 HydrophobicContact CE3-CB 4.27Å; W53-V109 HydrophobicContact CE3-CG1 3.99Å; W53-V109 HydrophobicContact CH2-CB 3.82Å; W53-V109 HydrophobicContact CH2-CG1 4.22Å; W53-V109 HydrophobicContact CZ2-CB 4.11Å; W53-V109 HydrophobicContact CZ2-CG1 4.15Å; W53-V109 WeakPolarHBondContact CZ2-O 3.16Å; W53-V109 HydrophobicContact CZ3-CB 3.9Å; W53-V109 HydrophobicContact CZ3-CG1 4.15Å; L55-V109 HydrophobicContact CD1-CG2 3.97Å; L55-V109 HydrophobicContact CD2-CG2 3.97Å; L55-V109 HydrophobicContact CG-CG2 4.27Å; L60-V109 HydrophobicContact CD1-CG1 4.34Å; P106-V109 HydrophobicContact CB-CG2 3.9Å; P106-V109 HydrophobicContact CG-CG2 3.67Å; V109-L116 HydrophobicContact CG1-CD1 3.68Å; V109-F117 WeakPolarHBondContact CA-O 3.42Å; V109-L118 HydrophobicContact CB-CD2 4.29Å; V109-L118 HydrophobicContact CG1-CD2 3.98Å; V109-L118 HydrophobicContact CG2-CD2 3.63Å
110	R	95.2	Very high	95.8	Very high	126 Å²	126	58.4 Å²	58.4	48%	0.475	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	140.8	173.4	-176.6	-179.6	66.1	75	-1.1	108.5	D112 F117	R110-D112 IonicContact NH1-OD2 3.3Å; R110-F117 HydrophobicContact CB-CB 4.3Å; R110-F117 PolarHBondContact N-O 3.36Å; R110-F117 VanDerWaalsContact NH2-CD1 3.32Å; R110-F117 VanDerWaalsContact NH2-CD2 3.25Å; R110-F117 WeakPolarHBondContact O-CA 3.47Å; R110-F117 WeakPolarHBondContact O-CB 3.46Å; R110-F117 PolarHBondContact O-N 2.83Å
111	V	94.4	Very high	95.9	Very high	33 Å²	33	60.8 Å²	60.8	20%	0.2	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	135.5	172.6	-176	0	0	0	0	107.9	C51 W53 L62 T115 L116 L130	C51-V111 HydrophobicContact CB-CG1 4.37Å; C51-V111 WeakPolarHBondContact SG-CG1 3.49Å; W53-V111 VanDerWaalsContact CD1-CG2 3.43Å; W53-V111 HydrophobicContact CG-CG2 4.17Å; L62-V111 HydrophobicContact CD1-CG2 4.47Å; V111-T115 WeakPolarHBondContact CA-O 3.33Å; V111-L116 HydrophobicContact CG2-CB 4.47Å; V111-L116 HydrophobicContact CG2-CD1 3.49Å; V111-L116 VanDerWaalsContact CG2-CD1 3.49Å; V111-L130 HydrophobicContact CG1-CD1 4.17Å; V111-L130 HydrophobicContact CG1-CD2 4.16Å
112	D	91.4	Very high	95.8	Very high	59 Å²	59	60.8 Å²	60.8	32%	0.316	33%	0.326	S	S	.	.			trans	-108.2	-165.5	163.8	63.3	34.1	0	0	0	110.3	R110 T114 T115 F117	R110-D112 IonicContact NH1-OD2 3.3Å; D112-T114 PolarHBondContact O-N 2.79Å; D112-T114 VanDerWaalsContact O-N 3.15Å; D112-T114 PolarHBondContact OD1-N 3.37Å; D112-T114 VanDerWaalsContact OD1-N 3.1Å; D112-T115 PolarHBondContact N-O 3.44Å; D112-T115 WeakPolarHBondContact OD1-CA 3.42Å; D112-T115 WeakPolarHBondContact OD1-CB 3.43Å; D112-T115 PolarHBondContact OD1-N 3.48Å; D112-F117 WeakPolarHBondContact OD2-CE2 3.35Å; D112-F117 WeakPolarHBondContact OD2-CZ 3.49Å
113	E	87	Confident	95.8	Very high	159 Å²	159	56.2 Å²	56.2	74%	0.743	31%	0.314	S	S	*	.	S	Bend	trans	-58.4	-29.4	-174.4	-62.4	-178.8	177.1	0	0	113.8
114	T	93.3	Very high	95.8	Very high	85 Å²	85	55.7 Å²	55.7	52%	0.521	30%	0.298	S	S	.	.	S	Bend	trans	-132.6	-11.4	-171	60.8	0	0	0	0	114	D112 G129 L130	D112-T114 PolarHBondContact O-N 2.79Å; D112-T114 VanDerWaalsContact O-N 3.15Å; D112-T114 PolarHBondContact OD1-N 3.37Å; D112-T114 VanDerWaalsContact OD1-N 3.1Å; T114-G129 CarbonylContact O-C 3.6Å; T114-G129 WeakPolarHBondContact O-CA 3.36Å; T114-L130 WeakPolarHBondContact O-CG 3.24Å; T114-L130 PolarHBondContact O-N 3.21Å
115	T	96.6	Very high	95.9	Very high	23 Å²	23	58.1 Å²	58.1	14%	0.141	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	132.8	-168	-55.3	0	0	0	0	112.6	V111 D112 F117 R127 Y128	V111-T115 WeakPolarHBondContact CA-O 3.33Å; D112-T115 PolarHBondContact N-O 3.44Å; D112-T115 WeakPolarHBondContact OD1-CA 3.42Å; D112-T115 WeakPolarHBondContact OD1-CB 3.43Å; D112-T115 PolarHBondContact OD1-N 3.48Å; T115-F117 HydrophobicContact CG2-CD2 4.02Å; T115-F117 HydrophobicContact CG2-CE1 4.2Å; T115-F117 HydrophobicContact CG2-CE2 3.43Å; T115-F117 VanDerWaalsContact CG2-CE2 3.43Å; T115-F117 HydrophobicContact CG2-CZ 3.54Å; T115-F117 WeakPolarHBondContact O-CD2 3.42Å; T115-F117 WeakPolarHBondContact O-CE2 3.25Å; T115-R127 HydrophobicContact CG2-CB 4.26Å; T115-Y128 CarbonylContact C-O 3.56Å; T115-Y128 VanDerWaalsContact CA-O 3.3Å; T115-Y128 WeakPolarHBondContact CA-O 3.34Å; T115-Y128 WeakPolarHBondContact CG2-O 3.5Å
116	L	97.2	Very high	95.9	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	134.6	165.1	172	68.9	0	0	0	110	L60 L76 V109 V111 L118 R127 Y128 L130 L133	L60-L116 HydrophobicContact CD2-CD1 4.01Å; L60-L116 HydrophobicContact CD2-CD2 3.6Å; L60-L116 HydrophobicContact CD2-CG 4.47Å; L76-L116 HydrophobicContact CD2-CD2 4.48Å; V109-L116 HydrophobicContact CG1-CD1 3.68Å; V111-L116 HydrophobicContact CG2-CB 4.47Å; V111-L116 HydrophobicContact CG2-CD1 3.49Å; V111-L116 VanDerWaalsContact CG2-CD1 3.49Å; L116-L118 HydrophobicContact CD1-CD2 4.13Å; L116-L118 HydrophobicContact CD1-CG 4.5Å; L116-L118 HydrophobicContact CD2-CD1 4.23Å; L116-L118 HydrophobicContact CD2-CD2 4.4Å; L116-L118 HydrophobicContact CD2-CG 4.31Å; L116-L118 HydrophobicContact CG-CD2 4.34Å; L116-L118 HydrophobicContact CG-CG 4.21Å; L116-R127 WeakPolarHBondContact O-CA 3.33Å; L116-Y128 HydrophobicContact CD2-CD2 4.44Å; L116-Y128 PolarHBondContact N-O 2.98Å; L116-Y128 PolarHBondContact O-N 3.03Å; L116-L130 HydrophobicContact CB-CD2 4.32Å; L116-L133 HydrophobicContact CB-CD1 3.9Å; L116-L133 HydrophobicContact CD2-CD1 3.63Å; L116-L133 HydrophobicContact CG-CD1 4.42Å
117	F	97.9	Very high	95.9	Very high	20 Å²	20	59.6 Å²	59.6	9%	0.088	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	132.4	175.1	-58.4	-104.8	0	0	0	109.9	V109 R110 D112 T115 T126 R127	V109-F117 WeakPolarHBondContact CA-O 3.42Å; R110-F117 HydrophobicContact CB-CB 4.3Å; R110-F117 PolarHBondContact N-O 3.36Å; R110-F117 VanDerWaalsContact NH2-CD1 3.32Å; R110-F117 VanDerWaalsContact NH2-CD2 3.25Å; R110-F117 WeakPolarHBondContact O-CA 3.47Å; R110-F117 WeakPolarHBondContact O-CB 3.46Å; R110-F117 PolarHBondContact O-N 2.83Å; D112-F117 WeakPolarHBondContact OD2-CE2 3.35Å; D112-F117 WeakPolarHBondContact OD2-CZ 3.49Å; T115-F117 HydrophobicContact CG2-CD2 4.02Å; T115-F117 HydrophobicContact CG2-CE1 4.2Å; T115-F117 HydrophobicContact CG2-CE2 3.43Å; T115-F117 VanDerWaalsContact CG2-CE2 3.43Å; T115-F117 HydrophobicContact CG2-CZ 3.54Å; T115-F117 WeakPolarHBondContact O-CD2 3.42Å; T115-F117 WeakPolarHBondContact O-CE2 3.25Å; F117-T126 WeakPolarHBondContact CA-O 3.47Å; F117-R127 HydrophobicContact CD1-CG 3.75Å; F117-R127 HydrophobicContact CE1-CG 3.91Å; F117-R127 VanDerWaalsContact CE1-NE 3.25Å
118	L	98.1	Very high	95.9	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	122.4	178.3	-58.8	167.6	0	0	0	108.5	L60 L76 P106 V109 L116 W120 V125 T126 Y128	L60-L118 HydrophobicContact CD2-CD2 4.34Å; L76-L118 HydrophobicContact CB-CD1 3.79Å; L76-L118 HydrophobicContact CD1-CD1 3.79Å; L76-L118 HydrophobicContact CD2-CD1 4.05Å; L76-L118 HydrophobicContact CG-CD1 4.09Å; P106-L118 HydrophobicContact CB-CB 4.46Å; P106-L118 HydrophobicContact CB-CD2 4.19Å; P106-L118 HydrophobicContact CG-CD2 4.32Å; V109-L118 HydrophobicContact CB-CD2 4.29Å; V109-L118 HydrophobicContact CG1-CD2 3.98Å; V109-L118 HydrophobicContact CG2-CD2 3.63Å; L116-L118 HydrophobicContact CD1-CD2 4.13Å; L116-L118 HydrophobicContact CD1-CG 4.5Å; L116-L118 HydrophobicContact CD2-CD1 4.23Å; L116-L118 HydrophobicContact CD2-CD2 4.4Å; L116-L118 HydrophobicContact CD2-CG 4.31Å; L116-L118 HydrophobicContact CG-CD2 4.34Å; L116-L118 HydrophobicContact CG-CG 4.21Å; L118-W120 HydrophobicContact CB-CZ2 4.02Å; L118-W120 HydrophobicContact CD1-CH2 4.13Å; L118-W120 HydrophobicContact CD1-CZ2 3.77Å; L118-V125 CarbonylContact O-C 3.56Å; L118-V125 VanDerWaalsContact O-CA 3.31Å; L118-V125 WeakPolarHBondContact O-CA 3.41Å; L118-T126 PolarHBondContact N-O 2.93Å; L118-T126 PolarHBondContact O-N 3.48Å; L118-Y128 HydrophobicContact CD1-CD2 4.47Å; L118-Y128 HydrophobicContact CD1-CE2 4.35Å
119	T	98.1	Very high	95.9	Very high	47 Å²	47	51.7 Å²	51.7	29%	0.288	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	121.2	172.3	-55.3	0	0	0	0	109.1	P106 K107 A108 H124 V125	P106-T119 CarbonylContact C-O 3.58Å; P106-T119 WeakPolarHBondContact CA-O 3.46Å; K107-T119 PolarHBondContact N-O 3.04Å; A108-T119 PolarHBondContact N-O 2.96Å; A108-T119 PolarHBondContact O-N 3.13Å; T119-H124 WeakPolarHBondContact CA-O 3.48Å; T119-V125 HydrophobicContact CG2-CG2 4.35Å
120	W	97.6	Very high	95.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.275	C	S	.	.			trans	-90.5	168.2	-175.6	-60	110.8	0	0	0	112.8	F73 L76 R77 I104 P106 L118 D122 G123 H124 T126	F73-W120 HydrophobicContact CB-CH2 4.48Å; F73-W120 HydrophobicContact CB-CZ3 4.33Å; F73-W120 WeakPolarHBondContact O-CH2 3.39Å; L76-W120 HydrophobicContact CB-CH2 3.95Å; L76-W120 HydrophobicContact CB-CZ2 4.06Å; R77-W120 HydrophobicContact CB-CH2 4.03Å; R77-W120 HydrophobicContact CB-CZ2 3.81Å; R77-W120 HydrophobicContact CB-CZ3 4.5Å; I104-W120 HydrophobicContact CD1-CB 4.34Å; I104-W120 HydrophobicContact CD1-CD2 3.95Å; I104-W120 HydrophobicContact CD1-CE3 3.57Å; I104-W120 HydrophobicContact CD1-CG 4.29Å; I104-W120 HydrophobicContact CD1-CZ3 4.17Å; I104-W120 HydrophobicContact CG1-CE3 3.69Å; I104-W120 HydrophobicContact CG1-CZ3 4.1Å; I104-W120 HydrophobicContact CG2-CZ3 4.31Å; P106-W120 HydrophobicContact CB-CE3 4.3Å; P106-W120 HydrophobicContact CB-CZ3 4.23Å; L118-W120 HydrophobicContact CB-CZ2 4.02Å; L118-W120 HydrophobicContact CD1-CH2 4.13Å; L118-W120 HydrophobicContact CD1-CZ2 3.77Å; W120-D122 VanDerWaalsContact CB-OD1 3.27Å; W120-D122 WeakPolarHBondContact CB-OD1 3.41Å; W120-D122 PolarHBondContact O-N 2.92Å; W120-G123 PolarHBondContact O-N 2.92Å; W120-H124 HydrophobicContact CB-CB 4.39Å; W120-H124 AromaticContact CD1-CD2 3.79Å; W120-H124 VanDerWaalsContact CD1-O 3.28Å; W120-H124 PolarHBondContact N-O 3.38Å; W120-T126 PolarHBondContact NE1-OG1 2.72Å
121	P	96.8	Very high	95.7	Very high	61 Å²	61	52.1 Å²	52.1	40%	0.396	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-32.1	-177.8	-27.8	37.6	0	0	0	115	I104 K105 K107 G123	I104-P121 HydrophobicContact CG1-CG 4.3Å; K105-P121 WeakPolarHBondContact O-CD 3.4Å; K105-P121 WeakPolarHBondContact O-CG 3.15Å; K107-P121 PolarHBondContact NZ-O 3.23Å; P121-G123 PolarHBondContact O-N 3.43Å
122	D	94	Very high	95.7	Very high	106 Å²	106	53.7 Å²	53.7	57%	0.567	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-1.8	175.5	64.1	-3	0	0	0	113.5	R77 W120 H124	R77-D122 IonicContact NH2-OD2 3.15Å; W120-D122 VanDerWaalsContact CB-OD1 3.27Å; W120-D122 WeakPolarHBondContact CB-OD1 3.41Å; W120-D122 PolarHBondContact O-N 2.92Å; D122-H124 VanDerWaalsContact C-N 3.29Å; D122-H124 WeakPolarHBondContact OD1-CB 3.45Å; D122-H124 PolarHBondContact OD1-N 3.5Å
123	G	95.8	Very high	95.9	Very high	49 Å²	49	50.9 Å²	50.9	51%	0.505	27%	0.273	S	S	.	.	S	Bend	trans	83.5	-1.9	-175.6	0	0	0	0	0	114.2	W120 P121	W120-G123 PolarHBondContact O-N 2.92Å; P121-G123 PolarHBondContact O-N 3.43Å
124	H	96.9	Very high	96.2	Very high	38 Å²	38	45.2 Å²	45.2	18%	0.176	25%	0.249	C	C	.	.			trans	-62.4	143.1	174.7	-170.5	84.3	0	0	0	110.6	C80 S82 S84 T119 W120 D122	C80-H124 PolarHBondContact SG-NE2 3.17Å; S82-H124 PolarHBondContact OG-CE1 2.82Å; S82-H124 VanDerWaalsContact OG-CE1 3.23Å; S82-H124 PolarHBondContact OG-NE2 2.95Å; S84-H124 PolarHBondContact OG-CE1 2.91Å; T119-H124 WeakPolarHBondContact CA-O 3.48Å; W120-H124 HydrophobicContact CB-CB 4.39Å; W120-H124 AromaticContact CD1-CD2 3.79Å; W120-H124 VanDerWaalsContact CD1-O 3.28Å; W120-H124 PolarHBondContact N-O 3.38Å; D122-H124 VanDerWaalsContact C-N 3.29Å; D122-H124 WeakPolarHBondContact OD1-CB 3.45Å; D122-H124 PolarHBondContact OD1-N 3.5Å
125	V	97.4	Very high	96.1	Very high	66 Å²	66	47.7 Å²	47.7	40%	0.4	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	117.5	177.6	-178.8	0	0	0	0	110	L118 T119 R127	L118-V125 CarbonylContact O-C 3.56Å; L118-V125 VanDerWaalsContact O-CA 3.31Å; L118-V125 WeakPolarHBondContact O-CA 3.41Å; T119-V125 HydrophobicContact CG2-CG2 4.35Å; V125-R127 HydrophobicContact CG1-CG 4.43Å
126	T	97.8	Very high	95.9	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	141.5	172.1	-62.8	0	0	0	0	110.4	C80 F117 L118 W120 Y128	C80-T126 HydrophobicContact CB-CG2 3.9Å; C80-T126 PolarHBondContact SG-OG1 2.84Å; F117-T126 WeakPolarHBondContact CA-O 3.47Å; L118-T126 PolarHBondContact N-O 2.93Å; L118-T126 PolarHBondContact O-N 3.48Å; W120-T126 PolarHBondContact NE1-OG1 2.72Å; T126-Y128 HydrophobicContact CG2-CD2 3.77Å; T126-Y128 HydrophobicContact CG2-CE1 4.35Å; T126-Y128 HydrophobicContact CG2-CE2 3.22Å
127	R	97.4	Very high	95.7	Very high	158 Å²	158	49.5 Å²	49.5	60%	0.596	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.6	131.1	179.7	-59.1	175	68.1	163.8	2.8	109.5	T115 L116 F117 V125	T115-R127 HydrophobicContact CG2-CB 4.26Å; L116-R127 WeakPolarHBondContact O-CA 3.33Å; F117-R127 HydrophobicContact CD1-CG 3.75Å; F117-R127 HydrophobicContact CE1-CG 3.91Å; F117-R127 VanDerWaalsContact CE1-NE 3.25Å; V125-R127 HydrophobicContact CG1-CG 4.43Å
128	Y	97.7	Very high	95.2	Very high	5 Å²	5	54.9 Å²	54.9	2%	0.02	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	132.4	175.8	-69.5	-66.7	0	0	0	110.9	L76 H79 C80 T115 L116 L118 T126 W132 L133	L76-Y128 HydrophobicContact CB-CE2 4.28Å; L76-Y128 HydrophobicContact CD2-CD2 3.93Å; L76-Y128 HydrophobicContact CD2-CE2 3.58Å; L76-Y128 WeakPolarHBondContact O-CE2 3.3Å; L76-Y128 PolarHBondContact O-OH 3.31Å; H79-Y128 WeakPolarHBondContact O-CE1 3.44Å; H79-Y128 PolarHBondContact O-OH 3.33Å; H79-Y128 VanDerWaalsContact O-OH 3.13Å; C80-Y128 WeakPolarHBondContact CA-OH 3.08Å; C80-Y128 PolarHBondContact N-OH 2.96Å; T115-Y128 CarbonylContact C-O 3.56Å; T115-Y128 VanDerWaalsContact CA-O 3.3Å; T115-Y128 WeakPolarHBondContact CA-O 3.34Å; T115-Y128 WeakPolarHBondContact CG2-O 3.5Å; L116-Y128 HydrophobicContact CD2-CD2 4.44Å; L116-Y128 PolarHBondContact N-O 2.98Å; L116-Y128 PolarHBondContact O-N 3.03Å; L118-Y128 HydrophobicContact CD1-CD2 4.47Å; L118-Y128 HydrophobicContact CD1-CE2 4.35Å; T126-Y128 HydrophobicContact CG2-CD2 3.77Å; T126-Y128 HydrophobicContact CG2-CE1 4.35Å; T126-Y128 HydrophobicContact CG2-CE2 3.22Å; Y128-W132 HydrophobicContact CD1-CD2 4.35Å; Y128-W132 AromaticContact CD1-CE3 3.49Å; Y128-W132 HydrophobicContact CD1-CE3 3.49Å; Y128-W132 VanDerWaalsContact CD1-CE3 3.49Å; Y128-W132 HydrophobicContact CD1-CH2 4.2Å; Y128-W132 AromaticContact CD1-CZ3 3.39Å; Y128-W132 HydrophobicContact CD1-CZ3 3.39Å; Y128-W132 HydrophobicContact CE1-CE3 4Å; Y128-W132 AromaticContact CE1-CH2 3.83Å; Y128-W132 HydrophobicContact CE1-CH2 3.83Å; Y128-W132 AromaticContact CE1-CZ3 3.41Å; Y128-W132 HydrophobicContact CE1-CZ3 3.41Å; Y128-W132 VanDerWaalsContact CE1-CZ3 3.41Å; Y128-W132 HydrophobicContact CG-CE3 4.31Å; Y128-W132 HydrophobicContact CG-CZ3 4.31Å; Y128-L133 HydrophobicContact CD1-CD2 4.37Å; Y128-L133 HydrophobicContact CD2-CD2 4.15Å; Y128-L133 HydrophobicContact CG-CD2 3.9Å; Y128-L133 HydrophobicContact CG-CG 4.33Å
129	G	96.5	Very high	94.8	Very high	32 Å²	32	57.3 Å²	57.3	33%	0.33	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	137.7	165.9	0	0	0	0	0	110.4	T114 E131 W132 L133	T114-G129 CarbonylContact O-C 3.6Å; T114-G129 WeakPolarHBondContact O-CA 3.36Å; G129-E131 VanDerWaalsContact C-N 3.31Å; G129-E131 PolarHBondContact O-N 2.75Å; G129-W132 WeakPolarHBondContact O-CB 3.49Å; G129-W132 PolarHBondContact O-N 2.93Å; G129-W132 VanDerWaalsContact O-N 3.08Å; G129-L133 PolarHBondContact O-N 2.96Å
130	L	95	Very high	94	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-62.8	-37.5	-178.1	-65.2	173.2	0	0	0	111.7	L62 Y64 V111 T114 L116 W132 L133 V134	L62-L130 HydrophobicContact CD1-CD2 4.49Å; L62-L130 HydrophobicContact CD2-CD2 3.85Å; Y64-L130 HydrophobicContact CD1-CB 3.85Å; Y64-L130 HydrophobicContact CD2-CB 3.98Å; Y64-L130 HydrophobicContact CD2-CD1 3.53Å; Y64-L130 HydrophobicContact CD2-CG 4.24Å; Y64-L130 HydrophobicContact CE1-CB 3.74Å; Y64-L130 HydrophobicContact CE2-CB 3.87Å; Y64-L130 HydrophobicContact CE2-CD1 3.43Å; Y64-L130 VanDerWaalsContact CE2-CD1 3.43Å; Y64-L130 HydrophobicContact CE2-CG 4.26Å; Y64-L130 HydrophobicContact CG-CB 3.95Å; Y64-L130 HydrophobicContact CG-CD1 4.28Å; V111-L130 HydrophobicContact CG1-CD1 4.17Å; V111-L130 HydrophobicContact CG1-CD2 4.16Å; T114-L130 WeakPolarHBondContact O-CG 3.24Å; T114-L130 PolarHBondContact O-N 3.21Å; L116-L130 HydrophobicContact CB-CD2 4.32Å; L130-W132 VanDerWaalsContact C-N 3.34Å; L130-W132 PolarHBondContact O-N 3.42Å; L130-L133 HydrophobicContact CD2-CD1 4.31Å; L130-L133 WeakPolarHBondContact O-CB 3.34Å; L130-L133 PolarHBondContact O-N 3.4Å; L130-V134 WeakPolarHBondContact O-CG2 3.4Å; L130-V134 PolarHBondContact O-N 2.83Å
131	E	93.4	Very high	93.3	Very high	153 Å²	153	58.8 Å²	58.8	72%	0.715	30%	0.302	S	S	*	.	H	α-helix	trans	-64.3	-37.4	172.6	-65	-176.2	169.8	0	0	112.7	G129 L133 V134 K135	G129-E131 VanDerWaalsContact C-N 3.31Å; G129-E131 PolarHBondContact O-N 2.75Å; E131-L133 VanDerWaalsContact C-N 3.32Å; E131-V134 PolarHBondContact O-N 2.8Å; E131-K135 WeakPolarHBondContact O-CB 3.32Å; E131-K135 PolarHBondContact O-N 3.01Å
132	W	94.5	Very high	92.4	Very high	65 Å²	65	61.4 Å²	61.4	25%	0.246	31%	0.307	C	S	.	.	H	α-helix	trans	-64.3	-40.8	174.9	-174.8	94.7	0	0	0	110.6	W75 H79 Y128 G129 L130 K135 N136	W75-W132 AromaticContact CH2-CH2 3.66Å; W75-W132 HydrophobicContact CH2-CH2 3.66Å; W75-W132 AromaticContact CH2-CZ3 3.58Å; W75-W132 HydrophobicContact CH2-CZ3 3.58Å; W75-W132 HydrophobicContact CZ2-CH2 4.27Å; W75-W132 HydrophobicContact CZ3-CH2 4.39Å; W75-W132 HydrophobicContact CZ3-CZ3 4.06Å; H79-W132 HydrophobicContact CB-CH2 4.21Å; Y128-W132 HydrophobicContact CD1-CD2 4.35Å; Y128-W132 AromaticContact CD1-CE3 3.49Å; Y128-W132 HydrophobicContact CD1-CE3 3.49Å; Y128-W132 VanDerWaalsContact CD1-CE3 3.49Å; Y128-W132 HydrophobicContact CD1-CH2 4.2Å; Y128-W132 AromaticContact CD1-CZ3 3.39Å; Y128-W132 HydrophobicContact CD1-CZ3 3.39Å; Y128-W132 HydrophobicContact CE1-CE3 4Å; Y128-W132 AromaticContact CE1-CH2 3.83Å; Y128-W132 HydrophobicContact CE1-CH2 3.83Å; Y128-W132 AromaticContact CE1-CZ3 3.41Å; Y128-W132 HydrophobicContact CE1-CZ3 3.41Å; Y128-W132 VanDerWaalsContact CE1-CZ3 3.41Å; Y128-W132 HydrophobicContact CG-CE3 4.31Å; Y128-W132 HydrophobicContact CG-CZ3 4.31Å; G129-W132 WeakPolarHBondContact O-CB 3.49Å; G129-W132 PolarHBondContact O-N 2.93Å; G129-W132 VanDerWaalsContact O-N 3.08Å; L130-W132 VanDerWaalsContact C-N 3.34Å; L130-W132 PolarHBondContact O-N 3.42Å; W132-K135 PolarHBondContact O-N 3.26Å; W132-N136 HydrophobicContact CD2-CB 4.5Å; W132-N136 HydrophobicContact CE3-CB 4.38Å; W132-N136 HydrophobicContact CH2-CB 4.04Å; W132-N136 HydrophobicContact CZ2-CB 4.16Å; W132-N136 HydrophobicContact CZ3-CB 4.17Å; W132-N136 PolarHBondContact NE1-ND2 2.93Å; W132-N136 WeakPolarHBondContact O-CB 3.28Å; W132-N136 PolarHBondContact O-N 2.93Å; W132-N136 PolarHBondContact O-ND2 3.4Å
133	L	95.5	Very high	91.3	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.1	-44.1	174.6	-71.3	172.5	0	0	0	111.7	L62 M69 F71 W75 L76 L116 Y128 G129 L130 E131 K135 N136 S137	L62-L133 HydrophobicContact CD2-CD1 3.59Å; M69-L133 HydrophobicContact SD-CB 4.35Å; F71-L133 HydrophobicContact CD1-CD2 4.36Å; F71-L133 HydrophobicContact CE1-CB 4.47Å; F71-L133 HydrophobicContact CE1-CD2 3.84Å; F71-L133 HydrophobicContact CE2-CB 4.11Å; F71-L133 HydrophobicContact CE2-CD1 4.48Å; F71-L133 HydrophobicContact CE2-CD2 4.12Å; F71-L133 HydrophobicContact CE2-CG 4.46Å; F71-L133 HydrophobicContact CZ-CB 3.65Å; F71-L133 HydrophobicContact CZ-CD2 3.71Å; F71-L133 HydrophobicContact CZ-CG 4.19Å; W75-L133 HydrophobicContact CZ3-CD2 4.29Å; L76-L133 HydrophobicContact CD2-CD2 4.24Å; L116-L133 HydrophobicContact CB-CD1 3.9Å; L116-L133 HydrophobicContact CD2-CD1 3.63Å; L116-L133 HydrophobicContact CG-CD1 4.42Å; Y128-L133 HydrophobicContact CD1-CD2 4.37Å; Y128-L133 HydrophobicContact CD2-CD2 4.15Å; Y128-L133 HydrophobicContact CG-CD2 3.9Å; Y128-L133 HydrophobicContact CG-CG 4.33Å; G129-L133 PolarHBondContact O-N 2.96Å; L130-L133 HydrophobicContact CD2-CD1 4.31Å; L130-L133 WeakPolarHBondContact O-CB 3.34Å; L130-L133 PolarHBondContact O-N 3.4Å; E131-L133 VanDerWaalsContact C-N 3.32Å; L133-K135 VanDerWaalsContact C-N 3.33Å; L133-K135 PolarHBondContact O-N 3.48Å; L133-N136 CarbonylContact O-C 3.6Å; L133-N136 PolarHBondContact O-N 2.82Å; L133-S137 VanDerWaalsContact O-CB 3.25Å; L133-S137 WeakPolarHBondContact O-CB 3.33Å; L133-S137 PolarHBondContact O-N 2.81Å; L133-S137 PolarHBondContact O-OG 3.18Å
134	V	92.7	Very high	90.5	Very high	40 Å²	40	66.4 Å²	66.4	24%	0.242	31%	0.314	C	S	.	.	H	α-helix	trans	-56.6	-49.8	173.9	173	0	0	0	0	110.5	Y64 M69 L130 E131 N136 S137	Y64-V134 HydrophobicContact CD1-CG2 3.73Å; Y64-V134 HydrophobicContact CE1-CG2 4.47Å; M69-V134 HydrophobicContact CE-CG2 3.96Å; M69-V134 VanDerWaalsContact SD-CA 3.52Å; M69-V134 HydrophobicContact SD-CB 4.27Å; M69-V134 HydrophobicContact SD-CG2 3.79Å; L130-V134 WeakPolarHBondContact O-CG2 3.4Å; L130-V134 PolarHBondContact O-N 2.83Å; E131-V134 PolarHBondContact O-N 2.8Å; V134-N136 VanDerWaalsContact C-N 3.28Å; V134-N136 PolarHBondContact O-N 3.1Å; V134-S137 PolarHBondContact O-OG 3.37Å
135	K	91.4	Very high	89.7	Confident	138 Å²	138	68.2 Å²	68.2	60%	0.6	33%	0.328	S	S	*	.	H	α-helix	trans	-62.9	-30.9	-179.7	-174.4	174.5	178.7	177.3	0	113.2	E131 W132 L133 Q141	E131-K135 WeakPolarHBondContact O-CB 3.32Å; E131-K135 PolarHBondContact O-N 3.01Å; W132-K135 PolarHBondContact O-N 3.26Å; L133-K135 VanDerWaalsContact C-N 3.33Å; L133-K135 PolarHBondContact O-N 3.48Å; K135-Q141 PolarHBondContact O-NE2 3.27Å
136	N	92.7	Very high	89.1	Confident	60 Å²	60	68.6 Å²	68.6	32%	0.321	33%	0.326	S	S	.	.	H	α-helix	trans	-109.7	5.6	-174.3	-64.1	-90.1	0	0	0	113.7	W75 W132 L133 V134	W75-N136 HydrophobicContact CH2-CB 4.08Å; W75-N136 HydrophobicContact CZ2-CB 4.23Å; W132-N136 HydrophobicContact CD2-CB 4.5Å; W132-N136 HydrophobicContact CE3-CB 4.38Å; W132-N136 HydrophobicContact CH2-CB 4.04Å; W132-N136 HydrophobicContact CZ2-CB 4.16Å; W132-N136 HydrophobicContact CZ3-CB 4.17Å; W132-N136 PolarHBondContact NE1-ND2 2.93Å; W132-N136 WeakPolarHBondContact O-CB 3.28Å; W132-N136 PolarHBondContact O-N 2.93Å; W132-N136 PolarHBondContact O-ND2 3.4Å; L133-N136 CarbonylContact O-C 3.6Å; L133-N136 PolarHBondContact O-N 2.82Å; V134-N136 VanDerWaalsContact C-N 3.28Å; V134-N136 PolarHBondContact O-N 3.1Å
137	S	92.3	Very high	88.5	Confident	1 Å²	1	70 Å²	70	1%	0.007	33%	0.332	C	S	.	.	S	Bend	trans	-74.1	150.8	174	62.8	0	0	0	0	111.4	L133 V134 E139 G140 Q141	L133-S137 VanDerWaalsContact O-CB 3.25Å; L133-S137 WeakPolarHBondContact O-CB 3.33Å; L133-S137 PolarHBondContact O-N 2.81Å; L133-S137 PolarHBondContact O-OG 3.18Å; V134-S137 PolarHBondContact O-OG 3.37Å; S137-E139 VanDerWaalsContact C-N 3.29Å; S137-E139 PolarHBondContact O-N 3.04Å; S137-G140 PolarHBondContact O-N 2.87Å; S137-G140 WeakPolarHBondContact OG-CA 3.42Å; S137-G140 PolarHBondContact OG-N 2.69Å; S137-Q141 WeakPolarHBondContact O-CG 3.48Å; S137-Q141 PolarHBondContact O-N 2.96Å
138	Y	87.8	Confident	88.1	Confident	132 Å²	132	64.4 Å²	64.4	52%	0.518	32%	0.316	S	S	.	.	H	α-helix	trans	-57	-45.7	171.2	172.4	-100.8	0	0	0	110.8	G140 Q141 K142	Y138-G140 VanDerWaalsContact C-N 3.31Å; Y138-G140 PolarHBondContact O-N 3.27Å; Y138-Q141 PolarHBondContact O-N 2.85Å; Y138-Q141 VanDerWaalsContact O-N 3.13Å; Y138-K142 HydrophobicContact CE1-CB 4.49Å; Y138-K142 HydrophobicContact CE1-CD 3.91Å; Y138-K142 HydrophobicContact CE1-CG 4.46Å; Y138-K142 WeakPolarHBondContact O-CB 3.4Å; Y138-K142 PolarHBondContact O-N 3.05Å
139	E	88.9	Confident	87.9	Confident	52 Å²	52	67 Å²	67	24%	0.243	33%	0.326	C	S	.	.	H	α-helix	trans	-61.6	-38.4	178.5	-68.9	81.2	-171.7	0	0	112.7	T67 L68 M69 R70 S137 Q141	T67-E139 HydrophobicContact CG2-CB 4.42Å; L68-E139 WeakPolarHBondContact O-CG 3.47Å; M69-E139 WeakPolarHBondContact CA-OE2 3.48Å; R70-E139 PolarHBondContact N-OE2 3.47Å; R70-E139 IonicContact NH1-OE1 3.86Å; S137-E139 VanDerWaalsContact C-N 3.29Å; S137-E139 PolarHBondContact O-N 3.04Å; E139-Q141 VanDerWaalsContact C-N 3.31Å; E139-Q141 PolarHBondContact O-N 3.15Å
140	G	81.9	Confident	88	Confident	16 Å²	16	68.5 Å²	68.5	17%	0.165	33%	0.326	C	S	.	.	H	α-helix	trans	-68.5	-27.9	175.9	0	0	0	0	0	113.7	S137 Y138 Q144	S137-G140 PolarHBondContact O-N 2.87Å; S137-G140 WeakPolarHBondContact OG-CA 3.42Å; S137-G140 PolarHBondContact OG-N 2.69Å; Y138-G140 VanDerWaalsContact C-N 3.31Å; Y138-G140 PolarHBondContact O-N 3.27Å; G140-Q144 WeakPolarHBondContact O-CG 3.39Å; G140-Q144 PolarHBondContact O-NE2 3.4Å
141	Q	83.3	Confident	88.1	Confident	61 Å²	61	70.9 Å²	70.9	29%	0.285	34%	0.338	S	S	.	.	H	α-helix	trans	-96	-22.1	-178.7	-69.6	-59	-47.4	0	0	113.9	K135 S137 Y138 E139 Q143 Q144	K135-Q141 PolarHBondContact O-NE2 3.27Å; S137-Q141 WeakPolarHBondContact O-CG 3.48Å; S137-Q141 PolarHBondContact O-N 2.96Å; Y138-Q141 PolarHBondContact O-N 2.85Å; Y138-Q141 VanDerWaalsContact O-N 3.13Å; E139-Q141 VanDerWaalsContact C-N 3.31Å; E139-Q141 PolarHBondContact O-N 3.15Å; Q141-Q143 PolarHBondContact O-N 3.4Å; Q141-Q144 PolarHBondContact O-N 3.21Å
142	K	77.7	Confident	88.4	Confident	116 Å²	116	63.6 Å²	63.6	50%	0.504	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-31.2	-174.9	-174.4	176.5	-177.6	176.7	0	113.9	Y138	Y138-K142 HydrophobicContact CE1-CB 4.49Å; Y138-K142 HydrophobicContact CE1-CD 3.91Å; Y138-K142 HydrophobicContact CE1-CG 4.46Å; Y138-K142 WeakPolarHBondContact O-CB 3.4Å; Y138-K142 PolarHBondContact O-N 3.05Å
143	Q	70.3	Confident	88.6	Confident	179 Å²	179	61.4 Å²	61.4	84%	0.836	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	0.8	-179.1	-63.5	-175.2	-14.9	0	0	113.2	Q141 V145	Q141-Q143 PolarHBondContact O-N 3.4Å; Q143-V145 PolarHBondContact O-N 2.98Å
144	Q	79.1	Confident	88.7	Confident	81 Å²	81	61.5 Å²	61.5	38%	0.379	30%	0.298	S	S	.	.			trans	-77.2	128.7	179.4	-72.9	-171.6	22.1	0	0	110.1	G140 Q141	G140-Q144 WeakPolarHBondContact O-CG 3.39Å; G140-Q144 PolarHBondContact O-NE2 3.4Å; Q141-Q144 PolarHBondContact O-N 3.21Å
145	V	80.2	Confident	88.9	Confident	77 Å²	77	65 Å²	65	47%	0.467	31%	0.312	S	S	.	.			trans	-76.6	129	168.6	-177.1	0	0	0	0	107	Q143 H147 E327	Q143-V145 PolarHBondContact O-N 2.98Å; V145-H147 VanDerWaalsContact C-N 3.34Å; V145-H147 VanDerWaalsContact CG1-O 3.25Å; V145-H147 WeakPolarHBondContact CG1-O 3.39Å; V145-E327 VanDerWaalsContact CG1-OE1 3.26Å; V145-E327 WeakPolarHBondContact CG1-OE1 3.47Å
146	M	85	Confident	89.3	Confident	74 Å²	74	61.3 Å²	61.3	37%	0.365	30%	0.298	S	S	.	.	S	Bend	trans	-63.5	-43.6	179.5	-69	-59.4	-59.6	0	0	111.2	Y322 W324 E327	M146-Y322 HydrophobicContact CB-CE2 3.87Å; M146-Y322 HydrophobicContact CG-CD2 3.91Å; M146-Y322 HydrophobicContact CG-CE2 3.57Å; M146-W324 HydrophobicContact CG-CZ2 4.02Å; M146-W324 HydrophobicContact SD-CZ2 3.91Å; M146-E327 WeakPolarHBondContact CG-OE2 3.3Å; M146-E327 PolarHBondContact N-OE1 3.38Å; M146-E327 PolarHBondContact N-OE2 3.24Å
147	H	84.3	Confident	89.5	Confident	30 Å²	30	59.3 Å²	59.3	14%	0.139	29%	0.286	C	S	.	.	S	Bend	trans	-131.5	112.2	-179	-55.4	82	0	0	0	110.2	V145 R149 A421	V145-H147 VanDerWaalsContact C-N 3.34Å; V145-H147 VanDerWaalsContact CG1-O 3.25Å; V145-H147 WeakPolarHBondContact CG1-O 3.39Å; H147-R149 PolarHBondContact O-N 3.21Å; H147-A421 PolarHBondContact CD2-OXT 2.98Å; H147-A421 PolarHBondContact NE2-OXT 3.43Å; H147-A421 VanDerWaalsContact NE2-OXT 3.07Å
148	P	89.6	Confident	89.8	Confident	39 Å²	39	66.2 Å²	66.2	25%	0.253	31%	0.312	S	S	.	.			trans	-56.4	131.3	173.1	-23	33	0	0	0	110.8	Q420	P148-Q420 HydrophobicContact CG-CB 4.01Å; P148-Q420 HydrophobicContact CG-CG 3.66Å
