A0A096N958_PAPAN Loading...

Elongation factor G, mitochondrial

Mitochondrial GTPase that catalyzes the GTP-dependent ribosomal translocation step during translation elongation. During this step, the ribosome changes from the pre-translocational (PRE) to the post-translocational (POST) state as the newly formed A-site-bound peptidyl-tRNA and P-site-bound deacylated tRNA move to the P and E sites, respectively. Catalyzes the coordinated movement of the two tRNA molecules, the mRNA and conformational changes in the ribosome. Does not mediate the disassembly of ribosomes from messenger RNA at the termination of mitochondrial protein biosynthesis.

AlphaFold DB , UniProt , Accession A0A096N958, Species PAPAN (Papio anubis, Olive baboon), Gene GFM1, Length 770 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.6	Very low	27.5	Very low	238 Å²	238	137.2 Å²	137.2	100%	1.172	85%	0.847	S	S	*	*				0	114.1	0	-133.8	173.4	-179.1	0	0	107.5
2	R	27.8	Very low	27.5	Very low	222 Å²	222	141.8 Å²	141.8	84%	0.838	86%	0.86	S	S	*	*			trans	45.9	117.6	153.1	-78.1	-179.8	173.3	-176.3	0.3	120.5
3	L	26.7	Very low	27.3	Very low	134 Å²	134	136.5 Å²	136.5	70%	0.702	85%	0.853	S	S	*	*				90.6	111	106.9	-76.2	162.9	0	0	0	112.5
4	L	28.6	Very low	27.4	Very low	166 Å²	166	145.2 Å²	145.2	87%	0.869	86%	0.861	S	S	*	*				79.3	125.6	75.6	-101.3	164.4	0	0	0	115.6
5	G	25.7	Very low	27.2	Very low	72 Å²	72	140.7 Å²	140.7	74%	0.742	86%	0.857	S	S	*	*			trans	85.6	149.1	152.1	0	0	0	0	0	116.1
6	A	26.1	Very low	27.2	Very low	102 Å²	102	147.6 Å²	147.6	84%	0.843	86%	0.862	S	S	*	*			cis	-179.6	171.6	-5.6	0	0	0	0	0	106.6
7	A	26.5	Very low	27.3	Very low	98 Å²	98	144.6 Å²	144.6	81%	0.81	86%	0.859	S	S	*	*			trans	91.6	104	153.3	0	0	0	0	0	121.1
8	A	27.6	Very low	27.2	Very low	96 Å²	96	143.6 Å²	143.6	79%	0.793	86%	0.857	S	S	*	*			trans	3.2	133.5	136.1	0	0	0	0	0	120.8
9	V	27.7	Very low	27.3	Very low	142 Å²	142	141.3 Å²	141.3	86%	0.861	86%	0.855	S	S	*	*			trans	-138.3	125.1	148.7	177	0	0	0	0	109.4
10	T	26.7	Very low	27.2	Very low	136 Å²	136	140.1 Å²	140.1	83%	0.834	85%	0.853	S	S	*	*			trans	-76.3	135.7	170.4	42.1	0	0	0	0	111.9
11	A	27.4	Very low	27.2	Very low	103 Å²	103	141 Å²	141	85%	0.851	85%	0.852	S	S	*	*			trans	-148.2	119	157.7	0	0	0	0	0	111
12	L	27.2	Very low	26.9	Very low	192 Å²	192	132.8 Å²	132.8	100%	1.005	83%	0.829	S	S	*	*			trans	-70.2	135.8	171.3	-83.2	134.1	0	0	0	110.7
13	G	24.8	Very low	26.7	Very low	74 Å²	74	133.7 Å²	133.7	76%	0.763	83%	0.832	S	S	*	*			trans	-175.3	85.2	173.1	0	0	0	0	0	114.3
14	R	29	Very low	26.6	Very low	258 Å²	258	136 Å²	136	97%	0.974	84%	0.84	S	S	*	*			trans	1.7	107.6	163.3	-69.8	176.2	173	179.8	-2.5	117.6
15	G	24.9	Very low	26.5	Very low	77 Å²	77	139.6 Å²	139.6	79%	0.794	84%	0.842	S	S	*	*			trans	-110	125.9	164	0	0	0	0	0	112
16	R	26.5	Very low	26.6	Very low	251 Å²	251	145.5 Å²	145.5	95%	0.947	85%	0.847	S	S	*	*			trans	-65.7	137.5	165.5	-82.5	175.3	167.6	174.5	-4.6	109.5
17	A	29.3	Very low	26.5	Very low	97 Å²	97	149.6 Å²	149.6	80%	0.802	85%	0.849	S	S	*	*			trans	-62.4	148.8	173.4	0	0	0	0	0	112.3
18	P	26.2	Very low	26.7	Very low	126 Å²	126	150 Å²	150	82%	0.818	84%	0.841	S	S	*	*				-128.7	150.7	118.8	27	-11.6	0	0	0	112.3
19	A	29.1	Very low	26.5	Very low	101 Å²	101	151.5 Å²	151.5	84%	0.835	84%	0.835	S	S	*	*			trans	-60.5	127.8	-173.2	0	0	0	0	0	113.5
20	S	25.1	Very low	26.5	Very low	116 Å²	116	154.4 Å²	154.4	81%	0.811	83%	0.831	S	S	*	*			trans	-91.4	111.8	164.1	57.2	0	0	0	0	110	G22	S20-G22 PolarHBondContact O-N 2.67Å; S20-G22 VanDerWaalsContact O-N 3.09Å
21	L	27	Very low	26.4	Very low	159 Å²	159	153.1 Å²	153.1	83%	0.832	82%	0.819	S	S	*	*			trans	-65.6	99.9	156.7	-100.4	104.8	0	0	0	107.9	W23	L21-W23 PolarHBondContact O-N 3.09Å
22	G	24.1	Very low	26.4	Very low	66 Å²	66	152.5 Å²	152.5	68%	0.68	81%	0.814	S	S	*	*			trans	-75.9	101.5	168.6	0	0	0	0	0	110.2	S20 Q24	S20-G22 PolarHBondContact O-N 2.67Å; S20-G22 VanDerWaalsContact O-N 3.09Å; G22-Q24 VanDerWaalsContact C-N 3.34Å; G22-Q24 PolarHBondContact O-N 3.37Å; G22-Q24 VanDerWaalsContact O-N 3.08Å
23	W	24.4	Very low	26.6	Very low	241 Å²	241	148.6 Å²	148.6	91%	0.913	80%	0.802	S	S	*	*			trans	-70.9	92.7	159	-93.5	35.3	0	0	0	108.6	L21 R25	L21-W23 PolarHBondContact O-N 3.09Å; W23-R25 PolarHBondContact O-N 2.85Å; W23-R25 VanDerWaalsContact O-N 3.08Å
24	Q	24.5	Very low	26.8	Very low	183 Å²	183	154.9 Å²	154.9	86%	0.855	80%	0.802	S	S	*	*			trans	-65.8	103.5	161.7	-85.2	-178.1	-28.4	0	0	108.2	G22 K26	G22-Q24 VanDerWaalsContact C-N 3.34Å; G22-Q24 PolarHBondContact O-N 3.37Å; G22-Q24 VanDerWaalsContact O-N 3.08Å; Q24-K26 VanDerWaalsContact C-N 3.34Å; Q24-K26 PolarHBondContact O-N 3.19Å
25	R	27	Very low	26.8	Very low	242 Å²	242	153 Å²	153	91%	0.913	80%	0.795	S	S	*	*			trans	-57.6	101	158.9	-96.9	-179.6	169.6	177.2	-3.3	107.3	W23 Q27	W23-R25 PolarHBondContact O-N 2.85Å; W23-R25 VanDerWaalsContact O-N 3.08Å; R25-Q27 PolarHBondContact O-N 3.18Å
26	K	27.9	Very low	27.1	Very low	195 Å²	195	154 Å²	154	85%	0.848	79%	0.79	S	S	*	*			trans	-56.9	108.9	166.7	-82.5	179.5	174.4	177.4	0	107.6	Q24 V28	Q24-K26 VanDerWaalsContact C-N 3.34Å; Q24-K26 PolarHBondContact O-N 3.19Å; K26-V28 PolarHBondContact O-N 2.96Å; K26-V28 VanDerWaalsContact O-N 3.1Å
27	Q	24	Very low	27.3	Very low	189 Å²	189	145.9 Å²	145.9	88%	0.883	77%	0.772	S	S	*	*			trans	-56.8	113.4	160.2	-93.5	176.3	-32.6	0	0	107.1	R25 N29	R25-Q27 PolarHBondContact O-N 3.18Å; Q27-N29 PolarHBondContact O-N 3.29Å; Q27-N29 VanDerWaalsContact O-N 3.16Å
28	V	29.8	Very low	27.5	Very low	107 Å²	107	147.6 Å²	147.6	65%	0.648	78%	0.778	S	S	*	*			trans	-58.8	116.9	169.4	-179.8	0	0	0	0	106.4	K26 W30	K26-V28 PolarHBondContact O-N 2.96Å; K26-V28 VanDerWaalsContact O-N 3.1Å; V28-W30 VanDerWaalsContact C-N 3.29Å; V28-W30 PolarHBondContact O-N 3.12Å
29	N	25	Very low	28.8	Very low	126 Å²	126	143.7 Å²	143.7	67%	0.674	76%	0.76	S	S	*	*			trans	-76.8	85.4	179.7	-154.6	-1.8	0	0	0	107.8	Q27 N31	Q27-N29 PolarHBondContact O-N 3.29Å; Q27-N29 VanDerWaalsContact O-N 3.16Å; N29-N31 PolarHBondContact O-N 3.37Å
30	W	26.9	Very low	30.5	Very low	204 Å²	204	142.4 Å²	142.4	77%	0.773	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-58	-9	179.5	-73.7	91.2	0	0	0	114.2	V28 A32	V28-W30 VanDerWaalsContact C-N 3.29Å; V28-W30 PolarHBondContact O-N 3.12Å; W30-A32 VanDerWaalsContact C-N 3.35Å; W30-A32 PolarHBondContact O-N 2.92Å
31	N	24.8	Very low	33.1	Very low	109 Å²	109	138.7 Å²	138.7	58%	0.583	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-80.1	-7.7	-175.6	-70.4	-25.6	0	0	0	114.8	N29 R34	N29-N31 PolarHBondContact O-N 3.37Å; N31-R34 PolarHBondContact O-N 2.73Å
32	A	27.2	Very low	35.9	Very low	89 Å²	89	134.3 Å²	134.3	74%	0.736	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-83.9	-11	-177.4	0	0	0	0	0	114.8	W30 R34	W30-A32 VanDerWaalsContact C-N 3.35Å; W30-A32 PolarHBondContact O-N 2.92Å; A32-R34 VanDerWaalsContact C-N 3.32Å
33	C	31.7	Very low	38.8	Very low	111 Å²	111	132 Å²	132	75%	0.75	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-89.2	4.2	168.4	-75.9	0	0	0	0	113.1	W35	C33-W35 VanDerWaalsContact C-N 3.25Å; C33-W35 PolarHBondContact O-N 3.12Å
34	R	28.1	Very low	41.9	Very low	205 Å²	205	127 Å²	127	77%	0.774	65%	0.653	S	S	*	*			trans	-88.3	67.1	163.8	-73	-175.5	174.9	-173.9	-1.6	109.1	N31 A32 S36	N31-R34 PolarHBondContact O-N 2.73Å; A32-R34 VanDerWaalsContact C-N 3.32Å; R34-S36 PolarHBondContact O-N 3.2Å; R34-S36 VanDerWaalsContact O-N 3.14Å
35	W	29.4	Very low	45.1	Very low	219 Å²	219	122.8 Å²	122.8	83%	0.83	63%	0.632	S	S	*	*			trans	-73.8	100.3	147.8	-151.5	-70.2	0	0	0	105.6	C33 S37	C33-W35 VanDerWaalsContact C-N 3.25Å; C33-W35 PolarHBondContact O-N 3.12Å; W35-S37 VanDerWaalsContact C-N 3.28Å; W35-S37 PolarHBondContact O-N 3.24Å
36	S	30.5	Very low	48.2	Very low	99 Å²	99	111.3 Å²	111.3	69%	0.692	59%	0.588	S	S	*	*			trans	-53.7	92.7	163.5	49.8	0	0	0	0	109.2	R34	R34-S36 PolarHBondContact O-N 3.2Å; R34-S36 VanDerWaalsContact O-N 3.14Å
37	S	31.7	Very low	51.4	Low	79 Å²	79	102.9 Å²	102.9	55%	0.552	55%	0.551	S	S	*	*			trans	-102.2	88.7	143.6	60.5	0	0	0	0	106.4	W35 G39	W35-S37 VanDerWaalsContact C-N 3.28Å; W35-S37 PolarHBondContact O-N 3.24Å; S37-G39 PolarHBondContact O-N 2.84Å
38	S	33.4	Very low	54.7	Low	133 Å²	133	93.9 Å²	93.9	93%	0.93	51%	0.509	S	S	*	.			trans	-64.4	45.6	153.5	50.1	0	0	0	0	110.4
39	G	53	Low	57.8	Low	44 Å²	44	89 Å²	89	45%	0.454	48%	0.48	S	S	.	.	S	Bend	trans	-145.4	132.4	-171.1	0	0	0	0	0	109.2	S37 I41	S37-G39 PolarHBondContact O-N 2.84Å; G39-I41 PolarHBondContact O-N 2.68Å
40	V	65.9	Low	61.1	Low	75 Å²	75	83 Å²	83	46%	0.455	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-57.7	123.2	178.5	-178	0	0	0	0	109.1	P42 R366 Y432	V40-P42 WeakPolarHBondContact O-CD 3.28Å; V40-R366 HydrophobicContact CG1-CB 4.26Å; V40-Y432 HydrophobicContact CG1-CD2 4.43Å; V40-Y432 HydrophobicContact CG1-CE2 4.2Å; V40-Y432 HydrophobicContact CG2-CE2 4.23Å
41	I	79.3	Confident	64.4	Low	38 Å²	38	73.5 Å²	73.5	20%	0.195	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-67.4	123.4	173.3	-60.1	175.8	0	0	0	107.7	G39 K45 I46 R366	G39-I41 PolarHBondContact O-N 2.68Å; I41-K45 HydrophobicContact CG2-CB 4.07Å; I41-I46 HydrophobicContact CG2-CD1 4.13Å; I41-I46 HydrophobicContact CG2-CG1 3.83Å; I41-R366 WeakPolarHBondContact O-CD 3.47Å; I41-R366 PolarHBondContact O-NE 3.39Å; I41-R366 VanDerWaalsContact O-NE 3.11Å
42	P	86	Confident	67.5	Low	66 Å²	66	68.3 Å²	68.3	43%	0.429	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-62.8	147.7	175.5	-21.3	33	0	0	0	111.6	V40 E44 K45	V40-P42 WeakPolarHBondContact O-CD 3.28Å; P42-E44 PolarHBondContact O-N 2.9Å; P42-E44 VanDerWaalsContact O-N 3.16Å; P42-K45 PolarHBondContact O-N 2.86Å
43	N	85.4	Confident	70.5	Confident	19 Å²	19	64.1 Å²	64.1	10%	0.102	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-54.3	-36.8	177.8	-75.3	-26	0	0	0	113.1	K45 I46 N338 S364 R366 A433	N43-K45 PolarHBondContact O-N 2.93Å; N43-K45 VanDerWaalsContact O-N 3.09Å; N43-I46 PolarHBondContact O-N 3.01Å; N43-N338 WeakPolarHBondContact O-CB 3.41Å; N43-S364 PolarHBondContact ND2-O 3.25Å; N43-R366 WeakPolarHBondContact OD1-CD 3.46Å; N43-R366 WeakPolarHBondContact OD1-CG 3.47Å; N43-A433 PolarHBondContact OD1-O 3.48Å
44	E	89.2	Confident	73.1	Confident	136 Å²	136	60.1 Å²	60.1	64%	0.636	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-58.2	-24.6	179.8	-63.4	171	179.8	0	0	113.3	P42 R47	P42-E44 PolarHBondContact O-N 2.9Å; P42-E44 VanDerWaalsContact O-N 3.16Å; E44-R47 PolarHBondContact O-NH1 2.91Å
45	K	91.4	Very high	75.7	Confident	94 Å²	94	52.8 Å²	52.8	41%	0.409	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-100.8	19.3	179.6	-62.9	-170.9	174.8	-167.8	0	113	I41 P42 N43 V114 N115	I41-K45 HydrophobicContact CG2-CB 4.07Å; P42-K45 PolarHBondContact O-N 2.86Å; N43-K45 PolarHBondContact O-N 2.93Å; N43-K45 VanDerWaalsContact O-N 3.09Å; K45-V114 CarbonylContact O-C 3.47Å; K45-V114 WeakPolarHBondContact O-CA 3.32Å; K45-V114 WeakPolarHBondContact O-CG1 3.47Å; K45-N115 PolarHBondContact O-N 3.39Å
46	I	92	Very high	78.2	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	139.8	175.5	-61	169.7	0	0	0	109.3	I41 N43 N115 P339	I41-I46 HydrophobicContact CG2-CD1 4.13Å; I41-I46 HydrophobicContact CG2-CG1 3.83Å; N43-I46 PolarHBondContact O-N 3.01Å; I46-N115 CarbonylContact C-O 3.36Å; I46-N115 WeakPolarHBondContact CA-O 3.21Å; I46-N115 HydrophobicContact CG1-CB 4.49Å; I46-P339 HydrophobicContact CB-CG 4.2Å; I46-P339 HydrophobicContact CG2-CG 3.94Å; I46-P339 WeakPolarHBondContact O-CD 3.39Å
47	R	94.3	Very high	80.9	Confident	17 Å²	17	43.2 Å²	43.2	6%	0.064	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	126.7	172.1	-64.6	-64	-179.9	-78.1	-2.8	109.4	E44 I49 V114 N115 I116 N117 L333 L336 P337	E44-R47 PolarHBondContact O-NH1 2.91Å; R47-I49 HydrophobicContact CB-CG2 4.37Å; R47-V114 HydrophobicContact CG-CG1 3.98Å; R47-N115 PolarHBondContact N-O 3.34Å; R47-I116 HydrophobicContact CB-CG1 4.42Å; R47-I116 HydrophobicContact CB-CG2 4.39Å; R47-I116 CarbonylContact O-C 3.58Å; R47-I116 WeakPolarHBondContact O-CA 3.48Å; R47-N117 PolarHBondContact O-N 2.79Å; R47-L333 PolarHBondContact NH2-O 3.24Å; R47-L336 PolarHBondContact NE-O 3.29Å; R47-P337 WeakPolarHBondContact CD-O 3.34Å
48	N	94.4	Very high	83.5	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	102.6	173.4	-62.6	-43.3	0	0	0	108.5	N117 L138 D139 G140 G434	N48-N117 WeakPolarHBondContact OD1-CB 3.47Å; N48-N117 PolarHBondContact OD1-ND2 3.28Å; N48-L138 HydrophobicContact CB-CD2 4.43Å; N48-D139 HydrophobicContact CB-CB 4.3Å; N48-D139 WeakPolarHBondContact CB-OD2 3.44Å; N48-D139 PolarHBondContact ND2-OD2 3.29Å; N48-D139 PolarHBondContact O-N 2.81Å; N48-G140 PolarHBondContact O-N 2.72Å; N48-G140 VanDerWaalsContact O-N 3.1Å; N48-G434 PolarHBondContact ND2-O 2.86Å
49	I	95.1	Very high	86.1	Confident	6 Å²	6	34.1 Å²	34.1	3%	0.031	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	143.7	-174.3	68.2	170.5	0	0	0	113.1	R47 I116 N117 I118 I119 L138 G140 V332 L336	R47-I49 HydrophobicContact CB-CG2 4.37Å; I49-I116 HydrophobicContact CD1-CG2 3.75Å; I49-I116 HydrophobicContact CG1-CG2 3.83Å; I49-N117 PolarHBondContact N-O 3.11Å; I49-I118 HydrophobicContact CD1-CG1 4.22Å; I49-I118 HydrophobicContact CG1-CG1 4.06Å; I49-I118 WeakPolarHBondContact O-CA 3.26Å; I49-I119 PolarHBondContact O-N 3.46Å; I49-L138 WeakPolarHBondContact O-CD2 3.2Å; I49-G140 VanDerWaalsContact CA-O 3.29Å; I49-G140 WeakPolarHBondContact CA-O 3.41Å; I49-V332 HydrophobicContact CD1-CG1 3.97Å; I49-V332 HydrophobicContact CD1-CG2 4.19Å; I49-V332 HydrophobicContact CG2-CG1 4.06Å; I49-L336 HydrophobicContact CG2-CD1 3.68Å
50	G	94.4	Very high	87.8	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	143	168.2	0	0	0	0	0	112	I119 G140 A141 V142	G50-I119 WeakPolarHBondContact CA-O 3.32Å; G50-G140 PolarHBondContact N-O 3.43Å; G50-G140 VanDerWaalsContact N-O 3.07Å; G50-A141 CarbonylContact O-C 3.59Å; G50-A141 VanDerWaalsContact O-CA 3.3Å; G50-A141 WeakPolarHBondContact O-CA 3.48Å; G50-V142 PolarHBondContact O-N 3.24Å
51	I	94.5	Very high	88.9	Confident	4 Å²	4	30.8 Å²	30.8	2%	0.021	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	115.1	169.8	-61.2	174.6	0	0	0	107.5	K59 L62 T63 I118 I119 T121 V144	I51-K59 HydrophobicContact CG2-CB 4.08Å; I51-K59 HydrophobicContact CG2-CG 4.08Å; I51-L62 HydrophobicContact CG2-CD2 4.45Å; I51-T63 WeakPolarHBondContact CD1-OG1 3.31Å; I51-I118 HydrophobicContact CD1-CG2 3.74Å; I51-I118 HydrophobicContact CG1-CG2 4.1Å; I51-I119 PolarHBondContact N-O 3.26Å; I51-T121 PolarHBondContact O-N 2.94Å; I51-T121 PolarHBondContact O-OG1 2.81Å; I51-V144 HydrophobicContact CG2-CG2 3.93Å
52	S	91.7	Very high	89.5	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	146.2	-177	-57.1	0	0	0	0	111	T121 V142 L143 V144	S52-T121 WeakPolarHBondContact CA-OG1 3.36Å; S52-T121 WeakPolarHBondContact CB-OG1 3.28Å; S52-T121 PolarHBondContact OG-OG1 3.44Å; S52-V142 PolarHBondContact N-O 3.3Å; S52-L143 CarbonylContact O-C 3.55Å; S52-L143 WeakPolarHBondContact O-CA 3.42Å; S52-V144 PolarHBondContact O-N 3.39Å
53	A	88.9	Confident	89.7	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.008	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.8	168	-171.3	0	0	0	0	0	111.2	K59 G123 V144	A53-K59 HydrophobicContact CB-CD 3.49Å; A53-K59 VanDerWaalsContact CB-CD 3.49Å; A53-K59 HydrophobicContact CB-CG 3.27Å; A53-K59 PolarHBondContact O-NZ 3.18Å; A53-G123 WeakPolarHBondContact O-CA 3.32Å; A53-V144 HydrophobicContact CB-CB 3.73Å; A53-V144 VanDerWaalsContact CB-O 3.22Å; A53-V144 WeakPolarHBondContact CB-O 3.49Å
54	H	86.4	Confident	89.8	Confident	27 Å²	27	25 Å²	25	13%	0.125	13%	0.126	C	C	.	.	S	Bend	trans	-64.7	165.2	165.2	-169.3	70.3	0	0	0	112.6	S57 K59 Q152 Q154	H54-S57 WeakPolarHBondContact O-CB 3.49Å; H54-S57 PolarHBondContact O-N 3.06Å; H54-S57 PolarHBondContact O-OG 2.97Å; H54-K59 PolarHBondContact O-NZ 3.47Å; H54-Q152 HydrophobicContact CB-CB 4.45Å; H54-Q152 PolarHBondContact CD2-NE2 3.13Å; H54-Q152 PolarHBondContact CD2-OE1 3.15Å; H54-Q152 PolarHBondContact NE2-NE2 2.85Å; H54-Q154 VanDerWaalsContact ND1-CB 3.3Å; H54-Q154 WeakPolarHBondContact ND1-CB 3.3Å
55	I	83.4	Confident	89.7	Confident	50 Å²	50	18.9 Å²	18.9	26%	0.256	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	142.8	173	-51.1	170	0	0	0	109	S57 G123 H124	I55-S57 PolarHBondContact O-N 3.34Å; I55-G123 WeakPolarHBondContact CG1-O 3.47Å; I55-H124 HydrophobicContact CD1-CB 4.31Å; I55-H124 VanDerWaalsContact CD1-CD2 3.46Å; I55-H124 WeakPolarHBondContact CD1-CD2 3.18Å; I55-H124 HydrophobicContact CG1-CB 4.41Å
56	D	81.4	Confident	89.6	Confident	117 Å²	117	14.7 Å²	14.7	63%	0.626	8%	0.079	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.2	26.5	178.5	-66.9	-18.7	0	0	0	115.4	G58 K175	D56-G58 VanDerWaalsContact C-N 3.3Å; D56-K175 VanDerWaalsContact O-CE 3.3Å; D56-K175 WeakPolarHBondContact O-CE 3.47Å; D56-K175 PolarHBondContact O-NZ 2.76Å
57	S	86.3	Confident	89.4	Confident	1 Å²	1	14.6 Å²	14.6	1%	0.007	8%	0.079	C	C	.	.	S	Bend	trans	-84	-7	172.2	-63	0	0	0	0	113	H54 I55 N174	H54-S57 WeakPolarHBondContact O-CB 3.49Å; H54-S57 PolarHBondContact O-N 3.06Å; H54-S57 PolarHBondContact O-OG 2.97Å; I55-S57 PolarHBondContact O-N 3.34Å; S57-N174 PolarHBondContact O-ND2 3Å
58	G	86.4	Confident	89	Confident	10 Å²	10	15.7 Å²	15.7	10%	0.103	8%	0.083	C	C	.	.			trans	86.1	34.5	178.2	0	0	0	0	0	114.6	D56 L62	D56-G58 VanDerWaalsContact C-N 3.3Å; G58-L62 WeakPolarHBondContact O-CB 3.28Å; G58-L62 PolarHBondContact O-N 3.02Å
59	K	89.6	Confident	88.5	Confident	11 Å²	11	16.3 Å²	16.3	5%	0.048	9%	0.086	C	C	.	.	H	α-helix	trans	-57.8	-60.3	174.6	-68.6	-174.3	-76.1	-72	0	112	I51 A53 H54 T61 L62 T63 T121	I51-K59 HydrophobicContact CG2-CB 4.08Å; I51-K59 HydrophobicContact CG2-CG 4.08Å; A53-K59 HydrophobicContact CB-CD 3.49Å; A53-K59 VanDerWaalsContact CB-CD 3.49Å; A53-K59 HydrophobicContact CB-CG 3.27Å; A53-K59 PolarHBondContact O-NZ 3.18Å; H54-K59 PolarHBondContact O-NZ 3.47Å; K59-T61 PolarHBondContact O-N 3.47Å; K59-L62 WeakPolarHBondContact O-CA 3.15Å; K59-L62 WeakPolarHBondContact O-CB 3.44Å; K59-L62 PolarHBondContact O-N 3.33Å; K59-T63 PolarHBondContact O-N 2.95Å; K59-T63 PolarHBondContact O-OG1 3.31Å; K59-T63 VanDerWaalsContact O-OG1 3.1Å; K59-T121 WeakPolarHBondContact CD-O 3.45Å; K59-T121 WeakPolarHBondContact CE-O 3.47Å
60	T	87.6	Confident	87.9	Confident	16 Å²	16	17.1 Å²	17.1	10%	0.098	9%	0.091	C	C	.	.	H	α-helix	trans	-56.7	-41.3	-179.3	-35.2	0	0	0	0	111.4	L62 T63 E64 V79 A87 M89 T101 D120	T60-L62 PolarHBondContact O-N 3.02Å; T60-T63 PolarHBondContact O-N 3.5Å; T60-E64 WeakPolarHBondContact O-CB 3.4Å; T60-E64 PolarHBondContact O-N 2.93Å; T60-V79 HydrophobicContact CG2-CG2 4.01Å; T60-A87 HydrophobicContact CG2-CB 3.96Å; T60-M89 HydrophobicContact CG2-CB 3.9Å; T60-T101 PolarHBondContact OG1-OG1 3.44Å; T60-D120 WeakPolarHBondContact CA-OD2 3.38Å
61	T	89.4	Confident	87	Confident	32 Å²	32	19.2 Å²	19.2	20%	0.196	11%	0.112	C	C	.	.	H	α-helix	trans	-61.2	-44.9	174.4	-46	0	0	0	0	111.7	K59 E64 R65 A319	K59-T61 PolarHBondContact O-N 3.47Å; T61-E64 PolarHBondContact O-N 3.01Å; T61-R65 WeakPolarHBondContact O-CG 3.31Å; T61-R65 PolarHBondContact O-N 2.78Å; T61-A319 HydrophobicContact CG2-CB 4.05Å
62	L	91.5	Very high	86.1	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-61.9	-48.3	177.2	179.4	64.5	0	0	0	111.1	I51 G58 K59 T60 E64 R65 V66 V144 F172 A319 V325 L328	I51-L62 HydrophobicContact CG2-CD2 4.45Å; G58-L62 WeakPolarHBondContact O-CB 3.28Å; G58-L62 PolarHBondContact O-N 3.02Å; K59-L62 WeakPolarHBondContact O-CA 3.15Å; K59-L62 WeakPolarHBondContact O-CB 3.44Å; K59-L62 PolarHBondContact O-N 3.33Å; T60-L62 PolarHBondContact O-N 3.02Å; L62-E64 VanDerWaalsContact C-N 3.3Å; L62-E64 PolarHBondContact O-N 2.94Å; L62-R65 PolarHBondContact O-N 2.79Å; L62-V66 WeakPolarHBondContact O-CG2 3.49Å; L62-V66 PolarHBondContact O-N 3.37Å; L62-V144 HydrophobicContact CD2-CG2 3.74Å; L62-F172 HydrophobicContact CD1-CD1 4.49Å; L62-F172 HydrophobicContact CD1-CE1 4.01Å; L62-F172 HydrophobicContact CD1-CZ 4.44Å; L62-F172 HydrophobicContact CD2-CD1 3.94Å; L62-F172 HydrophobicContact CD2-CE1 4.25Å; L62-A319 HydrophobicContact CB-CB 4.3Å; L62-A319 HydrophobicContact CD1-CB 4.4Å; L62-V325 HydrophobicContact CD1-CG1 4.16Å; L62-V325 HydrophobicContact CD1-CG2 4.02Å; L62-L328 HydrophobicContact CD1-CD2 4.06Å; L62-L328 HydrophobicContact CD2-CD2 3.92Å; L62-L328 HydrophobicContact CG-CD2 4.5Å
63	T	90.4	Very high	85.3	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-55.8	-45.4	177.1	-49.5	0	0	0	0	111.4	I51 K59 T60 R65 V66 L67 M89 I118 D120	I51-T63 WeakPolarHBondContact CD1-OG1 3.31Å; K59-T63 PolarHBondContact O-N 2.95Å; K59-T63 PolarHBondContact O-OG1 3.31Å; K59-T63 VanDerWaalsContact O-OG1 3.1Å; T60-T63 PolarHBondContact O-N 3.5Å; T63-R65 PolarHBondContact O-N 2.59Å; T63-V66 WeakPolarHBondContact O-CB 3.29Å; T63-V66 PolarHBondContact O-N 2.81Å; T63-L67 WeakPolarHBondContact O-CG 3.16Å; T63-L67 PolarHBondContact O-N 3.01Å; T63-M89 HydrophobicContact CG2-CE 3.82Å; T63-M89 HydrophobicContact CG2-CG 3.91Å; T63-M89 HydrophobicContact CG2-SD 4.07Å; T63-I118 HydrophobicContact CG2-CG2 4.19Å; T63-D120 HydrophobicContact CG2-CB 4.44Å; T63-D120 PolarHBondContact OG1-OD2 2.86Å
64	E	87.4	Confident	84.2	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-65.3	-38.5	179.2	-170.7	167.5	-170	0	0	112.6	T60 T61 L62 L67 Y68 I73 H77 A87	T60-E64 WeakPolarHBondContact O-CB 3.4Å; T60-E64 PolarHBondContact O-N 2.93Å; T61-E64 PolarHBondContact O-N 3.01Å; L62-E64 VanDerWaalsContact C-N 3.3Å; L62-E64 PolarHBondContact O-N 2.94Å; E64-L67 PolarHBondContact O-N 3.32Å; E64-Y68 PolarHBondContact O-N 3.42Å; E64-I73 HydrophobicContact CG-CD1 4.49Å; E64-H77 VanDerWaalsContact CD-O 3.3Å; E64-H77 PolarHBondContact OE1-N 3.04Å; E64-A87 VanDerWaalsContact OE2-CB 3.25Å; E64-A87 WeakPolarHBondContact OE2-CB 2.98Å
65	R	88.1	Confident	83.4	Confident	8 Å²	8	33.7 Å²	33.7	3%	0.03	19%	0.192	C	C	.	.	H	α-helix	trans	-66.6	-37.2	173.7	-60.9	-43.9	156.7	125.8	-13.2	112.3	T61 L62 T63 Y68 Y69 M76 A319 N322 V325	T61-R65 WeakPolarHBondContact O-CG 3.31Å; T61-R65 PolarHBondContact O-N 2.78Å; L62-R65 PolarHBondContact O-N 2.79Å; T63-R65 PolarHBondContact O-N 2.59Å; R65-Y68 PolarHBondContact O-N 2.9Å; R65-Y69 HydrophobicContact CB-CD2 4.47Å; R65-Y69 HydrophobicContact CB-CE2 4.17Å; R65-Y69 WeakPolarHBondContact O-CD2 3.21Å; R65-Y69 PolarHBondContact O-N 3.44Å; R65-M76 WeakPolarHBondContact CD-SD 3.23Å; R65-M76 PolarHBondContact NE-SD 3.37Å; R65-M76 PolarHBondContact NH1-SD 2.78Å; R65-A319 WeakPolarHBondContact CG-O 3.16Å; R65-N322 VanDerWaalsContact CD-OD1 3.3Å; R65-N322 WeakPolarHBondContact CD-OD1 3.36Å; R65-N322 VanDerWaalsContact NH1-CG 3.26Å; R65-N322 PolarHBondContact NH1-ND2 3.14Å; R65-N322 PolarHBondContact NH1-OD1 2.62Å; R65-V325 HydrophobicContact CB-CG1 4.33Å; R65-V325 HydrophobicContact CB-CG2 4.2Å
66	V	89.4	Confident	82.8	Confident	5 Å²	5	32.8 Å²	32.8	3%	0.03	19%	0.187	C	C	.	.	H	α-helix	trans	-60.6	-46.4	173.2	168.8	0	0	0	0	111	L62 T63 Y68 Y69 T70 T109 I118 V325 L329	L62-V66 WeakPolarHBondContact O-CG2 3.49Å; L62-V66 PolarHBondContact O-N 3.37Å; T63-V66 WeakPolarHBondContact O-CB 3.29Å; T63-V66 PolarHBondContact O-N 2.81Å; V66-Y68 VanDerWaalsContact C-N 3.31Å; V66-Y68 PolarHBondContact O-N 3.43Å; V66-Y69 PolarHBondContact O-N 3.15Å; V66-T70 WeakPolarHBondContact O-CB 3.44Å; V66-T70 VanDerWaalsContact O-CG2 3.29Å; V66-T70 WeakPolarHBondContact O-CG2 3.23Å; V66-T70 PolarHBondContact O-N 3.01Å; V66-T70 VanDerWaalsContact O-N 3.09Å; V66-T70 PolarHBondContact O-OG1 3.28Å; V66-T109 HydrophobicContact CG1-CG2 4.32Å; V66-I118 HydrophobicContact CB-CD1 4.44Å; V66-I118 HydrophobicContact CG1-CD1 3.56Å; V66-V325 HydrophobicContact CG2-CG1 3.81Å; V66-L329 HydrophobicContact CB-CD2 4.38Å; V66-L329 HydrophobicContact CG1-CD1 4.32Å; V66-L329 HydrophobicContact CG1-CD2 3.68Å; V66-L329 HydrophobicContact CG2-CD1 4.38Å; V66-L329 HydrophobicContact CG2-CD2 3.85Å; V66-L329 HydrophobicContact CG2-CG 4.25Å
67	L	87.2	Confident	82.5	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-65.3	-33.1	178.5	-69.4	-179.4	0	0	0	113.2	T63 E64 T70 R72 I73 M89 T107	T63-L67 WeakPolarHBondContact O-CG 3.16Å; T63-L67 PolarHBondContact O-N 3.01Å; E64-L67 PolarHBondContact O-N 3.32Å; L67-T70 WeakPolarHBondContact CA-OG1 3.37Å; L67-T70 PolarHBondContact O-OG1 2.95Å; L67-R72 HydrophobicContact CD2-CB 4.5Å; L67-R72 PolarHBondContact O-N 3.25Å; L67-I73 HydrophobicContact CB-CB 4.46Å; L67-I73 HydrophobicContact CB-CD1 3.57Å; L67-I73 HydrophobicContact CB-CG1 3.89Å; L67-I73 HydrophobicContact CD1-CD1 3.66Å; L67-I73 HydrophobicContact CD1-CG1 4.45Å; L67-I73 HydrophobicContact CG-CD1 4.28Å; L67-I73 PolarHBondContact O-N 3.43Å; L67-I73 VanDerWaalsContact O-N 3.16Å; L67-M89 HydrophobicContact CD1-SD 3.74Å; L67-T107 HydrophobicContact CD1-CG2 4.27Å; L67-T107 HydrophobicContact CD2-CG2 4Å
68	Y	85.7	Confident	81.9	Confident	40 Å²	40	33.6 Å²	33.6	16%	0.157	19%	0.187	C	C	.	.	H	α-helix	trans	-68.7	-49.9	173.7	-180	-88.4	0	0	0	112.2	E64 R65 V66 T70 G71 I73 M76	E64-Y68 PolarHBondContact O-N 3.42Å; R65-Y68 PolarHBondContact O-N 2.9Å; V66-Y68 VanDerWaalsContact C-N 3.31Å; V66-Y68 PolarHBondContact O-N 3.43Å; Y68-T70 PolarHBondContact O-N 2.98Å; Y68-G71 WeakPolarHBondContact O-CA 3.46Å; Y68-G71 PolarHBondContact O-N 2.97Å; Y68-I73 WeakPolarHBondContact CD2-O 3.46Å; Y68-M76 HydrophobicContact CD1-CE 3.02Å; Y68-M76 HydrophobicContact CD2-CE 3.79Å; Y68-M76 HydrophobicContact CD2-CG 3.56Å; Y68-M76 HydrophobicContact CD2-SD 4.41Å; Y68-M76 HydrophobicContact CE1-CE 3.44Å; Y68-M76 VanDerWaalsContact CE1-CE 3.44Å; Y68-M76 HydrophobicContact CE2-CE 4.14Å; Y68-M76 HydrophobicContact CE2-CG 4.13Å; Y68-M76 HydrophobicContact CG-CE 3.19Å; Y68-M76 HydrophobicContact CG-CG 3.78Å; Y68-M76 HydrophobicContact CG-SD 4.27Å
69	Y	83.8	Confident	80.9	Confident	13 Å²	13	34.4 Å²	34.4	5%	0.051	19%	0.19	C	C	.	.	H	α-helix	trans	-66.7	-26.5	-177.1	-69.7	-45.1	0	0	0	113.6	R65 V66 G71 M76 Q250 N322 V325 Q326	R65-Y69 HydrophobicContact CB-CD2 4.47Å; R65-Y69 HydrophobicContact CB-CE2 4.17Å; R65-Y69 WeakPolarHBondContact O-CD2 3.21Å; R65-Y69 PolarHBondContact O-N 3.44Å; V66-Y69 PolarHBondContact O-N 3.15Å; Y69-G71 PolarHBondContact O-N 2.9Å; Y69-M76 HydrophobicContact CE1-CE 4.47Å; Y69-Q250 HydrophobicContact CE1-CB 4.45Å; Y69-Q250 PolarHBondContact OH-OE1 3.3Å; Y69-Q250 VanDerWaalsContact OH-OE1 3.14Å; Y69-N322 WeakPolarHBondContact OH-CB 3.4Å; Y69-N322 PolarHBondContact OH-OD1 2.89Å; Y69-V325 HydrophobicContact CD2-CB 4.09Å; Y69-V325 HydrophobicContact CD2-CG1 3.86Å; Y69-V325 HydrophobicContact CE2-CB 3.79Å; Y69-V325 HydrophobicContact CE2-CG1 4.02Å; Y69-V325 HydrophobicContact CE2-CG2 4.22Å; Y69-Q326 HydrophobicContact CD2-CG 4.46Å
70	T	82.6	Confident	79.8	Confident	23 Å²	23	41.2 Å²	41.2	14%	0.141	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	2.6	173.6	53.5	0	0	0	0	113.2	V66 L67 Y68 R72 T109 W111	V66-T70 WeakPolarHBondContact O-CB 3.44Å; V66-T70 VanDerWaalsContact O-CG2 3.29Å; V66-T70 WeakPolarHBondContact O-CG2 3.23Å; V66-T70 PolarHBondContact O-N 3.01Å; V66-T70 VanDerWaalsContact O-N 3.09Å; V66-T70 PolarHBondContact O-OG1 3.28Å; L67-T70 WeakPolarHBondContact CA-OG1 3.37Å; L67-T70 PolarHBondContact O-OG1 2.95Å; Y68-T70 PolarHBondContact O-N 2.98Å; T70-R72 VanDerWaalsContact C-N 3.32Å; T70-R72 PolarHBondContact O-N 2.64Å; T70-T109 WeakPolarHBondContact CB-OG1 3.43Å; T70-T109 HydrophobicContact CG2-CG2 3.85Å; T70-T109 WeakPolarHBondContact CG2-OG1 3.23Å; T70-T109 PolarHBondContact OG1-OG1 3.44Å; T70-W111 HydrophobicContact CG2-CB 4.2Å; T70-W111 HydrophobicContact CG2-CD2 4.43Å; T70-W111 HydrophobicContact CG2-CE3 3.79Å
71	G	74.6	Confident	78.7	Confident	44 Å²	44	41.4 Å²	41.4	45%	0.454	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	10.2	174.2	0	0	0	0	0	115	Y68 Y69	Y68-G71 WeakPolarHBondContact O-CA 3.46Å; Y68-G71 PolarHBondContact O-N 2.97Å; Y69-G71 PolarHBondContact O-N 2.9Å
72	R	75.9	Confident	77.4	Confident	88 Å²	88	50.2 Å²	50.2	33%	0.332	26%	0.261	S	S	.	.	S	Bend	trans	-80.7	-36.5	179.6	-70.3	-67.3	-178.5	161.2	0.6	112.7	L67 T70 Y108 T109	L67-R72 HydrophobicContact CD2-CB 4.5Å; L67-R72 PolarHBondContact O-N 3.25Å; T70-R72 VanDerWaalsContact C-N 3.32Å; T70-R72 PolarHBondContact O-N 2.64Å; R72-Y108 PolarHBondContact NH1-OH 2.93Å; R72-Y108 PolarHBondContact NH2-OH 2.99Å; R72-Y108 VanDerWaalsContact NH2-OH 3.16Å; R72-T109 WeakPolarHBondContact CG-OG1 3.23Å
73	I	75.4	Confident	76	Confident	18 Å²	18	55.9 Å²	55.9	9%	0.092	29%	0.291	C	S	.	.			trans	-108.4	131.6	176.2	-65.8	178	0	0	0	109.7	E64 L67 Y68 Q75 V88	E64-I73 HydrophobicContact CG-CD1 4.49Å; L67-I73 HydrophobicContact CB-CB 4.46Å; L67-I73 HydrophobicContact CB-CD1 3.57Å; L67-I73 HydrophobicContact CB-CG1 3.89Å; L67-I73 HydrophobicContact CD1-CD1 3.66Å; L67-I73 HydrophobicContact CD1-CG1 4.45Å; L67-I73 HydrophobicContact CG-CD1 4.28Å; L67-I73 PolarHBondContact O-N 3.43Å; L67-I73 VanDerWaalsContact O-N 3.16Å; Y68-I73 WeakPolarHBondContact CD2-O 3.46Å; I73-Q75 WeakPolarHBondContact CG2-O 3.33Å; I73-V88 HydrophobicContact CD1-CB 4.01Å; I73-V88 HydrophobicContact CD1-CG1 4.38Å; I73-V88 HydrophobicContact CD1-CG2 3.9Å
74	A	66.2	Low	74.6	Confident	92 Å²	92	59.3 Å²	59.3	76%	0.76	33%	0.326	S	S	*	.	S	Bend	trans	-85.2	-26	179.9	0	0	0	0	0	113.9
75	Q	68.8	Low	73.7	Confident	138 Å²	138	62.6 Å²	62.6	65%	0.645	35%	0.346	S	S	*	.	S	Bend	trans	-139.8	129.8	-178.4	-71.1	-178.2	-13.3	0	0	110.7	I73 H77	I73-Q75 WeakPolarHBondContact CG2-O 3.33Å; Q75-H77 PolarHBondContact O-ND1 2.86Å
76	M	71.4	Confident	72.5	Confident	31 Å²	31	62.8 Å²	62.8	15%	0.153	35%	0.351	C	S	.	.			trans	-84.4	140.1	176.5	-54.8	169	177.4	0	0	109.9	R65 Y68 Y69 F229	R65-M76 WeakPolarHBondContact CD-SD 3.23Å; R65-M76 PolarHBondContact NE-SD 3.37Å; R65-M76 PolarHBondContact NH1-SD 2.78Å; Y68-M76 HydrophobicContact CD1-CE 3.02Å; Y68-M76 HydrophobicContact CD2-CE 3.79Å; Y68-M76 HydrophobicContact CD2-CG 3.56Å; Y68-M76 HydrophobicContact CD2-SD 4.41Å; Y68-M76 HydrophobicContact CE1-CE 3.44Å; Y68-M76 VanDerWaalsContact CE1-CE 3.44Å; Y68-M76 HydrophobicContact CE2-CE 4.14Å; Y68-M76 HydrophobicContact CE2-CG 4.13Å; Y68-M76 HydrophobicContact CG-CE 3.19Å; Y68-M76 HydrophobicContact CG-CG 3.78Å; Y68-M76 HydrophobicContact CG-SD 4.27Å; Y69-M76 HydrophobicContact CE1-CE 4.47Å; M76-F229 HydrophobicContact SD-CD1 4.35Å; M76-F229 HydrophobicContact SD-CE1 4.08Å
77	H	76.1	Confident	71.6	Confident	36 Å²	36	62.6 Å²	62.6	17%	0.167	35%	0.35	C	S	.	.			trans	-119.1	167.5	170.7	-61.8	83.5	0	0	0	109.8	E64 Q75 G86	E64-H77 VanDerWaalsContact CD-O 3.3Å; E64-H77 PolarHBondContact OE1-N 3.04Å; Q75-H77 PolarHBondContact O-ND1 2.86Å; H77-G86 WeakPolarHBondContact CB-O 3.38Å
78	E	73	Confident	70.9	Confident	99 Å²	99	65 Å²	65	46%	0.463	36%	0.364	S	S	.	.			trans	-106.3	144.7	172.1	-68.9	-173.9	173.5	0	0	109.9	K80 G81 L320	E78-K80 PolarHBondContact O-N 3.33Å; E78-K80 VanDerWaalsContact O-N 3.15Å; E78-G81 PolarHBondContact O-N 3.16Å; E78-L320 WeakPolarHBondContact OE1-CD1 3.3Å
79	V	64.3	Low	70.4	Confident	26 Å²	26	63.2 Å²	63.2	16%	0.158	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-34	-178.2	179.4	0	0	0	0	112.3	T60 A87 D90	T60-V79 HydrophobicContact CG2-CG2 4.01Å; V79-A87 HydrophobicContact CG2-CB 3.88Å; V79-D90 WeakPolarHBondContact CG1-OD2 3.46Å
80	K	66.5	Low	70	Confident	154 Å²	154	62.7 Å²	62.7	67%	0.67	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.5	42.7	171.6	-67.1	-171.1	-178.7	-179.4	0	112	E78 R98	E78-K80 PolarHBondContact O-N 3.33Å; E78-K80 VanDerWaalsContact O-N 3.15Å; K80-R98 WeakPolarHBondContact CE-O 3.39Å; K80-R98 PolarHBondContact NZ-O 3Å
81	G	64.6	Low	69.5	Low	21 Å²	21	63.9 Å²	63.9	22%	0.216	36%	0.364	C	S	.	.			trans	-67.4	155.9	176.8	0	0	0	0	0	112.5	E78 D83 G84	E78-G81 PolarHBondContact O-N 3.16Å; G81-D83 PolarHBondContact O-N 2.8Å; G81-D83 VanDerWaalsContact O-N 3.11Å; G81-G84 PolarHBondContact O-N 3.03Å
82	K	63.7	Low	69.7	Low	217 Å²	217	63.6 Å²	63.6	94%	0.943	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-13.9	173.2	-68.3	-176.6	179.9	178.5	0	113.2	G84	K82-G84 VanDerWaalsContact C-N 3.31Å; K82-G84 PolarHBondContact O-N 2.81Å
83	D	60.9	Low	69.8	Low	119 Å²	119	64.8 Å²	64.8	64%	0.636	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-13.3	-173.1	-48.9	-30.9	0	0	0	112.8	G81 V85	G81-D83 PolarHBondContact O-N 2.8Å; G81-D83 VanDerWaalsContact O-N 3.11Å; D83-V85 PolarHBondContact O-N 2.82Å
84	G	61.3	Low	70.2	Confident	72 Å²	72	64.4 Å²	64.4	74%	0.742	36%	0.359	S	S	*	.	S	Bend	trans	68.8	-3.6	175.3	0	0	0	0	0	116	G81 K82	G81-G84 PolarHBondContact O-N 3.03Å; K82-G84 VanDerWaalsContact C-N 3.31Å; K82-G84 PolarHBondContact O-N 2.81Å
85	V	68.6	Low	71	Confident	71 Å²	71	60.2 Å²	60.2	43%	0.43	32%	0.324	S	S	.	.			trans	-75.4	-40.2	179.9	-177.7	0	0	0	0	111.7	D83 R96	D83-V85 PolarHBondContact O-N 2.82Å; V85-R96 PolarHBondContact O-NH1 3.4Å
86	G	63.4	Low	71.6	Confident	12 Å²	12	58.2 Å²	58.2	12%	0.124	31%	0.31	C	S	.	.			trans	76.9	169.5	-176	0	0	0	0	0	113.5	H77	H77-G86 WeakPolarHBondContact CB-O 3.38Å
87	A	69.9	Low	72.1	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.008	33%	0.327	C	S	.	.			trans	-69.2	147.2	176.3	0	0	0	0	0	111.2	T60 E64 V79 M89 D90	T60-A87 HydrophobicContact CG2-CB 3.96Å; E64-A87 VanDerWaalsContact OE2-CB 3.25Å; E64-A87 WeakPolarHBondContact OE2-CB 2.98Å; V79-A87 HydrophobicContact CG2-CB 3.88Å; A87-M89 PolarHBondContact O-N 2.96Å; A87-D90 PolarHBondContact O-N 2.86Å
88	V	73.1	Confident	72.3	Confident	49 Å²	49	62.9 Å²	62.9	30%	0.297	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-28.9	-179.2	177.2	0	0	0	0	112.6	I73 A422	I73-V88 HydrophobicContact CD1-CB 4.01Å; I73-V88 HydrophobicContact CD1-CG1 4.38Å; I73-V88 HydrophobicContact CD1-CG2 3.9Å; V88-A422 HydrophobicContact CG1-CB 4.11Å
89	M	74.1	Confident	72.6	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.02	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-24.8	-178	-61.5	-55.6	-71.3	0	0	113.3	T60 T63 L67 A87 S91 A105 T107 D120 A422	T60-M89 HydrophobicContact CG2-CB 3.9Å; T63-M89 HydrophobicContact CG2-CE 3.82Å; T63-M89 HydrophobicContact CG2-CG 3.91Å; T63-M89 HydrophobicContact CG2-SD 4.07Å; L67-M89 HydrophobicContact CD1-SD 3.74Å; A87-M89 PolarHBondContact O-N 2.96Å; M89-S91 PolarHBondContact O-N 3.43Å; M89-A105 HydrophobicContact CE-CB 3.49Å; M89-A105 VanDerWaalsContact CE-CB 3.49Å; M89-T107 HydrophobicContact CE-CG2 3.83Å; M89-T107 HydrophobicContact SD-CG2 4.26Å; M89-D120 HydrophobicContact CE-CB 4.04Å; M89-A422 HydrophobicContact SD-CB 4.5Å
90	D	76.5	Confident	73.5	Confident	1 Å²	1	59 Å²	59	1%	0.005	31%	0.313	C	S	.	.			trans	-95.2	80.2	177.3	-67.3	-24.7	0	0	0	108.4	V79 A87 E95 R96 T101	V79-D90 WeakPolarHBondContact CG1-OD2 3.46Å; A87-D90 PolarHBondContact O-N 2.86Å; D90-E95 WeakPolarHBondContact CA-OE2 3.44Å; D90-E95 HydrophobicContact CB-CB 3.81Å; D90-R96 HydrophobicContact CB-CG 4.46Å; D90-R96 VanDerWaalsContact O-CG 3.23Å; D90-R96 WeakPolarHBondContact O-CG 3.1Å; D90-R96 PolarHBondContact O-NE 3.16Å; D90-T101 PolarHBondContact OD1-OG1 3.39Å