149	R	94.5	Very high	90.2	Very high	59 Å²	59	66 Å²	66	22%	0.223	32%	0.316	C	S	.	.			trans	-153.7	154.5	-178.5	58.5	-171.7	142.7	-173.1	-6.2	111.6	H147 L151 L186 E327 L328	H147-R149 PolarHBondContact O-N 3.21Å; R149-L151 HydrophobicContact CG-CD2 4.31Å; R149-L186 WeakPolarHBondContact CA-O 3.44Å; R149-E327 IonicContact CZ-OE1 3.63Å; R149-E327 IonicContact NH2-OE1 3.64Å; R149-E327 PolarHBondContact NH2-OE1 3.33Å; R149-L328 VanDerWaalsContact CZ-O 3.24Å; R149-L328 PolarHBondContact NH1-O 3.44Å; R149-L328 PolarHBondContact NH2-O 2.85Å
150	I	97.1	Very high	90.6	Very high	64 Å²	64	65.2 Å²	65.2	33%	0.328	32%	0.318	S	S	.	.			trans	-108.5	110.4	171.5	-65.2	168.5	0	0	0	106.6	I156 L186 Y187 R386	I150-I156 HydrophobicContact CG2-CG2 4.35Å; I150-L186 HydrophobicContact CD1-CD2 4.47Å; I150-L186 HydrophobicContact CG1-CD2 4.44Å; I150-L186 PolarHBondContact N-O 2.94Å; I150-Y187 HydrophobicContact CB-CD1 4.29Å; I150-Y187 HydrophobicContact CB-CE1 3.87Å; I150-Y187 HydrophobicContact CD1-CE1 4.1Å; I150-Y187 HydrophobicContact CD1-CE2 4.17Å; I150-Y187 VanDerWaalsContact CD1-OH 3.25Å; I150-Y187 WeakPolarHBondContact CD1-OH 3.48Å; I150-Y187 HydrophobicContact CG2-CD1 4.38Å; I150-Y187 HydrophobicContact CG2-CE1 3.72Å; I150-R386 PolarHBondContact O-NH2 3.09Å
151	L	98.1	Very high	91.3	Very high	51 Å²	51	72.4 Å²	72.4	27%	0.267	35%	0.347	S	S	.	.			trans	-71.8	132	173	-57.8	-174.6	0	0	0	109.1	R149 D273 F275 Y276 E279	R149-L151 HydrophobicContact CG-CD2 4.31Å; L151-D273 WeakPolarHBondContact CA-OD2 3.24Å; L151-F275 HydrophobicContact CD2-CB 3.6Å; L151-Y276 HydrophobicContact CB-CD2 3.95Å; L151-E279 HydrophobicContact CD1-CB 3.89Å; L151-E279 HydrophobicContact CD1-CG 4.02Å
152	W	98.7	Very high	91.9	Very high	1 Å²	1	71.2 Å²	71.2	0%	0.004	34%	0.343	C	S	.	.			trans	-133.8	148.8	-171.1	57.1	-95.4	0	0	0	114.4	I156 Y157 Y187 I189 L271 D273 Y276 L370 V387	W152-I156 HydrophobicContact CB-CB 4.09Å; W152-I156 HydrophobicContact CB-CG2 3.83Å; W152-Y157 AromaticContact CD2-CD2 4Å; W152-Y157 HydrophobicContact CD2-CD2 4Å; W152-Y157 HydrophobicContact CD2-CG 4.41Å; W152-Y157 HydrophobicContact CE3-CD2 4.47Å; W152-Y157 HydrophobicContact CE3-CG 4.48Å; W152-Y157 HydrophobicContact CG-CD2 4.17Å; W152-Y187 AromaticContact CD1-CD1 3.75Å; W152-Y187 HydrophobicContact CG-CD1 4.4Å; W152-Y187 PolarHBondContact NE1-O 3.08Å; W152-I189 HydrophobicContact CH2-CD1 4.31Å; W152-I189 HydrophobicContact CZ2-CD1 3.99Å; W152-I189 HydrophobicContact CZ2-CG1 4.32Å; W152-L271 HydrophobicContact CH2-CB 4.18Å; W152-D273 HydrophobicContact CD2-CB 3.7Å; W152-D273 HydrophobicContact CE3-CB 4.05Å; W152-D273 HydrophobicContact CG-CB 4.13Å; W152-D273 HydrophobicContact CH2-CB 4.2Å; W152-D273 HydrophobicContact CZ2-CB 3.86Å; W152-D273 HydrophobicContact CZ3-CB 4.29Å; W152-D273 PolarHBondContact N-OD2 2.74Å; W152-D273 VanDerWaalsContact O-CB 3.27Å; W152-D273 WeakPolarHBondContact O-CB 3.47Å; W152-Y276 VanDerWaalsContact O-CB 3.25Å; W152-Y276 WeakPolarHBondContact O-CB 3.33Å; W152-Y276 VanDerWaalsContact O-CG 3.29Å; W152-L370 HydrophobicContact CH2-CB 4.44Å; W152-L370 HydrophobicContact CH2-CD2 4.49Å; W152-L370 HydrophobicContact CZ3-CB 4Å; W152-L370 HydrophobicContact CZ3-CD2 4.46Å; W152-V387 HydrophobicContact CH2-CG1 4.3Å; W152-V387 HydrophobicContact CZ2-CG1 4.08Å; W152-V387 HydrophobicContact CZ2-CG2 4.09Å
153	N	98.6	Very high	92.6	Very high	19 Å²	19	69 Å²	69	10%	0.102	34%	0.34	C	S	.	.			trans	-104.4	-177.4	155.1	71.8	6.1	0	0	0	109.1	E155 I156 Y157 Y276 E367 N368	N153-E155 VanDerWaalsContact C-N 3.27Å; N153-E155 PolarHBondContact O-N 2.99Å; N153-E155 PolarHBondContact OD1-N 2.96Å; N153-E155 VanDerWaalsContact OD1-N 3.15Å; N153-I156 PolarHBondContact O-N 3.18Å; N153-I156 WeakPolarHBondContact OD1-CG1 3.48Å; N153-I156 PolarHBondContact OD1-N 3.02Å; N153-Y157 PolarHBondContact O-N 3.07Å; N153-Y276 HydrophobicContact CB-CD1 4.23Å; N153-Y276 HydrophobicContact CB-CE1 3.75Å; N153-E367 WeakPolarHBondContact CB-O 3.27Å; N153-N368 WeakPolarHBondContact CB-OD1 3.38Å
154	A	98.1	Very high	93.9	Very high	2 Å²	2	62 Å²	62	2%	0.017	31%	0.311	C	S	.	.	H	α-helix	trans	-64.7	-30	-175.1	0	0	0	0	0	113.4	R158 E367 E369	A154-R158 WeakPolarHBondContact O-CB 3.32Å; A154-R158 WeakPolarHBondContact O-CD 3.45Å; A154-R158 WeakPolarHBondContact O-CG 3.46Å; A154-R158 PolarHBondContact O-N 3.19Å; A154-E367 VanDerWaalsContact CB-O 3.25Å; A154-E367 WeakPolarHBondContact CB-O 3.24Å; A154-E367 PolarHBondContact N-O 2.87Å; A154-E369 WeakPolarHBondContact CB-O 3.45Å
155	E	98.1	Very high	94.8	Very high	114 Å²	114	58.4 Å²	58.4	53%	0.533	30%	0.295	S	S	.	.	H	α-helix	trans	-70.7	-51.9	176.6	-178.4	178.3	-179.5	0	0	111.3	N153 Y157 R158 Q159	N153-E155 VanDerWaalsContact C-N 3.27Å; N153-E155 PolarHBondContact O-N 2.99Å; N153-E155 PolarHBondContact OD1-N 2.96Å; N153-E155 VanDerWaalsContact OD1-N 3.15Å; E155-Y157 VanDerWaalsContact C-N 3.3Å; E155-Y157 PolarHBondContact O-N 3.26Å; E155-R158 PolarHBondContact O-N 3.19Å; E155-R158 VanDerWaalsContact O-N 3.16Å; E155-Q159 HydrophobicContact CG-CG 4.4Å; E155-Q159 WeakPolarHBondContact O-CG 3.25Å; E155-Q159 PolarHBondContact O-N 3.17Å; E155-Q159 PolarHBondContact OE1-NE2 3.2Å
156	I	98.4	Very high	95.7	Very high	59 Å²	59	57.8 Å²	57.8	30%	0.303	29%	0.289	S	S	.	.	H	α-helix	trans	-55.2	-47.7	178.6	-67.9	167.1	0	0	0	110.2	I150 W152 N153 R158 Q159 A160 Y276	I150-I156 HydrophobicContact CG2-CG2 4.35Å; W152-I156 HydrophobicContact CB-CB 4.09Å; W152-I156 HydrophobicContact CB-CG2 3.83Å; N153-I156 PolarHBondContact O-N 3.18Å; N153-I156 WeakPolarHBondContact OD1-CG1 3.48Å; N153-I156 PolarHBondContact OD1-N 3.02Å; I156-R158 PolarHBondContact O-N 3.25Å; I156-Q159 PolarHBondContact O-N 2.8Å; I156-A160 PolarHBondContact O-N 2.86Å; I156-A160 VanDerWaalsContact O-N 3.09Å; I156-Y276 HydrophobicContact CD1-CE2 4.14Å
157	Y	98.2	Very high	96.3	Very high	18 Å²	18	54.8 Å²	54.8	7%	0.071	28%	0.275	C	S	.	.	H	α-helix	trans	-63.4	-41.8	-179.7	-170.3	-85.5	0	0	0	112.3	W152 N153 E155 A160 Y187 I189 L370	W152-Y157 AromaticContact CD2-CD2 4Å; W152-Y157 HydrophobicContact CD2-CD2 4Å; W152-Y157 HydrophobicContact CD2-CG 4.41Å; W152-Y157 HydrophobicContact CE3-CD2 4.47Å; W152-Y157 HydrophobicContact CE3-CG 4.48Å; W152-Y157 HydrophobicContact CG-CD2 4.17Å; N153-Y157 PolarHBondContact O-N 3.07Å; E155-Y157 VanDerWaalsContact C-N 3.3Å; E155-Y157 PolarHBondContact O-N 3.26Å; Y157-A160 PolarHBondContact O-N 3.42Å; Y157-Y187 AromaticContact CD2-CD1 3.85Å; Y157-Y187 HydrophobicContact CD2-CD1 3.85Å; Y157-Y187 HydrophobicContact CD2-CG 4.28Å; Y157-Y187 HydrophobicContact CE2-CD1 4.1Å; Y157-Y187 HydrophobicContact CE2-CG 4.05Å; Y157-I189 HydrophobicContact CD2-CD1 4.18Å; Y157-I189 HydrophobicContact CD2-CG1 4.47Å; Y157-I189 HydrophobicContact CE1-CD1 4.19Å; Y157-I189 HydrophobicContact CE2-CD1 3.5Å; Y157-I189 VanDerWaalsContact CE2-CD1 3.5Å; Y157-I189 HydrophobicContact CE2-CG1 3.55Å; Y157-L370 HydrophobicContact CD1-CD1 4.26Å; Y157-L370 HydrophobicContact CD1-CD2 3.46Å; Y157-L370 VanDerWaalsContact CD1-CD2 3.46Å; Y157-L370 HydrophobicContact CE1-CD2 3.72Å; Y157-L370 HydrophobicContact CG-CD2 3.95Å
158	R	97.3	Very high	97	Very high	146 Å²	146	61.3 Å²	61.3	55%	0.551	30%	0.298	S	S	*	.	H	α-helix	trans	-66.9	-39.6	178.1	-74.2	173.7	-166.5	131.7	4.3	112.3	A154 E155 I156 A160 Q161 L370	A154-R158 WeakPolarHBondContact O-CB 3.32Å; A154-R158 WeakPolarHBondContact O-CD 3.45Å; A154-R158 WeakPolarHBondContact O-CG 3.46Å; A154-R158 PolarHBondContact O-N 3.19Å; E155-R158 PolarHBondContact O-N 3.19Å; E155-R158 VanDerWaalsContact O-N 3.16Å; I156-R158 PolarHBondContact O-N 3.25Å; R158-A160 VanDerWaalsContact C-N 3.27Å; R158-A160 PolarHBondContact O-N 2.97Å; R158-Q161 WeakPolarHBondContact O-CG 3.09Å; R158-Q161 PolarHBondContact O-N 3.24Å; R158-L370 HydrophobicContact CG-CD1 4.39Å
159	Q	97.9	Very high	97.4	Very high	128 Å²	128	61.5 Å²	61.5	60%	0.598	30%	0.301	S	S	*	.	H	α-helix	trans	-66.9	-29.2	178	-74	176.1	-0.5	0	0	112.6	E155 I156 Q161	E155-Q159 HydrophobicContact CG-CG 4.4Å; E155-Q159 WeakPolarHBondContact O-CG 3.25Å; E155-Q159 PolarHBondContact O-N 3.17Å; E155-Q159 PolarHBondContact OE1-NE2 3.2Å; I156-Q159 PolarHBondContact O-N 2.8Å; Q159-Q161 PolarHBondContact O-N 3.21Å
160	A	97	Very high	97.6	Very high	36 Å²	36	58.7 Å²	58.7	30%	0.298	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-19.4	175.6	0	0	0	0	0	113.4	I156 Y157 R158 I162 Y187	I156-A160 PolarHBondContact O-N 2.86Å; I156-A160 VanDerWaalsContact O-N 3.09Å; Y157-A160 PolarHBondContact O-N 3.42Å; R158-A160 VanDerWaalsContact C-N 3.27Å; R158-A160 PolarHBondContact O-N 2.97Å; A160-I162 HydrophobicContact CB-CD1 3.8Å; A160-I162 HydrophobicContact CB-CG1 3.86Å; A160-I162 PolarHBondContact O-N 3.27Å; A160-I162 VanDerWaalsContact O-N 3.14Å; A160-Y187 HydrophobicContact CB-CE1 4.13Å; A160-Y187 WeakPolarHBondContact CB-OH 3.46Å
161	Q	95.6	Very high	97.6	Very high	166 Å²	166	58 Å²	58	78%	0.776	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	41.3	177.3	-59.9	-171.2	-68.7	0	0	113.7	R158 Q159 P163	R158-Q161 WeakPolarHBondContact O-CG 3.09Å; R158-Q161 PolarHBondContact O-N 3.24Å; Q159-Q161 PolarHBondContact O-N 3.21Å; Q161-P163 WeakPolarHBondContact O-CD 3.49Å
162	I	95.3	Very high	97.6	Very high	37 Å²	37	61.9 Å²	61.9	19%	0.19	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-62.7	119.6	-176.4	-54.1	-55.9	0	0	0	110	A160 N183 Y187	A160-I162 HydrophobicContact CB-CD1 3.8Å; A160-I162 HydrophobicContact CB-CG1 3.86Å; A160-I162 PolarHBondContact O-N 3.27Å; A160-I162 VanDerWaalsContact O-N 3.14Å; I162-N183 HydrophobicContact CG2-CB 3.87Å; I162-Y187 HydrophobicContact CD1-CD2 4.15Å; I162-Y187 HydrophobicContact CD1-CE2 3.4Å; I162-Y187 HydrophobicContact CG1-CD2 4.05Å; I162-Y187 HydrophobicContact CG1-CE2 3.73Å
163	P	94.4	Very high	97.6	Very high	69 Å²	69	64 Å²	64	45%	0.448	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-72.3	150.4	-179.6	30.2	-34.4	0	0	0	111.1	Q161	Q161-P163 WeakPolarHBondContact O-CD 3.49Å
164	S	97.1	Very high	97.6	Very high	33 Å²	33	67.4 Å²	67.4	23%	0.231	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-71.9	143.8	161.4	-54.7	0	0	0	0	108.8	F191 E193 K378	S164-F191 WeakPolarHBondContact OG-CB 3.31Å; S164-E193 VanDerWaalsContact CB-CD 3.4Å; S164-E193 WeakPolarHBondContact CB-OE1 3.45Å; S164-E193 PolarHBondContact OG-OE1 3.31Å; S164-K378 PolarHBondContact OG-NZ 2.87Å
165	V	98.2	Very high	97.5	Very high	5 Å²	5	74.2 Å²	74.2	3%	0.03	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	138.5	173.7	-175.7	0	0	0	0	109.2	F170 E179 F180 F191 V192 E193	V165-F170 HydrophobicContact CG1-CB 3.92Å; V165-E179 HydrophobicContact CG2-CG 4.24Å; V165-F180 HydrophobicContact CB-CB 4.46Å; V165-F180 HydrophobicContact CG2-CB 3.91Å; V165-F180 HydrophobicContact CG2-CD2 4.49Å; V165-F191 PolarHBondContact N-O 3.34Å; V165-V192 CarbonylContact O-C 3.49Å; V165-V192 VanDerWaalsContact O-CA 3.26Å; V165-V192 WeakPolarHBondContact O-CA 3.46Å; V165-E193 PolarHBondContact O-N 2.89Å
166	D	98.4	Very high	97.5	Very high	63 Å²	63	68.8 Å²	68.8	34%	0.337	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	138.1	174.2	176.5	-96.6	0	0	0	111.3	R168 S169 F170 N194	D166-R168 VanDerWaalsContact C-N 3.28Å; D166-R168 PolarHBondContact O-N 2.92Å; D166-R168 WeakPolarHBondContact OD1-CA 3.36Å; D166-R168 WeakPolarHBondContact OD1-CB 3.28Å; D166-R168 PolarHBondContact OD1-N 2.88Å; D166-S169 PolarHBondContact O-N 3.44Å; D166-S169 PolarHBondContact OD1-N 3.36Å; D166-F170 WeakPolarHBondContact O-CB 3.48Å; D166-F170 PolarHBondContact O-N 3.37Å; D166-N194 PolarHBondContact OD2-ND2 3.03Å
167	C	98.3	Very high	97.5	Very high	12 Å²	12	66 Å²	66	8%	0.081	33%	0.327	C	S	.	.	H	α-helix	trans	-51.9	-43.9	-178.6	-177.1	0	0	0	0	112.9	F170 L171 V192 E193 N194 V195	C167-F170 PolarHBondContact O-N 3.43Å; C167-L171 WeakPolarHBondContact O-CB 3.29Å; C167-L171 WeakPolarHBondContact O-CG 3.33Å; C167-L171 PolarHBondContact O-N 3.1Å; C167-V192 HydrophobicContact CB-CG1 4.08Å; C167-E193 VanDerWaalsContact CB-O 3.24Å; C167-E193 WeakPolarHBondContact CB-O 3.35Å; C167-E193 PolarHBondContact N-O 2.76Å; C167-N194 WeakPolarHBondContact CB-O 3.35Å; C167-V195 HydrophobicContact CB-CG2 4.16Å
168	R	98.1	Very high	97.5	Very high	167 Å²	167	68.8 Å²	68.8	63%	0.63	34%	0.339	S	S	*	.	H	α-helix	trans	-68.3	-46.7	-178.6	-170.6	-176.8	176.4	-178.6	-0.8	111	D166 F170 L171 E172	D166-R168 VanDerWaalsContact C-N 3.28Å; D166-R168 PolarHBondContact O-N 2.92Å; D166-R168 WeakPolarHBondContact OD1-CA 3.36Å; D166-R168 WeakPolarHBondContact OD1-CB 3.28Å; D166-R168 PolarHBondContact OD1-N 2.88Å; R168-F170 VanDerWaalsContact C-N 3.3Å; R168-F170 PolarHBondContact O-N 3.16Å; R168-L171 PolarHBondContact O-N 2.88Å; R168-E172 VanDerWaalsContact CG-CD 3.4Å; R168-E172 HydrophobicContact CG-CG 4.14Å; R168-E172 VanDerWaalsContact CG-OE2 3.32Å; R168-E172 WeakPolarHBondContact CG-OE2 3.29Å; R168-E172 IonicContact CZ-OE2 3.58Å; R168-E172 IonicContact NE-OE1 2.78Å; R168-E172 IonicContact NE-OE2 3.44Å; R168-E172 PolarHBondContact NE-OE2 3.38Å; R168-E172 IonicContact NH2-OE2 3.3Å; R168-E172 PolarHBondContact NH2-OE2 3.49Å; R168-E172 VanDerWaalsContact O-CB 3.29Å; R168-E172 WeakPolarHBondContact O-CB 3.29Å; R168-E172 WeakPolarHBondContact O-CG 3.43Å; R168-E172 PolarHBondContact O-N 3Å
169	S	98.1	Very high	97.5	Very high	43 Å²	43	65.7 Å²	65.7	30%	0.301	33%	0.331	S	S	.	.	H	α-helix	trans	-57.6	-45.2	176.1	-175.3	0	0	0	0	111.5	D166 T173 G176	D166-S169 PolarHBondContact O-N 3.44Å; D166-S169 PolarHBondContact OD1-N 3.36Å; S169-T173 PolarHBondContact O-N 3.13Å; S169-T173 VanDerWaalsContact O-N 3.12Å; S169-T173 PolarHBondContact O-OG1 3.1Å; S169-G176 WeakPolarHBondContact OG-CA 3.34Å
170	F	98.3	Very high	97.5	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.8	-42.8	178.4	172.4	-87.7	0	0	0	113.1	V165 D166 C167 R168 L177 F180 V192 L205 R208 I209	V165-F170 HydrophobicContact CG1-CB 3.92Å; D166-F170 WeakPolarHBondContact O-CB 3.48Å; D166-F170 PolarHBondContact O-N 3.37Å; C167-F170 PolarHBondContact O-N 3.43Å; R168-F170 VanDerWaalsContact C-N 3.3Å; R168-F170 PolarHBondContact O-N 3.16Å; F170-L177 HydrophobicContact CD2-CD1 4.25Å; F170-L177 HydrophobicContact CE2-CD1 3.75Å; F170-L177 HydrophobicContact CZ-CD1 4.21Å; F170-F180 HydrophobicContact CD2-CB 3.79Å; F170-F180 HydrophobicContact CD2-CD1 4.3Å; F170-F180 AromaticContact CD2-CD2 3.98Å; F170-F180 HydrophobicContact CD2-CD2 3.98Å; F170-F180 AromaticContact CD2-CG 3.74Å; F170-F180 HydrophobicContact CD2-CG 3.74Å; F170-F180 HydrophobicContact CE2-CB 4.03Å; F170-F180 AromaticContact CE2-CD1 3.67Å; F170-F180 HydrophobicContact CE2-CD1 3.67Å; F170-F180 AromaticContact CE2-CD2 3.9Å; F170-F180 HydrophobicContact CE2-CD2 3.9Å; F170-F180 HydrophobicContact CE2-CE1 4.13Å; F170-F180 HydrophobicContact CE2-CE2 4.29Å; F170-F180 AromaticContact CE2-CG 3.56Å; F170-F180 HydrophobicContact CE2-CG 3.56Å; F170-F180 HydrophobicContact CE2-CZ 4.4Å; F170-V192 HydrophobicContact CB-CG1 4.33Å; F170-V192 HydrophobicContact CD2-CG2 3.98Å; F170-V192 HydrophobicContact CE2-CG2 4.18Å; F170-V192 HydrophobicContact CG-CG1 4.42Å; F170-V192 HydrophobicContact CG-CG2 4.18Å; F170-L205 HydrophobicContact CD1-CD2 3.38Å; F170-L205 HydrophobicContact CE1-CB 4.27Å; F170-L205 HydrophobicContact CE1-CD2 3.45Å; F170-L205 VanDerWaalsContact CE1-CD2 3.45Å; F170-L205 HydrophobicContact CE1-CG 4.47Å; F170-L205 WeakPolarHBondContact CE1-O 3.25Å; F170-L205 HydrophobicContact CG-CD2 4.42Å; F170-R208 HydrophobicContact CD1-CG 4.31Å; F170-R208 HydrophobicContact CE1-CB 3.79Å; F170-R208 HydrophobicContact CE1-CG 3.81Å; F170-R208 HydrophobicContact CZ-CB 4.28Å; F170-R208 HydrophobicContact CZ-CG 4.26Å; F170-I209 HydrophobicContact CE1-CG1 4.5Å; F170-I209 HydrophobicContact CE2-CD1 3.75Å; F170-I209 HydrophobicContact CE2-CG1 3.97Å; F170-I209 HydrophobicContact CZ-CD1 3.54Å; F170-I209 HydrophobicContact CZ-CG1 3.44Å; F170-I209 VanDerWaalsContact CZ-CG1 3.44Å
171	L	98.3	Very high	97.6	Very high	50 Å²	50	58 Å²	58	26%	0.262	29%	0.289	S	S	.	.	H	α-helix	trans	-77.8	-42.4	-178.3	-71.8	176.6	0	0	0	112.7	C167 R168 I204 L205 R208	C167-L171 WeakPolarHBondContact O-CB 3.29Å; C167-L171 WeakPolarHBondContact O-CG 3.33Å; C167-L171 PolarHBondContact O-N 3.1Å; R168-L171 PolarHBondContact O-N 2.88Å; L171-I204 HydrophobicContact CD1-CG2 4.12Å; L171-I204 HydrophobicContact CD2-CG2 3.89Å; L171-L205 HydrophobicContact CD1-CD2 4.3Å; L171-L205 HydrophobicContact CD2-CD2 3.92Å; L171-L205 HydrophobicContact CG-CD2 3.99Å; L171-R208 HydrophobicContact CD2-CB 3.91Å; L171-R208 HydrophobicContact CD2-CG 4.14Å; L171-R208 PolarHBondContact O-NE 3.33Å; L171-R208 VanDerWaalsContact O-NE 3.17Å
172	E	97.9	Very high	97.7	Very high	131 Å²	131	54.6 Å²	54.6	61%	0.612	27%	0.273	S	S	*	.	H	α-helix	trans	-97.6	-10.8	-165.6	-61.1	-179	-178.1	0	0	114.2	R168	R168-E172 VanDerWaalsContact CG-CD 3.4Å; R168-E172 HydrophobicContact CG-CG 4.14Å; R168-E172 VanDerWaalsContact CG-OE2 3.32Å; R168-E172 WeakPolarHBondContact CG-OE2 3.29Å; R168-E172 IonicContact CZ-OE2 3.58Å; R168-E172 IonicContact NE-OE1 2.78Å; R168-E172 IonicContact NE-OE2 3.44Å; R168-E172 PolarHBondContact NE-OE2 3.38Å; R168-E172 IonicContact NH2-OE2 3.3Å; R168-E172 PolarHBondContact NH2-OE2 3.49Å; R168-E172 VanDerWaalsContact O-CB 3.29Å; R168-E172 WeakPolarHBondContact O-CB 3.29Å; R168-E172 WeakPolarHBondContact O-CG 3.43Å; R168-E172 PolarHBondContact O-N 3Å
173	T	98.1	Very high	97.8	Very high	45 Å²	45	53.8 Å²	53.8	28%	0.276	27%	0.269	S	S	.	.			trans	-131	151	-176.2	74.8	0	0	0	0	112.9	S169 G176 L177 R208	S169-T173 PolarHBondContact O-N 3.13Å; S169-T173 VanDerWaalsContact O-N 3.12Å; S169-T173 PolarHBondContact O-OG1 3.1Å; T173-G176 PolarHBondContact OG1-N 2.94Å; T173-L177 PolarHBondContact O-N 3.38Å; T173-R208 PolarHBondContact O-NH2 3Å
174	D	97.7	Very high	97.9	Very high	91 Å²	91	50.8 Å²	50.8	49%	0.487	25%	0.249	S	C	.	.	H	α-helix	trans	-78.4	-29	173	-78.6	-13.6	0	0	0	111.3	K178 R208 L417	D174-K178 WeakPolarHBondContact O-CB 3.4Å; D174-K178 PolarHBondContact O-N 3.02Å; D174-R208 IonicContact OD1-NH2 2.98Å; D174-R208 PolarHBondContact OD1-NH2 3.04Å; D174-R208 VanDerWaalsContact OD1-NH2 3.07Å; D174-L417 HydrophobicContact CB-CD2 4.03Å
175	E	97.7	Very high	97.9	Very high	145 Å²	145	50.2 Å²	50.2	68%	0.678	24%	0.243	S	C	*	.	H	α-helix	trans	-63.1	-47.9	174.8	-67.5	71.6	-158.6	0	0	111.4	K178 E179	E175-K178 PolarHBondContact O-N 3.36Å; E175-E179 WeakPolarHBondContact O-CB 3.49Å; E175-E179 PolarHBondContact O-N 3.41Å
176	G	97.9	Very high	97.9	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-64.6	-42.8	177.8	0	0	0	0	0	112.7	S169 T173 F180	S169-G176 WeakPolarHBondContact OG-CA 3.34Å; T173-G176 PolarHBondContact OG1-N 2.94Å; G176-F180 WeakPolarHBondContact O-CB 3.38Å; G176-F180 PolarHBondContact O-N 3.1Å
177	L	98.1	Very high	97.9	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.8	-41.3	174.3	177.6	59.7	0	0	0	111.8	F170 T173 F180 L181 I209 T413 L417	F170-L177 HydrophobicContact CD2-CD1 4.25Å; F170-L177 HydrophobicContact CE2-CD1 3.75Å; F170-L177 HydrophobicContact CZ-CD1 4.21Å; T173-L177 PolarHBondContact O-N 3.38Å; L177-F180 WeakPolarHBondContact O-CB 3.25Å; L177-F180 PolarHBondContact O-N 2.85Å; L177-L181 HydrophobicContact CD1-CD1 3.93Å; L177-L181 HydrophobicContact CD1-CG 4.08Å; L177-L181 HydrophobicContact CD2-CD1 4.49Å; L177-L181 HydrophobicContact CG-CD1 3.91Å; L177-L181 HydrophobicContact CG-CG 4.46Å; L177-L181 WeakPolarHBondContact O-CB 3.43Å; L177-L181 WeakPolarHBondContact O-CG 3.13Å; L177-L181 PolarHBondContact O-N 2.95Å; L177-I209 HydrophobicContact CD1-CG1 4.02Å; L177-T413 HydrophobicContact CD2-CG2 4Å; L177-L417 HydrophobicContact CB-CD1 4.44Å; L177-L417 HydrophobicContact CD2-CD1 3.85Å; L177-L417 HydrophobicContact CG-CD1 3.85Å
178	K	97.8	Very high	97.9	Very high	77 Å²	77	49.4 Å²	49.4	34%	0.335	24%	0.236	S	C	.	.	H	α-helix	trans	-65.4	-42.4	178.2	-177.5	172.3	-179.9	160	0	111.8	D174 E175 F180 L181 Q182 L417 L419	D174-K178 WeakPolarHBondContact O-CB 3.4Å; D174-K178 PolarHBondContact O-N 3.02Å; E175-K178 PolarHBondContact O-N 3.36Å; K178-F180 VanDerWaalsContact C-N 3.35Å; K178-L181 PolarHBondContact O-N 3.15Å; K178-Q182 VanDerWaalsContact O-CB 3.24Å; K178-Q182 WeakPolarHBondContact O-CB 3.46Å; K178-Q182 PolarHBondContact O-N 2.56Å; K178-L417 HydrophobicContact CB-CD1 4.34Å; K178-L417 HydrophobicContact CD-CB 4.49Å; K178-L417 WeakPolarHBondContact CE-O 3.46Å; K178-L417 HydrophobicContact CG-CB 4.49Å; K178-L417 PolarHBondContact NZ-O 3.47Å; K178-L419 HydrophobicContact CD-CD2 4.46Å; K178-L419 HydrophobicContact CG-CD1 4.22Å; K178-L419 HydrophobicContact CG-CD2 3.94Å; K178-L419 HydrophobicContact CG-CG 4.16Å
179	E	97.8	Very high	97.9	Very high	81 Å²	81	41.4 Å²	41.4	38%	0.379	21%	0.206	S	C	.	.	H	α-helix	trans	-58.8	-48	173.6	-178	-177.2	167	0	0	110.7	V165 E175 L181 Q182 N183	V165-E179 HydrophobicContact CG2-CG 4.24Å; E175-E179 WeakPolarHBondContact O-CB 3.49Å; E175-E179 PolarHBondContact O-N 3.41Å; E179-L181 PolarHBondContact O-N 2.71Å; E179-Q182 PolarHBondContact O-N 2.79Å; E179-N183 PolarHBondContact O-N 3.07Å; E179-N183 PolarHBondContact O-ND2 3.16Å
180	F	98.3	Very high	97.9	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.009	19%	0.193	C	C	.	.	H	α-helix	trans	-56.6	-52.2	175.9	174.6	-85.2	0	0	0	111.6	V165 F170 G176 L177 K178 Q182 N183 F184 A190 V192 I209 F381	V165-F180 HydrophobicContact CB-CB 4.46Å; V165-F180 HydrophobicContact CG2-CB 3.91Å; V165-F180 HydrophobicContact CG2-CD2 4.49Å; F170-F180 HydrophobicContact CD2-CB 3.79Å; F170-F180 HydrophobicContact CD2-CD1 4.3Å; F170-F180 AromaticContact CD2-CD2 3.98Å; F170-F180 HydrophobicContact CD2-CD2 3.98Å; F170-F180 AromaticContact CD2-CG 3.74Å; F170-F180 HydrophobicContact CD2-CG 3.74Å; F170-F180 HydrophobicContact CE2-CB 4.03Å; F170-F180 AromaticContact CE2-CD1 3.67Å; F170-F180 HydrophobicContact CE2-CD1 3.67Å; F170-F180 AromaticContact CE2-CD2 3.9Å; F170-F180 HydrophobicContact CE2-CD2 3.9Å; F170-F180 HydrophobicContact CE2-CE1 4.13Å; F170-F180 HydrophobicContact CE2-CE2 4.29Å; F170-F180 AromaticContact CE2-CG 3.56Å; F170-F180 HydrophobicContact CE2-CG 3.56Å; F170-F180 HydrophobicContact CE2-CZ 4.4Å; G176-F180 WeakPolarHBondContact O-CB 3.38Å; G176-F180 PolarHBondContact O-N 3.1Å; L177-F180 WeakPolarHBondContact O-CB 3.25Å; L177-F180 PolarHBondContact O-N 2.85Å; K178-F180 VanDerWaalsContact C-N 3.35Å; F180-Q182 PolarHBondContact O-N 3.25Å; F180-N183 PolarHBondContact O-N 3.13Å; F180-F184 HydrophobicContact CE1-CB 4.14Å; F180-F184 HydrophobicContact CE1-CG 4.43Å; F180-F184 VanDerWaalsContact O-CB 3.31Å; F180-F184 WeakPolarHBondContact O-CB 3.22Å; F180-F184 PolarHBondContact O-N 2.88Å; F180-A190 HydrophobicContact CD2-CB 3.82Å; F180-A190 HydrophobicContact CE1-CB 4.39Å; F180-A190 HydrophobicContact CE2-CB 3.42Å; F180-A190 VanDerWaalsContact CE2-CB 3.42Å; F180-A190 HydrophobicContact CG-CB 4.47Å; F180-A190 HydrophobicContact CZ-CB 3.74Å; F180-V192 HydrophobicContact CD2-CG2 3.73Å; F180-V192 HydrophobicContact CE2-CG2 3.61Å; F180-I209 HydrophobicContact CD1-CD1 3.85Å; F180-I209 HydrophobicContact CE1-CD1 3.29Å; F180-I209 HydrophobicContact CZ-CD1 3.94Å; F180-F381 HydrophobicContact CE1-CG 4.46Å; F180-F381 AromaticContact CE2-CD2 3.84Å; F180-F381 HydrophobicContact CE2-CD2 3.84Å; F180-F381 HydrophobicContact CE2-CE2 4.29Å; F180-F381 HydrophobicContact CE2-CG 4.22Å; F180-F381 HydrophobicContact CZ-CB 3.75Å; F180-F381 AromaticContact CZ-CD1 3.96Å; F180-F381 HydrophobicContact CZ-CD1 3.96Å; F180-F381 AromaticContact CZ-CD2 3.57Å; F180-F381 HydrophobicContact CZ-CD2 3.57Å; F180-F381 HydrophobicContact CZ-CE1 4.45Å; F180-F381 HydrophobicContact CZ-CE2 4.12Å; F180-F381 AromaticContact CZ-CG 3.5Å; F180-F381 HydrophobicContact CZ-CG 3.5Å
181	L	98.1	Very high	97.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.9	-38.7	-176.9	-78.6	171.1	0	0	0	112.2	L177 K178 E179 N183 F184 L185 I209 V410 T413 A414 L417 L419	L177-L181 HydrophobicContact CD1-CD1 3.93Å; L177-L181 HydrophobicContact CD1-CG 4.08Å; L177-L181 HydrophobicContact CD2-CD1 4.49Å; L177-L181 HydrophobicContact CG-CD1 3.91Å; L177-L181 HydrophobicContact CG-CG 4.46Å; L177-L181 WeakPolarHBondContact O-CB 3.43Å; L177-L181 WeakPolarHBondContact O-CG 3.13Å; L177-L181 PolarHBondContact O-N 2.95Å; K178-L181 PolarHBondContact O-N 3.15Å; E179-L181 PolarHBondContact O-N 2.71Å; L181-N183 VanDerWaalsContact C-N 3.35Å; L181-N183 PolarHBondContact O-N 2.83Å; L181-F184 PolarHBondContact O-N 2.95Å; L181-L185 WeakPolarHBondContact O-CB 3.11Å; L181-L185 WeakPolarHBondContact O-CG 3.27Å; L181-L185 PolarHBondContact O-N 2.93Å; L181-I209 HydrophobicContact CD2-CG2 3.74Å; L181-V410 HydrophobicContact CD2-CG1 3.8Å; L181-T413 HydrophobicContact CD1-CG2 3.92Å; L181-A414 HydrophobicContact CD1-CB 4.23Å; L181-L417 HydrophobicContact CD1-CD1 3.81Å; L181-L419 HydrophobicContact CB-CD1 3.58Å
182	Q	97	Very high	97.9	Very high	94 Å²	94	37.9 Å²	37.9	44%	0.439	18%	0.184	S	C	.	.	H	α-helix	trans	-60.8	-46.5	175.7	-179.1	174.7	-19.5	0	0	110.8	K178 E179 F180 L186 L419	K178-Q182 VanDerWaalsContact O-CB 3.24Å; K178-Q182 WeakPolarHBondContact O-CB 3.46Å; K178-Q182 PolarHBondContact O-N 2.56Å; E179-Q182 PolarHBondContact O-N 2.79Å; F180-Q182 PolarHBondContact O-N 3.25Å; Q182-L186 HydrophobicContact CG-CD1 4.06Å; Q182-L186 WeakPolarHBondContact O-CB 3.36Å; Q182-L186 VanDerWaalsContact O-CG 3.24Å; Q182-L186 WeakPolarHBondContact O-CG 3.25Å; Q182-L186 PolarHBondContact O-N 2.77Å; Q182-L186 VanDerWaalsContact O-N 3.07Å; Q182-L419 HydrophobicContact CB-CD1 4.27Å; Q182-L419 HydrophobicContact CB-CD2 4.05Å; Q182-L419 HydrophobicContact CG-CD2 4.42Å
183	N	97.2	Very high	97.9	Very high	20 Å²	20	35 Å²	35	11%	0.107	17%	0.17	C	C	.	.	H	α-helix	trans	-64.8	-45.2	176.8	-70.5	-28	0	0	0	111.4	I162 E179 F180 L181 L185 L186 Y187	I162-N183 HydrophobicContact CG2-CB 3.87Å; E179-N183 PolarHBondContact O-N 3.07Å; E179-N183 PolarHBondContact O-ND2 3.16Å; F180-N183 PolarHBondContact O-N 3.13Å; L181-N183 VanDerWaalsContact C-N 3.35Å; L181-N183 PolarHBondContact O-N 2.83Å; N183-L185 PolarHBondContact O-N 3.32Å; N183-L186 PolarHBondContact O-N 3.33Å; N183-Y187 WeakPolarHBondContact O-CD2 3.45Å; N183-Y187 PolarHBondContact O-N 2.99Å
184	F	98.2	Very high	97.8	Very high	6 Å²	6	38.2 Å²	38.2	3%	0.026	19%	0.186	C	C	.	.	H	α-helix	trans	-60.1	-45.7	178.4	179.5	-101	0	0	0	112.2	F180 L181 G188 A190 I254 F381 D383 V410	F180-F184 HydrophobicContact CE1-CB 4.14Å; F180-F184 HydrophobicContact CE1-CG 4.43Å; F180-F184 VanDerWaalsContact O-CB 3.31Å; F180-F184 WeakPolarHBondContact O-CB 3.22Å; F180-F184 PolarHBondContact O-N 2.88Å; L181-F184 PolarHBondContact O-N 2.95Å; F184-G188 WeakPolarHBondContact O-CA 3.42Å; F184-G188 PolarHBondContact O-N 3.21Å; F184-A190 HydrophobicContact CB-CB 3.8Å; F184-A190 HydrophobicContact CD2-CB 4.19Å; F184-I254 HydrophobicContact CE1-CG1 3.97Å; F184-I254 HydrophobicContact CE2-CG2 4.16Å; F184-I254 HydrophobicContact CZ-CB 4.35Å; F184-I254 HydrophobicContact CZ-CG1 3.59Å; F184-I254 HydrophobicContact CZ-CG2 3.86Å; F184-F381 HydrophobicContact CD2-CB 4.09Å; F184-F381 HydrophobicContact CE2-CB 3.99Å; F184-D383 HydrophobicContact CE1-CB 4.47Å; F184-D383 HydrophobicContact CE2-CB 4.26Å; F184-D383 HydrophobicContact CZ-CB 3.79Å; F184-V410 HydrophobicContact CD1-CG1 4.34Å; F184-V410 HydrophobicContact CE1-CG1 4.14Å
185	L	97.1	Very high	97.8	Very high	22 Å²	22	34 Å²	34	12%	0.115	16%	0.164	C	C	.	.	H	α-helix	trans	-67.9	-40.8	179.6	-69.3	170.3	0	0	0	112	L181 N183 L411 A414 L419 A421	L181-L185 WeakPolarHBondContact O-CB 3.11Å; L181-L185 WeakPolarHBondContact O-CG 3.27Å; L181-L185 PolarHBondContact O-N 2.93Å; N183-L185 PolarHBondContact O-N 3.32Å; L185-L411 HydrophobicContact CD2-CD2 3.58Å; L185-A414 HydrophobicContact CD1-CB 3.67Å; L185-L419 HydrophobicContact CD1-CB 4.4Å; L185-L419 HydrophobicContact CD1-CD1 4.26Å; L185-A421 HydrophobicContact CD1-CB 3.54Å; L185-A421 HydrophobicContact CD2-CB 4.26Å
186	L	97.3	Very high	97.8	Very high	40 Å²	40	29.8 Å²	29.8	21%	0.209	15%	0.149	C	C	.	.	H	α-helix	trans	-66	-45.3	-179.8	-74.3	172.9	0	0	0	112.1	R149 I150 Q182 N183 R386	R149-L186 WeakPolarHBondContact CA-O 3.44Å; I150-L186 HydrophobicContact CD1-CD2 4.47Å; I150-L186 HydrophobicContact CG1-CD2 4.44Å; I150-L186 PolarHBondContact N-O 2.94Å; Q182-L186 HydrophobicContact CG-CD1 4.06Å; Q182-L186 WeakPolarHBondContact O-CB 3.36Å; Q182-L186 VanDerWaalsContact O-CG 3.24Å; Q182-L186 WeakPolarHBondContact O-CG 3.25Å; Q182-L186 PolarHBondContact O-N 2.77Å; Q182-L186 VanDerWaalsContact O-N 3.07Å; N183-L186 PolarHBondContact O-N 3.33Å; L186-R386 PolarHBondContact O-NH1 3.24Å
187	Y	98.3	Very high	97.7	Very high	22 Å²	22	32.8 Å²	32.8	9%	0.086	17%	0.168	C	C	.	.	H	α-helix	trans	-108.2	-10.3	-171	-63.7	-84.3	0	0	0	114.4	I150 W152 Y157 A160 I162 N183 I189	I150-Y187 HydrophobicContact CB-CD1 4.29Å; I150-Y187 HydrophobicContact CB-CE1 3.87Å; I150-Y187 HydrophobicContact CD1-CE1 4.1Å; I150-Y187 HydrophobicContact CD1-CE2 4.17Å; I150-Y187 VanDerWaalsContact CD1-OH 3.25Å; I150-Y187 WeakPolarHBondContact CD1-OH 3.48Å; I150-Y187 HydrophobicContact CG2-CD1 4.38Å; I150-Y187 HydrophobicContact CG2-CE1 3.72Å; W152-Y187 AromaticContact CD1-CD1 3.75Å; W152-Y187 HydrophobicContact CG-CD1 4.4Å; W152-Y187 PolarHBondContact NE1-O 3.08Å; Y157-Y187 AromaticContact CD2-CD1 3.85Å; Y157-Y187 HydrophobicContact CD2-CD1 3.85Å; Y157-Y187 HydrophobicContact CD2-CG 4.28Å; Y157-Y187 HydrophobicContact CE2-CD1 4.1Å; Y157-Y187 HydrophobicContact CE2-CG 4.05Å; A160-Y187 HydrophobicContact CB-CE1 4.13Å; A160-Y187 WeakPolarHBondContact CB-OH 3.46Å; I162-Y187 HydrophobicContact CD1-CD2 4.15Å; I162-Y187 HydrophobicContact CD1-CE2 3.4Å; I162-Y187 HydrophobicContact CG1-CD2 4.05Å; I162-Y187 HydrophobicContact CG1-CE2 3.73Å; N183-Y187 WeakPolarHBondContact O-CD2 3.45Å; N183-Y187 PolarHBondContact O-N 2.99Å; Y187-I189 PolarHBondContact O-N 2.86Å
188	G	98.3	Very high	97.6	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	S	Bend	trans	70.9	3.9	-175.3	0	0	0	0	0	114.2	F184 D383	F184-G188 WeakPolarHBondContact O-CA 3.42Å; F184-G188 PolarHBondContact O-N 3.21Å; G188-D383 WeakPolarHBondContact O-CB 3.05Å; G188-D383 PolarHBondContact O-N 2.9Å
189	I	98.5	Very high	97.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	147.4	171	56.3	174.9	0	0	0	110	W152 Y157 Y187 L271 L370 L380 F381 I382 V387	W152-I189 HydrophobicContact CH2-CD1 4.31Å; W152-I189 HydrophobicContact CZ2-CD1 3.99Å; W152-I189 HydrophobicContact CZ2-CG1 4.32Å; Y157-I189 HydrophobicContact CD2-CD1 4.18Å; Y157-I189 HydrophobicContact CD2-CG1 4.47Å; Y157-I189 HydrophobicContact CE1-CD1 4.19Å; Y157-I189 HydrophobicContact CE2-CD1 3.5Å; Y157-I189 VanDerWaalsContact CE2-CD1 3.5Å; Y157-I189 HydrophobicContact CE2-CG1 3.55Å; Y187-I189 PolarHBondContact O-N 2.86Å; I189-L271 HydrophobicContact CD1-CD1 3.77Å; I189-L271 HydrophobicContact CG2-CD1 4.37Å; I189-L271 HydrophobicContact CG2-CD2 4.36Å; I189-L370 HydrophobicContact CD1-CD2 3.86Å; I189-L380 HydrophobicContact CB-CD1 4.21Å; I189-L380 HydrophobicContact CG2-CD1 4.37Å; I189-F381 VanDerWaalsContact CA-O 3.27Å; I189-F381 WeakPolarHBondContact CA-O 3.46Å; I189-I382 HydrophobicContact CG2-CB 4.45Å; I189-I382 HydrophobicContact CG2-CG1 4.28Å; I189-I382 HydrophobicContact CG2-CG2 4.21Å; I189-V387 HydrophobicContact CG2-CB 4.2Å; I189-V387 HydrophobicContact CG2-CG1 3.82Å; I189-V387 HydrophobicContact CG2-CG2 4.15Å
190	A	98.1	Very high	97.5	Very high	4 Å²	4	34.8 Å²	34.8	3%	0.033	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	158.1	172	0	0	0	0	0	110.5	F180 F184 F381	F180-A190 HydrophobicContact CD2-CB 3.82Å; F180-A190 HydrophobicContact CE1-CB 4.39Å; F180-A190 HydrophobicContact CE2-CB 3.42Å; F180-A190 VanDerWaalsContact CE2-CB 3.42Å; F180-A190 HydrophobicContact CG-CB 4.47Å; F180-A190 HydrophobicContact CZ-CB 3.74Å; F184-A190 HydrophobicContact CB-CB 3.8Å; F184-A190 HydrophobicContact CD2-CB 4.19Å; A190-F381 PolarHBondContact N-O 3.41Å; A190-F381 VanDerWaalsContact N-O 3.13Å; A190-F381 PolarHBondContact O-N 2.84Å
191	F	98.1	Very high	97.4	Very high	15 Å²	15	36.8 Å²	36.8	7%	0.066	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	141.5	-176.9	-61.6	-88.5	0	0	0	111	S164 V165 L271 V372 L374 K378 A379 L380	S164-F191 WeakPolarHBondContact OG-CB 3.31Å; V165-F191 PolarHBondContact N-O 3.34Å; F191-L271 HydrophobicContact CZ-CD1 4.39Å; F191-V372 HydrophobicContact CE1-CG1 4Å; F191-V372 HydrophobicContact CZ-CG1 4.08Å; F191-V372 HydrophobicContact CZ-CG2 4.23Å; F191-L374 HydrophobicContact CE1-CD2 4.21Å; F191-K378 HydrophobicContact CD1-CD 4.25Å; F191-K378 HydrophobicContact CD1-CG 4.23Å; F191-A379 VanDerWaalsContact CA-O 3.31Å; F191-A379 WeakPolarHBondContact CA-O 3.5Å; F191-L380 HydrophobicContact CD1-CB 3.95Å; F191-L380 HydrophobicContact CD1-CD1 3.99Å; F191-L380 HydrophobicContact CD1-CG 4.5Å; F191-L380 HydrophobicContact CE1-CB 3.87Å; F191-L380 HydrophobicContact CE1-CD1 3.54Å; F191-L380 HydrophobicContact CE1-CD2 4.22Å; F191-L380 HydrophobicContact CE1-CG 4.06Å; F191-L380 HydrophobicContact CE2-CD1 4.33Å; F191-L380 HydrophobicContact CZ-CD1 3.72Å
192	V	98.3	Very high	97.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	129.2	165.5	-172.9	0	0	0	0	108	V165 C167 F170 F180 V195 L205 K378 A379 F381	V165-V192 CarbonylContact O-C 3.49Å; V165-V192 VanDerWaalsContact O-CA 3.26Å; V165-V192 WeakPolarHBondContact O-CA 3.46Å; C167-V192 HydrophobicContact CB-CG1 4.08Å; F170-V192 HydrophobicContact CB-CG1 4.33Å; F170-V192 HydrophobicContact CD2-CG2 3.98Å; F170-V192 HydrophobicContact CE2-CG2 4.18Å; F170-V192 HydrophobicContact CG-CG1 4.42Å; F170-V192 HydrophobicContact CG-CG2 4.18Å; F180-V192 HydrophobicContact CD2-CG2 3.73Å; F180-V192 HydrophobicContact CE2-CG2 3.61Å; V192-V195 HydrophobicContact CB-CG2 4.14Å; V192-V195 HydrophobicContact CG1-CG2 3.78Å; V192-L205 HydrophobicContact CG1-CD1 4.4Å; V192-L205 HydrophobicContact CG1-CD2 4.05Å; V192-K378 WeakPolarHBondContact O-CA 3.43Å; V192-A379 PolarHBondContact N-O 3.39Å; V192-A379 PolarHBondContact O-N 2.9Å; V192-F381 HydrophobicContact CG2-CE2 4.08Å
193	E	97.3	Very high	97.4	Very high	69 Å²	69	34.2 Å²	34.2	32%	0.322	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	165.5	178.9	-79.7	-179	-166.4	0	0	111.8	S164 V165 C167 V195 G377 K378	S164-E193 VanDerWaalsContact CB-CD 3.4Å; S164-E193 WeakPolarHBondContact CB-OE1 3.45Å; S164-E193 PolarHBondContact OG-OE1 3.31Å; V165-E193 PolarHBondContact O-N 2.89Å; C167-E193 VanDerWaalsContact CB-O 3.24Å; C167-E193 WeakPolarHBondContact CB-O 3.35Å; C167-E193 PolarHBondContact N-O 2.76Å; E193-V195 VanDerWaalsContact C-N 3.26Å; E193-V195 PolarHBondContact O-N 2.99Å; E193-G377 CarbonylContact C-O 3.51Å; E193-G377 WeakPolarHBondContact CA-O 3.47Å; E193-K378 HydrophobicContact CG-CB 4.34Å; E193-K378 HydrophobicContact CG-CD 3.93Å; E193-K378 HydrophobicContact CG-CG 3.92Å; E193-K378 VanDerWaalsContact OE1-CE 3.3Å; E193-K378 WeakPolarHBondContact OE1-CE 3.31Å; E193-K378 IonicContact OE1-NZ 3.25Å; E193-K378 PolarHBondContact OE1-NZ 3.03Å
194	N	97.4	Very high	97.4	Very high	114 Å²	114	37.2 Å²	37.2	61%	0.61	20%	0.195	S	C	*	.	S	Bend	trans	61.3	31.6	-175.3	-52.3	-42.5	0	0	0	113.7	D166 C167 G377	D166-N194 PolarHBondContact OD2-ND2 3.03Å; C167-N194 WeakPolarHBondContact CB-O 3.35Å; N194-G377 PolarHBondContact N-O 3.36Å
195	V	97.7	Very high	97.4	Very high	2 Å²	2	37 Å²	37	1%	0.012	19%	0.194	C	C	.	.			trans	-82.8	124.7	174.8	-170.1	0	0	0	0	109.2	C167 V192 E193 D201 L205 H258 G377 A379	C167-V195 HydrophobicContact CB-CG2 4.16Å; V192-V195 HydrophobicContact CB-CG2 4.14Å; V192-V195 HydrophobicContact CG1-CG2 3.78Å; E193-V195 VanDerWaalsContact C-N 3.26Å; E193-V195 PolarHBondContact O-N 2.99Å; V195-D201 HydrophobicContact CG1-CB 4.24Å; V195-L205 HydrophobicContact CB-CD1 4.04Å; V195-L205 HydrophobicContact CG1-CD1 3.34Å; V195-L205 HydrophobicContact CG1-CG 4.21Å; V195-L205 HydrophobicContact CG2-CD1 3.5Å; V195-L205 VanDerWaalsContact CG2-CD1 3.5Å; V195-H258 VanDerWaalsContact CG1-CE1 3.42Å; V195-H258 WeakPolarHBondContact CG1-CE1 3.47Å; V195-G377 PolarHBondContact N-O 3.28Å; V195-G377 WeakPolarHBondContact O-CA 3.21Å; V195-A379 HydrophobicContact CG2-CB 4.25Å
196	P	97.6	Very high	97.4	Very high	57 Å²	57	36 Å²	36	37%	0.37	19%	0.189	S	C	.	.			trans	-56.8	130.8	173.8	-20.9	31.2	0	0	0	110.1	T198 D201 H258	P196-T198 PolarHBondContact O-N 2.87Å; P196-D201 HydrophobicContact CB-CB 4.27Å; P196-D201 WeakPolarHBondContact CB-OD2 3.43Å; P196-D201 HydrophobicContact CG-CB 4.43Å; P196-D201 WeakPolarHBondContact O-CB 3.39Å; P196-H258 PolarHBondContact O-CE1 3.12Å; P196-H258 VanDerWaalsContact O-CE1 3.28Å
197	P	96.1	Very high	97.4	Very high	64 Å²	64	38.5 Å²	38.5	42%	0.416	20%	0.2	S	C	.	.	S	Bend	trans	-77.4	64.2	-171.1	32.6	-36.6	0	0	0	111.7	L260 P376	P197-L260 HydrophobicContact CB-CD2 4.42Å; P197-P376 HydrophobicContact CB-CB 4.01Å; P197-P376 HydrophobicContact CG-CB 4.33Å
198	T	96	Very high	97.3	Very high	47 Å²	47	40.9 Å²	40.9	29%	0.288	21%	0.209	S	C	.	.	S	Bend	trans	-125.2	163.3	174.3	83.8	0	0	0	0	109.8	P196 E200 D201 T202	P196-T198 PolarHBondContact O-N 2.87Å; T198-E200 PolarHBondContact OG1-N 3Å; T198-D201 WeakPolarHBondContact OG1-CB 3.18Å; T198-D201 PolarHBondContact OG1-N 3.25Å; T198-D201 PolarHBondContact OG1-OD2 2.81Å; T198-T202 PolarHBondContact O-N 2.72Å; T198-T202 PolarHBondContact O-OG1 2.57Å
199	K	95.1	Very high	97.1	Very high	44 Å²	44	41.2 Å²	41.2	19%	0.191	21%	0.21	C	C	.	.	H	α-helix	trans	-77.5	-33	175.5	171.1	-96.8	-144.7	133.4	0	111.4	T202 E203 M220 Y222 C401	K199-T202 WeakPolarHBondContact O-CB 3.44Å; K199-T202 PolarHBondContact O-N 3.46Å; K199-T202 VanDerWaalsContact O-N 3.15Å; K199-E203 WeakPolarHBondContact O-CB 3.48Å; K199-E203 PolarHBondContact O-N 3.11Å; K199-M220 HydrophobicContact CD-CB 4.12Å; K199-M220 HydrophobicContact CD-CG 4.14Å; K199-M220 HydrophobicContact CG-CB 4.13Å; K199-M220 HydrophobicContact CG-CE 4.13Å; K199-M220 HydrophobicContact CG-CG 4.36Å; K199-Y222 HydrophobicContact CB-CD1 4.32Å; K199-Y222 HydrophobicContact CB-CE1 3.26Å; K199-Y222 VanDerWaalsContact CB-CZ 3.42Å; K199-Y222 WeakPolarHBondContact CB-OH 3.45Å; K199-Y222 HydrophobicContact CD-CE1 4.39Å; K199-Y222 HydrophobicContact CD-CE2 4.22Å; K199-Y222 WeakPolarHBondContact CD-OH 3.43Å; K199-Y222 WeakPolarHBondContact CE-OH 3.27Å; K199-Y222 HydrophobicContact CG-CE1 3.59Å; K199-Y222 HydrophobicContact CG-CE2 3.97Å; K199-Y222 WeakPolarHBondContact CG-OH 3.39Å; K199-Y222 PolarHBondContact NZ-OH 2.74Å; K199-C401 HydrophobicContact CB-CB 4.36Å
200	E	96.9	Very high	97	Very high	108 Å²	108	41.6 Å²	41.6	51%	0.505	21%	0.213	S	C	.	.	H	α-helix	trans	-60.5	-46.4	177.7	-63.7	64.5	-142.9	0	0	110.2	T198 T202 E203 I204	T198-E200 PolarHBondContact OG1-N 3Å; E200-T202 VanDerWaalsContact C-N 3.3Å; E200-T202 PolarHBondContact O-N 2.91Å; E200-E203 PolarHBondContact O-N 3.26Å; E200-I204 WeakPolarHBondContact O-CG1 3.44Å; E200-I204 PolarHBondContact O-N 3.05Å
201	D	97.3	Very high	96.8	Very high	45 Å²	45	46.9 Å²	46.9	24%	0.241	24%	0.24	C	C	.	.	H	α-helix	trans	-67.5	-30.9	175.7	-70.1	-79.7	0	0	0	112.6	V195 P196 T198 L205	V195-D201 HydrophobicContact CG1-CB 4.24Å; P196-D201 HydrophobicContact CB-CB 4.27Å; P196-D201 WeakPolarHBondContact CB-OD2 3.43Å; P196-D201 HydrophobicContact CG-CB 4.43Å; P196-D201 WeakPolarHBondContact O-CB 3.39Å; T198-D201 WeakPolarHBondContact OG1-CB 3.18Å; T198-D201 PolarHBondContact OG1-N 3.25Å; T198-D201 PolarHBondContact OG1-OD2 2.81Å; D201-L205 WeakPolarHBondContact O-CG 3.45Å; D201-L205 PolarHBondContact O-N 3.16Å; D201-L205 VanDerWaalsContact O-N 3.1Å
202	T	96.8	Very high	96.8	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-68.9	-39.8	174.4	-50.2	0	0	0	0	111.6	T198 K199 E200 L205 A206 M220 V256 H258 C401	T198-T202 PolarHBondContact O-N 2.72Å; T198-T202 PolarHBondContact O-OG1 2.57Å; K199-T202 WeakPolarHBondContact O-CB 3.44Å; K199-T202 PolarHBondContact O-N 3.46Å; K199-T202 VanDerWaalsContact O-N 3.15Å; E200-T202 VanDerWaalsContact C-N 3.3Å; E200-T202 PolarHBondContact O-N 2.91Å; T202-L205 PolarHBondContact O-N 2.71Å; T202-A206 WeakPolarHBondContact O-CB 3.35Å; T202-A206 PolarHBondContact O-N 2.89Å; T202-M220 HydrophobicContact CG2-CE 3.99Å; T202-V256 HydrophobicContact CG2-CG1 4.29Å; T202-H258 HydrophobicContact CG2-CB 3.84Å; T202-H258 PolarHBondContact OG1-ND1 2.94Å; T202-C401 PolarHBondContact OG1-SG 2.93Å
203	E	97.7	Very high	96.7	Very high	39 Å²	39	49 Å²	49	18%	0.182	25%	0.249	C	C	.	.	H	α-helix	trans	-64.5	-44.8	176	-178.6	158.4	-155.3	0	0	110.7	K199 E200 L205 A206 E207 I212 R219 M220	K199-E203 WeakPolarHBondContact O-CB 3.48Å; K199-E203 PolarHBondContact O-N 3.11Å; E200-E203 PolarHBondContact O-N 3.26Å; E203-L205 VanDerWaalsContact C-N 3.33Å; E203-L205 PolarHBondContact O-N 3.33Å; E203-A206 WeakPolarHBondContact O-CB 3.34Å; E203-A206 PolarHBondContact O-N 3.13Å; E203-A206 VanDerWaalsContact O-N 3.15Å; E203-E207 WeakPolarHBondContact O-CB 3.42Å; E203-E207 WeakPolarHBondContact O-CG 3.25Å; E203-E207 PolarHBondContact O-N 2.61Å; E203-I212 HydrophobicContact CB-CD1 4.47Å; E203-I212 HydrophobicContact CG-CD1 3.72Å; E203-R219 WeakPolarHBondContact OE1-CD 3.47Å; E203-R219 IonicContact OE1-CZ 2.65Å; E203-R219 IonicContact OE1-NE 3.71Å; E203-R219 PolarHBondContact OE1-NE 3.21Å; E203-R219 IonicContact OE1-NH2 2.99Å; E203-M220 HydrophobicContact CB-CE 4.1Å; E203-M220 HydrophobicContact CB-CG 4.3Å; E203-M220 HydrophobicContact CB-SD 3.99Å; E203-M220 HydrophobicContact CG-CG 4.35Å; E203-M220 HydrophobicContact CG-SD 4.21Å
204	I	98.1	Very high	96.6	Very high	84 Å²	84	52.2 Å²	52.2	43%	0.431	26%	0.264	S	S	.	.	H	α-helix	trans	-57.6	-44.4	174.6	-68.4	165.6	0	0	0	111.6	L171 E200 R208	L171-I204 HydrophobicContact CD1-CG2 4.12Å; L171-I204 HydrophobicContact CD2-CG2 3.89Å; E200-I204 WeakPolarHBondContact O-CG1 3.44Å; E200-I204 PolarHBondContact O-N 3.05Å; I204-R208 PolarHBondContact O-N 3.11Å
205	L	97.1	Very high	96.5	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-61.9	-44.2	175.9	-76.1	177.9	0	0	0	112.8	F170 L171 V192 V195 D201 T202 E203 R208 A379 F381	F170-L205 HydrophobicContact CD1-CD2 3.38Å; F170-L205 HydrophobicContact CE1-CB 4.27Å; F170-L205 HydrophobicContact CE1-CD2 3.45Å; F170-L205 VanDerWaalsContact CE1-CD2 3.45Å; F170-L205 HydrophobicContact CE1-CG 4.47Å; F170-L205 WeakPolarHBondContact CE1-O 3.25Å; F170-L205 HydrophobicContact CG-CD2 4.42Å; L171-L205 HydrophobicContact CD1-CD2 4.3Å; L171-L205 HydrophobicContact CD2-CD2 3.92Å; L171-L205 HydrophobicContact CG-CD2 3.99Å; V192-L205 HydrophobicContact CG1-CD1 4.4Å; V192-L205 HydrophobicContact CG1-CD2 4.05Å; V195-L205 HydrophobicContact CB-CD1 4.04Å; V195-L205 HydrophobicContact CG1-CD1 3.34Å; V195-L205 HydrophobicContact CG1-CG 4.21Å; V195-L205 HydrophobicContact CG2-CD1 3.5Å; V195-L205 VanDerWaalsContact CG2-CD1 3.5Å; D201-L205 WeakPolarHBondContact O-CG 3.45Å; D201-L205 PolarHBondContact O-N 3.16Å; D201-L205 VanDerWaalsContact O-N 3.1Å; T202-L205 PolarHBondContact O-N 2.71Å; E203-L205 VanDerWaalsContact C-N 3.33Å; E203-L205 PolarHBondContact O-N 3.33Å; L205-R208 WeakPolarHBondContact O-CB 3.33Å; L205-R208 PolarHBondContact O-N 3.27Å; L205-A379 HydrophobicContact CD1-CB 4.12Å; L205-F381 HydrophobicContact CB-CZ 4.44Å
206	A	97.5	Very high	96.3	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.9	-45.1	-178.9	0	0	0	0	0	111	T202 E203 R208 I209 S210 I212 C403 L405	T202-A206 WeakPolarHBondContact O-CB 3.35Å; T202-A206 PolarHBondContact O-N 2.89Å; E203-A206 WeakPolarHBondContact O-CB 3.34Å; E203-A206 PolarHBondContact O-N 3.13Å; E203-A206 VanDerWaalsContact O-N 3.15Å; A206-R208 VanDerWaalsContact C-N 3.29Å; A206-R208 PolarHBondContact O-N 3.44Å; A206-I209 PolarHBondContact O-N 3.3Å; A206-S210 PolarHBondContact O-N 2.75Å; A206-I212 HydrophobicContact CB-CD1 4Å; A206-I212 HydrophobicContact CB-CG1 3.96Å; A206-C403 VanDerWaalsContact CB-SG 3.58Å; A206-L405 HydrophobicContact CB-CD2 3.97Å
207	E	97.6	Very high	95.9	Very high	94 Å²	94	48.3 Å²	48.3	44%	0.439	24%	0.238	S	C	.	.	H	α-helix	trans	-67.6	-23.8	179.4	-71	179.8	162	0	0	113.8	E203 I209 S210 I212 R219	E203-E207 WeakPolarHBondContact O-CB 3.42Å; E203-E207 WeakPolarHBondContact O-CG 3.25Å; E203-E207 PolarHBondContact O-N 2.61Å; E207-I209 PolarHBondContact O-N 3.08Å; E207-S210 WeakPolarHBondContact CA-O 3.48Å; E207-I212 HydrophobicContact CG-CD1 3.86Å; E207-I212 HydrophobicContact CG-CG1 4.29Å; E207-R219 IonicContact OE1-CZ 3.95Å; E207-R219 IonicContact OE1-NH2 3.36Å; E207-R219 PolarHBondContact OE1-NH2 3.06Å
208	R	96.7	Very high	95.8	Very high	72 Å²	72	46.5 Å²	46.5	27%	0.272	23%	0.231	S	C	.	.	H	α-helix	trans	-62.4	-28.9	175.3	179.4	60.3	-179.2	108.7	-3	112.8	F170 L171 T173 D174 I204 L205 A206	F170-R208 HydrophobicContact CD1-CG 4.31Å; F170-R208 HydrophobicContact CE1-CB 3.79Å; F170-R208 HydrophobicContact CE1-CG 3.81Å; F170-R208 HydrophobicContact CZ-CB 4.28Å; F170-R208 HydrophobicContact CZ-CG 4.26Å; L171-R208 HydrophobicContact CD2-CB 3.91Å; L171-R208 HydrophobicContact CD2-CG 4.14Å; L171-R208 PolarHBondContact O-NE 3.33Å; L171-R208 VanDerWaalsContact O-NE 3.17Å; T173-R208 PolarHBondContact O-NH2 3Å; D174-R208 IonicContact OD1-NH2 2.98Å; D174-R208 PolarHBondContact OD1-NH2 3.04Å; D174-R208 VanDerWaalsContact OD1-NH2 3.07Å; I204-R208 PolarHBondContact O-N 3.11Å; L205-R208 WeakPolarHBondContact O-CB 3.33Å; L205-R208 PolarHBondContact O-N 3.27Å; A206-R208 VanDerWaalsContact C-N 3.29Å; A206-R208 PolarHBondContact O-N 3.44Å
209	I	93.7	Very high	95.7	Very high	6 Å²	6	48.3 Å²	48.3	3%	0.031	23%	0.232	C	C	.	.	H	α-helix	trans	-100.8	-43.4	-177	-41.8	-174.2	0	0	0	112.1	F170 L177 F180 L181 A206 E207 F381 V410 T413	F170-I209 HydrophobicContact CE1-CG1 4.5Å; F170-I209 HydrophobicContact CE2-CD1 3.75Å; F170-I209 HydrophobicContact CE2-CG1 3.97Å; F170-I209 HydrophobicContact CZ-CD1 3.54Å; F170-I209 HydrophobicContact CZ-CG1 3.44Å; F170-I209 VanDerWaalsContact CZ-CG1 3.44Å; L177-I209 HydrophobicContact CD1-CG1 4.02Å; F180-I209 HydrophobicContact CD1-CD1 3.85Å; F180-I209 HydrophobicContact CE1-CD1 3.29Å; F180-I209 HydrophobicContact CZ-CD1 3.94Å; L181-I209 HydrophobicContact CD2-CG2 3.74Å; A206-I209 PolarHBondContact O-N 3.3Å; E207-I209 PolarHBondContact O-N 3.08Å; I209-F381 HydrophobicContact CD1-CD1 4.13Å; I209-F381 HydrophobicContact CD1-CE1 3.73Å; I209-F381 HydrophobicContact CD1-CZ 4.26Å; I209-V410 HydrophobicContact CG2-CB 4.36Å; I209-V410 HydrophobicContact CG2-CG1 4.14Å; I209-V410 HydrophobicContact CG2-CG2 3.89Å; I209-T413 PolarHBondContact O-OG1 2.79Å
210	S	95.3	Very high	95.7	Very high	9 Å²	9	47 Å²	47	6%	0.063	23%	0.228	C	C	.	.	S	Bend	trans	-155.5	163.4	-162.8	-178.5	0	0	0	0	111.9	A206 E207 T406 D409	A206-S210 PolarHBondContact O-N 2.75Å; E207-S210 WeakPolarHBondContact CA-O 3.48Å; S210-T406 PolarHBondContact OG-O 2.88Å; S210-T406 PolarHBondContact OG-OG1 2.64Å; S210-T406 VanDerWaalsContact OG-OG1 3.12Å; S210-D409 VanDerWaalsContact OG-CB 3.3Å; S210-D409 WeakPolarHBondContact OG-CB 2.94Å
211	L	94.6	Very high	95.4	Very high	115 Å²	115	42.7 Å²	42.7	60%	0.602	21%	0.207	S	C	*	.			trans	-64.6	135.8	163	-57	178.4	0	0	0	110	R213	L211-R213 PolarHBondContact O-N 2.7Å
212	I	97.3	Very high	94.7	Very high	11 Å²	11	45 Å²	45	6%	0.056	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	122.7	168.5	-63.8	169.6	0	0	0	108.3	E203 A206 E207 E214 R219 M220 C403 L405	E203-I212 HydrophobicContact CB-CD1 4.47Å; E203-I212 HydrophobicContact CG-CD1 3.72Å; A206-I212 HydrophobicContact CB-CD1 4Å; A206-I212 HydrophobicContact CB-CG1 3.96Å; E207-I212 HydrophobicContact CG-CD1 3.86Å; E207-I212 HydrophobicContact CG-CG1 4.29Å; I212-E214 PolarHBondContact O-N 3.24Å; I212-R219 HydrophobicContact CB-CG 4.34Å; I212-R219 HydrophobicContact CG2-CG 3.7Å; I212-R219 WeakPolarHBondContact CG2-O 3.36Å; I212-M220 HydrophobicContact CD1-SD 3.76Å; I212-C403 HydrophobicContact CG2-CB 3.86Å; I212-L405 HydrophobicContact CB-CD2 4.48Å; I212-L405 HydrophobicContact CG1-CD2 3.91Å
213	R	96.7	Very high	93.6	Very high	49 Å²	49	45.9 Å²	45.9	19%	0.185	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	103.7	175.6	-176.1	169.1	178.2	172.2	-11	109.2	L211 T215 E250 Y404 T406	L211-R213 PolarHBondContact O-N 2.7Å; R213-T215 HydrophobicContact CG-CG2 4.29Å; R213-E250 PolarHBondContact NH1-O 3.25Å; R213-E250 IonicContact NH1-OE1 3.58Å; R213-E250 PolarHBondContact NH1-OE1 2.73Å; R213-E250 IonicContact NH1-OE2 2.8Å; R213-E250 PolarHBondContact NH2-O 2.8Å; R213-Y404 PolarHBondContact N-O 3.42Å; R213-T406 HydrophobicContact CB-CG2 4.15Å; R213-T406 HydrophobicContact CG-CG2 4.49Å
214	E	96.2	Very high	92.4	Very high	136 Å²	136	45.9 Å²	45.9	64%	0.636	22%	0.219	S	C	*	.			trans	-66.3	135.8	170.5	-174.4	160.9	-162.7	0	0	110.6	I212 R219	I212-E214 PolarHBondContact O-N 3.24Å; E214-R219 HydrophobicContact CB-CB 4.49Å; E214-R219 HydrophobicContact CG-CB 4.34Å
215	T	95	Very high	91.1	Very high	22 Å²	22	42.9 Å²	42.9	14%	0.135	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-133.4	-177.4	-177.1	66.2	0	0	0	0	110.4	R213 Y217 G218 F248 Y404	R213-T215 HydrophobicContact CG-CG2 4.29Å; T215-Y217 PolarHBondContact O-N 2.89Å; T215-Y217 PolarHBondContact OG1-N 3.4Å; T215-Y217 VanDerWaalsContact OG1-N 3.14Å; T215-G218 PolarHBondContact N-O 2.69Å; T215-G218 WeakPolarHBondContact O-CA 3.45Å; T215-G218 PolarHBondContact O-N 3.28Å; T215-F248 HydrophobicContact CG2-CE2 3.87Å; T215-F248 HydrophobicContact CG2-CZ 4.18Å; T215-Y404 HydrophobicContact CG2-CD2 3.9Å
216	I	92.7	Very high	89.8	Confident	49 Å²	49	46.8 Å²	46.8	25%	0.251	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-14.8	169.5	61.8	138.8	0	0	0	113.8	G218 Y301 N310 M312	I216-G218 VanDerWaalsContact C-N 3.32Å; I216-Y301 HydrophobicContact CD1-CD1 4.12Å; I216-Y301 HydrophobicContact CD1-CE1 3.64Å; I216-N310 HydrophobicContact CD1-CB 4.07Å; I216-N310 WeakPolarHBondContact CG2-OD1 3.35Å; I216-M312 HydrophobicContact CB-CE 4.47Å; I216-M312 HydrophobicContact CD1-CE 3.21Å; I216-M312 HydrophobicContact CG1-CE 3.62Å; I216-M312 HydrophobicContact CG1-SD 4.39Å; I216-M312 HydrophobicContact CG2-CE 4.15Å; I216-M312 HydrophobicContact CG2-SD 4.03Å
217	Y	90.6	Very high	88.3	Confident	20 Å²	20	53.8 Å²	53.8	8%	0.078	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	0.5	174.2	-57.8	-71.5	0	0	0	112.8	T215 D231 Y247 Y404	T215-Y217 PolarHBondContact O-N 2.89Å; T215-Y217 PolarHBondContact OG1-N 3.4Å; T215-Y217 VanDerWaalsContact OG1-N 3.14Å; Y217-D231 PolarHBondContact OH-OD2 3.16Å; Y217-Y247 WeakPolarHBondContact CE2-OH 3.48Å; Y217-Y247 PolarHBondContact OH-OH 2.99Å; Y217-Y404 HydrophobicContact CD2-CE2 4.24Å
218	G	92.5	Very high	86.6	Confident	25 Å²	25	52 Å²	52	26%	0.258	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	91.1	178.8	-173.3	0	0	0	0	0	112.9	T215 I216	T215-G218 PolarHBondContact N-O 2.69Å; T215-G218 WeakPolarHBondContact O-CA 3.45Å; T215-G218 PolarHBondContact O-N 3.28Å; I216-G218 VanDerWaalsContact C-N 3.32Å
219	R	94.9	Very high	85.1	Confident	85 Å²	85	52 Å²	52	32%	0.321	26%	0.255	S	S	.	.	S	Bend	trans	-66.8	-55	174.9	179.4	-178.7	179.6	75.5	-0.4	111.8	E203 E207 I212 E214 C403	E203-R219 WeakPolarHBondContact OE1-CD 3.47Å; E203-R219 IonicContact OE1-CZ 2.65Å; E203-R219 IonicContact OE1-NE 3.71Å; E203-R219 PolarHBondContact OE1-NE 3.21Å; E203-R219 IonicContact OE1-NH2 2.99Å; E207-R219 IonicContact OE1-CZ 3.95Å; E207-R219 IonicContact OE1-NH2 3.36Å; E207-R219 PolarHBondContact OE1-NH2 3.06Å; I212-R219 HydrophobicContact CB-CG 4.34Å; I212-R219 HydrophobicContact CG2-CG 3.7Å; I212-R219 WeakPolarHBondContact CG2-O 3.36Å; E214-R219 HydrophobicContact CB-CB 4.49Å; E214-R219 HydrophobicContact CG-CB 4.34Å; R219-C403 WeakPolarHBondContact O-CB 3.4Å
220	M	95.8	Very high	83.5	Confident	18 Å²	18	53.7 Å²	53.7	9%	0.089	27%	0.273	C	S	.	.	S	Bend	trans	-116.7	137.2	171.3	-62.8	-61.4	-65.7	0	0	107.4	K199 T202 E203 I212 C403	K199-M220 HydrophobicContact CD-CB 4.12Å; K199-M220 HydrophobicContact CD-CG 4.14Å; K199-M220 HydrophobicContact CG-CB 4.13Å; K199-M220 HydrophobicContact CG-CE 4.13Å; K199-M220 HydrophobicContact CG-CG 4.36Å; T202-M220 HydrophobicContact CG2-CE 3.99Å; E203-M220 HydrophobicContact CB-CE 4.1Å; E203-M220 HydrophobicContact CB-CG 4.3Å; E203-M220 HydrophobicContact CB-SD 3.99Å; E203-M220 HydrophobicContact CG-CG 4.35Å; E203-M220 HydrophobicContact CG-SD 4.21Å; I212-M220 HydrophobicContact CD1-SD 3.76Å; M220-C403 HydrophobicContact CE-CB 4.08Å; M220-C403 HydrophobicContact SD-CB 3.48Å; M220-C403 WeakPolarHBondContact SD-CB 3.42Å
221	W	88.7	Confident	82.1	Confident	17 Å²	17	55.7 Å²	55.7	6%	0.064	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	150.8	175.3	43.9	-98.5	0	0	0	110.6	F223 Q255 V256 F257 C401 G402 Y404	W221-F223 HydrophobicContact CE3-CD1 4.48Å; W221-F223 HydrophobicContact CZ3-CD1 4.11Å; W221-Q255 VanDerWaalsContact CZ2-NE2 3.26Å; W221-V256 WeakPolarHBondContact CH2-O 3.4Å; W221-F257 AromaticContact CH2-CD1 3.47Å; W221-F257 HydrophobicContact CH2-CD1 3.47Å; W221-F257 VanDerWaalsContact CH2-CD1 3.47Å; W221-F257 AromaticContact CH2-CE1 3.34Å; W221-F257 HydrophobicContact CH2-CE1 3.34Å; W221-F257 HydrophobicContact CH2-CG 4.49Å; W221-F257 HydrophobicContact CH2-CZ 4.29Å; W221-F257 HydrophobicContact CZ2-CE1 4.33Å; W221-F257 HydrophobicContact CZ3-CD1 4Å; W221-F257 AromaticContact CZ3-CE1 3.9Å; W221-F257 HydrophobicContact CZ3-CE1 3.9Å; W221-C401 CarbonylContact O-C 3.47Å; W221-C401 VanDerWaalsContact O-CA 3.26Å; W221-C401 WeakPolarHBondContact O-CA 3.47Å; W221-G402 VanDerWaalsContact CH2-CA 3.43Å; W221-G402 VanDerWaalsContact CZ2-C 3.42Å; W221-G402 PolarHBondContact N-O 3.39Å; W221-G402 PolarHBondContact O-N 3.01Å; W221-Y404 AromaticContact NE1-CD2 3.73Å; W221-Y404 AromaticContact NE1-CE2 3.52Å
222	Y	83.3	Confident	80.9	Confident	94 Å²	94	52.9 Å²	52.9	37%	0.369	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	137.2	171.8	-55.3	-104.8	0	0	0	106.4	K199 L260 L400 C401	K199-Y222 HydrophobicContact CB-CD1 4.32Å; K199-Y222 HydrophobicContact CB-CE1 3.26Å; K199-Y222 VanDerWaalsContact CB-CZ 3.42Å; K199-Y222 WeakPolarHBondContact CB-OH 3.45Å; K199-Y222 HydrophobicContact CD-CE1 4.39Å; K199-Y222 HydrophobicContact CD-CE2 4.22Å; K199-Y222 WeakPolarHBondContact CD-OH 3.43Å; K199-Y222 WeakPolarHBondContact CE-OH 3.27Å; K199-Y222 HydrophobicContact CG-CE1 3.59Å; K199-Y222 HydrophobicContact CG-CE2 3.97Å; K199-Y222 WeakPolarHBondContact CG-OH 3.39Å; K199-Y222 PolarHBondContact NZ-OH 2.74Å; Y222-L260 HydrophobicContact CD1-CD1 4.38Å; Y222-L260 HydrophobicContact CE1-CD1 4.46Å; Y222-L400 WeakPolarHBondContact CA-O 3.28Å; Y222-C401 HydrophobicContact CD1-CB 3.93Å; Y222-C401 HydrophobicContact CE1-CB 4.36Å