91	S	71.5	Confident	74.3	Confident	48 Å²	48	52.1 Å²	52.1	34%	0.336	28%	0.284	S	S	.	.			trans	-81.3	-24.2	-174.3	65.3	0	0	0	0	113.4	M89 E95 D423	M89-S91 PolarHBondContact O-N 3.43Å; S91-E95 PolarHBondContact N-OE2 3.02Å; S91-D423 VanDerWaalsContact CB-CG 3.42Å; S91-D423 WeakPolarHBondContact CB-OD1 3.29Å; S91-D423 WeakPolarHBondContact CB-OD2 3.3Å; S91-D423 PolarHBondContact OG-OD1 2.82Å; S91-D423 VanDerWaalsContact OG-OD1 3.09Å
92	M	77.6	Confident	75.2	Confident	38 Å²	38	51.3 Å²	51.3	19%	0.187	28%	0.275	C	S	.	.	S	Bend	trans	-73.4	140.9	177.4	-62.2	-168.3	159.3	0	0	111.5	L94 E95 R96 Q103	M92-L94 PolarHBondContact O-N 3.19Å; M92-E95 HydrophobicContact CB-CB 4.19Å; M92-E95 HydrophobicContact CB-CG 3.81Å; M92-E95 WeakPolarHBondContact CB-OE2 3.34Å; M92-E95 HydrophobicContact CG-CG 4.46Å; M92-E95 PolarHBondContact N-OE2 3.43Å; M92-E95 WeakPolarHBondContact O-CB 3.25Å; M92-E95 PolarHBondContact O-N 2.89Å; M92-E95 VanDerWaalsContact O-N 3.1Å; M92-R96 PolarHBondContact O-N 2.85Å; M92-R96 VanDerWaalsContact O-N 3.11Å; M92-Q103 HydrophobicContact CE-CG 3.93Å; M92-Q103 HydrophobicContact SD-CG 4.28Å
93	E	79.8	Confident	76.1	Confident	113 Å²	113	41.7 Å²	41.7	53%	0.528	23%	0.233	S	C	.	.	H	α-helix	trans	-59.7	-36.7	177.5	-164.7	-165.7	176.7	0	0	112.1	R96 Q97 R529	E93-R96 PolarHBondContact O-N 3.13Å; E93-Q97 WeakPolarHBondContact O-CB 3.48Å; E93-Q97 WeakPolarHBondContact O-CG 3.43Å; E93-Q97 PolarHBondContact O-N 2.89Å; E93-Q97 PolarHBondContact OE1-NE2 2.81Å; E93-Q97 VanDerWaalsContact OE1-NE2 3.13Å; E93-R529 IonicContact OE1-NH1 3.56Å; E93-R529 PolarHBondContact OE1-NH1 3.4Å; E93-R529 IonicContact OE2-CZ 2.94Å; E93-R529 IonicContact OE2-NH1 2.99Å; E93-R529 PolarHBondContact OE2-NH1 3.42Å
94	L	83.4	Confident	77.2	Confident	10 Å²	10	36.2 Å²	36.2	5%	0.052	20%	0.204	C	C	.	.	H	α-helix	trans	-67	-36.4	177.1	-69.4	174.1	0	0	0	112.3	M92 Q97 R98 I102 I522 Q525 R526	M92-L94 PolarHBondContact O-N 3.19Å; L94-Q97 PolarHBondContact O-N 2.98Å; L94-R98 WeakPolarHBondContact O-CB 3.24Å; L94-R98 PolarHBondContact O-N 3.07Å; L94-I102 HydrophobicContact CB-CD1 4.21Å; L94-I522 HydrophobicContact CD1-CG2 4.41Å; L94-Q525 HydrophobicContact CD1-CB 4.12Å; L94-Q525 HydrophobicContact CD2-CB 4.22Å; L94-R526 HydrophobicContact CD1-CG 3.66Å
95	E	82.6	Confident	78.1	Confident	4 Å²	4	33.5 Å²	33.5	2%	0.019	17%	0.174	C	C	.	.	H	α-helix	trans	-65.2	-45.1	175.9	-67.6	175.5	149.2	0	0	110.2	D90 S91 M92 Q97 G99 I100 I102 Q103	D90-E95 WeakPolarHBondContact CA-OE2 3.44Å; D90-E95 HydrophobicContact CB-CB 3.81Å; S91-E95 PolarHBondContact N-OE2 3.02Å; M92-E95 HydrophobicContact CB-CB 4.19Å; M92-E95 HydrophobicContact CB-CG 3.81Å; M92-E95 WeakPolarHBondContact CB-OE2 3.34Å; M92-E95 HydrophobicContact CG-CG 4.46Å; M92-E95 PolarHBondContact N-OE2 3.43Å; M92-E95 WeakPolarHBondContact O-CB 3.25Å; M92-E95 PolarHBondContact O-N 2.89Å; M92-E95 VanDerWaalsContact O-N 3.1Å; E95-Q97 PolarHBondContact O-N 3.17Å; E95-G99 WeakPolarHBondContact O-CA 3.1Å; E95-G99 PolarHBondContact O-N 3.19Å; E95-I100 VanDerWaalsContact CA-O 3.31Å; E95-I100 WeakPolarHBondContact CA-O 3.3Å; E95-I100 VanDerWaalsContact CB-O 3.27Å; E95-I100 WeakPolarHBondContact CB-O 3.45Å; E95-I100 WeakPolarHBondContact CG-O 3.45Å; E95-I100 PolarHBondContact O-N 3.5Å; E95-I102 HydrophobicContact CG-CB 3.86Å; E95-I102 HydrophobicContact CG-CD1 3.8Å; E95-I102 HydrophobicContact CG-CG1 3.88Å; E95-I102 WeakPolarHBondContact OE1-CA 3.48Å; E95-I102 WeakPolarHBondContact OE1-CB 3.47Å; E95-I102 PolarHBondContact OE1-N 3.05Å; E95-Q103 PolarHBondContact OE1-N 3.37Å
96	R	82	Confident	78.9	Confident	97 Å²	97	30.7 Å²	30.7	37%	0.366	16%	0.159	S	C	.	.	H	α-helix	trans	-63.8	-40.3	176.7	-63.3	-175.6	-172	-170	8	113	V85 D90 M92 E93	V85-R96 PolarHBondContact O-NH1 3.4Å; D90-R96 HydrophobicContact CB-CG 4.46Å; D90-R96 VanDerWaalsContact O-CG 3.23Å; D90-R96 WeakPolarHBondContact O-CG 3.1Å; D90-R96 PolarHBondContact O-NE 3.16Å; M92-R96 PolarHBondContact O-N 2.85Å; M92-R96 VanDerWaalsContact O-N 3.11Å; E93-R96 PolarHBondContact O-N 3.13Å
97	Q	81.6	Confident	79.9	Confident	105 Å²	105	30.3 Å²	30.3	49%	0.491	15%	0.154	S	C	.	.	H	α-helix	trans	-69.9	-44.5	179.7	-75.1	179.2	0.4	0	0	112.5	E93 L94 E95 R529	E93-Q97 WeakPolarHBondContact O-CB 3.48Å; E93-Q97 WeakPolarHBondContact O-CG 3.43Å; E93-Q97 PolarHBondContact O-N 2.89Å; E93-Q97 PolarHBondContact OE1-NE2 2.81Å; E93-Q97 VanDerWaalsContact OE1-NE2 3.13Å; L94-Q97 PolarHBondContact O-N 2.98Å; E95-Q97 PolarHBondContact O-N 3.17Å; Q97-R529 VanDerWaalsContact NE2-NH1 3.2Å; Q97-R529 VanDerWaalsContact OE1-NH1 3.1Å
98	R	80	Confident	80.7	Confident	60 Å²	60	31.2 Å²	31.2	23%	0.226	16%	0.157	C	C	.	.	H	α-helix	trans	-82.5	-22.2	-179.7	-65.5	-168.9	-176.6	-133.4	-1.3	112.3	K80 L94 I100 E521	K80-R98 WeakPolarHBondContact CE-O 3.39Å; K80-R98 PolarHBondContact NZ-O 3Å; L94-R98 WeakPolarHBondContact O-CB 3.24Å; L94-R98 PolarHBondContact O-N 3.07Å; R98-I100 HydrophobicContact CB-CD1 4.31Å; R98-I100 HydrophobicContact CB-CG1 3.83Å; R98-E521 IonicContact CZ-OE1 3.37Å; R98-E521 IonicContact CZ-OE2 3.95Å; R98-E521 IonicContact NH1-OE1 3.72Å; R98-E521 IonicContact NH1-OE2 2.67Å; R98-E521 PolarHBondContact NH1-OE2 2.7Å; R98-E521 IonicContact NH2-OE1 3.87Å; R98-E521 PolarHBondContact NH2-OE1 2.83Å; R98-E521 IonicContact NH2-OE2 3.57Å; R98-E521 PolarHBondContact NH2-OE2 3.15Å
99	G	79.3	Confident	81.4	Confident	11 Å²	11	28.9 Å²	28.9	11%	0.113	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.4	39.9	-173.1	0	0	0	0	0	112.9	E95	E95-G99 WeakPolarHBondContact O-CA 3.1Å; E95-G99 PolarHBondContact O-N 3.19Å
100	I	83.1	Confident	82	Confident	32 Å²	32	32.2 Å²	32.2	16%	0.164	16%	0.16	C	C	.	.			trans	-130.4	142.6	175.1	59.9	171.3	0	0	0	108.6	E95 R98 I102 L518 I522	E95-I100 VanDerWaalsContact CA-O 3.31Å; E95-I100 WeakPolarHBondContact CA-O 3.3Å; E95-I100 VanDerWaalsContact CB-O 3.27Å; E95-I100 WeakPolarHBondContact CB-O 3.45Å; E95-I100 WeakPolarHBondContact CG-O 3.45Å; E95-I100 PolarHBondContact O-N 3.5Å; R98-I100 HydrophobicContact CB-CD1 4.31Å; R98-I100 HydrophobicContact CB-CG1 3.83Å; I100-I102 HydrophobicContact CD1-CG1 4.35Å; I100-I102 HydrophobicContact CG1-CG1 4.27Å; I100-L518 HydrophobicContact CD1-CD2 4.17Å; I100-I522 HydrophobicContact CD1-CD1 4.38Å
101	T	83.1	Confident	82.6	Confident	9 Å²	9	34.2 Å²	34.2	6%	0.055	17%	0.167	C	C	.	.			trans	-78.5	127.8	170.3	-51.5	0	0	0	0	108.8	T60 D90 Q103 P122	T60-T101 PolarHBondContact OG1-OG1 3.44Å; D90-T101 PolarHBondContact OD1-OG1 3.39Å; T101-Q103 VanDerWaalsContact CG2-O 3.29Å; T101-Q103 WeakPolarHBondContact CG2-O 3.32Å; T101-P122 WeakPolarHBondContact O-CB 3.32Å
102	I	82.6	Confident	83.3	Confident	4 Å²	4	36.4 Å²	36.4	2%	0.021	17%	0.171	C	C	.	.			trans	-106.3	-51.2	-177.3	-69.5	166	0	0	0	109.2	L94 E95 I100 F127 I522	L94-I102 HydrophobicContact CB-CD1 4.21Å; E95-I102 HydrophobicContact CG-CB 3.86Å; E95-I102 HydrophobicContact CG-CD1 3.8Å; E95-I102 HydrophobicContact CG-CG1 3.88Å; E95-I102 WeakPolarHBondContact OE1-CA 3.48Å; E95-I102 WeakPolarHBondContact OE1-CB 3.47Å; E95-I102 PolarHBondContact OE1-N 3.05Å; I100-I102 HydrophobicContact CD1-CG1 4.35Å; I100-I102 HydrophobicContact CG1-CG1 4.27Å; I102-F127 HydrophobicContact CB-CE2 4.46Å; I102-F127 HydrophobicContact CB-CZ 4.36Å; I102-F127 HydrophobicContact CG1-CE2 4.06Å; I102-F127 HydrophobicContact CG1-CZ 4.16Å; I102-F127 HydrophobicContact CG2-CD1 4.16Å; I102-F127 HydrophobicContact CG2-CE1 3.61Å; I102-F127 HydrophobicContact CG2-CE2 4.21Å; I102-F127 HydrophobicContact CG2-CZ 3.66Å; I102-I522 HydrophobicContact CD1-CD1 3.84Å; I102-I522 HydrophobicContact CD1-CG1 4.43Å; I102-I522 HydrophobicContact CD1-CG2 3.97Å; I102-I522 HydrophobicContact CG1-CD1 4.17Å; I102-I522 HydrophobicContact CG2-CG2 4.38Å
103	Q	84.1	Confident	83.7	Confident	15 Å²	15	40.4 Å²	40.4	7%	0.07	19%	0.193	C	C	.	.	S	Bend	trans	-101.6	148.3	176.4	-70.2	-167.6	-16.5	0	0	111.3	M92 E95 T101 A105 E495	M92-Q103 HydrophobicContact CE-CG 3.93Å; M92-Q103 HydrophobicContact SD-CG 4.28Å; E95-Q103 PolarHBondContact OE1-N 3.37Å; T101-Q103 VanDerWaalsContact CG2-O 3.29Å; T101-Q103 WeakPolarHBondContact CG2-O 3.32Å; Q103-A105 PolarHBondContact O-N 3.01Å; Q103-E495 PolarHBondContact NE2-OE1 2.97Å
104	S	82.5	Confident	84.2	Confident	5 Å²	5	35.8 Å²	35.8	4%	0.035	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-69.1	122.3	175.8	-52	0	0	0	0	111.1	D120 E130 K378	S104-D120 CarbonylContact C-O 3.56Å; S104-D120 WeakPolarHBondContact CA-O 3.17Å; S104-E130 WeakPolarHBondContact CB-OE2 3.39Å; S104-E130 PolarHBondContact N-OE2 2.86Å; S104-E130 WeakPolarHBondContact OG-CB 3.44Å; S104-E130 PolarHBondContact OG-O 3.1Å; S104-E130 PolarHBondContact OG-OE2 3Å; S104-K378 VanDerWaalsContact O-CE 3.26Å; S104-K378 WeakPolarHBondContact O-CE 3.37Å; S104-K378 PolarHBondContact O-NZ 3.49Å
105	A	81.9	Confident	84.6	Confident	14 Å²	14	35.5 Å²	35.5	12%	0.116	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	124.2	178.8	0	0	0	0	0	110.3	M89 Q103 I119 D120	M89-A105 HydrophobicContact CE-CB 3.49Å; M89-A105 VanDerWaalsContact CE-CB 3.49Å; Q103-A105 PolarHBondContact O-N 3.01Å; A105-I119 WeakPolarHBondContact O-CA 3.47Å; A105-D120 PolarHBondContact N-O 3.37Å; A105-D120 VanDerWaalsContact N-O 3.08Å; A105-D120 PolarHBondContact O-N 3.39Å
106	A	84.1	Confident	85	Confident	12 Å²	12	35.3 Å²	35.3	10%	0.099	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	130.8	176.8	0	0	0	0	0	110.3	I119 Y389 A422	A106-I119 HydrophobicContact CB-CG1 4.5Å; A106-Y389 HydrophobicContact CB-CD1 4.33Å; A106-Y389 HydrophobicContact CB-CE1 4Å; A106-A422 PolarHBondContact O-N 2.79Å
107	T	84.5	Confident	85.5	Confident	5 Å²	5	31.4 Å²	31.4	3%	0.031	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	162.7	176.3	-167.5	0	0	0	0	110	L67 M89 I118 H421	L67-T107 HydrophobicContact CD1-CG2 4.27Å; L67-T107 HydrophobicContact CD2-CG2 4Å; M89-T107 HydrophobicContact CE-CG2 3.83Å; M89-T107 HydrophobicContact SD-CG2 4.26Å; T107-I118 HydrophobicContact CG2-CB 3.85Å; T107-I118 PolarHBondContact N-O 3.15Å; T107-I118 PolarHBondContact O-N 2.98Å; T107-I118 VanDerWaalsContact O-O 3.11Å; T107-H421 PolarHBondContact OG1-CE1 2.89Å; T107-H421 PolarHBondContact OG1-ND1 3.21Å
108	Y	86.4	Confident	86	Confident	19 Å²	19	26.5 Å²	26.5	8%	0.075	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	149.8	175.6	86.1	-85.9	0	0	0	110	R72 I116 N117 H421 E426	R72-Y108 PolarHBondContact NH1-OH 2.93Å; R72-Y108 PolarHBondContact NH2-OH 2.99Å; R72-Y108 VanDerWaalsContact NH2-OH 3.16Å; Y108-I116 CarbonylContact C-O 3.59Å; Y108-I116 WeakPolarHBondContact CA-O 3.39Å; Y108-N117 WeakPolarHBondContact CB-OD1 3.4Å; Y108-H421 HydrophobicContact CD1-CB 4.33Å; Y108-H421 HydrophobicContact CE1-CB 4.21Å; Y108-H421 PolarHBondContact O-ND1 3.31Å; Y108-E426 PolarHBondContact OH-OE2 2.94Å
109	T	87.9	Confident	86.5	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	165.1	177.9	-164.9	0	0	0	0	112.5	V66 T70 R72 N115 I116 I118	V66-T109 HydrophobicContact CG1-CG2 4.32Å; T70-T109 WeakPolarHBondContact CB-OG1 3.43Å; T70-T109 HydrophobicContact CG2-CG2 3.85Å; T70-T109 WeakPolarHBondContact CG2-OG1 3.23Å; T70-T109 PolarHBondContact OG1-OG1 3.44Å; R72-T109 WeakPolarHBondContact CG-OG1 3.23Å; T109-N115 PolarHBondContact O-OD1 3.31Å; T109-I116 HydrophobicContact CG2-CB 4.19Å; T109-I116 PolarHBondContact N-O 3.4Å; T109-I116 PolarHBondContact O-N 3.29Å; T109-I118 HydrophobicContact CG2-CD1 4.18Å
110	M	87.6	Confident	87	Confident	74 Å²	74	23.2 Å²	23.2	37%	0.365	12%	0.118	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	127.9	-180	-171.2	67.7	65.8	0	0	109.6	V114 N115	M110-V114 VanDerWaalsContact SD-O 3.33Å; M110-N115 HydrophobicContact CE-CB 3.99Å; M110-N115 HydrophobicContact SD-CB 4.36Å
111	W	88.5	Confident	87.3	Confident	44 Å²	44	21.7 Å²	21.7	17%	0.167	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	123.1	175.3	-174.6	-110	0	0	0	109.7	T70 D113 V114 I116 L329 D330	T70-W111 HydrophobicContact CG2-CB 4.2Å; T70-W111 HydrophobicContact CG2-CD2 4.43Å; T70-W111 HydrophobicContact CG2-CE3 3.79Å; W111-D113 VanDerWaalsContact C-N 3.3Å; W111-D113 PolarHBondContact O-N 3.41Å; W111-V114 PolarHBondContact N-O 2.91Å; W111-V114 WeakPolarHBondContact O-CB 2.99Å; W111-V114 PolarHBondContact O-N 3.47Å; W111-I116 HydrophobicContact CB-CD1 3.95Å; W111-L329 HydrophobicContact CD2-CD1 4.2Å; W111-L329 HydrophobicContact CE3-CD1 4.48Å; W111-D330 PolarHBondContact NE1-OD1 2.78Å
112	K	86.6	Confident	87.4	Confident	94 Å²	94	21.3 Å²	21.3	41%	0.409	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.5	49.6	179.6	-62.3	177.9	175.7	173.6	0	113.2	V114 D330 L333	K112-V114 PolarHBondContact O-N 3.25Å; K112-D330 WeakPolarHBondContact CE-OD1 3.36Å; K112-D330 IonicContact NZ-OD1 3.57Å; K112-D330 PolarHBondContact NZ-OD1 3.36Å; K112-D330 IonicContact NZ-OD2 3.17Å; K112-D330 PolarHBondContact NZ-OD2 3.13Å; K112-L333 HydrophobicContact CB-CD2 4.28Å
113	D	86.6	Confident	87.1	Confident	121 Å²	121	21.5 Å²	21.5	65%	0.647	11%	0.111	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.2	17.8	-177	-56.5	-33.6	0	0	0	116	W111	W111-D113 VanDerWaalsContact C-N 3.3Å; W111-D113 PolarHBondContact O-N 3.41Å
114	V	89.9	Confident	87	Confident	17 Å²	17	22.7 Å²	22.7	10%	0.103	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	128.4	172.6	179.6	0	0	0	0	109.8	K45 R47 M110 W111 K112 L333	K45-V114 CarbonylContact O-C 3.47Å; K45-V114 WeakPolarHBondContact O-CA 3.32Å; K45-V114 WeakPolarHBondContact O-CG1 3.47Å; R47-V114 HydrophobicContact CG-CG1 3.98Å; M110-V114 VanDerWaalsContact SD-O 3.33Å; W111-V114 PolarHBondContact N-O 2.91Å; W111-V114 WeakPolarHBondContact O-CB 2.99Å; W111-V114 PolarHBondContact O-N 3.47Å; K112-V114 PolarHBondContact O-N 3.25Å; V114-L333 HydrophobicContact CB-CD2 3.78Å; V114-L333 HydrophobicContact CB-CG 4.12Å; V114-L333 HydrophobicContact CG1-CD2 4.37Å; V114-L333 HydrophobicContact CG1-CG 4.15Å; V114-L333 HydrophobicContact CG2-CD2 3.64Å; V114-L333 HydrophobicContact CG2-CG 4.21Å
115	N	91.1	Very high	86.9	Confident	4 Å²	4	24.1 Å²	24.1	2%	0.021	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	124.6	175.9	-174.4	23.4	0	0	0	110.1	K45 I46 R47 T109 M110	K45-N115 PolarHBondContact O-N 3.39Å; I46-N115 CarbonylContact C-O 3.36Å; I46-N115 WeakPolarHBondContact CA-O 3.21Å; I46-N115 HydrophobicContact CG1-CB 4.49Å; R47-N115 PolarHBondContact N-O 3.34Å; T109-N115 PolarHBondContact O-OD1 3.31Å; M110-N115 HydrophobicContact CE-CB 3.99Å; M110-N115 HydrophobicContact SD-CB 4.36Å
116	I	91.9	Very high	87.1	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	112.7	179.6	-50.1	176.2	0	0	0	108.4	R47 I49 Y108 T109 W111 I118 L329 L333	R47-I116 HydrophobicContact CB-CG1 4.42Å; R47-I116 HydrophobicContact CB-CG2 4.39Å; R47-I116 CarbonylContact O-C 3.58Å; R47-I116 WeakPolarHBondContact O-CA 3.48Å; I49-I116 HydrophobicContact CD1-CG2 3.75Å; I49-I116 HydrophobicContact CG1-CG2 3.83Å; Y108-I116 CarbonylContact C-O 3.59Å; Y108-I116 WeakPolarHBondContact CA-O 3.39Å; T109-I116 HydrophobicContact CG2-CB 4.19Å; T109-I116 PolarHBondContact N-O 3.4Å; T109-I116 PolarHBondContact O-N 3.29Å; W111-I116 HydrophobicContact CB-CD1 3.95Å; I116-I118 HydrophobicContact CG2-CD1 4.29Å; I116-I118 HydrophobicContact CG2-CG1 3.72Å; I116-L329 HydrophobicContact CD1-CD2 4.29Å; I116-L333 HydrophobicContact CD1-CD1 3.92Å
117	N	91.9	Very high	87.2	Confident	14 Å²	14	23.2 Å²	23.2	8%	0.075	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	120.5	167.7	-59.8	-37.7	0	0	0	108	R47 N48 I49 Y108 I436	R47-N117 PolarHBondContact O-N 2.79Å; N48-N117 WeakPolarHBondContact OD1-CB 3.47Å; N48-N117 PolarHBondContact OD1-ND2 3.28Å; I49-N117 PolarHBondContact N-O 3.11Å; Y108-N117 WeakPolarHBondContact CB-OD1 3.4Å; N117-I436 HydrophobicContact CB-CD1 4.44Å
118	I	91.5	Very high	87.2	Confident	2 Å²	2	23.4 Å²	23.4	1%	0.01	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	128.5	-177.4	-53.8	174	0	0	0	108.5	I49 I51 T63 V66 T107 T109 I116	I49-I118 HydrophobicContact CD1-CG1 4.22Å; I49-I118 HydrophobicContact CG1-CG1 4.06Å; I49-I118 WeakPolarHBondContact O-CA 3.26Å; I51-I118 HydrophobicContact CD1-CG2 3.74Å; I51-I118 HydrophobicContact CG1-CG2 4.1Å; T63-I118 HydrophobicContact CG2-CG2 4.19Å; V66-I118 HydrophobicContact CB-CD1 4.44Å; V66-I118 HydrophobicContact CG1-CD1 3.56Å; T107-I118 HydrophobicContact CG2-CB 3.85Å; T107-I118 PolarHBondContact N-O 3.15Å; T107-I118 PolarHBondContact O-N 2.98Å; T107-I118 VanDerWaalsContact O-O 3.11Å; T109-I118 HydrophobicContact CG2-CD1 4.18Å; I116-I118 HydrophobicContact CG2-CD1 4.29Å; I116-I118 HydrophobicContact CG2-CG1 3.72Å
119	I	91.3	Very high	87.3	Confident	2 Å²	2	22.6 Å²	22.6	1%	0.01	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	113.2	167.7	-57	-178.3	0	0	0	108.1	I49 G50 I51 A105 A106 T121 A134 L138 F377 I436	I49-I119 PolarHBondContact O-N 3.46Å; G50-I119 WeakPolarHBondContact CA-O 3.32Å; I51-I119 PolarHBondContact N-O 3.26Å; A105-I119 WeakPolarHBondContact O-CA 3.47Å; A106-I119 HydrophobicContact CB-CG1 4.5Å; I119-T121 HydrophobicContact CG2-CG2 4.21Å; I119-A134 HydrophobicContact CG2-CB 3.83Å; I119-L138 HydrophobicContact CB-CD1 4.33Å; I119-L138 HydrophobicContact CB-CD2 4.2Å; I119-L138 HydrophobicContact CD1-CD1 4.45Å; I119-L138 HydrophobicContact CD1-CD2 3.62Å; I119-L138 HydrophobicContact CD1-CG 4.04Å; I119-L138 HydrophobicContact CG1-CD2 3.86Å; I119-F377 HydrophobicContact CD1-CE2 4.07Å; I119-F377 HydrophobicContact CD1-CZ 4.16Å; I119-I436 HydrophobicContact CD1-CD1 4.07Å
120	D	90.4	Very high	87.4	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	123.8	172	-156.9	-9.8	0	0	0	108.8	T60 T63 M89 S104 A105	T60-D120 WeakPolarHBondContact CA-OD2 3.38Å; T63-D120 HydrophobicContact CG2-CB 4.44Å; T63-D120 PolarHBondContact OG1-OD2 2.86Å; M89-D120 HydrophobicContact CE-CB 4.04Å; S104-D120 CarbonylContact C-O 3.56Å; S104-D120 WeakPolarHBondContact CA-O 3.17Å; A105-D120 PolarHBondContact N-O 3.37Å; A105-D120 VanDerWaalsContact N-O 3.08Å; A105-D120 PolarHBondContact O-N 3.39Å
121	T	88.6	Confident	87.5	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.099	C	C	.	.			trans	-107.2	145.3	-173.4	61.8	0	0	0	0	111.1	I51 S52 K59 I119 A134	I51-T121 PolarHBondContact O-N 2.94Å; I51-T121 PolarHBondContact O-OG1 2.81Å; S52-T121 WeakPolarHBondContact CA-OG1 3.36Å; S52-T121 WeakPolarHBondContact CB-OG1 3.28Å; S52-T121 PolarHBondContact OG-OG1 3.44Å; K59-T121 WeakPolarHBondContact CD-O 3.45Å; K59-T121 WeakPolarHBondContact CE-O 3.47Å; I119-T121 HydrophobicContact CG2-CG2 4.21Å; T121-A134 HydrophobicContact CG2-CB 3.42Å; T121-A134 VanDerWaalsContact CG2-CB 3.42Å
122	P	85.4	Confident	87.5	Confident	1 Å²	1	17.7 Å²	17.7	1%	0.006	9%	0.092	C	C	.	.			trans	-64.4	146.4	177	27.7	-34.4	0	0	0	111.1	T101 F127 E130 V131	T101-P122 WeakPolarHBondContact O-CB 3.32Å; P122-F127 HydrophobicContact CB-CB 3.88Å; P122-F127 HydrophobicContact CG-CB 3.71Å; P122-E130 HydrophobicContact CG-CB 3.32Å; P122-E130 HydrophobicContact CG-CG 3.95Å; P122-V131 HydrophobicContact CG-CG2 4.29Å; P122-V131 VanDerWaalsContact O-CG2 3.28Å; P122-V131 WeakPolarHBondContact O-CG2 3.47Å
123	G	75.7	Confident	87.6	Confident	8 Å²	8	13.5 Å²	13.5	8%	0.082	7%	0.074	C	C	.	.			trans	-95.3	-3.6	-179.3	0	0	0	0	0	115.4	A53 I55 Q154	A53-G123 WeakPolarHBondContact O-CA 3.32Å; I55-G123 WeakPolarHBondContact CG1-O 3.47Å; G123-Q154 WeakPolarHBondContact O-CG 3.29Å
124	H	83.6	Confident	87.8	Confident	41 Å²	41	7.8 Å²	7.8	19%	0.19	4%	0.043	C	C	.	.	S	Bend	trans	-94.6	144.3	-170.7	-166.3	-76.9	0	0	0	111	I55 D126 F127 L518	I55-H124 HydrophobicContact CD1-CB 4.31Å; I55-H124 VanDerWaalsContact CD1-CD2 3.46Å; I55-H124 WeakPolarHBondContact CD1-CD2 3.18Å; I55-H124 HydrophobicContact CG1-CB 4.41Å; H124-D126 VanDerWaalsContact C-N 3.26Å; H124-D126 IonicContact CE1-OD1 3.92Å; H124-D126 IonicContact CE1-OD2 2.81Å; H124-D126 WeakPolarHBondContact ND1-CB 3.29Å; H124-D126 PolarHBondContact ND1-N 2.94Å; H124-D126 IonicContact ND1-OD1 3.62Å; H124-D126 PolarHBondContact O-N 3.25Å; H124-F127 HydrophobicContact CB-CD2 4.13Å; H124-F127 PolarHBondContact O-N 3Å; H124-F127 VanDerWaalsContact O-N 3.13Å; H124-L518 VanDerWaalsContact CE1-CD2 3.5Å; H124-L518 WeakPolarHBondContact CE1-CD2 3.41Å; H124-L518 VanDerWaalsContact NE2-CD2 3.3Å; H124-L518 WeakPolarHBondContact NE2-CD2 3.31Å
125	V	79.8	Confident	87.8	Confident	34 Å²	34	7 Å²	7	21%	0.206	4%	0.039	C	C	.	.	G	3₁₀ helix	trans	-56.5	-41.6	-177.9	-173.6	0	0	0	0	111.7	F127 T128 Q154	V125-F127 PolarHBondContact O-N 3.17Å; V125-T128 WeakPolarHBondContact O-CB 3.42Å; V125-T128 WeakPolarHBondContact O-CG2 3.46Å; V125-T128 PolarHBondContact O-N 3.04Å; V125-T128 PolarHBondContact O-OG1 3.36Å; V125-Q154 VanDerWaalsContact CG2-OE1 3.28Å
126	D	85.4	Confident	87.7	Confident	4 Å²	4	7.7 Å²	7.7	2%	0.021	4%	0.041	C	C	.	.	G	3₁₀ helix	trans	-64	-20.8	-179.1	-71.3	15.9	0	0	0	114.7	H124 M515 G516 L518 H519 R723	H124-D126 VanDerWaalsContact C-N 3.26Å; H124-D126 IonicContact CE1-OD1 3.92Å; H124-D126 IonicContact CE1-OD2 2.81Å; H124-D126 WeakPolarHBondContact ND1-CB 3.29Å; H124-D126 PolarHBondContact ND1-N 2.94Å; H124-D126 IonicContact ND1-OD1 3.62Å; H124-D126 PolarHBondContact O-N 3.25Å; D126-M515 WeakPolarHBondContact O-CB 3.18Å; D126-G516 WeakPolarHBondContact OD2-CA 3.34Å; D126-L518 WeakPolarHBondContact OD2-CB 3.4Å; D126-L518 PolarHBondContact OD2-N 2.98Å; D126-H519 HydrophobicContact CB-CB 4Å; D126-H519 PolarHBondContact OD2-N 3.26Å; D126-R723 IonicContact OD1-NH1 2.81Å; D126-R723 PolarHBondContact OD1-NH1 2.66Å
127	F	87.6	Confident	87.6	Confident	4 Å²	4	7.7 Å²	7.7	2%	0.018	4%	0.041	C	C	.	.	G	3₁₀ helix	trans	-109.6	30.3	178.7	-59.4	-69.3	0	0	0	111.5	I102 P122 H124 V125 I129 E130 H519 I522	I102-F127 HydrophobicContact CB-CE2 4.46Å; I102-F127 HydrophobicContact CB-CZ 4.36Å; I102-F127 HydrophobicContact CG1-CE2 4.06Å; I102-F127 HydrophobicContact CG1-CZ 4.16Å; I102-F127 HydrophobicContact CG2-CD1 4.16Å; I102-F127 HydrophobicContact CG2-CE1 3.61Å; I102-F127 HydrophobicContact CG2-CE2 4.21Å; I102-F127 HydrophobicContact CG2-CZ 3.66Å; P122-F127 HydrophobicContact CB-CB 3.88Å; P122-F127 HydrophobicContact CG-CB 3.71Å; H124-F127 HydrophobicContact CB-CD2 4.13Å; H124-F127 PolarHBondContact O-N 3Å; H124-F127 VanDerWaalsContact O-N 3.13Å; V125-F127 PolarHBondContact O-N 3.17Å; F127-I129 PolarHBondContact O-N 2.9Å; F127-E130 HydrophobicContact CB-CG 4.43Å; F127-E130 WeakPolarHBondContact O-CB 3.5Å; F127-E130 PolarHBondContact O-N 3.28Å; F127-E130 VanDerWaalsContact O-N 3.15Å; F127-H519 AromaticContact CD1-CD2 3.94Å; F127-H519 AromaticContact CE1-CD2 3.51Å; F127-I522 HydrophobicContact CE2-CD1 3.82Å; F127-I522 HydrophobicContact CZ-CB 4.46Å; F127-I522 HydrophobicContact CZ-CD1 3.55Å; F127-I522 HydrophobicContact CZ-CG2 4.35Å
128	T	84.2	Confident	87.6	Confident	9 Å²	9	7.3 Å²	7.3	6%	0.055	4%	0.039	C	C	.	.	H	α-helix	trans	-59.3	-30.4	179.6	37.1	0	0	0	0	113.4	V125 E130 V131 E132 T157	V125-T128 WeakPolarHBondContact O-CB 3.42Å; V125-T128 WeakPolarHBondContact O-CG2 3.46Å; V125-T128 PolarHBondContact O-N 3.04Å; V125-T128 PolarHBondContact O-OG1 3.36Å; T128-E130 VanDerWaalsContact C-N 3.31Å; T128-E130 PolarHBondContact O-N 3.1Å; T128-V131 WeakPolarHBondContact O-CB 3.33Å; T128-V131 PolarHBondContact O-N 3Å; T128-V131 VanDerWaalsContact O-N 3.13Å; T128-E132 WeakPolarHBondContact O-CG 3.3Å; T128-E132 PolarHBondContact O-N 2.95Å; T128-T157 HydrophobicContact CG2-CG2 4.4Å
129	I	88.4	Confident	87.6	Confident	1 Å²	1	7.3 Å²	7.3	1%	0.005	4%	0.039	C	C	.	.	H	α-helix	trans	-60.7	-38.9	175.9	-173.9	59.6	0	0	0	112.2	F127 V131 E132 R133 I463 V465 P497 T498	F127-I129 PolarHBondContact O-N 2.9Å; I129-V131 VanDerWaalsContact C-N 3.26Å; I129-V131 PolarHBondContact O-N 2.9Å; I129-E132 HydrophobicContact CD1-CB 4.43Å; I129-E132 WeakPolarHBondContact O-CB 2.74Å; I129-E132 PolarHBondContact O-N 2.97Å; I129-R133 HydrophobicContact CD1-CG 4.25Å; I129-R133 HydrophobicContact CG1-CG 4.27Å; I129-R133 WeakPolarHBondContact O-CG 3.42Å; I129-R133 PolarHBondContact O-N 3.41Å; I129-I463 HydrophobicContact CD1-CG2 4.28Å; I129-V465 HydrophobicContact CD1-CG2 4.28Å; I129-P497 HydrophobicContact CD1-CG 4.05Å; I129-P497 HydrophobicContact CG1-CG 4.05Å; I129-T498 HydrophobicContact CB-CG2 3.65Å; I129-T498 HydrophobicContact CD1-CG2 4.26Å; I129-T498 HydrophobicContact CG1-CG2 3.91Å; I129-T498 HydrophobicContact CG2-CG2 4.01Å
130	E	88.8	Confident	87.7	Confident	8 Å²	8	7.2 Å²	7.2	4%	0.037	4%	0.039	C	C	.	.	H	α-helix	trans	-59.1	-40.3	175.3	-73	-70.8	153.2	0	0	111.6	S104 P122 F127 T128 R133 A134	S104-E130 WeakPolarHBondContact CB-OE2 3.39Å; S104-E130 PolarHBondContact N-OE2 2.86Å; S104-E130 WeakPolarHBondContact OG-CB 3.44Å; S104-E130 PolarHBondContact OG-O 3.1Å; S104-E130 PolarHBondContact OG-OE2 3Å; P122-E130 HydrophobicContact CG-CB 3.32Å; P122-E130 HydrophobicContact CG-CG 3.95Å; F127-E130 HydrophobicContact CB-CG 4.43Å; F127-E130 WeakPolarHBondContact O-CB 3.5Å; F127-E130 PolarHBondContact O-N 3.28Å; F127-E130 VanDerWaalsContact O-N 3.15Å; T128-E130 VanDerWaalsContact C-N 3.31Å; T128-E130 PolarHBondContact O-N 3.1Å; E130-R133 PolarHBondContact O-N 2.73Å; E130-R133 IonicContact OE1-CZ 2.76Å; E130-R133 IonicContact OE1-NH2 3.52Å; E130-R133 PolarHBondContact OE1-NH2 2.95Å; E130-R133 IonicContact OE2-NH2 3.7Å; E130-A134 WeakPolarHBondContact O-CB 3.36Å; E130-A134 PolarHBondContact O-N 2.95Å
131	V	89.6	Confident	88	Confident	1 Å²	1	7.2 Å²	7.2	1%	0.006	4%	0.039	C	C	.	.	H	α-helix	trans	-67.8	-43.5	176.2	-170.5	0	0	0	0	111.2	P122 T128 I129 R133 A134 L135 V158 Q161	P122-V131 HydrophobicContact CG-CG2 4.29Å; P122-V131 VanDerWaalsContact O-CG2 3.28Å; P122-V131 WeakPolarHBondContact O-CG2 3.47Å; T128-V131 WeakPolarHBondContact O-CB 3.33Å; T128-V131 PolarHBondContact O-N 3Å; T128-V131 VanDerWaalsContact O-N 3.13Å; I129-V131 VanDerWaalsContact C-N 3.26Å; I129-V131 PolarHBondContact O-N 2.9Å; V131-R133 VanDerWaalsContact C-N 3.33Å; V131-R133 PolarHBondContact O-N 2.9Å; V131-A134 PolarHBondContact O-N 2.89Å; V131-L135 HydrophobicContact CG1-CD1 3.82Å; V131-L135 HydrophobicContact CG1-CG 4.16Å; V131-L135 WeakPolarHBondContact O-CB 3.23Å; V131-L135 WeakPolarHBondContact O-CG 3.37Å; V131-L135 PolarHBondContact O-N 3.41Å; V131-V158 HydrophobicContact CG1-CG2 4.34Å; V131-Q161 VanDerWaalsContact CG1-OE1 3.28Å
132	E	89.4	Confident	88.3	Confident	7 Å²	7	7.4 Å²	7.4	3%	0.033	4%	0.04	C	C	.	.	H	α-helix	trans	-58.2	-45.5	175.1	-66.7	-82.1	178.1	0	0	111.4	T128 I129 R136 Q161 R164 Y165 I463	T128-E132 WeakPolarHBondContact O-CG 3.3Å; T128-E132 PolarHBondContact O-N 2.95Å; I129-E132 HydrophobicContact CD1-CB 4.43Å; I129-E132 WeakPolarHBondContact O-CB 2.74Å; I129-E132 PolarHBondContact O-N 2.97Å; E132-R136 WeakPolarHBondContact O-CB 3.37Å; E132-R136 PolarHBondContact O-N 3.41Å; E132-R136 VanDerWaalsContact O-N 3.09Å; E132-Q161 VanDerWaalsContact OE1-CG 3.25Å; E132-Q161 WeakPolarHBondContact OE1-CG 3.11Å; E132-Q161 PolarHBondContact OE1-NE2 3.41Å; E132-R164 IonicContact OE1-CZ 3.4Å; E132-R164 IonicContact OE1-NH1 2.76Å; E132-R164 PolarHBondContact OE1-NH1 3.35Å; E132-R164 IonicContact OE2-NH1 3.41Å; E132-R164 PolarHBondContact OE2-NH1 3.2Å; E132-Y165 WeakPolarHBondContact OE2-CE2 3.41Å; E132-Y165 VanDerWaalsContact OE2-CZ 3.27Å; E132-Y165 PolarHBondContact OE2-OH 3.19Å; E132-I463 HydrophobicContact CB-CG2 3.88Å
133	R	89.1	Confident	88.8	Confident	5 Å²	5	7.3 Å²	7.3	2%	0.019	4%	0.039	C	C	.	.	H	α-helix	trans	-64.2	-43.7	179.7	-66.8	-165.5	-62.3	-174.5	-14.4	111.8	I129 E130 V131 V137 F377 S446 I463 E495	I129-R133 HydrophobicContact CD1-CG 4.25Å; I129-R133 HydrophobicContact CG1-CG 4.27Å; I129-R133 WeakPolarHBondContact O-CG 3.42Å; I129-R133 PolarHBondContact O-N 3.41Å; E130-R133 PolarHBondContact O-N 2.73Å; E130-R133 IonicContact OE1-CZ 2.76Å; E130-R133 IonicContact OE1-NH2 3.52Å; E130-R133 PolarHBondContact OE1-NH2 2.95Å; E130-R133 IonicContact OE2-NH2 3.7Å; V131-R133 VanDerWaalsContact C-N 3.33Å; V131-R133 PolarHBondContact O-N 2.9Å; R133-V137 WeakPolarHBondContact O-CG2 3.38Å; R133-F377 VanDerWaalsContact CD-O 3.26Å; R133-F377 WeakPolarHBondContact CD-O 3.44Å; R133-S446 VanDerWaalsContact CD-OG 3.31Å; R133-S446 WeakPolarHBondContact CD-OG 3.48Å; R133-S446 PolarHBondContact NH1-OG 2.98Å; R133-S446 VanDerWaalsContact NH1-OG 3.09Å; R133-I463 HydrophobicContact CB-CD1 4.25Å; R133-I463 HydrophobicContact CG-CD1 3.73Å; R133-I463 HydrophobicContact CG-CG2 4.2Å; R133-E495 PolarHBondContact NH1-O 2.85Å; R133-E495 PolarHBondContact NH2-O 3.12Å
134	A	90.1	Very high	89.8	Confident	1 Å²	1	7 Å²	7	1%	0.008	4%	0.035	C	C	.	.	H	α-helix	trans	-64.3	-53.3	176.3	0	0	0	0	0	111	I119 T121 E130 V131 R136 V137 L138	I119-A134 HydrophobicContact CG2-CB 3.83Å; T121-A134 HydrophobicContact CG2-CB 3.42Å; T121-A134 VanDerWaalsContact CG2-CB 3.42Å; E130-A134 WeakPolarHBondContact O-CB 3.36Å; E130-A134 PolarHBondContact O-N 2.95Å; V131-A134 PolarHBondContact O-N 2.89Å; A134-R136 VanDerWaalsContact C-N 3.27Å; A134-R136 PolarHBondContact O-N 3.46Å; A134-V137 CarbonylContact O-C 3.45Å; A134-V137 WeakPolarHBondContact O-CA 3.42Å; A134-V137 PolarHBondContact O-N 2.85Å; A134-L138 HydrophobicContact CB-CD1 4.08Å; A134-L138 VanDerWaalsContact O-CD1 3.3Å; A134-L138 WeakPolarHBondContact O-CD1 3.45Å; A134-L138 WeakPolarHBondContact O-CG 3.38Å; A134-L138 PolarHBondContact O-N 2.87Å; A134-L138 VanDerWaalsContact O-N 3.09Å
135	L	90.8	Very high	90.3	Very high	1 Å²	1	5 Å²	5	1%	0.005	3%	0.026	C	C	.	.	H	α-helix	trans	-61	-33.4	-175.7	-72.2	176.4	0	0	0	113.1	V131 V137 L138 A141 Q161 M162 Y165	V131-L135 HydrophobicContact CG1-CD1 3.82Å; V131-L135 HydrophobicContact CG1-CG 4.16Å; V131-L135 WeakPolarHBondContact O-CB 3.23Å; V131-L135 WeakPolarHBondContact O-CG 3.37Å; V131-L135 PolarHBondContact O-N 3.41Å; L135-V137 PolarHBondContact O-N 2.95Å; L135-L138 PolarHBondContact O-N 3.17Å; L135-A141 HydrophobicContact CD2-CB 4.17Å; L135-Q161 HydrophobicContact CD1-CB 3.64Å; L135-M162 HydrophobicContact CD1-CG 3.84Å; L135-M162 HydrophobicContact CD2-CE 4.11Å; L135-M162 HydrophobicContact CD2-CG 3.92Å; L135-Y165 HydrophobicContact CB-CD2 3.98Å; L135-Y165 HydrophobicContact CB-CE2 4.42Å
136	R	88.9	Confident	90.9	Very high	19 Å²	19	4 Å²	4	7%	0.072	2%	0.02	C	C	.	.	H	α-helix	trans	-61.9	-28.5	174.9	177.9	59.6	-171.1	102.4	-14.4	113.2	E132 A134 Y165 L375 Y393 I463	E132-R136 WeakPolarHBondContact O-CB 3.37Å; E132-R136 PolarHBondContact O-N 3.41Å; E132-R136 VanDerWaalsContact O-N 3.09Å; A134-R136 VanDerWaalsContact C-N 3.27Å; A134-R136 PolarHBondContact O-N 3.46Å; R136-Y165 HydrophobicContact CB-CD1 4.49Å; R136-Y165 HydrophobicContact CB-CE1 4.27Å; R136-L375 HydrophobicContact CG-CD2 4.45Å; R136-Y393 PolarHBondContact NH1-OH 2.91Å; R136-Y393 PolarHBondContact O-OH 3.08Å; R136-I463 HydrophobicContact CB-CG1 4.42Å; R136-I463 HydrophobicContact CG-CG1 4.21Å
137	V	90.1	Very high	91.3	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-104.4	-5.3	-170	173.6	0	0	0	0	111.6	R133 A134 L135 L375 F377 R391 I436	R133-V137 WeakPolarHBondContact O-CG2 3.38Å; A134-V137 CarbonylContact O-C 3.45Å; A134-V137 WeakPolarHBondContact O-CA 3.42Å; A134-V137 PolarHBondContact O-N 2.85Å; L135-V137 PolarHBondContact O-N 2.95Å; V137-L375 HydrophobicContact CG2-CD2 4.45Å; V137-F377 HydrophobicContact CB-CD1 4.43Å; V137-F377 HydrophobicContact CB-CD2 4.38Å; V137-F377 HydrophobicContact CB-CG 4.23Å; V137-F377 HydrophobicContact CG1-CD1 3.76Å; V137-F377 HydrophobicContact CG1-CD2 4.28Å; V137-F377 HydrophobicContact CG1-CE1 3.77Å; V137-F377 HydrophobicContact CG1-CE2 4.3Å; V137-F377 HydrophobicContact CG1-CG 4.02Å; V137-F377 HydrophobicContact CG1-CZ 4.05Å; V137-F377 HydrophobicContact CG2-CB 3.48Å; V137-F377 VanDerWaalsContact CG2-CB 3.48Å; V137-F377 HydrophobicContact CG2-CD1 3.95Å; V137-F377 HydrophobicContact CG2-CD2 4.08Å; V137-F377 HydrophobicContact CG2-CG 3.57Å; V137-R391 HydrophobicContact CG1-CB 3.57Å; V137-R391 HydrophobicContact CG1-CG 4.13Å; V137-R391 WeakPolarHBondContact O-CD 3.43Å; V137-R391 VanDerWaalsContact O-CZ 3.27Å; V137-R391 PolarHBondContact O-NE 2.99Å; V137-R391 PolarHBondContact O-NH1 2.79Å; V137-I436 HydrophobicContact CG1-CD1 4.34Å
138	L	91.3	Very high	91.3	Very high	6 Å²	6	6 Å²	6	3%	0.031	3%	0.033	C	C	.	.			trans	-100.4	154.9	-179.9	-67.8	163.7	0	0	0	111.3	N48 I49 I119 A134 L135	N48-L138 HydrophobicContact CB-CD2 4.43Å; I49-L138 WeakPolarHBondContact O-CD2 3.2Å; I119-L138 HydrophobicContact CB-CD1 4.33Å; I119-L138 HydrophobicContact CB-CD2 4.2Å; I119-L138 HydrophobicContact CD1-CD1 4.45Å; I119-L138 HydrophobicContact CD1-CD2 3.62Å; I119-L138 HydrophobicContact CD1-CG 4.04Å; I119-L138 HydrophobicContact CG1-CD2 3.86Å; A134-L138 HydrophobicContact CB-CD1 4.08Å; A134-L138 VanDerWaalsContact O-CD1 3.3Å; A134-L138 WeakPolarHBondContact O-CD1 3.45Å; A134-L138 WeakPolarHBondContact O-CG 3.38Å; A134-L138 PolarHBondContact O-N 2.87Å; A134-L138 VanDerWaalsContact O-N 3.09Å; L135-L138 PolarHBondContact O-N 3.17Å
139	D	90.8	Very high	91.4	Very high	1 Å²	1	6.9 Å²	6.9	1%	0.005	4%	0.044	C	C	.	.	S	Bend	trans	-96.4	-28.9	176.5	-67.5	-44.1	0	0	0	111.5	N48 P168 P337 V342 R391	N48-D139 HydrophobicContact CB-CB 4.3Å; N48-D139 WeakPolarHBondContact CB-OD2 3.44Å; N48-D139 PolarHBondContact ND2-OD2 3.29Å; N48-D139 PolarHBondContact O-N 2.81Å; D139-P168 VanDerWaalsContact O-CD 3.28Å; D139-P168 WeakPolarHBondContact O-CD 3.43Å; D139-P168 WeakPolarHBondContact O-CG 3.24Å; D139-P337 HydrophobicContact CB-CG 4.15Å; D139-P337 WeakPolarHBondContact O-CG 3.39Å; D139-V342 HydrophobicContact CB-CG2 3.86Å; D139-R391 IonicContact OD1-CZ 2.71Å; D139-R391 IonicContact OD1-NH1 3.71Å; D139-R391 PolarHBondContact OD1-NH1 3.25Å; D139-R391 IonicContact OD1-NH2 3.46Å; D139-R391 PolarHBondContact OD1-NH2 2.64Å; D139-R391 IonicContact OD2-CZ 3.19Å; D139-R391 IonicContact OD2-NH2 3.2Å; D139-R391 PolarHBondContact OD2-NH2 2.93Å; D139-R391 VanDerWaalsContact OD2-NH2 3.14Å
140	G	94.2	Very high	91.4	Very high	1 Å²	1	6.9 Å²	6.9	1%	0.01	4%	0.044	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	168.1	173.6	0	0	0	0	0	112	N48 I49 G50 P168	N48-G140 PolarHBondContact O-N 2.72Å; N48-G140 VanDerWaalsContact O-N 3.1Å; I49-G140 VanDerWaalsContact CA-O 3.29Å; I49-G140 WeakPolarHBondContact CA-O 3.41Å; G50-G140 PolarHBondContact N-O 3.43Å; G50-G140 VanDerWaalsContact N-O 3.07Å; G140-P168 CarbonylContact C-O 3.53Å; G140-P168 VanDerWaalsContact CA-O 3.24Å; G140-P168 WeakPolarHBondContact CA-O 3.25Å
141	A	95.6	Very high	91.3	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	4%	0.044	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	160.2	174.8	0	0	0	0	0	112.8	G50 L135 M162 V167 P168 F169 L170	G50-A141 CarbonylContact O-C 3.59Å; G50-A141 VanDerWaalsContact O-CA 3.3Å; G50-A141 WeakPolarHBondContact O-CA 3.48Å; L135-A141 HydrophobicContact CD2-CB 4.17Å; A141-M162 HydrophobicContact CB-CE 3.53Å; A141-M162 HydrophobicContact CB-SD 4.33Å; A141-V167 HydrophobicContact CB-CG1 4.06Å; A141-P168 PolarHBondContact N-O 3.18Å; A141-F169 HydrophobicContact CB-CB 3.97Å; A141-F169 CarbonylContact O-C 3.57Å; A141-F169 WeakPolarHBondContact O-CA 3.44Å; A141-F169 WeakPolarHBondContact O-CB 3.33Å; A141-L170 PolarHBondContact O-N 3.47Å