223	F	74.1	Confident	79.7	Confident	17 Å²	17	53.6 Å²	53.6	8%	0.075	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	134.8	168	88.6	-100	0	0	0	111.2	W221 Y234 F257 L400	W221-F223 HydrophobicContact CE3-CD1 4.48Å; W221-F223 HydrophobicContact CZ3-CD1 4.11Å; F223-Y234 HydrophobicContact CB-CD1 4.22Å; F223-Y234 HydrophobicContact CB-CE1 3.81Å; F223-F257 HydrophobicContact CE1-CE1 4.48Å; F223-L400 HydrophobicContact CD1-CB 3.76Å; F223-L400 HydrophobicContact CD1-CD1 4.35Å; F223-L400 HydrophobicContact CD1-CG 4.32Å; F223-L400 HydrophobicContact CE1-CB 3.46Å; F223-L400 VanDerWaalsContact CE1-CB 3.46Å; F223-L400 HydrophobicContact CE1-CD1 3.25Å; F223-L400 HydrophobicContact CE1-CG 3.55Å; F223-L400 HydrophobicContact CZ-CB 4.11Å; F223-L400 HydrophobicContact CZ-CD1 3.48Å; F223-L400 VanDerWaalsContact CZ-CD1 3.48Å; F223-L400 HydrophobicContact CZ-CG 3.74Å; F223-L400 PolarHBondContact N-O 2.7Å; F223-L400 PolarHBondContact O-N 2.87Å
224	T	72.1	Confident	78.5	Confident	40 Å²	40	52.1 Å²	52.1	25%	0.245	27%	0.273	C	S	.	.			trans	-121.3	162.9	155.2	-179.9	0	0	0	0	106.4	D226	T224-D226 VanDerWaalsContact C-N 3.26Å; T224-D226 HydrophobicContact CG2-CB 3.9Å; T224-D226 WeakPolarHBondContact CG2-OD2 3.36Å; T224-D226 PolarHBondContact O-N 2.88Å
225	S	70.7	Confident	77.6	Confident	21 Å²	21	46.3 Å²	46.3	15%	0.147	25%	0.247	C	C	.	.	S	Bend	trans	-77.2	77.4	178	-60.4	0	0	0	0	111.2	Y234 T235 K236 F394	S225-Y234 CarbonylContact C-O 3.6Å; S225-Y234 VanDerWaalsContact CA-O 3.23Å; S225-Y234 WeakPolarHBondContact CA-O 3.16Å; S225-T235 PolarHBondContact OG-O 3.45Å; S225-K236 WeakPolarHBondContact OG-CG 3.39Å; S225-F394 WeakPolarHBondContact OG-CZ 3.26Å
226	D	69.4	Low	77	Confident	82 Å²	82	50.2 Å²	50.2	44%	0.439	26%	0.262	S	S	.	.	S	Bend	trans	-122	1.8	-175.2	64.7	3.8	0	0	0	114.8	T224 S228 Y234	T224-D226 VanDerWaalsContact C-N 3.26Å; T224-D226 HydrophobicContact CG2-CB 3.9Å; T224-D226 WeakPolarHBondContact CG2-OD2 3.36Å; T224-D226 PolarHBondContact O-N 2.88Å; D226-S228 PolarHBondContact O-N 3.3Å; D226-S228 WeakPolarHBondContact OD1-CB 3.37Å; D226-S228 PolarHBondContact OD1-N 3.27Å; D226-S228 PolarHBondContact OD1-OG 3.34Å; D226-S228 PolarHBondContact OD2-OG 3.26Å; D226-Y234 PolarHBondContact N-O 3.46Å
227	F	65.9	Low	76.6	Confident	147 Å²	147	53.5 Å²	53.5	65%	0.645	28%	0.28	S	S	*	.			trans	57.2	26.5	-175	-60.2	-93.2	0	0	0	114.6	R229 Y234 T235	F227-R229 PolarHBondContact O-N 3.23Å; F227-Y234 PolarHBondContact N-O 3.38Å; F227-T235 HydrophobicContact CD1-CG2 4.28Å; F227-T235 HydrophobicContact CE1-CG2 3.64Å; F227-T235 HydrophobicContact CZ-CG2 4.14Å
228	S	63	Low	76.5	Confident	56 Å²	56	55.3 Å²	55.3	39%	0.392	30%	0.299	S	S	.	.			trans	-69.9	-7	-179.6	56.3	0	0	0	0	115.5	D226 Y234	D226-S228 PolarHBondContact O-N 3.3Å; D226-S228 WeakPolarHBondContact OD1-CB 3.37Å; D226-S228 PolarHBondContact OD1-N 3.27Å; D226-S228 PolarHBondContact OD1-OG 3.34Å; D226-S228 PolarHBondContact OD2-OG 3.26Å; S228-Y234 VanDerWaalsContact OG-CD1 3.28Å; S228-Y234 WeakPolarHBondContact OG-CD1 3.42Å; S228-Y234 VanDerWaalsContact OG-CE1 3.32Å; S228-Y234 WeakPolarHBondContact OG-CE1 3.39Å
229	R	65.4	Low	76.4	Confident	74 Å²	74	55 Å²	55	28%	0.279	29%	0.291	S	S	.	.	S	Bend	trans	-133.7	157.4	175.3	-65.6	-72.6	113.2	135.6	0.6	110	F227 D231 Y234 E303 C308	F227-R229 PolarHBondContact O-N 3.23Å; R229-D231 HydrophobicContact CB-CB 4.23Å; R229-D231 PolarHBondContact O-N 3.44Å; R229-Y234 HydrophobicContact CB-CD2 3.69Å; R229-Y234 HydrophobicContact CB-CE1 4.4Å; R229-Y234 HydrophobicContact CB-CE2 3.56Å; R229-Y234 HydrophobicContact CB-CG 4.19Å; R229-Y234 HydrophobicContact CG-CD1 4.48Å; R229-Y234 HydrophobicContact CG-CD2 4.13Å; R229-Y234 HydrophobicContact CG-CE1 3.91Å; R229-Y234 HydrophobicContact CG-CE2 3.53Å; R229-E303 WeakPolarHBondContact CA-OE1 3.25Å; R229-E303 WeakPolarHBondContact CD-OE1 3.05Å; R229-C308 PolarHBondContact NH2-SG 3.36Å
230	G	60.5	Low	76.4	Confident	40 Å²	40	52.7 Å²	52.7	41%	0.412	29%	0.285	S	S	.	.	S	Bend	trans	-72	37.2	171.5	0	0	0	0	0	114.2	E303	G230-E303 PolarHBondContact N-OE1 3.45Å
231	D	64.8	Low	76.4	Confident	51 Å²	51	52.8 Å²	52.8	27%	0.273	29%	0.285	S	S	.	.	S	Bend	trans	-129.4	135.7	-169	-168.2	-44.1	0	0	0	111.4	Y217 R229 A233 Y234	Y217-D231 PolarHBondContact OH-OD2 3.16Å; R229-D231 HydrophobicContact CB-CB 4.23Å; R229-D231 PolarHBondContact O-N 3.44Å; D231-A233 PolarHBondContact O-N 3.37Å; D231-A233 VanDerWaalsContact O-N 3.12Å; D231-A233 VanDerWaalsContact OD1-CB 3.27Å; D231-A233 WeakPolarHBondContact OD1-CB 3.43Å; D231-A233 PolarHBondContact OD1-N 3.37Å; D231-Y234 HydrophobicContact CB-CD2 3.95Å; D231-Y234 HydrophobicContact CB-CE2 4.23Å; D231-Y234 PolarHBondContact O-N 2.92Å; D231-Y234 VanDerWaalsContact O-N 3.1Å
232	T	70.6	Confident	76.9	Confident	56 Å²	56	52.7 Å²	52.7	34%	0.344	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-62	-22.3	-178.4	-49.3	0	0	0	0	112.1	Y234 T235 L239	T232-Y234 PolarHBondContact O-N 3.35Å; T232-Y234 VanDerWaalsContact O-N 3.15Å; T232-T235 HydrophobicContact CG2-CG2 4.42Å; T232-T235 WeakPolarHBondContact O-CB 3.46Å; T232-T235 WeakPolarHBondContact O-CG2 3.23Å; T232-T235 PolarHBondContact O-N 3.09Å; T232-T235 VanDerWaalsContact O-N 3.11Å; T232-T235 PolarHBondContact O-OG1 3.3Å; T232-L239 HydrophobicContact CG2-CD2 3.63Å
233	A	70.7	Confident	77.6	Confident	26 Å²	26	48.3 Å²	48.3	22%	0.215	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-53.8	-30.5	173.8	0	0	0	0	0	113.4	D231 T235 L239	D231-A233 PolarHBondContact O-N 3.37Å; D231-A233 VanDerWaalsContact O-N 3.12Å; D231-A233 VanDerWaalsContact OD1-CB 3.27Å; D231-A233 WeakPolarHBondContact OD1-CB 3.43Å; D231-A233 PolarHBondContact OD1-N 3.37Å; A233-T235 VanDerWaalsContact C-N 3.27Å; A233-T235 PolarHBondContact O-N 3.22Å; A233-L239 HydrophobicContact CB-CD1 4.36Å
234	Y	72.1	Confident	78.7	Confident	19 Å²	19	48.4 Å²	48.4	8%	0.075	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-87.4	12.3	-177.2	-66.8	-101.4	0	0	0	113.7	F223 S225 D226 F227 S228 R229 D231 T232	F223-Y234 HydrophobicContact CB-CD1 4.22Å; F223-Y234 HydrophobicContact CB-CE1 3.81Å; S225-Y234 CarbonylContact C-O 3.6Å; S225-Y234 VanDerWaalsContact CA-O 3.23Å; S225-Y234 WeakPolarHBondContact CA-O 3.16Å; D226-Y234 PolarHBondContact N-O 3.46Å; F227-Y234 PolarHBondContact N-O 3.38Å; S228-Y234 VanDerWaalsContact OG-CD1 3.28Å; S228-Y234 WeakPolarHBondContact OG-CD1 3.42Å; S228-Y234 VanDerWaalsContact OG-CE1 3.32Å; S228-Y234 WeakPolarHBondContact OG-CE1 3.39Å; R229-Y234 HydrophobicContact CB-CD2 3.69Å; R229-Y234 HydrophobicContact CB-CE1 4.4Å; R229-Y234 HydrophobicContact CB-CE2 3.56Å; R229-Y234 HydrophobicContact CB-CG 4.19Å; R229-Y234 HydrophobicContact CG-CD1 4.48Å; R229-Y234 HydrophobicContact CG-CD2 4.13Å; R229-Y234 HydrophobicContact CG-CE1 3.91Å; R229-Y234 HydrophobicContact CG-CE2 3.53Å; D231-Y234 HydrophobicContact CB-CD2 3.95Å; D231-Y234 HydrophobicContact CB-CE2 4.23Å; D231-Y234 PolarHBondContact O-N 2.92Å; D231-Y234 VanDerWaalsContact O-N 3.1Å; T232-Y234 PolarHBondContact O-N 3.35Å; T232-Y234 VanDerWaalsContact O-N 3.15Å
235	T	77.2	Confident	79.9	Confident	14 Å²	14	46.6 Å²	46.6	9%	0.086	26%	0.258	C	S	.	.	S	Bend	trans	-98.5	179.3	172.9	74.1	0	0	0	0	111.5	S225 F227 T232 A233 L237 R391	S225-T235 PolarHBondContact OG-O 3.45Å; F227-T235 HydrophobicContact CD1-CG2 4.28Å; F227-T235 HydrophobicContact CE1-CG2 3.64Å; F227-T235 HydrophobicContact CZ-CG2 4.14Å; T232-T235 HydrophobicContact CG2-CG2 4.42Å; T232-T235 WeakPolarHBondContact O-CB 3.46Å; T232-T235 WeakPolarHBondContact O-CG2 3.23Å; T232-T235 PolarHBondContact O-N 3.09Å; T232-T235 VanDerWaalsContact O-N 3.11Å; T232-T235 PolarHBondContact O-OG1 3.3Å; A233-T235 VanDerWaalsContact C-N 3.27Å; A233-T235 PolarHBondContact O-N 3.22Å; T235-L237 PolarHBondContact OG1-N 3.33Å; T235-R391 PolarHBondContact O-NH2 2.65Å
236	K	81.8	Confident	81.2	Confident	104 Å²	104	45.6 Å²	45.6	45%	0.452	25%	0.251	S	S	.	.	S	Bend	trans	-97.8	-6.4	169.3	-63.9	-176.1	-175.9	-176.9	0	113.5	S225 R391 A393 F394	S225-K236 WeakPolarHBondContact OG-CG 3.39Å; K236-R391 PolarHBondContact O-NH1 3.12Å; K236-A393 WeakPolarHBondContact O-CA 3.39Å; K236-F394 HydrophobicContact CG-CE2 4.39Å; K236-F394 HydrophobicContact CG-CZ 4.33Å; K236-F394 PolarHBondContact O-N 2.91Å
237	L	84.4	Confident	82.5	Confident	118 Å²	118	42.1 Å²	42.1	62%	0.618	23%	0.232	S	C	*	.	S	Bend	trans	-67.9	155.2	-177.1	-60.5	178.1	0	0	0	111.4	T235 R391	T235-L237 PolarHBondContact OG1-N 3.33Å; L237-R391 PolarHBondContact O-NH1 3.08Å; L237-R391 PolarHBondContact O-NH2 3.27Å
238	A	88.8	Confident	84	Confident	58 Å²	58	36.1 Å²	36.1	48%	0.479	21%	0.205	S	C	.	.			trans	-59.7	142.9	173.6	0	0	0	0	0	110.9	R391 A393	A238-R391 CarbonylContact C-O 3.4Å; A238-R391 WeakPolarHBondContact CA-O 3.25Å; A238-A393 HydrophobicContact CB-CB 4.34Å
239	L	91.4	Very high	85.5	Confident	17 Å²	17	40.1 Å²	40.1	9%	0.089	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125.3	169.4	-59.7	175.4	0	0	0	107.8	T232 A233 G390 R391	T232-L239 HydrophobicContact CG2-CD2 3.63Å; A233-L239 HydrophobicContact CB-CD1 4.36Å; L239-G390 WeakPolarHBondContact O-CA 3.48Å; L239-R391 HydrophobicContact CB-CG 3.97Å; L239-R391 HydrophobicContact CD1-CG 3.93Å; L239-R391 HydrophobicContact CG-CG 3.92Å; L239-R391 PolarHBondContact N-O 2.7Å; L239-R391 PolarHBondContact O-N 2.99Å
240	D	93.4	Very high	86.9	Confident	38 Å²	38	40.6 Å²	40.6	20%	0.203	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	163.7	174.1	-156.5	6.2	0	0	0	110.2	H242 Y336 R364	D240-H242 PolarHBondContact O-N 2.79Å; D240-H242 PolarHBondContact O-ND1 3.21Å; D240-Y336 WeakPolarHBondContact CB-OH 3.45Å; D240-Y336 PolarHBondContact N-OH 2.74Å; D240-R364 IonicContact OD2-CZ 2.79Å; D240-R364 IonicContact OD2-NE 3.51Å; D240-R364 PolarHBondContact OD2-NE 2.78Å; D240-R364 IonicContact OD2-NH2 3.31Å; D240-R364 PolarHBondContact OD2-NH2 3.35Å
241	R	96.7	Very high	88.6	Confident	20 Å²	20	38.9 Å²	38.9	8%	0.075	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	127.6	-180	68.5	-137.9	72.8	-146.7	-6.6	112.1	L270 V272 Y333 L363 R364 E369 L388 H389	R241-L270 HydrophobicContact CB-CD2 4.09Å; R241-V272 HydrophobicContact CB-CG2 4.5Å; R241-Y333 HydrophobicContact CG-CE1 4.36Å; R241-L363 HydrophobicContact CG-CB 4.47Å; R241-L363 PolarHBondContact NH1-O 2.77Å; R241-R364 VanDerWaalsContact CZ-CG 3.44Å; R241-R364 VanDerWaalsContact NH1-CA 3.26Å; R241-E369 IonicContact CZ-OE1 3.83Å; R241-E369 VanDerWaalsContact CZ-OE1 3.25Å; R241-E369 IonicContact NH1-OE1 3.24Å; R241-E369 PolarHBondContact NH1-OE1 3.35Å; R241-E369 IonicContact NH2-OE1 3.69Å; R241-E369 PolarHBondContact NH2-OE1 2.83Å; R241-L388 HydrophobicContact CB-CB 3.92Å; R241-L388 HydrophobicContact CB-CD2 4.07Å; R241-L388 HydrophobicContact CG-CD2 3.81Å; R241-H389 CarbonylContact C-O 3.56Å; R241-H389 WeakPolarHBondContact CA-O 3.35Å
242	H	98.3	Very high	90.1	Very high	14 Å²	14	36.5 Å²	36.5	7%	0.065	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	164.4	177.6	57.5	-73.7	0	0	0	111.9	D240 D244 Y333 N334 L388 H389	D240-H242 PolarHBondContact O-N 2.79Å; D240-H242 PolarHBondContact O-ND1 3.21Å; H242-D244 IonicContact CD2-OD1 2.7Å; H242-D244 PolarHBondContact CD2-OD1 3Å; H242-D244 IonicContact NE2-OD1 2.7Å; H242-D244 PolarHBondContact NE2-OD1 2.65Å; H242-Y333 CarbonylContact C-O 3.58Å; H242-Y333 WeakPolarHBondContact CA-O 3.3Å; H242-N334 HydrophobicContact CB-CB 3.87Å; H242-L388 CarbonylContact O-C 3.56Å; H242-L388 VanDerWaalsContact O-CA 3.3Å; H242-L388 WeakPolarHBondContact O-CA 3.49Å; H242-H389 PolarHBondContact CE1-O 2.98Å; H242-H389 PolarHBondContact N-O 3.1Å; H242-H389 PolarHBondContact ND1-O 2.83Å; H242-H389 VanDerWaalsContact ND1-O 3.08Å; H242-H389 AromaticContact NE2-NE2 4Å; H242-H389 PolarHBondContact O-N 2.94Å; H242-H389 PolarHBondContact O-ND1 3.27Å
243	T	98.4	Very high	91.3	Very high	3 Å²	3	33.8 Å²	33.8	2%	0.018	18%	0.176	C	C	.	.			trans	-102.6	141.8	158.4	53.3	0	0	0	0	109.3	T246 I331 Y333 N334 N384 L388	T243-T246 WeakPolarHBondContact O-CG2 3.33Å; T243-I331 HydrophobicContact CG2-CG2 3.9Å; T243-I331 PolarHBondContact OG1-O 3Å; T243-Y333 PolarHBondContact N-O 2.98Å; T243-Y333 PolarHBondContact OG1-N 2.81Å; T243-Y333 VanDerWaalsContact OG1-N 3.1Å; T243-N334 WeakPolarHBondContact O-CB 3.49Å; T243-N334 PolarHBondContact O-ND2 2.91Å; T243-N384 VanDerWaalsContact CB-O 3.32Å; T243-N384 WeakPolarHBondContact CB-O 3.16Å; T243-N384 WeakPolarHBondContact CG2-O 3.3Å; T243-L388 HydrophobicContact CG2-CG 4.14Å
244	D	97.3	Very high	92.7	Very high	19 Å²	19	32.7 Å²	32.7	10%	0.102	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	153.9	-177.8	-78.3	-15.6	0	0	0	111.1	H242 T246 Q255 N384 H389 Y404	H242-D244 IonicContact CD2-OD1 2.7Å; H242-D244 PolarHBondContact CD2-OD1 3Å; H242-D244 IonicContact NE2-OD1 2.7Å; H242-D244 PolarHBondContact NE2-OD1 2.65Å; D244-T246 VanDerWaalsContact C-N 3.33Å; D244-T246 PolarHBondContact O-N 2.89Å; D244-Q255 PolarHBondContact OD2-NE2 2.88Å; D244-N384 PolarHBondContact N-OD1 2.87Å; D244-N384 PolarHBondContact O-ND2 2.82Å; D244-H389 IonicContact OD1-CE1 2.64Å; D244-H389 IonicContact OD1-NE2 3.88Å; D244-H389 IonicContact OD2-CE1 2.69Å; D244-H389 IonicContact OD2-NE2 3.87Å; D244-H389 PolarHBondContact OD2-NE2 2.84Å; D244-Y404 HydrophobicContact CB-CE1 3.88Å; D244-Y404 PolarHBondContact OD2-OH 2.85Å
245	T	96.9	Very high	93.9	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.006	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	34.1	170.4	67.5	0	0	0	0	114.8	Y247 F248 P251 C252 Y404	T245-Y247 PolarHBondContact O-N 3.39Å; T245-Y247 VanDerWaalsContact O-N 3.11Å; T245-F248 HydrophobicContact CG2-CD2 4.05Å; T245-F248 HydrophobicContact CG2-CE1 4.3Å; T245-F248 HydrophobicContact CG2-CE2 3.73Å; T245-F248 HydrophobicContact CG2-CG 4.48Å; T245-F248 HydrophobicContact CG2-CZ 3.86Å; T245-F248 WeakPolarHBondContact O-CB 3.1Å; T245-F248 PolarHBondContact O-N 2.99Å; T245-P251 WeakPolarHBondContact OG1-CA 3.34Å; T245-C252 HydrophobicContact CG2-CB 4.48Å; T245-C252 PolarHBondContact OG1-N 2.89Å; T245-Y404 HydrophobicContact CG2-CE1 4.4Å
246	T	97.4	Very high	94.9	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.006	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.7	179	71.1	0	0	0	0	113	T243 D244 F248 H299 R332 N334 D337	T243-T246 WeakPolarHBondContact O-CG2 3.33Å; D244-T246 VanDerWaalsContact C-N 3.33Å; D244-T246 PolarHBondContact O-N 2.89Å; T246-F248 VanDerWaalsContact C-N 3.33Å; T246-H299 WeakPolarHBondContact OG1-CB 3.49Å; T246-H299 PolarHBondContact OG1-CD2 3.42Å; T246-R332 HydrophobicContact CG2-CB 4.38Å; T246-R332 PolarHBondContact O-NH1 2.83Å; T246-N334 HydrophobicContact CG2-CB 3.65Å; T246-D337 PolarHBondContact OG1-OD1 2.66Å; T246-D337 PolarHBondContact OG1-OD2 2.71Å
247	Y	97.2	Very high	95.6	Very high	9 Å²	9	27.2 Å²	27.2	4%	0.035	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-1.9	172.7	53.4	-97.7	0	0	0	114.7	Y217 T245 Y301 M312 I313 G314 D337	Y217-Y247 WeakPolarHBondContact CE2-OH 3.48Å; Y217-Y247 PolarHBondContact OH-OH 2.99Å; T245-Y247 PolarHBondContact O-N 3.39Å; T245-Y247 VanDerWaalsContact O-N 3.11Å; Y247-Y301 HydrophobicContact CD2-CG 4.43Å; Y247-Y301 HydrophobicContact CE1-CD2 4.23Å; Y247-Y301 HydrophobicContact CE1-CG 4.2Å; Y247-Y301 HydrophobicContact CE2-CD1 4.41Å; Y247-Y301 HydrophobicContact CE2-CG 4.09Å; Y247-Y301 AromaticContact CZ-CG 3.98Å; Y247-M312 HydrophobicContact CD2-CB 3.8Å; Y247-M312 HydrophobicContact CD2-CE 3.88Å; Y247-M312 HydrophobicContact CD2-SD 4.44Å; Y247-M312 HydrophobicContact CE2-CE 3.48Å; Y247-M312 VanDerWaalsContact CE2-CE 3.48Å; Y247-M312 HydrophobicContact CE2-SD 4.4Å; Y247-I313 CarbonylContact O-C 3.59Å; Y247-I313 PolarHBondContact O-N 2.88Å; Y247-G314 WeakPolarHBondContact O-CA 3.35Å; Y247-G314 PolarHBondContact O-N 3.49Å; Y247-D337 HydrophobicContact CD1-CB 3.72Å; Y247-D337 WeakPolarHBondContact CD1-OD2 3.46Å; Y247-D337 HydrophobicContact CE1-CB 4.2Å; Y247-D337 WeakPolarHBondContact CE1-OD2 3.48Å
248	F	97.2	Very high	96.2	Very high	20 Å²	20	21.6 Å²	21.6	9%	0.088	11%	0.112	C	C	.	.	S	Bend	trans	-78.8	147.2	165	-71.3	3.7	0	0	0	109.9	T215 T245 T246 E250 M312 R332	T215-F248 HydrophobicContact CG2-CE2 3.87Å; T215-F248 HydrophobicContact CG2-CZ 4.18Å; T245-F248 HydrophobicContact CG2-CD2 4.05Å; T245-F248 HydrophobicContact CG2-CE1 4.3Å; T245-F248 HydrophobicContact CG2-CE2 3.73Å; T245-F248 HydrophobicContact CG2-CG 4.48Å; T245-F248 HydrophobicContact CG2-CZ 3.86Å; T245-F248 WeakPolarHBondContact O-CB 3.1Å; T245-F248 PolarHBondContact O-N 2.99Å; T246-F248 VanDerWaalsContact C-N 3.33Å; F248-E250 VanDerWaalsContact CB-O 3.31Å; F248-E250 WeakPolarHBondContact CB-O 3.3Å; F248-E250 PolarHBondContact O-N 2.81Å; F248-M312 HydrophobicContact CD1-CE 4.38Å; F248-M312 HydrophobicContact CD1-SD 3.78Å; F248-M312 HydrophobicContact CE1-CE 3.66Å; F248-M312 HydrophobicContact CE1-SD 3.32Å; F248-M312 WeakPolarHBondContact CE1-SD 3.07Å; F248-M312 HydrophobicContact CZ-SD 4.33Å; F248-R332 PolarHBondContact O-NH1 2.86Å
249	Q	94.6	Very high	96.4	Very high	140 Å²	140	18.9 Å²	18.9	65%	0.654	9%	0.089	S	C	*	.	S	Bend	trans	-57.3	-43	168.8	-69.2	-66.1	-24.6	0	0	110.2	I313 R332	Q249-I313 PolarHBondContact NE2-O 3.37Å; Q249-R332 PolarHBondContact O-NH2 3.39Å
250	E	94.6	Very high	96.5	Very high	85 Å²	85	19 Å²	19	40%	0.397	9%	0.09	S	C	.	.	S	Bend	trans	-117.1	101.1	170.1	-171.8	-158.5	145.9	0	0	109	R213 F248 W385	R213-E250 PolarHBondContact NH1-O 3.25Å; R213-E250 IonicContact NH1-OE1 3.58Å; R213-E250 PolarHBondContact NH1-OE1 2.73Å; R213-E250 IonicContact NH1-OE2 2.8Å; R213-E250 PolarHBondContact NH2-O 2.8Å; F248-E250 VanDerWaalsContact CB-O 3.31Å; F248-E250 WeakPolarHBondContact CB-O 3.3Å; F248-E250 PolarHBondContact O-N 2.81Å; E250-W385 HydrophobicContact CG-CZ2 4.34Å
251	P	96.3	Very high	96.4	Very high	4 Å²	4	21.2 Å²	21.2	3%	0.026	10%	0.098	C	C	.	.			trans	-56.1	146.5	175.2	-26.3	35.3	0	0	0	111.1	T245 G253 L330 R332 W385	T245-P251 WeakPolarHBondContact OG1-CA 3.34Å; P251-G253 PolarHBondContact O-N 3.24Å; P251-L330 HydrophobicContact CG-CD2 4.37Å; P251-R332 HydrophobicContact CG-CG 4.48Å; P251-R332 VanDerWaalsContact CG-CZ 3.45Å; P251-R332 VanDerWaalsContact CG-NH1 3.35Å; P251-W385 PolarHBondContact O-NE1 2.68Å
252	C	97.1	Very high	96.1	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.102	C	C	.	.			trans	-55.1	136.2	175.1	-69.2	0	0	0	0	111	T245 N384 W385 Y404	T245-C252 HydrophobicContact CG2-CB 4.48Å; T245-C252 PolarHBondContact OG1-N 2.89Å; C252-N384 WeakPolarHBondContact O-CB 3.32Å; C252-N384 PolarHBondContact O-ND2 3.07Å; C252-W385 VanDerWaalsContact O-CD1 3.23Å; C252-W385 PolarHBondContact O-NE1 3.12Å; C252-Y404 HydrophobicContact CB-CD1 3.26Å; C252-Y404 HydrophobicContact CB-CE1 3.95Å; C252-Y404 HydrophobicContact CB-CG 3.63Å
253	G	96.5	Very high	95.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.124	C	C	.	.	S	Bend	trans	-73.7	-53.5	-172.2	0	0	0	0	0	113	P251 N384 L405	P251-G253 PolarHBondContact O-N 3.24Å; G253-N384 PolarHBondContact O-N 3.41Å; G253-L405 PolarHBondContact N-O 2.71Å
254	I	98.3	Very high	95.2	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.01	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138.7	-177.8	-56.3	83.8	0	0	0	108.7	F184 F381 I382 Y404 L405 T406 R407 V410	F184-I254 HydrophobicContact CE1-CG1 3.97Å; F184-I254 HydrophobicContact CE2-CG2 4.16Å; F184-I254 HydrophobicContact CZ-CB 4.35Å; F184-I254 HydrophobicContact CZ-CG1 3.59Å; F184-I254 HydrophobicContact CZ-CG2 3.86Å; I254-F381 HydrophobicContact CG2-CB 4.3Å; I254-F381 HydrophobicContact CG2-CD1 4.16Å; I254-I382 CarbonylContact C-O 3.57Å; I254-I382 VanDerWaalsContact CA-O 3.26Å; I254-I382 WeakPolarHBondContact CA-O 3.36Å; I254-I382 WeakPolarHBondContact CG2-O 3.23Å; I254-Y404 CarbonylContact O-C 3.53Å; I254-Y404 VanDerWaalsContact O-CA 3.29Å; I254-Y404 WeakPolarHBondContact O-CA 3.32Å; I254-L405 HydrophobicContact CB-CB 4.04Å; I254-L405 HydrophobicContact CB-CD1 4.39Å; I254-L405 HydrophobicContact CB-CG 4.47Å; I254-L405 HydrophobicContact CD1-CB 4.26Å; I254-L405 HydrophobicContact CG2-CD1 4.28Å; I254-L405 PolarHBondContact N-O 3.21Å; I254-L405 PolarHBondContact O-N 3.07Å; I254-T406 WeakPolarHBondContact CD1-O 3.29Å; I254-R407 HydrophobicContact CD1-CB 4.34Å; I254-V410 HydrophobicContact CD1-CB 3.95Å; I254-V410 HydrophobicContact CD1-CG1 4.48Å; I254-V410 HydrophobicContact CD1-CG2 3.45Å; I254-V410 VanDerWaalsContact CD1-CG2 3.45Å; I254-V410 HydrophobicContact CG1-CG2 4.11Å
255	Q	98.1	Very high	94.9	Very high	3 Å²	3	32 Å²	32	1%	0.014	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129.6	173.4	179.2	67.4	-34.5	0	0	109.2	W221 D244 F257 I382 N384 C403 Y404	W221-Q255 VanDerWaalsContact CZ2-NE2 3.26Å; D244-Q255 PolarHBondContact OD2-NE2 2.88Å; Q255-F257 HydrophobicContact CG-CD2 4.07Å; Q255-F257 HydrophobicContact CG-CE1 4.45Å; Q255-F257 HydrophobicContact CG-CE2 3.46Å; Q255-F257 VanDerWaalsContact CG-CE2 3.46Å; Q255-F257 HydrophobicContact CG-CZ 3.68Å; Q255-I382 HydrophobicContact CB-CB 4.42Å; Q255-I382 PolarHBondContact N-O 3.19Å; Q255-I382 PolarHBondContact O-N 3.24Å; Q255-N384 HydrophobicContact CB-CB 4.29Å; Q255-C403 PolarHBondContact OE1-O 2.87Å; Q255-Y404 HydrophobicContact CB-CD1 4.49Å; Q255-Y404 HydrophobicContact CB-CE1 4.47Å; Q255-Y404 HydrophobicContact CG-CE1 4.38Å; Q255-Y404 PolarHBondContact NE2-OH 2.8Å
256	V	98.1	Very high	94.7	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	127.7	178.2	-172.6	0	0	0	0	109.3	T202 W221 L380 F381 G402 C403 L405	T202-V256 HydrophobicContact CG2-CG1 4.29Å; W221-V256 WeakPolarHBondContact CH2-O 3.4Å; V256-L380 CarbonylContact C-O 3.42Å; V256-L380 WeakPolarHBondContact CA-O 3.42Å; V256-F381 HydrophobicContact CG1-CD1 4.42Å; V256-F381 HydrophobicContact CG1-CD2 4.4Å; V256-F381 HydrophobicContact CG1-CE1 4.13Å; V256-F381 HydrophobicContact CG1-CE2 4.1Å; V256-F381 HydrophobicContact CG1-CZ 3.95Å; V256-F381 HydrophobicContact CG2-CD1 3.58Å; V256-F381 HydrophobicContact CG2-CE1 3.55Å; V256-F381 HydrophobicContact CG2-CG 4.27Å; V256-F381 HydrophobicContact CG2-CZ 4.23Å; V256-G402 WeakPolarHBondContact O-CA 3.4Å; V256-C403 PolarHBondContact N-O 2.74Å; V256-C403 PolarHBondContact O-N 3.02Å; V256-L405 HydrophobicContact CG2-CD1 4.04Å; V256-L405 HydrophobicContact CG2-CG 4.17Å
257	F	97.4	Very high	94.3	Very high	20 Å²	20	33 Å²	33	9%	0.088	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	127.4	171.9	-72.1	-65.7	0	0	0	110.7	W221 F223 Q255 L374 A379 L380 I382 H389 L400	W221-F257 AromaticContact CH2-CD1 3.47Å; W221-F257 HydrophobicContact CH2-CD1 3.47Å; W221-F257 VanDerWaalsContact CH2-CD1 3.47Å; W221-F257 AromaticContact CH2-CE1 3.34Å; W221-F257 HydrophobicContact CH2-CE1 3.34Å; W221-F257 HydrophobicContact CH2-CG 4.49Å; W221-F257 HydrophobicContact CH2-CZ 4.29Å; W221-F257 HydrophobicContact CZ2-CE1 4.33Å; W221-F257 HydrophobicContact CZ3-CD1 4Å; W221-F257 AromaticContact CZ3-CE1 3.9Å; W221-F257 HydrophobicContact CZ3-CE1 3.9Å; F223-F257 HydrophobicContact CE1-CE1 4.48Å; Q255-F257 HydrophobicContact CG-CD2 4.07Å; Q255-F257 HydrophobicContact CG-CE1 4.45Å; Q255-F257 HydrophobicContact CG-CE2 3.46Å; Q255-F257 VanDerWaalsContact CG-CE2 3.46Å; Q255-F257 HydrophobicContact CG-CZ 3.68Å; F257-L374 HydrophobicContact CB-CD1 3.92Å; F257-A379 CarbonylContact O-C 3.41Å; F257-A379 WeakPolarHBondContact O-CA 3.36Å; F257-L380 PolarHBondContact N-O 3.46Å; F257-L380 PolarHBondContact O-N 3.29Å; F257-I382 HydrophobicContact CD2-CD1 3.75Å; F257-I382 HydrophobicContact CE2-CD1 3.82Å; F257-H389 AromaticContact CE2-CD2 3.54Å; F257-H389 AromaticContact CE2-NE2 3.68Å; F257-H389 AromaticContact CZ-CD2 3.82Å; F257-H389 AromaticContact CZ-NE2 3.68Å; F257-L400 HydrophobicContact CD1-CD1 3.86Å; F257-L400 HydrophobicContact CE1-CD1 4.45Å
258	H	96.4	Very high	94.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	122.7	169	-174.1	-168.3	0	0	0	110.2	V195 P196 T202 L260 K378 A379 L400 C401	V195-H258 VanDerWaalsContact CG1-CE1 3.42Å; V195-H258 WeakPolarHBondContact CG1-CE1 3.47Å; P196-H258 PolarHBondContact O-CE1 3.12Å; P196-H258 VanDerWaalsContact O-CE1 3.28Å; T202-H258 HydrophobicContact CG2-CB 3.84Å; T202-H258 PolarHBondContact OG1-ND1 2.94Å; H258-L260 PolarHBondContact O-N 2.87Å; H258-K378 PolarHBondContact CD2-O 2.83Å; H258-A379 HydrophobicContact CB-CB 4.28Å; H258-L400 VanDerWaalsContact O-CA 3.31Å; H258-L400 WeakPolarHBondContact O-CA 3.21Å; H258-C401 PolarHBondContact N-O 2.83Å; H258-C401 PolarHBondContact O-N 2.88Å
259	C	93.3	Very high	94.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	117.4	174.9	-176.6	0	0	0	0	110.2	L374 P376 L400	C259-L374 HydrophobicContact CB-CB 3.9Å; C259-P376 WeakPolarHBondContact O-CA 3.46Å; C259-L400 HydrophobicContact CB-CD2 3.51Å
260	L	93.3	Very high	94.4	Very high	21 Å²	21	30 Å²	30	11%	0.11	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-40.1	177.6	-54.6	-168.5	0	0	0	111	P197 Y222 H258 Q399 C401	P197-L260 HydrophobicContact CB-CD2 4.42Å; Y222-L260 HydrophobicContact CD1-CD1 4.38Å; Y222-L260 HydrophobicContact CE1-CD1 4.46Å; H258-L260 PolarHBondContact O-N 2.87Å; L260-Q399 HydrophobicContact CB-CB 4.45Å; L260-Q399 HydrophobicContact CB-CG 4.33Å; L260-Q399 HydrophobicContact CD1-CG 4.45Å; L260-Q399 PolarHBondContact N-O 2.78Å; L260-C401 HydrophobicContact CD1-CB 3.94Å; L260-C401 VanDerWaalsContact CD2-SG 3.54Å; L260-C401 HydrophobicContact CG-CB 4.27Å
261	K	91.9	Very high	94.6	Very high	83 Å²	83	26 Å²	26	36%	0.361	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	142	-178.8	-168.5	169.4	179.5	-165.4	0	111.7	E263 Y397 R398 Q399	K261-E263 WeakPolarHBondContact CE-OE1 3.1Å; K261-E263 VanDerWaalsContact NZ-CD 3.28Å; K261-E263 IonicContact NZ-OE1 2.81Å; K261-E263 PolarHBondContact NZ-OE1 3.39Å; K261-E263 IonicContact NZ-OE2 2.77Å; K261-E263 PolarHBondContact NZ-OE2 3Å; K261-Y397 HydrophobicContact CB-CD1 4.36Å; K261-Y397 HydrophobicContact CB-CE1 4.01Å; K261-Y397 HydrophobicContact CD-CD1 3.93Å; K261-Y397 HydrophobicContact CD-CE1 3.75Å; K261-Y397 HydrophobicContact CG-CD1 4.02Å; K261-Y397 HydrophobicContact CG-CE1 4.02Å; K261-R398 CarbonylContact O-C 3.58Å; K261-R398 WeakPolarHBondContact O-CA 3.5Å; K261-Q399 HydrophobicContact CB-CB 4.22Å; K261-Q399 PolarHBondContact N-O 3.23Å; K261-Q399 PolarHBondContact O-N 3.26Å
262	H	88.9	Confident	94.7	Very high	36 Å²	36	25.8 Å²	25.8	17%	0.167	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	111.3	171.4	-169.2	170.1	0	0	0	110.9	G266 K373 Y397 R398	H262-G266 PolarHBondContact CE1-O 3.39Å; H262-K373 PolarHBondContact CE1-NZ 3.17Å; H262-K373 PolarHBondContact ND1-NZ 3.35Å; H262-Y397 CarbonylContact C-O 3.06Å; H262-Y397 WeakPolarHBondContact CA-O 3.36Å; H262-R398 HydrophobicContact CB-CG 4.49Å
263	E	89.9	Confident	94.8	Very high	112 Å²	112	25.9 Å²	25.9	52%	0.523	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	93.1	173.2	-67.9	172.1	167.5	0	0	108.2	K261 G396 Y397	K261-E263 WeakPolarHBondContact CE-OE1 3.1Å; K261-E263 VanDerWaalsContact NZ-CD 3.28Å; K261-E263 IonicContact NZ-OE1 2.81Å; K261-E263 PolarHBondContact NZ-OE1 3.39Å; K261-E263 IonicContact NZ-OE2 2.77Å; K261-E263 PolarHBondContact NZ-OE2 3Å; E263-G396 CarbonylContact O-C 3.54Å; E263-G396 VanDerWaalsContact O-CA 3.27Å; E263-G396 WeakPolarHBondContact O-CA 3.37Å; E263-Y397 PolarHBondContact N-O 2.92Å; E263-Y397 PolarHBondContact O-N 2.99Å
264	G	88.4	Confident	94.9	Very high	42 Å²	42	25.9 Å²	25.9	43%	0.433	14%	0.14	S	C	.	.	S	Bend	trans	159.8	-166.6	-176.3	0	0	0	0	0	114.1	T395	G264-T395 WeakPolarHBondContact CA-O 3.42Å
265	T	90.4	Very high	95	Very high	94 Å²	94	26 Å²	26	58%	0.577	14%	0.141	S	C	*	.	S	Bend	trans	-119.7	161.2	-179.3	65.6	0	0	0	0	111.4	F394 T395	T265-F394 VanDerWaalsContact O-CA 3.23Å; T265-F394 WeakPolarHBondContact O-CA 3.48Å; T265-F394 VanDerWaalsContact O-CB 3.26Å; T265-F394 WeakPolarHBondContact O-CB 3.21Å; T265-T395 PolarHBondContact N-OG1 3.19Å; T265-T395 PolarHBondContact O-N 2.87Å; T265-T395 PolarHBondContact OG1-OG1 2.96Å
266	G	92.5	Very high	95	Very high	22 Å²	22	27.8 Å²	27.8	23%	0.227	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	76.2	-151.3	-178.7	0	0	0	0	0	113.5	H262 R268 K373 E392 A393	H262-G266 PolarHBondContact CE1-O 3.39Å; G266-R268 VanDerWaalsContact C-N 3.29Å; G266-R268 PolarHBondContact O-N 3.48Å; G266-K373 PolarHBondContact O-NZ 3.07Å; G266-E392 WeakPolarHBondContact CA-OE2 3.47Å; G266-A393 WeakPolarHBondContact CA-O 3.31Å
267	G	91	Very high	95	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.01	15%	0.147	C	C	.	.			trans	66.9	27.5	173.3	0	0	0	0	0	114.4	A393	G267-A393 PolarHBondContact N-O 3.34Å
268	R	95.4	Very high	95.1	Very high	99 Å²	99	26.8 Å²	26.8	37%	0.374	14%	0.143	S	C	.	.	P	Polyproline II helix	trans	-65.5	139	166.6	-64.7	-179.9	-69.3	163.7	1.4	109	G266 W371 V372 K373 R391 E392	G266-R268 VanDerWaalsContact C-N 3.29Å; G266-R268 PolarHBondContact O-N 3.48Å; R268-W371 HydrophobicContact CB-CE3 3.83Å; R268-W371 HydrophobicContact CB-CZ3 4.41Å; R268-V372 CarbonylContact C-O 3.54Å; R268-V372 WeakPolarHBondContact CA-O 3.41Å; R268-K373 HydrophobicContact CG-CB 4.41Å; R268-K373 HydrophobicContact CG-CD 4.03Å; R268-R391 VanDerWaalsContact O-CA 3.28Å; R268-R391 WeakPolarHBondContact O-CA 3.38Å; R268-E392 HydrophobicContact CB-CB 4.43Å; R268-E392 IonicContact CZ-OE1 2.96Å; R268-E392 IonicContact CZ-OE2 3.61Å; R268-E392 IonicContact NE-OE1 3.07Å; R268-E392 IonicContact NE-OE2 3.92Å; R268-E392 PolarHBondContact NE-OE2 2.83Å; R268-E392 IonicContact NH2-OE1 2.69Å; R268-E392 PolarHBondContact NH2-OE1 3.07Å; R268-E392 IonicContact NH2-OE2 3.68Å; R268-E392 PolarHBondContact O-N 2.88Å
269	T	96.9	Very high	95.1	Very high	6 Å²	6	29.9 Å²	29.9	4%	0.037	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	128.3	172.3	-56.6	0	0	0	0	108.6	L271 W371 V372 L380	T269-L271 HydrophobicContact CG2-CD2 4.11Å; T269-L271 HydrophobicContact CG2-CG 4.23Å; T269-W371 WeakPolarHBondContact O-CA 3.22Å; T269-V372 PolarHBondContact N-O 3.3Å; T269-V372 PolarHBondContact O-N 2.99Å; T269-L380 HydrophobicContact CG2-CD2 4.05Å
270	L	98.3	Very high	95.4	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	136.5	169.4	172.2	60.3	0	0	0	108.5	R241 V272 E369 W371 H389 G390	R241-L270 HydrophobicContact CB-CD2 4.09Å; L270-V272 HydrophobicContact CD1-CG2 3.84Å; L270-V272 HydrophobicContact CD2-CG2 4.44Å; L270-V272 HydrophobicContact CG-CG2 4.08Å; L270-E369 HydrophobicContact CD1-CB 3.61Å; L270-E369 HydrophobicContact CD1-CG 3.75Å; L270-W371 HydrophobicContact CB-CD2 4.38Å; L270-W371 HydrophobicContact CB-CE3 3.97Å; L270-W371 HydrophobicContact CB-CH2 3.73Å; L270-W371 HydrophobicContact CB-CZ2 4.13Å; L270-W371 HydrophobicContact CB-CZ3 3.63Å; L270-W371 HydrophobicContact CD1-CD2 4.14Å; L270-W371 HydrophobicContact CD1-CH2 4.31Å; L270-W371 HydrophobicContact CD1-CZ2 3.81Å; L270-W371 HydrophobicContact CD2-CH2 4.19Å; L270-W371 HydrophobicContact CD2-CZ2 4.15Å; L270-W371 HydrophobicContact CG-CH2 4.29Å; L270-W371 HydrophobicContact CG-CZ2 4.25Å; L270-H389 CarbonylContact O-C 3.59Å; L270-H389 WeakPolarHBondContact O-CA 3.37Å; L270-G390 PolarHBondContact N-O 2.89Å; L270-G390 PolarHBondContact O-N 3.41Å
271	L	98.8	Very high	95.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	132.3	172.9	-60.6	168.8	0	0	0	109	W152 I189 F191 T269 L370 V372 L380 I382 V387 L388 H389	W152-L271 HydrophobicContact CH2-CB 4.18Å; I189-L271 HydrophobicContact CD1-CD1 3.77Å; I189-L271 HydrophobicContact CG2-CD1 4.37Å; I189-L271 HydrophobicContact CG2-CD2 4.36Å; F191-L271 HydrophobicContact CZ-CD1 4.39Å; T269-L271 HydrophobicContact CG2-CD2 4.11Å; T269-L271 HydrophobicContact CG2-CG 4.23Å; L271-L370 HydrophobicContact CB-CB 4.27Å; L271-L370 HydrophobicContact CD1-CD2 4.35Å; L271-L370 PolarHBondContact N-O 3.44Å; L271-L370 PolarHBondContact O-N 2.81Å; L271-V372 HydrophobicContact CD1-CG2 4.13Å; L271-L380 HydrophobicContact CD1-CD1 4.35Å; L271-L380 HydrophobicContact CD1-CD2 4.1Å; L271-L380 HydrophobicContact CD2-CD2 4.19Å; L271-I382 HydrophobicContact CD2-CD1 3.66Å; L271-I382 HydrophobicContact CD2-CG1 4.16Å; L271-V387 HydrophobicContact CB-CG1 4.3Å; L271-V387 HydrophobicContact CD2-CG1 4.25Å; L271-L388 WeakPolarHBondContact CA-O 3.17Å; L271-H389 HydrophobicContact CD2-CB 3.93Å
272	V	98.8	Very high	95.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	123.6	179.6	-177	0	0	0	0	108.8	R241 L270 G274 L363 N368 E369 V387 L388	R241-V272 HydrophobicContact CB-CG2 4.5Å; L270-V272 HydrophobicContact CD1-CG2 3.84Å; L270-V272 HydrophobicContact CD2-CG2 4.44Å; L270-V272 HydrophobicContact CG-CG2 4.08Å; V272-G274 PolarHBondContact O-N 3.4Å; V272-L363 HydrophobicContact CG1-CD2 3.83Å; V272-N368 HydrophobicContact CG1-CB 4.37Å; V272-E369 HydrophobicContact CG2-CG 4.31Å; V272-V387 CarbonylContact O-C 3.57Å; V272-V387 WeakPolarHBondContact O-CA 3.26Å; V272-L388 HydrophobicContact CB-CB 4.5Å; V272-L388 PolarHBondContact N-O 3.19Å; V272-L388 PolarHBondContact O-N 2.96Å
273	D	98.9	Very high	96.3	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.011	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	103.3	172.5	-168.9	-8.6	0	0	0	110.2	L151 W152 F275 Y276 A277 R386	L151-D273 WeakPolarHBondContact CA-OD2 3.24Å; W152-D273 HydrophobicContact CD2-CB 3.7Å; W152-D273 HydrophobicContact CE3-CB 4.05Å; W152-D273 HydrophobicContact CG-CB 4.13Å; W152-D273 HydrophobicContact CH2-CB 4.2Å; W152-D273 HydrophobicContact CZ2-CB 3.86Å; W152-D273 HydrophobicContact CZ3-CB 4.29Å; W152-D273 PolarHBondContact N-OD2 2.74Å; W152-D273 VanDerWaalsContact O-CB 3.27Å; W152-D273 WeakPolarHBondContact O-CB 3.47Å; D273-F275 PolarHBondContact O-N 2.99Å; D273-F275 PolarHBondContact OD1-N 2.82Å; D273-F275 VanDerWaalsContact OD1-N 3.11Å; D273-Y276 PolarHBondContact O-N 2.95Å; D273-Y276 PolarHBondContact OD1-N 3.03Å; D273-A277 PolarHBondContact O-N 2.9Å; D273-A277 VanDerWaalsContact O-N 3.16Å; D273-R386 IonicContact OD1-CZ 3.52Å; D273-R386 IonicContact OD1-NE 2.75Å; D273-R386 PolarHBondContact OD1-NE 3.14Å; D273-R386 VanDerWaalsContact OD1-NE 3.08Å; D273-R386 IonicContact OD1-NH2 3.61Å; D273-R386 IonicContact OD2-CZ 2.67Å; D273-R386 IonicContact OD2-NE 2.97Å; D273-R386 IonicContact OD2-NH2 2.81Å; D273-R386 PolarHBondContact OD2-NH2 3.13Å
274	G	98.8	Very high	96.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.1	-30	-179.8	0	0	0	0	0	112.5	V272 A278 R386	V272-G274 PolarHBondContact O-N 3.4Å; G274-A278 VanDerWaalsContact O-CB 3.28Å; G274-A278 WeakPolarHBondContact O-CB 3.19Å; G274-A278 PolarHBondContact O-N 2.91Å; G274-R386 WeakPolarHBondContact CA-O 3.38Å; G274-R386 PolarHBondContact N-O 2.8Å
275	F	98.6	Very high	97.1	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.018	16%	0.162	C	C	.	.	H	α-helix	trans	-74.9	-37.3	178.6	-66.2	-8.2	0	0	0	111.7	L151 D273 A278 E279 L328 I331 W385 R386	L151-F275 HydrophobicContact CD2-CB 3.6Å; D273-F275 PolarHBondContact O-N 2.99Å; D273-F275 PolarHBondContact OD1-N 2.82Å; D273-F275 VanDerWaalsContact OD1-N 3.11Å; F275-A278 PolarHBondContact O-N 3.3Å; F275-E279 WeakPolarHBondContact O-CB 3.24Å; F275-E279 PolarHBondContact O-N 2.92Å; F275-L328 HydrophobicContact CB-CD1 4.4Å; F275-L328 HydrophobicContact CD1-CB 3.99Å; F275-L328 HydrophobicContact CD1-CD1 4.11Å; F275-L328 HydrophobicContact CE1-CB 4.05Å; F275-L328 HydrophobicContact CG-CB 4.23Å; F275-L328 HydrophobicContact CG-CD1 4.38Å; F275-L328 HydrophobicContact CZ-CB 4.34Å; F275-I331 HydrophobicContact CE1-CB 4.14Å; F275-I331 HydrophobicContact CE1-CG2 4.27Å; F275-W385 WeakPolarHBondContact CE1-O 3.17Å; F275-W385 VanDerWaalsContact CZ-O 3.3Å; F275-W385 WeakPolarHBondContact CZ-O 3.48Å; F275-R386 HydrophobicContact CB-CG 4.38Å; F275-R386 HydrophobicContact CD1-CG 4.3Å; F275-R386 HydrophobicContact CD2-CB 3.96Å; F275-R386 HydrophobicContact CD2-CG 3.41Å; F275-R386 VanDerWaalsContact CD2-CG 3.41Å; F275-R386 HydrophobicContact CE1-CB 4.27Å; F275-R386 HydrophobicContact CE1-CG 4.47Å; F275-R386 HydrophobicContact CE2-CB 3.6Å; F275-R386 HydrophobicContact CE2-CG 3.61Å; F275-R386 HydrophobicContact CG-CB 4.45Å; F275-R386 HydrophobicContact CG-CG 3.8Å; F275-R386 HydrophobicContact CZ-CB 3.78Å; F275-R386 HydrophobicContact CZ-CG 4.16Å
276	Y	98.7	Very high	97.4	Very high	40 Å²	40	31.1 Å²	31.1	16%	0.157	16%	0.155	C	C	.	.	H	α-helix	trans	-59.3	-48.6	170.7	-180	-92.2	0	0	0	111.1	L151 W152 N153 I156 D273 A278 E279 Q280 N368	L151-Y276 HydrophobicContact CB-CD2 3.95Å; W152-Y276 VanDerWaalsContact O-CB 3.25Å; W152-Y276 WeakPolarHBondContact O-CB 3.33Å; W152-Y276 VanDerWaalsContact O-CG 3.29Å; N153-Y276 HydrophobicContact CB-CD1 4.23Å; N153-Y276 HydrophobicContact CB-CE1 3.75Å; I156-Y276 HydrophobicContact CD1-CE2 4.14Å; D273-Y276 PolarHBondContact O-N 2.95Å; D273-Y276 PolarHBondContact OD1-N 3.03Å; Y276-A278 VanDerWaalsContact C-N 3.35Å; Y276-A278 PolarHBondContact O-N 2.7Å; Y276-E279 WeakPolarHBondContact O-CB 3.21Å; Y276-E279 PolarHBondContact O-N 3.11Å; Y276-Q280 HydrophobicContact CD1-CG 4.25Å; Y276-Q280 HydrophobicContact CE1-CG 3.86Å; Y276-Q280 WeakPolarHBondContact O-CG 3.21Å; Y276-Q280 PolarHBondContact O-N 2.91Å; Y276-N368 VanDerWaalsContact CE1-OD1 3.29Å; Y276-N368 WeakPolarHBondContact CE1-OD1 3.35Å
277	A	98.7	Very high	97.7	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-62	-41.8	178.2	0	0	0	0	0	112.1	D273 Q280 V281 L359 E362 L363	D273-A277 PolarHBondContact O-N 2.9Å; D273-A277 VanDerWaalsContact O-N 3.16Å; A277-Q280 WeakPolarHBondContact O-CB 3.47Å; A277-Q280 PolarHBondContact O-N 2.83Å; A277-V281 WeakPolarHBondContact O-CG2 3.49Å; A277-V281 PolarHBondContact O-N 2.99Å; A277-V281 VanDerWaalsContact O-N 3.07Å; A277-L359 HydrophobicContact CB-CD1 4.46Å; A277-E362 HydrophobicContact CB-CB 4.31Å; A277-L363 HydrophobicContact CB-CD2 3.53Å; A277-L363 HydrophobicContact CB-CG 3.97Å
278	A	98.4	Very high	98	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65	-37.8	176.8	0	0	0	0	0	112.4	G274 F275 Y276 Q280 V281 L282 F289 L319 L328 L359	G274-A278 VanDerWaalsContact O-CB 3.28Å; G274-A278 WeakPolarHBondContact O-CB 3.19Å; G274-A278 PolarHBondContact O-N 2.91Å; F275-A278 PolarHBondContact O-N 3.3Å; Y276-A278 VanDerWaalsContact C-N 3.35Å; Y276-A278 PolarHBondContact O-N 2.7Å; A278-Q280 VanDerWaalsContact C-N 3.32Å; A278-Q280 PolarHBondContact O-N 3.4Å; A278-V281 CarbonylContact O-C 3.56Å; A278-V281 WeakPolarHBondContact O-CB 3.32Å; A278-V281 PolarHBondContact O-N 3.46Å; A278-V281 VanDerWaalsContact O-N 3.12Å; A278-L282 PolarHBondContact O-N 3.08Å; A278-F289 HydrophobicContact CB-CE2 4.09Å; A278-F289 WeakPolarHBondContact O-CD2 3.41Å; A278-L319 HydrophobicContact CB-CD1 4.14Å; A278-L319 HydrophobicContact CB-CD2 3.83Å; A278-L328 HydrophobicContact CB-CD1 3.55Å; A278-L359 HydrophobicContact CB-CD1 4.47Å
279	E	97.6	Very high	98.2	Very high	64 Å²	64	33.4 Å²	33.4	30%	0.299	17%	0.168	S	C	.	.	H	α-helix	trans	-62.8	-39	173.5	-171.6	63.7	-156.1	0	0	111.4	L151 F275 Y276 V281 L282 Q283	L151-E279 HydrophobicContact CD1-CB 3.89Å; L151-E279 HydrophobicContact CD1-CG 4.02Å; F275-E279 WeakPolarHBondContact O-CB 3.24Å; F275-E279 PolarHBondContact O-N 2.92Å; Y276-E279 WeakPolarHBondContact O-CB 3.21Å; Y276-E279 PolarHBondContact O-N 3.11Å; E279-V281 VanDerWaalsContact C-N 3.31Å; E279-V281 PolarHBondContact O-N 2.76Å; E279-L282 WeakPolarHBondContact O-CB 3.25Å; E279-L282 PolarHBondContact O-N 3.37Å; E279-Q283 WeakPolarHBondContact O-CG 3.36Å; E279-Q283 PolarHBondContact O-N 2.85Å
280	Q	98.3	Very high	98.2	Very high	35 Å²	35	37.2 Å²	37.2	16%	0.164	19%	0.185	C	C	.	.	H	α-helix	trans	-62.4	-38.1	172.5	-65.6	-56.6	-68.8	0	0	112.1	Y276 A277 A278 K284 E362	Y276-Q280 HydrophobicContact CD1-CG 4.25Å; Y276-Q280 HydrophobicContact CE1-CG 3.86Å; Y276-Q280 WeakPolarHBondContact O-CG 3.21Å; Y276-Q280 PolarHBondContact O-N 2.91Å; A277-Q280 WeakPolarHBondContact O-CB 3.47Å; A277-Q280 PolarHBondContact O-N 2.83Å; A278-Q280 VanDerWaalsContact C-N 3.32Å; A278-Q280 PolarHBondContact O-N 3.4Å; Q280-K284 WeakPolarHBondContact O-CB 3.2Å; Q280-K284 WeakPolarHBondContact O-CD 3.42Å; Q280-K284 WeakPolarHBondContact O-CG 3.09Å; Q280-K284 PolarHBondContact O-N 2.82Å; Q280-K284 VanDerWaalsContact O-N 3.12Å; Q280-E362 HydrophobicContact CB-CG 4.46Å
281	V	98.3	Very high	98.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-66.8	-43.6	173.5	179.9	0	0	0	0	110.8	A277 A278 E279 Q283 K284 A285 Q288 F289 T358 L359 E362	A277-V281 WeakPolarHBondContact O-CG2 3.49Å; A277-V281 PolarHBondContact O-N 2.99Å; A277-V281 VanDerWaalsContact O-N 3.07Å; A278-V281 CarbonylContact O-C 3.56Å; A278-V281 WeakPolarHBondContact O-CB 3.32Å; A278-V281 PolarHBondContact O-N 3.46Å; A278-V281 VanDerWaalsContact O-N 3.12Å; E279-V281 VanDerWaalsContact C-N 3.31Å; E279-V281 PolarHBondContact O-N 2.76Å; V281-Q283 VanDerWaalsContact C-N 3.3Å; V281-Q283 PolarHBondContact O-N 3.33Å; V281-K284 PolarHBondContact O-N 3.15Å; V281-A285 CarbonylContact O-C 3.55Å; V281-A285 VanDerWaalsContact O-C 3.22Å; V281-A285 WeakPolarHBondContact O-CA 3.36Å; V281-A285 PolarHBondContact O-N 2.97Å; V281-Q288 HydrophobicContact CG1-CB 4.46Å; V281-F289 HydrophobicContact CG1-CB 4.23Å; V281-T358 HydrophobicContact CG1-CG2 4.26Å; V281-T358 HydrophobicContact CG2-CG2 4.25Å; V281-L359 HydrophobicContact CG2-CB 4.28Å; V281-L359 HydrophobicContact CG2-CD1 4.07Å; V281-E362 HydrophobicContact CG2-CB 4.33Å; V281-E362 HydrophobicContact CG2-CG 3.9Å
282	L	97.4	Very high	98.1	Very high	59 Å²	59	38.2 Å²	38.2	31%	0.309	19%	0.19	S	C	.	.	H	α-helix	trans	-57	-44.2	177.7	179.5	58.4	0	0	0	111.7	A278 E279 P286 F289	A278-L282 PolarHBondContact O-N 3.08Å; E279-L282 WeakPolarHBondContact O-CB 3.25Å; E279-L282 PolarHBondContact O-N 3.37Å; L282-P286 HydrophobicContact CD1-CB 4.4Å; L282-F289 HydrophobicContact CB-CB 4.31Å; L282-F289 HydrophobicContact CB-CD2 3.66Å; L282-F289 HydrophobicContact CB-CE2 4.02Å; L282-F289 HydrophobicContact CB-CG 3.95Å; L282-F289 HydrophobicContact CD1-CB 4.15Å; L282-F289 HydrophobicContact CD1-CD1 3.77Å; L282-F289 HydrophobicContact CD1-CD2 4.37Å; L282-F289 HydrophobicContact CD1-CE1 4.24Å; L282-F289 HydrophobicContact CD1-CG 3.85Å; L282-F289 HydrophobicContact CD2-CZ 4.46Å; L282-F289 HydrophobicContact CG-CD2 4.48Å; L282-F289 HydrophobicContact CG-CG 4.43Å
283	Q	97.3	Very high	98.1	Very high	126 Å²	126	39.1 Å²	39.1	59%	0.589	20%	0.197	S	C	*	.	H	α-helix	trans	-69.4	-38.1	179.8	-69.6	174.6	0.7	0	0	113.1	E279 V281	E279-Q283 WeakPolarHBondContact O-CG 3.36Å; E279-Q283 PolarHBondContact O-N 2.85Å; V281-Q283 VanDerWaalsContact C-N 3.3Å; V281-Q283 PolarHBondContact O-N 3.33Å
284	K	97.6	Very high	97.9	Very high	106 Å²	106	45.7 Å²	45.7	46%	0.461	23%	0.225	S	C	.	.	H	α-helix	trans	-91.4	-32.4	-173.6	-64.6	168.8	-167.3	169.3	0	113.5	Q280 V281 E362	Q280-K284 WeakPolarHBondContact O-CB 3.2Å; Q280-K284 WeakPolarHBondContact O-CD 3.42Å; Q280-K284 WeakPolarHBondContact O-CG 3.09Å; Q280-K284 PolarHBondContact O-N 2.82Å; Q280-K284 VanDerWaalsContact O-N 3.12Å; V281-K284 PolarHBondContact O-N 3.15Å; K284-E362 VanDerWaalsContact NZ-CD 3.34Å; K284-E362 IonicContact NZ-OE1 2.74Å; K284-E362 PolarHBondContact NZ-OE1 3.35Å; K284-E362 IonicContact NZ-OE2 2.74Å; K284-E362 PolarHBondContact NZ-OE2 3.33Å
285	A	97.9	Very high	97.9	Very high	19 Å²	19	46.5 Å²	46.5	16%	0.157	23%	0.23	C	C	.	.			trans	-149.7	68.2	-171.6	0	0	0	0	0	110.9	V281 D287 Q288 F289	V281-A285 CarbonylContact O-C 3.55Å; V281-A285 VanDerWaalsContact O-C 3.22Å; V281-A285 WeakPolarHBondContact O-CA 3.36Å; V281-A285 PolarHBondContact O-N 2.97Å; A285-D287 VanDerWaalsContact C-N 3.31Å; A285-D287 PolarHBondContact O-N 2.88Å; A285-Q288 HydrophobicContact CB-CB 4.02Å; A285-Q288 HydrophobicContact CB-CG 4.07Å; A285-Q288 WeakPolarHBondContact O-CB 3.47Å; A285-Q288 PolarHBondContact O-N 2.99Å; A285-F289 PolarHBondContact O-N 2.81Å; A285-F289 VanDerWaalsContact O-N 3.14Å
286	P	97.6	Very high	97.7	Very high	69 Å²	69	49.3 Å²	49.3	45%	0.448	25%	0.249	S	C	.	.	H	α-helix	trans	-57.4	-38.4	-174.6	21.3	-33.3	0	0	0	113.6	L282 Q288 F289 E290	L282-P286 HydrophobicContact CD1-CB 4.4Å; P286-Q288 PolarHBondContact O-N 2.88Å; P286-F289 WeakPolarHBondContact O-CB 3.4Å; P286-F289 PolarHBondContact O-N 2.99Å; P286-E290 PolarHBondContact O-N 2.92Å
287	D	97.9	Very high	97.6	Very high	112 Å²	112	47.5 Å²	47.5	60%	0.599	24%	0.242	S	C	*	.	H	α-helix	trans	-61.8	-30.7	176.8	-61.7	-11.1	0	0	0	112.6	A285 L291	A285-D287 VanDerWaalsContact C-N 3.31Å; A285-D287 PolarHBondContact O-N 2.88Å; D287-L291 WeakPolarHBondContact O-CB 3.5Å; D287-L291 PolarHBondContact O-N 3.41Å; D287-L291 VanDerWaalsContact O-N 3.14Å
288	Q	98.3	Very high	97.5	Very high	49 Å²	49	49.8 Å²	49.8	23%	0.229	25%	0.252	C	S	.	.	H	α-helix	trans	-79	-38.6	177.9	-65.7	-175.9	14.2	0	0	111.2	V281 A285 P286 E290 L291 L292 A355 T358	V281-Q288 HydrophobicContact CG1-CB 4.46Å; A285-Q288 HydrophobicContact CB-CB 4.02Å; A285-Q288 HydrophobicContact CB-CG 4.07Å; A285-Q288 WeakPolarHBondContact O-CB 3.47Å; A285-Q288 PolarHBondContact O-N 2.99Å; P286-Q288 PolarHBondContact O-N 2.88Å; Q288-E290 VanDerWaalsContact C-N 3.34Å; Q288-L291 PolarHBondContact O-N 2.75Å; Q288-L292 WeakPolarHBondContact O-CG 3.48Å; Q288-L292 PolarHBondContact O-N 3.36Å; Q288-A355 HydrophobicContact CB-CB 3.61Å; Q288-A355 HydrophobicContact CG-CB 4Å; Q288-T358 PolarHBondContact OE1-OG1 2.67Å
289	F	98.4	Very high	97.4	Very high	9 Å²	9	49.9 Å²	49.9	4%	0.039	25%	0.252	C	S	.	.	H	α-helix	trans	-57.8	-48.2	169.9	-179.2	-82.4	0	0	0	111	A278 V281 L282 A285 P286 L291 L292 S293 L319 V321 L328	A278-F289 HydrophobicContact CB-CE2 4.09Å; A278-F289 WeakPolarHBondContact O-CD2 3.41Å; V281-F289 HydrophobicContact CG1-CB 4.23Å; L282-F289 HydrophobicContact CB-CB 4.31Å; L282-F289 HydrophobicContact CB-CD2 3.66Å; L282-F289 HydrophobicContact CB-CE2 4.02Å; L282-F289 HydrophobicContact CB-CG 3.95Å; L282-F289 HydrophobicContact CD1-CB 4.15Å; L282-F289 HydrophobicContact CD1-CD1 3.77Å; L282-F289 HydrophobicContact CD1-CD2 4.37Å; L282-F289 HydrophobicContact CD1-CE1 4.24Å; L282-F289 HydrophobicContact CD1-CG 3.85Å; L282-F289 HydrophobicContact CD2-CZ 4.46Å; L282-F289 HydrophobicContact CG-CD2 4.48Å; L282-F289 HydrophobicContact CG-CG 4.43Å; A285-F289 PolarHBondContact O-N 2.81Å; A285-F289 VanDerWaalsContact O-N 3.14Å; P286-F289 WeakPolarHBondContact O-CB 3.4Å; P286-F289 PolarHBondContact O-N 2.99Å; F289-L291 VanDerWaalsContact C-N 3.27Å; F289-L291 PolarHBondContact O-N 2.87Å; F289-L292 PolarHBondContact O-N 2.95Å; F289-S293 PolarHBondContact O-N 2.77Å; F289-S293 PolarHBondContact O-OG 3.15Å; F289-L319 HydrophobicContact CD2-CD1 3.61Å; F289-L319 HydrophobicContact CE2-CD1 3.72Å; F289-L319 HydrophobicContact CG-CD1 4.21Å; F289-L319 HydrophobicContact CZ-CD1 4.35Å; F289-V321 HydrophobicContact CE1-CG1 4.11Å; F289-V321 HydrophobicContact CZ-CG1 4.01Å; F289-L328 HydrophobicContact CE2-CD1 4.03Å; F289-L328 HydrophobicContact CE2-CD2 4.48Å; F289-L328 HydrophobicContact CE2-CG 4.41Å; F289-L328 HydrophobicContact CZ-CD1 4.19Å; F289-L328 HydrophobicContact CZ-CD2 4.2Å; F289-L328 HydrophobicContact CZ-CG 4.09Å
290	E	97.3	Very high	97.4	Very high	86 Å²	86	49.4 Å²	49.4	40%	0.402	25%	0.25	S	C	.	.	H	α-helix	trans	-58	-41.5	177.3	-176.7	-177.1	-175.6	0	0	111.6	P286 Q288 S293 K294	P286-E290 PolarHBondContact O-N 2.92Å; Q288-E290 VanDerWaalsContact C-N 3.34Å; E290-S293 PolarHBondContact O-N 2.88Å; E290-S293 PolarHBondContact O-OG 3.21Å; E290-K294 HydrophobicContact CG-CD 3.77Å; E290-K294 HydrophobicContact CG-CG 4.33Å; E290-K294 WeakPolarHBondContact O-CB 3.38Å; E290-K294 WeakPolarHBondContact O-CG 3.26Å; E290-K294 PolarHBondContact O-N 3.22Å; E290-K294 WeakPolarHBondContact OE1-CE 3.41Å; E290-K294 IonicContact OE1-NZ 3.87Å; E290-K294 PolarHBondContact OE1-NZ 2.87Å
291	L	97.4	Very high	97.2	Very high	22 Å²	22	48.5 Å²	48.5	12%	0.115	25%	0.245	C	C	.	.	H	α-helix	trans	-66.3	-40.5	179	-162.9	66	0	0	0	112.2	D287 Q288 F289 S293 V295 V348 R351 W352 A355	D287-L291 WeakPolarHBondContact O-CB 3.5Å; D287-L291 PolarHBondContact O-N 3.41Å; D287-L291 VanDerWaalsContact O-N 3.14Å; Q288-L291 PolarHBondContact O-N 2.75Å; F289-L291 VanDerWaalsContact C-N 3.27Å; F289-L291 PolarHBondContact O-N 2.87Å; L291-S293 PolarHBondContact O-N 3.36Å; L291-V295 HydrophobicContact CD1-CG2 3.55Å; L291-V295 HydrophobicContact CG-CG2 3.94Å; L291-V295 WeakPolarHBondContact O-CB 3.41Å; L291-V295 VanDerWaalsContact O-CG2 3.28Å; L291-V295 WeakPolarHBondContact O-CG2 3.27Å; L291-V295 PolarHBondContact O-N 2.87Å; L291-V295 VanDerWaalsContact O-N 3.07Å; L291-V348 HydrophobicContact CD1-CG1 3.84Å; L291-R351 HydrophobicContact CD2-CB 3.62Å; L291-R351 WeakPolarHBondContact CD2-O 3.46Å; L291-W352 VanDerWaalsContact CD2-CA 3.46Å; L291-W352 HydrophobicContact CD2-CB 4.05Å; L291-W352 VanDerWaalsContact CD2-N 3.27Å; L291-W352 HydrophobicContact CG-CB 4.47Å; L291-A355 HydrophobicContact CB-CB 4.4Å; L291-A355 HydrophobicContact CD2-CB 4.29Å
292	L	98	Very high	97	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-67.8	-23.3	175.4	-70.6	167.8	0	0	0	113	Q288 F289 P317 V318 L319 A355 H356 L359	Q288-L292 WeakPolarHBondContact O-CG 3.48Å; Q288-L292 PolarHBondContact O-N 3.36Å; F289-L292 PolarHBondContact O-N 2.95Å; L292-P317 WeakPolarHBondContact O-CB 3.16Å; L292-V318 HydrophobicContact CD2-CB 4.25Å; L292-V318 HydrophobicContact CD2-CG2 4.33Å; L292-V318 PolarHBondContact O-N 2.94Å; L292-L319 HydrophobicContact CB-CB 4.42Å; L292-L319 HydrophobicContact CB-CD1 3.72Å; L292-L319 HydrophobicContact CB-CG 3.91Å; L292-L319 HydrophobicContact CD1-CD1 4.13Å; L292-L319 PolarHBondContact O-N 2.67Å; L292-L319 VanDerWaalsContact O-N 3.09Å; L292-A355 HydrophobicContact CD1-CB 4.24Å; L292-A355 HydrophobicContact CD2-CB 4.26Å; L292-A355 HydrophobicContact CG-CB 3.88Å; L292-H356 HydrophobicContact CD2-CB 4.36Å; L292-L359 HydrophobicContact CD1-CB 3.79Å; L292-L359 HydrophobicContact CD1-CD2 4.04Å; L292-L359 HydrophobicContact CD1-CG 4.48Å
293	S	98	Very high	96.8	Very high	19 Å²	19	49.4 Å²	49.4	13%	0.133	25%	0.253	C	S	.	.	H	α-helix	trans	-92.2	-21.6	178.8	71.5	0	0	0	0	115.1	F289 E290 L291 P317 L319	F289-S293 PolarHBondContact O-N 2.77Å; F289-S293 PolarHBondContact O-OG 3.15Å; E290-S293 PolarHBondContact O-N 2.88Å; E290-S293 PolarHBondContact O-OG 3.21Å; L291-S293 PolarHBondContact O-N 3.36Å; S293-P317 VanDerWaalsContact O-CB 3.27Å; S293-P317 WeakPolarHBondContact O-CB 3.47Å; S293-P317 WeakPolarHBondContact O-CG 3.36Å; S293-L319 WeakPolarHBondContact CA-O 3.32Å; S293-L319 VanDerWaalsContact CB-O 3.25Å; S293-L319 WeakPolarHBondContact CB-O 3.48Å
294	K	96.3	Very high	96.4	Very high	140 Å²	140	48.8 Å²	48.8	61%	0.609	25%	0.254	S	S	*	.	H	α-helix	trans	-104.1	-25.7	-177.9	-67.9	-174	178.9	-179.7	0	114.7	E290 P296	E290-K294 HydrophobicContact CG-CD 3.77Å; E290-K294 HydrophobicContact CG-CG 4.33Å; E290-K294 WeakPolarHBondContact O-CB 3.38Å; E290-K294 WeakPolarHBondContact O-CG 3.26Å; E290-K294 PolarHBondContact O-N 3.22Å; E290-K294 WeakPolarHBondContact OE1-CE 3.41Å; E290-K294 IonicContact OE1-NZ 3.87Å; E290-K294 PolarHBondContact OE1-NZ 2.87Å; K294-P296 WeakPolarHBondContact O-CD 3.26Å
295	V	97	Very high	95.7	Very high	17 Å²	17	47.1 Å²	47.1	10%	0.103	25%	0.252	C	S	.	.			trans	-87.4	109.2	-176.2	178	0	0	0	0	110.1	L291 L297 P317 V344 V348 W352	L291-V295 HydrophobicContact CD1-CG2 3.55Å; L291-V295 HydrophobicContact CG-CG2 3.94Å; L291-V295 WeakPolarHBondContact O-CB 3.41Å; L291-V295 VanDerWaalsContact O-CG2 3.28Å; L291-V295 WeakPolarHBondContact O-CG2 3.27Å; L291-V295 PolarHBondContact O-N 2.87Å; L291-V295 VanDerWaalsContact O-N 3.07Å; V295-L297 HydrophobicContact CG1-CD2 4.24Å; V295-P317 WeakPolarHBondContact O-CA 3.38Å; V295-V344 HydrophobicContact CG1-CB 4.43Å; V295-V344 HydrophobicContact CG1-CG1 4.09Å; V295-V344 HydrophobicContact CG1-CG2 3.47Å; V295-V344 VanDerWaalsContact CG1-CG2 3.47Å; V295-V348 HydrophobicContact CG2-CG1 4.14Å; V295-W352 HydrophobicContact CG1-CG 4.42Å
296	P	95.7	Very high	94.9	Very high	64 Å²	64	49.8 Å²	49.8	42%	0.416	28%	0.281	S	S	.	.			trans	-76.1	139.8	177.5	32.7	-35	0	0	0	111	K294 V315	K294-P296 WeakPolarHBondContact O-CD 3.26Å; P296-V315 HydrophobicContact CB-CG1 4.02Å
297	L	95.3	Very high	94.2	Very high	2 Å²	2	50 Å²	50	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	147.3	178.5	-58.3	169.9	0	0	0	110.7	V295 H299 V315 G316 V318 I341 V344 W352	V295-L297 HydrophobicContact CG1-CD2 4.24Å; L297-H299 PolarHBondContact O-ND1 3.13Å; L297-V315 WeakPolarHBondContact O-CA 3.4Å; L297-G316 PolarHBondContact N-O 3.03Å; L297-G316 PolarHBondContact O-N 3.5Å; L297-G316 VanDerWaalsContact O-N 3.08Å; L297-V318 HydrophobicContact CD1-CG2 3.82Å; L297-I341 HydrophobicContact CD2-CD1 4.2Å; L297-I341 HydrophobicContact CD2-CG1 4.31Å; L297-I341 HydrophobicContact CD2-CG2 4.15Å; L297-V344 HydrophobicContact CD2-CG2 3.84Å; L297-W352 VanDerWaalsContact CD1-CE2 3.47Å; L297-W352 HydrophobicContact CD1-CH2 3.8Å; L297-W352 HydrophobicContact CD1-CZ2 3.05Å; L297-W352 HydrophobicContact CD2-CZ2 4.32Å; L297-W352 HydrophobicContact CG-CZ2 4.23Å
298	K	96.8	Very high	93.5	Very high	47 Å²	47	45.9 Å²	45.9	20%	0.204	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	132	170.7	-172.5	174.8	61	134.5	0	109.8	E300 I313 A339	K298-E300 IonicContact NZ-OE1 3.7Å; K298-E300 IonicContact NZ-OE2 3.38Å; K298-E300 PolarHBondContact NZ-OE2 3.37Å; K298-I313 HydrophobicContact CD-CG2 3.84Å; K298-I313 HydrophobicContact CG-CG2 3.64Å; K298-A339 HydrophobicContact CB-CB 3.93Å; K298-A339 HydrophobicContact CD-CB 4.18Å; K298-A339 HydrophobicContact CG-CB 3.76Å; K298-A339 WeakPolarHBondContact O-CB 3.47Å; K298-A339 PolarHBondContact O-N 3.31Å
299	H	96.9	Very high	93.2	Very high	3 Å²	3	50 Å²	50	1%	0.014	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	137.2	167.3	-55.8	75.1	0	0	0	107.2	T246 L297 I313 G314 D337	T246-H299 WeakPolarHBondContact OG1-CB 3.49Å; T246-H299 PolarHBondContact OG1-CD2 3.42Å; L297-H299 PolarHBondContact O-ND1 3.13Å; H299-I313 WeakPolarHBondContact O-CA 3.47Å; H299-G314 PolarHBondContact N-O 2.83Å; H299-G314 PolarHBondContact O-N 2.94Å; H299-D337 CarbonylContact C-O 3.57Å; H299-D337 VanDerWaalsContact CA-O 3.25Å; H299-D337 WeakPolarHBondContact CA-O 3.42Å; H299-D337 IonicContact CD2-OD1 3.89Å
300	E	97	Very high	93	Very high	53 Å²	53	51.1 Å²	51.1	25%	0.248	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	129.4	-167.5	-177.5	163	-145.9	0	0	111.2	K298 V302 H311 M312 I313 D337 A339	K298-E300 IonicContact NZ-OE1 3.7Å; K298-E300 IonicContact NZ-OE2 3.38Å; K298-E300 PolarHBondContact NZ-OE2 3.37Å; E300-V302 HydrophobicContact CG-CG2 4.05Å; E300-H311 IonicContact OE1-CD2 2.74Å; E300-H311 IonicContact OE1-CE1 3.78Å; E300-H311 IonicContact OE1-NE2 3.57Å; E300-H311 PolarHBondContact OE1-NE2 3.5Å; E300-M312 WeakPolarHBondContact CA-O 3.37Å; E300-I313 HydrophobicContact CB-CG1 4.49Å; E300-I313 HydrophobicContact CG-CG1 4.13Å; E300-D337 PolarHBondContact N-O 2.9Å; E300-A339 HydrophobicContact CB-CB 3.72Å