142	V	96.6	Very high	91.1	Very high	3 Å²	3	9.6 Å²	9.6	2%	0.018	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	111.2	169.9	-178.3	0	0	0	0	107.6	G50 S52 V144 L170 F172 L328 V332 L336	G50-V142 PolarHBondContact O-N 3.24Å; S52-V142 PolarHBondContact N-O 3.3Å; V142-V144 HydrophobicContact CG1-CG2 4.32Å; V142-L170 CarbonylContact C-O 3.57Å; V142-L170 WeakPolarHBondContact CA-O 3.16Å; V142-F172 HydrophobicContact CG1-CB 4.05Å; V142-L328 HydrophobicContact CG1-CD1 4.31Å; V142-L328 HydrophobicContact CG1-CD2 4.37Å; V142-V332 HydrophobicContact CG2-CG2 4.13Å; V142-L336 HydrophobicContact CG2-CD1 4.48Å
143	L	96	Very high	90.7	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	108.8	174.6	-175.3	65.7	0	0	0	109.4	S52 L145 T155 V158 M162 F169 L170 T171 F172 M190	S52-L143 CarbonylContact O-C 3.55Å; S52-L143 WeakPolarHBondContact O-CA 3.42Å; L143-L145 HydrophobicContact CD2-CD2 4.45Å; L143-L145 HydrophobicContact CG-CD2 4.34Å; L143-T155 HydrophobicContact CD1-CG2 4.18Å; L143-T155 HydrophobicContact CD2-CG2 4.04Å; L143-T155 HydrophobicContact CG-CG2 4.43Å; L143-V158 HydrophobicContact CD1-CG1 3.97Å; L143-M162 HydrophobicContact CB-CE 4.45Å; L143-M162 HydrophobicContact CD1-CE 4.35Å; L143-F169 HydrophobicContact CB-CD2 3.84Å; L143-F169 HydrophobicContact CB-CE2 4.24Å; L143-F169 HydrophobicContact CD2-CD2 4.36Å; L143-F169 HydrophobicContact CD2-CE2 3.94Å; L143-L170 PolarHBondContact N-O 2.83Å; L143-T171 CarbonylContact O-C 3.48Å; L143-T171 WeakPolarHBondContact O-CA 3.38Å; L143-F172 PolarHBondContact O-N 2.91Å; L143-M190 HydrophobicContact CD2-CE 4.32Å
144	V	95.6	Very high	90.4	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	130.1	178.2	-175.3	0	0	0	0	110	I51 S52 A53 L62 V142 F172 N174	I51-V144 HydrophobicContact CG2-CG2 3.93Å; S52-V144 PolarHBondContact O-N 3.39Å; A53-V144 HydrophobicContact CB-CB 3.73Å; A53-V144 VanDerWaalsContact CB-O 3.22Å; A53-V144 WeakPolarHBondContact CB-O 3.49Å; L62-V144 HydrophobicContact CD2-CG2 3.74Å; V142-V144 HydrophobicContact CG1-CG2 4.32Å; V144-F172 CarbonylContact C-O 3.6Å; V144-F172 WeakPolarHBondContact CA-O 3.45Å; V144-F172 HydrophobicContact CG1-CD1 4.16Å; V144-F172 HydrophobicContact CG2-CD1 4.44Å; V144-N174 HydrophobicContact CG1-CB 3.64Å
145	L	94.6	Very high	90.4	Very high	1 Å²	1	10.3 Å²	10.3	1%	0.005	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	148.9	175	-59.1	177.9	0	0	0	110.5	L143 T155 T171 F172 N174 M190	L143-L145 HydrophobicContact CD2-CD2 4.45Å; L143-L145 HydrophobicContact CG-CD2 4.34Å; L145-T155 HydrophobicContact CD2-CG2 3.41Å; L145-T155 VanDerWaalsContact CD2-CG2 3.41Å; L145-T171 HydrophobicContact CD1-CG2 3.54Å; L145-T171 HydrophobicContact CG-CG2 3.97Å; L145-F172 PolarHBondContact N-O 2.87Å; L145-N174 PolarHBondContact O-N 2.94Å; L145-M190 HydrophobicContact CD1-CG 3.72Å; L145-M190 HydrophobicContact CD1-SD 3.49Å; L145-M190 WeakPolarHBondContact CD1-SD 3.48Å
146	C	93	Very high	90.2	Very high	11 Å²	11	12.4 Å²	12.4	7%	0.074	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	127.8	171.5	-177.8	0	0	0	0	110	V148 G149 G150	C146-V148 PolarHBondContact O-N 2.87Å; C146-V148 VanDerWaalsContact O-N 3.11Å; C146-G149 PolarHBondContact O-N 3.37Å; C146-G149 VanDerWaalsContact O-N 3.14Å; C146-G150 PolarHBondContact O-N 2.84Å
147	A	92	Very high	90.1	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-28.2	177.7	0	0	0	0	0	113.9	I173 N174 L176 N182	A147-I173 HydrophobicContact CB-CG2 3.71Å; A147-N174 WeakPolarHBondContact CB-O 3.22Å; A147-N174 PolarHBondContact N-O 2.77Å; A147-L176 HydrophobicContact CB-CG 4.29Å; A147-N182 PolarHBondContact O-N 3.49Å
148	V	89.4	Confident	90.1	Very high	51 Å²	51	13.1 Å²	13.1	31%	0.309	8%	0.08	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-32.5	178.2	-174.6	0	0	0	0	112.1	C146 R178 R185	C146-V148 PolarHBondContact O-N 2.87Å; C146-V148 VanDerWaalsContact O-N 3.11Å; V148-R178 HydrophobicContact CG2-CB 3.84Å; V148-R185 VanDerWaalsContact C-NH2 3.34Å; V148-R185 PolarHBondContact O-NH2 3.22Å
149	G	84.3	Confident	90.1	Very high	28 Å²	28	13.5 Å²	13.5	29%	0.289	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-32.1	-176.9	0	0	0	0	0	113.8	C146	C146-G149 PolarHBondContact O-N 3.37Å; C146-G149 VanDerWaalsContact O-N 3.14Å
150	G	88.4	Confident	90	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.102	C	C	.	.	B	Isolated β-bridge	trans	63.9	-143	-174.2	0	0	0	0	0	112.7	C146 Q189	C146-G150 PolarHBondContact O-N 2.84Å; G150-Q189 VanDerWaalsContact CA-OE1 3.25Å
151	V	87.3	Confident	89.8	Confident	6 Å²	6	19.2 Å²	19.2	4%	0.036	10%	0.103	C	C	.	.	S	Bend	trans	-84.4	116.3	178.8	179.4	0	0	0	0	110.2	T155 M156 Q189 M190 K193 L194	V151-T155 HydrophobicContact CG1-CG2 4.26Å; V151-M156 HydrophobicContact CG1-CG 4.07Å; V151-Q189 HydrophobicContact CB-CB 4.1Å; V151-Q189 HydrophobicContact CG2-CB 3.8Å; V151-M190 HydrophobicContact CG2-CG 4Å; V151-M190 HydrophobicContact CG2-SD 3.78Å; V151-K193 HydrophobicContact CB-CD 4.32Å; V151-K193 HydrophobicContact CG1-CB 4.34Å; V151-K193 HydrophobicContact CG1-CD 4.38Å; V151-L194 HydrophobicContact CG1-CD1 4.36Å; V151-L194 HydrophobicContact CG1-CD2 3.74Å; V151-L194 HydrophobicContact CG1-CG 3.98Å; V151-L194 HydrophobicContact CG2-CD1 4.45Å; V151-L194 HydrophobicContact CG2-CG 4.43Å
152	Q	86.8	Confident	89.7	Confident	61 Å²	61	19.2 Å²	19.2	29%	0.285	10%	0.103	S	C	.	.			trans	-109.2	166.9	-179.2	-62.5	174.3	-72.9	0	0	111.3	H54 Q154 T155 M156	H54-Q152 HydrophobicContact CB-CB 4.45Å; H54-Q152 PolarHBondContact CD2-NE2 3.13Å; H54-Q152 PolarHBondContact CD2-OE1 3.15Å; H54-Q152 PolarHBondContact NE2-NE2 2.85Å; Q152-Q154 PolarHBondContact O-N 2.93Å; Q152-T155 WeakPolarHBondContact O-CA 3.27Å; Q152-T155 WeakPolarHBondContact O-CB 3.36Å; Q152-T155 PolarHBondContact O-N 3.29Å; Q152-M156 PolarHBondContact O-N 2.97Å
153	C	81.1	Confident	89.4	Confident	25 Å²	25	25.9 Å²	25.9	17%	0.169	13%	0.132	C	C	.	.	H	α-helix	trans	-50.9	-51.2	-176.9	53.6	0	0	0	0	113.4	T155 M156 T157 E727 K729	C153-T155 PolarHBondContact O-N 3.47Å; C153-M156 WeakPolarHBondContact O-CA 3.49Å; C153-M156 VanDerWaalsContact O-CB 3.3Å; C153-M156 WeakPolarHBondContact O-CB 3.39Å; C153-M156 PolarHBondContact O-N 2.81Å; C153-T157 PolarHBondContact O-N 2.98Å; C153-T157 VanDerWaalsContact O-N 3.12Å; C153-T157 PolarHBondContact O-OG1 3.19Å; C153-E727 VanDerWaalsContact CB-O 3.32Å; C153-E727 WeakPolarHBondContact CB-O 3.14Å; C153-E727 PolarHBondContact SG-O 3.21Å; C153-K729 HydrophobicContact CB-CG 3.8Å
154	Q	82.8	Confident	89.1	Confident	2 Å²	2	31 Å²	31	1%	0.009	15%	0.151	C	C	.	.	H	α-helix	trans	-62.7	-29.5	177.9	-169.9	62.2	13.3	0	0	113.1	H54 G123 V125 Q152 M156 T157 V158	H54-Q154 VanDerWaalsContact ND1-CB 3.3Å; H54-Q154 WeakPolarHBondContact ND1-CB 3.3Å; G123-Q154 WeakPolarHBondContact O-CG 3.29Å; V125-Q154 VanDerWaalsContact CG2-OE1 3.28Å; Q152-Q154 PolarHBondContact O-N 2.93Å; Q154-M156 VanDerWaalsContact C-N 3.26Å; Q154-M156 PolarHBondContact O-N 3.3Å; Q154-T157 PolarHBondContact O-N 3.19Å; Q154-V158 HydrophobicContact CG-CG2 4.36Å; Q154-V158 VanDerWaalsContact O-CG2 3.31Å; Q154-V158 WeakPolarHBondContact O-CG2 3.49Å; Q154-V158 PolarHBondContact O-N 3.16Å
155	T	88.9	Confident	88.8	Confident	1 Å²	1	33 Å²	33	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-64.1	-38.3	175.5	-53	0	0	0	0	109.9	L143 L145 V151 Q152 C153 N159 L194	L143-T155 HydrophobicContact CD1-CG2 4.18Å; L143-T155 HydrophobicContact CD2-CG2 4.04Å; L143-T155 HydrophobicContact CG-CG2 4.43Å; L145-T155 HydrophobicContact CD2-CG2 3.41Å; L145-T155 VanDerWaalsContact CD2-CG2 3.41Å; V151-T155 HydrophobicContact CG1-CG2 4.26Å; Q152-T155 WeakPolarHBondContact O-CA 3.27Å; Q152-T155 WeakPolarHBondContact O-CB 3.36Å; Q152-T155 PolarHBondContact O-N 3.29Å; C153-T155 PolarHBondContact O-N 3.47Å; T155-N159 VanDerWaalsContact O-CB 3.27Å; T155-N159 WeakPolarHBondContact O-CB 3.1Å; T155-N159 PolarHBondContact O-N 2.96Å; T155-L194 HydrophobicContact CG2-CD1 4.48Å
156	M	87.1	Confident	88.6	Confident	44 Å²	44	38.4 Å²	38.4	22%	0.217	19%	0.188	C	C	.	.	H	α-helix	trans	-65.9	-41.9	174.8	-57.4	176.7	66.6	0	0	111.3	V151 Q152 C153 Q154 N159 R160 L194	V151-M156 HydrophobicContact CG1-CG 4.07Å; Q152-M156 PolarHBondContact O-N 2.97Å; C153-M156 WeakPolarHBondContact O-CA 3.49Å; C153-M156 VanDerWaalsContact O-CB 3.3Å; C153-M156 WeakPolarHBondContact O-CB 3.39Å; C153-M156 PolarHBondContact O-N 2.81Å; Q154-M156 VanDerWaalsContact C-N 3.26Å; Q154-M156 PolarHBondContact O-N 3.3Å; M156-N159 WeakPolarHBondContact O-CB 3.31Å; M156-N159 PolarHBondContact O-N 3.48Å; M156-R160 WeakPolarHBondContact O-CB 3.48Å; M156-R160 PolarHBondContact O-N 3.48Å; M156-L194 HydrophobicContact CB-CD2 4.28Å; M156-L194 HydrophobicContact CG-CD2 3.74Å
157	T	86.4	Confident	88.6	Confident	32 Å²	32	38.1 Å²	38.1	20%	0.196	19%	0.186	C	C	.	.	H	α-helix	trans	-60.5	-50.7	175.7	-48.2	0	0	0	0	111	T128 C153 Q154 N159 R160 Q161	T128-T157 HydrophobicContact CG2-CG2 4.4Å; C153-T157 PolarHBondContact O-N 2.98Å; C153-T157 VanDerWaalsContact O-N 3.12Å; C153-T157 PolarHBondContact O-OG1 3.19Å; Q154-T157 PolarHBondContact O-N 3.19Å; T157-N159 VanDerWaalsContact C-N 3.31Å; T157-N159 PolarHBondContact O-N 3.15Å; T157-R160 WeakPolarHBondContact O-CB 3.28Å; T157-R160 PolarHBondContact O-N 3.43Å; T157-R160 VanDerWaalsContact O-N 3.11Å; T157-Q161 VanDerWaalsContact O-CG 3.31Å; T157-Q161 WeakPolarHBondContact O-CG 3.34Å; T157-Q161 PolarHBondContact O-N 3.31Å
158	V	89.9	Confident	88.8	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.012	19%	0.189	C	C	.	.	H	α-helix	trans	-59.8	-41	176.3	171.6	0	0	0	0	111.2	V131 L143 Q154 R160 Q161 M162	V131-V158 HydrophobicContact CG1-CG2 4.34Å; L143-V158 HydrophobicContact CD1-CG1 3.97Å; Q154-V158 HydrophobicContact CG-CG2 4.36Å; Q154-V158 VanDerWaalsContact O-CG2 3.31Å; Q154-V158 WeakPolarHBondContact O-CG2 3.49Å; Q154-V158 PolarHBondContact O-N 3.16Å; V158-R160 VanDerWaalsContact C-N 3.34Å; V158-R160 PolarHBondContact O-N 2.88Å; V158-Q161 WeakPolarHBondContact O-CB 3.4Å; V158-Q161 PolarHBondContact O-N 2.74Å; V158-M162 HydrophobicContact CG1-CE 3.64Å; V158-M162 HydrophobicContact CG1-CG 4.48Å; V158-M162 HydrophobicContact CG1-SD 4.29Å; V158-M162 WeakPolarHBondContact O-CG 3.22Å; V158-M162 PolarHBondContact O-N 3.49Å
159	N	91.3	Very high	89.1	Confident	15 Å²	15	36.4 Å²	36.4	8%	0.08	18%	0.176	C	C	.	.	H	α-helix	trans	-61.7	-41.2	175.4	-178.6	48.3	0	0	0	112.2	T155 M156 T157 Q161 M162 K163 L194 H196	T155-N159 VanDerWaalsContact O-CB 3.27Å; T155-N159 WeakPolarHBondContact O-CB 3.1Å; T155-N159 PolarHBondContact O-N 2.96Å; M156-N159 WeakPolarHBondContact O-CB 3.31Å; M156-N159 PolarHBondContact O-N 3.48Å; T157-N159 VanDerWaalsContact C-N 3.31Å; T157-N159 PolarHBondContact O-N 3.15Å; N159-Q161 VanDerWaalsContact C-N 3.32Å; N159-Q161 PolarHBondContact O-N 3.31Å; N159-M162 PolarHBondContact O-N 2.99Å; N159-K163 WeakPolarHBondContact O-CB 3.32Å; N159-K163 PolarHBondContact O-N 3.29Å; N159-L194 HydrophobicContact CB-CD1 4.3Å; N159-L194 HydrophobicContact CB-CD2 4.27Å; N159-H196 PolarHBondContact ND2-NE2 2.88Å; N159-H196 PolarHBondContact OD1-NE2 2.91Å
160	R	89	Confident	89.7	Confident	114 Å²	114	35.1 Å²	35.1	43%	0.43	16%	0.162	S	C	.	.	H	α-helix	trans	-63.2	-39	175	-170	-175.7	-69.2	156.9	-4.2	111.3	M156 T157 V158 K163 R164	M156-R160 WeakPolarHBondContact O-CB 3.48Å; M156-R160 PolarHBondContact O-N 3.48Å; T157-R160 WeakPolarHBondContact O-CB 3.28Å; T157-R160 PolarHBondContact O-N 3.43Å; T157-R160 VanDerWaalsContact O-N 3.11Å; V158-R160 VanDerWaalsContact C-N 3.34Å; V158-R160 PolarHBondContact O-N 2.88Å; R160-K163 WeakPolarHBondContact O-CB 3.5Å; R160-K163 PolarHBondContact O-N 3.24Å; R160-R164 PolarHBondContact O-N 3.03Å
161	Q	90.4	Very high	90.2	Very high	7 Å²	7	35.1 Å²	35.1	3%	0.033	16%	0.162	C	C	.	.	H	α-helix	trans	-66.4	-46.5	175.6	-64.6	176.4	-31.3	0	0	111.9	V131 E132 L135 T157 V158 N159 K163 R164 Y165	V131-Q161 VanDerWaalsContact CG1-OE1 3.28Å; E132-Q161 VanDerWaalsContact OE1-CG 3.25Å; E132-Q161 WeakPolarHBondContact OE1-CG 3.11Å; E132-Q161 PolarHBondContact OE1-NE2 3.41Å; L135-Q161 HydrophobicContact CD1-CB 3.64Å; T157-Q161 VanDerWaalsContact O-CG 3.31Å; T157-Q161 WeakPolarHBondContact O-CG 3.34Å; T157-Q161 PolarHBondContact O-N 3.31Å; V158-Q161 WeakPolarHBondContact O-CB 3.4Å; V158-Q161 PolarHBondContact O-N 2.74Å; N159-Q161 VanDerWaalsContact C-N 3.32Å; N159-Q161 PolarHBondContact O-N 3.31Å; Q161-K163 PolarHBondContact O-N 2.88Å; Q161-R164 WeakPolarHBondContact O-CB 3.31Å; Q161-R164 PolarHBondContact O-N 3.42Å; Q161-R164 VanDerWaalsContact O-N 3.15Å; Q161-Y165 VanDerWaalsContact O-CD2 3.27Å; Q161-Y165 WeakPolarHBondContact O-CD2 3.49Å; Q161-Y165 PolarHBondContact O-N 2.92Å
162	M	91.9	Very high	90.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-58.8	-37.2	172	-69.2	178.1	179.1	0	0	111	L135 A141 L143 V158 N159 N166 V167 F169 R309	L135-M162 HydrophobicContact CD1-CG 3.84Å; L135-M162 HydrophobicContact CD2-CE 4.11Å; L135-M162 HydrophobicContact CD2-CG 3.92Å; A141-M162 HydrophobicContact CB-CE 3.53Å; A141-M162 HydrophobicContact CB-SD 4.33Å; L143-M162 HydrophobicContact CB-CE 4.45Å; L143-M162 HydrophobicContact CD1-CE 4.35Å; V158-M162 HydrophobicContact CG1-CE 3.64Å; V158-M162 HydrophobicContact CG1-CG 4.48Å; V158-M162 HydrophobicContact CG1-SD 4.29Å; V158-M162 WeakPolarHBondContact O-CG 3.22Å; V158-M162 PolarHBondContact O-N 3.49Å; N159-M162 PolarHBondContact O-N 2.99Å; M162-N166 PolarHBondContact O-N 3.2Å; M162-N166 VanDerWaalsContact O-N 3.08Å; M162-V167 PolarHBondContact O-N 2.79Å; M162-V167 VanDerWaalsContact O-N 3.15Å; M162-F169 HydrophobicContact SD-CB 3.99Å; M162-F169 HydrophobicContact SD-CD1 3.92Å; M162-F169 HydrophobicContact SD-CD2 4.21Å; M162-F169 HydrophobicContact SD-CG 3.77Å; M162-R309 PolarHBondContact O-NH2 3.14Å; M162-R309 VanDerWaalsContact O-NH2 3.15Å
163	K	91.2	Very high	91.1	Very high	144 Å²	144	32 Å²	32	63%	0.626	15%	0.147	S	C	*	.	H	α-helix	trans	-61.9	-45.2	174.5	-165.2	174.4	-179.3	177.5	0	112.6	N159 R160 Q161 Y165 N166 R309	N159-K163 WeakPolarHBondContact O-CB 3.32Å; N159-K163 PolarHBondContact O-N 3.29Å; R160-K163 WeakPolarHBondContact O-CB 3.5Å; R160-K163 PolarHBondContact O-N 3.24Å; Q161-K163 PolarHBondContact O-N 2.88Å; K163-Y165 PolarHBondContact O-N 3.48Å; K163-N166 PolarHBondContact O-N 3.42Å; K163-N166 PolarHBondContact O-OD1 3.13Å; K163-R309 VanDerWaalsContact CA-NH2 3.25Å; K163-R309 PolarHBondContact O-NH1 2.87Å
164	R	89.7	Confident	91.8	Very high	106 Å²	106	30.9 Å²	30.9	40%	0.4	14%	0.139	S	C	.	.	H	α-helix	trans	-59.2	-42.5	179.3	-172.9	-175.8	-67.4	146.5	-4.8	112.9	E132 R160 Q161 H464	E132-R164 IonicContact OE1-CZ 3.4Å; E132-R164 IonicContact OE1-NH1 2.76Å; E132-R164 PolarHBondContact OE1-NH1 3.35Å; E132-R164 IonicContact OE2-NH1 3.41Å; E132-R164 PolarHBondContact OE2-NH1 3.2Å; R160-R164 PolarHBondContact O-N 3.03Å; Q161-R164 WeakPolarHBondContact O-CB 3.31Å; Q161-R164 PolarHBondContact O-N 3.42Å; Q161-R164 VanDerWaalsContact O-N 3.15Å; R164-H464 PolarHBondContact NH1-ND1 3.28Å
165	Y	89.4	Confident	92.3	Very high	43 Å²	43	32.2 Å²	32.2	17%	0.169	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	4	-177.9	-58.2	-63.6	0	0	0	114.3	E132 L135 R136 Q161 K163 V167 H464	E132-Y165 WeakPolarHBondContact OE2-CE2 3.41Å; E132-Y165 VanDerWaalsContact OE2-CZ 3.27Å; E132-Y165 PolarHBondContact OE2-OH 3.19Å; L135-Y165 HydrophobicContact CB-CD2 3.98Å; L135-Y165 HydrophobicContact CB-CE2 4.42Å; R136-Y165 HydrophobicContact CB-CD1 4.49Å; R136-Y165 HydrophobicContact CB-CE1 4.27Å; Q161-Y165 VanDerWaalsContact O-CD2 3.27Å; Q161-Y165 WeakPolarHBondContact O-CD2 3.49Å; Q161-Y165 PolarHBondContact O-N 2.92Å; K163-Y165 PolarHBondContact O-N 3.48Å; Y165-V167 PolarHBondContact O-N 3.23Å; Y165-H464 PolarHBondContact OH-N 2.99Å
166	N	91	Very high	92.5	Very high	114 Å²	114	32.2 Å²	32.2	61%	0.61	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	39.6	-177.4	-67.4	-41.7	0	0	0	114.7	M162 K163 P168 R309	M162-N166 PolarHBondContact O-N 3.2Å; M162-N166 VanDerWaalsContact O-N 3.08Å; K163-N166 PolarHBondContact O-N 3.42Å; K163-N166 PolarHBondContact O-OD1 3.13Å; N166-P168 WeakPolarHBondContact O-CD 3.36Å; N166-R309 VanDerWaalsContact C-CD 3.47Å; N166-R309 WeakPolarHBondContact O-CD 3.39Å; N166-R309 PolarHBondContact OD1-NH1 2.77Å; N166-R309 VanDerWaalsContact OD1-NH1 3.14Å
167	V	93.1	Very high	92.7	Very high	6 Å²	6	31.2 Å²	31.2	4%	0.036	14%	0.141	C	C	.	.			trans	-81.6	122	179.7	-179.9	0	0	0	0	110.1	A141 M162 Y165 R309	A141-V167 HydrophobicContact CB-CG1 4.06Å; M162-V167 PolarHBondContact O-N 2.79Å; M162-V167 VanDerWaalsContact O-N 3.15Å; Y165-V167 PolarHBondContact O-N 3.23Å; V167-R309 WeakPolarHBondContact O-CD 3.15Å; V167-R309 PolarHBondContact O-NE 2.89Å
168	P	95.6	Very high	92.8	Very high	10 Å²	10	35.5 Å²	35.5	7%	0.065	15%	0.153	C	C	.	.			trans	-68	138.6	171.1	28.8	-34.2	0	0	0	110.5	D139 G140 A141 N166 T306 L307 R309 P337	D139-P168 VanDerWaalsContact O-CD 3.28Å; D139-P168 WeakPolarHBondContact O-CD 3.43Å; D139-P168 WeakPolarHBondContact O-CG 3.24Å; G140-P168 CarbonylContact C-O 3.53Å; G140-P168 VanDerWaalsContact CA-O 3.24Å; G140-P168 WeakPolarHBondContact CA-O 3.25Å; A141-P168 PolarHBondContact N-O 3.18Å; N166-P168 WeakPolarHBondContact O-CD 3.36Å; P168-T306 WeakPolarHBondContact CB-O 3.45Å; P168-L307 HydrophobicContact CB-CD2 4.45Å; P168-L307 HydrophobicContact CG-CD2 4.24Å; P168-R309 HydrophobicContact CB-CG 4.36Å; P168-P337 HydrophobicContact CG-CG 3.63Å
169	F	96.2	Very high	92.8	Very high	5 Å²	5	42.3 Å²	42.3	2%	0.022	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	151.2	-175	71.2	-84.2	0	0	0	113.2	A141 L143 M162 H196 T312	A141-F169 HydrophobicContact CB-CB 3.97Å; A141-F169 CarbonylContact O-C 3.57Å; A141-F169 WeakPolarHBondContact O-CA 3.44Å; A141-F169 WeakPolarHBondContact O-CB 3.33Å; L143-F169 HydrophobicContact CB-CD2 3.84Å; L143-F169 HydrophobicContact CB-CE2 4.24Å; L143-F169 HydrophobicContact CD2-CD2 4.36Å; L143-F169 HydrophobicContact CD2-CE2 3.94Å; M162-F169 HydrophobicContact SD-CB 3.99Å; M162-F169 HydrophobicContact SD-CD1 3.92Å; M162-F169 HydrophobicContact SD-CD2 4.21Å; M162-F169 HydrophobicContact SD-CG 3.77Å; F169-H196 AromaticContact CZ-NE2 3.67Å; F169-T312 HydrophobicContact CD2-CG2 4.02Å; F169-T312 HydrophobicContact CE2-CG2 3.5Å; F169-T312 VanDerWaalsContact CE2-CG2 3.5Å; F169-T312 HydrophobicContact CZ-CG2 3.95Å
170	L	96.9	Very high	92.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	150.6	170.2	-54.8	-179.7	0	0	0	109.2	A141 V142 L143 T306 P313 F315 A331 V332 L336	A141-L170 PolarHBondContact O-N 3.47Å; V142-L170 CarbonylContact C-O 3.57Å; V142-L170 WeakPolarHBondContact CA-O 3.16Å; L143-L170 PolarHBondContact N-O 2.83Å; L170-T306 HydrophobicContact CD2-CG2 4.04Å; L170-P313 HydrophobicContact CD2-CB 3.96Å; L170-P313 HydrophobicContact CD2-CG 3.65Å; L170-F315 HydrophobicContact CD1-CE2 4.35Å; L170-A331 HydrophobicContact CD1-CB 4.15Å; L170-V332 HydrophobicContact CD1-CG2 4.23Å; L170-L336 HydrophobicContact CD1-CD1 4.16Å; L170-L336 HydrophobicContact CD1-CD2 4.49Å; L170-L336 HydrophobicContact CD1-CG 3.98Å; L170-L336 HydrophobicContact CD2-CD2 4.33Å; L170-L336 HydrophobicContact CG-CD1 4.27Å; L170-L336 HydrophobicContact CG-CD2 3.91Å; L170-L336 HydrophobicContact CG-CG 3.95Å
171	T	97.4	Very high	92.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	133.1	172.4	-60.8	0	0	0	0	110	L143 L145 M190 T312 P313 V314 F315	L143-T171 CarbonylContact O-C 3.48Å; L143-T171 WeakPolarHBondContact O-CA 3.38Å; L145-T171 HydrophobicContact CD1-CG2 3.54Å; L145-T171 HydrophobicContact CG-CG2 3.97Å; T171-M190 HydrophobicContact CG2-CE 4.18Å; T171-M190 WeakPolarHBondContact OG1-CE 3.41Å; T171-T312 VanDerWaalsContact OG1-CG2 3.26Å; T171-T312 WeakPolarHBondContact OG1-CG2 3.27Å; T171-P313 PolarHBondContact N-O 3.36Å; T171-V314 HydrophobicContact CG2-CG1 4.25Å; T171-V314 HydrophobicContact CG2-CG2 4.48Å; T171-V314 WeakPolarHBondContact O-CA 3.36Å; T171-F315 PolarHBondContact O-N 3.19Å
172	F	97.6	Very high	92.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	111.2	175.1	-179.2	-109.3	0	0	0	110.4	L62 V142 L143 V144 L145 N174 F315 L316 L328	L62-F172 HydrophobicContact CD1-CD1 4.49Å; L62-F172 HydrophobicContact CD1-CE1 4.01Å; L62-F172 HydrophobicContact CD1-CZ 4.44Å; L62-F172 HydrophobicContact CD2-CD1 3.94Å; L62-F172 HydrophobicContact CD2-CE1 4.25Å; V142-F172 HydrophobicContact CG1-CB 4.05Å; L143-F172 PolarHBondContact O-N 2.91Å; V144-F172 CarbonylContact C-O 3.6Å; V144-F172 WeakPolarHBondContact CA-O 3.45Å; V144-F172 HydrophobicContact CG1-CD1 4.16Å; V144-F172 HydrophobicContact CG2-CD1 4.44Å; L145-F172 PolarHBondContact N-O 2.87Å; F172-N174 HydrophobicContact CD1-CB 3.97Å; F172-N174 HydrophobicContact CE1-CB 3.76Å; F172-N174 PolarHBondContact O-N 3.07Å; F172-F315 WeakPolarHBondContact CA-O 3.3Å; F172-F315 HydrophobicContact CD2-CB 3.95Å; F172-L316 VanDerWaalsContact CE2-C 3.46Å; F172-L328 HydrophobicContact CB-CD1 4.21Å; F172-L328 HydrophobicContact CB-CD2 4.19Å; F172-L328 HydrophobicContact CD1-CD2 4.25Å; F172-L328 HydrophobicContact CD2-CB 4.38Å; F172-L328 HydrophobicContact CD2-CD1 4.11Å; F172-L328 HydrophobicContact CD2-CD2 3.78Å; F172-L328 HydrophobicContact CD2-CG 4.31Å; F172-L328 HydrophobicContact CE2-CB 4.45Å; F172-L328 HydrophobicContact CE2-CD2 4.16Å; F172-L328 HydrophobicContact CG-CD1 4.42Å; F172-L328 HydrophobicContact CG-CD2 3.81Å
173	I	96.6	Very high	93	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	110.2	173.7	-60.2	172.8	0	0	0	108	A147 L176 P183 A186 F200 V314 F315 L316 G317	A147-I173 HydrophobicContact CB-CG2 3.71Å; I173-L176 HydrophobicContact CB-CD1 4.42Å; I173-L176 HydrophobicContact CG2-CD1 3.94Å; I173-L176 WeakPolarHBondContact O-CD1 3.17Å; I173-P183 HydrophobicContact CD1-CB 4.28Å; I173-A186 HydrophobicContact CD1-CB 3.96Å; I173-A186 HydrophobicContact CG1-CB 4.48Å; I173-F200 HydrophobicContact CD1-CE1 4.03Å; I173-V314 HydrophobicContact CD1-CG1 3.61Å; I173-V314 HydrophobicContact CG1-CG1 3.93Å; I173-F315 PolarHBondContact N-O 3.06Å; I173-L316 WeakPolarHBondContact O-CA 3.33Å; I173-G317 PolarHBondContact O-N 3.01Å
174	N	95	Very high	93.2	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.011	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	167.6	-179.9	-163.6	12.3	0	0	0	111.3	S57 V144 L145 A147 F172 G317 A319	S57-N174 PolarHBondContact O-ND2 3Å; V144-N174 HydrophobicContact CG1-CB 3.64Å; L145-N174 PolarHBondContact O-N 2.94Å; A147-N174 WeakPolarHBondContact CB-O 3.22Å; A147-N174 PolarHBondContact N-O 2.77Å; F172-N174 HydrophobicContact CD1-CB 3.97Å; F172-N174 HydrophobicContact CE1-CB 3.76Å; F172-N174 PolarHBondContact O-N 3.07Å; N174-G317 CarbonylContact C-O 3.57Å; N174-G317 WeakPolarHBondContact CA-O 3.49Å; N174-A319 PolarHBondContact OD1-N 3.34Å
175	K	93.4	Very high	93.4	Very high	31 Å²	31	38 Å²	38	14%	0.135	20%	0.201	C	C	.	.			trans	64.3	35.8	175.8	-53.7	-173.9	170.7	-167.7	0	114.3	D56 D177 R178 G317	D56-K175 VanDerWaalsContact O-CE 3.3Å; D56-K175 WeakPolarHBondContact O-CE 3.47Å; D56-K175 PolarHBondContact O-NZ 2.76Å; K175-D177 WeakPolarHBondContact CA-OD1 3.36Å; K175-D177 PolarHBondContact O-N 2.76Å; K175-D177 VanDerWaalsContact O-N 3.11Å; K175-R178 HydrophobicContact CB-CG 4.25Å; K175-R178 PolarHBondContact O-N 2.71Å; K175-G317 PolarHBondContact N-O 2.64Å
176	L	92.9	Very high	93.6	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-9.9	171.5	-83.8	96.1	0	0	0	113.9	A147 I173 S181 P183 P204 L207 E208 F211 L316 G317	A147-L176 HydrophobicContact CB-CG 4.29Å; I173-L176 HydrophobicContact CB-CD1 4.42Å; I173-L176 HydrophobicContact CG2-CD1 3.94Å; I173-L176 WeakPolarHBondContact O-CD1 3.17Å; L176-S181 PolarHBondContact O-OG 2.78Å; L176-P183 HydrophobicContact CD2-CG 4.45Å; L176-P204 HydrophobicContact CD2-CB 3.64Å; L176-P204 HydrophobicContact CD2-CG 3.99Å; L176-L207 HydrophobicContact CD2-CD2 4.1Å; L176-E208 WeakPolarHBondContact O-CA 3.3Å; L176-E208 PolarHBondContact O-N 3.11Å; L176-F211 HydrophobicContact CB-CD1 4.35Å; L176-F211 HydrophobicContact CB-CE1 4.4Å; L176-F211 HydrophobicContact CB-CG 4.44Å; L176-F211 HydrophobicContact CD2-CE2 4.39Å; L176-L316 HydrophobicContact CD1-CB 3.83Å; L176-L316 HydrophobicContact CD2-CB 4.24Å; L176-G317 WeakPolarHBondContact CD1-O 3.43Å
177	D	91.1	Very high	93.8	Very high	24 Å²	24	30.9 Å²	30.9	13%	0.128	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-8.8	177	60.5	-62.3	0	0	0	114.4	K175 E208 S318 K321	K175-D177 WeakPolarHBondContact CA-OD1 3.36Å; K175-D177 PolarHBondContact O-N 2.76Å; K175-D177 VanDerWaalsContact O-N 3.11Å; D177-E208 WeakPolarHBondContact CA-O 3.49Å; D177-E208 CarbonylContact O-C 3.51Å; D177-S318 WeakPolarHBondContact OD1-CB 3.12Å; D177-S318 PolarHBondContact OD1-OG 2.91Å; D177-K321 HydrophobicContact CB-CD 3.64Å; D177-K321 HydrophobicContact CB-CG 4.1Å
178	R	90.1	Very high	93.9	Very high	121 Å²	121	35.9 Å²	35.9	46%	0.457	19%	0.19	S	C	.	.	S	Bend	trans	-81.6	145	178.4	-75	-170.8	169.5	-174.5	-4.8	112	V148 K175 G180 S181 E208	V148-R178 HydrophobicContact CG2-CB 3.84Å; K175-R178 HydrophobicContact CB-CG 4.25Å; K175-R178 PolarHBondContact O-N 2.71Å; R178-G180 PolarHBondContact O-N 3.3Å; R178-S181 VanDerWaalsContact O-CB 3.3Å; R178-S181 WeakPolarHBondContact O-CB 3.35Å; R178-S181 PolarHBondContact O-N 3.25Å; R178-S181 PolarHBondContact O-OG 2.9Å; R178-E208 WeakPolarHBondContact O-CG 3.24Å
179	L	89.7	Confident	93.7	Very high	145 Å²	145	37.1 Å²	37.1	76%	0.759	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	134.9	170.6	-63	173.5	0	0	0	110.7	E208	L179-E208 HydrophobicContact CD2-CB 4.45Å; L179-E208 VanDerWaalsContact CD2-OE2 3.31Å; L179-E208 WeakPolarHBondContact CD2-OE2 3.2Å
180	G	88.1	Confident	93.6	Very high	45 Å²	45	37 Å²	37	46%	0.464	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	15.3	-176.2	0	0	0	0	0	114.4	R178 N182 E208	R178-G180 PolarHBondContact O-N 3.3Å; G180-N182 PolarHBondContact O-N 2.88Å; G180-E208 PolarHBondContact N-OE1 3.06Å
181	S	91.4	Very high	93.5	Very high	6 Å²	6	40.1 Å²	40.1	4%	0.042	21%	0.206	C	C	.	.			trans	-63.8	122.8	176	63.2	0	0	0	0	110.7	L176 R178	L176-S181 PolarHBondContact O-OG 2.78Å; R178-S181 VanDerWaalsContact O-CB 3.3Å; R178-S181 WeakPolarHBondContact O-CB 3.35Å; R178-S181 PolarHBondContact O-N 3.25Å; R178-S181 PolarHBondContact O-OG 2.9Å
182	N	92.9	Very high	93.2	Very high	71 Å²	71	43.4 Å²	43.4	38%	0.38	23%	0.229	S	C	.	.			trans	-135.8	95.4	176.3	-173.7	-23.1	0	0	0	110.3	A147 G180 A184 R185 A186	A147-N182 PolarHBondContact O-N 3.49Å; G180-N182 PolarHBondContact O-N 2.88Å; N182-A184 PolarHBondContact OD1-N 2.86Å; N182-R185 HydrophobicContact CB-CB 4.14Å; N182-R185 PolarHBondContact O-N 2.8Å; N182-R185 PolarHBondContact OD1-N 3.32Å; N182-A186 PolarHBondContact O-N 2.56Å
183	P	94.4	Very high	92.7	Very high	13 Å²	13	47.9 Å²	47.9	8%	0.084	25%	0.248	C	C	.	.	H	α-helix	trans	-66.5	-36.1	-178.5	26.1	-32.9	0	0	0	112.4	I173 L176 R185 A186 L187 F200 P204 L207	I173-P183 HydrophobicContact CD1-CB 4.28Å; L176-P183 HydrophobicContact CD2-CG 4.45Å; P183-R185 VanDerWaalsContact C-N 3.31Å; P183-R185 PolarHBondContact O-N 3.18Å; P183-A186 WeakPolarHBondContact O-CB 3.43Å; P183-A186 PolarHBondContact O-N 2.96Å; P183-A186 VanDerWaalsContact O-N 3.09Å; P183-L187 PolarHBondContact O-N 3.25Å; P183-F200 HydrophobicContact CB-CE1 4.13Å; P183-F200 HydrophobicContact CB-CZ 3.95Å; P183-P204 HydrophobicContact CG-CG 4.24Å; P183-L207 HydrophobicContact CG-CD2 4.39Å
184	A	93.8	Very high	92.4	Very high	58 Å²	58	48.6 Å²	48.6	48%	0.479	25%	0.252	S	S	.	.	H	α-helix	trans	-61.5	-40	179.8	0	0	0	0	0	111.8	N182 A186 L187 Q188	N182-A184 PolarHBondContact OD1-N 2.86Å; A184-A186 VanDerWaalsContact C-N 3.34Å; A184-A186 PolarHBondContact O-N 2.81Å; A184-L187 PolarHBondContact O-N 3.2Å; A184-Q188 PolarHBondContact O-N 3.11Å
185	R	94.4	Very high	92.2	Very high	102 Å²	102	54.9 Å²	54.9	39%	0.385	29%	0.286	S	S	.	.	H	α-helix	trans	-62.7	-40.4	173.9	-175.4	-176.1	61.5	160.7	-0.2	112.1	V148 N182 P183 Q188 Q189	V148-R185 VanDerWaalsContact C-NH2 3.34Å; V148-R185 PolarHBondContact O-NH2 3.22Å; N182-R185 HydrophobicContact CB-CB 4.14Å; N182-R185 PolarHBondContact O-N 2.8Å; N182-R185 PolarHBondContact OD1-N 3.32Å; P183-R185 VanDerWaalsContact C-N 3.31Å; P183-R185 PolarHBondContact O-N 3.18Å; R185-Q188 PolarHBondContact O-N 2.88Å; R185-Q189 WeakPolarHBondContact O-CG 3.43Å; R185-Q189 PolarHBondContact O-N 3.45Å
186	A	93.5	Very high	92.2	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.008	29%	0.286	C	S	.	.	H	α-helix	trans	-64.5	-41.1	177.1	0	0	0	0	0	111.4	I173 N182 P183 A184 Q189 M190	I173-A186 HydrophobicContact CD1-CB 3.96Å; I173-A186 HydrophobicContact CG1-CB 4.48Å; N182-A186 PolarHBondContact O-N 2.56Å; P183-A186 WeakPolarHBondContact O-CB 3.43Å; P183-A186 PolarHBondContact O-N 2.96Å; P183-A186 VanDerWaalsContact O-N 3.09Å; A184-A186 VanDerWaalsContact C-N 3.34Å; A184-A186 PolarHBondContact O-N 2.81Å; A186-Q189 PolarHBondContact O-N 2.81Å; A186-M190 WeakPolarHBondContact O-CG 3.35Å; A186-M190 PolarHBondContact O-N 2.83Å
187	L	95.1	Very high	92.4	Very high	8 Å²	8	57.2 Å²	57.2	4%	0.042	30%	0.299	C	S	.	.	H	α-helix	trans	-62.5	-45.3	173.8	-178.6	65.2	0	0	0	112.1	P183 A184 Q189 M190 R191 A198 F200 V314	P183-L187 PolarHBondContact O-N 3.25Å; A184-L187 PolarHBondContact O-N 3.2Å; L187-Q189 VanDerWaalsContact C-N 3.29Å; L187-Q189 PolarHBondContact O-N 3.07Å; L187-M190 WeakPolarHBondContact O-CB 3.45Å; L187-M190 PolarHBondContact O-N 2.92Å; L187-M190 VanDerWaalsContact O-N 3.12Å; L187-R191 PolarHBondContact O-N 2.96Å; L187-A198 HydrophobicContact CD1-CB 3.86Å; L187-F200 HydrophobicContact CB-CE1 4.48Å; L187-F200 HydrophobicContact CB-CE2 4.01Å; L187-F200 HydrophobicContact CB-CZ 3.81Å; L187-F200 HydrophobicContact CD2-CD2 3.46Å; L187-F200 VanDerWaalsContact CD2-CD2 3.46Å; L187-F200 HydrophobicContact CD2-CE2 3.35Å; L187-F200 HydrophobicContact CD2-CG 4.12Å; L187-F200 HydrophobicContact CD2-CZ 3.94Å; L187-F200 HydrophobicContact CG-CE2 4.29Å; L187-F200 HydrophobicContact CG-CZ 4.46Å; L187-V314 HydrophobicContact CD1-CG2 3.88Å
188	Q	95.1	Very high	92.6	Very high	111 Å²	111	56.1 Å²	56.1	52%	0.519	29%	0.293	S	S	.	.	H	α-helix	trans	-59.9	-41.9	177.8	-174.6	62	20.3	0	0	111.6	A184 R185 M190 R191 S192	A184-Q188 PolarHBondContact O-N 3.11Å; R185-Q188 PolarHBondContact O-N 2.88Å; Q188-M190 VanDerWaalsContact C-N 3.35Å; Q188-R191 PolarHBondContact O-N 3.33Å; Q188-S192 PolarHBondContact O-N 3.13Å; Q188-S192 PolarHBondContact O-OG 2.83Å; Q188-S192 VanDerWaalsContact O-OG 3.08Å
189	Q	92.7	Very high	92.9	Very high	36 Å²	36	50.3 Å²	50.3	17%	0.168	27%	0.271	C	S	.	.	H	α-helix	trans	-67.1	-33.8	176	-72.2	179.7	-10.6	0	0	112.9	G150 V151 R185 A186 L187 R191 K193	G150-Q189 VanDerWaalsContact CA-OE1 3.25Å; V151-Q189 HydrophobicContact CB-CB 4.1Å; V151-Q189 HydrophobicContact CG2-CB 3.8Å; R185-Q189 WeakPolarHBondContact O-CG 3.43Å; R185-Q189 PolarHBondContact O-N 3.45Å; A186-Q189 PolarHBondContact O-N 2.81Å; L187-Q189 VanDerWaalsContact C-N 3.29Å; L187-Q189 PolarHBondContact O-N 3.07Å; Q189-R191 VanDerWaalsContact C-N 3.34Å; Q189-K193 HydrophobicContact CB-CD 4.5Å; Q189-K193 WeakPolarHBondContact O-CA 3.18Å; Q189-K193 VanDerWaalsContact O-CB 3.24Å; Q189-K193 WeakPolarHBondContact O-CB 3.34Å; Q189-K193 PolarHBondContact O-N 2.95Å
190	M	93.8	Very high	93.3	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-61.5	-44.6	171.9	-74.8	-71.3	-69.2	0	0	111.1	L143 L145 V151 T171 A186 L187 Q188 L194	L143-M190 HydrophobicContact CD2-CE 4.32Å; L145-M190 HydrophobicContact CD1-CG 3.72Å; L145-M190 HydrophobicContact CD1-SD 3.49Å; L145-M190 WeakPolarHBondContact CD1-SD 3.48Å; V151-M190 HydrophobicContact CG2-CG 4Å; V151-M190 HydrophobicContact CG2-SD 3.78Å; T171-M190 HydrophobicContact CG2-CE 4.18Å; T171-M190 WeakPolarHBondContact OG1-CE 3.41Å; A186-M190 WeakPolarHBondContact O-CG 3.35Å; A186-M190 PolarHBondContact O-N 2.83Å; L187-M190 WeakPolarHBondContact O-CB 3.45Å; L187-M190 PolarHBondContact O-N 2.92Å; L187-M190 VanDerWaalsContact O-N 3.12Å; Q188-M190 VanDerWaalsContact C-N 3.35Å; M190-L194 HydrophobicContact CE-CD1 3.85Å; M190-L194 WeakPolarHBondContact O-CB 2.93Å; M190-L194 PolarHBondContact O-N 3.25Å; M190-L194 HydrophobicContact SD-CD1 3.31Å; M190-L194 WeakPolarHBondContact SD-CD1 3.48Å; M190-L194 HydrophobicContact SD-CG 4.23Å
191	R	94.2	Very high	93.7	Very high	67 Å²	67	42 Å²	42	25%	0.253	22%	0.216	S	C	.	.	H	α-helix	trans	-65.9	-46.8	177.8	-68.8	177.3	178.5	170.7	-1.8	112.1	L187 Q188 Q189 N195 H196 A198 E271	L187-R191 PolarHBondContact O-N 2.96Å; Q188-R191 PolarHBondContact O-N 3.33Å; Q189-R191 VanDerWaalsContact C-N 3.34Å; R191-N195 WeakPolarHBondContact O-CA 3.31Å; R191-N195 PolarHBondContact O-N 3.02Å; R191-H196 WeakPolarHBondContact CA-O 3.36Å; R191-A198 VanDerWaalsContact CZ-O 3.23Å; R191-A198 PolarHBondContact NE-O 3.46Å; R191-A198 PolarHBondContact NH2-O 3.38Å; R191-E271 IonicContact CZ-OE1 3.28Å; R191-E271 VanDerWaalsContact CZ-OE1 3.26Å; R191-E271 IonicContact NH1-OE1 3.51Å; R191-E271 PolarHBondContact NH1-OE1 2.95Å; R191-E271 IonicContact NH2-OE1 3.14Å; R191-E271 PolarHBondContact NH2-OE1 3.36Å
192	S	91.1	Very high	93.9	Very high	69 Å²	69	41.8 Å²	41.8	48%	0.483	21%	0.214	S	C	.	.	H	α-helix	trans	-85.4	-39.1	-173.7	65.6	0	0	0	0	115.2	Q188 N195	Q188-S192 PolarHBondContact O-N 3.13Å; Q188-S192 PolarHBondContact O-OG 2.83Å; Q188-S192 VanDerWaalsContact O-OG 3.08Å; S192-N195 PolarHBondContact O-OD1 2.98Å
193	K	87.8	Confident	93.9	Very high	94 Å²	94	39.1 Å²	39.1	41%	0.409	20%	0.2	S	C	.	.	H	α-helix	trans	-90.9	-32.1	-175.5	-62.3	-172.1	174.3	-174.4	0	113.5	V151 Q189	V151-K193 HydrophobicContact CB-CD 4.32Å; V151-K193 HydrophobicContact CG1-CB 4.34Å; V151-K193 HydrophobicContact CG1-CD 4.38Å; Q189-K193 HydrophobicContact CB-CD 4.5Å; Q189-K193 WeakPolarHBondContact O-CA 3.18Å; Q189-K193 VanDerWaalsContact O-CB 3.24Å; Q189-K193 WeakPolarHBondContact O-CB 3.34Å; Q189-K193 PolarHBondContact O-N 2.95Å
194	L	89.5	Confident	94	Very high	15 Å²	15	39.6 Å²	39.6	8%	0.079	20%	0.203	C	C	.	.	S	Bend	trans	-100	-8.4	179.4	-54.8	-171.3	0	0	0	113	V151 T155 M156 N159 M190 H196	V151-L194 HydrophobicContact CG1-CD1 4.36Å; V151-L194 HydrophobicContact CG1-CD2 3.74Å; V151-L194 HydrophobicContact CG1-CG 3.98Å; V151-L194 HydrophobicContact CG2-CD1 4.45Å; V151-L194 HydrophobicContact CG2-CG 4.43Å; T155-L194 HydrophobicContact CG2-CD1 4.48Å; M156-L194 HydrophobicContact CB-CD2 4.28Å; M156-L194 HydrophobicContact CG-CD2 3.74Å; N159-L194 HydrophobicContact CB-CD1 4.3Å; N159-L194 HydrophobicContact CB-CD2 4.27Å; M190-L194 HydrophobicContact CE-CD1 3.85Å; M190-L194 WeakPolarHBondContact O-CB 2.93Å; M190-L194 PolarHBondContact O-N 3.25Å; M190-L194 HydrophobicContact SD-CD1 3.31Å; M190-L194 WeakPolarHBondContact SD-CD1 3.48Å; M190-L194 HydrophobicContact SD-CG 4.23Å; L194-H196 VanDerWaalsContact C-N 3.27Å; L194-H196 VanDerWaalsContact CB-CD2 3.45Å; L194-H196 WeakPolarHBondContact CB-CD2 3.37Å; L194-H196 PolarHBondContact O-N 2.87Å