301	Y	95.8	Very high	92.9	Very high	16 Å²	16	52.7 Å²	52.7	6%	0.063	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	125.5	171.5	179.9	-99.7	0	0	0	109	I216 Y247 E303 N310 H311 M312	I216-Y301 HydrophobicContact CD1-CD1 4.12Å; I216-Y301 HydrophobicContact CD1-CE1 3.64Å; Y247-Y301 HydrophobicContact CD2-CG 4.43Å; Y247-Y301 HydrophobicContact CE1-CD2 4.23Å; Y247-Y301 HydrophobicContact CE1-CG 4.2Å; Y247-Y301 HydrophobicContact CE2-CD1 4.41Å; Y247-Y301 HydrophobicContact CE2-CG 4.09Å; Y247-Y301 AromaticContact CZ-CG 3.98Å; Y301-E303 HydrophobicContact CD1-CB 4.4Å; Y301-E303 HydrophobicContact CE1-CB 3.52Å; Y301-E303 HydrophobicContact CE1-CG 4.49Å; Y301-E303 PolarHBondContact OH-OE1 3Å; Y301-E303 VanDerWaalsContact OH-OE1 3.14Å; Y301-E303 PolarHBondContact OH-OE2 2.84Å; Y301-N310 HydrophobicContact CD1-CB 4.27Å; Y301-N310 HydrophobicContact CE1-CB 4.07Å; Y301-H311 WeakPolarHBondContact O-CA 3.47Å; Y301-M312 HydrophobicContact CD1-CE 3.67Å; Y301-M312 HydrophobicContact CE1-CE 4.32Å; Y301-M312 HydrophobicContact CG-CE 4.44Å; Y301-M312 PolarHBondContact N-O 3.48Å; Y301-M312 PolarHBondContact O-N 3.42Å
302	V	94	Very high	92.9	Very high	76 Å²	76	53.3 Å²	53.3	46%	0.461	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	121.3	175.7	-178.2	0	0	0	0	107.8	E300 N304 N310	E300-V302 HydrophobicContact CG-CG2 4.05Å; V302-N304 WeakPolarHBondContact CG1-ND2 3.33Å; V302-N310 CarbonylContact C-O 3.59Å; V302-N310 WeakPolarHBondContact CA-O 3.43Å
303	E	91.8	Very high	92.8	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.009	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	125.3	177.6	178.3	176.1	-130.5	0	0	109.8	R229 G230 Y301 C308 H309 N310	R229-E303 WeakPolarHBondContact CA-OE1 3.25Å; R229-E303 WeakPolarHBondContact CD-OE1 3.05Å; G230-E303 PolarHBondContact N-OE1 3.45Å; Y301-E303 HydrophobicContact CD1-CB 4.4Å; Y301-E303 HydrophobicContact CE1-CB 3.52Å; Y301-E303 HydrophobicContact CE1-CG 4.49Å; Y301-E303 PolarHBondContact OH-OE1 3Å; Y301-E303 VanDerWaalsContact OH-OE1 3.14Å; Y301-E303 PolarHBondContact OH-OE2 2.84Å; E303-C308 HydrophobicContact CG-CB 4.06Å; E303-H309 CarbonylContact O-C 3.59Å; E303-H309 VanDerWaalsContact O-CA 3.31Å; E303-H309 WeakPolarHBondContact O-CA 3.31Å; E303-N310 HydrophobicContact CB-CB 4.22Å; E303-N310 PolarHBondContact N-O 3.4Å; E303-N310 PolarHBondContact O-N 3.06Å; E303-N310 PolarHBondContact OE2-ND2 3.36Å
304	N	90.4	Very high	92.8	Very high	113 Å²	113	55.5 Å²	55.5	60%	0.604	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.6	47.6	174.9	-62	-64.5	0	0	0	109.3	V302 C308	V302-N304 WeakPolarHBondContact CG1-ND2 3.33Å; N304-C308 WeakPolarHBondContact CA-O 3.47Å
305	V	81.8	Confident	92.8	Very high	72 Å²	72	52.6 Å²	52.6	44%	0.436	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	128.5	-176.8	-180	0	0	0	0	109.5	G307 C308	V305-G307 PolarHBondContact O-N 2.84Å; V305-C308 PolarHBondContact N-O 3.27Å; V305-C308 PolarHBondContact O-N 2.86Å
306	G	81.7	Confident	92.7	Very high	74 Å²	74	52 Å²	52	76%	0.763	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	-130.4	-176.1	0	0	0	0	0	111.8
307	G	81.8	Confident	92.8	Very high	73 Å²	73	50.1 Å²	50.1	75%	0.753	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-2.4	174.9	0	0	0	0	0	114.7	V305 H309	V305-G307 PolarHBondContact O-N 2.84Å; G307-H309 PolarHBondContact O-ND1 3.31Å; G307-H309 VanDerWaalsContact O-ND1 3.14Å
308	C	84.6	Confident	92.9	Very high	26 Å²	26	50.2 Å²	50.2	18%	0.176	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	127	-176	-64.5	0	0	0	0	111	R229 E303 N304 V305	R229-C308 PolarHBondContact NH2-SG 3.36Å; E303-C308 HydrophobicContact CG-CB 4.06Å; N304-C308 WeakPolarHBondContact CA-O 3.47Å; V305-C308 PolarHBondContact N-O 3.27Å; V305-C308 PolarHBondContact O-N 2.86Å
309	H	91.8	Very high	93	Very high	136 Å²	136	48 Å²	48	63%	0.63	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.6	91.9	-179.8	-63.3	84.1	0	0	0	108.7	E303 G307	E303-H309 CarbonylContact O-C 3.59Å; E303-H309 VanDerWaalsContact O-CA 3.31Å; E303-H309 WeakPolarHBondContact O-CA 3.31Å; G307-H309 PolarHBondContact O-ND1 3.31Å; G307-H309 VanDerWaalsContact O-ND1 3.14Å
310	N	94.1	Very high	93.1	Very high	32 Å²	32	48.5 Å²	48.5	17%	0.171	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	136.7	-176.4	-63.2	-60.5	0	0	0	110.1	I216 Y301 V302 E303 M312	I216-N310 HydrophobicContact CD1-CB 4.07Å; I216-N310 WeakPolarHBondContact CG2-OD1 3.35Å; Y301-N310 HydrophobicContact CD1-CB 4.27Å; Y301-N310 HydrophobicContact CE1-CB 4.07Å; V302-N310 CarbonylContact C-O 3.59Å; V302-N310 WeakPolarHBondContact CA-O 3.43Å; E303-N310 HydrophobicContact CB-CB 4.22Å; E303-N310 PolarHBondContact N-O 3.4Å; E303-N310 PolarHBondContact O-N 3.06Å; E303-N310 PolarHBondContact OE2-ND2 3.36Å; N310-M312 HydrophobicContact CB-CE 4.4Å
311	H	95.5	Very high	93	Very high	120 Å²	120	47.1 Å²	47.1	56%	0.556	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.2	110.6	169	-173.9	-174.2	0	0	0	108.7	E300 Y301	E300-H311 IonicContact OE1-CD2 2.74Å; E300-H311 IonicContact OE1-CE1 3.78Å; E300-H311 IonicContact OE1-NE2 3.57Å; E300-H311 PolarHBondContact OE1-NE2 3.5Å; Y301-H311 WeakPolarHBondContact O-CA 3.47Å
312	M	96.6	Very high	92.9	Very high	35 Å²	35	48.5 Å²	48.5	17%	0.172	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	140.2	-176	-66.8	178.1	-69.7	0	0	110.7	I216 Y247 F248 E300 Y301 N310	I216-M312 HydrophobicContact CB-CE 4.47Å; I216-M312 HydrophobicContact CD1-CE 3.21Å; I216-M312 HydrophobicContact CG1-CE 3.62Å; I216-M312 HydrophobicContact CG1-SD 4.39Å; I216-M312 HydrophobicContact CG2-CE 4.15Å; I216-M312 HydrophobicContact CG2-SD 4.03Å; Y247-M312 HydrophobicContact CD2-CB 3.8Å; Y247-M312 HydrophobicContact CD2-CE 3.88Å; Y247-M312 HydrophobicContact CD2-SD 4.44Å; Y247-M312 HydrophobicContact CE2-CE 3.48Å; Y247-M312 VanDerWaalsContact CE2-CE 3.48Å; Y247-M312 HydrophobicContact CE2-SD 4.4Å; F248-M312 HydrophobicContact CD1-CE 4.38Å; F248-M312 HydrophobicContact CD1-SD 3.78Å; F248-M312 HydrophobicContact CE1-CE 3.66Å; F248-M312 HydrophobicContact CE1-SD 3.32Å; F248-M312 WeakPolarHBondContact CE1-SD 3.07Å; F248-M312 HydrophobicContact CZ-SD 4.33Å; E300-M312 WeakPolarHBondContact CA-O 3.37Å; Y301-M312 HydrophobicContact CD1-CE 3.67Å; Y301-M312 HydrophobicContact CE1-CE 4.32Å; Y301-M312 HydrophobicContact CG-CE 4.44Å; Y301-M312 PolarHBondContact N-O 3.48Å; Y301-M312 PolarHBondContact O-N 3.42Å; N310-M312 HydrophobicContact CB-CE 4.4Å
313	I	96.8	Very high	92.5	Very high	65 Å²	65	50.4 Å²	50.4	33%	0.333	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	125.8	-178.4	-61.7	176.2	0	0	0	109.2	Y247 Q249 K298 H299 E300 V315	Y247-I313 CarbonylContact O-C 3.59Å; Y247-I313 PolarHBondContact O-N 2.88Å; Q249-I313 PolarHBondContact NE2-O 3.37Å; K298-I313 HydrophobicContact CD-CG2 3.84Å; K298-I313 HydrophobicContact CG-CG2 3.64Å; H299-I313 WeakPolarHBondContact O-CA 3.47Å; E300-I313 HydrophobicContact CB-CG1 4.49Å; E300-I313 HydrophobicContact CG-CG1 4.13Å; I313-V315 HydrophobicContact CG2-CG2 4.31Å
314	G	96.6	Very high	92.2	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	140.6	172.3	0	0	0	0	0	109.4	Y247 H299	Y247-G314 WeakPolarHBondContact O-CA 3.35Å; Y247-G314 PolarHBondContact O-N 3.49Å; H299-G314 PolarHBondContact N-O 2.83Å; H299-G314 PolarHBondContact O-N 2.94Å
315	V	96.5	Very high	91.9	Very high	78 Å²	78	53.2 Å²	53.2	47%	0.473	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	128.4	177.5	-178.6	0	0	0	0	109.1	P296 L297 I313	P296-V315 HydrophobicContact CB-CG1 4.02Å; L297-V315 WeakPolarHBondContact O-CA 3.4Å; I313-V315 HydrophobicContact CG2-CG2 4.31Å
316	G	96.1	Very high	92.2	Very high	6 Å²	6	54.8 Å²	54.8	6%	0.062	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.1	164.1	177	0	0	0	0	0	112.2	L297	L297-G316 PolarHBondContact N-O 3.03Å; L297-G316 PolarHBondContact O-N 3.5Å; L297-G316 VanDerWaalsContact O-N 3.08Å
317	P	97.1	Very high	92.7	Very high	23 Å²	23	52.2 Å²	52.2	15%	0.149	29%	0.288	C	S	.	.			trans	-68.6	160.5	172.9	30.7	-34.5	0	0	0	110.9	L292 S293 V295 L319 N320	L292-P317 WeakPolarHBondContact O-CB 3.16Å; S293-P317 VanDerWaalsContact O-CB 3.27Å; S293-P317 WeakPolarHBondContact O-CB 3.47Å; S293-P317 WeakPolarHBondContact O-CG 3.36Å; V295-P317 WeakPolarHBondContact O-CA 3.38Å; P317-L319 VanDerWaalsContact C-N 3.31Å; P317-N320 WeakPolarHBondContact CD-OD1 3.38Å; P317-N320 WeakPolarHBondContact CG-OD1 3.35Å; P317-N320 PolarHBondContact O-ND2 3.2Å
318	V	97.9	Very high	93.3	Very high	4 Å²	4	49.3 Å²	49.3	2%	0.024	25%	0.254	C	S	.	.	S	Bend	trans	-65	-40.7	174.4	174.9	0	0	0	0	110	L292 L297 I331 R332 Y333 W352 L359	L292-V318 HydrophobicContact CD2-CB 4.25Å; L292-V318 HydrophobicContact CD2-CG2 4.33Å; L292-V318 PolarHBondContact O-N 2.94Å; L297-V318 HydrophobicContact CD1-CG2 3.82Å; V318-I331 CarbonylContact O-C 3.54Å; V318-I331 WeakPolarHBondContact O-CA 3.31Å; V318-R332 WeakPolarHBondContact CA-O 3.35Å; V318-R332 PolarHBondContact O-N 3.31Å; V318-Y333 HydrophobicContact CG1-CD2 4.06Å; V318-W352 HydrophobicContact CG2-CZ2 4.19Å; V318-L359 HydrophobicContact CG1-CD2 3.71Å
319	L	98.4	Very high	93.9	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	108.6	-179.5	-62.6	-177.1	0	0	0	110.4	A278 F289 L292 S293 P317 L328 I331 L359	A278-L319 HydrophobicContact CB-CD1 4.14Å; A278-L319 HydrophobicContact CB-CD2 3.83Å; F289-L319 HydrophobicContact CD2-CD1 3.61Å; F289-L319 HydrophobicContact CE2-CD1 3.72Å; F289-L319 HydrophobicContact CG-CD1 4.21Å; F289-L319 HydrophobicContact CZ-CD1 4.35Å; L292-L319 HydrophobicContact CB-CB 4.42Å; L292-L319 HydrophobicContact CB-CD1 3.72Å; L292-L319 HydrophobicContact CB-CG 3.91Å; L292-L319 HydrophobicContact CD1-CD1 4.13Å; L292-L319 PolarHBondContact O-N 2.67Å; L292-L319 VanDerWaalsContact O-N 3.09Å; S293-L319 WeakPolarHBondContact CA-O 3.32Å; S293-L319 VanDerWaalsContact CB-O 3.25Å; S293-L319 WeakPolarHBondContact CB-O 3.48Å; P317-L319 VanDerWaalsContact C-N 3.31Å; L319-L328 HydrophobicContact CB-CD2 3.84Å; L319-L328 HydrophobicContact CD2-CD2 4.05Å; L319-L328 HydrophobicContact CG-CD2 4.4Å; L319-I331 HydrophobicContact CD2-CD1 3.71Å; L319-I331 HydrophobicContact CD2-CG1 3.97Å; L319-L359 HydrophobicContact CD2-CD2 4.26Å
320	N	98	Very high	94.2	Very high	14 Å²	14	45.4 Å²	45.4	8%	0.075	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	122.6	179.8	-62.3	-103.6	0	0	0	108.7	P317 L328 Y329 L330	P317-N320 WeakPolarHBondContact CD-OD1 3.38Å; P317-N320 WeakPolarHBondContact CG-OD1 3.35Å; P317-N320 PolarHBondContact O-ND2 3.2Å; N320-L328 WeakPolarHBondContact O-CA 3.3Å; N320-Y329 HydrophobicContact CB-CD1 4.45Å; N320-Y329 HydrophobicContact CB-CD2 4.37Å; N320-Y329 HydrophobicContact CB-CE1 3.91Å; N320-Y329 HydrophobicContact CB-CE2 3.81Å; N320-Y329 WeakPolarHBondContact O-CD1 3.28Å; N320-Y329 PolarHBondContact O-N 2.85Å; N320-L330 HydrophobicContact CB-CB 3.93Å; N320-L330 HydrophobicContact CB-CG 4.37Å; N320-L330 WeakPolarHBondContact CB-O 3.42Å; N320-L330 PolarHBondContact N-O 3.18Å; N320-L330 PolarHBondContact ND2-O 2.96Å; N320-L330 PolarHBondContact O-N 3.36Å
321	V	96.3	Very high	94.4	Very high	24 Å²	24	43.9 Å²	43.9	15%	0.145	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	147.5	-174.6	-61.5	0	0	0	0	111.4	F289 P323 E327 L328 Y329	F289-V321 HydrophobicContact CE1-CG1 4.11Å; F289-V321 HydrophobicContact CZ-CG1 4.01Å; V321-P323 WeakPolarHBondContact O-CD 3.49Å; V321-E327 CarbonylContact C-O 3.6Å; V321-E327 VanDerWaalsContact CA-O 3.29Å; V321-E327 WeakPolarHBondContact CA-O 3.35Å; V321-L328 HydrophobicContact CG1-CD2 3.7Å; V321-L328 HydrophobicContact CG1-CG 4.01Å; V321-Y329 VanDerWaalsContact C-CE1 3.49Å
322	Y	92.6	Very high	94.5	Very high	46 Å²	46	39 Å²	39	18%	0.18	20%	0.2	C	C	.	.			trans	-69	126	171.3	-70.7	-57.1	0	0	0	110.1	M146 W324 N325 N326 E327 Y329	M146-Y322 HydrophobicContact CB-CE2 3.87Å; M146-Y322 HydrophobicContact CG-CD2 3.91Å; M146-Y322 HydrophobicContact CG-CE2 3.57Å; Y322-W324 AromaticContact CD1-CH2 3.07Å; Y322-W324 HydrophobicContact CD1-CH2 3.07Å; Y322-W324 AromaticContact CD1-CZ2 3.76Å; Y322-W324 HydrophobicContact CD1-CZ2 3.76Å; Y322-W324 AromaticContact CD1-CZ3 3.52Å; Y322-W324 HydrophobicContact CD1-CZ3 3.52Å; Y322-W324 HydrophobicContact CD2-CH2 4.23Å; Y322-W324 HydrophobicContact CD2-CZ2 4.08Å; Y322-W324 AromaticContact CE1-CH2 3.69Å; Y322-W324 HydrophobicContact CE1-CH2 3.69Å; Y322-W324 HydrophobicContact CE1-CZ2 4.37Å; Y322-W324 HydrophobicContact CE1-CZ3 4.41Å; Y322-W324 AromaticContact CG-CH2 3.4Å; Y322-W324 HydrophobicContact CG-CH2 3.4Å; Y322-W324 AromaticContact CG-CZ2 3.58Å; Y322-W324 HydrophobicContact CG-CZ2 3.58Å; Y322-W324 AromaticContact CG-CZ3 3.91Å; Y322-W324 HydrophobicContact CG-CZ3 3.91Å; Y322-W324 PolarHBondContact O-N 3.48Å; Y322-W324 VanDerWaalsContact O-N 3.1Å; Y322-N325 VanDerWaalsContact CB-OD1 3.29Å; Y322-N325 WeakPolarHBondContact CB-OD1 3.49Å; Y322-N325 PolarHBondContact O-N 3.37Å; Y322-N326 WeakPolarHBondContact O-CA 3.48Å; Y322-N326 PolarHBondContact O-N 2.95Å; Y322-E327 HydrophobicContact CD2-CB 4.04Å; Y322-E327 HydrophobicContact CD2-CG 4.24Å; Y322-E327 PolarHBondContact N-O 2.95Å; Y322-Y329 AromaticContact CD1-CD1 3.81Å; Y322-Y329 HydrophobicContact CD1-CD1 3.81Å; Y322-Y329 HydrophobicContact CD1-CE1 4.17Å; Y322-Y329 HydrophobicContact CD2-CD1 4.18Å; Y322-Y329 AromaticContact CE1-CD1 3.84Å; Y322-Y329 HydrophobicContact CE1-CD1 3.84Å; Y322-Y329 HydrophobicContact CE1-CE1 4.34Å; Y322-Y329 HydrophobicContact CE1-CG 4.16Å; Y322-Y329 HydrophobicContact CE2-CD1 4.19Å; Y322-Y329 HydrophobicContact CE2-CG 4.27Å; Y322-Y329 AromaticContact CG-CD1 4Å; Y322-Y329 HydrophobicContact CG-CD1 4Å
323	P	87.3	Confident	94.5	Very high	116 Å²	116	37.7 Å²	37.7	75%	0.753	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.5	-172.7	-27.1	35.2	0	0	0	115.4	V321	V321-P323 WeakPolarHBondContact O-CD 3.49Å
324	W	84.3	Confident	94.6	Very high	128 Å²	128	35.3 Å²	35.3	49%	0.485	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-23.2	-174.4	64.9	89.3	0	0	0	114.2	M146 Y322	M146-W324 HydrophobicContact CG-CZ2 4.02Å; M146-W324 HydrophobicContact SD-CZ2 3.91Å; Y322-W324 AromaticContact CD1-CH2 3.07Å; Y322-W324 HydrophobicContact CD1-CH2 3.07Å; Y322-W324 AromaticContact CD1-CZ2 3.76Å; Y322-W324 HydrophobicContact CD1-CZ2 3.76Å; Y322-W324 AromaticContact CD1-CZ3 3.52Å; Y322-W324 HydrophobicContact CD1-CZ3 3.52Å; Y322-W324 HydrophobicContact CD2-CH2 4.23Å; Y322-W324 HydrophobicContact CD2-CZ2 4.08Å; Y322-W324 AromaticContact CE1-CH2 3.69Å; Y322-W324 HydrophobicContact CE1-CH2 3.69Å; Y322-W324 HydrophobicContact CE1-CZ2 4.37Å; Y322-W324 HydrophobicContact CE1-CZ3 4.41Å; Y322-W324 AromaticContact CG-CH2 3.4Å; Y322-W324 HydrophobicContact CG-CH2 3.4Å; Y322-W324 AromaticContact CG-CZ2 3.58Å; Y322-W324 HydrophobicContact CG-CZ2 3.58Å; Y322-W324 AromaticContact CG-CZ3 3.91Å; Y322-W324 HydrophobicContact CG-CZ3 3.91Å; Y322-W324 PolarHBondContact O-N 3.48Å; Y322-W324 VanDerWaalsContact O-N 3.1Å
325	N	85.2	Confident	94.4	Very high	46 Å²	46	39.2 Å²	39.2	25%	0.246	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.5	1.2	-176.7	69.2	-2.8	0	0	0	114.2	Y322 E327	Y322-N325 VanDerWaalsContact CB-OD1 3.29Å; Y322-N325 WeakPolarHBondContact CB-OD1 3.49Å; Y322-N325 PolarHBondContact O-N 3.37Å; N325-E327 PolarHBondContact ND2-OE2 3.02Å; N325-E327 VanDerWaalsContact ND2-OE2 3.1Å; N325-E327 PolarHBondContact O-N 3.35Å; N325-E327 VanDerWaalsContact O-N 3.13Å; N325-E327 WeakPolarHBondContact OD1-CB 3.44Å; N325-E327 PolarHBondContact OD1-N 3.29Å
326	N	86.9	Confident	94.2	Very high	104 Å²	104	40.6 Å²	40.6	56%	0.556	20%	0.2	S	C	*	.			trans	57.2	16.8	-175.1	-67.1	-30.9	0	0	0	114.9	Y322 L328	Y322-N326 WeakPolarHBondContact O-CA 3.48Å; Y322-N326 PolarHBondContact O-N 2.95Å; N326-L328 PolarHBondContact O-N 3.36Å
327	E	91.8	Very high	94.1	Very high	21 Å²	21	40.8 Å²	40.8	10%	0.098	20%	0.199	C	C	.	.			trans	-68.3	125.9	177.7	176.6	-175.2	-179.7	0	0	109.9	V145 M146 R149 V321 Y322 N325	V145-E327 VanDerWaalsContact CG1-OE1 3.26Å; V145-E327 WeakPolarHBondContact CG1-OE1 3.47Å; M146-E327 WeakPolarHBondContact CG-OE2 3.3Å; M146-E327 PolarHBondContact N-OE1 3.38Å; M146-E327 PolarHBondContact N-OE2 3.24Å; R149-E327 IonicContact CZ-OE1 3.63Å; R149-E327 IonicContact NH2-OE1 3.64Å; R149-E327 PolarHBondContact NH2-OE1 3.33Å; V321-E327 CarbonylContact C-O 3.6Å; V321-E327 VanDerWaalsContact CA-O 3.29Å; V321-E327 WeakPolarHBondContact CA-O 3.35Å; Y322-E327 HydrophobicContact CD2-CB 4.04Å; Y322-E327 HydrophobicContact CD2-CG 4.24Å; Y322-E327 PolarHBondContact N-O 2.95Å; N325-E327 PolarHBondContact ND2-OE2 3.02Å; N325-E327 VanDerWaalsContact ND2-OE2 3.1Å; N325-E327 PolarHBondContact O-N 3.35Å; N325-E327 VanDerWaalsContact O-N 3.13Å; N325-E327 WeakPolarHBondContact OD1-CB 3.44Å; N325-E327 PolarHBondContact OD1-N 3.29Å
328	L	95.6	Very high	94	Very high	11 Å²	11	42.8 Å²	42.8	6%	0.058	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	132.8	176.3	-79.1	160.7	0	0	0	111.2	R149 F275 A278 F289 L319 N320 V321 N326	R149-L328 VanDerWaalsContact CZ-O 3.24Å; R149-L328 PolarHBondContact NH1-O 3.44Å; R149-L328 PolarHBondContact NH2-O 2.85Å; F275-L328 HydrophobicContact CB-CD1 4.4Å; F275-L328 HydrophobicContact CD1-CB 3.99Å; F275-L328 HydrophobicContact CD1-CD1 4.11Å; F275-L328 HydrophobicContact CE1-CB 4.05Å; F275-L328 HydrophobicContact CG-CB 4.23Å; F275-L328 HydrophobicContact CG-CD1 4.38Å; F275-L328 HydrophobicContact CZ-CB 4.34Å; A278-L328 HydrophobicContact CB-CD1 3.55Å; F289-L328 HydrophobicContact CE2-CD1 4.03Å; F289-L328 HydrophobicContact CE2-CD2 4.48Å; F289-L328 HydrophobicContact CE2-CG 4.41Å; F289-L328 HydrophobicContact CZ-CD1 4.19Å; F289-L328 HydrophobicContact CZ-CD2 4.2Å; F289-L328 HydrophobicContact CZ-CG 4.09Å; L319-L328 HydrophobicContact CB-CD2 3.84Å; L319-L328 HydrophobicContact CD2-CD2 4.05Å; L319-L328 HydrophobicContact CG-CD2 4.4Å; N320-L328 WeakPolarHBondContact O-CA 3.3Å; V321-L328 HydrophobicContact CG1-CD2 3.7Å; V321-L328 HydrophobicContact CG1-CG 4.01Å; N326-L328 PolarHBondContact O-N 3.36Å
329	Y	96.2	Very high	93.9	Very high	73 Å²	73	43.1 Å²	43.1	29%	0.286	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	-16.7	173.8	70.1	-98.1	0	0	0	113.9	N320 V321 Y322	N320-Y329 HydrophobicContact CB-CD1 4.45Å; N320-Y329 HydrophobicContact CB-CD2 4.37Å; N320-Y329 HydrophobicContact CB-CE1 3.91Å; N320-Y329 HydrophobicContact CB-CE2 3.81Å; N320-Y329 WeakPolarHBondContact O-CD1 3.28Å; N320-Y329 PolarHBondContact O-N 2.85Å; V321-Y329 VanDerWaalsContact C-CE1 3.49Å; Y322-Y329 AromaticContact CD1-CD1 3.81Å; Y322-Y329 HydrophobicContact CD1-CD1 3.81Å; Y322-Y329 HydrophobicContact CD1-CE1 4.17Å; Y322-Y329 HydrophobicContact CD2-CD1 4.18Å; Y322-Y329 AromaticContact CE1-CD1 3.84Å; Y322-Y329 HydrophobicContact CE1-CD1 3.84Å; Y322-Y329 HydrophobicContact CE1-CE1 4.34Å; Y322-Y329 HydrophobicContact CE1-CG 4.16Å; Y322-Y329 HydrophobicContact CE2-CD1 4.19Å; Y322-Y329 HydrophobicContact CE2-CG 4.27Å; Y322-Y329 AromaticContact CG-CD1 4Å; Y322-Y329 HydrophobicContact CG-CD1 4Å
330	L	97.8	Very high	93.7	Very high	8 Å²	8	48.1 Å²	48.1	4%	0.042	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	131.7	177.2	161.8	67.5	0	0	0	111.8	P251 N320 R332 W385	P251-L330 HydrophobicContact CG-CD2 4.37Å; N320-L330 HydrophobicContact CB-CB 3.93Å; N320-L330 HydrophobicContact CB-CG 4.37Å; N320-L330 WeakPolarHBondContact CB-O 3.42Å; N320-L330 PolarHBondContact N-O 3.18Å; N320-L330 PolarHBondContact ND2-O 2.96Å; N320-L330 PolarHBondContact O-N 3.36Å; L330-R332 HydrophobicContact CD1-CG 4.25Å; L330-R332 HydrophobicContact CD2-CG 4.02Å; L330-R332 HydrophobicContact CG-CG 4.07Å; L330-W385 CarbonylContact C-O 3.55Å; L330-W385 WeakPolarHBondContact CA-O 3.27Å; L330-W385 HydrophobicContact CB-CB 4.38Å; L330-W385 HydrophobicContact CB-CD2 4.38Å; L330-W385 HydrophobicContact CB-CE3 4.2Å; L330-W385 HydrophobicContact CB-CG 4.5Å; L330-W385 HydrophobicContact CD1-CB 3.69Å; L330-W385 HydrophobicContact CD1-CD2 4Å; L330-W385 HydrophobicContact CD1-CG 3.55Å
331	I	98.3	Very high	93.6	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	118.4	165.8	-167.7	159.2	0	0	0	110.9	T243 F275 V318 L319 L359 W385 L388	T243-I331 HydrophobicContact CG2-CG2 3.9Å; T243-I331 PolarHBondContact OG1-O 3Å; F275-I331 HydrophobicContact CE1-CB 4.14Å; F275-I331 HydrophobicContact CE1-CG2 4.27Å; V318-I331 CarbonylContact O-C 3.54Å; V318-I331 WeakPolarHBondContact O-CA 3.31Å; L319-I331 HydrophobicContact CD2-CD1 3.71Å; L319-I331 HydrophobicContact CD2-CG1 3.97Å; I331-L359 HydrophobicContact CD1-CD2 4.47Å; I331-W385 WeakPolarHBondContact CG2-O 3.46Å; I331-W385 PolarHBondContact N-O 3.33Å; I331-L388 HydrophobicContact CD1-CD1 4.1Å; I331-L388 HydrophobicContact CG2-CD1 3.97Å
332	R	97.8	Very high	93.4	Very high	17 Å²	17	53.3 Å²	53.3	6%	0.064	26%	0.264	C	S	.	.			trans	-100.1	90.2	171.4	-68	-176.7	-177.1	-111.8	3.8	108.2	T246 F248 Q249 P251 V318 L330	T246-R332 HydrophobicContact CG2-CB 4.38Å; T246-R332 PolarHBondContact O-NH1 2.83Å; F248-R332 PolarHBondContact O-NH1 2.86Å; Q249-R332 PolarHBondContact O-NH2 3.39Å; P251-R332 HydrophobicContact CG-CG 4.48Å; P251-R332 VanDerWaalsContact CG-CZ 3.45Å; P251-R332 VanDerWaalsContact CG-NH1 3.35Å; V318-R332 WeakPolarHBondContact CA-O 3.35Å; V318-R332 PolarHBondContact O-N 3.31Å; L330-R332 HydrophobicContact CD1-CG 4.25Å; L330-R332 HydrophobicContact CD2-CG 4.02Å; L330-R332 HydrophobicContact CG-CG 4.07Å
333	Y	98	Very high	93.4	Very high	8 Å²	8	55.4 Å²	55.4	3%	0.031	28%	0.282	C	S	.	.			trans	-132.5	101.6	-177.4	-172.9	-80.2	0	0	0	109.4	R241 H242 T243 V318 H356 L359 T360 L363 L388	R241-Y333 HydrophobicContact CG-CE1 4.36Å; H242-Y333 CarbonylContact C-O 3.58Å; H242-Y333 WeakPolarHBondContact CA-O 3.3Å; T243-Y333 PolarHBondContact N-O 2.98Å; T243-Y333 PolarHBondContact OG1-N 2.81Å; T243-Y333 VanDerWaalsContact OG1-N 3.1Å; V318-Y333 HydrophobicContact CG1-CD2 4.06Å; Y333-H356 AromaticContact CE2-NE2 3.72Å; Y333-L359 HydrophobicContact CD2-CD2 4.12Å; Y333-L359 HydrophobicContact CE2-CD2 4.38Å; Y333-T360 WeakPolarHBondContact OH-CB 3.46Å; Y333-T360 WeakPolarHBondContact OH-CG2 3.37Å; Y333-T360 PolarHBondContact OH-OG1 3.39Å; Y333-L363 HydrophobicContact CD1-CD1 4.28Å; Y333-L363 HydrophobicContact CD2-CD1 4.04Å; Y333-L363 HydrophobicContact CE1-CD1 4.09Å; Y333-L363 HydrophobicContact CE2-CD1 3.83Å; Y333-L363 HydrophobicContact CG-CD1 4.26Å; Y333-L388 HydrophobicContact CD1-CD2 3.36Å; Y333-L388 HydrophobicContact CE1-CD2 4.07Å; Y333-L388 HydrophobicContact CG-CD2 3.83Å
334	N	97.4	Very high	93.8	Very high	15 Å²	15	50.8 Å²	50.8	8%	0.08	25%	0.251	C	S	.	.			trans	-147.4	120.5	168.3	-178.3	-20.5	0	0	0	107.9	H242 T243 T246 Y336 D337 R338	H242-N334 HydrophobicContact CB-CB 3.87Å; T243-N334 WeakPolarHBondContact O-CB 3.49Å; T243-N334 PolarHBondContact O-ND2 2.91Å; T246-N334 HydrophobicContact CG2-CB 3.65Å; N334-Y336 VanDerWaalsContact C-N 3.31Å; N334-Y336 VanDerWaalsContact OD1-CB 3.32Å; N334-Y336 WeakPolarHBondContact OD1-CB 3.31Å; N334-Y336 WeakPolarHBondContact OD1-CD2 3.43Å; N334-Y336 PolarHBondContact OD1-N 3.48Å; N334-D337 WeakPolarHBondContact CB-OD1 3.41Å; N334-D337 VanDerWaalsContact CG-CG 3.45Å; N334-D337 VanDerWaalsContact CG-OD1 3.24Å; N334-D337 PolarHBondContact ND2-OD2 2.91Å; N334-R338 PolarHBondContact O-N 3.24Å
335	N	93.1	Very high	94.3	Very high	82 Å²	82	48.2 Å²	48.2	44%	0.439	25%	0.251	S	S	.	.	S	Bend	trans	-79.8	-19.5	-176.3	-176	73.5	0	0	0	112
336	Y	92.5	Very high	94.8	Very high	106 Å²	106	56.2 Å²	56.2	42%	0.416	28%	0.279	S	S	.	.	S	Bend	trans	-78	-33.7	-176	-54.1	-68.8	0	0	0	112.3	D240 N334	D240-Y336 WeakPolarHBondContact CB-OH 3.45Å; D240-Y336 PolarHBondContact N-OH 2.74Å; N334-Y336 VanDerWaalsContact C-N 3.31Å; N334-Y336 VanDerWaalsContact OD1-CB 3.32Å; N334-Y336 WeakPolarHBondContact OD1-CB 3.31Å; N334-Y336 WeakPolarHBondContact OD1-CD2 3.43Å; N334-Y336 PolarHBondContact OD1-N 3.48Å
337	D	93.7	Very high	95.2	Very high	10 Å²	10	57 Å²	57	5%	0.053	28%	0.283	C	S	.	.	S	Bend	trans	-107.2	1.1	-178.7	63.4	8.5	0	0	0	113.2	T246 Y247 H299 E300 N334 A339	T246-D337 PolarHBondContact OG1-OD1 2.66Å; T246-D337 PolarHBondContact OG1-OD2 2.71Å; Y247-D337 HydrophobicContact CD1-CB 3.72Å; Y247-D337 WeakPolarHBondContact CD1-OD2 3.46Å; Y247-D337 HydrophobicContact CE1-CB 4.2Å; Y247-D337 WeakPolarHBondContact CE1-OD2 3.48Å; H299-D337 CarbonylContact C-O 3.57Å; H299-D337 VanDerWaalsContact CA-O 3.25Å; H299-D337 WeakPolarHBondContact CA-O 3.42Å; H299-D337 IonicContact CD2-OD1 3.89Å; E300-D337 PolarHBondContact N-O 2.9Å; N334-D337 WeakPolarHBondContact CB-OD1 3.41Å; N334-D337 VanDerWaalsContact CG-CG 3.45Å; N334-D337 VanDerWaalsContact CG-OD1 3.24Å; N334-D337 PolarHBondContact ND2-OD2 2.91Å; D337-A339 PolarHBondContact O-N 2.91Å; D337-A339 VanDerWaalsContact O-N 3.13Å
338	R	94.6	Very high	95.5	Very high	65 Å²	65	57.1 Å²	57.1	25%	0.245	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-63.2	115.7	171.2	-174.9	-174.5	57.9	65.9	4.8	109.4	N334	N334-R338 PolarHBondContact O-N 3.24Å
339	A	95.7	Very high	95.6	Very high	12 Å²	12	58.2 Å²	58.2	10%	0.099	29%	0.293	C	S	.	.			trans	-74.8	177.9	-177.5	0	0	0	0	0	112.3	K298 E300 D337 I341	K298-A339 HydrophobicContact CB-CB 3.93Å; K298-A339 HydrophobicContact CD-CB 4.18Å; K298-A339 HydrophobicContact CG-CB 3.76Å; K298-A339 WeakPolarHBondContact O-CB 3.47Å; K298-A339 PolarHBondContact O-N 3.31Å; E300-A339 HydrophobicContact CB-CB 3.72Å; D337-A339 PolarHBondContact O-N 2.91Å; D337-A339 VanDerWaalsContact O-N 3.13Å; A339-I341 PolarHBondContact O-N 3.22Å
340	V	95.4	Very high	95.6	Very high	105 Å²	105	61.5 Å²	61.5	64%	0.636	31%	0.311	S	S	*	.			trans	-57.6	127.9	172.7	-179.8	0	0	0	0	110	N342	V340-N342 HydrophobicContact CG1-CB 4.37Å; V340-N342 PolarHBondContact O-N 2.77Å; V340-N342 VanDerWaalsContact O-N 3.12Å
341	I	94.6	Very high	95.7	Very high	31 Å²	31	67.8 Å²	67.8	16%	0.159	33%	0.334	C	S	.	.			trans	-83.8	86.5	178.9	-53.4	-176	0	0	0	108.8	L297 A339 V344 V349 W352 Y353	L297-I341 HydrophobicContact CD2-CD1 4.2Å; L297-I341 HydrophobicContact CD2-CG1 4.31Å; L297-I341 HydrophobicContact CD2-CG2 4.15Å; A339-I341 PolarHBondContact O-N 3.22Å; I341-V344 HydrophobicContact CG2-CB 3.67Å; I341-V344 HydrophobicContact CG2-CG2 3.37Å; I341-V349 HydrophobicContact CG2-CG2 4.22Å; I341-W352 HydrophobicContact CD1-CD2 4.48Å; I341-W352 HydrophobicContact CD1-CE3 3.65Å; I341-W352 HydrophobicContact CD1-CH2 3.82Å; I341-W352 HydrophobicContact CD1-CZ3 3.25Å; I341-Y353 HydrophobicContact CD1-CE1 4.3Å; I341-Y353 HydrophobicContact CD1-CE2 4.39Å
342	N	93.8	Very high	95.6	Very high	115 Å²	115	67.8 Å²	67.8	62%	0.615	33%	0.334	S	S	*	.			trans	-115.8	4.9	179.4	63.1	-1.9	0	0	0	113.7	V340	V340-N342 HydrophobicContact CG1-CB 4.37Å; V340-N342 PolarHBondContact O-N 2.77Å; V340-N342 VanDerWaalsContact O-N 3.12Å
343	T	92.4	Very high	95.6	Very high	91 Å²	91	72.1 Å²	72.1	56%	0.558	35%	0.351	S	S	*	.	S	Bend	trans	-106.5	-11.1	177.9	54.5	0	0	0	0	113.6
344	V	95.1	Very high	95.7	Very high	18 Å²	18	74.3 Å²	74.3	11%	0.109	37%	0.365	C	S	.	.	S	Bend	trans	-90	127.3	-178.2	-176.9	0	0	0	0	109.4	V295 L297 I341 V348 V349	V295-V344 HydrophobicContact CG1-CB 4.43Å; V295-V344 HydrophobicContact CG1-CG1 4.09Å; V295-V344 HydrophobicContact CG1-CG2 3.47Å; V295-V344 VanDerWaalsContact CG1-CG2 3.47Å; L297-V344 HydrophobicContact CD2-CG2 3.84Å; I341-V344 HydrophobicContact CG2-CB 3.67Å; I341-V344 HydrophobicContact CG2-CG2 3.37Å; V344-V348 HydrophobicContact CG1-CB 3.91Å; V344-V348 HydrophobicContact CG1-CG1 3.83Å; V344-V349 HydrophobicContact CB-CB 4.46Å; V344-V349 HydrophobicContact CG1-CB 4.04Å; V344-V349 HydrophobicContact CG1-CG2 4.48Å
345	P	95.7	Very high	95.7	Very high	74 Å²	74	73.6 Å²	73.6	48%	0.481	36%	0.361	S	S	.	.			trans	-56.1	149.4	178.2	-27.8	36.1	0	0	0	113.7	D347 V348 V349	P345-D347 VanDerWaalsContact C-N 3.28Å; P345-D347 WeakPolarHBondContact CB-OD1 3.48Å; P345-D347 PolarHBondContact O-N 2.94Å; P345-V348 HydrophobicContact CB-CB 4.36Å; P345-V348 HydrophobicContact CB-CG2 4.09Å; P345-V348 HydrophobicContact CG-CG2 4.38Å; P345-V348 PolarHBondContact O-N 3.38Å; P345-V349 PolarHBondContact O-N 3.22Å
346	Y	95.3	Very high	95.9	Very high	214 Å²	214	71 Å²	71	84%	0.839	35%	0.346	S	S	*	.	H	α-helix	trans	-56.6	-38.6	-177.5	173.1	-97.6	0	0	0	113.3	V348	Y346-V348 PolarHBondContact O-N 2.97Å
347	D	95.6	Very high	96.2	Very high	120 Å²	120	74.9 Å²	74.9	64%	0.642	36%	0.36	S	S	*	.	H	α-helix	trans	-74.8	-12.9	178.7	63.2	-44.3	0	0	0	113.5	P345	P345-D347 VanDerWaalsContact C-N 3.28Å; P345-D347 WeakPolarHBondContact CB-OD1 3.48Å; P345-D347 PolarHBondContact O-N 2.94Å
348	V	97.1	Very high	96.5	Very high	24 Å²	24	76 Å²	76	15%	0.145	37%	0.368	C	S	.	.	H	α-helix	trans	-104.1	-35.4	-178.6	-178.3	0	0	0	0	112.1	L291 V295 V344 P345 Y346 H350 R351 W352	L291-V348 HydrophobicContact CD1-CG1 3.84Å; V295-V348 HydrophobicContact CG2-CG1 4.14Å; V344-V348 HydrophobicContact CG1-CB 3.91Å; V344-V348 HydrophobicContact CG1-CG1 3.83Å; P345-V348 HydrophobicContact CB-CB 4.36Å; P345-V348 HydrophobicContact CB-CG2 4.09Å; P345-V348 HydrophobicContact CG-CG2 4.38Å; P345-V348 PolarHBondContact O-N 3.38Å; Y346-V348 PolarHBondContact O-N 2.97Å; V348-H350 VanDerWaalsContact C-N 3.33Å; V348-H350 PolarHBondContact O-N 3.15Å; V348-R351 WeakPolarHBondContact O-CB 3.38Å; V348-R351 PolarHBondContact O-N 2.77Å; V348-W352 PolarHBondContact O-N 3.4Å
349	V	97.3	Very high	96.7	Very high	34 Å²	34	73 Å²	73	21%	0.206	36%	0.356	C	S	.	.	H	α-helix	trans	-57.9	-39.8	-168.1	71.6	0	0	0	0	113.5	I341 V344 P345 W352 Y353	I341-V349 HydrophobicContact CG2-CG2 4.22Å; V344-V349 HydrophobicContact CB-CB 4.46Å; V344-V349 HydrophobicContact CG1-CB 4.04Å; V344-V349 HydrophobicContact CG1-CG2 4.48Å; P345-V349 PolarHBondContact O-N 3.22Å; V349-W352 WeakPolarHBondContact O-CB 3.4Å; V349-W352 PolarHBondContact O-N 3.23Å; V349-Y353 HydrophobicContact CG2-CD2 3.99Å; V349-Y353 HydrophobicContact CG2-CE2 3.72Å; V349-Y353 VanDerWaalsContact O-CD2 3.24Å; V349-Y353 WeakPolarHBondContact O-CD2 3.43Å; V349-Y353 PolarHBondContact O-N 2.96Å
350	H	97.8	Very high	96.8	Very high	143 Å²	143	73 Å²	73	66%	0.662	36%	0.355	S	S	*	.	H	α-helix	trans	-64.5	-45.7	177.7	-176.5	76.1	0	0	0	111.8	V348 W352 Y353 T354	V348-H350 VanDerWaalsContact C-N 3.33Å; V348-H350 PolarHBondContact O-N 3.15Å; H350-W352 PolarHBondContact O-N 3.31Å; H350-Y353 PolarHBondContact O-N 2.67Å; H350-Y353 VanDerWaalsContact O-N 3.17Å; H350-T354 PolarHBondContact O-N 3.38Å; H350-T354 PolarHBondContact O-OG1 2.53Å
351	R	98	Very high	96.9	Very high	139 Å²	139	71.5 Å²	71.5	53%	0.525	35%	0.346	S	S	.	.	H	α-helix	trans	-61.1	-36.9	176.5	-65.9	169.8	60.3	-161	-1	110.8	L291 V348 T354 A355	L291-R351 HydrophobicContact CD2-CB 3.62Å; L291-R351 WeakPolarHBondContact CD2-O 3.46Å; V348-R351 WeakPolarHBondContact O-CB 3.38Å; V348-R351 PolarHBondContact O-N 2.77Å; R351-T354 WeakPolarHBondContact O-CB 3.26Å; R351-T354 PolarHBondContact O-N 2.76Å; R351-A355 WeakPolarHBondContact O-CB 3.27Å; R351-A355 PolarHBondContact O-N 2.87Å
352	W	97.6	Very high	97.1	Very high	1 Å²	1	70.5 Å²	70.5	0%	0.004	34%	0.341	C	S	.	.	H	α-helix	trans	-64.4	-44.4	176.3	-178.5	89.2	0	0	0	111.3	L291 V295 L297 V318 I341 V348 V349 H350 T354 A355 H356	L291-W352 VanDerWaalsContact CD2-CA 3.46Å; L291-W352 HydrophobicContact CD2-CB 4.05Å; L291-W352 VanDerWaalsContact CD2-N 3.27Å; L291-W352 HydrophobicContact CG-CB 4.47Å; V295-W352 HydrophobicContact CG1-CG 4.42Å; L297-W352 VanDerWaalsContact CD1-CE2 3.47Å; L297-W352 HydrophobicContact CD1-CH2 3.8Å; L297-W352 HydrophobicContact CD1-CZ2 3.05Å; L297-W352 HydrophobicContact CD2-CZ2 4.32Å; L297-W352 HydrophobicContact CG-CZ2 4.23Å; V318-W352 HydrophobicContact CG2-CZ2 4.19Å; I341-W352 HydrophobicContact CD1-CD2 4.48Å; I341-W352 HydrophobicContact CD1-CE3 3.65Å; I341-W352 HydrophobicContact CD1-CH2 3.82Å; I341-W352 HydrophobicContact CD1-CZ3 3.25Å; V348-W352 PolarHBondContact O-N 3.4Å; V349-W352 WeakPolarHBondContact O-CB 3.4Å; V349-W352 PolarHBondContact O-N 3.23Å; H350-W352 PolarHBondContact O-N 3.31Å; W352-T354 VanDerWaalsContact C-N 3.31Å; W352-T354 PolarHBondContact O-N 3.18Å; W352-A355 PolarHBondContact O-N 2.96Å; W352-H356 HydrophobicContact CE3-CB 4.41Å; W352-H356 HydrophobicContact CH2-CB 3.79Å; W352-H356 AromaticContact CH2-CD2 3.39Å; W352-H356 WeakPolarHBondContact CH2-CD2 3.48Å; W352-H356 AromaticContact CH2-CG 3.7Å; W352-H356 HydrophobicContact CZ2-CB 3.94Å; W352-H356 AromaticContact CZ2-CD2 3.65Å; W352-H356 HydrophobicContact CZ3-CB 4.04Å; W352-H356 WeakPolarHBondContact O-CB 3.32Å; W352-H356 PolarHBondContact O-N 2.92Å
353	Y	97.9	Very high	97.3	Very high	108 Å²	108	65 Å²	65	42%	0.424	31%	0.312	S	S	.	.	H	α-helix	trans	-62	-37.4	173.9	-82.7	-68	0	0	0	112.7	I341 V349 H350 R357	I341-Y353 HydrophobicContact CD1-CE1 4.3Å; I341-Y353 HydrophobicContact CD1-CE2 4.39Å; V349-Y353 HydrophobicContact CG2-CD2 3.99Å; V349-Y353 HydrophobicContact CG2-CE2 3.72Å; V349-Y353 VanDerWaalsContact O-CD2 3.24Å; V349-Y353 WeakPolarHBondContact O-CD2 3.43Å; V349-Y353 PolarHBondContact O-N 2.96Å; H350-Y353 PolarHBondContact O-N 2.67Å; H350-Y353 VanDerWaalsContact O-N 3.17Å; Y353-R357 WeakPolarHBondContact O-CB 3.43Å; Y353-R357 PolarHBondContact O-N 3.3Å
354	T	98.4	Very high	97.6	Very high	54 Å²	54	66.9 Å²	66.9	33%	0.331	31%	0.309	S	S	.	.	H	α-helix	trans	-60.8	-48.1	172.3	-51.6	0	0	0	0	111.1	H350 R351 W352 R357 T358	H350-T354 PolarHBondContact O-N 3.38Å; H350-T354 PolarHBondContact O-OG1 2.53Å; R351-T354 WeakPolarHBondContact O-CB 3.26Å; R351-T354 PolarHBondContact O-N 2.76Å; W352-T354 VanDerWaalsContact C-N 3.31Å; W352-T354 PolarHBondContact O-N 3.18Å; T354-R357 WeakPolarHBondContact O-CB 3.29Å; T354-R357 PolarHBondContact O-N 3.08Å; T354-T358 PolarHBondContact O-N 2.99Å; T354-T358 PolarHBondContact O-OG1 2.89Å
355	A	98.5	Very high	97.7	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.8	-46.2	179.3	0	0	0	0	0	112.2	Q288 L291 L292 R351 W352 R357 T358 L359	Q288-A355 HydrophobicContact CB-CB 3.61Å; Q288-A355 HydrophobicContact CG-CB 4Å; L291-A355 HydrophobicContact CB-CB 4.4Å; L291-A355 HydrophobicContact CD2-CB 4.29Å; L292-A355 HydrophobicContact CD1-CB 4.24Å; L292-A355 HydrophobicContact CD2-CB 4.26Å; L292-A355 HydrophobicContact CG-CB 3.88Å; R351-A355 WeakPolarHBondContact O-CB 3.27Å; R351-A355 PolarHBondContact O-N 2.87Å; W352-A355 PolarHBondContact O-N 2.96Å; A355-R357 VanDerWaalsContact C-N 3.32Å; A355-R357 PolarHBondContact O-N 2.9Å; A355-T358 WeakPolarHBondContact O-CB 3.23Å; A355-T358 PolarHBondContact O-N 2.96Å; A355-T358 VanDerWaalsContact O-N 3.15Å; A355-L359 PolarHBondContact O-N 3.12Å
356	H	98.1	Very high	97.8	Very high	26 Å²	26	71.4 Å²	71.4	12%	0.12	33%	0.326	C	S	.	.	H	α-helix	trans	-56.8	-46.2	174.4	179.5	-78.3	0	0	0	111	L292 Y333 W352 T358 L359 T360	L292-H356 HydrophobicContact CD2-CB 4.36Å; Y333-H356 AromaticContact CE2-NE2 3.72Å; W352-H356 HydrophobicContact CE3-CB 4.41Å; W352-H356 HydrophobicContact CH2-CB 3.79Å; W352-H356 AromaticContact CH2-CD2 3.39Å; W352-H356 WeakPolarHBondContact CH2-CD2 3.48Å; W352-H356 AromaticContact CH2-CG 3.7Å; W352-H356 HydrophobicContact CZ2-CB 3.94Å; W352-H356 AromaticContact CZ2-CD2 3.65Å; W352-H356 HydrophobicContact CZ3-CB 4.04Å; W352-H356 WeakPolarHBondContact O-CB 3.32Å; W352-H356 PolarHBondContact O-N 2.92Å; H356-T358 VanDerWaalsContact C-N 3.31Å; H356-T358 PolarHBondContact O-N 3.15Å; H356-L359 PolarHBondContact O-N 3.11Å; H356-T360 PolarHBondContact CE1-OG1 2.86Å; H356-T360 PolarHBondContact ND1-OG1 2.97Å; H356-T360 WeakPolarHBondContact O-CB 3.39Å; H356-T360 PolarHBondContact O-N 2.93Å; H356-T360 PolarHBondContact O-OG1 2.82Å
357	R	98.3	Very high	97.9	Very high	188 Å²	188	66.2 Å²	66.2	71%	0.709	31%	0.31	S	S	*	.	H	α-helix	trans	-59	-41.3	177.1	-176.4	179.5	-173.8	177.7	3.4	112.1	Y353 T354 A355 T360 T361	Y353-R357 WeakPolarHBondContact O-CB 3.43Å; Y353-R357 PolarHBondContact O-N 3.3Å; T354-R357 WeakPolarHBondContact O-CB 3.29Å; T354-R357 PolarHBondContact O-N 3.08Å; A355-R357 VanDerWaalsContact C-N 3.32Å; A355-R357 PolarHBondContact O-N 2.9Å; R357-T360 PolarHBondContact O-N 3.5Å; R357-T361 WeakPolarHBondContact O-CB 3.05Å; R357-T361 PolarHBondContact O-N 2.69Å; R357-T361 PolarHBondContact O-OG1 3.3Å
358	T	98.6	Very high	98.1	Very high	35 Å²	35	60.8 Å²	60.8	22%	0.215	28%	0.281	C	S	.	.	H	α-helix	trans	-63.3	-47.6	177.7	-59.7	0	0	0	0	111.2	V281 Q288 T354 A355 H356 T361 E362	V281-T358 HydrophobicContact CG1-CG2 4.26Å; V281-T358 HydrophobicContact CG2-CG2 4.25Å; Q288-T358 PolarHBondContact OE1-OG1 2.67Å; T354-T358 PolarHBondContact O-N 2.99Å; T354-T358 PolarHBondContact O-OG1 2.89Å; A355-T358 WeakPolarHBondContact O-CB 3.23Å; A355-T358 PolarHBondContact O-N 2.96Å; A355-T358 VanDerWaalsContact O-N 3.15Å; H356-T358 VanDerWaalsContact C-N 3.31Å; H356-T358 PolarHBondContact O-N 3.15Å; T358-T361 WeakPolarHBondContact O-CB 3.42Å; T358-T361 PolarHBondContact O-N 2.82Å; T358-E362 PolarHBondContact O-N 3.12Å
359	L	98.7	Very high	98.1	Very high	0 Å²	0	61 Å²	61	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60	-48.7	174.9	177.5	63.5	0	0	0	111.7	A277 A278 V281 L292 V318 L319 I331 Y333 A355 H356 T361 E362 L363	A277-L359 HydrophobicContact CB-CD1 4.46Å; A278-L359 HydrophobicContact CB-CD1 4.47Å; V281-L359 HydrophobicContact CG2-CB 4.28Å; V281-L359 HydrophobicContact CG2-CD1 4.07Å; L292-L359 HydrophobicContact CD1-CB 3.79Å; L292-L359 HydrophobicContact CD1-CD2 4.04Å; L292-L359 HydrophobicContact CD1-CG 4.48Å; V318-L359 HydrophobicContact CG1-CD2 3.71Å; L319-L359 HydrophobicContact CD2-CD2 4.26Å; I331-L359 HydrophobicContact CD1-CD2 4.47Å; Y333-L359 HydrophobicContact CD2-CD2 4.12Å; Y333-L359 HydrophobicContact CE2-CD2 4.38Å; A355-L359 PolarHBondContact O-N 3.12Å; H356-L359 PolarHBondContact O-N 3.11Å; L359-T361 PolarHBondContact O-N 3.35Å; L359-E362 PolarHBondContact O-N 2.88Å; L359-L363 HydrophobicContact CD1-CD1 4.18Å; L359-L363 HydrophobicContact CD1-CG 4.14Å; L359-L363 HydrophobicContact CD2-CD1 4.46Å; L359-L363 HydrophobicContact CG-CD1 3.86Å; L359-L363 HydrophobicContact CG-CG 4.29Å; L359-L363 WeakPolarHBondContact O-CB 3.42Å; L359-L363 VanDerWaalsContact O-CG 3.32Å; L359-L363 WeakPolarHBondContact O-CG 3.37Å; L359-L363 PolarHBondContact O-N 3.33Å
360	T	98.3	Very high	98.2	Very high	12 Å²	12	59.9 Å²	59.9	7%	0.074	27%	0.273	C	S	.	.	H	α-helix	trans	-57.8	-36.7	176.6	-55.9	0	0	0	0	111.9	Y333 H356 R357 R364	Y333-T360 WeakPolarHBondContact OH-CB 3.46Å; Y333-T360 WeakPolarHBondContact OH-CG2 3.37Å; Y333-T360 PolarHBondContact OH-OG1 3.39Å; H356-T360 PolarHBondContact CE1-OG1 2.86Å; H356-T360 PolarHBondContact ND1-OG1 2.97Å; H356-T360 WeakPolarHBondContact O-CB 3.39Å; H356-T360 PolarHBondContact O-N 2.93Å; H356-T360 PolarHBondContact O-OG1 2.82Å; R357-T360 PolarHBondContact O-N 3.5Å; T360-R364 HydrophobicContact CG2-CG 4.46Å; T360-R364 VanDerWaalsContact O-CB 3.25Å; T360-R364 WeakPolarHBondContact O-CB 3.44Å; T360-R364 VanDerWaalsContact O-CG 3.25Å; T360-R364 WeakPolarHBondContact O-CG 3.42Å; T360-R364 PolarHBondContact O-N 2.82Å
361	T	98.3	Very high	98.2	Very high	74 Å²	74	56.8 Å²	56.8	45%	0.454	26%	0.255	S	S	.	.	H	α-helix	trans	-67.9	-45.3	178.2	-58.3	0	0	0	0	111	R357 T358 L359 R364 R365	R357-T361 WeakPolarHBondContact O-CB 3.05Å; R357-T361 PolarHBondContact O-N 2.69Å; R357-T361 PolarHBondContact O-OG1 3.3Å; T358-T361 WeakPolarHBondContact O-CB 3.42Å; T358-T361 PolarHBondContact O-N 2.82Å; L359-T361 PolarHBondContact O-N 3.35Å; T361-R364 CarbonylContact O-C 3.44Å; T361-R364 PolarHBondContact O-N 2.85Å; T361-R365 PolarHBondContact O-N 3.1Å
362	E	98.5	Very high	98	Very high	11 Å²	11	51.3 Å²	51.3	5%	0.051	24%	0.237	C	C	.	.	H	α-helix	trans	-63.3	-44	174.9	-67.2	-62.1	128.7	0	0	111.6	A277 Q280 V281 K284 T358 L359 R364 R365 N368	A277-E362 HydrophobicContact CB-CB 4.31Å; Q280-E362 HydrophobicContact CB-CG 4.46Å; V281-E362 HydrophobicContact CG2-CB 4.33Å; V281-E362 HydrophobicContact CG2-CG 3.9Å; K284-E362 VanDerWaalsContact NZ-CD 3.34Å; K284-E362 IonicContact NZ-OE1 2.74Å; K284-E362 PolarHBondContact NZ-OE1 3.35Å; K284-E362 IonicContact NZ-OE2 2.74Å; K284-E362 PolarHBondContact NZ-OE2 3.33Å; T358-E362 PolarHBondContact O-N 3.12Å; L359-E362 PolarHBondContact O-N 2.88Å; E362-R364 PolarHBondContact O-N 3.2Å; E362-R365 WeakPolarHBondContact O-CB 3.26Å; E362-R365 PolarHBondContact O-N 3.14Å; E362-R365 IonicContact OE1-CZ 3.62Å; E362-R365 VanDerWaalsContact OE1-CZ 3.23Å; E362-R365 IonicContact OE1-NE 3.87Å; E362-R365 PolarHBondContact OE1-NE 3.38Å; E362-R365 IonicContact OE1-NH2 3.75Å; E362-R365 PolarHBondContact OE1-NH2 3.15Å; E362-R365 IonicContact OE2-CZ 2.62Å; E362-R365 IonicContact OE2-NE 2.91Å; E362-R365 PolarHBondContact OE2-NE 3.11Å; E362-R365 IonicContact OE2-NH2 3.23Å; E362-N368 PolarHBondContact O-ND2 3.41Å
363	L	98.4	Very high	97.9	Very high	0 Å²	0	55 Å²	55	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-60.4	-26.6	174.8	-71.1	169	0	0	0	112.8	R241 V272 A277 Y333 L359 L388	R241-L363 HydrophobicContact CG-CB 4.47Å; R241-L363 PolarHBondContact NH1-O 2.77Å; V272-L363 HydrophobicContact CG1-CD2 3.83Å; A277-L363 HydrophobicContact CB-CD2 3.53Å; A277-L363 HydrophobicContact CB-CG 3.97Å; Y333-L363 HydrophobicContact CD1-CD1 4.28Å; Y333-L363 HydrophobicContact CD2-CD1 4.04Å; Y333-L363 HydrophobicContact CE1-CD1 4.09Å; Y333-L363 HydrophobicContact CE2-CD1 3.83Å; Y333-L363 HydrophobicContact CG-CD1 4.26Å; L359-L363 HydrophobicContact CD1-CD1 4.18Å; L359-L363 HydrophobicContact CD1-CG 4.14Å; L359-L363 HydrophobicContact CD2-CD1 4.46Å; L359-L363 HydrophobicContact CG-CD1 3.86Å; L359-L363 HydrophobicContact CG-CG 4.29Å; L359-L363 WeakPolarHBondContact O-CB 3.42Å; L359-L363 VanDerWaalsContact O-CG 3.32Å; L359-L363 WeakPolarHBondContact O-CG 3.37Å; L359-L363 PolarHBondContact O-N 3.33Å; L363-L388 HydrophobicContact CD1-CD2 3.88Å; L363-L388 HydrophobicContact CD2-CD1 3.99Å; L363-L388 HydrophobicContact CD2-CD2 4.06Å
364	R	97.7	Very high	97.6	Very high	130 Å²	130	49.9 Å²	49.9	49%	0.491	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	1.1	-179.8	-75.7	177.6	178	169.8	0.4	115.5	D240 R241 T360 T361 E362 P366	D240-R364 IonicContact OD2-CZ 2.79Å; D240-R364 IonicContact OD2-NE 3.51Å; D240-R364 PolarHBondContact OD2-NE 2.78Å; D240-R364 IonicContact OD2-NH2 3.31Å; D240-R364 PolarHBondContact OD2-NH2 3.35Å; R241-R364 VanDerWaalsContact CZ-CG 3.44Å; R241-R364 VanDerWaalsContact NH1-CA 3.26Å; T360-R364 HydrophobicContact CG2-CG 4.46Å; T360-R364 VanDerWaalsContact O-CB 3.25Å; T360-R364 WeakPolarHBondContact O-CB 3.44Å; T360-R364 VanDerWaalsContact O-CG 3.25Å; T360-R364 WeakPolarHBondContact O-CG 3.42Å; T360-R364 PolarHBondContact O-N 2.82Å; T361-R364 CarbonylContact O-C 3.44Å; T361-R364 PolarHBondContact O-N 2.85Å; E362-R364 PolarHBondContact O-N 3.2Å; R364-P366 WeakPolarHBondContact O-CD 3.49Å
365	R	98.3	Very high	97.3	Very high	93 Å²	93	53.9 Å²	53.9	35%	0.351	25%	0.246	S	C	.	.			trans	-63.5	125.7	172.8	-73.3	-179.4	179.3	-113	2.5	109.7	T361 E362 E367 N368	T361-R365 PolarHBondContact O-N 3.1Å; E362-R365 WeakPolarHBondContact O-CB 3.26Å; E362-R365 PolarHBondContact O-N 3.14Å; E362-R365 IonicContact OE1-CZ 3.62Å; E362-R365 VanDerWaalsContact OE1-CZ 3.23Å; E362-R365 IonicContact OE1-NE 3.87Å; E362-R365 PolarHBondContact OE1-NE 3.38Å; E362-R365 IonicContact OE1-NH2 3.75Å; E362-R365 PolarHBondContact OE1-NH2 3.15Å; E362-R365 IonicContact OE2-CZ 2.62Å; E362-R365 IonicContact OE2-NE 2.91Å; E362-R365 PolarHBondContact OE2-NE 3.11Å; E362-R365 IonicContact OE2-NH2 3.23Å; R365-E367 PolarHBondContact O-N 3.14Å; R365-E367 VanDerWaalsContact O-N 3.13Å; R365-N368 HydrophobicContact CB-CB 4.37Å; R365-N368 WeakPolarHBondContact O-CB 3.49Å; R365-N368 PolarHBondContact O-N 3.22Å
366	P	97.8	Very high	97.1	Very high	93 Å²	93	57.1 Å²	57.1	60%	0.604	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-54.6	-33	178.6	-27.5	35.6	0	0	0	113.3	R364 N368 E369	R364-P366 WeakPolarHBondContact O-CD 3.49Å; P366-N368 PolarHBondContact O-N 3.03Å; P366-E369 PolarHBondContact O-N 3.02Å; P366-E369 VanDerWaalsContact O-N 3.16Å
367	E	98	Very high	96.9	Very high	106 Å²	106	56.8 Å²	56.8	50%	0.495	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-62.9	-24.9	176.6	-50.5	79.4	-116.7	0	0	113.3	N153 A154 R365	N153-E367 WeakPolarHBondContact CB-O 3.27Å; A154-E367 VanDerWaalsContact CB-O 3.25Å; A154-E367 WeakPolarHBondContact CB-O 3.24Å; A154-E367 PolarHBondContact N-O 2.87Å; R365-E367 PolarHBondContact O-N 3.14Å; R365-E367 VanDerWaalsContact O-N 3.13Å
368	N	98.4	Very high	96.7	Very high	6 Å²	6	49.9 Å²	49.9	3%	0.032	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-89.3	-10.6	179.1	-66.6	-13.9	0	0	0	112.8	N153 V272 Y276 E362 R365 P366	N153-N368 WeakPolarHBondContact CB-OD1 3.38Å; V272-N368 HydrophobicContact CG1-CB 4.37Å; Y276-N368 VanDerWaalsContact CE1-OD1 3.29Å; Y276-N368 WeakPolarHBondContact CE1-OD1 3.35Å; E362-N368 PolarHBondContact O-ND2 3.41Å; R365-N368 HydrophobicContact CB-CB 4.37Å; R365-N368 WeakPolarHBondContact O-CB 3.49Å; R365-N368 PolarHBondContact O-N 3.22Å; P366-N368 PolarHBondContact O-N 3.03Å
369	E	98.1	Very high	96.6	Very high	29 Å²	29	48.2 Å²	48.2	14%	0.136	24%	0.235	C	C	.	.			trans	-91	112.7	-175.5	-63.2	-170.4	164	0	0	112.4	A154 R241 L270 V272 P366 W371	A154-E369 WeakPolarHBondContact CB-O 3.45Å; R241-E369 IonicContact CZ-OE1 3.83Å; R241-E369 VanDerWaalsContact CZ-OE1 3.25Å; R241-E369 IonicContact NH1-OE1 3.24Å; R241-E369 PolarHBondContact NH1-OE1 3.35Å; R241-E369 IonicContact NH2-OE1 3.69Å; R241-E369 PolarHBondContact NH2-OE1 2.83Å; L270-E369 HydrophobicContact CD1-CB 3.61Å; L270-E369 HydrophobicContact CD1-CG 3.75Å; V272-E369 HydrophobicContact CG2-CG 4.31Å; P366-E369 PolarHBondContact O-N 3.02Å; P366-E369 VanDerWaalsContact O-N 3.16Å; E369-W371 PolarHBondContact OE2-NE1 3.47Å
370	L	98.3	Very high	96.6	Very high	9 Å²	9	48.2 Å²	48.2	5%	0.047	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	113.1	168.5	-178.7	68.8	0	0	0	109.8	W152 Y157 R158 I189 L271 V372	W152-L370 HydrophobicContact CH2-CB 4.44Å; W152-L370 HydrophobicContact CH2-CD2 4.49Å; W152-L370 HydrophobicContact CZ3-CB 4Å; W152-L370 HydrophobicContact CZ3-CD2 4.46Å; Y157-L370 HydrophobicContact CD1-CD1 4.26Å; Y157-L370 HydrophobicContact CD1-CD2 3.46Å; Y157-L370 VanDerWaalsContact CD1-CD2 3.46Å; Y157-L370 HydrophobicContact CE1-CD2 3.72Å; Y157-L370 HydrophobicContact CG-CD2 3.95Å; R158-L370 HydrophobicContact CG-CD1 4.39Å; I189-L370 HydrophobicContact CD1-CD2 3.86Å; L271-L370 HydrophobicContact CB-CB 4.27Å; L271-L370 HydrophobicContact CD1-CD2 4.35Å; L271-L370 PolarHBondContact N-O 3.44Å; L271-L370 PolarHBondContact O-N 2.81Å; L370-V372 HydrophobicContact CD2-CG2 4.23Å; L370-V372 HydrophobicContact CG-CG2 4Å
371	W	97.5	Very high	96.6	Very high	79 Å²	79	47.7 Å²	47.7	30%	0.299	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	121.3	177.5	-70.4	93.8	0	0	0	111.4	R268 T269 L270 E369 E392	R268-W371 HydrophobicContact CB-CE3 3.83Å; R268-W371 HydrophobicContact CB-CZ3 4.41Å; T269-W371 WeakPolarHBondContact O-CA 3.22Å; L270-W371 HydrophobicContact CB-CD2 4.38Å; L270-W371 HydrophobicContact CB-CE3 3.97Å; L270-W371 HydrophobicContact CB-CH2 3.73Å; L270-W371 HydrophobicContact CB-CZ2 4.13Å; L270-W371 HydrophobicContact CB-CZ3 3.63Å; L270-W371 HydrophobicContact CD1-CD2 4.14Å; L270-W371 HydrophobicContact CD1-CH2 4.31Å; L270-W371 HydrophobicContact CD1-CZ2 3.81Å; L270-W371 HydrophobicContact CD2-CH2 4.19Å; L270-W371 HydrophobicContact CD2-CZ2 4.15Å; L270-W371 HydrophobicContact CG-CH2 4.29Å; L270-W371 HydrophobicContact CG-CZ2 4.25Å; E369-W371 PolarHBondContact OE2-NE1 3.47Å; W371-E392 HydrophobicContact CH2-CB 4.46Å; W371-E392 HydrophobicContact CZ3-CB 3.91Å
372	V	95.4	Very high	96.7	Very high	24 Å²	24	44.1 Å²	44.1	15%	0.145	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	135.6	-177.7	-176	0	0	0	0	110.4	F191 R268 T269 L271 L370	F191-V372 HydrophobicContact CE1-CG1 4Å; F191-V372 HydrophobicContact CZ-CG1 4.08Å; F191-V372 HydrophobicContact CZ-CG2 4.23Å; R268-V372 CarbonylContact C-O 3.54Å; R268-V372 WeakPolarHBondContact CA-O 3.41Å; T269-V372 PolarHBondContact N-O 3.3Å; T269-V372 PolarHBondContact O-N 2.99Å; L271-V372 HydrophobicContact CD1-CG2 4.13Å; L370-V372 HydrophobicContact CD2-CG2 4.23Å; L370-V372 HydrophobicContact CG-CG2 4Å
373	K	93.8	Very high	96.7	Very high	77 Å²	77	43.9 Å²	43.9	34%	0.335	21%	0.209	S	C	.	.			trans	-95	109.1	171.7	-174.7	78.8	-178.7	-155.5	0	109.5	H262 G266 R268	H262-K373 PolarHBondContact CE1-NZ 3.17Å; H262-K373 PolarHBondContact ND1-NZ 3.35Å; G266-K373 PolarHBondContact O-NZ 3.07Å; R268-K373 HydrophobicContact CG-CB 4.41Å; R268-K373 HydrophobicContact CG-CD 4.03Å
374	L	92.9	Very high	96.7	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.01	21%	0.209	C	C	.	.			trans	-72.6	132.8	168.1	-61.4	179.5	0	0	0	109.8	F191 F257 C259 K378 L380	F191-L374 HydrophobicContact CE1-CD2 4.21Å; F257-L374 HydrophobicContact CB-CD1 3.92Å; C259-L374 HydrophobicContact CB-CB 3.9Å; L374-K378 HydrophobicContact CD2-CG 4.47Å; L374-L380 HydrophobicContact CD1-CB 4.35Å; L374-L380 HydrophobicContact CD1-CD2 4.35Å; L374-L380 HydrophobicContact CD2-CB 3.91Å; L374-L380 HydrophobicContact CD2-CD2 4.37Å
375	K	92	Very high	96.7	Very high	138 Å²	138	39.4 Å²	39.4	60%	0.6	19%	0.192	S	C	*	.			trans	-120.9	157.2	175.3	-64.3	-178.4	-178.8	178.4	0	108.4	G377 K378	K375-G377 PolarHBondContact O-N 3.41Å; K375-K378 PolarHBondContact O-N 3.23Å
376	P	94.5	Very high	96.7	Very high	68 Å²	68	35.1 Å²	35.1	44%	0.442	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.5	131.6	165.4	-26.3	36.1	0	0	0	111.2	P197 C259	P197-P376 HydrophobicContact CB-CB 4.01Å; P197-P376 HydrophobicContact CG-CB 4.33Å; C259-P376 WeakPolarHBondContact O-CA 3.46Å
377	G	92.6	Very high	96.7	Very high	18 Å²	18	30.7 Å²	30.7	19%	0.186	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	104.6	-11.8	-173.9	0	0	0	0	0	115.5	E193 N194 V195 K375	E193-G377 CarbonylContact C-O 3.51Å; E193-G377 WeakPolarHBondContact CA-O 3.47Å; N194-G377 PolarHBondContact N-O 3.36Å; V195-G377 PolarHBondContact N-O 3.28Å; V195-G377 WeakPolarHBondContact O-CA 3.21Å; K375-G377 PolarHBondContact O-N 3.41Å
378	K	94.8	Very high	96.8	Very high	43 Å²	43	25.6 Å²	25.6	19%	0.187	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	117	-171.8	-171.3	164.8	-175.3	155.7	0	112	S164 F191 V192 E193 H258 L374 K375	S164-K378 PolarHBondContact OG-NZ 2.87Å; F191-K378 HydrophobicContact CD1-CD 4.25Å; F191-K378 HydrophobicContact CD1-CG 4.23Å; V192-K378 WeakPolarHBondContact O-CA 3.43Å; E193-K378 HydrophobicContact CG-CB 4.34Å; E193-K378 HydrophobicContact CG-CD 3.93Å; E193-K378 HydrophobicContact CG-CG 3.92Å; E193-K378 VanDerWaalsContact OE1-CE 3.3Å; E193-K378 WeakPolarHBondContact OE1-CE 3.31Å; E193-K378 IonicContact OE1-NZ 3.25Å; E193-K378 PolarHBondContact OE1-NZ 3.03Å; H258-K378 PolarHBondContact CD2-O 2.83Å; L374-K378 HydrophobicContact CD2-CG 4.47Å; K375-K378 PolarHBondContact O-N 3.23Å
379	A	97.3	Very high	96.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	143	172.1	0	0	0	0	0	110.6	F191 V192 V195 L205 F257 H258 F381	F191-A379 VanDerWaalsContact CA-O 3.31Å; F191-A379 WeakPolarHBondContact CA-O 3.5Å; V192-A379 PolarHBondContact N-O 3.39Å; V192-A379 PolarHBondContact O-N 2.9Å; V195-A379 HydrophobicContact CG2-CB 4.25Å; L205-A379 HydrophobicContact CD1-CB 4.12Å; F257-A379 CarbonylContact O-C 3.41Å; F257-A379 WeakPolarHBondContact O-CA 3.36Å; H258-A379 HydrophobicContact CB-CB 4.28Å; A379-F381 HydrophobicContact CB-CE2 4.28Å
380	L	98.4	Very high	96.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	129.4	178	163	62.8	0	0	0	108.8	I189 F191 V256 F257 T269 L271 L374 I382	I189-L380 HydrophobicContact CB-CD1 4.21Å; I189-L380 HydrophobicContact CG2-CD1 4.37Å; F191-L380 HydrophobicContact CD1-CB 3.95Å; F191-L380 HydrophobicContact CD1-CD1 3.99Å; F191-L380 HydrophobicContact CD1-CG 4.5Å; F191-L380 HydrophobicContact CE1-CB 3.87Å; F191-L380 HydrophobicContact CE1-CD1 3.54Å; F191-L380 HydrophobicContact CE1-CD2 4.22Å; F191-L380 HydrophobicContact CE1-CG 4.06Å; F191-L380 HydrophobicContact CE2-CD1 4.33Å; F191-L380 HydrophobicContact CZ-CD1 3.72Å; V256-L380 CarbonylContact C-O 3.42Å; V256-L380 WeakPolarHBondContact CA-O 3.42Å; F257-L380 PolarHBondContact N-O 3.46Å; F257-L380 PolarHBondContact O-N 3.29Å; T269-L380 HydrophobicContact CG2-CD2 4.05Å; L271-L380 HydrophobicContact CD1-CD1 4.35Å; L271-L380 HydrophobicContact CD1-CD2 4.1Å; L271-L380 HydrophobicContact CD2-CD2 4.19Å; L374-L380 HydrophobicContact CD1-CB 4.35Å; L374-L380 HydrophobicContact CD1-CD2 4.35Å; L374-L380 HydrophobicContact CD2-CB 3.91Å; L374-L380 HydrophobicContact CD2-CD2 4.37Å; L380-I382 HydrophobicContact CD1-CG1 3.93Å; L380-I382 HydrophobicContact CD2-CD1 3.85Å; L380-I382 HydrophobicContact CD2-CG1 4Å; L380-I382 HydrophobicContact CG-CD1 4.1Å; L380-I382 HydrophobicContact CG-CG1 3.72Å
381	F	98.6	Very high	96.5	Very high	1 Å²	1	24.6 Å²	24.6	0%	0.004	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	134.9	171.9	-68.5	-114	0	0	0	108.7	F180 F184 I189 A190 V192 L205 I209 I254 V256 A379 L405	F180-F381 HydrophobicContact CE1-CG 4.46Å; F180-F381 AromaticContact CE2-CD2 3.84Å; F180-F381 HydrophobicContact CE2-CD2 3.84Å; F180-F381 HydrophobicContact CE2-CE2 4.29Å; F180-F381 HydrophobicContact CE2-CG 4.22Å; F180-F381 HydrophobicContact CZ-CB 3.75Å; F180-F381 AromaticContact CZ-CD1 3.96Å; F180-F381 HydrophobicContact CZ-CD1 3.96Å; F180-F381 AromaticContact CZ-CD2 3.57Å; F180-F381 HydrophobicContact CZ-CD2 3.57Å; F180-F381 HydrophobicContact CZ-CE1 4.45Å; F180-F381 HydrophobicContact CZ-CE2 4.12Å; F180-F381 AromaticContact CZ-CG 3.5Å; F180-F381 HydrophobicContact CZ-CG 3.5Å; F184-F381 HydrophobicContact CD2-CB 4.09Å; F184-F381 HydrophobicContact CE2-CB 3.99Å; I189-F381 VanDerWaalsContact CA-O 3.27Å; I189-F381 WeakPolarHBondContact CA-O 3.46Å; A190-F381 PolarHBondContact N-O 3.41Å; A190-F381 VanDerWaalsContact N-O 3.13Å; A190-F381 PolarHBondContact O-N 2.84Å; V192-F381 HydrophobicContact CG2-CE2 4.08Å; L205-F381 HydrophobicContact CB-CZ 4.44Å; I209-F381 HydrophobicContact CD1-CD1 4.13Å; I209-F381 HydrophobicContact CD1-CE1 3.73Å; I209-F381 HydrophobicContact CD1-CZ 4.26Å; I254-F381 HydrophobicContact CG2-CB 4.3Å; I254-F381 HydrophobicContact CG2-CD1 4.16Å; V256-F381 HydrophobicContact CG1-CD1 4.42Å; V256-F381 HydrophobicContact CG1-CD2 4.4Å; V256-F381 HydrophobicContact CG1-CE1 4.13Å; V256-F381 HydrophobicContact CG1-CE2 4.1Å; V256-F381 HydrophobicContact CG1-CZ 3.95Å; V256-F381 HydrophobicContact CG2-CD1 3.58Å; V256-F381 HydrophobicContact CG2-CE1 3.55Å; V256-F381 HydrophobicContact CG2-CG 4.27Å; V256-F381 HydrophobicContact CG2-CZ 4.23Å; A379-F381 HydrophobicContact CB-CE2 4.28Å; F381-L405 HydrophobicContact CD1-CD1 4.23Å; F381-L405 HydrophobicContact CE1-CD1 4.01Å
382	I	98.7	Very high	96.3	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	125.3	-176.4	-52.1	175.2	0	0	0	108.3	I189 I254 Q255 F257 L271 L380 N384 V387 H389	I189-I382 HydrophobicContact CG2-CB 4.45Å; I189-I382 HydrophobicContact CG2-CG1 4.28Å; I189-I382 HydrophobicContact CG2-CG2 4.21Å; I254-I382 CarbonylContact C-O 3.57Å; I254-I382 VanDerWaalsContact CA-O 3.26Å; I254-I382 WeakPolarHBondContact CA-O 3.36Å; I254-I382 WeakPolarHBondContact CG2-O 3.23Å; Q255-I382 HydrophobicContact CB-CB 4.42Å; Q255-I382 PolarHBondContact N-O 3.19Å; Q255-I382 PolarHBondContact O-N 3.24Å; F257-I382 HydrophobicContact CD2-CD1 3.75Å; F257-I382 HydrophobicContact CE2-CD1 3.82Å; L271-I382 HydrophobicContact CD2-CD1 3.66Å; L271-I382 HydrophobicContact CD2-CG1 4.16Å; L380-I382 HydrophobicContact CD1-CG1 3.93Å; L380-I382 HydrophobicContact CD2-CD1 3.85Å; L380-I382 HydrophobicContact CD2-CG1 4Å; L380-I382 HydrophobicContact CG-CD1 4.1Å; L380-I382 HydrophobicContact CG-CG1 3.72Å; I382-N384 VanDerWaalsContact C-N 3.32Å; I382-N384 PolarHBondContact O-N 3.46Å; I382-V387 HydrophobicContact CG2-CB 3.78Å; I382-V387 HydrophobicContact CG2-CG1 4.04Å; I382-H389 HydrophobicContact CD1-CB 3.82Å