195	N	91.7	Very high	93.9	Very high	135 Å²	135	37.6 Å²	37.6	72%	0.722	18%	0.184	S	C	*	.			trans	55	41.6	-176.7	-61.8	-30.4	0	0	0	112.7	R191 S192	R191-N195 WeakPolarHBondContact O-CA 3.31Å; R191-N195 PolarHBondContact O-N 3.02Å; S192-N195 PolarHBondContact O-OD1 2.98Å
196	H	93.8	Very high	93.7	Very high	30 Å²	30	34.3 Å²	34.3	14%	0.139	18%	0.181	C	C	.	.			trans	-104.4	134.9	177.9	-76.6	-54.1	0	0	0	111.7	N159 F169 R191 L194 A198	N159-H196 PolarHBondContact ND2-NE2 2.88Å; N159-H196 PolarHBondContact OD1-NE2 2.91Å; F169-H196 AromaticContact CZ-NE2 3.67Å; R191-H196 WeakPolarHBondContact CA-O 3.36Å; L194-H196 VanDerWaalsContact C-N 3.27Å; L194-H196 VanDerWaalsContact CB-CD2 3.45Å; L194-H196 WeakPolarHBondContact CB-CD2 3.37Å; L194-H196 PolarHBondContact O-N 2.87Å; H196-A198 PolarHBondContact O-N 3.2Å; H196-A198 VanDerWaalsContact O-N 3.12Å
197	N	95.3	Very high	93.6	Very high	50 Å²	50	37.4 Å²	37.4	27%	0.267	20%	0.198	S	C	.	.			trans	-74.4	100	164.9	-179.3	23	0	0	0	108.7	C275 S310 F311 T312	N197-C275 PolarHBondContact ND2-O 2.71Å; N197-S310 WeakPolarHBondContact CB-O 2.96Å; N197-F311 CarbonylContact O-C 3.55Å; N197-F311 WeakPolarHBondContact O-CA 3.47Å; N197-T312 PolarHBondContact O-N 3.13Å
198	A	95.8	Very high	93.4	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	144.3	-176.8	0	0	0	0	0	109.6	L187 R191 H196 T312 V314	L187-A198 HydrophobicContact CD1-CB 3.86Å; R191-A198 VanDerWaalsContact CZ-O 3.23Å; R191-A198 PolarHBondContact NE-O 3.46Å; R191-A198 PolarHBondContact NH2-O 3.38Å; H196-A198 PolarHBondContact O-N 3.2Å; H196-A198 VanDerWaalsContact O-N 3.12Å; A198-T312 WeakPolarHBondContact CA-O 3.45Å; A198-V314 HydrophobicContact CB-CG2 3.91Å
199	A	96.6	Very high	93	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	158.7	174.2	0	0	0	0	0	111.1	M201 L272 C275 F311 V314	A199-M201 PolarHBondContact O-N 2.99Å; A199-L272 HydrophobicContact CB-CD1 3.81Å; A199-C275 HydrophobicContact CB-CB 3.95Å; A199-F311 HydrophobicContact CB-CE2 3.74Å; A199-F311 HydrophobicContact CB-CZ 3.89Å; A199-V314 WeakPolarHBondContact O-CB 3.44Å; A199-V314 PolarHBondContact O-N 3Å; A199-V314 VanDerWaalsContact O-N 3.11Å
200	F	97.5	Very high	93	Very high	14 Å²	14	41.6 Å²	41.6	6%	0.061	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	130.5	175.6	-78.7	-58.7	0	0	0	110.6	I173 P183 L187 L217 V314 L316	I173-F200 HydrophobicContact CD1-CE1 4.03Å; P183-F200 HydrophobicContact CB-CE1 4.13Å; P183-F200 HydrophobicContact CB-CZ 3.95Å; L187-F200 HydrophobicContact CB-CE1 4.48Å; L187-F200 HydrophobicContact CB-CE2 4.01Å; L187-F200 HydrophobicContact CB-CZ 3.81Å; L187-F200 HydrophobicContact CD2-CD2 3.46Å; L187-F200 VanDerWaalsContact CD2-CD2 3.46Å; L187-F200 HydrophobicContact CD2-CE2 3.35Å; L187-F200 HydrophobicContact CD2-CG 4.12Å; L187-F200 HydrophobicContact CD2-CZ 3.94Å; L187-F200 HydrophobicContact CG-CE2 4.29Å; L187-F200 HydrophobicContact CG-CZ 4.46Å; F200-L217 HydrophobicContact CB-CD1 4.39Å; F200-L217 WeakPolarHBondContact O-CD1 3.43Å; F200-V314 HydrophobicContact CD1-CB 4.44Å; F200-V314 HydrophobicContact CD1-CG1 4.2Å; F200-V314 HydrophobicContact CE1-CG1 4.19Å; F200-L316 HydrophobicContact CD1-CD2 3.48Å; F200-L316 VanDerWaalsContact CD1-CD2 3.48Å; F200-L316 HydrophobicContact CE1-CD2 3.61Å
201	M	96.4	Very high	92.9	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	24%	0.237	C	C	.	.	S	Bend	trans	-88.5	-18.7	165.3	-62.8	-64.4	-67.9	0	0	111.3	A199 L217 I218 L272 I302 P313 V314 F315 Y335	A199-M201 PolarHBondContact O-N 2.99Å; M201-L217 WeakPolarHBondContact O-CB 3.47Å; M201-L217 PolarHBondContact O-N 2.82Å; M201-I218 HydrophobicContact CE-CD1 3.73Å; M201-I218 HydrophobicContact CE-CG1 3.71Å; M201-I218 HydrophobicContact SD-CD1 4.5Å; M201-L272 HydrophobicContact SD-CD1 3.95Å; M201-L272 HydrophobicContact SD-CD2 4.17Å; M201-I302 HydrophobicContact CE-CD1 3.79Å; M201-I302 HydrophobicContact CE-CG2 4.39Å; M201-I302 HydrophobicContact SD-CD1 4.05Å; M201-P313 HydrophobicContact CG-CB 3.69Å; M201-P313 HydrophobicContact SD-CB 4Å; M201-V314 WeakPolarHBondContact CB-O 3.28Å; M201-V314 PolarHBondContact N-O 2.91Å; M201-F315 HydrophobicContact CB-CD1 4.19Å; M201-F315 HydrophobicContact CB-CE1 3.83Å; M201-F315 HydrophobicContact CB-CE2 4.34Å; M201-F315 HydrophobicContact CB-CZ 3.89Å; M201-F315 HydrophobicContact CE-CZ 4.13Å; M201-F315 HydrophobicContact CG-CD2 4.42Å; M201-F315 HydrophobicContact CG-CE1 4.24Å; M201-F315 HydrophobicContact CG-CE2 3.9Å; M201-F315 HydrophobicContact CG-CZ 3.77Å; M201-Y335 HydrophobicContact CE-CE2 3.9Å
202	Q	95.6	Very high	92.5	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.009	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	154.5	-168.9	-72.7	174	-19.7	0	0	111.1	I214 I215 F315 L316 P327	Q202-I214 HydrophobicContact CG-CD1 4.44Å; Q202-I214 VanDerWaalsContact NE2-CD1 3.34Å; Q202-I215 CarbonylContact C-O 3.53Å; Q202-I215 WeakPolarHBondContact CA-O 3.49Å; Q202-F315 HydrophobicContact CG-CD1 4.24Å; Q202-L316 HydrophobicContact CB-CD1 3.81Å; Q202-L316 HydrophobicContact CB-CD2 4.19Å; Q202-L316 HydrophobicContact CB-CG 3.69Å; Q202-L316 WeakPolarHBondContact O-CD2 3.41Å; Q202-L316 VanDerWaalsContact OE1-N 3.11Å; Q202-L316 PolarHBondContact OE1-O 3.18Å; Q202-P327 VanDerWaalsContact NE2-CB 3.29Å
203	I	94.8	Very high	92.4	Very high	15 Å²	15	41.5 Å²	41.5	8%	0.077	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	137.4	171.1	-63.2	176.2	0	0	0	109.6	I214 I215 L217 A265 H268 L316	I203-I214 CarbonylContact O-C 3.49Å; I203-I214 WeakPolarHBondContact O-CA 3.41Å; I203-I215 HydrophobicContact CB-CB 4.27Å; I203-I215 HydrophobicContact CB-CD1 4.43Å; I203-I215 HydrophobicContact CG2-CD1 4.4Å; I203-I215 PolarHBondContact N-O 3.3Å; I203-I215 PolarHBondContact O-N 3.48Å; I203-L217 HydrophobicContact CD1-CD2 3.76Å; I203-L217 HydrophobicContact CG1-CD1 4.27Å; I203-L217 HydrophobicContact CG1-CD2 4.01Å; I203-L217 HydrophobicContact CG1-CG 4.4Å; I203-A265 HydrophobicContact CD1-CB 4.11Å; I203-H268 HydrophobicContact CD1-CB 3.96Å; I203-H268 HydrophobicContact CG1-CB 4.49Å; I203-L316 VanDerWaalsContact C-CD1 3.44Å
204	P	94.6	Very high	92.7	Very high	23 Å²	23	37 Å²	37	15%	0.149	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	139	178	32.6	-32.7	0	0	0	111.6	L176 P183 G206 L207 F211 L316	L176-P204 HydrophobicContact CD2-CB 3.64Å; L176-P204 HydrophobicContact CD2-CG 3.99Å; P183-P204 HydrophobicContact CG-CG 4.24Å; P204-G206 PolarHBondContact O-N 3.34Å; P204-L207 HydrophobicContact CB-CD2 4.31Å; P204-L207 HydrophobicContact CG-CD2 3.95Å; P204-F211 HydrophobicContact CB-CD2 4.11Å; P204-F211 HydrophobicContact CB-CE2 3.82Å; P204-L316 HydrophobicContact CB-CD1 3.91Å; P204-L316 VanDerWaalsContact CD-CD1 3.46Å; P204-L316 HydrophobicContact CG-CD1 4.13Å; P204-L316 VanDerWaalsContact N-CD1 3.28Å
205	I	92.9	Very high	93	Very high	16 Å²	16	36.3 Å²	36.3	8%	0.082	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	96	170.7	-54.6	174.9	0	0	0	107.8	K212 G213 I215 A222 Y224 L261	I205-K212 PolarHBondContact O-N 3.28Å; I205-G213 WeakPolarHBondContact CB-O 3.29Å; I205-G213 PolarHBondContact N-O 3.4Å; I205-I215 HydrophobicContact CD1-CG1 3.93Å; I205-I215 HydrophobicContact CG1-CD1 4.1Å; I205-I215 HydrophobicContact CG1-CG1 3.79Å; I205-A222 HydrophobicContact CD1-CB 4.02Å; I205-Y224 HydrophobicContact CD1-CE1 3.93Å; I205-Y224 HydrophobicContact CD1-CE2 4.47Å; I205-Y224 HydrophobicContact CG2-CE1 4.47Å; I205-L261 HydrophobicContact CG1-CD1 4.36Å; I205-L261 HydrophobicContact CG2-CD1 4.33Å
206	G	90.7	Very high	93.1	Very high	32 Å²	32	31.3 Å²	31.3	33%	0.33	18%	0.18	S	C	.	.	S	Bend	trans	78.6	170.7	-172.3	0	0	0	0	0	113	P204 F211	P204-G206 PolarHBondContact O-N 3.34Å; G206-F211 WeakPolarHBondContact O-CD2 3.09Å
207	L	91.6	Very high	93.1	Very high	67 Å²	67	30 Å²	30	35%	0.351	17%	0.174	S	C	.	.			trans	-131.1	162.1	178.6	-67	174.1	0	0	0	110.1	L176 P183 P204 G209 N210 F211	L176-L207 HydrophobicContact CD2-CD2 4.1Å; P183-L207 HydrophobicContact CG-CD2 4.39Å; P204-L207 HydrophobicContact CB-CD2 4.31Å; P204-L207 HydrophobicContact CG-CD2 3.95Å; L207-G209 PolarHBondContact O-N 2.96Å; L207-N210 CarbonylContact O-C 3.6Å; L207-N210 WeakPolarHBondContact O-CA 3.4Å; L207-N210 WeakPolarHBondContact O-CB 3.3Å; L207-N210 PolarHBondContact O-N 3.48Å; L207-F211 PolarHBondContact O-N 3.02Å
208	E	90.9	Very high	93	Very high	63 Å²	63	27.6 Å²	27.6	29%	0.294	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	58.5	-122.4	172.1	-44	-177.5	158	0	0	113.3	L176 D177 R178 L179 G180 N210 F211 K321	L176-E208 WeakPolarHBondContact O-CA 3.3Å; L176-E208 PolarHBondContact O-N 3.11Å; D177-E208 WeakPolarHBondContact CA-O 3.49Å; D177-E208 CarbonylContact O-C 3.51Å; R178-E208 WeakPolarHBondContact O-CG 3.24Å; L179-E208 HydrophobicContact CD2-CB 4.45Å; L179-E208 VanDerWaalsContact CD2-OE2 3.31Å; L179-E208 WeakPolarHBondContact CD2-OE2 3.2Å; G180-E208 PolarHBondContact N-OE1 3.06Å; E208-N210 PolarHBondContact O-N 2.95Å; E208-F211 PolarHBondContact O-N 2.76Å; E208-K321 PolarHBondContact O-NZ 2.71Å
209	G	86.5	Confident	92.7	Very high	61 Å²	61	30.5 Å²	30.5	63%	0.629	17%	0.174	S	C	*	.	G	3₁₀ helix	trans	-62.8	-28.4	173.1	0	0	0	0	0	113.4	L207	L207-G209 PolarHBondContact O-N 2.96Å
210	N	90.9	Very high	92.4	Very high	118 Å²	118	35 Å²	35	63%	0.631	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-92.3	4.3	-176.1	-66.3	-36	0	0	0	113.6	L207 E208 K212	L207-N210 CarbonylContact O-C 3.6Å; L207-N210 WeakPolarHBondContact O-CA 3.4Å; L207-N210 WeakPolarHBondContact O-CB 3.3Å; L207-N210 PolarHBondContact O-N 3.48Å; E208-N210 PolarHBondContact O-N 2.95Å; N210-K212 WeakPolarHBondContact O-CG 3.49Å; N210-K212 PolarHBondContact O-N 3.41Å
211	F	91.7	Very high	92.1	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.009	22%	0.215	C	C	.	.			trans	-67.3	104.5	177.6	-179.7	-124.5	0	0	0	110.9	L176 P204 G206 L207 E208 G213 I214 K323	L176-F211 HydrophobicContact CB-CD1 4.35Å; L176-F211 HydrophobicContact CB-CE1 4.4Å; L176-F211 HydrophobicContact CB-CG 4.44Å; L176-F211 HydrophobicContact CD2-CE2 4.39Å; P204-F211 HydrophobicContact CB-CD2 4.11Å; P204-F211 HydrophobicContact CB-CE2 3.82Å; G206-F211 WeakPolarHBondContact O-CD2 3.09Å; L207-F211 PolarHBondContact O-N 3.02Å; E208-F211 PolarHBondContact O-N 2.76Å; F211-G213 WeakPolarHBondContact CE2-O 3.31Å; F211-I214 HydrophobicContact CE2-CG2 3.91Å; F211-I214 HydrophobicContact CZ-CG2 3.8Å; F211-K323 HydrophobicContact CD1-CB 4.41Å; F211-K323 HydrophobicContact CD1-CD 3.93Å; F211-K323 HydrophobicContact CE1-CB 3.62Å; F211-K323 HydrophobicContact CE1-CD 3.93Å; F211-K323 HydrophobicContact CE1-CG 4.38Å; F211-K323 HydrophobicContact CZ-CB 4.25Å; F211-K323 PolarHBondContact O-NZ 2.8Å
212	K	87.1	Confident	91.8	Very high	133 Å²	133	40.2 Å²	40.2	58%	0.578	22%	0.215	S	C	*	.			trans	-103.1	-39.5	-172.5	-74.4	174.1	-172.3	180	0	113.2	I205 N210 K323	I205-K212 PolarHBondContact O-N 3.28Å; N210-K212 WeakPolarHBondContact O-CG 3.49Å; N210-K212 PolarHBondContact O-N 3.41Å; K212-K323 PolarHBondContact O-NZ 2.82Å
213	G	89.1	Confident	91.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.9	-168.9	-173.9	0	0	0	0	0	111.9	I205 F211 I223	I205-G213 WeakPolarHBondContact CB-O 3.29Å; I205-G213 PolarHBondContact N-O 3.4Å; F211-G213 WeakPolarHBondContact CE2-O 3.31Å; G213-I223 CarbonylContact C-O 3.51Å; G213-I223 WeakPolarHBondContact CA-O 3.41Å
214	I	94	Very high	91.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	154.9	178.4	63.9	-178.7	0	0	0	110	Q202 I203 F211 I223 F225 L316 P327	Q202-I214 HydrophobicContact CG-CD1 4.44Å; Q202-I214 VanDerWaalsContact NE2-CD1 3.34Å; I203-I214 CarbonylContact O-C 3.49Å; I203-I214 WeakPolarHBondContact O-CA 3.41Å; F211-I214 HydrophobicContact CE2-CG2 3.91Å; F211-I214 HydrophobicContact CZ-CG2 3.8Å; I214-I223 HydrophobicContact CD1-CD1 4.43Å; I214-I223 HydrophobicContact CG1-CB 3.92Å; I214-I223 HydrophobicContact CG1-CD1 4.3Å; I214-I223 HydrophobicContact CG1-CG1 4.47Å; I214-I223 PolarHBondContact N-O 3.16Å; I214-I223 PolarHBondContact O-N 2.76Å; I214-F225 HydrophobicContact CD1-CE2 4.21Å; I214-F225 HydrophobicContact CD1-CZ 3.95Å; I214-F225 HydrophobicContact CG1-CE2 3.96Å; I214-F225 HydrophobicContact CG1-CZ 4.09Å; I214-F225 HydrophobicContact CG2-CE2 4.49Å; I214-L316 HydrophobicContact CG2-CD1 4.38Å; I214-P327 HydrophobicContact CD1-CB 4.15Å; I214-P327 HydrophobicContact CD1-CG 3.77Å
215	I	94.5	Very high	90.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.9	172.5	-62.3	160.6	0	0	0	107.3	Q202 I203 I205 R221 A222 I257 L261 A265	Q202-I215 CarbonylContact C-O 3.53Å; Q202-I215 WeakPolarHBondContact CA-O 3.49Å; I203-I215 HydrophobicContact CB-CB 4.27Å; I203-I215 HydrophobicContact CB-CD1 4.43Å; I203-I215 HydrophobicContact CG2-CD1 4.4Å; I203-I215 PolarHBondContact N-O 3.3Å; I203-I215 PolarHBondContact O-N 3.48Å; I205-I215 HydrophobicContact CD1-CG1 3.93Å; I205-I215 HydrophobicContact CG1-CD1 4.1Å; I205-I215 HydrophobicContact CG1-CG1 3.79Å; I215-R221 WeakPolarHBondContact CA-O 3.38Å; I215-A222 HydrophobicContact CG1-CB 4.45Å; I215-I257 HydrophobicContact CD1-CG2 3.9Å; I215-I257 HydrophobicContact CG1-CG2 4.43Å; I215-I257 HydrophobicContact CG2-CD1 3.87Å; I215-I257 HydrophobicContact CG2-CG1 3.89Å; I215-L261 HydrophobicContact CD1-CB 3.86Å; I215-L261 HydrophobicContact CD1-CD1 3.94Å; I215-A265 HydrophobicContact CG2-CB 4.32Å
216	D	93.9	Very high	89.9	Confident	30 Å²	30	43.6 Å²	43.6	16%	0.16	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	121.8	170.1	-175.6	-1.1	0	0	0	109.6	I218 E220 R221 I223	D216-I218 PolarHBondContact OD1-N 3.01Å; D216-E220 VanDerWaalsContact O-CA 3.31Å; D216-E220 WeakPolarHBondContact O-CA 3.3Å; D216-E220 PolarHBondContact O-N 2.74Å; D216-E220 VanDerWaalsContact O-N 3.09Å; D216-R221 PolarHBondContact N-O 3.1Å; D216-R221 PolarHBondContact O-N 2.58Å; D216-I223 HydrophobicContact CB-CD1 4.36Å
217	L	94.3	Very high	88.6	Confident	2 Å²	2	44 Å²	44	1%	0.01	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-18.6	-178.3	-62.6	179	0	0	0	113.1	F200 M201 I203 A265 H268 R269 L272	F200-L217 HydrophobicContact CB-CD1 4.39Å; F200-L217 WeakPolarHBondContact O-CD1 3.43Å; M201-L217 WeakPolarHBondContact O-CB 3.47Å; M201-L217 PolarHBondContact O-N 2.82Å; I203-L217 HydrophobicContact CD1-CD2 3.76Å; I203-L217 HydrophobicContact CG1-CD1 4.27Å; I203-L217 HydrophobicContact CG1-CD2 4.01Å; I203-L217 HydrophobicContact CG1-CG 4.4Å; L217-A265 HydrophobicContact CD2-CB 4.09Å; L217-A265 WeakPolarHBondContact CD2-O 3.35Å; L217-H268 HydrophobicContact CD1-CB 3.88Å; L217-R269 WeakPolarHBondContact O-CD 3.22Å; L217-L272 HydrophobicContact CB-CD2 4.4Å
218	I	92.9	Very high	87	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-48.6	-178.3	-54.4	-60.4	0	0	0	110.5	M201 D216 L272 I295 L298 K299 I302	M201-I218 HydrophobicContact CE-CD1 3.73Å; M201-I218 HydrophobicContact CE-CG1 3.71Å; M201-I218 HydrophobicContact SD-CD1 4.5Å; D216-I218 PolarHBondContact OD1-N 3.01Å; I218-L272 HydrophobicContact CD1-CD2 3.66Å; I218-I295 HydrophobicContact CG2-CG2 3.95Å; I218-L298 HydrophobicContact CD1-CD2 3.67Å; I218-L298 HydrophobicContact CD1-CG 4.13Å; I218-L298 HydrophobicContact CG2-CD2 4.47Å; I218-K299 HydrophobicContact CG2-CG 4.05Å; I218-I302 HydrophobicContact CD1-CD1 3.64Å
219	E	90.3	Very high	85.1	Confident	60 Å²	60	50.3 Å²	50.3	28%	0.28	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-4.1	-179.2	-64	-170.3	-176.4	0	0	114.1	R221 K299	E219-R221 HydrophobicContact CB-CG 4.45Å; E219-R221 IonicContact OE2-CZ 3.36Å; E219-R221 IonicContact OE2-NH1 2.77Å; E219-R221 PolarHBondContact OE2-NH1 3.41Å; E219-K299 IonicContact OE1-NZ 3.06Å
220	E	89.3	Confident	82.9	Confident	94 Å²	94	48.1 Å²	48.1	44%	0.439	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	49.2	-176.4	-81.1	175.4	-175.8	0	0	113.8	D216 I257 R269	D216-E220 VanDerWaalsContact O-CA 3.31Å; D216-E220 WeakPolarHBondContact O-CA 3.3Å; D216-E220 PolarHBondContact O-N 2.74Å; D216-E220 VanDerWaalsContact O-N 3.09Å; E220-I257 HydrophobicContact CB-CD1 4.11Å; E220-I257 HydrophobicContact CG-CD1 4.43Å; E220-R269 VanDerWaalsContact OE1-CD 3.29Å; E220-R269 WeakPolarHBondContact OE1-CD 3.12Å; E220-R269 IonicContact OE1-CZ 3.14Å; E220-R269 IonicContact OE1-NE 2.62Å; E220-R269 IonicContact OE1-NH1 3.35Å; E220-R269 PolarHBondContact OE1-NH1 2.83Å; E220-R269 IonicContact OE2-NH1 3.79Å
221	R	91.6	Very high	80.1	Confident	126 Å²	126	50.3 Å²	50.3	48%	0.475	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	142.6	-178	-69.8	169.9	-176.3	170.4	-4.8	111.8	I215 D216 E219	I215-R221 WeakPolarHBondContact CA-O 3.38Å; D216-R221 PolarHBondContact N-O 3.1Å; D216-R221 PolarHBondContact O-N 2.58Å; E219-R221 HydrophobicContact CB-CG 4.45Å; E219-R221 IonicContact OE2-CZ 3.36Å; E219-R221 IonicContact OE2-NH1 2.77Å; E219-R221 PolarHBondContact OE2-NH1 3.41Å
222	A	90.9	Very high	77.2	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	133.1	169.1	0	0	0	0	0	110.1	I205 I215 Y224 Y254 G255 E256	I205-A222 HydrophobicContact CD1-CB 4.02Å; I215-A222 HydrophobicContact CG1-CB 4.45Å; A222-Y224 HydrophobicContact CB-CD2 4.41Å; A222-Y224 HydrophobicContact CB-CE2 3.75Å; A222-Y254 WeakPolarHBondContact O-CA 3.34Å; A222-G255 PolarHBondContact N-O 3.06Å; A222-G255 PolarHBondContact O-N 3.28Å; A222-E256 WeakPolarHBondContact CB-O 3.33Å
223	I	90.3	Very high	74.4	Confident	5 Å²	5	58.4 Å²	58.4	3%	0.026	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	114.4	178.4	-53.5	178.8	0	0	0	107.9	G213 I214 D216 F225 V252 Y254 P327	G213-I223 CarbonylContact C-O 3.51Å; G213-I223 WeakPolarHBondContact CA-O 3.41Å; I214-I223 HydrophobicContact CD1-CD1 4.43Å; I214-I223 HydrophobicContact CG1-CB 3.92Å; I214-I223 HydrophobicContact CG1-CD1 4.3Å; I214-I223 HydrophobicContact CG1-CG1 4.47Å; I214-I223 PolarHBondContact N-O 3.16Å; I214-I223 PolarHBondContact O-N 2.76Å; D216-I223 HydrophobicContact CB-CD1 4.36Å; I223-F225 HydrophobicContact CB-CZ 4.48Å; I223-F225 HydrophobicContact CG2-CE1 3.91Å; I223-F225 HydrophobicContact CG2-CE2 4.16Å; I223-F225 HydrophobicContact CG2-CZ 3.67Å; I223-V252 HydrophobicContact CG2-CG1 3.55Å; I223-Y254 HydrophobicContact CD1-CE1 4.12Å; I223-Y254 HydrophobicContact CG1-CD1 4.06Å; I223-Y254 HydrophobicContact CG1-CE1 4.03Å; I223-P327 HydrophobicContact CD1-CG 3.99Å
224	Y	87.9	Confident	71.7	Confident	45 Å²	45	69.3 Å²	69.3	18%	0.176	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	139.9	173	-65.5	-83.5	0	0	0	110.1	I205 A222 R253 P258	I205-Y224 HydrophobicContact CD1-CE1 3.93Å; I205-Y224 HydrophobicContact CD1-CE2 4.47Å; I205-Y224 HydrophobicContact CG2-CE1 4.47Å; A222-Y224 HydrophobicContact CB-CD2 4.41Å; A222-Y224 HydrophobicContact CB-CE2 3.75Å; Y224-R253 PolarHBondContact N-O 3.44Å; Y224-R253 PolarHBondContact O-N 3.5Å; Y224-P258 WeakPolarHBondContact OH-CG 3.34Å
225	F	84.3	Confident	68.7	Low	9 Å²	9	76 Å²	76	4%	0.039	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	95.3	-178.9	-57.3	-82.5	0	0	0	108.7	I214 I223 Q250 V252 K323 G324 P327	I214-F225 HydrophobicContact CD1-CE2 4.21Å; I214-F225 HydrophobicContact CD1-CZ 3.95Å; I214-F225 HydrophobicContact CG1-CE2 3.96Å; I214-F225 HydrophobicContact CG1-CZ 4.09Å; I214-F225 HydrophobicContact CG2-CE2 4.49Å; I223-F225 HydrophobicContact CB-CZ 4.48Å; I223-F225 HydrophobicContact CG2-CE1 3.91Å; I223-F225 HydrophobicContact CG2-CE2 4.16Å; I223-F225 HydrophobicContact CG2-CZ 3.67Å; F225-Q250 HydrophobicContact CB-CG 4.49Å; F225-V252 HydrophobicContact CD1-CG2 4.48Å; F225-K323 HydrophobicContact CB-CG 3.98Å; F225-K323 HydrophobicContact CD2-CB 3.86Å; F225-K323 HydrophobicContact CD2-CD 4.35Å; F225-K323 HydrophobicContact CD2-CG 3.79Å; F225-K323 HydrophobicContact CE2-CB 4.18Å; F225-K323 HydrophobicContact CG-CB 4.34Å; F225-K323 HydrophobicContact CG-CG 4.04Å; F225-G324 VanDerWaalsContact CZ-N 3.26Å; F225-P327 HydrophobicContact CZ-CG 4.2Å
226	D	75.6	Confident	65.5	Low	68 Å²	68	85.8 Å²	85.8	36%	0.364	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	132.6	-177.8	-68	-34.9	0	0	0	110.4	Q250 I251 R253	D226-Q250 WeakPolarHBondContact O-CG 3.27Å; D226-I251 HydrophobicContact CB-CB 4.45Å; D226-I251 PolarHBondContact N-O 2.9Å; D226-I251 PolarHBondContact O-N 2.9Å; D226-R253 IonicContact OD2-CZ 2.77Å; D226-R253 IonicContact OD2-NE 2.8Å
227	G	63.5	Low	62.4	Low	39 Å²	39	91.6 Å²	91.6	40%	0.402	44%	0.438	S	S	.	.			trans	112.6	127.6	180	0	0	0	0	0	113.3	Q250	G227-Q250 PolarHBondContact O-NE2 3.25Å
228	D	56.7	Low	59.7	Low	147 Å²	147	97.3 Å²	97.3	79%	0.786	48%	0.476	S	S	*	.	S	Bend	trans	-71	-42.6	-178.8	-72.4	-34.2	0	0	0	111.7
229	F	52.8	Low	56.5	Low	117 Å²	117	104.8 Å²	104.8	51%	0.513	52%	0.515	S	S	.	.	S	Bend	trans	-158.7	77.6	173.2	-68	-82.5	0	0	0	109.2	M76 H231	M76-F229 HydrophobicContact SD-CD1 4.35Å; M76-F229 HydrophobicContact SD-CE1 4.08Å; F229-H231 PolarHBondContact O-CD2 3.06Å; F229-H231 PolarHBondContact O-N 3.18Å
230	G	40.3	Very low	53.6	Low	14 Å²	14	110.2 Å²	110.2	14%	0.144	55%	0.545	C	S	.	.			trans	56.5	26.9	164.2	0	0	0	0	0	117.1	F232 G248	G230-F232 PolarHBondContact O-N 2.81Å; G230-G248 WeakPolarHBondContact CA-O 3.44Å
231	H	30.4	Very low	50.8	Low	165 Å²	165	113 Å²	113	76%	0.764	55%	0.551	S	S	*	*			trans	-83.7	110.2	176.2	-89.5	-81.3	0	0	0	109.3	F229 L233	F229-H231 PolarHBondContact O-CD2 3.06Å; F229-H231 PolarHBondContact O-N 3.18Å; H231-L233 PolarHBondContact O-N 3.24Å; H231-L233 VanDerWaalsContact O-N 3.14Å
232	F	31.7	Very low	47.8	Very low	147 Å²	147	115.2 Å²	115.2	65%	0.645	57%	0.573	S	S	*	*			trans	-51.9	111.3	169.4	-86.9	-95.9	0	0	0	110.6	G230 C245	G230-F232 PolarHBondContact O-N 2.81Å; F232-C245 HydrophobicContact CZ-CB 4.5Å
233	L	29	Very low	44.9	Very low	158 Å²	158	124.3 Å²	124.3	83%	0.827	61%	0.607	S	S	*	*			trans	-86.6	105.2	158.3	-87.9	162.5	0	0	0	107.5	H231 D235	H231-L233 PolarHBondContact O-N 3.24Å; H231-L233 VanDerWaalsContact O-N 3.14Å; L233-D235 VanDerWaalsContact C-N 3.32Å; L233-D235 PolarHBondContact O-N 2.82Å
234	R	31.7	Very low	42.2	Very low	229 Å²	229	128.9 Å²	128.9	86%	0.864	63%	0.632	S	S	*	*			trans	-85.9	6.6	-173.6	-152.1	179.7	174.9	-168.7	-3	114.2
235	D	30.3	Very low	39.8	Very low	140 Å²	140	129.1 Å²	129.1	75%	0.749	64%	0.639	S	S	*	*			trans	-115.6	17.8	-162.6	-65.8	-25.5	0	0	0	116.6	L233	L233-D235 VanDerWaalsContact C-N 3.32Å; L233-D235 PolarHBondContact O-N 2.82Å
236	F	26.9	Very low	37.6	Very low	206 Å²	206	138 Å²	138	90%	0.904	67%	0.672	S	S	*	*	S	Bend	trans	-131	126.8	171	-94.3	-93.7	0	0	0	113.9
237	L	28.9	Very low	35.8	Very low	151 Å²	151	137.4 Å²	137.4	79%	0.791	67%	0.674	S	S	*	*			trans	-8.9	135.9	-177.5	-106.7	74.2	0	0	0	121.2	L239	L237-L239 PolarHBondContact O-N 3.42Å
238	P	37.7	Very low	34.6	Very low	122 Å²	122	136.7 Å²	136.7	79%	0.792	67%	0.666	S	S	*	*	S	Bend	trans	-96.4	83.9	-178.2	37.5	-31.2	0	0	0	112.8
239	L	27.4	Very low	34.1	Very low	158 Å²	158	131.7 Å²	131.7	83%	0.827	64%	0.643	S	S	*	*	S	Bend	trans	-143.8	-2.2	172.1	-110.7	133	0	0	0	117.4	L237	L237-L239 PolarHBondContact O-N 3.42Å
240	L	28.3	Very low	34.1	Very low	175 Å²	175	126.9 Å²	126.9	92%	0.916	62%	0.622	S	S	*	*	S	Bend	trans	-140.2	59.4	178.3	-86.4	157.8	0	0	0	111.2
241	W	31.6	Very low	35	Very low	151 Å²	151	129 Å²	129	57%	0.572	63%	0.63	S	S	*	*			trans	-130.4	108.6	173.7	-153.4	-82.2	0	0	0	111.3	W243 C245 I251	W241-W243 PolarHBondContact NE1-O 3.43Å; W241-W243 VanDerWaalsContact NE1-O 3.12Å; W241-C245 PolarHBondContact NE1-SG 2.92Å; W241-I251 HydrophobicContact CH2-CB 4.06Å; W241-I251 HydrophobicContact CH2-CD1 3.88Å; W241-I251 HydrophobicContact CH2-CG1 3.74Å; W241-I251 HydrophobicContact CH2-CG2 3.37Å; W241-I251 HydrophobicContact CZ2-CG1 4.43Å; W241-I251 HydrophobicContact CZ2-CG2 4.33Å; W241-I251 HydrophobicContact CZ3-CG2 3.95Å
242	N	27.1	Very low	36.9	Very low	173 Å²	173	123.1 Å²	123.1	93%	0.925	61%	0.605	S	S	*	*			trans	-117.2	89.7	164.1	-103.1	-4.1	0	0	0	108
243	W	31.7	Very low	39.3	Very low	191 Å²	191	122.3 Å²	122.3	72%	0.723	60%	0.598	S	S	*	*	S	Bend		166.3	156.7	115.4	-139.9	0.6	0	0	0	109.9	W241 C245	W241-W243 PolarHBondContact NE1-O 3.43Å; W241-W243 VanDerWaalsContact NE1-O 3.12Å; W243-C245 PolarHBondContact O-N 3.3Å
244	D	33.3	Very low	42	Very low	102 Å²	102	120.9 Å²	120.9	55%	0.545	58%	0.582	S	S	.	*			trans	-67	103.7	-158	-160.5	-9.1	0	0	0	114.6	R246	D244-R246 VanDerWaalsContact CG-NE 3.28Å; D244-R246 PolarHBondContact O-N 3.16Å; D244-R246 VanDerWaalsContact OD1-CG 3.24Å; D244-R246 WeakPolarHBondContact OD1-CG 3.38Å; D244-R246 IonicContact OD1-NE 2.81Å; D244-R246 PolarHBondContact OD1-NE 3.12Å; D244-R246 IonicContact OD2-CZ 3.99Å; D244-R246 IonicContact OD2-NE 3.43Å; D244-R246 PolarHBondContact OD2-NE 3.29Å; D244-R246 IonicContact OD2-NH2 3.16Å; D244-R246 PolarHBondContact OD2-NH2 3.28Å
245	C	36.1	Very low	44.6	Very low	49 Å²	49	111.3 Å²	111.3	33%	0.331	56%	0.555	S	S	.	*			trans	-83.4	87.2	176.6	-60.7	0	0	0	0	111.6	F232 W241 W243	F232-C245 HydrophobicContact CZ-CB 4.5Å; W241-C245 PolarHBondContact NE1-SG 2.92Å; W243-C245 PolarHBondContact O-N 3.3Å
246	R	38.5	Very low	47.4	Very low	195 Å²	195	112.3 Å²	112.3	74%	0.736	56%	0.555	S	S	*	*			trans	-92.5	-7.8	-179.1	-67.5	-167.9	-174.1	-176.2	7.4	116.4	D244	D244-R246 VanDerWaalsContact CG-NE 3.28Å; D244-R246 PolarHBondContact O-N 3.16Å; D244-R246 VanDerWaalsContact OD1-CG 3.24Å; D244-R246 WeakPolarHBondContact OD1-CG 3.38Å; D244-R246 IonicContact OD1-NE 2.81Å; D244-R246 PolarHBondContact OD1-NE 3.12Å; D244-R246 IonicContact OD2-CZ 3.99Å; D244-R246 IonicContact OD2-NE 3.43Å; D244-R246 PolarHBondContact OD2-NE 3.29Å; D244-R246 IonicContact OD2-NH2 3.16Å; D244-R246 PolarHBondContact OD2-NH2 3.28Å
247	S	37.4	Very low	50.5	Low	56 Å²	56	103.2 Å²	103.2	39%	0.392	52%	0.516	S	S	.	.	S	Bend	trans	-149.2	102.6	177	53.6	0	0	0	0	110.9	S249	S247-S249 WeakPolarHBondContact O-CA 3.44Å; S247-S249 PolarHBondContact O-N 2.79Å; S247-S249 PolarHBondContact O-OG 2.88Å
248	G	39.7	Very low	53.4	Low	24 Å²	24	97.7 Å²	97.7	25%	0.247	49%	0.489	C	S	.	.			trans	26.7	48.2	165.2	0	0	0	0	0	116.5	G230	G230-G248 WeakPolarHBondContact CA-O 3.44Å
249	S	46.3	Very low	56	Low	42 Å²	42	96 Å²	96	29%	0.294	49%	0.486	S	S	.	.			trans	-89.3	136.3	-167.6	-68.1	0	0	0	0	109	S247 I251	S247-S249 WeakPolarHBondContact O-CA 3.44Å; S247-S249 PolarHBondContact O-N 2.79Å; S247-S249 PolarHBondContact O-OG 2.88Å; S249-I251 PolarHBondContact O-N 3.2Å
250	Q	51.6	Low	59	Low	17 Å²	17	97.3 Å²	97.3	8%	0.079	49%	0.488	C	S	.	.			trans	-53	136.5	166.8	-168.8	178.7	34.2	0	0	109.4	Y69 F225 D226 G227 V252 N322 Q326	Y69-Q250 HydrophobicContact CE1-CB 4.45Å; Y69-Q250 PolarHBondContact OH-OE1 3.3Å; Y69-Q250 VanDerWaalsContact OH-OE1 3.14Å; F225-Q250 HydrophobicContact CB-CG 4.49Å; D226-Q250 WeakPolarHBondContact O-CG 3.27Å; G227-Q250 PolarHBondContact O-NE2 3.25Å; Q250-V252 PolarHBondContact O-N 3.28Å; Q250-N322 VanDerWaalsContact CD-O 3.32Å; Q250-N322 PolarHBondContact NE2-O 2.89Å; Q250-N322 PolarHBondContact OE1-O 2.88Å; Q250-Q326 VanDerWaalsContact OE1-NE2 3.15Å
251	I	59.8	Low	62.1	Low	58 Å²	58	91.3 Å²	91.3	30%	0.297	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	110	-178.4	-61.3	178.2	0	0	0	107.5	D226 W241 S249 R253	D226-I251 HydrophobicContact CB-CB 4.45Å; D226-I251 PolarHBondContact N-O 2.9Å; D226-I251 PolarHBondContact O-N 2.9Å; W241-I251 HydrophobicContact CH2-CB 4.06Å; W241-I251 HydrophobicContact CH2-CD1 3.88Å; W241-I251 HydrophobicContact CH2-CG1 3.74Å; W241-I251 HydrophobicContact CH2-CG2 3.37Å; W241-I251 HydrophobicContact CZ2-CG1 4.43Å; W241-I251 HydrophobicContact CZ2-CG2 4.33Å; W241-I251 HydrophobicContact CZ3-CG2 3.95Å; S249-I251 PolarHBondContact O-N 3.2Å; I251-R253 PolarHBondContact O-N 2.79Å
252	V	69.1	Low	65	Low	42 Å²	42	89.7 Å²	89.7	26%	0.255	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	108.6	170.9	-175.8	0	0	0	0	107.6	I223 F225 Q250 Y254 Q326	I223-V252 HydrophobicContact CG2-CG1 3.55Å; F225-V252 HydrophobicContact CD1-CG2 4.48Å; Q250-V252 PolarHBondContact O-N 3.28Å; V252-Y254 HydrophobicContact CG1-CE2 4Å; V252-Q326 HydrophobicContact CG2-CG 4.4Å
253	R	82.4	Confident	68.2	Low	129 Å²	129	84.6 Å²	84.6	49%	0.487	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	117.3	177.6	-175.2	-177.9	64.5	171.7	-1.9	109.7	Y224 D226 I251	Y224-R253 PolarHBondContact N-O 3.44Å; Y224-R253 PolarHBondContact O-N 3.5Å; D226-R253 IonicContact OD2-CZ 2.77Å; D226-R253 IonicContact OD2-NE 2.8Å; I251-R253 PolarHBondContact O-N 2.79Å
254	Y	85.4	Confident	71.1	Confident	128 Å²	128	77.2 Å²	77.2	50%	0.502	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	130.6	168.9	-60.1	-85.4	0	0	0	109.4	A222 I223 V252	A222-Y254 WeakPolarHBondContact O-CA 3.34Å; I223-Y254 HydrophobicContact CD1-CE1 4.12Å; I223-Y254 HydrophobicContact CG1-CD1 4.06Å; I223-Y254 HydrophobicContact CG1-CE1 4.03Å; V252-Y254 HydrophobicContact CG1-CE2 4Å
255	G	86.4	Confident	74	Confident	29 Å²	29	72.6 Å²	72.6	30%	0.299	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	177.8	178.7	0	0	0	0	0	112.1	A222	A222-G255 PolarHBondContact N-O 3.06Å; A222-G255 PolarHBondContact O-N 3.28Å
256	E	90.1	Very high	76.8	Confident	160 Å²	160	73.2 Å²	73.2	75%	0.748	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-71.5	150.5	175.6	-67.5	-172.1	-174.7	0	0	112.1	A222 R262	A222-E256 WeakPolarHBondContact CB-O 3.33Å; E256-R262 IonicContact OE2-NH2 3.96Å
257	I	90.8	Very high	79.5	Confident	15 Å²	15	68.7 Å²	68.7	8%	0.077	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-65.1	129.3	175.7	-60.1	169.3	0	0	0	109.6	I215 E220 A259 R262 A265	I215-I257 HydrophobicContact CD1-CG2 3.9Å; I215-I257 HydrophobicContact CG1-CG2 4.43Å; I215-I257 HydrophobicContact CG2-CD1 3.87Å; I215-I257 HydrophobicContact CG2-CG1 3.89Å; E220-I257 HydrophobicContact CB-CD1 4.11Å; E220-I257 HydrophobicContact CG-CD1 4.43Å; I257-A259 PolarHBondContact O-N 3.29Å; I257-R262 HydrophobicContact CG2-CB 4.26Å; I257-R262 PolarHBondContact O-NH2 3.35Å; I257-A265 HydrophobicContact CD1-CB 4.28Å; I257-A265 HydrophobicContact CG2-CB 4.44Å
258	P	91.1	Very high	82.2	Confident	35 Å²	35	68.9 Å²	68.9	23%	0.227	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-52.4	137.7	173.9	-27.1	35	0	0	0	112.2	Y224 E260 L261 R262	Y224-P258 WeakPolarHBondContact OH-CG 3.34Å; P258-E260 PolarHBondContact O-N 3.3Å; P258-E260 VanDerWaalsContact O-N 3.16Å; P258-L261 PolarHBondContact O-N 3.01Å; P258-R262 PolarHBondContact O-N 3.5Å; P258-R262 VanDerWaalsContact O-N 3.15Å
259	A	91.3	Very high	84.8	Confident	87 Å²	87	69.3 Å²	69.3	72%	0.719	37%	0.369	S	S	*	.	H	α-helix	trans	-55.7	-37.5	-175.4	0	0	0	0	0	113	I257 L261 R262	I257-A259 PolarHBondContact O-N 3.29Å; A259-L261 VanDerWaalsContact C-N 3.31Å; A259-L261 PolarHBondContact O-N 2.86Å; A259-R262 PolarHBondContact O-N 2.8Å
260	E	91.8	Very high	87.1	Confident	186 Å²	186	72.5 Å²	72.5	87%	0.869	38%	0.379	S	S	*	.	H	α-helix	trans	-63.9	-32.8	179	-62.8	174.2	-173.1	0	0	113.3	P258	P258-E260 PolarHBondContact O-N 3.3Å; P258-E260 VanDerWaalsContact O-N 3.16Å
261	L	91.6	Very high	89.2	Confident	48 Å²	48	74 Å²	74	25%	0.251	39%	0.386	S	S	.	.	H	α-helix	trans	-100.2	-3.9	-175.5	-65.1	175.7	0	0	0	112.9	I205 I215 P258 A259 A264 A265	I205-L261 HydrophobicContact CG1-CD1 4.36Å; I205-L261 HydrophobicContact CG2-CD1 4.33Å; I215-L261 HydrophobicContact CD1-CB 3.86Å; I215-L261 HydrophobicContact CD1-CD1 3.94Å; P258-L261 PolarHBondContact O-N 3.01Å; A259-L261 VanDerWaalsContact C-N 3.31Å; A259-L261 PolarHBondContact O-N 2.86Å; L261-A264 PolarHBondContact O-N 2.87Å; L261-A265 WeakPolarHBondContact O-CB 3.48Å; L261-A265 PolarHBondContact O-N 3.13Å
262	R	92.9	Very high	90.9	Very high	118 Å²	118	71.2 Å²	71.2	45%	0.445	37%	0.372	S	S	.	.	H	α-helix	trans	-64.5	-43	-175.5	-171.9	171.3	-65.8	172.9	-1.3	112.5	E256 I257 P258 A259 A265 T266	E256-R262 IonicContact OE2-NH2 3.96Å; I257-R262 HydrophobicContact CG2-CB 4.26Å; I257-R262 PolarHBondContact O-NH2 3.35Å; P258-R262 PolarHBondContact O-N 3.5Å; P258-R262 VanDerWaalsContact O-N 3.15Å; A259-R262 PolarHBondContact O-N 2.8Å; R262-A265 PolarHBondContact O-N 2.99Å; R262-T266 PolarHBondContact O-N 3.28Å; R262-T266 PolarHBondContact O-OG1 2.77Å
263	A	94.4	Very high	92.2	Very high	66 Å²	66	70.2 Å²	70.2	55%	0.545	37%	0.365	S	S	.	.	H	α-helix	trans	-60.9	-49.9	176.2	0	0	0	0	0	111.2	A265 T266 D267	A263-A265 VanDerWaalsContact C-N 3.28Å; A263-A265 PolarHBondContact O-N 2.75Å; A263-T266 PolarHBondContact O-N 3.34Å; A263-T266 VanDerWaalsContact O-N 3.14Å; A263-D267 VanDerWaalsContact O-CG 3.28Å; A263-D267 PolarHBondContact O-N 3.39Å
264	A	92.6	Very high	92.7	Very high	36 Å²	36	68.5 Å²	68.5	30%	0.298	36%	0.362	S	S	.	.	H	α-helix	trans	-60.8	-35.7	177.1	0	0	0	0	0	112.9	L261 H268	L261-A264 PolarHBondContact O-N 2.87Å; A264-H268 WeakPolarHBondContact O-CB 3.41Å; A264-H268 PolarHBondContact O-CD2 3.35Å; A264-H268 PolarHBondContact O-N 2.85Å
265	A	93.9	Very high	93.2	Very high	5 Å²	5	63.1 Å²	63.1	4%	0.041	34%	0.343	C	S	.	.	H	α-helix	trans	-65.1	-43.3	174.9	0	0	0	0	0	112.3	I203 I215 L217 I257 L261 R262 A263 R269	I203-A265 HydrophobicContact CD1-CB 4.11Å; I215-A265 HydrophobicContact CG2-CB 4.32Å; L217-A265 HydrophobicContact CD2-CB 4.09Å; L217-A265 WeakPolarHBondContact CD2-O 3.35Å; I257-A265 HydrophobicContact CD1-CB 4.28Å; I257-A265 HydrophobicContact CG2-CB 4.44Å; L261-A265 WeakPolarHBondContact O-CB 3.48Å; L261-A265 PolarHBondContact O-N 3.13Å; R262-A265 PolarHBondContact O-N 2.99Å; A263-A265 VanDerWaalsContact C-N 3.28Å; A263-A265 PolarHBondContact O-N 2.75Å; A265-R269 VanDerWaalsContact O-CB 3.3Å; A265-R269 WeakPolarHBondContact O-CB 3.36Å; A265-R269 PolarHBondContact O-N 2.95Å
266	T	94.7	Very high	93.6	Very high	62 Å²	62	61.7 Å²	61.7	38%	0.38	33%	0.329	S	S	.	.	H	α-helix	trans	-63.7	-44.5	175.2	-56.5	0	0	0	0	111.5	R262 A263 R269 Q270	R262-T266 PolarHBondContact O-N 3.28Å; R262-T266 PolarHBondContact O-OG1 2.77Å; A263-T266 PolarHBondContact O-N 3.34Å; A263-T266 VanDerWaalsContact O-N 3.14Å; T266-R269 WeakPolarHBondContact O-CB 3.44Å; T266-R269 PolarHBondContact O-N 3.31Å; T266-Q270 PolarHBondContact O-N 3.01Å
267	D	95.3	Very high	93.8	Very high	99 Å²	99	54.7 Å²	54.7	53%	0.529	30%	0.299	S	S	.	.	H	α-helix	trans	-62.2	-47.3	179.9	-64.4	-17.5	0	0	0	111.5	A263 R269 Q270 E271	A263-D267 VanDerWaalsContact O-CG 3.28Å; A263-D267 PolarHBondContact O-N 3.39Å; D267-R269 VanDerWaalsContact C-N 3.31Å; D267-R269 PolarHBondContact O-N 3.32Å; D267-Q270 WeakPolarHBondContact O-CB 3.37Å; D267-Q270 PolarHBondContact O-N 2.88Å; D267-E271 PolarHBondContact O-N 3.39Å
268	H	95.1	Very high	93.9	Very high	60 Å²	60	60.6 Å²	60.6	28%	0.278	33%	0.33	S	S	.	.	H	α-helix	trans	-69.1	-28	176.6	-78.3	-59.3	0	0	0	113.3	I203 L217 A264 E271 L272	I203-H268 HydrophobicContact CD1-CB 3.96Å; I203-H268 HydrophobicContact CG1-CB 4.49Å; L217-H268 HydrophobicContact CD1-CB 3.88Å; A264-H268 WeakPolarHBondContact O-CB 3.41Å; A264-H268 PolarHBondContact O-CD2 3.35Å; A264-H268 PolarHBondContact O-N 2.85Å; H268-E271 IonicContact CE1-OE2 3.66Å; H268-E271 IonicContact ND1-OE2 2.97Å; H268-E271 PolarHBondContact ND1-OE2 2.84Å; H268-L272 VanDerWaalsContact O-CB 3.32Å; H268-L272 WeakPolarHBondContact O-CB 3.25Å; H268-L272 PolarHBondContact O-N 3.11Å
269	R	94.9	Very high	94	Very high	34 Å²	34	59.5 Å²	59.5	13%	0.128	32%	0.323	C	S	.	.	H	α-helix	trans	-66.2	-41.3	171.5	-178.3	179.3	178.5	151.4	12.6	110.7	L217 E220 A265 T266 D267 L272 I273	L217-R269 WeakPolarHBondContact O-CD 3.22Å; E220-R269 VanDerWaalsContact OE1-CD 3.29Å; E220-R269 WeakPolarHBondContact OE1-CD 3.12Å; E220-R269 IonicContact OE1-CZ 3.14Å; E220-R269 IonicContact OE1-NE 2.62Å; E220-R269 IonicContact OE1-NH1 3.35Å; E220-R269 PolarHBondContact OE1-NH1 2.83Å; E220-R269 IonicContact OE2-NH1 3.79Å; A265-R269 VanDerWaalsContact O-CB 3.3Å; A265-R269 WeakPolarHBondContact O-CB 3.36Å; A265-R269 PolarHBondContact O-N 2.95Å; T266-R269 WeakPolarHBondContact O-CB 3.44Å; T266-R269 PolarHBondContact O-N 3.31Å; D267-R269 VanDerWaalsContact C-N 3.31Å; D267-R269 PolarHBondContact O-N 3.32Å; R269-L272 WeakPolarHBondContact O-CB 3.31Å; R269-L272 PolarHBondContact O-N 3.07Å; R269-I273 HydrophobicContact CG-CD1 4.15Å; R269-I273 VanDerWaalsContact O-CG1 3.31Å; R269-I273 WeakPolarHBondContact O-CG1 3.34Å; R269-I273 PolarHBondContact O-N 3.1Å
270	Q	94.3	Very high	94.2	Very high	109 Å²	109	56 Å²	56	51%	0.509	29%	0.292	S	S	.	.	H	α-helix	trans	-62.7	-47.8	173.7	-71.5	180	-12.4	0	0	110.9	T266 D267 L272 I273 E274	T266-Q270 PolarHBondContact O-N 3.01Å; D267-Q270 WeakPolarHBondContact O-CB 3.37Å; D267-Q270 PolarHBondContact O-N 2.88Å; Q270-L272 VanDerWaalsContact C-N 3.27Å; Q270-L272 PolarHBondContact O-N 3.17Å; Q270-I273 PolarHBondContact O-N 3.39Å; Q270-I273 VanDerWaalsContact O-N 3.11Å; Q270-E274 WeakPolarHBondContact O-CG 3.49Å; Q270-E274 PolarHBondContact O-N 2.87Å
271	E	95.4	Very high	94.3	Very high	47 Å²	47	54.1 Å²	54.1	22%	0.22	28%	0.284	C	S	.	.	H	α-helix	trans	-55.9	-41.7	175.1	-172.8	-168.4	174.5	0	0	111.8	R191 D267 H268 E274 C275	R191-E271 IonicContact CZ-OE1 3.28Å; R191-E271 VanDerWaalsContact CZ-OE1 3.26Å; R191-E271 IonicContact NH1-OE1 3.51Å; R191-E271 PolarHBondContact NH1-OE1 2.95Å; R191-E271 IonicContact NH2-OE1 3.14Å; R191-E271 PolarHBondContact NH2-OE1 3.36Å; D267-E271 PolarHBondContact O-N 3.39Å; H268-E271 IonicContact CE1-OE2 3.66Å; H268-E271 IonicContact ND1-OE2 2.97Å; H268-E271 PolarHBondContact ND1-OE2 2.84Å; E271-E274 PolarHBondContact O-N 2.98Å; E271-C275 WeakPolarHBondContact O-CB 3.39Å; E271-C275 PolarHBondContact O-N 3.39Å; E271-C275 PolarHBondContact O-SG 3.46Å
272	L	95.8	Very high	94.4	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-61.9	-47.9	176.4	172.1	63.5	0	0	0	111.5	A199 M201 L217 I218 H268 R269 Q270 E274 C275 V276 F311	A199-L272 HydrophobicContact CB-CD1 3.81Å; M201-L272 HydrophobicContact SD-CD1 3.95Å; M201-L272 HydrophobicContact SD-CD2 4.17Å; L217-L272 HydrophobicContact CB-CD2 4.4Å; I218-L272 HydrophobicContact CD1-CD2 3.66Å; H268-L272 VanDerWaalsContact O-CB 3.32Å; H268-L272 WeakPolarHBondContact O-CB 3.25Å; H268-L272 PolarHBondContact O-N 3.11Å; R269-L272 WeakPolarHBondContact O-CB 3.31Å; R269-L272 PolarHBondContact O-N 3.07Å; Q270-L272 VanDerWaalsContact C-N 3.27Å; Q270-L272 PolarHBondContact O-N 3.17Å; L272-E274 VanDerWaalsContact C-N 3.34Å; L272-E274 PolarHBondContact O-N 2.79Å; L272-C275 PolarHBondContact O-N 2.88Å; L272-V276 HydrophobicContact CD1-CG2 3.97Å; L272-V276 VanDerWaalsContact O-CG2 3.25Å; L272-V276 WeakPolarHBondContact O-CG2 3.35Å; L272-V276 PolarHBondContact O-N 2.9Å; L272-F311 HydrophobicContact CD1-CE1 4.37Å; L272-F311 HydrophobicContact CD1-CE2 4.35Å; L272-F311 HydrophobicContact CD1-CZ 3.59Å
273	I	94.9	Very high	94.4	Very high	21 Å²	21	51.5 Å²	51.5	11%	0.108	28%	0.275	C	S	.	.	H	α-helix	trans	-61.7	-44.4	179.2	-68.4	167.4	0	0	0	110.2	R269 Q270 V276 A277 L283 F287 P293 L298	R269-I273 HydrophobicContact CG-CD1 4.15Å; R269-I273 VanDerWaalsContact O-CG1 3.31Å; R269-I273 WeakPolarHBondContact O-CG1 3.34Å; R269-I273 PolarHBondContact O-N 3.1Å; Q270-I273 PolarHBondContact O-N 3.39Å; Q270-I273 VanDerWaalsContact O-N 3.11Å; I273-V276 PolarHBondContact O-N 2.83Å; I273-A277 WeakPolarHBondContact O-CB 3.31Å; I273-A277 PolarHBondContact O-N 2.96Å; I273-L283 HydrophobicContact CG2-CD2 4.24Å; I273-F287 HydrophobicContact CG2-CD2 3.79Å; I273-F287 HydrophobicContact CG2-CE2 4.25Å; I273-P293 HydrophobicContact CD1-CG 4.11Å; I273-P293 HydrophobicContact CG2-CG 4.49Å; I273-L298 HydrophobicContact CG1-CD1 4.35Å
274	E	94.1	Very high	94.3	Very high	93 Å²	93	49 Å²	49	44%	0.435	26%	0.255	S	S	.	.	H	α-helix	trans	-60.6	-46.6	176.3	-72.8	173.7	-175.8	0	0	112.2	Q270 E271 L272 V276 A277 N278 F287	Q270-E274 WeakPolarHBondContact O-CG 3.49Å; Q270-E274 PolarHBondContact O-N 2.87Å; E271-E274 PolarHBondContact O-N 2.98Å; L272-E274 VanDerWaalsContact C-N 3.34Å; L272-E274 PolarHBondContact O-N 2.79Å; E274-V276 VanDerWaalsContact C-N 3.33Å; E274-V276 PolarHBondContact O-N 3.04Å; E274-A277 PolarHBondContact O-N 2.79Å; E274-N278 PolarHBondContact O-N 3Å; E274-N278 VanDerWaalsContact O-N 3.13Å; E274-N278 PolarHBondContact O-ND2 3.13Å; E274-F287 HydrophobicContact CG-CE1 4.4Å; E274-F287 HydrophobicContact CG-CE2 3.95Å; E274-F287 HydrophobicContact CG-CZ 3.6Å
275	C	95.2	Very high	94.4	Very high	15 Å²	15	53.4 Å²	53.4	10%	0.101	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-40.3	178.9	-70.3	0	0	0	0	111.7	N197 A199 E271 L272 F311	N197-C275 PolarHBondContact ND2-O 2.71Å; A199-C275 HydrophobicContact CB-CB 3.95Å; E271-C275 WeakPolarHBondContact O-CB 3.39Å; E271-C275 PolarHBondContact O-N 3.39Å; E271-C275 PolarHBondContact O-SG 3.46Å; L272-C275 PolarHBondContact O-N 2.88Å; C275-F311 HydrophobicContact CB-CE2 4.13Å
276	V	95.3	Very high	94.4	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-72.9	-39.3	178.1	179.4	0	0	0	0	110.8	L272 I273 E274 N278 S279 D280 L283 A301 I302 F311	L272-V276 HydrophobicContact CD1-CG2 3.97Å; L272-V276 VanDerWaalsContact O-CG2 3.25Å; L272-V276 WeakPolarHBondContact O-CG2 3.35Å; L272-V276 PolarHBondContact O-N 2.9Å; I273-V276 PolarHBondContact O-N 2.83Å; E274-V276 VanDerWaalsContact C-N 3.33Å; E274-V276 PolarHBondContact O-N 3.04Å; V276-N278 PolarHBondContact O-N 2.91Å; V276-S279 CarbonylContact O-C 3.56Å; V276-S279 WeakPolarHBondContact O-CA 3.26Å; V276-S279 PolarHBondContact O-N 3.09Å; V276-S279 PolarHBondContact O-OG 2.87Å; V276-D280 HydrophobicContact CG1-CB 4.38Å; V276-D280 PolarHBondContact O-N 3.14Å; V276-L283 HydrophobicContact CB-CD2 4.17Å; V276-L283 HydrophobicContact CG1-CD2 4.05Å; V276-A301 HydrophobicContact CG1-CB 4.19Å; V276-I302 HydrophobicContact CG1-CG1 4.23Å; V276-I302 HydrophobicContact CG2-CG1 3.94Å; V276-F311 HydrophobicContact CG2-CD1 4.16Å; V276-F311 HydrophobicContact CG2-CD2 4.02Å; V276-F311 HydrophobicContact CG2-CE1 3.9Å; V276-F311 HydrophobicContact CG2-CE2 3.76Å; V276-F311 HydrophobicContact CG2-CG 4.22Å; V276-F311 HydrophobicContact CG2-CZ 3.7Å
277	A	94.9	Very high	94.3	Very high	13 Å²	13	57 Å²	57	11%	0.107	28%	0.281	C	S	.	.	H	α-helix	trans	-56.7	-36.9	175.8	0	0	0	0	0	112.5	I273 E274 S279 L283 F287	I273-A277 WeakPolarHBondContact O-CB 3.31Å; I273-A277 PolarHBondContact O-N 2.96Å; E274-A277 PolarHBondContact O-N 2.79Å; A277-S279 PolarHBondContact O-N 2.98Å; A277-L283 HydrophobicContact CB-CD2 3.97Å; A277-F287 HydrophobicContact CB-CB 4.08Å; A277-F287 HydrophobicContact CB-CD1 4.32Å; A277-F287 HydrophobicContact CB-CG 4.17Å
278	N	93.1	Very high	94.2	Very high	139 Å²	139	59.1 Å²	59.1	74%	0.743	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-15.2	174.6	-69.8	-28.2	0	0	0	113.9	E274 V276	E274-N278 PolarHBondContact O-N 3Å; E274-N278 VanDerWaalsContact O-N 3.13Å; E274-N278 PolarHBondContact O-ND2 3.13Å; V276-N278 PolarHBondContact O-N 2.91Å
279	S	92.7	Very high	94.1	Very high	11 Å²	11	63 Å²	63	8%	0.077	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-24.7	-173.9	64.2	0	0	0	0	114.9	V276 A277 S310	V276-S279 CarbonylContact O-C 3.56Å; V276-S279 WeakPolarHBondContact O-CA 3.26Å; V276-S279 PolarHBondContact O-N 3.09Å; V276-S279 PolarHBondContact O-OG 2.87Å; A277-S279 PolarHBondContact O-N 2.98Å; S279-S310 WeakPolarHBondContact CB-OG 3.33Å
280	D	95.3	Very high	93.8	Very high	14 Å²	14	70.1 Å²	70.1	8%	0.075	34%	0.344	C	S	.	.			trans	-116.6	121.6	179.8	-174.7	83.5	0	0	0	110.4	V276 Q282 L283 G284 A301 R304	V276-D280 HydrophobicContact CG1-CB 4.38Å; V276-D280 PolarHBondContact O-N 3.14Å; D280-Q282 PolarHBondContact OD2-N 2.65Å; D280-L283 HydrophobicContact CB-CB 4.3Å; D280-L283 WeakPolarHBondContact OD2-CB 2.99Å; D280-L283 PolarHBondContact OD2-N 3.22Å; D280-G284 PolarHBondContact O-N 2.61Å; D280-A301 HydrophobicContact CB-CB 4.35Å; D280-R304 IonicContact OD1-CZ 2.84Å; D280-R304 IonicContact OD1-NE 2.61Å; D280-R304 PolarHBondContact OD1-NE 2.96Å; D280-R304 IonicContact OD1-NH2 3.67Å; D280-R304 PolarHBondContact OD1-NH2 3.38Å; D280-R304 IonicContact OD2-CZ 2.98Å; D280-R304 IonicContact OD2-NE 3.62Å; D280-R304 IonicContact OD2-NH2 3.92Å; D280-R304 PolarHBondContact OD2-NH2 3.16Å
281	E	93.6	Very high	93.6	Very high	146 Å²	146	70.9 Å²	70.9	68%	0.682	35%	0.346	S	S	*	.	H	α-helix	trans	-64.4	-43.8	-173.7	-69.7	162.6	-157.3	0	0	112.5	G284 E285	E281-G284 PolarHBondContact O-N 3.29Å; E281-E285 WeakPolarHBondContact O-CG 3.33Å; E281-E285 PolarHBondContact O-N 2.78Å
282	Q	93.6	Very high	93.3	Very high	107 Å²	107	76.1 Å²	76.1	50%	0.5	37%	0.374	S	S	.	.	H	α-helix	trans	-70.7	-39.8	-176.2	-58.1	-177.2	-2.1	0	0	112.1	D280 G284 M286 R304	D280-Q282 PolarHBondContact OD2-N 2.65Å; Q282-G284 VanDerWaalsContact C-N 3.31Å; Q282-M286 WeakPolarHBondContact O-CG 3.35Å; Q282-M286 PolarHBondContact O-N 2.83Å; Q282-R304 VanDerWaalsContact OE1-CZ 3.28Å
283	L	93.3	Very high	93	Very high	5 Å²	5	76.9 Å²	76.9	3%	0.026	38%	0.379	C	S	.	.	H	α-helix	trans	-70.7	-32.6	174.5	-165.6	125.4	0	0	0	111.2	I273 V276 A277 D280 M286 F287 P293 L298 A301	I273-L283 HydrophobicContact CG2-CD2 4.24Å; V276-L283 HydrophobicContact CB-CD2 4.17Å; V276-L283 HydrophobicContact CG1-CD2 4.05Å; A277-L283 HydrophobicContact CB-CD2 3.97Å; D280-L283 HydrophobicContact CB-CB 4.3Å; D280-L283 WeakPolarHBondContact OD2-CB 2.99Å; D280-L283 PolarHBondContact OD2-N 3.22Å; L283-M286 PolarHBondContact O-N 2.7Å; L283-F287 WeakPolarHBondContact O-CB 3.45Å; L283-F287 PolarHBondContact O-N 3Å; L283-P293 HydrophobicContact CD1-CB 4.24Å; L283-L298 HydrophobicContact CD1-CD1 3.81Å; L283-A301 HydrophobicContact CB-CB 3.84Å; L283-A301 HydrophobicContact CD1-CB 3.53Å; L283-A301 HydrophobicContact CG-CB 4.25Å
284	G	92.6	Very high	92.9	Very high	12 Å²	12	78.1 Å²	78.1	12%	0.124	39%	0.389	C	S	.	.	H	α-helix	trans	-59.6	-45.2	171.7	0	0	0	0	0	113.1	D280 E281 Q282 F287 L288	D280-G284 PolarHBondContact O-N 2.61Å; E281-G284 PolarHBondContact O-N 3.29Å; Q282-G284 VanDerWaalsContact C-N 3.31Å; G284-F287 PolarHBondContact O-N 3.09Å; G284-L288 WeakPolarHBondContact O-CG 3.47Å; G284-L288 PolarHBondContact O-N 3.3Å
285	E	93.9	Very high	92.9	Very high	130 Å²	130	77.4 Å²	77.4	61%	0.607	39%	0.388	S	S	*	.	H	α-helix	trans	-60.9	-48	174.4	-73.1	175.5	177.9	0	0	111.9	E281 F287 L288 E289	E281-E285 WeakPolarHBondContact O-CG 3.33Å; E281-E285 PolarHBondContact O-N 2.78Å; E285-F287 VanDerWaalsContact C-N 3.27Å; E285-F287 PolarHBondContact O-N 3.14Å; E285-L288 PolarHBondContact O-N 2.81Å; E285-E289 WeakPolarHBondContact O-CG 3.4Å; E285-E289 PolarHBondContact O-N 2.78Å; E285-E289 VanDerWaalsContact O-N 3.07Å
286	M	93.3	Very high	92.9	Very high	50 Å²	50	80 Å²	80	25%	0.246	41%	0.406	C	S	.	.	H	α-helix	trans	-59.6	-38.9	177	-67.9	-172.5	-161.6	0	0	112.2	Q282 L283 E289 E290 K291	Q282-M286 WeakPolarHBondContact O-CG 3.35Å; Q282-M286 PolarHBondContact O-N 2.83Å; L283-M286 PolarHBondContact O-N 2.7Å; M286-E289 PolarHBondContact O-N 3.01Å; M286-E290 PolarHBondContact O-N 2.94Å; M286-K291 HydrophobicContact CB-CB 4.43Å; M286-K291 WeakPolarHBondContact O-CB 3.15Å; M286-K291 PolarHBondContact O-N 2.76Å
287	F	92.7	Very high	92.8	Very high	91 Å²	91	83 Å²	83	40%	0.399	42%	0.422	S	S	.	.	H	α-helix	trans	-66.8	-42	178.2	-177.6	-100.3	0	0	0	112.1	I273 E274 A277 L283 G284 E285 E289 E290	I273-F287 HydrophobicContact CG2-CD2 3.79Å; I273-F287 HydrophobicContact CG2-CE2 4.25Å; E274-F287 HydrophobicContact CG-CE1 4.4Å; E274-F287 HydrophobicContact CG-CE2 3.95Å; E274-F287 HydrophobicContact CG-CZ 3.6Å; A277-F287 HydrophobicContact CB-CB 4.08Å; A277-F287 HydrophobicContact CB-CD1 4.32Å; A277-F287 HydrophobicContact CB-CG 4.17Å; L283-F287 WeakPolarHBondContact O-CB 3.45Å; L283-F287 PolarHBondContact O-N 3Å; G284-F287 PolarHBondContact O-N 3.09Å; E285-F287 VanDerWaalsContact C-N 3.27Å; E285-F287 PolarHBondContact O-N 3.14Å; F287-E289 VanDerWaalsContact C-N 3.3Å; F287-E289 PolarHBondContact O-N 3.15Å; F287-E290 PolarHBondContact O-N 3.42Å
288	L	93.3	Very high	92.8	Very high	145 Å²	145	82.3 Å²	82.3	76%	0.759	42%	0.417	S	S	*	.	H	α-helix	trans	-65.4	-31.7	176.7	-72.6	172.4	0	0	0	113	G284 E285 E290	G284-L288 WeakPolarHBondContact O-CG 3.47Å; G284-L288 PolarHBondContact O-N 3.3Å; E285-L288 PolarHBondContact O-N 2.81Å; L288-E290 PolarHBondContact O-N 2.5Å
289	E	93.3	Very high	92.9	Very high	142 Å²	142	77.8 Å²	77.8	66%	0.664	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	5.8	173.6	-67.2	-176.3	170.1	0	0	113.4	E285 M286 F287 K291	E285-E289 WeakPolarHBondContact O-CG 3.4Å; E285-E289 PolarHBondContact O-N 2.78Å; E285-E289 VanDerWaalsContact O-N 3.07Å; M286-E289 PolarHBondContact O-N 3.01Å; F287-E289 VanDerWaalsContact C-N 3.3Å; F287-E289 PolarHBondContact O-N 3.15Å; E289-K291 HydrophobicContact CB-CB 4.48Å; E289-K291 PolarHBondContact O-N 3.28Å; E289-K291 VanDerWaalsContact O-N 3.16Å
290	E	88.6	Confident	93	Very high	182 Å²	182	81.6 Å²	81.6	85%	0.85	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	26.3	-174.3	-58.7	-176.5	170.9	0	0	113.4	M286 F287 L288	M286-E290 PolarHBondContact O-N 2.94Å; F287-E290 PolarHBondContact O-N 3.42Å; L288-E290 PolarHBondContact O-N 2.5Å
291	K	91	Very high	93	Very high	126 Å²	126	81 Å²	81	55%	0.548	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-87.3	122.9	-178.4	-161.8	179	-174.3	177.6	0	110.3	M286 E289 P293	M286-K291 HydrophobicContact CB-CB 4.43Å; M286-K291 WeakPolarHBondContact O-CB 3.15Å; M286-K291 PolarHBondContact O-N 2.76Å; E289-K291 HydrophobicContact CB-CB 4.48Å; E289-K291 PolarHBondContact O-N 3.28Å; E289-K291 VanDerWaalsContact O-N 3.16Å; K291-P293 WeakPolarHBondContact O-CD 3.18Å
292	I	88.3	Confident	93.1	Very high	156 Å²	156	74 Å²	74	80%	0.8	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-67.8	119.8	179.6	-58.5	174.4	0	0	0	109.5
293	P	90.2	Very high	93.2	Very high	16 Å²	16	71 Å²	71	10%	0.104	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-71.4	142.1	-179.1	28.5	-34	0	0	0	111.1	I273 L283 K291	I273-P293 HydrophobicContact CD1-CG 4.11Å; I273-P293 HydrophobicContact CG2-CG 4.49Å; L283-P293 HydrophobicContact CD1-CB 4.24Å; K291-P293 WeakPolarHBondContact O-CD 3.18Å
294	S	93.3	Very high	93.3	Very high	47 Å²	47	74.6 Å²	74.6	33%	0.329	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-73.3	162.1	171.1	79	0	0	0	0	111.2	S296 D297 L298	S294-S296 VanDerWaalsContact C-N 3.27Å; S294-S296 PolarHBondContact O-N 2.77Å; S294-S296 PolarHBondContact OG-OG 2.8Å; S294-D297 WeakPolarHBondContact CB-OD2 3.38Å; S294-D297 PolarHBondContact O-N 2.85Å; S294-D297 PolarHBondContact OG-N 2.87Å; S294-D297 PolarHBondContact OG-OD2 3.38Å; S294-L298 WeakPolarHBondContact O-CB 3.27Å; S294-L298 PolarHBondContact O-N 3.05Å
295	I	93.7	Very high	93.5	Very high	79 Å²	79	74.1 Å²	74.1	41%	0.405	37%	0.365	S	S	.	.	H	α-helix	trans	-58.9	-41.1	177.3	-60.2	177.1	0	0	0	110.8	I218 L298 K299	I218-I295 HydrophobicContact CG2-CG2 3.95Å; I295-L298 PolarHBondContact O-N 3.16Å; I295-K299 WeakPolarHBondContact O-CG 3.43Å; I295-K299 PolarHBondContact O-N 2.9Å
296	S	94.3	Very high	93.5	Very high	69 Å²	69	68 Å²	68	48%	0.483	34%	0.336	S	S	.	.	H	α-helix	trans	-66.6	-43.2	179	48.2	0	0	0	0	112.1	S294 L298 K299 I300	S294-S296 VanDerWaalsContact C-N 3.27Å; S294-S296 PolarHBondContact O-N 2.77Å; S294-S296 PolarHBondContact OG-OG 2.8Å; S296-L298 VanDerWaalsContact C-N 3.31Å; S296-L298 PolarHBondContact O-N 2.69Å; S296-K299 PolarHBondContact O-N 2.71Å; S296-I300 VanDerWaalsContact O-CG1 3.27Å; S296-I300 WeakPolarHBondContact O-CG1 3.49Å; S296-I300 PolarHBondContact O-N 3.06Å
297	D	93.5	Very high	93.6	Very high	62 Å²	62	68.3 Å²	68.3	33%	0.332	34%	0.339	S	S	.	.	H	α-helix	trans	-64.5	-41.6	179.6	-58.1	-33.3	0	0	0	110.3	S294 I300 A301	S294-D297 WeakPolarHBondContact CB-OD2 3.38Å; S294-D297 PolarHBondContact O-N 2.85Å; S294-D297 PolarHBondContact OG-N 2.87Å; S294-D297 PolarHBondContact OG-OD2 3.38Å; D297-I300 PolarHBondContact O-N 3.48Å; D297-A301 WeakPolarHBondContact O-CB 3.32Å; D297-A301 PolarHBondContact O-N 3.02Å
298	L	94.6	Very high	93.6	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-63.5	-45.2	176.5	-174.7	59.7	0	0	0	111.8	I218 I273 L283 S294 I295 S296 I300 A301 I302	I218-L298 HydrophobicContact CD1-CD2 3.67Å; I218-L298 HydrophobicContact CD1-CG 4.13Å; I218-L298 HydrophobicContact CG2-CD2 4.47Å; I273-L298 HydrophobicContact CG1-CD1 4.35Å; L283-L298 HydrophobicContact CD1-CD1 3.81Å; S294-L298 WeakPolarHBondContact O-CB 3.27Å; S294-L298 PolarHBondContact O-N 3.05Å; I295-L298 PolarHBondContact O-N 3.16Å; S296-L298 VanDerWaalsContact C-N 3.31Å; S296-L298 PolarHBondContact O-N 2.69Å; L298-I300 VanDerWaalsContact C-N 3.34Å; L298-I300 PolarHBondContact O-N 2.98Å; L298-A301 PolarHBondContact O-N 3.09Å; L298-I302 HydrophobicContact CD1-CD1 4.06Å; L298-I302 HydrophobicContact CD1-CG1 4.3Å; L298-I302 HydrophobicContact CG-CD1 3.96Å; L298-I302 WeakPolarHBondContact O-CB 3.4Å; L298-I302 VanDerWaalsContact O-CG1 3.25Å; L298-I302 WeakPolarHBondContact O-CG1 3.42Å; L298-I302 PolarHBondContact O-N 2.93Å
299	K	94.9	Very high	93.6	Very high	43 Å²	43	65.7 Å²	65.7	19%	0.187	32%	0.32	C	S	.	.	H	α-helix	trans	-61.3	-41.9	176.6	-75.1	-167.2	178	-165.9	0	112	I218 E219 I295 S296 R303 E334 Y335	I218-K299 HydrophobicContact CG2-CG 4.05Å; E219-K299 IonicContact OE1-NZ 3.06Å; I295-K299 WeakPolarHBondContact O-CG 3.43Å; I295-K299 PolarHBondContact O-N 2.9Å; S296-K299 PolarHBondContact O-N 2.71Å; K299-R303 WeakPolarHBondContact O-CB 3.14Å; K299-R303 PolarHBondContact O-N 3.45Å; K299-E334 WeakPolarHBondContact CD-OE2 3.35Å; K299-E334 VanDerWaalsContact CE-OE2 3.29Å; K299-E334 WeakPolarHBondContact CE-OE2 3.45Å; K299-E334 IonicContact NZ-OE1 3.4Å; K299-E334 PolarHBondContact NZ-OE1 2.97Å; K299-E334 IonicContact NZ-OE2 2.8Å; K299-E334 PolarHBondContact NZ-OE2 2.91Å; K299-Y335 HydrophobicContact CB-CE1 4.37Å; K299-Y335 HydrophobicContact CG-CE1 4.43Å
300	I	95.1	Very high	93.7	Very high	92 Å²	92	61.2 Å²	61.2	47%	0.472	31%	0.305	S	S	.	.	H	α-helix	trans	-65.8	-45.1	177.9	-68.3	166	0	0	0	110.8	S296 D297 L298 R303 R304	S296-I300 VanDerWaalsContact O-CG1 3.27Å; S296-I300 WeakPolarHBondContact O-CG1 3.49Å; S296-I300 PolarHBondContact O-N 3.06Å; D297-I300 PolarHBondContact O-N 3.48Å; L298-I300 VanDerWaalsContact C-N 3.34Å; L298-I300 PolarHBondContact O-N 2.98Å; I300-R303 PolarHBondContact O-N 3.39Å; I300-R304 WeakPolarHBondContact O-CG 3.37Å; I300-R304 PolarHBondContact O-N 3.28Å
301	A	95.8	Very high	94	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.3	-45.7	177.8	0	0	0	0	0	111.9	V276 D280 L283 D297 L298 R303 R304 A305	V276-A301 HydrophobicContact CG1-CB 4.19Å; D280-A301 HydrophobicContact CB-CB 4.35Å; L283-A301 HydrophobicContact CB-CB 3.84Å; L283-A301 HydrophobicContact CD1-CB 3.53Å; L283-A301 HydrophobicContact CG-CB 4.25Å; D297-A301 WeakPolarHBondContact O-CB 3.32Å; D297-A301 PolarHBondContact O-N 3.02Å; L298-A301 PolarHBondContact O-N 3.09Å; A301-R303 VanDerWaalsContact C-N 3.33Å; A301-R303 PolarHBondContact O-N 3.11Å; A301-R304 PolarHBondContact O-N 3.46Å; A301-A305 WeakPolarHBondContact O-CB 3.47Å; A301-A305 PolarHBondContact O-N 3.44Å
302	I	96.3	Very high	94.3	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.9	-43.6	176	-68	171.9	0	0	0	110.6	M201 I218 V276 L298 A305 T306 F311 P313 Y335	M201-I302 HydrophobicContact CE-CD1 3.79Å; M201-I302 HydrophobicContact CE-CG2 4.39Å; M201-I302 HydrophobicContact SD-CD1 4.05Å; I218-I302 HydrophobicContact CD1-CD1 3.64Å; V276-I302 HydrophobicContact CG1-CG1 4.23Å; V276-I302 HydrophobicContact CG2-CG1 3.94Å; L298-I302 HydrophobicContact CD1-CD1 4.06Å; L298-I302 HydrophobicContact CD1-CG1 4.3Å; L298-I302 HydrophobicContact CG-CD1 3.96Å; L298-I302 WeakPolarHBondContact O-CB 3.4Å; L298-I302 VanDerWaalsContact O-CG1 3.25Å; L298-I302 WeakPolarHBondContact O-CG1 3.42Å; L298-I302 PolarHBondContact O-N 2.93Å; I302-A305 PolarHBondContact O-N 3.3Å; I302-T306 VanDerWaalsContact O-CB 3.28Å; I302-T306 WeakPolarHBondContact O-CB 3.26Å; I302-T306 PolarHBondContact O-N 2.95Å; I302-T306 PolarHBondContact O-OG1 3.36Å; I302-F311 HydrophobicContact CG2-CD1 4.37Å; I302-F311 HydrophobicContact CG2-CE1 4.19Å; I302-P313 HydrophobicContact CG2-CG 3.94Å; I302-Y335 HydrophobicContact CB-CD1 4.14Å; I302-Y335 HydrophobicContact CB-CE1 3.87Å; I302-Y335 HydrophobicContact CG2-CD1 3.61Å; I302-Y335 HydrophobicContact CG2-CE1 3.6Å; I302-Y335 HydrophobicContact CG2-CG 4.2Å
303	R	95.9	Very high	94.8	Very high	44 Å²	44	39.3 Å²	39.3	17%	0.166	20%	0.201	C	C	.	.	H	α-helix	trans	-58.7	-51.2	175.9	-175.8	180	179	75.5	4.5	110.8	K299 I300 A301 A305 T306 L307 E334 Y335 L336 E341	K299-R303 WeakPolarHBondContact O-CB 3.14Å; K299-R303 PolarHBondContact O-N 3.45Å; I300-R303 PolarHBondContact O-N 3.39Å; A301-R303 VanDerWaalsContact C-N 3.33Å; A301-R303 PolarHBondContact O-N 3.11Å; R303-A305 PolarHBondContact O-N 3.22Å; R303-T306 PolarHBondContact O-N 2.82Å; R303-L307 HydrophobicContact CG-CD1 4.22Å; R303-L307 HydrophobicContact CG-CG 4.45Å; R303-L307 VanDerWaalsContact O-CG 3.3Å; R303-L307 WeakPolarHBondContact O-CG 3.27Å; R303-L307 PolarHBondContact O-N 2.88Å; R303-E334 WeakPolarHBondContact CD-O 3.3Å; R303-E334 PolarHBondContact NH1-O 2.88Å; R303-Y335 HydrophobicContact CB-CD1 4.28Å; R303-L336 PolarHBondContact NH1-O 3.41Å; R303-L336 PolarHBondContact NH2-O 3.02Å; R303-E341 IonicContact CZ-OE1 2.86Å; R303-E341 IonicContact CZ-OE2 3.61Å; R303-E341 IonicContact NE-OE1 3.74Å; R303-E341 IonicContact NH2-OE1 3.71Å; R303-E341 PolarHBondContact NH2-OE1 3.25Å; R303-E341 IonicContact NH2-OE2 3.94Å; R303-E341 PolarHBondContact NH2-OE2 2.96Å
304	R	95.1	Very high	95.1	Very high	81 Å²	81	38.6 Å²	38.6	31%	0.306	20%	0.196	S	C	.	.	H	α-helix	trans	-58.8	-46.4	178.9	-72.2	-168	-59	-135.6	-1.9	112.6	D280 Q282 I300 A301 T306 L307 K308	D280-R304 IonicContact OD1-CZ 2.84Å; D280-R304 IonicContact OD1-NE 2.61Å; D280-R304 PolarHBondContact OD1-NE 2.96Å; D280-R304 IonicContact OD1-NH2 3.67Å; D280-R304 PolarHBondContact OD1-NH2 3.38Å; D280-R304 IonicContact OD2-CZ 2.98Å; D280-R304 IonicContact OD2-NE 3.62Å; D280-R304 IonicContact OD2-NH2 3.92Å; D280-R304 PolarHBondContact OD2-NH2 3.16Å; Q282-R304 VanDerWaalsContact OE1-CZ 3.28Å; I300-R304 WeakPolarHBondContact O-CG 3.37Å; I300-R304 PolarHBondContact O-N 3.28Å; A301-R304 PolarHBondContact O-N 3.46Å; R304-T306 VanDerWaalsContact C-N 3.3Å; R304-T306 PolarHBondContact O-N 2.94Å; R304-L307 PolarHBondContact O-N 3.16Å; R304-K308 WeakPolarHBondContact O-CB 3.33Å; R304-K308 PolarHBondContact O-N 3.43Å
305	A	95.9	Very high	95.3	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.008	18%	0.182	C	C	.	.	H	α-helix	trans	-65.7	-35	-179.8	0	0	0	0	0	112.2	A301 I302 R303 R309 S310 F311	A301-A305 WeakPolarHBondContact O-CB 3.47Å; A301-A305 PolarHBondContact O-N 3.44Å; I302-A305 PolarHBondContact O-N 3.3Å; R303-A305 PolarHBondContact O-N 3.22Å; A305-R309 PolarHBondContact O-N 3.01Å; A305-S310 PolarHBondContact O-N 2.96Å; A305-F311 HydrophobicContact CB-CB 3.54Å; A305-F311 HydrophobicContact CB-CG 4.42Å; A305-F311 PolarHBondContact O-N 3.43Å
306	T	95.4	Very high	95.4	Very high	1 Å²	1	33 Å²	33	1%	0.006	16%	0.163	C	C	.	.	H	α-helix	trans	-67.6	-45.6	174.7	-55	0	0	0	0	111.3	P168 L170 I302 R303 R304 K308 R309 P313	P168-T306 WeakPolarHBondContact CB-O 3.45Å; L170-T306 HydrophobicContact CD2-CG2 4.04Å; I302-T306 VanDerWaalsContact O-CB 3.28Å; I302-T306 WeakPolarHBondContact O-CB 3.26Å; I302-T306 PolarHBondContact O-N 2.95Å; I302-T306 PolarHBondContact O-OG1 3.36Å; R303-T306 PolarHBondContact O-N 2.82Å; R304-T306 VanDerWaalsContact C-N 3.3Å; R304-T306 PolarHBondContact O-N 2.94Å; T306-K308 VanDerWaalsContact C-N 3.34Å; T306-K308 PolarHBondContact O-N 2.93Å; T306-R309 WeakPolarHBondContact O-CA 3.34Å; T306-R309 PolarHBondContact O-N 2.95Å; T306-P313 HydrophobicContact CG2-CG 4.29Å; T306-P313 WeakPolarHBondContact OG1-CD 3.26Å; T306-P313 VanDerWaalsContact OG1-CG 3.26Å; T306-P313 WeakPolarHBondContact OG1-CG 3.48Å
307	L	93.9	Very high	95.3	Very high	58 Å²	58	29.7 Å²	29.7	30%	0.304	14%	0.14	S	C	.	.	H	α-helix	trans	-63.4	-38.3	177.1	-67.2	-177.7	0	0	0	112.2	P168 R303 R304 R309 P337	P168-L307 HydrophobicContact CB-CD2 4.45Å; P168-L307 HydrophobicContact CG-CD2 4.24Å; R303-L307 HydrophobicContact CG-CD1 4.22Å; R303-L307 HydrophobicContact CG-CG 4.45Å; R303-L307 VanDerWaalsContact O-CG 3.3Å; R303-L307 WeakPolarHBondContact O-CG 3.27Å; R303-L307 PolarHBondContact O-N 2.88Å; R304-L307 PolarHBondContact O-N 3.16Å; L307-R309 PolarHBondContact O-N 2.91Å; L307-P337 HydrophobicContact CD2-CB 3.56Å; L307-P337 HydrophobicContact CD2-CG 3.9Å
308	K	93.4	Very high	95.3	Very high	138 Å²	138	26.8 Å²	26.8	60%	0.6	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-10.6	173.8	-166.5	174.3	179.1	-177.5	0	112.9	R304 T306 S310	R304-K308 WeakPolarHBondContact O-CB 3.33Å; R304-K308 PolarHBondContact O-N 3.43Å; T306-K308 VanDerWaalsContact C-N 3.34Å; T306-K308 PolarHBondContact O-N 2.93Å; K308-S310 PolarHBondContact O-N 3.1Å
309	R	93.3	Very high	95.1	Very high	43 Å²	43	26.8 Å²	26.8	16%	0.162	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	24	-173.3	-53.6	179.3	67.6	-136	-0.2	113.6	M162 K163 N166 V167 P168 A305 T306 L307	M162-R309 PolarHBondContact O-NH2 3.14Å; M162-R309 VanDerWaalsContact O-NH2 3.15Å; K163-R309 VanDerWaalsContact CA-NH2 3.25Å; K163-R309 PolarHBondContact O-NH1 2.87Å; N166-R309 VanDerWaalsContact C-CD 3.47Å; N166-R309 WeakPolarHBondContact O-CD 3.39Å; N166-R309 PolarHBondContact OD1-NH1 2.77Å; N166-R309 VanDerWaalsContact OD1-NH1 3.14Å; V167-R309 WeakPolarHBondContact O-CD 3.15Å; V167-R309 PolarHBondContact O-NE 2.89Å; P168-R309 HydrophobicContact CB-CG 4.36Å; A305-R309 PolarHBondContact O-N 3.01Å; T306-R309 WeakPolarHBondContact O-CA 3.34Å; T306-R309 PolarHBondContact O-N 2.95Å; L307-R309 PolarHBondContact O-N 2.91Å
310	S	94.6	Very high	94.8	Very high	48 Å²	48	28.7 Å²	28.7	34%	0.336	14%	0.136	S	C	.	.	S	Bend	trans	-89.1	-19.9	175.3	-169.8	0	0	0	0	112	N197 S279 A305 K308	N197-S310 WeakPolarHBondContact CB-O 2.96Å; S279-S310 WeakPolarHBondContact CB-OG 3.33Å; A305-S310 PolarHBondContact O-N 2.96Å; K308-S310 PolarHBondContact O-N 3.1Å
311	F	96.4	Very high	94.4	Very high	1 Å²	1	28.1 Å²	28.1	0%	0.004	13%	0.13	C	C	.	.			trans	-132.2	142.3	176.2	179.7	-104.4	0	0	0	110	N197 A199 L272 C275 V276 I302 A305 P313	N197-F311 CarbonylContact O-C 3.55Å; N197-F311 WeakPolarHBondContact O-CA 3.47Å; A199-F311 HydrophobicContact CB-CE2 3.74Å; A199-F311 HydrophobicContact CB-CZ 3.89Å; L272-F311 HydrophobicContact CD1-CE1 4.37Å; L272-F311 HydrophobicContact CD1-CE2 4.35Å; L272-F311 HydrophobicContact CD1-CZ 3.59Å; C275-F311 HydrophobicContact CB-CE2 4.13Å; V276-F311 HydrophobicContact CG2-CD1 4.16Å; V276-F311 HydrophobicContact CG2-CD2 4.02Å; V276-F311 HydrophobicContact CG2-CE1 3.9Å; V276-F311 HydrophobicContact CG2-CE2 3.76Å; V276-F311 HydrophobicContact CG2-CG 4.22Å; V276-F311 HydrophobicContact CG2-CZ 3.7Å; I302-F311 HydrophobicContact CG2-CD1 4.37Å; I302-F311 HydrophobicContact CG2-CE1 4.19Å; A305-F311 HydrophobicContact CB-CB 3.54Å; A305-F311 HydrophobicContact CB-CG 4.42Å; A305-F311 PolarHBondContact O-N 3.43Å; F311-P313 HydrophobicContact CD1-CG 3.96Å; F311-P313 HydrophobicContact CE1-CB 4.12Å; F311-P313 HydrophobicContact CE1-CG 3.8Å
312	T	96.8	Very high	94	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.012	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	108.1	177	-55.7	0	0	0	0	110.4	F169 T171 N197 A198	F169-T312 HydrophobicContact CD2-CG2 4.02Å; F169-T312 HydrophobicContact CE2-CG2 3.5Å; F169-T312 VanDerWaalsContact CE2-CG2 3.5Å; F169-T312 HydrophobicContact CZ-CG2 3.95Å; T171-T312 VanDerWaalsContact OG1-CG2 3.26Å; T171-T312 WeakPolarHBondContact OG1-CG2 3.27Å; N197-T312 PolarHBondContact O-N 3.13Å; A198-T312 WeakPolarHBondContact CA-O 3.45Å
313	P	97.3	Very high	93.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	131.7	176.6	-18.4	30.7	0	0	0	111.8	L170 T171 M201 I302 T306 F311 F315	L170-P313 HydrophobicContact CD2-CB 3.96Å; L170-P313 HydrophobicContact CD2-CG 3.65Å; T171-P313 PolarHBondContact N-O 3.36Å; M201-P313 HydrophobicContact CG-CB 3.69Å; M201-P313 HydrophobicContact SD-CB 4Å; I302-P313 HydrophobicContact CG2-CG 3.94Å; T306-P313 HydrophobicContact CG2-CG 4.29Å; T306-P313 WeakPolarHBondContact OG1-CD 3.26Å; T306-P313 VanDerWaalsContact OG1-CG 3.26Å; T306-P313 WeakPolarHBondContact OG1-CG 3.48Å; F311-P313 HydrophobicContact CD1-CG 3.96Å; F311-P313 HydrophobicContact CE1-CB 4.12Å; F311-P313 HydrophobicContact CE1-CG 3.8Å; P313-F315 HydrophobicContact CB-CD2 4.48Å; P313-F315 HydrophobicContact CB-CE2 3.8Å
314	V	97.5	Very high	93.3	Very high	1 Å²	1	28 Å²	28	1%	0.006	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	116	-180	-173.4	0	0	0	0	111.5	T171 I173 L187 A198 A199 F200 M201	T171-V314 HydrophobicContact CG2-CG1 4.25Å; T171-V314 HydrophobicContact CG2-CG2 4.48Å; T171-V314 WeakPolarHBondContact O-CA 3.36Å; I173-V314 HydrophobicContact CD1-CG1 3.61Å; I173-V314 HydrophobicContact CG1-CG1 3.93Å; L187-V314 HydrophobicContact CD1-CG2 3.88Å; A198-V314 HydrophobicContact CB-CG2 3.91Å; A199-V314 WeakPolarHBondContact O-CB 3.44Å; A199-V314 PolarHBondContact O-N 3Å; A199-V314 VanDerWaalsContact O-N 3.11Å; F200-V314 HydrophobicContact CD1-CB 4.44Å; F200-V314 HydrophobicContact CD1-CG1 4.2Å; F200-V314 HydrophobicContact CE1-CG1 4.19Å; M201-V314 WeakPolarHBondContact CB-O 3.28Å; M201-V314 PolarHBondContact N-O 2.91Å
315	F	97.3	Very high	93.1	Very high	9 Å²	9	24.2 Å²	24.2	4%	0.039	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	162	175.6	-68	-90.1	0	0	0	111.1	L170 T171 F172 I173 M201 Q202 P313 L328 A331 Y335	L170-F315 HydrophobicContact CD1-CE2 4.35Å; T171-F315 PolarHBondContact O-N 3.19Å; F172-F315 WeakPolarHBondContact CA-O 3.3Å; F172-F315 HydrophobicContact CD2-CB 3.95Å; I173-F315 PolarHBondContact N-O 3.06Å; M201-F315 HydrophobicContact CB-CD1 4.19Å; M201-F315 HydrophobicContact CB-CE1 3.83Å; M201-F315 HydrophobicContact CB-CE2 4.34Å; M201-F315 HydrophobicContact CB-CZ 3.89Å; M201-F315 HydrophobicContact CE-CZ 4.13Å; M201-F315 HydrophobicContact CG-CD2 4.42Å; M201-F315 HydrophobicContact CG-CE1 4.24Å; M201-F315 HydrophobicContact CG-CE2 3.9Å; M201-F315 HydrophobicContact CG-CZ 3.77Å; Q202-F315 HydrophobicContact CG-CD1 4.24Å; P313-F315 HydrophobicContact CB-CD2 4.48Å; P313-F315 HydrophobicContact CB-CE2 3.8Å; F315-L328 HydrophobicContact CB-CD1 4.27Å; F315-L328 HydrophobicContact CD2-CD1 4.41Å; F315-L328 HydrophobicContact CG-CD1 4.35Å; F315-A331 HydrophobicContact CD1-CB 4.29Å; F315-A331 HydrophobicContact CD2-CB 4.35Å; F315-A331 HydrophobicContact CE1-CB 3.56Å; F315-A331 HydrophobicContact CE2-CB 3.6Å; F315-A331 HydrophobicContact CZ-CB 3.17Å; F315-Y335 HydrophobicContact CZ-CD2 4.2Å; F315-Y335 HydrophobicContact CZ-CE2 4.01Å
316	L	95.4	Very high	92.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	147.7	-177.3	9.5	145.3	0	0	0	111.4	F172 I173 L176 F200 Q202 I203 P204 I214	F172-L316 VanDerWaalsContact CE2-C 3.46Å; I173-L316 WeakPolarHBondContact O-CA 3.33Å; L176-L316 HydrophobicContact CD1-CB 3.83Å; L176-L316 HydrophobicContact CD2-CB 4.24Å; F200-L316 HydrophobicContact CD1-CD2 3.48Å; F200-L316 VanDerWaalsContact CD1-CD2 3.48Å; F200-L316 HydrophobicContact CE1-CD2 3.61Å; Q202-L316 HydrophobicContact CB-CD1 3.81Å; Q202-L316 HydrophobicContact CB-CD2 4.19Å; Q202-L316 HydrophobicContact CB-CG 3.69Å; Q202-L316 WeakPolarHBondContact O-CD2 3.41Å; Q202-L316 VanDerWaalsContact OE1-N 3.11Å; Q202-L316 PolarHBondContact OE1-O 3.18Å; I203-L316 VanDerWaalsContact C-CD1 3.44Å; P204-L316 HydrophobicContact CB-CD1 3.91Å; P204-L316 VanDerWaalsContact CD-CD1 3.46Å; P204-L316 HydrophobicContact CG-CD1 4.13Å; P204-L316 VanDerWaalsContact N-CD1 3.28Å; I214-L316 HydrophobicContact CG2-CD1 4.38Å
317	G	93.6	Very high	92.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.124	C	C	.	.			trans	-177.5	-173.3	169.8	0	0	0	0	0	114.7	I173 N174 K175 L176 K323	I173-G317 PolarHBondContact O-N 3.01Å; N174-G317 CarbonylContact C-O 3.57Å; N174-G317 WeakPolarHBondContact CA-O 3.49Å; K175-G317 PolarHBondContact N-O 2.64Å; L176-G317 WeakPolarHBondContact CD1-O 3.43Å; G317-K323 CarbonylContact C-O 3.51Å; G317-K323 VanDerWaalsContact CA-O 3.3Å; G317-K323 WeakPolarHBondContact CA-O 2.96Å
318	S	93.4	Very high	92.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.112	C	C	.	.	B	Isolated β-bridge	trans	-132.2	106.7	169.5	174.4	0	0	0	0	108.2	D177 L320 K321 N322 K323	D177-S318 WeakPolarHBondContact OD1-CB 3.12Å; D177-S318 PolarHBondContact OD1-OG 2.91Å; S318-L320 PolarHBondContact O-N 3.12Å; S318-K321 PolarHBondContact O-N 2.91Å; S318-K321 PolarHBondContact OG-N 2.87Å; S318-N322 PolarHBondContact O-N 3.5Å; S318-N322 VanDerWaalsContact O-N 3.15Å; S318-K323 CarbonylContact C-O 3.54Å; S318-K323 PolarHBondContact N-O 3.35Å; S318-K323 PolarHBondContact O-N 2.68Å
319	A	90.8	Very high	92.7	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-32.3	176.4	0	0	0	0	0	111.7	T61 L62 R65 N174 N322	T61-A319 HydrophobicContact CG2-CB 4.05Å; L62-A319 HydrophobicContact CB-CB 4.3Å; L62-A319 HydrophobicContact CD1-CB 4.4Å; R65-A319 WeakPolarHBondContact CG-O 3.16Å; N174-A319 PolarHBondContact OD1-N 3.34Å; A319-N322 PolarHBondContact O-N 2.77Å
320	L	87.8	Confident	92.6	Very high	83 Å²	83	16 Å²	16	44%	0.435	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-49.1	178.7	-176.8	65.3	0	0	0	111.5	E78 S318 N322	E78-L320 WeakPolarHBondContact OE1-CD1 3.3Å; S318-L320 PolarHBondContact O-N 3.12Å; L320-N322 PolarHBondContact O-N 3.01Å
321	K	86.8	Confident	92.7	Very high	80 Å²	80	13.9 Å²	13.9	35%	0.348	7%	0.068	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	13.7	179.5	-67.7	-167.4	-179.9	171	0	113.9	D177 E208 S318 K323	D177-K321 HydrophobicContact CB-CD 3.64Å; D177-K321 HydrophobicContact CB-CG 4.1Å; E208-K321 PolarHBondContact O-NZ 2.71Å; S318-K321 PolarHBondContact O-N 2.91Å; S318-K321 PolarHBondContact OG-N 2.87Å; K321-K323 WeakPolarHBondContact O-CG 3.35Å; K321-K323 PolarHBondContact O-N 3.28Å
322	N	86.9	Confident	92.6	Very high	8 Å²	8	14 Å²	14	4%	0.043	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	43.2	176.6	-71.9	-33.8	0	0	0	113.8	R65 Y69 Q250 S318 A319 L320	R65-N322 VanDerWaalsContact CD-OD1 3.3Å; R65-N322 WeakPolarHBondContact CD-OD1 3.36Å; R65-N322 VanDerWaalsContact NH1-CG 3.26Å; R65-N322 PolarHBondContact NH1-ND2 3.14Å; R65-N322 PolarHBondContact NH1-OD1 2.62Å; Y69-N322 WeakPolarHBondContact OH-CB 3.4Å; Y69-N322 PolarHBondContact OH-OD1 2.89Å; Q250-N322 VanDerWaalsContact CD-O 3.32Å; Q250-N322 PolarHBondContact NE2-O 2.89Å; Q250-N322 PolarHBondContact OE1-O 2.88Å; S318-N322 PolarHBondContact O-N 3.5Å; S318-N322 VanDerWaalsContact O-N 3.15Å; A319-N322 PolarHBondContact O-N 2.77Å; L320-N322 PolarHBondContact O-N 3.01Å