383	D	98.6	Very high	96.2	Very high	5 Å²	5	24.6 Å²	24.6	3%	0.027	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	95.1	164.1	-178	-18.6	0	0	0	107.9	F184 G188 W385 R386 V387 R407	F184-D383 HydrophobicContact CE1-CB 4.47Å; F184-D383 HydrophobicContact CE2-CB 4.26Å; F184-D383 HydrophobicContact CZ-CB 3.79Å; G188-D383 WeakPolarHBondContact O-CB 3.05Å; G188-D383 PolarHBondContact O-N 2.9Å; D383-W385 PolarHBondContact O-N 3.17Å; D383-W385 VanDerWaalsContact O-N 3.15Å; D383-W385 WeakPolarHBondContact OD1-CB 3.28Å; D383-W385 PolarHBondContact OD1-N 2.79Å; D383-R386 HydrophobicContact CB-CB 4.18Å; D383-R386 PolarHBondContact O-N 3.4Å; D383-R386 PolarHBondContact OD1-N 2.93Å; D383-V387 PolarHBondContact O-N 3.39Å; D383-R407 IonicContact OD1-CZ 3.08Å; D383-R407 IonicContact OD1-NH1 3.73Å; D383-R407 PolarHBondContact OD1-NH1 2.98Å; D383-R407 IonicContact OD1-NH2 3.51Å; D383-R407 IonicContact OD2-CZ 3.76Å; D383-R407 IonicContact OD2-NH1 3.73Å; D383-R407 PolarHBondContact OD2-NH1 3.31Å; D383-R407 IonicContact OD2-NH2 3.67Å; D383-R407 PolarHBondContact OD2-NH2 3.44Å
384	N	98.6	Very high	96	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.005	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-9.4	-175.8	-176.5	60.9	0	0	0	112.3	T243 D244 C252 G253 Q255 I382	T243-N384 VanDerWaalsContact CB-O 3.32Å; T243-N384 WeakPolarHBondContact CB-O 3.16Å; T243-N384 WeakPolarHBondContact CG2-O 3.3Å; D244-N384 PolarHBondContact N-OD1 2.87Å; D244-N384 PolarHBondContact O-ND2 2.82Å; C252-N384 WeakPolarHBondContact O-CB 3.32Å; C252-N384 PolarHBondContact O-ND2 3.07Å; G253-N384 PolarHBondContact O-N 3.41Å; Q255-N384 HydrophobicContact CB-CB 4.29Å; I382-N384 VanDerWaalsContact C-N 3.32Å; I382-N384 PolarHBondContact O-N 3.46Å
385	W	98	Very high	95.8	Very high	35 Å²	35	25 Å²	25	13%	0.133	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-7	172	-69.3	15	0	0	0	112.8	E250 P251 C252 F275 L330 I331 D383 R407	E250-W385 HydrophobicContact CG-CZ2 4.34Å; P251-W385 PolarHBondContact O-NE1 2.68Å; C252-W385 VanDerWaalsContact O-CD1 3.23Å; C252-W385 PolarHBondContact O-NE1 3.12Å; F275-W385 WeakPolarHBondContact CE1-O 3.17Å; F275-W385 VanDerWaalsContact CZ-O 3.3Å; F275-W385 WeakPolarHBondContact CZ-O 3.48Å; L330-W385 CarbonylContact C-O 3.55Å; L330-W385 WeakPolarHBondContact CA-O 3.27Å; L330-W385 HydrophobicContact CB-CB 4.38Å; L330-W385 HydrophobicContact CB-CD2 4.38Å; L330-W385 HydrophobicContact CB-CE3 4.2Å; L330-W385 HydrophobicContact CB-CG 4.5Å; L330-W385 HydrophobicContact CD1-CB 3.69Å; L330-W385 HydrophobicContact CD1-CD2 4Å; L330-W385 HydrophobicContact CD1-CG 3.55Å; I331-W385 WeakPolarHBondContact CG2-O 3.46Å; I331-W385 PolarHBondContact N-O 3.33Å; D383-W385 PolarHBondContact O-N 3.17Å; D383-W385 VanDerWaalsContact O-N 3.15Å; D383-W385 WeakPolarHBondContact OD1-CB 3.28Å; D383-W385 PolarHBondContact OD1-N 2.79Å; W385-R407 HydrophobicContact CZ2-CB 4.5Å; W385-R407 VanDerWaalsContact CZ3-CD 3.47Å
386	R	98.4	Very high	95.6	Very high	3 Å²	3	20.4 Å²	20.4	1%	0.011	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.4	-54.9	-174.2	172.1	176.9	175.5	-169.7	-3.5	113	I150 L186 D273 G274 F275 D383	I150-R386 PolarHBondContact O-NH2 3.09Å; L186-R386 PolarHBondContact O-NH1 3.24Å; D273-R386 IonicContact OD1-CZ 3.52Å; D273-R386 IonicContact OD1-NE 2.75Å; D273-R386 PolarHBondContact OD1-NE 3.14Å; D273-R386 VanDerWaalsContact OD1-NE 3.08Å; D273-R386 IonicContact OD1-NH2 3.61Å; D273-R386 IonicContact OD2-CZ 2.67Å; D273-R386 IonicContact OD2-NE 2.97Å; D273-R386 IonicContact OD2-NH2 2.81Å; D273-R386 PolarHBondContact OD2-NH2 3.13Å; G274-R386 WeakPolarHBondContact CA-O 3.38Å; G274-R386 PolarHBondContact N-O 2.8Å; F275-R386 HydrophobicContact CB-CG 4.38Å; F275-R386 HydrophobicContact CD1-CG 4.3Å; F275-R386 HydrophobicContact CD2-CB 3.96Å; F275-R386 HydrophobicContact CD2-CG 3.41Å; F275-R386 VanDerWaalsContact CD2-CG 3.41Å; F275-R386 HydrophobicContact CE1-CB 4.27Å; F275-R386 HydrophobicContact CE1-CG 4.47Å; F275-R386 HydrophobicContact CE2-CB 3.6Å; F275-R386 HydrophobicContact CE2-CG 3.61Å; F275-R386 HydrophobicContact CG-CB 4.45Å; F275-R386 HydrophobicContact CG-CG 3.8Å; F275-R386 HydrophobicContact CZ-CB 3.78Å; F275-R386 HydrophobicContact CZ-CG 4.16Å; D383-R386 HydrophobicContact CB-CB 4.18Å; D383-R386 PolarHBondContact O-N 3.4Å; D383-R386 PolarHBondContact OD1-N 2.93Å
387	V	98.8	Very high	95.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	115.9	-168.9	-179.8	0	0	0	0	108.5	W152 I189 L271 V272 I382 D383	W152-V387 HydrophobicContact CH2-CG1 4.3Å; W152-V387 HydrophobicContact CZ2-CG1 4.08Å; W152-V387 HydrophobicContact CZ2-CG2 4.09Å; I189-V387 HydrophobicContact CG2-CB 4.2Å; I189-V387 HydrophobicContact CG2-CG1 3.82Å; I189-V387 HydrophobicContact CG2-CG2 4.15Å; L271-V387 HydrophobicContact CB-CG1 4.3Å; L271-V387 HydrophobicContact CD2-CG1 4.25Å; V272-V387 CarbonylContact O-C 3.57Å; V272-V387 WeakPolarHBondContact O-CA 3.26Å; I382-V387 HydrophobicContact CG2-CB 3.78Å; I382-V387 HydrophobicContact CG2-CG1 4.04Å; D383-V387 PolarHBondContact O-N 3.39Å
388	L	98.8	Very high	95.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	144.4	172.2	-67.2	77.8	0	0	0	108.5	R241 H242 T243 L271 V272 I331 Y333 L363	R241-L388 HydrophobicContact CB-CB 3.92Å; R241-L388 HydrophobicContact CB-CD2 4.07Å; R241-L388 HydrophobicContact CG-CD2 3.81Å; H242-L388 CarbonylContact O-C 3.56Å; H242-L388 VanDerWaalsContact O-CA 3.3Å; H242-L388 WeakPolarHBondContact O-CA 3.49Å; T243-L388 HydrophobicContact CG2-CG 4.14Å; L271-L388 WeakPolarHBondContact CA-O 3.17Å; V272-L388 HydrophobicContact CB-CB 4.5Å; V272-L388 PolarHBondContact N-O 3.19Å; V272-L388 PolarHBondContact O-N 2.96Å; I331-L388 HydrophobicContact CD1-CD1 4.1Å; I331-L388 HydrophobicContact CG2-CD1 3.97Å; Y333-L388 HydrophobicContact CD1-CD2 3.36Å; Y333-L388 HydrophobicContact CE1-CD2 4.07Å; Y333-L388 HydrophobicContact CG-CD2 3.83Å; L363-L388 HydrophobicContact CD1-CD2 3.88Å; L363-L388 HydrophobicContact CD2-CD1 3.99Å; L363-L388 HydrophobicContact CD2-CD2 4.06Å
389	H	98.4	Very high	94.9	Very high	7 Å²	7	21.1 Å²	21.1	3%	0.032	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	160.1	177.8	65.1	-79.5	0	0	0	111.3	R241 H242 D244 F257 L270 L271 I382	R241-H389 CarbonylContact C-O 3.56Å; R241-H389 WeakPolarHBondContact CA-O 3.35Å; H242-H389 PolarHBondContact CE1-O 2.98Å; H242-H389 PolarHBondContact N-O 3.1Å; H242-H389 PolarHBondContact ND1-O 2.83Å; H242-H389 VanDerWaalsContact ND1-O 3.08Å; H242-H389 AromaticContact NE2-NE2 4Å; H242-H389 PolarHBondContact O-N 2.94Å; H242-H389 PolarHBondContact O-ND1 3.27Å; D244-H389 IonicContact OD1-CE1 2.64Å; D244-H389 IonicContact OD1-NE2 3.88Å; D244-H389 IonicContact OD2-CE1 2.69Å; D244-H389 IonicContact OD2-NE2 3.87Å; D244-H389 PolarHBondContact OD2-NE2 2.84Å; F257-H389 AromaticContact CE2-CD2 3.54Å; F257-H389 AromaticContact CE2-NE2 3.68Å; F257-H389 AromaticContact CZ-CD2 3.82Å; F257-H389 AromaticContact CZ-NE2 3.68Å; L270-H389 CarbonylContact O-C 3.59Å; L270-H389 WeakPolarHBondContact O-CA 3.37Å; L271-H389 HydrophobicContact CD2-CB 3.93Å; I382-H389 HydrophobicContact CD1-CB 3.82Å
390	G	96.4	Very high	94.7	Very high	5 Å²	5	21.2 Å²	21.2	5%	0.052	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	-168.5	179.3	0	0	0	0	0	109.9	L239 L270	L239-G390 WeakPolarHBondContact O-CA 3.48Å; L270-G390 PolarHBondContact N-O 2.89Å; L270-G390 PolarHBondContact O-N 3.41Å
391	R	94.5	Very high	94.5	Very high	10 Å²	10	21.2 Å²	21.2	4%	0.038	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	150.2	174.3	65.3	171	-171.4	64.6	7.4	113.2	T235 K236 L237 A238 L239 R268	T235-R391 PolarHBondContact O-NH2 2.65Å; K236-R391 PolarHBondContact O-NH1 3.12Å; L237-R391 PolarHBondContact O-NH1 3.08Å; L237-R391 PolarHBondContact O-NH2 3.27Å; A238-R391 CarbonylContact C-O 3.4Å; A238-R391 WeakPolarHBondContact CA-O 3.25Å; L239-R391 HydrophobicContact CB-CG 3.97Å; L239-R391 HydrophobicContact CD1-CG 3.93Å; L239-R391 HydrophobicContact CG-CG 3.92Å; L239-R391 PolarHBondContact N-O 2.7Å; L239-R391 PolarHBondContact O-N 2.99Å; R268-R391 VanDerWaalsContact O-CA 3.28Å; R268-R391 WeakPolarHBondContact O-CA 3.38Å
392	E	93.6	Very high	94.4	Very high	57 Å²	57	21.2 Å²	21.2	27%	0.266	12%	0.12	S	C	.	.			trans	-64.4	153.9	165.9	-167.6	174.6	-137.5	0	0	110.1	G266 R268 W371	G266-E392 WeakPolarHBondContact CA-OE2 3.47Å; R268-E392 HydrophobicContact CB-CB 4.43Å; R268-E392 IonicContact CZ-OE1 2.96Å; R268-E392 IonicContact CZ-OE2 3.61Å; R268-E392 IonicContact NE-OE1 3.07Å; R268-E392 IonicContact NE-OE2 3.92Å; R268-E392 PolarHBondContact NE-OE2 2.83Å; R268-E392 IonicContact NH2-OE1 2.69Å; R268-E392 PolarHBondContact NH2-OE1 3.07Å; R268-E392 IonicContact NH2-OE2 3.68Å; R268-E392 PolarHBondContact O-N 2.88Å; W371-E392 HydrophobicContact CH2-CB 4.46Å; W371-E392 HydrophobicContact CZ3-CB 3.91Å
393	A	92.4	Very high	94.3	Very high	47 Å²	47	21.2 Å²	21.2	39%	0.388	12%	0.12	S	C	.	.			trans	-58.2	156	165.5	0	0	0	0	0	110.4	K236 A238 G266 G267	K236-A393 WeakPolarHBondContact O-CA 3.39Å; A238-A393 HydrophobicContact CB-CB 4.34Å; G266-A393 WeakPolarHBondContact CA-O 3.31Å; G267-A393 PolarHBondContact N-O 3.34Å
394	F	89.9	Confident	94.3	Very high	13 Å²	13	21.7 Å²	21.7	6%	0.057	12%	0.121	C	C	.	.	B	Isolated β-bridge	trans	-147.1	162.6	179.5	70.9	-88.1	0	0	0	113.4	S225 K236 T265 R398	S225-F394 WeakPolarHBondContact OG-CZ 3.26Å; K236-F394 HydrophobicContact CG-CE2 4.39Å; K236-F394 HydrophobicContact CG-CZ 4.33Å; K236-F394 PolarHBondContact O-N 2.91Å; T265-F394 VanDerWaalsContact O-CA 3.23Å; T265-F394 WeakPolarHBondContact O-CA 3.48Å; T265-F394 VanDerWaalsContact O-CB 3.26Å; T265-F394 WeakPolarHBondContact O-CB 3.21Å; F394-R398 HydrophobicContact CD2-CB 3.99Å; F394-R398 HydrophobicContact CE2-CB 3.46Å; F394-R398 VanDerWaalsContact CE2-CB 3.46Å; F394-R398 HydrophobicContact CE2-CG 4.45Å; F394-R398 HydrophobicContact CZ-CB 3.92Å
395	T	88.6	Confident	94.3	Very high	74 Å²	74	21.6 Å²	21.6	45%	0.454	12%	0.121	S	C	.	.			trans	-116.2	165	175.6	63.2	0	0	0	0	111.1	G264 T265	G264-T395 WeakPolarHBondContact CA-O 3.42Å; T265-T395 PolarHBondContact N-OG1 3.19Å; T265-T395 PolarHBondContact O-N 2.87Å; T265-T395 PolarHBondContact OG1-OG1 2.96Å
396	G	88.1	Confident	94.2	Very high	42 Å²	42	21.2 Å²	21.2	43%	0.433	12%	0.123	S	C	.	.	S	Bend	trans	72.7	-149.2	176.7	0	0	0	0	0	114	E263	E263-G396 CarbonylContact O-C 3.54Å; E263-G396 VanDerWaalsContact O-CA 3.27Å; E263-G396 WeakPolarHBondContact O-CA 3.37Å
397	Y	88.3	Confident	94	Very high	82 Å²	82	22.4 Å²	22.4	32%	0.322	13%	0.127	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	132.9	-176.7	-178	-99.2	0	0	0	110.8	K261 H262 E263 Q399	K261-Y397 HydrophobicContact CB-CD1 4.36Å; K261-Y397 HydrophobicContact CB-CE1 4.01Å; K261-Y397 HydrophobicContact CD-CD1 3.93Å; K261-Y397 HydrophobicContact CD-CE1 3.75Å; K261-Y397 HydrophobicContact CG-CD1 4.02Å; K261-Y397 HydrophobicContact CG-CE1 4.02Å; H262-Y397 CarbonylContact C-O 3.06Å; H262-Y397 WeakPolarHBondContact CA-O 3.36Å; E263-Y397 PolarHBondContact N-O 2.92Å; E263-Y397 PolarHBondContact O-N 2.99Å; Y397-Q399 HydrophobicContact CE1-CB 3.84Å
398	R	88.6	Confident	93.7	Very high	5 Å²	5	27.6 Å²	27.6	2%	0.019	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	128.6	175.7	-175	174.9	179	-105.2	6.2	108.9	K261 H262 F394	K261-R398 CarbonylContact O-C 3.58Å; K261-R398 WeakPolarHBondContact O-CA 3.5Å; H262-R398 HydrophobicContact CB-CG 4.49Å; F394-R398 HydrophobicContact CD2-CB 3.99Å; F394-R398 HydrophobicContact CE2-CB 3.46Å; F394-R398 VanDerWaalsContact CE2-CB 3.46Å; F394-R398 HydrophobicContact CE2-CG 4.45Å; F394-R398 HydrophobicContact CZ-CB 3.92Å
399	Q	90.4	Very high	93.6	Very high	56 Å²	56	29.8 Å²	29.8	26%	0.262	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	116.4	177.4	-169.6	178.1	37.5	0	0	108.5	L260 K261 Y397	L260-Q399 HydrophobicContact CB-CB 4.45Å; L260-Q399 HydrophobicContact CB-CG 4.33Å; L260-Q399 HydrophobicContact CD1-CG 4.45Å; L260-Q399 PolarHBondContact N-O 2.78Å; K261-Q399 HydrophobicContact CB-CB 4.22Å; K261-Q399 PolarHBondContact N-O 3.23Å; K261-Q399 PolarHBondContact O-N 3.26Å; Y397-Q399 HydrophobicContact CE1-CB 3.84Å
400	L	92	Very high	93.5	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.016	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	150.4	165.1	-57.5	-170	0	0	0	109.1	Y222 F223 F257 H258 C259	Y222-L400 WeakPolarHBondContact CA-O 3.28Å; F223-L400 HydrophobicContact CD1-CB 3.76Å; F223-L400 HydrophobicContact CD1-CD1 4.35Å; F223-L400 HydrophobicContact CD1-CG 4.32Å; F223-L400 HydrophobicContact CE1-CB 3.46Å; F223-L400 VanDerWaalsContact CE1-CB 3.46Å; F223-L400 HydrophobicContact CE1-CD1 3.25Å; F223-L400 HydrophobicContact CE1-CG 3.55Å; F223-L400 HydrophobicContact CZ-CB 4.11Å; F223-L400 HydrophobicContact CZ-CD1 3.48Å; F223-L400 VanDerWaalsContact CZ-CD1 3.48Å; F223-L400 HydrophobicContact CZ-CG 3.74Å; F223-L400 PolarHBondContact N-O 2.7Å; F223-L400 PolarHBondContact O-N 2.87Å; F257-L400 HydrophobicContact CD1-CD1 3.86Å; F257-L400 HydrophobicContact CE1-CD1 4.45Å; H258-L400 VanDerWaalsContact O-CA 3.31Å; H258-L400 WeakPolarHBondContact O-CA 3.21Å; C259-L400 HydrophobicContact CB-CD2 3.51Å
401	C	95	Very high	93.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	167.6	157.5	68.7	0	0	0	0	109.8	K199 T202 W221 Y222 H258 L260	K199-C401 HydrophobicContact CB-CB 4.36Å; T202-C401 PolarHBondContact OG1-SG 2.93Å; W221-C401 CarbonylContact O-C 3.47Å; W221-C401 VanDerWaalsContact O-CA 3.26Å; W221-C401 WeakPolarHBondContact O-CA 3.47Å; Y222-C401 HydrophobicContact CD1-CB 3.93Å; Y222-C401 HydrophobicContact CE1-CB 4.36Å; H258-C401 PolarHBondContact N-O 2.83Å; H258-C401 PolarHBondContact O-N 2.88Å; L260-C401 HydrophobicContact CD1-CB 3.94Å; L260-C401 VanDerWaalsContact CD2-SG 3.54Å; L260-C401 HydrophobicContact CG-CB 4.27Å
402	G	96	Very high	93.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.8	-176.5	175.8	0	0	0	0	0	112.9	W221 V256	W221-G402 VanDerWaalsContact CH2-CA 3.43Å; W221-G402 VanDerWaalsContact CZ2-C 3.42Å; W221-G402 PolarHBondContact N-O 3.39Å; W221-G402 PolarHBondContact O-N 3.01Å; V256-G402 WeakPolarHBondContact O-CA 3.4Å
403	C	97.7	Very high	93.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	170.5	177.7	61.4	0	0	0	0	110.2	A206 I212 R219 M220 Q255 V256	A206-C403 VanDerWaalsContact CB-SG 3.58Å; I212-C403 HydrophobicContact CG2-CB 3.86Å; R219-C403 WeakPolarHBondContact O-CB 3.4Å; M220-C403 HydrophobicContact CE-CB 4.08Å; M220-C403 HydrophobicContact SD-CB 3.48Å; M220-C403 WeakPolarHBondContact SD-CB 3.42Å; Q255-C403 PolarHBondContact OE1-O 2.87Å; V256-C403 PolarHBondContact N-O 2.74Å; V256-C403 PolarHBondContact O-N 3.02Å
404	Y	98.3	Very high	93.9	Very high	15 Å²	15	29.5 Å²	29.5	6%	0.059	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	143.8	169.1	-62.5	-73.5	0	0	0	109.8	R213 T215 Y217 W221 D244 T245 C252 I254 Q255	R213-Y404 PolarHBondContact N-O 3.42Å; T215-Y404 HydrophobicContact CG2-CD2 3.9Å; Y217-Y404 HydrophobicContact CD2-CE2 4.24Å; W221-Y404 AromaticContact NE1-CD2 3.73Å; W221-Y404 AromaticContact NE1-CE2 3.52Å; D244-Y404 HydrophobicContact CB-CE1 3.88Å; D244-Y404 PolarHBondContact OD2-OH 2.85Å; T245-Y404 HydrophobicContact CG2-CE1 4.4Å; C252-Y404 HydrophobicContact CB-CD1 3.26Å; C252-Y404 HydrophobicContact CB-CE1 3.95Å; C252-Y404 HydrophobicContact CB-CG 3.63Å; I254-Y404 CarbonylContact O-C 3.53Å; I254-Y404 VanDerWaalsContact O-CA 3.29Å; I254-Y404 WeakPolarHBondContact O-CA 3.32Å; Q255-Y404 HydrophobicContact CB-CD1 4.49Å; Q255-Y404 HydrophobicContact CB-CE1 4.47Å; Q255-Y404 HydrophobicContact CG-CE1 4.38Å; Q255-Y404 PolarHBondContact NE2-OH 2.8Å
405	L	98	Very high	94.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	152.8	170.5	-49.2	172.6	0	0	0	110.5	A206 I212 G253 I254 V256 F381 V410	A206-L405 HydrophobicContact CB-CD2 3.97Å; I212-L405 HydrophobicContact CB-CD2 4.48Å; I212-L405 HydrophobicContact CG1-CD2 3.91Å; G253-L405 PolarHBondContact N-O 2.71Å; I254-L405 HydrophobicContact CB-CB 4.04Å; I254-L405 HydrophobicContact CB-CD1 4.39Å; I254-L405 HydrophobicContact CB-CG 4.47Å; I254-L405 HydrophobicContact CD1-CB 4.26Å; I254-L405 HydrophobicContact CG2-CD1 4.28Å; I254-L405 PolarHBondContact N-O 3.21Å; I254-L405 PolarHBondContact O-N 3.07Å; V256-L405 HydrophobicContact CG2-CD1 4.04Å; V256-L405 HydrophobicContact CG2-CG 4.17Å; F381-L405 HydrophobicContact CD1-CD1 4.23Å; F381-L405 HydrophobicContact CE1-CD1 4.01Å; L405-V410 HydrophobicContact CD1-CG2 4.47Å
406	T	95.2	Very high	94.5	Very high	27 Å²	27	37.8 Å²	37.8	17%	0.166	19%	0.193	C	C	.	.			trans	-69.6	137.2	169.2	45	0	0	0	0	110.1	S210 R213 I254 D409	S210-T406 PolarHBondContact OG-O 2.88Å; S210-T406 PolarHBondContact OG-OG1 2.64Å; S210-T406 VanDerWaalsContact OG-OG1 3.12Å; R213-T406 HydrophobicContact CB-CG2 4.15Å; R213-T406 HydrophobicContact CG-CG2 4.49Å; I254-T406 WeakPolarHBondContact CD1-O 3.29Å; T406-D409 WeakPolarHBondContact CB-OD2 3.49Å; T406-D409 WeakPolarHBondContact OG1-CB 3.14Å; T406-D409 PolarHBondContact OG1-OD2 3.28Å
407	R	94.4	Very high	94.9	Very high	28 Å²	28	37.2 Å²	37.2	11%	0.106	18%	0.18	C	C	.	.	H	α-helix	trans	-68.5	-42	178.3	-167.5	-176.4	-172.7	82.4	3.6	111.3	I254 D383 W385 D409 V410 L411	I254-R407 HydrophobicContact CD1-CB 4.34Å; D383-R407 IonicContact OD1-CZ 3.08Å; D383-R407 IonicContact OD1-NH1 3.73Å; D383-R407 PolarHBondContact OD1-NH1 2.98Å; D383-R407 IonicContact OD1-NH2 3.51Å; D383-R407 IonicContact OD2-CZ 3.76Å; D383-R407 IonicContact OD2-NH1 3.73Å; D383-R407 PolarHBondContact OD2-NH1 3.31Å; D383-R407 IonicContact OD2-NH2 3.67Å; D383-R407 PolarHBondContact OD2-NH2 3.44Å; W385-R407 HydrophobicContact CZ2-CB 4.5Å; W385-R407 VanDerWaalsContact CZ3-CD 3.47Å; R407-D409 VanDerWaalsContact C-N 3.32Å; R407-D409 PolarHBondContact O-N 2.79Å; R407-V410 PolarHBondContact O-N 2.75Å; R407-L411 HydrophobicContact CG-CD1 4.16Å; R407-L411 HydrophobicContact CG-CG 4.23Å; R407-L411 WeakPolarHBondContact O-CG 3.39Å; R407-L411 PolarHBondContact O-N 3.15Å
408	D	94.1	Very high	95.2	Very high	108 Å²	108	36.2 Å²	36.2	58%	0.578	20%	0.195	S	C	*	.	H	α-helix	trans	-59.2	-42.8	-174.1	-67.5	-24.9	0	0	0	112.4	L411 N412	D408-L411 PolarHBondContact O-N 3Å; D408-N412 VanDerWaalsContact O-CB 3.3Å; D408-N412 WeakPolarHBondContact O-CB 2.83Å; D408-N412 PolarHBondContact O-N 3.26Å
409	D	95.3	Very high	95.5	Very high	47 Å²	47	37.1 Å²	37.1	25%	0.251	20%	0.2	S	C	.	.	H	α-helix	trans	-68.4	-38.2	179.4	-67.7	-71.1	0	0	0	112.2	S210 T406 R407 N412 T413	S210-D409 VanDerWaalsContact OG-CB 3.3Å; S210-D409 WeakPolarHBondContact OG-CB 2.94Å; T406-D409 WeakPolarHBondContact CB-OD2 3.49Å; T406-D409 WeakPolarHBondContact OG1-CB 3.14Å; T406-D409 PolarHBondContact OG1-OD2 3.28Å; R407-D409 VanDerWaalsContact C-N 3.32Å; R407-D409 PolarHBondContact O-N 2.79Å; D409-N412 WeakPolarHBondContact O-CB 3.09Å; D409-N412 PolarHBondContact O-N 2.88Å; D409-T413 PolarHBondContact O-N 3.39Å; D409-T413 PolarHBondContact O-OG1 3.41Å; D409-T413 VanDerWaalsContact O-OG1 3.08Å
410	V	96.1	Very high	95.4	Very high	4 Å²	4	40.9 Å²	40.9	2%	0.024	22%	0.217	C	C	.	.	H	α-helix	trans	-61.9	-46.3	173.2	174.3	0	0	0	0	111.2	L181 F184 I209 I254 L405 R407 N412 T413 A414	L181-V410 HydrophobicContact CD2-CG1 3.8Å; F184-V410 HydrophobicContact CD1-CG1 4.34Å; F184-V410 HydrophobicContact CE1-CG1 4.14Å; I209-V410 HydrophobicContact CG2-CB 4.36Å; I209-V410 HydrophobicContact CG2-CG1 4.14Å; I209-V410 HydrophobicContact CG2-CG2 3.89Å; I254-V410 HydrophobicContact CD1-CB 3.95Å; I254-V410 HydrophobicContact CD1-CG1 4.48Å; I254-V410 HydrophobicContact CD1-CG2 3.45Å; I254-V410 VanDerWaalsContact CD1-CG2 3.45Å; I254-V410 HydrophobicContact CG1-CG2 4.11Å; L405-V410 HydrophobicContact CD1-CG2 4.47Å; R407-V410 PolarHBondContact O-N 2.75Å; V410-N412 VanDerWaalsContact C-N 3.33Å; V410-N412 PolarHBondContact O-N 3.43Å; V410-T413 PolarHBondContact O-N 3.15Å; V410-A414 WeakPolarHBondContact O-CB 3.2Å; V410-A414 PolarHBondContact O-N 3.04Å
411	L	95.8	Very high	95.1	Very high	9 Å²	9	41.4 Å²	41.4	5%	0.047	22%	0.222	C	C	.	.	H	α-helix	trans	-66.2	-36.6	177.4	-58.9	-177.8	0	0	0	111.4	L185 R407 D408 A414 R415 A421	L185-L411 HydrophobicContact CD2-CD2 3.58Å; R407-L411 HydrophobicContact CG-CD1 4.16Å; R407-L411 HydrophobicContact CG-CG 4.23Å; R407-L411 WeakPolarHBondContact O-CG 3.39Å; R407-L411 PolarHBondContact O-N 3.15Å; D408-L411 PolarHBondContact O-N 3Å; L411-A414 PolarHBondContact O-N 3.37Å; L411-R415 WeakPolarHBondContact O-CB 3.09Å; L411-R415 VanDerWaalsContact O-CG 3.26Å; L411-R415 WeakPolarHBondContact O-CG 3.44Å; L411-R415 PolarHBondContact O-N 2.93Å; L411-A421 HydrophobicContact CD2-CB 4.14Å; L411-A421 WeakPolarHBondContact CD2-OXT 3.41Å
412	N	96.3	Very high	95.2	Very high	79 Å²	79	43.5 Å²	43.5	42%	0.422	23%	0.233	S	C	.	.	H	α-helix	trans	-60.2	-51.5	173.9	175.3	63.6	0	0	0	111.5	D408 D409 V410 A414 R415 L416	D408-N412 VanDerWaalsContact O-CB 3.3Å; D408-N412 WeakPolarHBondContact O-CB 2.83Å; D408-N412 PolarHBondContact O-N 3.26Å; D409-N412 WeakPolarHBondContact O-CB 3.09Å; D409-N412 PolarHBondContact O-N 2.88Å; V410-N412 VanDerWaalsContact C-N 3.33Å; V410-N412 PolarHBondContact O-N 3.43Å; N412-A414 VanDerWaalsContact C-N 3.3Å; N412-A414 PolarHBondContact O-N 3.19Å; N412-R415 PolarHBondContact O-N 3.14Å; N412-L416 WeakPolarHBondContact O-CG 3.34Å; N412-L416 PolarHBondContact O-N 3.46Å
413	T	96.8	Very high	95.1	Very high	28 Å²	28	45.8 Å²	45.8	17%	0.172	25%	0.246	C	C	.	.	H	α-helix	trans	-58.3	-42.8	176.9	-60.4	0	0	0	0	111.4	L177 L181 I209 D409 V410 L416 L417	L177-T413 HydrophobicContact CD2-CG2 4Å; L181-T413 HydrophobicContact CD1-CG2 3.92Å; I209-T413 PolarHBondContact O-OG1 2.79Å; D409-T413 PolarHBondContact O-N 3.39Å; D409-T413 PolarHBondContact O-OG1 3.41Å; D409-T413 VanDerWaalsContact O-OG1 3.08Å; V410-T413 PolarHBondContact O-N 3.15Å; T413-L416 PolarHBondContact O-N 3.2Å; T413-L417 HydrophobicContact CG2-CD1 4.34Å; T413-L417 WeakPolarHBondContact O-CG 3.49Å; T413-L417 PolarHBondContact O-N 3.1Å; T413-L417 VanDerWaalsContact O-N 3.15Å
414	A	96.8	Very high	95	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.2	-44.4	176.3	0	0	0	0	0	113	L181 L185 V410 L411 N412 L416 L417 G418 L419 A421	L181-A414 HydrophobicContact CD1-CB 4.23Å; L185-A414 HydrophobicContact CD1-CB 3.67Å; V410-A414 WeakPolarHBondContact O-CB 3.2Å; V410-A414 PolarHBondContact O-N 3.04Å; L411-A414 PolarHBondContact O-N 3.37Å; N412-A414 VanDerWaalsContact C-N 3.3Å; N412-A414 PolarHBondContact O-N 3.19Å; A414-L416 VanDerWaalsContact C-N 3.34Å; A414-L416 PolarHBondContact O-N 2.9Å; A414-L417 CarbonylContact O-C 3.57Å; A414-L417 PolarHBondContact O-N 2.8Å; A414-G418 PolarHBondContact O-N 3.44Å; A414-L419 HydrophobicContact CB-CB 4.19Å; A414-L419 HydrophobicContact CB-CD1 4.11Å; A414-L419 WeakPolarHBondContact O-CB 3.41Å; A414-L419 PolarHBondContact O-N 2.87Å; A414-A421 HydrophobicContact CB-CB 3.68Å
415	R	95.9	Very high	94.8	Very high	124 Å²	124	50.3 Å²	50.3	47%	0.468	27%	0.271	S	S	.	.	H	α-helix	trans	-63.8	-38.5	177	-71.7	172.7	-169.2	128.8	5.5	112	L411 N412 L417 G418 A421	L411-R415 WeakPolarHBondContact O-CB 3.09Å; L411-R415 VanDerWaalsContact O-CG 3.26Å; L411-R415 WeakPolarHBondContact O-CG 3.44Å; L411-R415 PolarHBondContact O-N 2.93Å; N412-R415 PolarHBondContact O-N 3.14Å; R415-L417 VanDerWaalsContact C-N 3.25Å; R415-L417 PolarHBondContact O-N 3.33Å; R415-G418 PolarHBondContact O-N 3.3Å; R415-A421 HydrophobicContact CG-CB 4.19Å; R415-A421 PolarHBondContact NE-O 2.77Å; R415-A421 PolarHBondContact NH2-O 2.75Å; R415-A421 PolarHBondContact NH2-OXT 2.56Å
416	L	95.9	Very high	94.6	Very high	136 Å²	136	53.4 Å²	53.4	71%	0.712	29%	0.288	S	S	*	.	H	α-helix	trans	-61.6	-34.4	174.7	-72.9	174.5	0	0	0	112.2	N412 T413 A414 G418	N412-L416 WeakPolarHBondContact O-CG 3.34Å; N412-L416 PolarHBondContact O-N 3.46Å; T413-L416 PolarHBondContact O-N 3.2Å; A414-L416 VanDerWaalsContact C-N 3.34Å; A414-L416 PolarHBondContact O-N 2.9Å; L416-G418 PolarHBondContact O-N 2.78Å
417	L	96.3	Very high	94.5	Very high	31 Å²	31	55.2 Å²	55.2	16%	0.162	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	6.4	174.8	-64.6	171.3	0	0	0	113.5	D174 L177 K178 L181 T413 A414 R415	D174-L417 HydrophobicContact CB-CD2 4.03Å; L177-L417 HydrophobicContact CB-CD1 4.44Å; L177-L417 HydrophobicContact CD2-CD1 3.85Å; L177-L417 HydrophobicContact CG-CD1 3.85Å; K178-L417 HydrophobicContact CB-CD1 4.34Å; K178-L417 HydrophobicContact CD-CB 4.49Å; K178-L417 WeakPolarHBondContact CE-O 3.46Å; K178-L417 HydrophobicContact CG-CB 4.49Å; K178-L417 PolarHBondContact NZ-O 3.47Å; L181-L417 HydrophobicContact CD1-CD1 3.81Å; T413-L417 HydrophobicContact CG2-CD1 4.34Å; T413-L417 WeakPolarHBondContact O-CG 3.49Å; T413-L417 PolarHBondContact O-N 3.1Å; T413-L417 VanDerWaalsContact O-N 3.15Å; A414-L417 CarbonylContact O-C 3.57Å; A414-L417 PolarHBondContact O-N 2.8Å; R415-L417 VanDerWaalsContact C-N 3.25Å; R415-L417 PolarHBondContact O-N 3.33Å
418	G	95.3	Very high	94.5	Very high	61 Å²	61	57.1 Å²	57.1	63%	0.629	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	21.5	177	0	0	0	0	0	114.4	A414 R415 L416	A414-G418 PolarHBondContact O-N 3.44Å; R415-G418 PolarHBondContact O-N 3.3Å; L416-G418 PolarHBondContact O-N 2.78Å
419	L	94.6	Very high	94.6	Very high	23 Å²	23	53.2 Å²	53.2	12%	0.12	29%	0.289	C	S	.	.			trans	-83.4	147.1	171.2	-60.5	174.8	0	0	0	110.5	K178 L181 Q182 L185 A414 A421	K178-L419 HydrophobicContact CD-CD2 4.46Å; K178-L419 HydrophobicContact CG-CD1 4.22Å; K178-L419 HydrophobicContact CG-CD2 3.94Å; K178-L419 HydrophobicContact CG-CG 4.16Å; L181-L419 HydrophobicContact CB-CD1 3.58Å; Q182-L419 HydrophobicContact CB-CD1 4.27Å; Q182-L419 HydrophobicContact CB-CD2 4.05Å; Q182-L419 HydrophobicContact CG-CD2 4.42Å; L185-L419 HydrophobicContact CD1-CB 4.4Å; L185-L419 HydrophobicContact CD1-CD1 4.26Å; A414-L419 HydrophobicContact CB-CB 4.19Å; A414-L419 HydrophobicContact CB-CD1 4.11Å; A414-L419 WeakPolarHBondContact O-CB 3.41Å; A414-L419 PolarHBondContact O-N 2.87Å; L419-A421 PolarHBondContact O-N 2.93Å
420	Q	89	Confident	94.5	Very high	136 Å²	136	53.8 Å²	53.8	64%	0.636	29%	0.292	S	S	*	.			trans	-79.1	106.5	169.1	-173	179.7	-0	0	0	108.3	P148	P148-Q420 HydrophobicContact CG-CB 4.01Å; P148-Q420 HydrophobicContact CG-CG 3.66Å
421	A	85.6	Confident	94.4	Very high	14 Å²	14	58.3 Å²	58.3	12%	0.116	32%	0.317	C	S	.	.			trans	-145.5	0	-172	0	0	0	0	0	110.9	H147 L185 L411 A414 R415 L419	H147-A421 PolarHBondContact CD2-OXT 2.98Å; H147-A421 PolarHBondContact NE2-OXT 3.43Å; H147-A421 VanDerWaalsContact NE2-OXT 3.07Å; L185-A421 HydrophobicContact CD1-CB 3.54Å; L185-A421 HydrophobicContact CD2-CB 4.26Å; L411-A421 HydrophobicContact CD2-CB 4.14Å; L411-A421 WeakPolarHBondContact CD2-OXT 3.41Å; A414-A421 HydrophobicContact CB-CB 3.68Å; R415-A421 HydrophobicContact CG-CB 4.19Å; R415-A421 PolarHBondContact NE-O 2.77Å; R415-A421 PolarHBondContact NH2-O 2.75Å; R415-A421 PolarHBondContact NH2-OXT 2.56Å; L419-A421 PolarHBondContact O-N 2.93Å

Retrieved 421 of 421 residues in 113.8 ms (Link to these results)

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