323	K	89.4	Confident	92.5	Very high	35 Å²	35	15 Å²	15	15%	0.152	7%	0.074	C	C	.	.	B	Isolated β-bridge	trans	-128.8	133.6	-178	-67.2	-178.9	-169.9	-164.5	0	111.5	F211 K212 F225 G317 S318 K321	F211-K323 HydrophobicContact CD1-CB 4.41Å; F211-K323 HydrophobicContact CD1-CD 3.93Å; F211-K323 HydrophobicContact CE1-CB 3.62Å; F211-K323 HydrophobicContact CE1-CD 3.93Å; F211-K323 HydrophobicContact CE1-CG 4.38Å; F211-K323 HydrophobicContact CZ-CB 4.25Å; F211-K323 PolarHBondContact O-NZ 2.8Å; K212-K323 PolarHBondContact O-NZ 2.82Å; F225-K323 HydrophobicContact CB-CG 3.98Å; F225-K323 HydrophobicContact CD2-CB 3.86Å; F225-K323 HydrophobicContact CD2-CD 4.35Å; F225-K323 HydrophobicContact CD2-CG 3.79Å; F225-K323 HydrophobicContact CE2-CB 4.18Å; F225-K323 HydrophobicContact CG-CB 4.34Å; F225-K323 HydrophobicContact CG-CG 4.04Å; G317-K323 CarbonylContact C-O 3.51Å; G317-K323 VanDerWaalsContact CA-O 3.3Å; G317-K323 WeakPolarHBondContact CA-O 2.96Å; S318-K323 CarbonylContact C-O 3.54Å; S318-K323 PolarHBondContact N-O 3.35Å; S318-K323 PolarHBondContact O-N 2.68Å; K321-K323 WeakPolarHBondContact O-CG 3.35Å; K321-K323 PolarHBondContact O-N 3.28Å
324	G	88	Confident	92.3	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.091	C	C	.	.	S	Bend	trans	81.9	7.6	175	0	0	0	0	0	115.9	F225	F225-G324 VanDerWaalsContact CZ-N 3.26Å
325	V	91.1	Very high	92.2	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-79.2	-40.6	178.5	-177.7	0	0	0	0	111.6	L62 R65 V66 Y69 L328 L329	L62-V325 HydrophobicContact CD1-CG1 4.16Å; L62-V325 HydrophobicContact CD1-CG2 4.02Å; R65-V325 HydrophobicContact CB-CG1 4.33Å; R65-V325 HydrophobicContact CB-CG2 4.2Å; V66-V325 HydrophobicContact CG2-CG1 3.81Å; Y69-V325 HydrophobicContact CD2-CB 4.09Å; Y69-V325 HydrophobicContact CD2-CG1 3.86Å; Y69-V325 HydrophobicContact CE2-CB 3.79Å; Y69-V325 HydrophobicContact CE2-CG1 4.02Å; Y69-V325 HydrophobicContact CE2-CG2 4.22Å; V325-L328 WeakPolarHBondContact O-CB 3.48Å; V325-L328 PolarHBondContact O-N 3.26Å; V325-L329 PolarHBondContact O-N 2.93Å
326	Q	90.4	Very high	92.1	Very high	14 Å²	14	18.4 Å²	18.4	7%	0.065	9%	0.09	C	C	.	.	H	α-helix	trans	-65	-45	-179	-51.3	85.4	-25.9	0	0	112	Y69 Q250 V252 L328 L329 D330	Y69-Q326 HydrophobicContact CD2-CG 4.46Å; Q250-Q326 VanDerWaalsContact OE1-NE2 3.15Å; V252-Q326 HydrophobicContact CG2-CG 4.4Å; Q326-L328 VanDerWaalsContact C-N 3.28Å; Q326-L328 PolarHBondContact O-N 3.4Å; Q326-L329 WeakPolarHBondContact O-CB 3.46Å; Q326-L329 PolarHBondContact O-N 3.37Å; Q326-L329 VanDerWaalsContact O-N 3.13Å; Q326-D330 PolarHBondContact O-N 3.32Å
327	P	92.3	Very high	92.1	Very high	16 Å²	16	18.5 Å²	18.5	10%	0.104	9%	0.091	C	C	.	.	H	α-helix	trans	-64.2	-32	175	-26.4	40.2	0	0	0	113.2	Q202 I214 I223 F225 D330 A331	Q202-P327 VanDerWaalsContact NE2-CB 3.29Å; I214-P327 HydrophobicContact CD1-CB 4.15Å; I214-P327 HydrophobicContact CD1-CG 3.77Å; I223-P327 HydrophobicContact CD1-CG 3.99Å; F225-P327 HydrophobicContact CZ-CG 4.2Å; P327-D330 PolarHBondContact O-N 2.9Å; P327-A331 WeakPolarHBondContact O-CB 3.44Å; P327-A331 PolarHBondContact O-N 2.98Å
328	L	94.3	Very high	92.1	Very high	7 Å²	7	19 Å²	19	4%	0.037	9%	0.093	C	C	.	.	H	α-helix	trans	-65.5	-41.9	172.2	177.7	68.1	0	0	0	111.4	L62 V142 F172 F315 V325 Q326 A331 V332	L62-L328 HydrophobicContact CD1-CD2 4.06Å; L62-L328 HydrophobicContact CD2-CD2 3.92Å; L62-L328 HydrophobicContact CG-CD2 4.5Å; V142-L328 HydrophobicContact CG1-CD1 4.31Å; V142-L328 HydrophobicContact CG1-CD2 4.37Å; F172-L328 HydrophobicContact CB-CD1 4.21Å; F172-L328 HydrophobicContact CB-CD2 4.19Å; F172-L328 HydrophobicContact CD1-CD2 4.25Å; F172-L328 HydrophobicContact CD2-CB 4.38Å; F172-L328 HydrophobicContact CD2-CD1 4.11Å; F172-L328 HydrophobicContact CD2-CD2 3.78Å; F172-L328 HydrophobicContact CD2-CG 4.31Å; F172-L328 HydrophobicContact CE2-CB 4.45Å; F172-L328 HydrophobicContact CE2-CD2 4.16Å; F172-L328 HydrophobicContact CG-CD1 4.42Å; F172-L328 HydrophobicContact CG-CD2 3.81Å; F315-L328 HydrophobicContact CB-CD1 4.27Å; F315-L328 HydrophobicContact CD2-CD1 4.41Å; F315-L328 HydrophobicContact CG-CD1 4.35Å; V325-L328 WeakPolarHBondContact O-CB 3.48Å; V325-L328 PolarHBondContact O-N 3.26Å; Q326-L328 VanDerWaalsContact C-N 3.28Å; Q326-L328 PolarHBondContact O-N 3.4Å; L328-A331 WeakPolarHBondContact O-CB 3.22Å; L328-A331 PolarHBondContact O-N 3.45Å; L328-V332 WeakPolarHBondContact O-CG2 3.48Å; L328-V332 PolarHBondContact O-N 2.89Å
329	L	92.6	Very high	91.9	Very high	5 Å²	5	19 Å²	19	3%	0.026	9%	0.094	C	C	.	.	H	α-helix	trans	-60.5	-47.6	174.5	-72.9	173.9	0	0	0	110.7	V66 W111 I116 V325 Q326 A331 V332 L333	V66-L329 HydrophobicContact CB-CD2 4.38Å; V66-L329 HydrophobicContact CG1-CD1 4.32Å; V66-L329 HydrophobicContact CG1-CD2 3.68Å; V66-L329 HydrophobicContact CG2-CD1 4.38Å; V66-L329 HydrophobicContact CG2-CD2 3.85Å; V66-L329 HydrophobicContact CG2-CG 4.25Å; W111-L329 HydrophobicContact CD2-CD1 4.2Å; W111-L329 HydrophobicContact CE3-CD1 4.48Å; I116-L329 HydrophobicContact CD1-CD2 4.29Å; V325-L329 PolarHBondContact O-N 2.93Å; Q326-L329 WeakPolarHBondContact O-CB 3.46Å; Q326-L329 PolarHBondContact O-N 3.37Å; Q326-L329 VanDerWaalsContact O-N 3.13Å; L329-A331 VanDerWaalsContact C-N 3.28Å; L329-A331 PolarHBondContact O-N 3.47Å; L329-V332 WeakPolarHBondContact O-CB 3.29Å; L329-V332 PolarHBondContact O-N 3.21Å; L329-V332 VanDerWaalsContact O-N 3.07Å; L329-L333 WeakPolarHBondContact O-CD1 3.23Å; L329-L333 PolarHBondContact O-N 3.2Å
330	D	92.7	Very high	91.8	Very high	28 Å²	28	21.8 Å²	21.8	15%	0.15	11%	0.113	C	C	.	.	H	α-helix	trans	-58.8	-42	177.6	-68.3	-16.2	0	0	0	111.8	W111 K112 Q326 P327 V332 L333 E334	W111-D330 PolarHBondContact NE1-OD1 2.78Å; K112-D330 WeakPolarHBondContact CE-OD1 3.36Å; K112-D330 IonicContact NZ-OD1 3.57Å; K112-D330 PolarHBondContact NZ-OD1 3.36Å; K112-D330 IonicContact NZ-OD2 3.17Å; K112-D330 PolarHBondContact NZ-OD2 3.13Å; Q326-D330 PolarHBondContact O-N 3.32Å; P327-D330 PolarHBondContact O-N 2.9Å; D330-V332 VanDerWaalsContact C-N 3.34Å; D330-V332 PolarHBondContact O-N 3.15Å; D330-L333 PolarHBondContact O-N 3.34Å; D330-L333 VanDerWaalsContact O-N 3.14Å; D330-E334 WeakPolarHBondContact O-CG 3.4Å; D330-E334 PolarHBondContact O-N 2.79Å
331	A	95.1	Very high	91.9	Very high	2 Å²	2	21.6 Å²	21.6	2%	0.017	11%	0.11	C	C	.	.	H	α-helix	trans	-62.4	-35.6	174.5	0	0	0	0	0	114	L170 F315 P327 L328 L329 L333 E334 Y335	L170-A331 HydrophobicContact CD1-CB 4.15Å; F315-A331 HydrophobicContact CD1-CB 4.29Å; F315-A331 HydrophobicContact CD2-CB 4.35Å; F315-A331 HydrophobicContact CE1-CB 3.56Å; F315-A331 HydrophobicContact CE2-CB 3.6Å; F315-A331 HydrophobicContact CZ-CB 3.17Å; P327-A331 WeakPolarHBondContact O-CB 3.44Å; P327-A331 PolarHBondContact O-N 2.98Å; L328-A331 WeakPolarHBondContact O-CB 3.22Å; L328-A331 PolarHBondContact O-N 3.45Å; L329-A331 VanDerWaalsContact C-N 3.28Å; L329-A331 PolarHBondContact O-N 3.47Å; A331-L333 VanDerWaalsContact C-N 3.3Å; A331-L333 PolarHBondContact O-N 2.87Å; A331-E334 PolarHBondContact O-N 2.98Å; A331-Y335 HydrophobicContact CB-CD2 3.85Å; A331-Y335 HydrophobicContact CB-CE2 4.12Å; A331-Y335 WeakPolarHBondContact O-CB 3.38Å; A331-Y335 WeakPolarHBondContact O-CD2 3.37Å; A331-Y335 PolarHBondContact O-N 3.26Å
332	V	95.1	Very high	92	Very high	3 Å²	3	19.5 Å²	19.5	2%	0.018	10%	0.104	C	C	.	.	H	α-helix	trans	-61.1	-40.9	173.5	160.6	0	0	0	0	110.6	I49 V142 L170 L328 L329 D330 L336	I49-V332 HydrophobicContact CD1-CG1 3.97Å; I49-V332 HydrophobicContact CD1-CG2 4.19Å; I49-V332 HydrophobicContact CG2-CG1 4.06Å; V142-V332 HydrophobicContact CG2-CG2 4.13Å; L170-V332 HydrophobicContact CD1-CG2 4.23Å; L328-V332 WeakPolarHBondContact O-CG2 3.48Å; L328-V332 PolarHBondContact O-N 2.89Å; L329-V332 WeakPolarHBondContact O-CB 3.29Å; L329-V332 PolarHBondContact O-N 3.21Å; L329-V332 VanDerWaalsContact O-N 3.07Å; D330-V332 VanDerWaalsContact C-N 3.34Å; D330-V332 PolarHBondContact O-N 3.15Å; V332-L336 HydrophobicContact CB-CD1 4.3Å; V332-L336 HydrophobicContact CG1-CD1 4.17Å; V332-L336 HydrophobicContact CG2-CD1 3.96Å; V332-L336 WeakPolarHBondContact O-CB 3.46Å; V332-L336 PolarHBondContact O-N 2.8Å
333	L	94.2	Very high	92	Very high	23 Å²	23	25.2 Å²	25.2	12%	0.12	13%	0.13	C	C	.	.	H	α-helix	trans	-68.9	-43.7	178.8	-77.1	73.7	0	0	0	111	R47 K112 V114 I116 L329 D330 A331	R47-L333 PolarHBondContact NH2-O 3.24Å; K112-L333 HydrophobicContact CB-CD2 4.28Å; V114-L333 HydrophobicContact CB-CD2 3.78Å; V114-L333 HydrophobicContact CB-CG 4.12Å; V114-L333 HydrophobicContact CG1-CD2 4.37Å; V114-L333 HydrophobicContact CG1-CG 4.15Å; V114-L333 HydrophobicContact CG2-CD2 3.64Å; V114-L333 HydrophobicContact CG2-CG 4.21Å; I116-L333 HydrophobicContact CD1-CD1 3.92Å; L329-L333 WeakPolarHBondContact O-CD1 3.23Å; L329-L333 PolarHBondContact O-N 3.2Å; D330-L333 PolarHBondContact O-N 3.34Å; D330-L333 VanDerWaalsContact O-N 3.14Å; A331-L333 VanDerWaalsContact C-N 3.3Å; A331-L333 PolarHBondContact O-N 2.87Å
334	E	93.9	Very high	91.8	Very high	75 Å²	75	24 Å²	24	35%	0.35	13%	0.126	S	C	.	.	H	α-helix	trans	-77	-40.4	-173	-69.6	-173.5	174.2	0	0	113.9	K299 R303 D330 A331	K299-E334 WeakPolarHBondContact CD-OE2 3.35Å; K299-E334 VanDerWaalsContact CE-OE2 3.29Å; K299-E334 WeakPolarHBondContact CE-OE2 3.45Å; K299-E334 IonicContact NZ-OE1 3.4Å; K299-E334 PolarHBondContact NZ-OE1 2.97Å; K299-E334 IonicContact NZ-OE2 2.8Å; K299-E334 PolarHBondContact NZ-OE2 2.91Å; R303-E334 WeakPolarHBondContact CD-O 3.3Å; R303-E334 PolarHBondContact NH1-O 2.88Å; D330-E334 WeakPolarHBondContact O-CG 3.4Å; D330-E334 PolarHBondContact O-N 2.79Å; A331-E334 PolarHBondContact O-N 2.98Å
335	Y	95.8	Very high	91.8	Very high	6 Å²	6	28 Å²	28	2%	0.024	14%	0.141	C	C	.	.	H	α-helix	trans	-110.4	-25.3	-168.9	-55.2	-59.1	0	0	0	114.9	M201 K299 I302 R303 F315 A331	M201-Y335 HydrophobicContact CE-CE2 3.9Å; K299-Y335 HydrophobicContact CB-CE1 4.37Å; K299-Y335 HydrophobicContact CG-CE1 4.43Å; I302-Y335 HydrophobicContact CB-CD1 4.14Å; I302-Y335 HydrophobicContact CB-CE1 3.87Å; I302-Y335 HydrophobicContact CG2-CD1 3.61Å; I302-Y335 HydrophobicContact CG2-CE1 3.6Å; I302-Y335 HydrophobicContact CG2-CG 4.2Å; R303-Y335 HydrophobicContact CB-CD1 4.28Å; F315-Y335 HydrophobicContact CZ-CD2 4.2Å; F315-Y335 HydrophobicContact CZ-CE2 4.01Å; A331-Y335 HydrophobicContact CB-CD2 3.85Å; A331-Y335 HydrophobicContact CB-CE2 4.12Å; A331-Y335 WeakPolarHBondContact O-CB 3.38Å; A331-Y335 WeakPolarHBondContact O-CD2 3.37Å; A331-Y335 PolarHBondContact O-N 3.26Å
336	L	95.8	Very high	91.5	Very high	1 Å²	1	28 Å²	28	1%	0.005	14%	0.141	C	C	.	.	S	Bend	trans	-84.1	152.5	177.4	-69	180	0	0	0	112.3	R47 I49 V142 L170 R303 V332	R47-L336 PolarHBondContact NE-O 3.29Å; I49-L336 HydrophobicContact CG2-CD1 3.68Å; V142-L336 HydrophobicContact CG2-CD1 4.48Å; L170-L336 HydrophobicContact CD1-CD1 4.16Å; L170-L336 HydrophobicContact CD1-CD2 4.49Å; L170-L336 HydrophobicContact CD1-CG 3.98Å; L170-L336 HydrophobicContact CD2-CD2 4.33Å; L170-L336 HydrophobicContact CG-CD1 4.27Å; L170-L336 HydrophobicContact CG-CD2 3.91Å; L170-L336 HydrophobicContact CG-CG 3.95Å; R303-L336 PolarHBondContact NH1-O 3.41Å; R303-L336 PolarHBondContact NH2-O 3.02Å; V332-L336 HydrophobicContact CB-CD1 4.3Å; V332-L336 HydrophobicContact CG1-CD1 4.17Å; V332-L336 HydrophobicContact CG2-CD1 3.96Å; V332-L336 WeakPolarHBondContact O-CB 3.46Å; V332-L336 PolarHBondContact O-N 2.8Å
337	P	94.6	Very high	91.2	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.013	14%	0.144	C	C	.	.	P	Polyproline II helix	trans	-70.9	158.3	-174.8	27.5	-34.2	0	0	0	112.8	R47 D139 P168 L307 E341 V342	R47-P337 WeakPolarHBondContact CD-O 3.34Å; D139-P337 HydrophobicContact CB-CG 4.15Å; D139-P337 WeakPolarHBondContact O-CG 3.39Å; P168-P337 HydrophobicContact CG-CG 3.63Å; L307-P337 HydrophobicContact CD2-CB 3.56Å; L307-P337 HydrophobicContact CD2-CG 3.9Å; P337-E341 VanDerWaalsContact CA-OE2 3.31Å; P337-E341 WeakPolarHBondContact CA-OE2 3.2Å; P337-E341 HydrophobicContact CB-CB 4.28Å; P337-V342 HydrophobicContact CB-CG2 3.83Å; P337-V342 HydrophobicContact CG-CG2 3.87Å
338	N	92.9	Very high	90.7	Very high	10 Å²	10	29.5 Å²	29.5	5%	0.053	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-90.8	164.5	159.6	59.3	45.7	0	0	0	110.5	N43 S340 E341	N43-N338 WeakPolarHBondContact O-CB 3.41Å; N338-S340 PolarHBondContact O-N 3.03Å; N338-S340 VanDerWaalsContact O-N 3.09Å; N338-S340 PolarHBondContact OD1-N 2.88Å; N338-S340 PolarHBondContact OD1-OG 3.46Å; N338-E341 PolarHBondContact N-OE2 3.32Å; N338-E341 PolarHBondContact ND2-OE1 3.15Å; N338-E341 PolarHBondContact O-N 2.98Å; N338-E341 VanDerWaalsContact O-N 3.16Å; N338-E341 VanDerWaalsContact OD1-CG 3.22Å; N338-E341 WeakPolarHBondContact OD1-CG 3.32Å; N338-E341 PolarHBondContact OD1-N 2.77Å
339	P	90.3	Very high	89.7	Confident	1 Å²	1	32 Å²	32	1%	0.006	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-14.9	-178.9	-24.7	34.8	0	0	0	115.5	I46 S364	I46-P339 HydrophobicContact CB-CG 4.2Å; I46-P339 HydrophobicContact CG2-CG 3.94Å; I46-P339 WeakPolarHBondContact O-CD 3.39Å; P339-S364 WeakPolarHBondContact O-CB 3.26Å; P339-S364 PolarHBondContact O-OG 2.88Å
340	S	88.7	Confident	88.5	Confident	58 Å²	58	38 Å²	38	41%	0.406	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-23.4	176.8	36.5	0	0	0	0	113.9	N338	N338-S340 PolarHBondContact O-N 3.03Å; N338-S340 VanDerWaalsContact O-N 3.09Å; N338-S340 PolarHBondContact OD1-N 2.88Å; N338-S340 PolarHBondContact OD1-OG 3.46Å
341	E	89.5	Confident	86.7	Confident	79 Å²	79	45.3 Å²	45.3	37%	0.369	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-28.8	179.1	-75.5	164.2	-168.1	0	0	112.4	R303 P337 N338 Q343	R303-E341 IonicContact CZ-OE1 2.86Å; R303-E341 IonicContact CZ-OE2 3.61Å; R303-E341 IonicContact NE-OE1 3.74Å; R303-E341 IonicContact NH2-OE1 3.71Å; R303-E341 PolarHBondContact NH2-OE1 3.25Å; R303-E341 IonicContact NH2-OE2 3.94Å; R303-E341 PolarHBondContact NH2-OE2 2.96Å; P337-E341 VanDerWaalsContact CA-OE2 3.31Å; P337-E341 WeakPolarHBondContact CA-OE2 3.2Å; P337-E341 HydrophobicContact CB-CB 4.28Å; N338-E341 PolarHBondContact N-OE2 3.32Å; N338-E341 PolarHBondContact ND2-OE1 3.15Å; N338-E341 PolarHBondContact O-N 2.98Å; N338-E341 VanDerWaalsContact O-N 3.16Å; N338-E341 VanDerWaalsContact OD1-CG 3.22Å; N338-E341 WeakPolarHBondContact OD1-CG 3.32Å; N338-E341 PolarHBondContact OD1-N 2.77Å; E341-Q343 PolarHBondContact O-N 3.14Å
342	V	87.7	Confident	84.5	Confident	37 Å²	37	51.3 Å²	51.3	22%	0.224	26%	0.255	C	S	.	.	S	Bend	trans	-80.1	119	-179.8	-176.4	0	0	0	0	110.4	D139 P337 N344	D139-V342 HydrophobicContact CB-CG2 3.86Å; P337-V342 HydrophobicContact CB-CG2 3.83Å; P337-V342 HydrophobicContact CG-CG2 3.87Å; V342-N344 PolarHBondContact O-N 2.88Å; V342-N344 PolarHBondContact O-ND2 2.93Å
343	Q	86.9	Confident	82.3	Confident	127 Å²	127	59.4 Å²	59.4	59%	0.593	30%	0.298	S	S	*	.			trans	-78.6	111.9	175.6	-65.6	-179.7	-4.1	0	0	110.4	E341 Y345 L361	E341-Q343 PolarHBondContact O-N 3.14Å; Q343-Y345 HydrophobicContact CB-CE2 4.05Å; Q343-Y345 PolarHBondContact OE1-OH 3.08Å; Q343-L361 HydrophobicContact CB-CD1 3.88Å; Q343-L361 HydrophobicContact CG-CD1 4.26Å
344	N	86	Confident	80.1	Confident	11 Å²	11	62.3 Å²	62.3	6%	0.059	32%	0.32	C	S	.	.			trans	-106.2	132.1	178.9	-71	-73	0	0	0	110.5	V342 M362 Y393	V342-N344 PolarHBondContact O-N 2.88Å; V342-N344 PolarHBondContact O-ND2 2.93Å; N344-M362 HydrophobicContact CB-CB 4.45Å; N344-M362 WeakPolarHBondContact O-CB 3.2Å; N344-M362 WeakPolarHBondContact O-CG 3.42Å; N344-M362 PolarHBondContact O-N 3.29Å; N344-Y393 HydrophobicContact CB-CD1 3.62Å; N344-Y393 HydrophobicContact CB-CE1 3.94Å; N344-Y393 VanDerWaalsContact CG-CE1 3.44Å; N344-Y393 VanDerWaalsContact OD1-CE1 3.3Å; N344-Y393 WeakPolarHBondContact OD1-CE1 3.24Å
345	Y	87.5	Confident	78.2	Confident	83 Å²	83	68.9 Å²	68.9	33%	0.325	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	136	-178.5	-60.9	-86.2	0	0	0	111.1	Q343 K359 I360 L361 M460	Q343-Y345 HydrophobicContact CB-CE2 4.05Å; Q343-Y345 PolarHBondContact OE1-OH 3.08Å; Y345-K359 HydrophobicContact CD1-CB 4.11Å; Y345-I360 WeakPolarHBondContact CA-O 3.29Å; Y345-L361 HydrophobicContact CD1-CB 4.43Å; Y345-L361 HydrophobicContact CD1-CD1 4.32Å; Y345-L361 HydrophobicContact CE1-CB 4.26Å; Y345-L361 HydrophobicContact CE1-CD1 3.92Å; Y345-M460 WeakPolarHBondContact O-CE 3.22Å
346	A	85.4	Confident	76.2	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	149.5	165.2	0	0	0	0	0	109.9	K359 I360 M362 M460	A346-K359 CarbonylContact O-C 3.56Å; A346-K359 WeakPolarHBondContact O-CA 3.17Å; A346-I360 PolarHBondContact N-O 2.99Å; A346-I360 PolarHBondContact O-N 3.08Å; A346-M362 HydrophobicContact CB-CE 3.51Å; A346-M362 HydrophobicContact CB-CG 4.27Å; A346-M362 HydrophobicContact CB-SD 3.72Å; A346-M460 HydrophobicContact CB-SD 3.71Å
347	I	84.1	Confident	74.8	Confident	23 Å²	23	83.5 Å²	83.5	12%	0.118	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	129.1	175.5	-58.3	170.5	0	0	0	108.3	K357 L458 S459 E461	I347-K357 HydrophobicContact CG2-CB 3.54Å; I347-K357 HydrophobicContact CG2-CD 3.52Å; I347-K357 HydrophobicContact CG2-CG 4.09Å; I347-L458 WeakPolarHBondContact O-CA 3.33Å; I347-S459 WeakPolarHBondContact CA-O 3.39Å; I347-S459 WeakPolarHBondContact CB-O 3.43Å; I347-S459 PolarHBondContact N-O 2.84Å; I347-S459 PolarHBondContact O-N 3.32Å; I347-E461 HydrophobicContact CD1-CB 4.39Å; I347-E461 HydrophobicContact CD1-CG 3.84Å; I347-E461 HydrophobicContact CG1-CG 3.99Å
348	L	81.6	Confident	74.2	Confident	38 Å²	38	87 Å²	87	20%	0.199	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	118.5	168	-167.8	71.7	0	0	0	109.8	Q350 T358 I360 L458	L348-Q350 HydrophobicContact CD2-CG 3.82Å; L348-Q350 HydrophobicContact CG-CG 4.05Å; L348-Q350 PolarHBondContact O-N 2.99Å; L348-T358 PolarHBondContact N-O 2.94Å; L348-T358 VanDerWaalsContact N-O 3.13Å; L348-I360 HydrophobicContact CB-CD1 3.94Å; L348-I360 HydrophobicContact CD1-CD1 4.07Å; L348-I360 HydrophobicContact CD2-CD1 4.38Å; L348-I360 HydrophobicContact CG-CD1 4.36Å; L348-L458 HydrophobicContact CB-CD2 4.5Å; L348-L458 HydrophobicContact CD1-CD2 3.65Å; L348-L458 HydrophobicContact CD1-CG 4.4Å
349	N	73.6	Confident	73.9	Confident	60 Å²	60	92.7 Å²	92.7	32%	0.321	46%	0.46	S	S	.	.			trans	-88.6	75.2	176.4	-61.9	-39.3	0	0	0	109.5	D457 S459	N349-D457 HydrophobicContact CB-CB 4.27Å; N349-D457 PolarHBondContact N-O 3.32Å; N349-D457 WeakPolarHBondContact O-CB 3.19Å; N349-S459 VanDerWaalsContact ND2-CB 3.28Å; N349-S459 WeakPolarHBondContact ND2-CB 3.24Å; N349-S459 PolarHBondContact ND2-OG 3.22Å; N349-S459 PolarHBondContact OD1-OG 3.25Å
350	Q	66.1	Low	73.7	Confident	132 Å²	132	95.8 Å²	95.8	62%	0.617	48%	0.476	S	S	*	.			trans	-79.4	150.9	164.3	-73.7	178.8	-17.6	0	0	109.7	L348 D352	L348-Q350 HydrophobicContact CD2-CG 3.82Å; L348-Q350 HydrophobicContact CG-CG 4.05Å; L348-Q350 PolarHBondContact O-N 2.99Å; Q350-D352 PolarHBondContact O-N 2.85Å; Q350-D352 VanDerWaalsContact O-N 3.13Å
351	E	56.6	Low	73.8	Confident	181 Å²	181	97.5 Å²	97.5	85%	0.846	48%	0.48	S	S	*	.	S	Bend	trans	-70.6	-0.6	-174.9	-65.3	-169.9	164.8	0	0	114.5	D353	E351-D353 PolarHBondContact O-N 2.88Å
352	D	48.6	Very low	73.8	Confident	128 Å²	128	94.2 Å²	94.2	68%	0.684	47%	0.465	S	S	*	.			trans	-80.6	109.3	179.3	-73.5	-31.3	0	0	0	111.1	Q350 S354	Q350-D352 PolarHBondContact O-N 2.85Å; Q350-D352 VanDerWaalsContact O-N 3.13Å; D352-S354 PolarHBondContact O-N 3.46Å
353	D	49.4	Very low	73.8	Confident	172 Å²	172	95.7 Å²	95.7	92%	0.92	47%	0.471	S	S	*	.			trans	-62.1	19.6	-179.2	-133.8	0.9	0	0	0	114.8	E351	E351-D353 PolarHBondContact O-N 2.88Å
354	S	46.8	Very low	73.8	Confident	85 Å²	85	90.4 Å²	90.4	59%	0.594	45%	0.448	S	S	*	.			trans	-85.1	133.3	176.2	70.3	0	0	0	0	111	D352 E356	D352-S354 PolarHBondContact O-N 3.46Å; S354-E356 PolarHBondContact O-N 3.29Å
355	K	53.8	Low	73.9	Confident	213 Å²	213	91.3 Å²	91.3	93%	0.926	46%	0.456	S	S	*	.	S	Bend	trans	-63.3	3	-161.4	-67.2	173.2	175.9	177.1	0	117.3
356	E	53.5	Low	73.9	Confident	174 Å²	174	88.5 Å²	88.5	81%	0.813	44%	0.444	S	S	*	.			trans	-118.1	92.8	177.9	-71.5	-169.3	169.9	0	0	111.3	S354 T358	S354-E356 PolarHBondContact O-N 3.29Å; E356-T358 PolarHBondContact O-N 3.19Å
357	K	67.9	Low	73.7	Confident	140 Å²	140	93 Å²	93	61%	0.609	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-65.8	125.8	171.9	-57.8	-176.9	-178.9	-177.2	0	109.3	I347 K359	I347-K357 HydrophobicContact CG2-CB 3.54Å; I347-K357 HydrophobicContact CG2-CD 3.52Å; I347-K357 HydrophobicContact CG2-CG 4.09Å; K357-K359 PolarHBondContact O-N 3.28Å
358	T	81.1	Confident	73.6	Confident	76 Å²	76	97.1 Å²	97.1	47%	0.466	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-68	125	179	50.1	0	0	0	0	110.5	L348 E356	L348-T358 PolarHBondContact N-O 2.94Å; L348-T358 VanDerWaalsContact N-O 3.13Å; E356-T358 PolarHBondContact O-N 3.19Å
359	K	86	Confident	73.8	Confident	129 Å²	129	99.1 Å²	99.1	56%	0.561	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	122.5	176.5	-62.3	-167.1	-176.4	-155.8	0	109.8	Y345 A346 K357 E461	Y345-K359 HydrophobicContact CD1-CB 4.11Å; A346-K359 CarbonylContact O-C 3.56Å; A346-K359 WeakPolarHBondContact O-CA 3.17Å; K357-K359 PolarHBondContact O-N 3.28Å; K359-E461 IonicContact NZ-OE1 2.72Å; K359-E461 PolarHBondContact NZ-OE1 2.91Å
360	I	87.4	Confident	74.5	Confident	66 Å²	66	99.7 Å²	99.7	34%	0.338	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	126.5	176	-60.5	169.4	0	0	0	108.1	Y345 A346 L348 M362 L458	Y345-I360 WeakPolarHBondContact CA-O 3.29Å; A346-I360 PolarHBondContact N-O 2.99Å; A346-I360 PolarHBondContact O-N 3.08Å; L348-I360 HydrophobicContact CB-CD1 3.94Å; L348-I360 HydrophobicContact CD1-CD1 4.07Å; L348-I360 HydrophobicContact CD2-CD1 4.38Å; L348-I360 HydrophobicContact CG-CD1 4.36Å; I360-M362 HydrophobicContact CB-CE 3.98Å; I360-M362 HydrophobicContact CG2-CE 3.58Å; I360-M362 WeakPolarHBondContact O-CE 3.46Å; I360-M362 PolarHBondContact O-N 3.36Å; I360-L458 HydrophobicContact CD1-CD2 3.65Å
361	L	90.3	Very high	75.6	Confident	93 Å²	93	95.6 Å²	95.6	49%	0.487	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	126.5	173.5	-178.9	65.1	0	0	0	109.8	Q343 Y345	Q343-L361 HydrophobicContact CB-CD1 3.88Å; Q343-L361 HydrophobicContact CG-CD1 4.26Å; Y345-L361 HydrophobicContact CD1-CB 4.43Å; Y345-L361 HydrophobicContact CD1-CD1 4.32Å; Y345-L361 HydrophobicContact CE1-CB 4.26Å; Y345-L361 HydrophobicContact CE1-CD1 3.92Å
362	M	89.1	Confident	77.3	Confident	11 Å²	11	87.1 Å²	87.1	5%	0.054	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-79	143.7	175.6	-60.5	-65.9	91	0	0	110.6	N344 A346 I360 V373 Q394	N344-M362 HydrophobicContact CB-CB 4.45Å; N344-M362 WeakPolarHBondContact O-CB 3.2Å; N344-M362 WeakPolarHBondContact O-CG 3.42Å; N344-M362 PolarHBondContact O-N 3.29Å; A346-M362 HydrophobicContact CB-CE 3.51Å; A346-M362 HydrophobicContact CB-CG 4.27Å; A346-M362 HydrophobicContact CB-SD 3.72Å; I360-M362 HydrophobicContact CB-CE 3.98Å; I360-M362 HydrophobicContact CG2-CE 3.58Å; I360-M362 WeakPolarHBondContact O-CE 3.46Å; I360-M362 PolarHBondContact O-N 3.36Å; M362-V373 HydrophobicContact SD-CB 4.31Å; M362-V373 HydrophobicContact SD-CG1 4.28Å; M362-V373 HydrophobicContact SD-CG2 4.14Å; M362-Q394 PolarHBondContact SD-OE1 3.08Å; M362-Q394 VanDerWaalsContact SD-OE1 3.34Å
363	N	88.1	Confident	79.4	Confident	67 Å²	67	81 Å²	81	36%	0.358	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-98.7	116.2	175.9	-170	-27.8	0	0	0	110	S365 H370 Q394	N363-S365 VanDerWaalsContact CG-OG 3.23Å; N363-S365 PolarHBondContact O-N 3.18Å; N363-S365 VanDerWaalsContact OD1-CB 3.27Å; N363-S365 WeakPolarHBondContact OD1-CB 3.44Å; N363-S365 PolarHBondContact OD1-N 3.17Å; N363-S365 PolarHBondContact OD1-OG 3.37Å; N363-H370 PolarHBondContact ND2-CE1 3.38Å; N363-H370 VanDerWaalsContact ND2-CE1 3.3Å; N363-Q394 WeakPolarHBondContact O-CG 3.39Å
364	S	87.7	Confident	81.5	Confident	16 Å²	16	72.8 Å²	72.8	11%	0.112	38%	0.377	C	S	.	.			trans	-76.7	1.4	179.9	-54.8	0	0	0	0	114	N43 P339 R366	N43-S364 PolarHBondContact ND2-O 3.25Å; P339-S364 WeakPolarHBondContact O-CB 3.26Å; P339-S364 PolarHBondContact O-OG 2.88Å; S364-R366 PolarHBondContact O-N 3.21Å
365	S	87.3	Confident	83.7	Confident	31 Å²	31	68.9 Å²	68.9	22%	0.217	35%	0.349	C	S	.	.			trans	-54.8	133.9	176.1	49.8	0	0	0	0	111.3	N363 D367	N363-S365 VanDerWaalsContact CG-OG 3.23Å; N363-S365 PolarHBondContact O-N 3.18Å; N363-S365 VanDerWaalsContact OD1-CB 3.27Å; N363-S365 WeakPolarHBondContact OD1-CB 3.44Å; N363-S365 PolarHBondContact OD1-N 3.17Å; N363-S365 PolarHBondContact OD1-OG 3.37Å; S365-D367 PolarHBondContact O-N 2.8Å
366	R	86.5	Confident	85.5	Confident	23 Å²	23	58.7 Å²	58.7	9%	0.087	31%	0.305	C	S	.	.	S	Bend	trans	-84	48.2	-178.1	-61	-177.1	75.3	96	-16.3	111.5	V40 I41 N43 S364 Y432 A433 D435	V40-R366 HydrophobicContact CG1-CB 4.26Å; I41-R366 WeakPolarHBondContact O-CD 3.47Å; I41-R366 PolarHBondContact O-NE 3.39Å; I41-R366 VanDerWaalsContact O-NE 3.11Å; N43-R366 WeakPolarHBondContact OD1-CD 3.46Å; N43-R366 WeakPolarHBondContact OD1-CG 3.47Å; S364-R366 PolarHBondContact O-N 3.21Å; R366-Y432 HydrophobicContact CB-CD1 4.05Å; R366-Y432 HydrophobicContact CB-CG 4.26Å; R366-Y432 VanDerWaalsContact NH2-CD2 3.32Å; R366-A433 PolarHBondContact NH1-O 2.76Å; R366-D435 IonicContact CZ-OD1 3.79Å; R366-D435 IonicContact CZ-OD2 3.37Å; R366-D435 IonicContact NH1-OD1 2.73Å; R366-D435 PolarHBondContact NH1-OD1 3.2Å; R366-D435 IonicContact NH1-OD2 2.91Å; R366-D435 IonicContact NH2-OD1 3.9Å; R366-D435 PolarHBondContact NH2-OD1 2.98Å; R366-D435 IonicContact NH2-OD2 3.57Å; R366-D435 PolarHBondContact NH2-OD2 3.24Å
367	D	82.7	Confident	87.2	Confident	94 Å²	94	50.7 Å²	50.7	50%	0.503	27%	0.268	S	S	.	.	S	Bend	trans	-124.5	157	-174.6	-59.8	-29.4	0	0	0	111.8	S365 S369	S365-D367 PolarHBondContact O-N 2.8Å; D367-S369 PolarHBondContact O-N 3.39Å
368	N	81.8	Confident	88.2	Confident	110 Å²	110	44.5 Å²	44.5	59%	0.588	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.3	8.6	171.9	-79.2	-47.2	0	0	0	114.5	H370 E396	N368-H370 VanDerWaalsContact C-N 3.26Å; N368-H370 PolarHBondContact O-N 3.26Å; N368-E396 PolarHBondContact ND2-OE2 3.03Å; N368-E396 WeakPolarHBondContact OD1-CB 3.34Å; N368-E396 PolarHBondContact OD1-OE2 3.26Å
369	S	86	Confident	88.5	Confident	81 Å²	81	41.2 Å²	41.2	57%	0.566	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-27.2	-176	55.3	0	0	0	0	112.7	D367	D367-S369 PolarHBondContact O-N 3.39Å
370	H	87.6	Confident	88.4	Confident	72 Å²	72	36.9 Å²	36.9	33%	0.333	20%	0.202	S	C	.	.	S	Bend	trans	-119.2	154.6	-175.7	-66.2	84.5	0	0	0	111.9	N363 N368 Q394	N363-H370 PolarHBondContact ND2-CE1 3.38Å; N363-H370 VanDerWaalsContact ND2-CE1 3.3Å; N368-H370 VanDerWaalsContact C-N 3.26Å; N368-H370 PolarHBondContact O-N 3.26Å; H370-Q394 HydrophobicContact CB-CG 3.59Å; H370-Q394 PolarHBondContact CD2-NE2 2.93Å
371	P	89.5	Confident	88	Confident	46 Å²	46	36.2 Å²	36.2	30%	0.299	20%	0.201	S	C	.	.			trans	-64	144.1	176.8	28.2	-35.1	0	0	0	111.3	V373	P371-V373 PolarHBondContact O-N 3Å
372	F	92.2	Very high	87	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.009	19%	0.192	C	C	.	.			trans	-59.9	133.4	172.1	172	-105.5	0	0	0	111.4	I392 Q394 L397 I403 F450 T451 N452	F372-I392 HydrophobicContact CD2-CG2 3.91Å; F372-I392 HydrophobicContact CE2-CB 4.28Å; F372-I392 HydrophobicContact CE2-CD1 4.02Å; F372-I392 HydrophobicContact CE2-CG1 3.85Å; F372-I392 HydrophobicContact CE2-CG2 3.61Å; F372-I392 HydrophobicContact CZ-CG1 4.49Å; F372-Q394 VanDerWaalsContact CA-O 3.31Å; F372-Q394 WeakPolarHBondContact CA-O 3.45Å; F372-L397 HydrophobicContact CD1-CD1 4.11Å; F372-L397 HydrophobicContact CD2-CB 3.86Å; F372-L397 HydrophobicContact CD2-CD1 4.31Å; F372-L397 HydrophobicContact CE1-CD1 4.1Å; F372-L397 HydrophobicContact CE1-CD2 4.31Å; F372-L397 HydrophobicContact CE2-CB 3.69Å; F372-L397 HydrophobicContact CE2-CD1 4.27Å; F372-L397 HydrophobicContact CE2-CD2 3.96Å; F372-L397 HydrophobicContact CE2-CG 4.21Å; F372-L397 HydrophobicContact CG-CD1 4.23Å; F372-L397 HydrophobicContact CZ-CB 4.28Å; F372-L397 HydrophobicContact CZ-CD1 4.19Å; F372-L397 HydrophobicContact CZ-CD2 3.72Å; F372-L397 HydrophobicContact CZ-CG 4.3Å; F372-I403 HydrophobicContact CD1-CG2 4.14Å; F372-I403 HydrophobicContact CE1-CG2 4.05Å; F372-F450 HydrophobicContact CE1-CB 3.98Å; F372-T451 VanDerWaalsContact O-CA 3.29Å; F372-T451 WeakPolarHBondContact O-CA 3.49Å; F372-N452 HydrophobicContact CB-CB 4.09Å; F372-N452 VanDerWaalsContact CB-ND2 3.32Å; F372-N452 WeakPolarHBondContact CB-ND2 2.94Å; F372-N452 WeakPolarHBondContact CB-OD1 3.4Å; F372-N452 WeakPolarHBondContact CD1-OD1 3.44Å
373	V	92.9	Very high	85.9	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	118.8	169.5	-176.6	0	0	0	0	108.6	M362 P371 Y393 Q394 T449 F450 T451 L458 M460	M362-V373 HydrophobicContact SD-CB 4.31Å; M362-V373 HydrophobicContact SD-CG1 4.28Å; M362-V373 HydrophobicContact SD-CG2 4.14Å; P371-V373 PolarHBondContact O-N 3Å; V373-Y393 PolarHBondContact O-N 2.92Å; V373-Q394 HydrophobicContact CB-CB 4.47Å; V373-Q394 PolarHBondContact N-O 2.98Å; V373-T449 HydrophobicContact CG1-CG2 3.97Å; V373-F450 WeakPolarHBondContact CA-O 3.46Å; V373-T451 HydrophobicContact CG2-CG2 4.38Å; V373-L458 HydrophobicContact CG2-CD1 4.2Å; V373-M460 HydrophobicContact CG1-CG 4.41Å; V373-M460 HydrophobicContact CG1-SD 4.03Å
374	G	92.9	Very high	85	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	141.8	177.4	0	0	0	0	0	112.6	R391 T449 F450	G374-R391 CarbonylContact C-O 3.52Å; G374-R391 VanDerWaalsContact CA-O 3.24Å; G374-R391 WeakPolarHBondContact CA-O 3.27Å; G374-T449 CarbonylContact O-C 3.53Å; G374-T449 WeakPolarHBondContact O-CA 3.04Å; G374-F450 PolarHBondContact N-O 3.34Å; G374-F450 PolarHBondContact O-N 3.04Å
375	L	93	Very high	84.6	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	123.5	177.5	179.3	58.5	0	0	0	110.7	R136 V137 V390 R391 Y393 G447 M460	R136-L375 HydrophobicContact CG-CD2 4.45Å; V137-L375 HydrophobicContact CG2-CD2 4.45Å; L375-V390 VanDerWaalsContact O-CA 3.25Å; L375-V390 WeakPolarHBondContact O-CA 3.47Å; L375-R391 PolarHBondContact N-O 3.11Å; L375-R391 PolarHBondContact O-N 3Å; L375-Y393 HydrophobicContact CB-CD2 4.4Å; L375-Y393 HydrophobicContact CB-CE2 3.76Å; L375-Y393 HydrophobicContact CD2-CE2 4.28Å; L375-G447 WeakPolarHBondContact CD1-O 3.28Å; L375-M460 HydrophobicContact CB-CG 4.19Å; L375-M460 HydrophobicContact CD1-CB 4.05Å; L375-M460 HydrophobicContact CD1-CG 4.48Å; L375-M460 HydrophobicContact CD2-CB 4.15Å; L375-M460 HydrophobicContact CG-CB 4.47Å
376	A	91.8	Very high	84.5	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	125.2	168.3	0	0	0	0	0	110.1	T388 Y389 V390 G447 D448 F450	A376-T388 HydrophobicContact CB-CG2 3.65Å; A376-Y389 WeakPolarHBondContact CA-O 3.34Å; A376-V390 HydrophobicContact CB-CG2 4.32Å; A376-G447 VanDerWaalsContact O-CA 3.31Å; A376-G447 WeakPolarHBondContact O-CA 3.47Å; A376-G447 PolarHBondContact O-N 3.27Å; A376-D448 WeakPolarHBondContact CB-O 3.38Å; A376-D448 PolarHBondContact N-O 3.19Å; A376-F450 HydrophobicContact CB-CE2 3.91Å
377	F	89.7	Confident	84.6	Confident	6 Å²	6	48.5 Å²	48.5	3%	0.026	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	-20.2	-176.3	74.5	-86.2	0	0	0	114.7	I119 R133 V137 Y389 I436 S446	I119-F377 HydrophobicContact CD1-CE2 4.07Å; I119-F377 HydrophobicContact CD1-CZ 4.16Å; R133-F377 VanDerWaalsContact CD-O 3.26Å; R133-F377 WeakPolarHBondContact CD-O 3.44Å; V137-F377 HydrophobicContact CB-CD1 4.43Å; V137-F377 HydrophobicContact CB-CD2 4.38Å; V137-F377 HydrophobicContact CB-CG 4.23Å; V137-F377 HydrophobicContact CG1-CD1 3.76Å; V137-F377 HydrophobicContact CG1-CD2 4.28Å; V137-F377 HydrophobicContact CG1-CE1 3.77Å; V137-F377 HydrophobicContact CG1-CE2 4.3Å; V137-F377 HydrophobicContact CG1-CG 4.02Å; V137-F377 HydrophobicContact CG1-CZ 4.05Å; V137-F377 HydrophobicContact CG2-CB 3.48Å; V137-F377 VanDerWaalsContact CG2-CB 3.48Å; V137-F377 HydrophobicContact CG2-CD1 3.95Å; V137-F377 HydrophobicContact CG2-CD2 4.08Å; V137-F377 HydrophobicContact CG2-CG 3.57Å; F377-Y389 WeakPolarHBondContact CD1-O 3.32Å; F377-Y389 HydrophobicContact CZ-CG 4.5Å; F377-Y389 PolarHBondContact N-O 3.26Å; F377-I436 HydrophobicContact CE1-CG2 3.97Å; F377-I436 HydrophobicContact CZ-CG2 4.06Å; F377-S446 PolarHBondContact O-OG 3.16Å; F377-S446 VanDerWaalsContact O-OG 3.13Å
378	K	88.4	Confident	85	Confident	10 Å²	10	44 Å²	44	4%	0.043	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	135.4	174.5	-175.2	-173	-179.3	-160	0	109.1	S104 E380 Y389	S104-K378 VanDerWaalsContact O-CE 3.26Å; S104-K378 WeakPolarHBondContact O-CE 3.37Å; S104-K378 PolarHBondContact O-NZ 3.49Å; K378-E380 IonicContact NZ-OE2 3.7Å; K378-Y389 HydrophobicContact CB-CD2 3.88Å; K378-Y389 HydrophobicContact CB-CG 4.09Å; K378-Y389 HydrophobicContact CD-CD2 3.99Å; K378-Y389 HydrophobicContact CD-CE2 4.03Å; K378-Y389 HydrophobicContact CD-CG 4.47Å; K378-Y389 HydrophobicContact CG-CD2 4Å; K378-Y389 HydrophobicContact CG-CE2 4.4Å; K378-Y389 PolarHBondContact O-N 3.48Å
379	L	88.3	Confident	85.4	Confident	6 Å²	6	39.1 Å²	39.1	3%	0.031	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	134.6	172.9	-60.7	178.5	0	0	0	108.3	T388 C444 R494	L379-T388 HydrophobicContact CD2-CG2 3.78Å; L379-C444 VanDerWaalsContact CD1-O 3.23Å; L379-C444 WeakPolarHBondContact CD1-O 3.43Å; L379-R494 WeakPolarHBondContact CD1-O 3.38Å
380	E	84.2	Confident	85.7	Confident	39 Å²	39	35.2 Å²	35.2	18%	0.182	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	126.4	178.3	-171.3	-173.5	147.4	0	0	107.9	K378 L387 Y389	K378-E380 IonicContact NZ-OE2 3.7Å; E380-L387 HydrophobicContact CB-CB 4.4Å; E380-L387 PolarHBondContact N-O 3.47Å; E380-L387 WeakPolarHBondContact O-CA 3.44Å; E380-L387 WeakPolarHBondContact O-CB 3.23Å; E380-L387 PolarHBondContact O-N 2.97Å; E380-L387 VanDerWaalsContact O-O 3.13Å; E380-Y389 HydrophobicContact CB-CE2 3.94Å; E380-Y389 WeakPolarHBondContact OE2-CE2 3.48Å; E380-Y389 PolarHBondContact OE2-OH 3.42Å
381	V	77.4	Confident	86	Confident	52 Å²	52	32 Å²	32	32%	0.315	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	105.2	173.8	-174.9	0	0	0	0	107.8	Q386 R491	V381-Q386 HydrophobicContact CG2-CB 4.19Å; V381-Q386 HydrophobicContact CG2-CG 4.17Å; V381-R491 HydrophobicContact CG2-CG 4.31Å; V381-R491 PolarHBondContact O-NH2 3.42Å
382	G	70	Confident	86.2	Confident	29 Å²	29	29.8 Å²	29.8	30%	0.299	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-179	175.2	0	0	0	0	0	112	F384 G385	G382-F384 PolarHBondContact O-N 3.35Å; G382-F384 VanDerWaalsContact O-N 3.14Å; G382-G385 PolarHBondContact N-O 3.29Å; G382-G385 PolarHBondContact O-N 3.49Å
383	R	66	Low	86.1	Confident	248 Å²	248	29.9 Å²	29.9	94%	0.936	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-27	175.4	-64.4	-179.3	-178.2	178.2	1.2	113.5
384	F	68.4	Low	86	Confident	152 Å²	152	30.5 Å²	30.5	67%	0.667	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-15.6	-175.3	-56.6	-71.9	0	0	0	112.7	G382 M425 F440	G382-F384 PolarHBondContact O-N 3.35Å; G382-F384 VanDerWaalsContact O-N 3.14Å; F384-M425 HydrophobicContact CD2-CE 3.71Å; F384-M425 HydrophobicContact CE2-CE 4.21Å; F384-F440 HydrophobicContact CB-CE2 3.89Å; F384-F440 HydrophobicContact CB-CZ 4.03Å; F384-F440 WeakPolarHBondContact O-CZ 3.23Å
385	G	79.8	Confident	85.9	Confident	23 Å²	23	30.6 Å²	30.6	24%	0.237	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	142.2	-174.6	-177.5	0	0	0	0	0	112.3	G382	G382-G385 PolarHBondContact N-O 3.29Å; G382-G385 PolarHBondContact O-N 3.49Å
386	Q	84.7	Confident	85.8	Confident	41 Å²	41	30.9 Å²	30.9	19%	0.192	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	122.5	176.3	-177.9	168.9	-11.9	0	0	110.6	V381 G441 I442	V381-Q386 HydrophobicContact CG2-CB 4.19Å; V381-Q386 HydrophobicContact CG2-CG 4.17Å; Q386-G441 PolarHBondContact O-N 2.7Å; Q386-I442 VanDerWaalsContact CD-O 3.25Å; Q386-I442 PolarHBondContact NE2-O 3.41Å; Q386-I442 VanDerWaalsContact NE2-O 3.17Å
387	L	89.3	Confident	85.8	Confident	6 Å²	6	30.9 Å²	30.9	3%	0.031	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	131.4	170.3	-68.2	164.2	0	0	0	108.7	E380 M420 A438 L439 F440	E380-L387 HydrophobicContact CB-CB 4.4Å; E380-L387 PolarHBondContact N-O 3.47Å; E380-L387 WeakPolarHBondContact O-CA 3.44Å; E380-L387 WeakPolarHBondContact O-CB 3.23Å; E380-L387 PolarHBondContact O-N 2.97Å; E380-L387 VanDerWaalsContact O-O 3.13Å; L387-M420 HydrophobicContact CD1-CE 4.12Å; L387-M420 HydrophobicContact CD1-SD 4.47Å; L387-A438 HydrophobicContact CD2-CB 4.42Å; L387-L439 WeakPolarHBondContact CA-O 3.19Å; L387-F440 HydrophobicContact CD2-CD2 3.83Å
388	T	91.1	Very high	85.9	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	113.8	175.7	-59.9	0	0	0	0	108.5	A376 L379 V390 A438 L439 I442 C444 F450	A376-T388 HydrophobicContact CB-CG2 3.65Å; L379-T388 HydrophobicContact CD2-CG2 3.78Å; T388-V390 HydrophobicContact CG2-CG2 3.85Å; T388-A438 CarbonylContact O-C 3.59Å; T388-A438 WeakPolarHBondContact O-CA 3.43Å; T388-L439 PolarHBondContact N-O 2.82Å; T388-L439 PolarHBondContact O-N 2.87Å; T388-I442 PolarHBondContact OG1-O 3.1Å; T388-C444 WeakPolarHBondContact CG2-SG 3.43Å; T388-C444 PolarHBondContact OG1-SG 2.98Å; T388-C444 VanDerWaalsContact OG1-SG 3.41Å; T388-F450 HydrophobicContact CG2-CE2 4.23Å
389	Y	90.9	Very high	86.1	Confident	6 Å²	6	39.7 Å²	39.7	2%	0.024	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	126.4	175	-66.1	-105.1	0	0	0	109.5	A106 A376 F377 K378 E380 M420 C437 A438	A106-Y389 HydrophobicContact CB-CD1 4.33Å; A106-Y389 HydrophobicContact CB-CE1 4Å; A376-Y389 WeakPolarHBondContact CA-O 3.34Å; F377-Y389 WeakPolarHBondContact CD1-O 3.32Å; F377-Y389 HydrophobicContact CZ-CG 4.5Å; F377-Y389 PolarHBondContact N-O 3.26Å; K378-Y389 HydrophobicContact CB-CD2 3.88Å; K378-Y389 HydrophobicContact CB-CG 4.09Å; K378-Y389 HydrophobicContact CD-CD2 3.99Å; K378-Y389 HydrophobicContact CD-CE2 4.03Å; K378-Y389 HydrophobicContact CD-CG 4.47Å; K378-Y389 HydrophobicContact CG-CD2 4Å; K378-Y389 HydrophobicContact CG-CE2 4.4Å; K378-Y389 PolarHBondContact O-N 3.48Å; E380-Y389 HydrophobicContact CB-CE2 3.94Å; E380-Y389 WeakPolarHBondContact OE2-CE2 3.48Å; E380-Y389 PolarHBondContact OE2-OH 3.42Å; Y389-M420 HydrophobicContact CD1-CG 4.38Å; Y389-M420 HydrophobicContact CE1-CB 3.75Å; Y389-M420 HydrophobicContact CE1-CG 3.5Å; Y389-M420 VanDerWaalsContact CE1-CG 3.5Å; Y389-C437 CarbonylContact C-O 3.52Å; Y389-C437 WeakPolarHBondContact CA-O 3.44Å; Y389-A438 HydrophobicContact CD1-CB 4.49Å
390	V	92.6	Very high	86.1	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	130.2	-176.4	-179.2	0	0	0	0	109.7	L375 A376 T388 C437 L439 F450	L375-V390 VanDerWaalsContact O-CA 3.25Å; L375-V390 WeakPolarHBondContact O-CA 3.47Å; A376-V390 HydrophobicContact CB-CG2 4.32Å; T388-V390 HydrophobicContact CG2-CG2 3.85Å; V390-C437 PolarHBondContact N-O 3.22Å; V390-C437 PolarHBondContact O-N 2.99Å; V390-L439 HydrophobicContact CB-CD1 4.3Å; V390-L439 HydrophobicContact CB-CG 4.44Å; V390-L439 HydrophobicContact CG2-CD1 3.52Å; V390-L439 HydrophobicContact CG2-CG 3.85Å; V390-F450 HydrophobicContact CG2-CD2 4.13Å; V390-F450 HydrophobicContact CG2-CE2 4.13Å
391	R	93.1	Very high	86.5	Confident	3 Å²	3	41.8 Å²	41.8	1%	0.011	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	132.6	165.6	171.2	169.7	-179.7	-165.4	-0.8	110	V137 D139 G374 L375 Y393 I436	V137-R391 HydrophobicContact CG1-CB 3.57Å; V137-R391 HydrophobicContact CG1-CG 4.13Å; V137-R391 WeakPolarHBondContact O-CD 3.43Å; V137-R391 VanDerWaalsContact O-CZ 3.27Å; V137-R391 PolarHBondContact O-NE 2.99Å; V137-R391 PolarHBondContact O-NH1 2.79Å; D139-R391 IonicContact OD1-CZ 2.71Å; D139-R391 IonicContact OD1-NH1 3.71Å; D139-R391 PolarHBondContact OD1-NH1 3.25Å; D139-R391 IonicContact OD1-NH2 3.46Å; D139-R391 PolarHBondContact OD1-NH2 2.64Å; D139-R391 IonicContact OD2-CZ 3.19Å; D139-R391 IonicContact OD2-NH2 3.2Å; D139-R391 PolarHBondContact OD2-NH2 2.93Å; D139-R391 VanDerWaalsContact OD2-NH2 3.14Å; G374-R391 CarbonylContact C-O 3.52Å; G374-R391 VanDerWaalsContact CA-O 3.24Å; G374-R391 WeakPolarHBondContact CA-O 3.27Å; L375-R391 PolarHBondContact N-O 3.11Å; L375-R391 PolarHBondContact O-N 3Å; R391-Y393 HydrophobicContact CB-CE2 4.37Å; R391-Y393 HydrophobicContact CG-CD2 4.41Å; R391-Y393 HydrophobicContact CG-CE1 4.42Å; R391-Y393 HydrophobicContact CG-CE2 3.96Å; R391-Y393 VanDerWaalsContact CZ-CE1 3.49Å; R391-I436 HydrophobicContact CB-CG1 4.42Å
392	I	92.6	Very high	87.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	126.7	-179.1	-50.1	176.7	0	0	0	108.6	F372 V431 Y432 G434 D435	F372-I392 HydrophobicContact CD2-CG2 3.91Å; F372-I392 HydrophobicContact CE2-CB 4.28Å; F372-I392 HydrophobicContact CE2-CD1 4.02Å; F372-I392 HydrophobicContact CE2-CG1 3.85Å; F372-I392 HydrophobicContact CE2-CG2 3.61Å; F372-I392 HydrophobicContact CZ-CG1 4.49Å; I392-V431 HydrophobicContact CD1-CB 3.61Å; I392-V431 HydrophobicContact CD1-CG2 3.26Å; I392-Y432 WeakPolarHBondContact CB-O 3.4Å; I392-G434 PolarHBondContact O-N 2.93Å; I392-D435 PolarHBondContact N-O 2.91Å
393	Y	91.6	Very high	88.3	Confident	4 Å²	4	40 Å²	40	2%	0.016	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-30.9	179.9	-72.1	-81.8	0	0	0	112.6	R136 N344 V373 L375 R391 M460	R136-Y393 PolarHBondContact NH1-OH 2.91Å; R136-Y393 PolarHBondContact O-OH 3.08Å; N344-Y393 HydrophobicContact CB-CD1 3.62Å; N344-Y393 HydrophobicContact CB-CE1 3.94Å; N344-Y393 VanDerWaalsContact CG-CE1 3.44Å; N344-Y393 VanDerWaalsContact OD1-CE1 3.3Å; N344-Y393 WeakPolarHBondContact OD1-CE1 3.24Å; V373-Y393 PolarHBondContact O-N 2.92Å; L375-Y393 HydrophobicContact CB-CD2 4.4Å; L375-Y393 HydrophobicContact CB-CE2 3.76Å; L375-Y393 HydrophobicContact CD2-CE2 4.28Å; R391-Y393 HydrophobicContact CB-CE2 4.37Å; R391-Y393 HydrophobicContact CG-CD2 4.41Å; R391-Y393 HydrophobicContact CG-CE1 4.42Å; R391-Y393 HydrophobicContact CG-CE2 3.96Å; R391-Y393 VanDerWaalsContact CZ-CE1 3.49Å; Y393-M460 HydrophobicContact CD1-CE 4.16Å; Y393-M460 HydrophobicContact CD2-CE 3.74Å; Y393-M460 HydrophobicContact CD2-CG 4.48Å; Y393-M460 HydrophobicContact CD2-SD 4.28Å; Y393-M460 HydrophobicContact CE1-CE 4.18Å; Y393-M460 HydrophobicContact CE2-CE 3.77Å; Y393-M460 HydrophobicContact CG-CE 3.93Å
394	Q	91.3	Very high	89.5	Confident	14 Å²	14	30.8 Å²	30.8	7%	0.065	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	148.9	-176	-179.1	167.2	26.2	0	0	110.5	M362 N363 H370 F372 V373	M362-Q394 PolarHBondContact SD-OE1 3.08Å; M362-Q394 VanDerWaalsContact SD-OE1 3.34Å; N363-Q394 WeakPolarHBondContact O-CG 3.39Å; H370-Q394 HydrophobicContact CB-CG 3.59Å; H370-Q394 PolarHBondContact CD2-NE2 2.93Å; F372-Q394 VanDerWaalsContact CA-O 3.31Å; F372-Q394 WeakPolarHBondContact CA-O 3.45Å; V373-Q394 HydrophobicContact CB-CB 4.47Å; V373-Q394 PolarHBondContact N-O 2.98Å
395	G	90.1	Very high	90.6	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.01	13%	0.125	C	C	.	.	S	Bend	trans	76.4	-162.7	177.5	0	0	0	0	0	113.4	A433	G395-A433 PolarHBondContact O-N 3.26Å
396	E	90.9	Very high	91	Very high	9 Å²	9	23.5 Å²	23.5	4%	0.042	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	150.5	-177.2	-177.8	179.2	-177.1	0	0	109.5	N368 K398 V431 Y432	N368-E396 PolarHBondContact ND2-OE2 3.03Å; N368-E396 WeakPolarHBondContact OD1-CB 3.34Å; N368-E396 PolarHBondContact OD1-OE2 3.26Å; E396-K398 HydrophobicContact CG-CG 4.43Å; E396-K398 WeakPolarHBondContact OE1-CE 3.35Å; E396-K398 IonicContact OE1-NZ 3.75Å; E396-K398 PolarHBondContact OE1-NZ 2.95Å; E396-K398 IonicContact OE2-NZ 2.79Å; E396-V431 WeakPolarHBondContact CA-O 3.22Å; E396-Y432 HydrophobicContact CB-CD1 4.06Å; E396-Y432 HydrophobicContact CB-CE1 4.31Å; E396-Y432 HydrophobicContact CG-CD1 3.77Å; E396-Y432 HydrophobicContact CG-CE1 3.69Å; E396-Y432 HydrophobicContact CG-CG 4.49Å; E396-Y432 VanDerWaalsContact OE1-CE1 3.32Å; E396-Y432 WeakPolarHBondContact OE1-CE1 3.25Å; E396-Y432 PolarHBondContact OE1-OH 3Å
397	L	91.9	Very high	91	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	126.8	176	-170.9	68.8	0	0	0	110.3	F372 D401 I403 L414 L417 E430 V431 L439	F372-L397 HydrophobicContact CD1-CD1 4.11Å; F372-L397 HydrophobicContact CD2-CB 3.86Å; F372-L397 HydrophobicContact CD2-CD1 4.31Å; F372-L397 HydrophobicContact CE1-CD1 4.1Å; F372-L397 HydrophobicContact CE1-CD2 4.31Å; F372-L397 HydrophobicContact CE2-CB 3.69Å; F372-L397 HydrophobicContact CE2-CD1 4.27Å; F372-L397 HydrophobicContact CE2-CD2 3.96Å; F372-L397 HydrophobicContact CE2-CG 4.21Å; F372-L397 HydrophobicContact CG-CD1 4.23Å; F372-L397 HydrophobicContact CZ-CB 4.28Å; F372-L397 HydrophobicContact CZ-CD1 4.19Å; F372-L397 HydrophobicContact CZ-CD2 3.72Å; F372-L397 HydrophobicContact CZ-CG 4.3Å; L397-D401 HydrophobicContact CD1-CB 4.19Å; L397-I403 HydrophobicContact CD1-CG2 3.54Å; L397-L414 HydrophobicContact CD1-CD1 3.42Å; L397-L414 VanDerWaalsContact CD1-CD1 3.42Å; L397-L414 HydrophobicContact CD2-CD1 3.58Å; L397-L414 HydrophobicContact CG-CD1 3.56Å; L397-L417 HydrophobicContact CD2-CD2 3.98Å; L397-L417 HydrophobicContact CG-CD1 4.48Å; L397-E430 WeakPolarHBondContact O-CA 3.49Å; L397-V431 HydrophobicContact CB-CG2 3.76Å; L397-V431 HydrophobicContact CD2-CG2 4.28Å; L397-V431 HydrophobicContact CG-CG2 4.46Å; L397-V431 PolarHBondContact N-O 3.13Å; L397-V431 WeakPolarHBondContact O-CG2 3.35Å; L397-V431 PolarHBondContact O-N 3.21Å; L397-L439 HydrophobicContact CD2-CD2 4.1Å
398	K	91.9	Very high	90.8	Very high	77 Å²	77	31 Å²	31	34%	0.335	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	153.4	-179.7	-62.7	-172.7	177.1	-168.1	0	112.1	E396 G400 D401 E430	E396-K398 HydrophobicContact CG-CG 4.43Å; E396-K398 WeakPolarHBondContact OE1-CE 3.35Å; E396-K398 IonicContact OE1-NZ 3.75Å; E396-K398 PolarHBondContact OE1-NZ 2.95Å; E396-K398 IonicContact OE2-NZ 2.79Å; K398-G400 PolarHBondContact O-N 3.09Å; K398-D401 PolarHBondContact N-OD2 2.82Å; K398-D401 VanDerWaalsContact O-CB 3.3Å; K398-D401 WeakPolarHBondContact O-CB 3.08Å; K398-D401 PolarHBondContact O-N 3.46Å; K398-D401 VanDerWaalsContact O-N 3.13Å; K398-E430 HydrophobicContact CG-CB 4.15Å; K398-E430 IonicContact NZ-OE2 3.16Å
399	K	91.5	Very high	90.6	Very high	124 Å²	124	38.7 Å²	38.7	54%	0.539	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	127.1	170.8	-177.2	-177.9	176.1	-178.2	0	109.7	Q415 L417 E429	K399-Q415 VanDerWaalsContact CE-O 3.23Å; K399-Q415 WeakPolarHBondContact CE-O 3.5Å; K399-L417 HydrophobicContact CB-CD1 4.45Å; K399-E429 PolarHBondContact N-O 3.41Å
400	G	89.5	Confident	90.5	Very high	33 Å²	33	44.7 Å²	44.7	34%	0.34	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	99	-11.9	-178.2	0	0	0	0	0	114.5	K398 L414	K398-G400 PolarHBondContact O-N 3.09Å; G400-L414 WeakPolarHBondContact CA-O 3.4Å; G400-L414 PolarHBondContact N-O 3.23Å
401	D	91.6	Very high	90.4	Very high	56 Å²	56	51.3 Å²	51.3	30%	0.299	24%	0.236	S	C	.	.			trans	-64.3	161.2	178.5	-79	-15.4	0	0	0	112.5	L397 K398 L414	L397-D401 HydrophobicContact CD1-CB 4.19Å; K398-D401 PolarHBondContact N-OD2 2.82Å; K398-D401 VanDerWaalsContact O-CB 3.3Å; K398-D401 WeakPolarHBondContact O-CB 3.08Å; K398-D401 PolarHBondContact O-N 3.46Å; K398-D401 VanDerWaalsContact O-N 3.13Å; D401-L414 HydrophobicContact CB-CD1 4.3Å; D401-L414 WeakPolarHBondContact O-CB 3.27Å; D401-L414 PolarHBondContact O-N 3.2Å
402	T	92.5	Very high	90.3	Very high	43 Å²	43	52.5 Å²	52.5	26%	0.264	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	123.8	173.9	-54.3	0	0	0	0	110.1	Y404 K411 V412	T402-Y404 HydrophobicContact CG2-CE2 4.48Å; T402-K411 HydrophobicContact CG2-CD 3.8Å; T402-K411 HydrophobicContact CG2-CG 3.28Å; T402-V412 WeakPolarHBondContact CA-O 3.42Å; T402-V412 WeakPolarHBondContact CG2-O 3.42Å
403	I	93.1	Very high	90.2	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	161.3	177.2	61.2	177.4	0	0	0	110.8	F372 L397 V412 L414 L439 I442 F450 T451	F372-I403 HydrophobicContact CD1-CG2 4.14Å; F372-I403 HydrophobicContact CE1-CG2 4.05Å; L397-I403 HydrophobicContact CD1-CG2 3.54Å; I403-V412 HydrophobicContact CG1-CB 4.11Å; I403-V412 PolarHBondContact N-O 3.09Å; I403-V412 PolarHBondContact O-N 3.09Å; I403-L414 HydrophobicContact CD1-CD1 4.3Å; I403-L414 HydrophobicContact CD1-CD2 3.91Å; I403-L414 HydrophobicContact CD1-CG 4.24Å; I403-L414 HydrophobicContact CG1-CD2 4.46Å; I403-L414 HydrophobicContact CG1-CG 4.36Å; I403-L414 HydrophobicContact CG2-CD1 3.92Å; I403-L439 HydrophobicContact CD1-CD1 4Å; I403-I442 HydrophobicContact CD1-CD1 3.99Å; I403-F450 HydrophobicContact CB-CB 4.5Å; I403-F450 HydrophobicContact CD1-CB 4.04Å; I403-F450 HydrophobicContact CD1-CD1 3.8Å; I403-F450 HydrophobicContact CD1-CD2 4.36Å; I403-F450 HydrophobicContact CD1-CE1 4.32Å; I403-F450 HydrophobicContact CD1-CG 3.82Å; I403-F450 HydrophobicContact CG1-CD1 4.3Å; I403-T451 CarbonylContact C-O 3.56Å; I403-T451 WeakPolarHBondContact CA-O 3.49Å
404	Y	91.8	Very high	90.2	Very high	54 Å²	54	60.4 Å²	60.4	21%	0.212	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	130.4	179.5	-62.5	-94.7	0	0	0	109.1	T402 K411 F450 T451 N452 A454	T402-Y404 HydrophobicContact CG2-CE2 4.48Å; Y404-K411 HydrophobicContact CD1-CB 4.06Å; Y404-K411 HydrophobicContact CD1-CG 4.28Å; Y404-K411 HydrophobicContact CE1-CB 3.82Å; Y404-K411 HydrophobicContact CE1-CD 4.04Å; Y404-K411 HydrophobicContact CE1-CG 3.73Å; Y404-F450 WeakPolarHBondContact O-CA 3.07Å; Y404-T451 PolarHBondContact N-O 2.68Å; Y404-T451 PolarHBondContact O-N 2.88Å; Y404-N452 WeakPolarHBondContact CE2-O 3.49Å; Y404-A454 HydrophobicContact CD1-CB 3.9Å; Y404-A454 HydrophobicContact CE1-CB 3.76Å; Y404-A454 HydrophobicContact CE2-CB 4.46Å; Y404-A454 HydrophobicContact CG-CB 4.29Å
405	N	90.8	Very high	90	Very high	1 Å²	1	65.4 Å²	65.4	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	123.2	169.8	-179.5	-42.5	0	0	0	108.5	R407 T408 R409 K410 D448 F450	N405-R407 PolarHBondContact OD1-N 3.22Å; N405-T408 WeakPolarHBondContact CB-OG1 3.46Å; N405-T408 PolarHBondContact ND2-OG1 3.09Å; N405-T408 PolarHBondContact OD1-N 3.09Å; N405-T408 VanDerWaalsContact OD1-N 3.1Å; N405-T408 PolarHBondContact OD1-OG1 3Å; N405-R409 WeakPolarHBondContact O-CA 3.47Å; N405-R409 PolarHBondContact O-N 2.76Å; N405-K410 PolarHBondContact N-O 2.99Å; N405-D448 PolarHBondContact ND2-OD2 3.42Å; N405-F450 HydrophobicContact CB-CD1 4.09Å; N405-F450 HydrophobicContact CB-CE1 3.85Å
406	T	87.9	Confident	90	Very high	21 Å²	21	70.2 Å²	70.2	13%	0.129	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-31.3	-172.8	59.1	0	0	0	0	113.1	T449 T451 L458	T406-T449 PolarHBondContact N-O 3.18Å; T406-T449 PolarHBondContact OG1-O 2.91Å; T406-T451 HydrophobicContact CG2-CG2 3.71Å; T406-L458 WeakPolarHBondContact CB-O 3.34Å; T406-L458 WeakPolarHBondContact CG2-O 3.38Å; T406-L458 PolarHBondContact OG1-O 3.37Å; T406-L458 VanDerWaalsContact OG1-O 3.07Å
407	R	84.9	Confident	89.9	Confident	156 Å²	156	69.8 Å²	69.8	59%	0.589	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-45.8	176.9	-175.5	-177.1	60.1	82.4	4.3	112.6	N405 D448	N405-R407 PolarHBondContact OD1-N 3.22Å; R407-D448 IonicContact CZ-OD1 3.9Å; R407-D448 IonicContact CZ-OD2 3.74Å; R407-D448 IonicContact NE-OD1 3.77Å; R407-D448 PolarHBondContact NE-OD1 3.16Å; R407-D448 IonicContact NE-OD2 2.64Å; R407-D448 IonicContact NH2-OD1 3.25Å; R407-D448 PolarHBondContact NH2-OD1 3.16Å; R407-D448 IonicContact NH2-OD2 3.25Å; R407-D448 PolarHBondContact NH2-OD2 2.68Å
408	T	86.1	Confident	89.7	Confident	50 Å²	50	70 Å²	70	31%	0.307	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-10.6	-176.4	60.4	0	0	0	0	113.8	N405 K410	N405-T408 WeakPolarHBondContact CB-OG1 3.46Å; N405-T408 PolarHBondContact ND2-OG1 3.09Å; N405-T408 PolarHBondContact OD1-N 3.09Å; N405-T408 VanDerWaalsContact OD1-N 3.1Å; N405-T408 PolarHBondContact OD1-OG1 3Å; T408-K410 PolarHBondContact O-N 3.46Å
409	R	86	Confident	89.3	Confident	160 Å²	160	68.5 Å²	68.5	60%	0.604	31%	0.306	S	S	*	.			trans	54.1	18	-172.4	-61.7	-178.4	170.7	173.2	-4.6	113.8	N405 D457	N405-R409 WeakPolarHBondContact O-CA 3.47Å; N405-R409 PolarHBondContact O-N 2.76Å; R409-D457 IonicContact CZ-OD1 2.78Å; R409-D457 IonicContact NE-OD1 3.81Å; R409-D457 IonicContact NH2-OD1 3.99Å; R409-D457 PolarHBondContact NH2-OD1 3.05Å; R409-D457 VanDerWaalsContact NH2-OD1 3.16Å
410	K	89.3	Confident	88.5	Confident	132 Å²	132	63.4 Å²	63.4	57%	0.574	28%	0.284	S	S	*	.			trans	-80.2	134.6	179	-72.7	-175.8	177.8	179.4	0	110.6	N405 T408	N405-K410 PolarHBondContact N-O 2.99Å; T408-K410 PolarHBondContact O-N 3.46Å
411	K	91	Very high	87.6	Confident	140 Å²	140	62.7 Å²	62.7	61%	0.609	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	129.9	173.6	-173.5	178.3	-178.6	177.8	0	109.8	T402 Y404	T402-K411 HydrophobicContact CG2-CD 3.8Å; T402-K411 HydrophobicContact CG2-CG 3.28Å; Y404-K411 HydrophobicContact CD1-CB 4.06Å; Y404-K411 HydrophobicContact CD1-CG 4.28Å; Y404-K411 HydrophobicContact CE1-CB 3.82Å; Y404-K411 HydrophobicContact CE1-CD 4.04Å; Y404-K411 HydrophobicContact CE1-CG 3.73Å
412	V	90.7	Very high	86.5	Confident	28 Å²	28	60.7 Å²	60.7	17%	0.17	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	128.7	-180	-176.2	0	0	0	0	109.7	T402 I403 I442	T402-V412 WeakPolarHBondContact CA-O 3.42Å; T402-V412 WeakPolarHBondContact CG2-O 3.42Å; I403-V412 HydrophobicContact CG1-CB 4.11Å; I403-V412 PolarHBondContact N-O 3.09Å; I403-V412 PolarHBondContact O-N 3.09Å; V412-I442 HydrophobicContact CG1-CB 4.4Å; V412-I442 HydrophobicContact CG1-CD1 3.88Å; V412-I442 HydrophobicContact CG1-CG1 3.8Å; V412-I442 HydrophobicContact CG1-CG2 4.09Å; V412-I442 HydrophobicContact CG2-CG2 4.41Å
413	R	90.8	Very high	85.4	Confident	168 Å²	168	63 Å²	63	63%	0.634	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	130	176.6	-174.3	175.2	-176.1	176.5	0.4	110.6
414	L	90.4	Very high	84.4	Confident	2 Å²	2	68.5 Å²	68.5	1%	0.01	30%	0.301	C	S	.	.			trans	-82.9	117.1	-179.1	-66.5	172.5	0	0	0	111.4	L397 G400 D401 I403 L417 L439 I442	L397-L414 HydrophobicContact CD1-CD1 3.42Å; L397-L414 VanDerWaalsContact CD1-CD1 3.42Å; L397-L414 HydrophobicContact CD2-CD1 3.58Å; L397-L414 HydrophobicContact CG-CD1 3.56Å; G400-L414 WeakPolarHBondContact CA-O 3.4Å; G400-L414 PolarHBondContact N-O 3.23Å; D401-L414 HydrophobicContact CB-CD1 4.3Å; D401-L414 WeakPolarHBondContact O-CB 3.27Å; D401-L414 PolarHBondContact O-N 3.2Å; I403-L414 HydrophobicContact CD1-CD1 4.3Å; I403-L414 HydrophobicContact CD1-CD2 3.91Å; I403-L414 HydrophobicContact CD1-CG 4.24Å; I403-L414 HydrophobicContact CG1-CD2 4.46Å; I403-L414 HydrophobicContact CG1-CG 4.36Å; I403-L414 HydrophobicContact CG2-CD1 3.92Å; L414-L417 HydrophobicContact CD1-CD2 4.28Å; L414-L417 HydrophobicContact CD2-CD2 4.44Å; L414-L439 HydrophobicContact CD2-CB 4.44Å; L414-L439 HydrophobicContact CD2-CD1 4.15Å; L414-L439 HydrophobicContact CD2-CD2 4.01Å; L414-L439 HydrophobicContact CD2-CG 4.44Å; L414-I442 HydrophobicContact CD2-CD1 3.66Å
415	Q	88.3	Confident	83.9	Confident	118 Å²	118	69.5 Å²	69.5	55%	0.551	31%	0.308	S	S	*	.			trans	-89.8	-41.9	177	-62.8	-62.9	-28.4	0	0	111.7	K399	K399-Q415 VanDerWaalsContact CE-O 3.23Å; K399-Q415 WeakPolarHBondContact CE-O 3.5Å
416	R	88.3	Confident	83.6	Confident	102 Å²	102	73.8 Å²	73.8	39%	0.385	33%	0.328	S	S	.	.			trans	-146.6	140.7	-173.6	-64.2	180	67	178.9	2.3	109.9	D427 F440	R416-D427 IonicContact CZ-OD1 3.84Å; R416-D427 IonicContact NE-OD1 2.68Å; R416-D427 PolarHBondContact NE-OD1 2.87Å; R416-D427 VanDerWaalsContact NH2-CG 3.31Å; R416-D427 IonicContact NH2-OD1 3Å; R416-D427 PolarHBondContact NH2-OD1 2.98Å; R416-D427 IonicContact NH2-OD2 3.79Å; R416-D427 PolarHBondContact NH2-OD2 2.89Å; R416-F440 HydrophobicContact CB-CB 4.44Å
417	L	89.4	Confident	83.5	Confident	1 Å²	1	77.6 Å²	77.6	1%	0.005	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	132.2	172.5	-62.9	174.9	0	0	0	107.3	L397 K399 L414 V428 V431 L439	L397-L417 HydrophobicContact CD2-CD2 3.98Å; L397-L417 HydrophobicContact CG-CD1 4.48Å; K399-L417 HydrophobicContact CB-CD1 4.45Å; L414-L417 HydrophobicContact CD1-CD2 4.28Å; L414-L417 HydrophobicContact CD2-CD2 4.44Å; L417-V428 PolarHBondContact O-N 2.66Å; L417-V431 HydrophobicContact CD1-CG2 4.2Å; L417-L439 HydrophobicContact CD2-CD2 3.16Å
418	T	87.7	Confident	83.6	Confident	3 Å²	3	71.4 Å²	71.4	2%	0.018	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	149.5	179.8	56.6	0	0	0	0	111.4	M425 E426 D427 A438	T418-M425 HydrophobicContact CG2-CB 4.44Å; T418-E426 CarbonylContact C-O 3.55Å; T418-E426 WeakPolarHBondContact CA-O 3.14Å; T418-E426 WeakPolarHBondContact CB-O 3.4Å; T418-D427 WeakPolarHBondContact CG2-OD1 3.36Å; T418-A438 PolarHBondContact N-O 3Å; T418-A438 VanDerWaalsContact N-O 3.07Å; T418-A438 PolarHBondContact O-N 2.68Å; T418-A438 PolarHBondContact OG1-O 3.29Å
419	R	83.4	Confident	83.8	Confident	47 Å²	47	76.5 Å²	76.5	18%	0.177	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	133.1	160.6	-76	177.1	-179.3	169.8	-2.2	108	E426 V428 D435	R419-E426 PolarHBondContact N-O 2.79Å; R419-E426 PolarHBondContact O-N 2.87Å; R419-V428 HydrophobicContact CB-CG2 4.14Å; R419-V428 HydrophobicContact CG-CG2 3.76Å; R419-D435 IonicContact NH2-OD2 2.86Å; R419-D435 PolarHBondContact NH2-OD2 3.22Å
420	M	75.8	Confident	83.9	Confident	17 Å²	17	72.4 Å²	72.4	8%	0.084	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	135.8	-179.2	-62.7	-60.9	-64.3	0	0	109.7	L387 Y389 M425 A438	L387-M420 HydrophobicContact CD1-CE 4.12Å; L387-M420 HydrophobicContact CD1-SD 4.47Å; Y389-M420 HydrophobicContact CD1-CG 4.38Å; Y389-M420 HydrophobicContact CE1-CB 3.75Å; Y389-M420 HydrophobicContact CE1-CG 3.5Å; Y389-M420 VanDerWaalsContact CE1-CG 3.5Å; M420-M425 HydrophobicContact CE-CG 3.98Å; M420-M425 HydrophobicContact SD-CB 4.46Å; M420-M425 HydrophobicContact SD-CG 3.7Å; M420-M425 HydrophobicContact SD-SD 4.46Å; M420-A438 HydrophobicContact CG-CB 3.6Å; M420-A438 HydrophobicContact SD-CB 4.1Å
421	H	69.8	Low	84	Confident	18 Å²	18	66.1 Å²	66.1	8%	0.083	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	90.7	168.8	-179.2	80	0	0	0	108.2	T107 Y108 D423 M424	T107-H421 PolarHBondContact OG1-CE1 2.89Å; T107-H421 PolarHBondContact OG1-ND1 3.21Å; Y108-H421 HydrophobicContact CD1-CB 4.33Å; Y108-H421 HydrophobicContact CE1-CB 4.21Å; Y108-H421 PolarHBondContact O-ND1 3.31Å; H421-D423 PolarHBondContact O-N 3Å; H421-M424 PolarHBondContact N-O 2.92Å; H421-M424 PolarHBondContact O-N 2.82Å
422	A	68.1	Low	84	Confident	13 Å²	13	60.4 Å²	60.4	11%	0.107	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.7	-111.3	-168.1	0	0	0	0	0	110	V88 M89 A106	V88-A422 HydrophobicContact CG1-CB 4.11Å; M89-A422 HydrophobicContact SD-CB 4.5Å; A106-A422 PolarHBondContact O-N 2.79Å
423	D	69.4	Low	84	Confident	91 Å²	91	59 Å²	59	49%	0.487	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-9.6	-178.9	-64.4	-28	0	0	0	115	S91 H421	S91-D423 VanDerWaalsContact CB-CG 3.42Å; S91-D423 WeakPolarHBondContact CB-OD1 3.29Å; S91-D423 WeakPolarHBondContact CB-OD2 3.3Å; S91-D423 PolarHBondContact OG-OD1 2.82Å; S91-D423 VanDerWaalsContact OG-OD1 3.09Å; H421-D423 PolarHBondContact O-N 3Å
424	M	73.3	Confident	83.8	Confident	117 Å²	117	51.1 Å²	51.1	58%	0.576	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	136.1	-178.9	-67.5	-167.7	-66.3	0	0	111.6	H421	H421-M424 PolarHBondContact N-O 2.92Å; H421-M424 PolarHBondContact O-N 2.82Å
425	M	79.9	Confident	83.8	Confident	75 Å²	75	51.1 Å²	51.1	37%	0.369	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	131.5	178.9	-57.4	-175.5	-130.9	0	0	110.7	F384 T418 M420	F384-M425 HydrophobicContact CD2-CE 3.71Å; F384-M425 HydrophobicContact CE2-CE 4.21Å; T418-M425 HydrophobicContact CG2-CB 4.44Å; M420-M425 HydrophobicContact CE-CG 3.98Å; M420-M425 HydrophobicContact SD-CB 4.46Å; M420-M425 HydrophobicContact SD-CG 3.7Å; M420-M425 HydrophobicContact SD-SD 4.46Å
426	E	84.3	Confident	83.9	Confident	91 Å²	91	46.4 Å²	46.4	43%	0.425	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	118.7	170.7	-174	174.9	177.4	0	0	109.2	Y108 T418 R419	Y108-E426 PolarHBondContact OH-OE2 2.94Å; T418-E426 CarbonylContact C-O 3.55Å; T418-E426 WeakPolarHBondContact CA-O 3.14Å; T418-E426 WeakPolarHBondContact CB-O 3.4Å; R419-E426 PolarHBondContact N-O 2.79Å; R419-E426 PolarHBondContact O-N 2.87Å
427	D	86.1	Confident	84	Confident	100 Å²	100	41.7 Å²	41.7	54%	0.535	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	131.4	177.5	-74.2	-52.5	0	0	0	110.2	R416 T418	R416-D427 IonicContact CZ-OD1 3.84Å; R416-D427 IonicContact NE-OD1 2.68Å; R416-D427 PolarHBondContact NE-OD1 2.87Å; R416-D427 VanDerWaalsContact NH2-CG 3.31Å; R416-D427 IonicContact NH2-OD1 3Å; R416-D427 PolarHBondContact NH2-OD1 2.98Å; R416-D427 IonicContact NH2-OD2 3.79Å; R416-D427 PolarHBondContact NH2-OD2 2.89Å; T418-D427 WeakPolarHBondContact CG2-OD1 3.36Å
428	V	87.9	Confident	84.1	Confident	26 Å²	26	41.6 Å²	41.6	16%	0.158	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	145.5	179.1	-172.9	0	0	0	0	109.6	L417 R419 E430 V431	L417-V428 PolarHBondContact O-N 2.66Å; R419-V428 HydrophobicContact CB-CG2 4.14Å; R419-V428 HydrophobicContact CG-CG2 3.76Å; V428-E430 WeakPolarHBondContact CG1-O 3.33Å; V428-V431 HydrophobicContact CG1-CG1 4.23Å
429	E	89.6	Confident	84.3	Confident	157 Å²	157	41.5 Å²	41.5	73%	0.734	21%	0.205	S	C	*	.	S	Bend	trans	-85.6	-37.9	-178.7	-63.6	-171.9	169.1	0	0	113	K399	K399-E429 PolarHBondContact N-O 3.41Å
430	E	89.4	Confident	84.5	Confident	74 Å²	74	42 Å²	42	35%	0.346	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	147.4	-176.5	64.5	-167.6	176.8	0	0	111.5	L397 K398 V428 Y432	L397-E430 WeakPolarHBondContact O-CA 3.49Å; K398-E430 HydrophobicContact CG-CB 4.15Å; K398-E430 IonicContact NZ-OE2 3.16Å; V428-E430 WeakPolarHBondContact CG1-O 3.33Å; E430-Y432 HydrophobicContact CG-CE2 3.9Å; E430-Y432 PolarHBondContact OE1-OH 2.95Å; E430-Y432 VanDerWaalsContact OE1-OH 3.06Å; E430-Y432 PolarHBondContact OE2-OH 2.9Å
431	V	90.6	Very high	84.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	145.3	179.2	-67.5	0	0	0	0	109.1	I392 E396 L397 L417 V428 C437	I392-V431 HydrophobicContact CD1-CB 3.61Å; I392-V431 HydrophobicContact CD1-CG2 3.26Å; E396-V431 WeakPolarHBondContact CA-O 3.22Å; L397-V431 HydrophobicContact CB-CG2 3.76Å; L397-V431 HydrophobicContact CD2-CG2 4.28Å; L397-V431 HydrophobicContact CG-CG2 4.46Å; L397-V431 PolarHBondContact N-O 3.13Å; L397-V431 WeakPolarHBondContact O-CG2 3.35Å; L397-V431 PolarHBondContact O-N 3.21Å; L417-V431 HydrophobicContact CD1-CG2 4.2Å; V428-V431 HydrophobicContact CG1-CG1 4.23Å; V431-C437 HydrophobicContact CG1-CB 3.96Å; V431-C437 HydrophobicContact CG2-CB 4.49Å
432	Y	90.9	Very high	85.7	Confident	20 Å²	20	43.1 Å²	43.1	8%	0.078	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	171.8	-171.3	-59	-92.3	0	0	0	111.9	V40 R366 I392 E396 E430 G434 D435	V40-Y432 HydrophobicContact CG1-CD2 4.43Å; V40-Y432 HydrophobicContact CG1-CE2 4.2Å; V40-Y432 HydrophobicContact CG2-CE2 4.23Å; R366-Y432 HydrophobicContact CB-CD1 4.05Å; R366-Y432 HydrophobicContact CB-CG 4.26Å; R366-Y432 VanDerWaalsContact NH2-CD2 3.32Å; I392-Y432 WeakPolarHBondContact CB-O 3.4Å; E396-Y432 HydrophobicContact CB-CD1 4.06Å; E396-Y432 HydrophobicContact CB-CE1 4.31Å; E396-Y432 HydrophobicContact CG-CD1 3.77Å; E396-Y432 HydrophobicContact CG-CE1 3.69Å; E396-Y432 HydrophobicContact CG-CG 4.49Å; E396-Y432 VanDerWaalsContact OE1-CE1 3.32Å; E396-Y432 WeakPolarHBondContact OE1-CE1 3.25Å; E396-Y432 PolarHBondContact OE1-OH 3Å; E430-Y432 HydrophobicContact CG-CE2 3.9Å; E430-Y432 PolarHBondContact OE1-OH 2.95Å; E430-Y432 VanDerWaalsContact OE1-OH 3.06Å; E430-Y432 PolarHBondContact OE2-OH 2.9Å; Y432-G434 PolarHBondContact O-N 2.88Å; Y432-D435 WeakPolarHBondContact O-CB 3.45Å; Y432-D435 PolarHBondContact O-N 2.87Å; Y432-D435 VanDerWaalsContact O-N 3.1Å
433	A	90.3	Very high	86.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.4	130.9	169	0	0	0	0	0	112.8	N43 R366 G395	N43-A433 PolarHBondContact OD1-O 3.48Å; R366-A433 PolarHBondContact NH1-O 2.76Å; G395-A433 PolarHBondContact O-N 3.26Å
434	G	87.6	Confident	87.1	Confident	2 Å²	2	43.1 Å²	43.1	2%	0.021	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	93	-14	-177.3	0	0	0	0	0	114.9	N48 I392 Y432	N48-G434 PolarHBondContact ND2-O 2.86Å; I392-G434 PolarHBondContact O-N 2.93Å; Y432-G434 PolarHBondContact O-N 2.88Å
435	D	89	Confident	87.7	Confident	2 Å²	2	39 Å²	39	1%	0.011	21%	0.211	C	C	.	.			trans	-85.5	153.4	179.7	-66.8	-0.8	0	0	0	112.3	R366 I392 R419 Y432	R366-D435 IonicContact CZ-OD1 3.79Å; R366-D435 IonicContact CZ-OD2 3.37Å; R366-D435 IonicContact NH1-OD1 2.73Å; R366-D435 PolarHBondContact NH1-OD1 3.2Å; R366-D435 IonicContact NH1-OD2 2.91Å; R366-D435 IonicContact NH2-OD1 3.9Å; R366-D435 PolarHBondContact NH2-OD1 2.98Å; R366-D435 IonicContact NH2-OD2 3.57Å; R366-D435 PolarHBondContact NH2-OD2 3.24Å; I392-D435 PolarHBondContact N-O 2.91Å; R419-D435 IonicContact NH2-OD2 2.86Å; R419-D435 PolarHBondContact NH2-OD2 3.22Å; Y432-D435 WeakPolarHBondContact O-CB 3.45Å; Y432-D435 PolarHBondContact O-N 2.87Å; Y432-D435 VanDerWaalsContact O-N 3.1Å
436	I	90.9	Very high	88	Confident	19 Å²	19	36.6 Å²	36.6	10%	0.097	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	126.8	167.8	-58.7	177.9	0	0	0	108	N117 I119 V137 F377 R391	N117-I436 HydrophobicContact CB-CD1 4.44Å; I119-I436 HydrophobicContact CD1-CD1 4.07Å; V137-I436 HydrophobicContact CG1-CD1 4.34Å; F377-I436 HydrophobicContact CE1-CG2 3.97Å; F377-I436 HydrophobicContact CZ-CG2 4.06Å; R391-I436 HydrophobicContact CB-CG1 4.42Å
437	C	91.3	Very high	88.1	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.014	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	164.5	-179.7	68.1	0	0	0	0	111.2	Y389 V390 V431	Y389-C437 CarbonylContact C-O 3.52Å; Y389-C437 WeakPolarHBondContact CA-O 3.44Å; V390-C437 PolarHBondContact N-O 3.22Å; V390-C437 PolarHBondContact O-N 2.99Å; V431-C437 HydrophobicContact CG1-CB 3.96Å; V431-C437 HydrophobicContact CG2-CB 4.49Å
438	A	90.9	Very high	88.2	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	135.9	172.1	0	0	0	0	0	110.4	L387 T388 Y389 T418 M420	L387-A438 HydrophobicContact CD2-CB 4.42Å; T388-A438 CarbonylContact O-C 3.59Å; T388-A438 WeakPolarHBondContact O-CA 3.43Å; Y389-A438 HydrophobicContact CD1-CB 4.49Å; T418-A438 PolarHBondContact N-O 3Å; T418-A438 VanDerWaalsContact N-O 3.07Å; T418-A438 PolarHBondContact O-N 2.68Å; T418-A438 PolarHBondContact OG1-O 3.29Å; M420-A438 HydrophobicContact CG-CB 3.6Å; M420-A438 HydrophobicContact SD-CB 4.1Å
439	L	90.9	Very high	88.4	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	138.9	177.1	-49.7	-177.8	0	0	0	109.6	L387 T388 V390 L397 I403 L414 L417 I442 F450	L387-L439 WeakPolarHBondContact CA-O 3.19Å; T388-L439 PolarHBondContact N-O 2.82Å; T388-L439 PolarHBondContact O-N 2.87Å; V390-L439 HydrophobicContact CB-CD1 4.3Å; V390-L439 HydrophobicContact CB-CG 4.44Å; V390-L439 HydrophobicContact CG2-CD1 3.52Å; V390-L439 HydrophobicContact CG2-CG 3.85Å; L397-L439 HydrophobicContact CD2-CD2 4.1Å; I403-L439 HydrophobicContact CD1-CD1 4Å; L414-L439 HydrophobicContact CD2-CB 4.44Å; L414-L439 HydrophobicContact CD2-CD1 4.15Å; L414-L439 HydrophobicContact CD2-CD2 4.01Å; L414-L439 HydrophobicContact CD2-CG 4.44Å; L417-L439 HydrophobicContact CD2-CD2 3.16Å; L439-I442 HydrophobicContact CB-CD1 3.45Å; L439-I442 VanDerWaalsContact CB-CD1 3.45Å; L439-I442 HydrophobicContact CB-CG1 4.06Å; L439-I442 HydrophobicContact CD1-CD1 3.48Å; L439-I442 VanDerWaalsContact CD1-CD1 3.48Å; L439-I442 HydrophobicContact CG-CD1 4.08Å; L439-F450 HydrophobicContact CD1-CD2 4.45Å; L439-F450 HydrophobicContact CD1-CE2 4.42Å
440	F	89	Confident	88.6	Confident	59 Å²	59	20.5 Å²	20.5	26%	0.259	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	134.1	-174.4	-166.6	-88.7	0	0	0	112.8	F384 L387 R416 I442	F384-F440 HydrophobicContact CB-CE2 3.89Å; F384-F440 HydrophobicContact CB-CZ 4.03Å; F384-F440 WeakPolarHBondContact O-CZ 3.23Å; L387-F440 HydrophobicContact CD2-CD2 3.83Å; R416-F440 HydrophobicContact CB-CB 4.44Å; F440-I442 VanDerWaalsContact C-N 3.3Å; F440-I442 PolarHBondContact O-N 3.3Å
441	G	83.2	Confident	88.7	Confident	55 Å²	55	17 Å²	17	57%	0.567	11%	0.113	S	C	*	.	S	Bend	trans	71.8	22.7	171.2	0	0	0	0	0	114.2	Q386	Q386-G441 PolarHBondContact O-N 2.7Å
442	I	86.4	Confident	88.5	Confident	3 Å²	3	19.6 Å²	19.6	2%	0.015	13%	0.127	C	C	.	.			trans	-94.6	121.6	178	-55.1	-167.2	0	0	0	109.5	Q386 T388 I403 V412 L414 L439 F440 C444 F450	Q386-I442 VanDerWaalsContact CD-O 3.25Å; Q386-I442 PolarHBondContact NE2-O 3.41Å; Q386-I442 VanDerWaalsContact NE2-O 3.17Å; T388-I442 PolarHBondContact OG1-O 3.1Å; I403-I442 HydrophobicContact CD1-CD1 3.99Å; V412-I442 HydrophobicContact CG1-CB 4.4Å; V412-I442 HydrophobicContact CG1-CD1 3.88Å; V412-I442 HydrophobicContact CG1-CG1 3.8Å; V412-I442 HydrophobicContact CG1-CG2 4.09Å; V412-I442 HydrophobicContact CG2-CG2 4.41Å; L414-I442 HydrophobicContact CD2-CD1 3.66Å; L439-I442 HydrophobicContact CB-CD1 3.45Å; L439-I442 VanDerWaalsContact CB-CD1 3.45Å; L439-I442 HydrophobicContact CB-CG1 4.06Å; L439-I442 HydrophobicContact CD1-CD1 3.48Å; L439-I442 VanDerWaalsContact CD1-CD1 3.48Å; L439-I442 HydrophobicContact CG-CD1 4.08Å; F440-I442 VanDerWaalsContact C-N 3.3Å; F440-I442 PolarHBondContact O-N 3.3Å; I442-C444 HydrophobicContact CG2-CB 4.26Å; I442-C444 PolarHBondContact O-N 3.31Å; I442-F450 HydrophobicContact CG2-CE1 4.09Å; I442-F450 HydrophobicContact CG2-CZ 3.67Å
443	D	82.6	Confident	88	Confident	97 Å²	97	25.1 Å²	25.1	52%	0.519	15%	0.151	S	C	.	.			trans	-83.8	108.3	170	-173.8	26.2	0	0	0	109.4
444	C	86	Confident	86.9	Confident	7 Å²	7	27.8 Å²	27.8	5%	0.047	17%	0.173	C	C	.	.			trans	-151.6	169.5	176.5	64	0	0	0	0	110.7	L379 T388 I442 D448 F450	L379-C444 VanDerWaalsContact CD1-O 3.23Å; L379-C444 WeakPolarHBondContact CD1-O 3.43Å; T388-C444 WeakPolarHBondContact CG2-SG 3.43Å; T388-C444 PolarHBondContact OG1-SG 2.98Å; T388-C444 VanDerWaalsContact OG1-SG 3.41Å; I442-C444 HydrophobicContact CG2-CB 4.26Å; I442-C444 PolarHBondContact O-N 3.31Å; C444-D448 HydrophobicContact CB-CB 4.37Å; C444-F450 HydrophobicContact CB-CE1 4.44Å; C444-F450 HydrophobicContact CB-CZ 3.7Å
445	A	85	Confident	85.9	Confident	29 Å²	29	34.8 Å²	34.8	24%	0.24	21%	0.21	C	C	.	.			trans	-100.5	155.1	171.6	0	0	0	0	0	110.8	G447 D448	A445-G447 PolarHBondContact O-N 2.73Å; A445-D448 PolarHBondContact N-OD2 2.73Å; A445-D448 WeakPolarHBondContact O-CB 3.43Å; A445-D448 PolarHBondContact O-N 2.81Å
446	S	85.3	Confident	85	Confident	25 Å²	25	35.7 Å²	35.7	18%	0.175	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	130.1	171.1	-172.7	0	0	0	0	109.7	R133 F377	R133-S446 VanDerWaalsContact CD-OG 3.31Å; R133-S446 WeakPolarHBondContact CD-OG 3.48Å; R133-S446 PolarHBondContact NH1-OG 2.98Å; R133-S446 VanDerWaalsContact NH1-OG 3.09Å; F377-S446 PolarHBondContact O-OG 3.16Å; F377-S446 VanDerWaalsContact O-OG 3.13Å
447	G	86.3	Confident	84.3	Confident	26 Å²	26	37.2 Å²	37.2	27%	0.268	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.8	-5.4	-175.1	0	0	0	0	0	114.8	L375 A376 A445	L375-G447 WeakPolarHBondContact CD1-O 3.28Å; A376-G447 VanDerWaalsContact O-CA 3.31Å; A376-G447 WeakPolarHBondContact O-CA 3.47Å; A376-G447 PolarHBondContact O-N 3.27Å; A445-G447 PolarHBondContact O-N 2.73Å
448	D	89.5	Confident	84	Confident	9 Å²	9	37.9 Å²	37.9	5%	0.048	23%	0.228	C	C	.	.			trans	-68.7	140.4	175.9	-75.7	-10.6	0	0	0	111.4	A376 N405 R407 C444 A445	A376-D448 WeakPolarHBondContact CB-O 3.38Å; A376-D448 PolarHBondContact N-O 3.19Å; N405-D448 PolarHBondContact ND2-OD2 3.42Å; R407-D448 IonicContact CZ-OD1 3.9Å; R407-D448 IonicContact CZ-OD2 3.74Å; R407-D448 IonicContact NE-OD1 3.77Å; R407-D448 PolarHBondContact NE-OD1 3.16Å; R407-D448 IonicContact NE-OD2 2.64Å; R407-D448 IonicContact NH2-OD1 3.25Å; R407-D448 PolarHBondContact NH2-OD1 3.16Å; R407-D448 IonicContact NH2-OD2 3.25Å; R407-D448 PolarHBondContact NH2-OD2 2.68Å; C444-D448 HydrophobicContact CB-CB 4.37Å; A445-D448 PolarHBondContact N-OD2 2.73Å; A445-D448 WeakPolarHBondContact O-CB 3.43Å; A445-D448 PolarHBondContact O-N 2.81Å
449	T	92	Very high	83.7	Confident	2 Å²	2	39 Å²	39	1%	0.012	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	137.3	175	-55.1	0	0	0	0	110.2	V373 G374 T406 T451 M460	V373-T449 HydrophobicContact CG1-CG2 3.97Å; G374-T449 CarbonylContact O-C 3.53Å; G374-T449 WeakPolarHBondContact O-CA 3.04Å; T406-T449 PolarHBondContact N-O 3.18Å; T406-T449 PolarHBondContact OG1-O 2.91Å; T449-T451 HydrophobicContact CG2-CG2 4.4Å; T449-M460 HydrophobicContact CG2-CG 4.05Å; T449-M460 PolarHBondContact OG1-N 3.13Å
450	F	92.8	Very high	83.5	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	138	175.3	-64.9	-66.1	0	0	0	111	F372 V373 G374 A376 T388 V390 I403 Y404 N405 L439 I442 C444	F372-F450 HydrophobicContact CE1-CB 3.98Å; V373-F450 WeakPolarHBondContact CA-O 3.46Å; G374-F450 PolarHBondContact N-O 3.34Å; G374-F450 PolarHBondContact O-N 3.04Å; A376-F450 HydrophobicContact CB-CE2 3.91Å; T388-F450 HydrophobicContact CG2-CE2 4.23Å; V390-F450 HydrophobicContact CG2-CD2 4.13Å; V390-F450 HydrophobicContact CG2-CE2 4.13Å; I403-F450 HydrophobicContact CB-CB 4.5Å; I403-F450 HydrophobicContact CD1-CB 4.04Å; I403-F450 HydrophobicContact CD1-CD1 3.8Å; I403-F450 HydrophobicContact CD1-CD2 4.36Å; I403-F450 HydrophobicContact CD1-CE1 4.32Å; I403-F450 HydrophobicContact CD1-CG 3.82Å; I403-F450 HydrophobicContact CG1-CD1 4.3Å; Y404-F450 WeakPolarHBondContact O-CA 3.07Å; N405-F450 HydrophobicContact CB-CD1 4.09Å; N405-F450 HydrophobicContact CB-CE1 3.85Å; L439-F450 HydrophobicContact CD1-CD2 4.45Å; L439-F450 HydrophobicContact CD1-CE2 4.42Å; I442-F450 HydrophobicContact CG2-CE1 4.09Å; I442-F450 HydrophobicContact CG2-CZ 3.67Å; C444-F450 HydrophobicContact CB-CE1 4.44Å; C444-F450 HydrophobicContact CB-CZ 3.7Å
451	T	92.3	Very high	82.9	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	159.4	177.6	63.2	0	0	0	0	111.8	F372 V373 I403 Y404 T406 T449 K453 S456 L458	F372-T451 VanDerWaalsContact O-CA 3.29Å; F372-T451 WeakPolarHBondContact O-CA 3.49Å; V373-T451 HydrophobicContact CG2-CG2 4.38Å; I403-T451 CarbonylContact C-O 3.56Å; I403-T451 WeakPolarHBondContact CA-O 3.49Å; Y404-T451 PolarHBondContact N-O 2.68Å; Y404-T451 PolarHBondContact O-N 2.88Å; T406-T451 HydrophobicContact CG2-CG2 3.71Å; T449-T451 HydrophobicContact CG2-CG2 4.4Å; T451-K453 PolarHBondContact OG1-O 3.1Å; T451-S456 VanDerWaalsContact CB-OG 3.28Å; T451-S456 WeakPolarHBondContact CB-OG 3.38Å; T451-S456 PolarHBondContact OG1-OG 3.05Å; T451-L458 HydrophobicContact CG2-CB 4.44Å
452	N	86.5	Confident	82.4	Confident	53 Å²	53	41.5 Å²	41.5	28%	0.283	25%	0.245	S	C	.	.	S	Bend	trans	-81.1	-18.4	178	-80.4	1.6	0	0	0	113.9	F372 Y404	F372-N452 HydrophobicContact CB-CB 4.09Å; F372-N452 VanDerWaalsContact CB-ND2 3.32Å; F372-N452 WeakPolarHBondContact CB-ND2 2.94Å; F372-N452 WeakPolarHBondContact CB-OD1 3.4Å; F372-N452 WeakPolarHBondContact CD1-OD1 3.44Å; Y404-N452 WeakPolarHBondContact CE2-O 3.49Å
453	K	80	Confident	82.2	Confident	136 Å²	136	42.3 Å²	42.3	59%	0.591	25%	0.249	S	C	*	.	S	Bend	trans	-107.7	136.7	-178.7	-67.1	-177.3	-179.3	178.5	0	110.3	T451 N455 S456	T451-K453 PolarHBondContact OG1-O 3.1Å; K453-N455 VanDerWaalsContact C-N 3.27Å; K453-N455 PolarHBondContact O-N 3.3Å; K453-S456 PolarHBondContact O-N 3.44Å; K453-S456 PolarHBondContact O-OG 2.68Å
454	A	67.8	Low	82.3	Confident	56 Å²	56	41.8 Å²	41.8	46%	0.463	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-30	178.8	0	0	0	0	0	113.4	Y404	Y404-A454 HydrophobicContact CD1-CB 3.9Å; Y404-A454 HydrophobicContact CE1-CB 3.76Å; Y404-A454 HydrophobicContact CE2-CB 4.46Å; Y404-A454 HydrophobicContact CG-CB 4.29Å
455	N	66.8	Low	82.3	Confident	150 Å²	150	44.1 Å²	44.1	80%	0.802	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	13.4	-176.2	-66.1	5.9	0	0	0	113.5	K453 D457	K453-N455 VanDerWaalsContact C-N 3.27Å; K453-N455 PolarHBondContact O-N 3.3Å; N455-D457 PolarHBondContact O-N 3.24Å
456	S	69.4	Low	82.2	Confident	20 Å²	20	43.9 Å²	43.9	14%	0.14	25%	0.254	C	S	.	.			trans	-83.2	93.3	166.4	38.3	0	0	0	0	108.3	T451 K453 L458	T451-S456 VanDerWaalsContact CB-OG 3.28Å; T451-S456 WeakPolarHBondContact CB-OG 3.38Å; T451-S456 PolarHBondContact OG1-OG 3.05Å; K453-S456 PolarHBondContact O-N 3.44Å; K453-S456 PolarHBondContact O-OG 2.68Å; S456-L458 PolarHBondContact O-N 2.96Å
457	D	75.9	Confident	82.1	Confident	52 Å²	52	47.9 Å²	47.9	28%	0.278	27%	0.273	S	S	.	.			trans	-72.7	53.5	170.3	-69.6	-51.3	0	0	0	110.3	N349 R409 N455	N349-D457 HydrophobicContact CB-CB 4.27Å; N349-D457 PolarHBondContact N-O 3.32Å; N349-D457 WeakPolarHBondContact O-CB 3.19Å; R409-D457 IonicContact CZ-OD1 2.78Å; R409-D457 IonicContact NE-OD1 3.81Å; R409-D457 IonicContact NH2-OD1 3.99Å; R409-D457 PolarHBondContact NH2-OD1 3.05Å; R409-D457 VanDerWaalsContact NH2-OD1 3.16Å; N455-D457 PolarHBondContact O-N 3.24Å
458	L	84.5	Confident	82.1	Confident	16 Å²	16	48.2 Å²	48.2	8%	0.084	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	127.8	177.5	-65.1	172	0	0	0	109.1	I347 L348 I360 V373 T406 T451 S456	I347-L458 WeakPolarHBondContact O-CA 3.33Å; L348-L458 HydrophobicContact CB-CD2 4.5Å; L348-L458 HydrophobicContact CD1-CD2 3.65Å; L348-L458 HydrophobicContact CD1-CG 4.4Å; I360-L458 HydrophobicContact CD1-CD2 3.65Å; V373-L458 HydrophobicContact CG2-CD1 4.2Å; T406-L458 WeakPolarHBondContact CB-O 3.34Å; T406-L458 WeakPolarHBondContact CG2-O 3.38Å; T406-L458 PolarHBondContact OG1-O 3.37Å; T406-L458 VanDerWaalsContact OG1-O 3.07Å; T451-L458 HydrophobicContact CG2-CB 4.44Å; S456-L458 PolarHBondContact O-N 2.96Å
459	S	85.4	Confident	81.8	Confident	23 Å²	23	49.1 Å²	49.1	16%	0.161	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	135.4	165.8	56.2	0	0	0	0	109.5	I347 N349	I347-S459 WeakPolarHBondContact CA-O 3.39Å; I347-S459 WeakPolarHBondContact CB-O 3.43Å; I347-S459 PolarHBondContact N-O 2.84Å; I347-S459 PolarHBondContact O-N 3.32Å; N349-S459 VanDerWaalsContact ND2-CB 3.28Å; N349-S459 WeakPolarHBondContact ND2-CB 3.24Å; N349-S459 PolarHBondContact ND2-OG 3.22Å; N349-S459 PolarHBondContact OD1-OG 3.25Å
460	M	86.4	Confident	81.5	Confident	6 Å²	6	50.1 Å²	50.1	3%	0.03	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	155.5	165.8	-62.8	-59.1	-66.8	0	0	110	Y345 A346 V373 L375 Y393 T449 S462	Y345-M460 WeakPolarHBondContact O-CE 3.22Å; A346-M460 HydrophobicContact CB-SD 3.71Å; V373-M460 HydrophobicContact CG1-CG 4.41Å; V373-M460 HydrophobicContact CG1-SD 4.03Å; L375-M460 HydrophobicContact CB-CG 4.19Å; L375-M460 HydrophobicContact CD1-CB 4.05Å; L375-M460 HydrophobicContact CD1-CG 4.48Å; L375-M460 HydrophobicContact CD2-CB 4.15Å; L375-M460 HydrophobicContact CG-CB 4.47Å; Y393-M460 HydrophobicContact CD1-CE 4.16Å; Y393-M460 HydrophobicContact CD2-CE 3.74Å; Y393-M460 HydrophobicContact CD2-CG 4.48Å; Y393-M460 HydrophobicContact CD2-SD 4.28Å; Y393-M460 HydrophobicContact CE1-CE 4.18Å; Y393-M460 HydrophobicContact CE2-CE 3.77Å; Y393-M460 HydrophobicContact CG-CE 3.93Å; T449-M460 HydrophobicContact CG2-CG 4.05Å; T449-M460 PolarHBondContact OG1-N 3.13Å; M460-S462 PolarHBondContact O-N 2.93Å
461	E	77.5	Confident	81.4	Confident	58 Å²	58	52.2 Å²	52.2	27%	0.271	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-55.7	129.9	174.9	-62.6	-176.8	155.4	0	0	110.7	I347 K359	I347-E461 HydrophobicContact CD1-CB 4.39Å; I347-E461 HydrophobicContact CD1-CG 3.84Å; I347-E461 HydrophobicContact CG1-CG 3.99Å; K359-E461 IonicContact NZ-OE1 2.72Å; K359-E461 PolarHBondContact NZ-OE1 2.91Å
462	S	72.3	Confident	81.3	Confident	103 Å²	103	53.5 Å²	53.5	72%	0.72	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-65.5	149.4	-179	56.7	0	0	0	0	111.7	M460	M460-S462 PolarHBondContact O-N 2.93Å
463	I	82.8	Confident	81.6	Confident	19 Å²	19	51.5 Å²	51.5	10%	0.097	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-71.9	139.5	174.4	-56.5	166.2	0	0	0	108.1	I129 E132 R133 R136 V465	I129-I463 HydrophobicContact CD1-CG2 4.28Å; E132-I463 HydrophobicContact CB-CG2 3.88Å; R133-I463 HydrophobicContact CB-CD1 4.25Å; R133-I463 HydrophobicContact CG-CD1 3.73Å; R133-I463 HydrophobicContact CG-CG2 4.2Å; R136-I463 HydrophobicContact CB-CG1 4.42Å; R136-I463 HydrophobicContact CG-CG1 4.21Å; I463-V465 PolarHBondContact O-N 3.16Å
464	H	84.6	Confident	82.2	Confident	87 Å²	87	45.6 Å²	45.6	40%	0.403	27%	0.27	S	S	.	.			trans	-71.4	111.5	173	176.5	-83.8	0	0	0	109.6	R164 Y165	R164-H464 PolarHBondContact NH1-ND1 3.28Å; Y165-H464 PolarHBondContact OH-N 2.99Å
465	V	85.8	Confident	83.3	Confident	55 Å²	55	48.9 Å²	48.9	33%	0.333	27%	0.273	S	S	.	.			trans	-95.1	114.4	176.3	-176.4	0	0	0	0	108.1	I129 I463 P497 T498	I129-V465 HydrophobicContact CD1-CG2 4.28Å; I463-V465 PolarHBondContact O-N 3.16Å; V465-P497 HydrophobicContact CG1-CB 4.02Å; V465-P497 HydrophobicContact CG1-CG 4.1Å; V465-P497 HydrophobicContact CG2-CB 3.99Å; V465-P497 HydrophobicContact CG2-CG 3.8Å; V465-T498 HydrophobicContact CG1-CG2 3.85Å
466	P	82.3	Confident	84.6	Confident	25 Å²	25	43 Å²	43	16%	0.162	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-69.3	154.3	174.9	30.4	-34.4	0	0	0	111.1	T498 M515	P466-T498 HydrophobicContact CG-CG2 4.04Å; P466-M515 HydrophobicContact CB-CE 3.82Å; P466-M515 HydrophobicContact CB-SD 4.27Å; P466-M515 HydrophobicContact CG-CE 3.63Å; P466-M515 HydrophobicContact CG-SD 3.85Å
467	D	82.9	Confident	85.7	Confident	109 Å²	109	45 Å²	45	58%	0.583	26%	0.257	S	S	*	.	P	Polyproline II helix	trans	-76.6	142.4	176.3	-76.6	-48.2	0	0	0	112.4	K500	D467-K500 IonicContact OD1-NZ 3.81Å; D467-K500 PolarHBondContact OD1-NZ 2.7Å
468	P	86.8	Confident	86.6	Confident	33 Å²	33	46 Å²	46	21%	0.214	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-69.2	137.9	179.9	28.8	-34	0	0	0	111.1	K500 G514	P468-K500 HydrophobicContact CG-CD 4.01Å; P468-K500 HydrophobicContact CG-CG 4.41Å; P468-G514 CarbonylContact C-O 3.59Å; P468-G514 WeakPolarHBondContact CA-O 3.33Å; P468-G514 WeakPolarHBondContact CB-O 3.45Å
469	V	83.4	Confident	86.8	Confident	28 Å²	28	54.2 Å²	54.2	17%	0.17	30%	0.298	C	S	.	.			trans	-103.3	-12.1	-174.4	-62.1	0	0	0	0	114	G514 M515 S719 Y732	V469-G514 PolarHBondContact N-O 2.92Å; V469-M515 WeakPolarHBondContact CG2-O 3.43Å; V469-S719 WeakPolarHBondContact CG2-OG 3.39Å; V469-Y732 HydrophobicContact CB-CE1 4.24Å; V469-Y732 PolarHBondContact O-OH 2.9Å
470	I	86.2	Confident	87.2	Confident	22 Å²	22	59.8 Å²	59.8	11%	0.113	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	143.5	178.1	-172	168.7	0	0	0	110.2	V472 S513 G514 G516 E517 L520	I470-V472 HydrophobicContact CD1-CG2 4.37Å; I470-V472 HydrophobicContact CG1-CG2 4.26Å; I470-S513 CarbonylContact O-C 3.57Å; I470-S513 WeakPolarHBondContact O-CA 3.3Å; I470-G514 WeakPolarHBondContact CG2-O 3.31Å; I470-G514 PolarHBondContact N-O 3.24Å; I470-G514 VanDerWaalsContact N-O 3.08Å; I470-G514 PolarHBondContact O-N 3.38Å; I470-G516 VanDerWaalsContact CG2-C 3.48Å; I470-G516 WeakPolarHBondContact CG2-O 3.41Å; I470-E517 HydrophobicContact CD1-CB 4.14Å; I470-L520 HydrophobicContact CG1-CD1 4.39Å; I470-L520 HydrophobicContact CG2-CD1 3.72Å; I470-L520 HydrophobicContact CG2-CG 4.25Å
471	S	89.3	Confident	87.5	Confident	45 Å²	45	60.6 Å²	60.6	32%	0.315	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	136.5	173.4	-64.2	0	0	0	0	110.4	V512 S513 P540	S471-V512 CarbonylContact C-O 3.51Å; S471-V512 WeakPolarHBondContact CA-O 2.91Å; S471-S513 PolarHBondContact OG-OG 2.91Å; S471-P540 WeakPolarHBondContact O-CD 3.37Å; S471-P540 WeakPolarHBondContact O-CG 3.28Å
472	V	90.8	Very high	88.2	Confident	27 Å²	27	62.8 Å²	62.8	16%	0.164	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	137.8	-177.2	175.7	0	0	0	0	109	I470 V512 L520 T537 G538	I470-V472 HydrophobicContact CD1-CG2 4.37Å; I470-V472 HydrophobicContact CG1-CG2 4.26Å; V472-V512 PolarHBondContact N-O 3.37Å; V472-V512 PolarHBondContact O-N 3.18Å; V472-L520 HydrophobicContact CB-CD1 3.86Å; V472-L520 HydrophobicContact CG2-CD1 3.48Å; V472-L520 VanDerWaalsContact CG2-CD1 3.48Å; V472-T537 HydrophobicContact CG1-CG2 4.09Å; V472-G538 VanDerWaalsContact CG1-O 3.27Å; V472-G538 WeakPolarHBondContact CG1-O 3.5Å
473	A	92.3	Very high	89.2	Confident	12 Å²	12	65.9 Å²	65.9	10%	0.099	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	123.6	169.9	0	0	0	0	0	109.1	T537 G538	A473-T537 CarbonylContact O-C 3.56Å; A473-T537 WeakPolarHBondContact O-CA 3.35Å; A473-G538 PolarHBondContact N-O 3.27Å; A473-G538 PolarHBondContact O-N 2.88Å
474	M	92.6	Very high	89.7	Confident	12 Å²	12	69.5 Å²	69.5	6%	0.059	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	125.1	-178.4	-167.7	177.5	-171.8	0	0	109.5	F485 I489 T510 V512 A524 M527 C535 T537	M474-F485 HydrophobicContact CE-CE2 4.33Å; M474-F485 HydrophobicContact CG-CE2 4.05Å; M474-F485 HydrophobicContact CG-CZ 4.27Å; M474-F485 HydrophobicContact SD-CE2 4.1Å; M474-F485 HydrophobicContact SD-CZ 4.47Å; M474-I489 HydrophobicContact SD-CD1 4.33Å; M474-T510 PolarHBondContact N-O 3.47Å; M474-V512 HydrophobicContact CB-CG2 3.81Å; M474-V512 HydrophobicContact SD-CG2 4.13Å; M474-A524 HydrophobicContact CE-CB 3.82Å; M474-M527 HydrophobicContact CE-CB 4.3Å; M474-M527 HydrophobicContact CE-CG 3.87Å; M474-C535 HydrophobicContact CE-CB 3.38Å; M474-C535 HydrophobicContact CG-CB 4.03Å; M474-T537 HydrophobicContact CG-CG2 4.48Å
475	K	91.9	Very high	90.1	Very high	124 Å²	124	65.8 Å²	65.8	54%	0.539	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	141.8	177.4	62.8	-177.6	177.1	-175.9	0	111.3	C535 I536	K475-C535 CarbonylContact O-C 3.57Å; K475-C535 WeakPolarHBondContact O-CA 3.46Å; K475-I536 HydrophobicContact CG-CB 3.98Å; K475-I536 PolarHBondContact N-O 3.25Å; K475-I536 PolarHBondContact O-N 2.89Å
476	P	94.4	Very high	90.4	Very high	26 Å²	26	67.1 Å²	67.1	17%	0.169	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	138.6	170.2	29	-34.1	0	0	0	109.4	N478 L482 F485	P476-N478 VanDerWaalsContact C-N 3.29Å; P476-N478 PolarHBondContact O-N 3.29Å; P476-L482 HydrophobicContact CG-CD1 4.19Å; P476-F485 HydrophobicContact CB-CB 4.48Å; P476-F485 HydrophobicContact CB-CD2 4.5Å; P476-F485 HydrophobicContact CG-CG 4.44Å
477	S	93	Very high	90.8	Very high	63 Å²	63	73.1 Å²	73.1	44%	0.441	38%	0.379	S	S	.	.	S	Bend	trans	-63.4	-38.6	177.4	55.4	0	0	0	0	111.6	P534	S477-P534 WeakPolarHBondContact CB-O 3.08Å; S477-P534 PolarHBondContact N-O 3.5Å; S477-P534 WeakPolarHBondContact OG-CG 3.19Å; S477-P534 PolarHBondContact OG-O 2.74Å
478	N	92.9	Very high	91.2	Very high	72 Å²	72	67.9 Å²	67.9	39%	0.385	35%	0.351	S	S	.	.	S	Bend	trans	-110.2	132.1	175.9	-168.7	-12.2	0	0	0	110.9	P476 N480 D481	P476-N478 VanDerWaalsContact C-N 3.29Å; P476-N478 PolarHBondContact O-N 3.29Å; N478-N480 PolarHBondContact O-N 3.13Å; N478-N480 PolarHBondContact OD1-N 3.42Å; N478-N480 VanDerWaalsContact OD1-N 3.11Å; N478-D481 PolarHBondContact O-N 2.81Å
479	K	90.3	Very high	91.4	Very high	190 Å²	190	67 Å²	67	83%	0.826	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-65.4	-24.2	177.9	-68.2	-172.1	178	-177	0	113	D481 L482	K479-D481 PolarHBondContact O-N 3.34Å; K479-L482 WeakPolarHBondContact O-CB 3.48Å; K479-L482 PolarHBondContact O-N 2.72Å
480	N	92.8	Very high	91.7	Very high	139 Å²	139	66.9 Å²	66.9	74%	0.743	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-67.7	-21.8	179.7	-64	-10.3	0	0	0	112.8	N478 L482	N478-N480 PolarHBondContact O-N 3.13Å; N478-N480 PolarHBondContact OD1-N 3.42Å; N478-N480 VanDerWaalsContact OD1-N 3.11Å; N480-L482 VanDerWaalsContact C-N 3.32Å
481	D	92.8	Very high	91.7	Very high	23 Å²	23	67.9 Å²	67.9	12%	0.123	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-91.5	10.2	-178.9	-63.9	-57.5	0	0	0	113.2	N478 K479 E483 K484 F485 C533	N478-D481 PolarHBondContact O-N 2.81Å; K479-D481 PolarHBondContact O-N 3.34Å; D481-E483 VanDerWaalsContact C-N 3.28Å; D481-E483 PolarHBondContact O-N 3Å; D481-K484 PolarHBondContact O-N 2.99Å; D481-K484 VanDerWaalsContact O-N 3.13Å; D481-K484 IonicContact OD1-NZ 3.99Å; D481-K484 PolarHBondContact OD1-NZ 2.86Å; D481-F485 WeakPolarHBondContact O-CB 3Å; D481-F485 PolarHBondContact O-N 3.29Å; D481-C533 HydrophobicContact CB-CB 4.37Å
482	L	92.1	Very high	91.7	Very high	104 Å²	104	65.7 Å²	65.7	55%	0.545	34%	0.336	S	S	.	.	H	α-helix	trans	-59.2	-35.5	-176.9	-171.1	67.8	0	0	0	113.2	P476 K479 N480 F485 S486	P476-L482 HydrophobicContact CG-CD1 4.19Å; K479-L482 WeakPolarHBondContact O-CB 3.48Å; K479-L482 PolarHBondContact O-N 2.72Å; N480-L482 VanDerWaalsContact C-N 3.32Å; L482-F485 HydrophobicContact CD1-CD1 4.47Å; L482-F485 WeakPolarHBondContact O-CB 3.31Å; L482-F485 PolarHBondContact O-N 3.47Å; L482-S486 WeakPolarHBondContact O-CB 3.25Å; L482-S486 PolarHBondContact O-N 2.91Å
483	E	92.8	Very high	91.7	Very high	168 Å²	168	67 Å²	67	79%	0.785	35%	0.345	S	S	*	.	H	α-helix	trans	-66.5	-44.4	176.8	-171.1	-174.9	167.7	0	0	111.4	D481 F485 S486 K487	D481-E483 VanDerWaalsContact C-N 3.28Å; D481-E483 PolarHBondContact O-N 3Å; E483-F485 VanDerWaalsContact C-N 3.3Å; E483-F485 PolarHBondContact O-N 3.47Å; E483-S486 PolarHBondContact O-N 3.47Å; E483-K487 WeakPolarHBondContact O-CB 3.34Å; E483-K487 PolarHBondContact O-N 2.73Å
484	K	93.1	Very high	91.4	Very high	96 Å²	96	73.1 Å²	73.1	42%	0.417	37%	0.365	S	S	.	.	H	α-helix	trans	-63.9	-39.8	175.3	-59.3	178.1	-168.5	157	0	110.8	D481 K487 G488 Y531	D481-K484 PolarHBondContact O-N 2.99Å; D481-K484 VanDerWaalsContact O-N 3.13Å; D481-K484 IonicContact OD1-NZ 3.99Å; D481-K484 PolarHBondContact OD1-NZ 2.86Å; K484-K487 PolarHBondContact O-N 3.47Å; K484-G488 PolarHBondContact O-N 3.15Å; K484-Y531 WeakPolarHBondContact CD-O 3.3Å
485	F	93.2	Very high	91.1	Very high	9 Å²	9	72.8 Å²	72.8	4%	0.039	36%	0.363	C	S	.	.	H	α-helix	trans	-59.3	-52.8	175.6	-178.3	-100.7	0	0	0	111.6	M474 P476 D481 L482 E483 K487 G488 I489 T510 M527	M474-F485 HydrophobicContact CE-CE2 4.33Å; M474-F485 HydrophobicContact CG-CE2 4.05Å; M474-F485 HydrophobicContact CG-CZ 4.27Å; M474-F485 HydrophobicContact SD-CE2 4.1Å; M474-F485 HydrophobicContact SD-CZ 4.47Å; P476-F485 HydrophobicContact CB-CB 4.48Å; P476-F485 HydrophobicContact CB-CD2 4.5Å; P476-F485 HydrophobicContact CG-CG 4.44Å; D481-F485 WeakPolarHBondContact O-CB 3Å; D481-F485 PolarHBondContact O-N 3.29Å; L482-F485 HydrophobicContact CD1-CD1 4.47Å; L482-F485 WeakPolarHBondContact O-CB 3.31Å; L482-F485 PolarHBondContact O-N 3.47Å; E483-F485 VanDerWaalsContact C-N 3.3Å; E483-F485 PolarHBondContact O-N 3.47Å; F485-K487 VanDerWaalsContact C-N 3.33Å; F485-K487 PolarHBondContact O-N 3.25Å; F485-G488 PolarHBondContact O-N 3.22Å; F485-I489 HydrophobicContact CD1-CG1 4.28Å; F485-I489 HydrophobicContact CD2-CG1 4.29Å; F485-I489 HydrophobicContact CE1-CG1 3.91Å; F485-I489 HydrophobicContact CE2-CD1 4.14Å; F485-I489 HydrophobicContact CE2-CG1 3.91Å; F485-I489 HydrophobicContact CG-CG1 4.46Å; F485-I489 HydrophobicContact CZ-CD1 4.04Å; F485-I489 HydrophobicContact CZ-CG1 3.71Å; F485-I489 WeakPolarHBondContact O-CB 3.31Å; F485-I489 WeakPolarHBondContact O-CG1 3.28Å; F485-I489 PolarHBondContact O-N 3.14Å; F485-T510 HydrophobicContact CE1-CG2 4.35Å; F485-M527 HydrophobicContact CB-CE 4.44Å; F485-M527 HydrophobicContact CD2-CE 3.89Å; F485-M527 HydrophobicContact CG-CE 4.49Å
486	S	92.7	Very high	90.9	Very high	82 Å²	82	67 Å²	67	57%	0.573	34%	0.338	S	S	*	.	H	α-helix	trans	-59.9	-42.5	178.5	-177.6	0	0	0	0	112.2	L482 E483 G490	L482-S486 WeakPolarHBondContact O-CB 3.25Å; L482-S486 PolarHBondContact O-N 2.91Å; E483-S486 PolarHBondContact O-N 3.47Å; S486-G490 PolarHBondContact O-N 3.32Å
487	K	90.8	Very high	90.6	Very high	151 Å²	151	67.9 Å²	67.9	66%	0.657	34%	0.344	S	S	*	.	H	α-helix	trans	-63.6	-43.5	176.4	-173.1	178.4	-179.7	-179.9	0	112.5	E483 K484 F485 R491	E483-K487 WeakPolarHBondContact O-CB 3.34Å; E483-K487 PolarHBondContact O-N 2.73Å; K484-K487 PolarHBondContact O-N 3.47Å; F485-K487 VanDerWaalsContact C-N 3.33Å; F485-K487 PolarHBondContact O-N 3.25Å; K487-R491 PolarHBondContact O-N 3.44Å; K487-R491 VanDerWaalsContact O-N 3.15Å
488	G	90.6	Very high	90.4	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-66.7	-48.2	179.1	0	0	0	0	0	112.6	K484 F485 G490 R491 F492	K484-G488 PolarHBondContact O-N 3.15Å; F485-G488 PolarHBondContact O-N 3.22Å; G488-G490 PolarHBondContact O-N 3.08Å; G488-R491 WeakPolarHBondContact O-CB 3.44Å; G488-R491 PolarHBondContact O-N 3.24Å; G488-R491 VanDerWaalsContact O-N 3.16Å; G488-F492 WeakPolarHBondContact O-CD2 3.13Å; G488-F492 WeakPolarHBondContact O-CG 3.43Å; G488-F492 PolarHBondContact O-N 2.91Å
489	I	92	Very high	90.4	Very high	14 Å²	14	61.6 Å²	61.6	7%	0.072	31%	0.305	C	S	.	.	H	α-helix	trans	-58.9	-49	175.4	-70.2	-64.4	0	0	0	111.2	M474 F485 R491 F492 T493 F499 V501	M474-I489 HydrophobicContact SD-CD1 4.33Å; F485-I489 HydrophobicContact CD1-CG1 4.28Å; F485-I489 HydrophobicContact CD2-CG1 4.29Å; F485-I489 HydrophobicContact CE1-CG1 3.91Å; F485-I489 HydrophobicContact CE2-CD1 4.14Å; F485-I489 HydrophobicContact CE2-CG1 3.91Å; F485-I489 HydrophobicContact CG-CG1 4.46Å; F485-I489 HydrophobicContact CZ-CD1 4.04Å; F485-I489 HydrophobicContact CZ-CG1 3.71Å; F485-I489 WeakPolarHBondContact O-CB 3.31Å; F485-I489 WeakPolarHBondContact O-CG1 3.28Å; F485-I489 PolarHBondContact O-N 3.14Å; I489-R491 PolarHBondContact O-N 3.15Å; I489-F492 PolarHBondContact O-N 3.28Å; I489-F492 VanDerWaalsContact O-N 3.11Å; I489-T493 PolarHBondContact O-N 3.1Å; I489-T493 PolarHBondContact O-OG1 3.32Å; I489-T493 VanDerWaalsContact O-OG1 3.13Å; I489-F499 HydrophobicContact CD1-CE1 3.96Å; I489-F499 HydrophobicContact CD1-CZ 3.94Å; I489-V501 HydrophobicContact CG2-CB 4.1Å; I489-V501 HydrophobicContact CG2-CG1 4.01Å; I489-V501 HydrophobicContact CG2-CG2 3.69Å
490	G	89.4	Confident	90.4	Very high	26 Å²	26	56.7 Å²	56.7	27%	0.268	28%	0.284	S	S	.	.	H	α-helix	trans	-60.7	-28.4	178.9	0	0	0	0	0	113.5	S486 G488 R494	S486-G490 PolarHBondContact O-N 3.32Å; G488-G490 PolarHBondContact O-N 3.08Å; G490-R494 WeakPolarHBondContact O-CG 3.44Å; G490-R494 PolarHBondContact O-NE 3.15Å
491	R	86.3	Confident	90.4	Very high	42 Å²	42	52.4 Å²	52.4	16%	0.158	26%	0.263	C	S	.	.	H	α-helix	trans	-73	-51.4	171.3	177.1	-167.7	166.8	-169.9	-6.5	111.2	V381 K487 G488 I489 T493 R494 E495 E530 Y531	V381-R491 HydrophobicContact CG2-CG 4.31Å; V381-R491 PolarHBondContact O-NH2 3.42Å; K487-R491 PolarHBondContact O-N 3.44Å; K487-R491 VanDerWaalsContact O-N 3.15Å; G488-R491 WeakPolarHBondContact O-CB 3.44Å; G488-R491 PolarHBondContact O-N 3.24Å; G488-R491 VanDerWaalsContact O-N 3.16Å; I489-R491 PolarHBondContact O-N 3.15Å; R491-T493 VanDerWaalsContact C-N 3.3Å; R491-T493 PolarHBondContact O-N 2.92Å; R491-R494 PolarHBondContact O-N 2.82Å; R491-E495 IonicContact NE-OE2 3.94Å; R491-E495 IonicContact NH2-OE2 3.14Å; R491-E495 PolarHBondContact O-N 3.41Å; R491-E530 IonicContact CZ-OE2 2.73Å; R491-E530 IonicContact NH1-OE2 3.19Å; R491-E530 PolarHBondContact NH1-OE2 2.92Å; R491-E530 IonicContact NH2-OE2 2.81Å; R491-E530 PolarHBondContact NH2-OE2 3.3Å; R491-Y531 WeakPolarHBondContact CD-OH 3.37Å; R491-Y531 PolarHBondContact NH1-OH 3.2Å
492	F	89.8	Confident	90.3	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.4	-38.5	-176.6	-67.2	-24.4	0	0	0	112.6	G488 I489 R494 E495 D496 F499 Y523 R526 M527 Y531	G488-F492 WeakPolarHBondContact O-CD2 3.13Å; G488-F492 WeakPolarHBondContact O-CG 3.43Å; G488-F492 PolarHBondContact O-N 2.91Å; I489-F492 PolarHBondContact O-N 3.28Å; I489-F492 VanDerWaalsContact O-N 3.11Å; F492-R494 VanDerWaalsContact C-N 3.28Å; F492-R494 PolarHBondContact O-N 3.24Å; F492-E495 PolarHBondContact O-N 2.86Å; F492-D496 PolarHBondContact O-N 2.99Å; F492-F499 HydrophobicContact CB-CD1 4Å; F492-F499 HydrophobicContact CB-CE1 3.97Å; F492-Y523 HydrophobicContact CB-CD1 3.87Å; F492-Y523 HydrophobicContact CB-CE1 3.69Å; F492-Y523 HydrophobicContact CD1-CD1 4.19Å; F492-Y523 HydrophobicContact CD1-CE1 4.01Å; F492-Y523 AromaticContact CD2-CD1 3.61Å; F492-Y523 HydrophobicContact CD2-CD1 3.61Å; F492-Y523 HydrophobicContact CD2-CE1 4.19Å; F492-Y523 HydrophobicContact CE2-CD1 4.1Å; F492-Y523 AromaticContact CG-CD1 3.65Å; F492-Y523 HydrophobicContact CG-CD1 3.65Å; F492-Y523 AromaticContact CG-CE1 3.72Å; F492-Y523 HydrophobicContact CG-CE1 3.72Å; F492-R526 HydrophobicContact CE2-CB 4.28Å; F492-R526 HydrophobicContact CZ-CB 3.81Å; F492-M527 HydrophobicContact CD2-CG 4.35Å; F492-M527 HydrophobicContact CD2-SD 3.8Å; F492-M527 HydrophobicContact CE2-CG 3.69Å; F492-M527 HydrophobicContact CE2-SD 3.24Å; F492-M527 WeakPolarHBondContact CE2-SD 3.41Å; F492-M527 HydrophobicContact CZ-SD 4.09Å; F492-Y531 HydrophobicContact CE1-CE2 4.36Å; F492-Y531 HydrophobicContact CZ-CD2 4.46Å; F492-Y531 AromaticContact CZ-CE2 3.99Å; F492-Y531 HydrophobicContact CZ-CE2 3.99Å
493	T	90.1	Very high	90.2	Very high	55 Å²	55	56.3 Å²	56.3	34%	0.337	28%	0.276	S	S	.	.	H	α-helix	trans	-64.5	-28.2	174.2	-56.6	0	0	0	0	113.6	I489 R491	I489-T493 PolarHBondContact O-N 3.1Å; I489-T493 PolarHBondContact O-OG1 3.32Å; I489-T493 VanDerWaalsContact O-OG1 3.13Å; R491-T493 VanDerWaalsContact C-N 3.3Å; R491-T493 PolarHBondContact O-N 2.92Å
494	R	86.4	Confident	89.9	Confident	139 Å²	139	49.6 Å²	49.6	53%	0.525	25%	0.245	S	C	.	.	H	α-helix	trans	-81.6	-35.8	174.6	-66.9	177.4	-154.5	156.2	7.6	112.1	L379 G490 R491 F492	L379-R494 WeakPolarHBondContact CD1-O 3.38Å; G490-R494 WeakPolarHBondContact O-CG 3.44Å; G490-R494 PolarHBondContact O-NE 3.15Å; R491-R494 PolarHBondContact O-N 2.82Å; F492-R494 VanDerWaalsContact C-N 3.28Å; F492-R494 PolarHBondContact O-N 3.24Å
495	E	85.6	Confident	89.5	Confident	6 Å²	6	50.7 Å²	50.7	3%	0.028	26%	0.26	C	S	.	.	H	α-helix	trans	-66.3	-40.6	179	-171.1	177.6	128.1	0	0	111.3	Q103 R133 R491 F492 R526	Q103-E495 PolarHBondContact NE2-OE1 2.97Å; R133-E495 PolarHBondContact NH1-O 2.85Å; R133-E495 PolarHBondContact NH2-O 3.12Å; R491-E495 IonicContact NE-OE2 3.94Å; R491-E495 IonicContact NH2-OE2 3.14Å; R491-E495 PolarHBondContact O-N 3.41Å; F492-E495 PolarHBondContact O-N 2.86Å; E495-R526 IonicContact OE1-CZ 3.24Å; E495-R526 IonicContact OE1-NH1 2.7Å; E495-R526 PolarHBondContact OE1-NH1 3.48Å; E495-R526 IonicContact OE1-NH2 3.9Å; E495-R526 PolarHBondContact OE1-NH2 3.2Å; E495-R526 IonicContact OE2-NH2 3Å; E495-R526 PolarHBondContact OE2-NH2 3.11Å
496	D	88.3	Confident	88.9	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	27%	0.268	C	S	.	.			trans	-133	112.4	-175.8	-174.9	-12.7	0	0	0	111.8	F492 T498 F499 H519 Y523	F492-D496 PolarHBondContact O-N 2.99Å; D496-T498 VanDerWaalsContact CG-OG1 3.26Å; D496-T498 PolarHBondContact O-N 2.91Å; D496-T498 WeakPolarHBondContact OD1-CB 3.35Å; D496-T498 PolarHBondContact OD1-N 3.23Å; D496-T498 PolarHBondContact OD1-OG1 2.77Å; D496-T498 PolarHBondContact OD2-OG1 3.07Å; D496-F499 HydrophobicContact CB-CB 4.19Å; D496-F499 PolarHBondContact O-N 2.82Å; D496-H519 IonicContact OD2-CE1 2.84Å; D496-H519 IonicContact OD2-NE2 2.83Å; D496-H519 PolarHBondContact OD2-NE2 3.37Å; D496-H519 VanDerWaalsContact OD2-NE2 3.14Å; D496-Y523 WeakPolarHBondContact CB-OH 3.07Å; D496-Y523 PolarHBondContact OD2-OH 2.85Å
497	P	86.9	Confident	88.4	Confident	46 Å²	46	50.2 Å²	50.2	30%	0.299	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-14.5	-179.8	31	-36.2	0	0	0	114	I129 V465	I129-P497 HydrophobicContact CD1-CG 4.05Å; I129-P497 HydrophobicContact CG1-CG 4.05Å; V465-P497 HydrophobicContact CG1-CB 4.02Å; V465-P497 HydrophobicContact CG1-CG 4.1Å; V465-P497 HydrophobicContact CG2-CB 3.99Å; V465-P497 HydrophobicContact CG2-CG 3.8Å
498	T	89.9	Confident	88.2	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-20.6	174.4	68.3	0	0	0	0	112.5	I129 V465 P466 D496 K500 M515	I129-T498 HydrophobicContact CB-CG2 3.65Å; I129-T498 HydrophobicContact CD1-CG2 4.26Å; I129-T498 HydrophobicContact CG1-CG2 3.91Å; I129-T498 HydrophobicContact CG2-CG2 4.01Å; V465-T498 HydrophobicContact CG1-CG2 3.85Å; P466-T498 HydrophobicContact CG-CG2 4.04Å; D496-T498 VanDerWaalsContact CG-OG1 3.26Å; D496-T498 PolarHBondContact O-N 2.91Å; D496-T498 WeakPolarHBondContact OD1-CB 3.35Å; D496-T498 PolarHBondContact OD1-N 3.23Å; D496-T498 PolarHBondContact OD1-OG1 2.77Å; D496-T498 PolarHBondContact OD2-OG1 3.07Å; T498-K500 PolarHBondContact O-N 2.82Å; T498-K500 VanDerWaalsContact O-N 3.09Å; T498-M515 HydrophobicContact CG2-CG 4.16Å; T498-M515 HydrophobicContact CG2-SD 4.15Å
499	F	92	Very high	88.2	Confident	3 Å²	3	52.4 Å²	52.4	1%	0.013	26%	0.26	C	S	.	.			trans	-81.7	83.3	175.4	-172.4	-95.6	0	0	0	110.2	I489 F492 D496 V501 V512 L520 Y523	I489-F499 HydrophobicContact CD1-CE1 3.96Å; I489-F499 HydrophobicContact CD1-CZ 3.94Å; F492-F499 HydrophobicContact CB-CD1 4Å; F492-F499 HydrophobicContact CB-CE1 3.97Å; D496-F499 HydrophobicContact CB-CB 4.19Å; D496-F499 PolarHBondContact O-N 2.82Å; F499-V501 HydrophobicContact CD1-CG2 4Å; F499-V501 HydrophobicContact CE1-CG2 3.55Å; F499-V501 HydrophobicContact CZ-CG2 4.27Å; F499-V512 HydrophobicContact CD2-CG1 3.89Å; F499-V512 HydrophobicContact CE1-CG1 3.98Å; F499-V512 HydrophobicContact CE2-CG1 3.13Å; F499-V512 HydrophobicContact CZ-CB 4.43Å; F499-V512 HydrophobicContact CZ-CG1 3.18Å; F499-V512 HydrophobicContact CZ-CG2 4.4Å; F499-L520 HydrophobicContact CD2-CD2 4.2Å; F499-L520 HydrophobicContact CE2-CD2 3.98Å; F499-Y523 HydrophobicContact CD2-CD1 4.12Å; F499-Y523 HydrophobicContact CD2-CD2 4.27Å; F499-Y523 HydrophobicContact CD2-CE1 4.39Å; F499-Y523 HydrophobicContact CD2-CG 4.03Å; F499-Y523 HydrophobicContact CE2-CD1 4.02Å; F499-Y523 HydrophobicContact CE2-CD2 4.45Å; F499-Y523 AromaticContact CE2-CG 3.85Å; F499-Y523 HydrophobicContact CE2-CG 3.85Å; F499-Y523 HydrophobicContact CG-CE1 4.48Å; F499-Y523 HydrophobicContact CZ-CD1 4.39Å
500	K	91.3	Very high	88.2	Confident	87 Å²	87	53.5 Å²	53.5	38%	0.378	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	136	-179.6	-61	-174.2	-171.4	170.4	0	109.8	D467 P468 T498 S513	D467-K500 IonicContact OD1-NZ 3.81Å; D467-K500 PolarHBondContact OD1-NZ 2.7Å; P468-K500 HydrophobicContact CG-CD 4.01Å; P468-K500 HydrophobicContact CG-CG 4.41Å; T498-K500 PolarHBondContact O-N 2.82Å; T498-K500 VanDerWaalsContact O-N 3.09Å; K500-S513 PolarHBondContact N-O 3.1Å; K500-S513 VanDerWaalsContact N-O 3.14Å; K500-S513 PolarHBondContact O-N 2.82Å
501	V	92.9	Very high	88.4	Confident	49 Å²	49	52.9 Å²	52.9	30%	0.297	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	130.1	174.4	-178.9	0	0	0	0	109.1	I489 F499 T510 V512	I489-V501 HydrophobicContact CG2-CB 4.1Å; I489-V501 HydrophobicContact CG2-CG1 4.01Å; I489-V501 HydrophobicContact CG2-CG2 3.69Å; F499-V501 HydrophobicContact CD1-CG2 4Å; F499-V501 HydrophobicContact CE1-CG2 3.55Å; F499-V501 HydrophobicContact CZ-CG2 4.27Å; V501-T510 HydrophobicContact CG1-CG2 3.52Å; V501-V512 HydrophobicContact CG1-CG2 4.47Å; V501-V512 HydrophobicContact CG2-CG1 4.29Å; V501-V512 HydrophobicContact CG2-CG2 4.06Å
502	H	90.9	Very high	88.7	Confident	89 Å²	89	51 Å²	51	41%	0.412	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	149.5	173	66.1	-80.9	0	0	0	110	I511	H502-I511 VanDerWaalsContact CE1-CB 3.43Å; H502-I511 WeakPolarHBondContact CE1-CB 3.13Å; H502-I511 WeakPolarHBondContact CE1-CG2 3.24Å; H502-I511 PolarHBondContact N-O 3.01Å; H502-I511 WeakPolarHBondContact NE2-CB 3.38Å; H502-I511 PolarHBondContact O-N 3.07Å; H502-I511 VanDerWaalsContact O-O 3.09Å
503	F	89.5	Confident	88.8	Confident	119 Å²	119	51.4 Å²	51.4	52%	0.522	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	118.9	174.4	-176.8	-98.8	0	0	0	108.3	T505 K508 E509	F503-T505 PolarHBondContact O-N 3.44Å; F503-K508 VanDerWaalsContact CZ-CA 3.47Å; F503-K508 HydrophobicContact CZ-CB 3.9Å; F503-K508 HydrophobicContact CZ-CG 4.44Å; F503-E509 WeakPolarHBondContact CD2-O 3.25Å
504	D	86.3	Confident	88.8	Confident	27 Å²	27	48.8 Å²	48.8	14%	0.144	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	112.7	173	-179.6	4.4	0	0	0	109	E506 N507 K508 E509 I511	D504-E506 VanDerWaalsContact C-N 3.26Å; D504-E506 PolarHBondContact O-N 3.09Å; D504-E506 PolarHBondContact OD1-N 3.27Å; D504-N507 VanDerWaalsContact OD2-CB 3.28Å; D504-N507 WeakPolarHBondContact OD2-CB 3.34Å; D504-N507 PolarHBondContact OD2-N 3.39Å; D504-N507 PolarHBondContact OD2-ND2 3.41Å; D504-K508 WeakPolarHBondContact O-CA 3.46Å; D504-K508 PolarHBondContact O-N 3.23Å; D504-E509 HydrophobicContact CB-CG 4.27Å; D504-E509 PolarHBondContact N-O 3.02Å; D504-E509 PolarHBondContact O-N 3.34Å; D504-I511 HydrophobicContact CB-CD1 3.82Å; D504-I511 HydrophobicContact CB-CG1 4.39Å
505	T	83.7	Confident	88.9	Confident	119 Å²	119	42.8 Å²	42.8	73%	0.73	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-27.1	179.9	48.6	0	0	0	0	113.2	F503	F503-T505 PolarHBondContact O-N 3.44Å
506	E	80.6	Confident	89	Confident	46 Å²	46	42.6 Å²	42.6	22%	0.215	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-52.9	-175.7	-172.7	160.9	-165	0	0	111.2	D504 A543 R545 K622	D504-E506 VanDerWaalsContact C-N 3.26Å; D504-E506 PolarHBondContact O-N 3.09Å; D504-E506 PolarHBondContact OD1-N 3.27Å; E506-A543 WeakPolarHBondContact OE2-CB 3.49Å; E506-R545 VanDerWaalsContact CD-NH2 3.35Å; E506-R545 IonicContact OE1-CZ 3.3Å; E506-R545 IonicContact OE1-NE 3.96Å; E506-R545 IonicContact OE1-NH1 2.78Å; E506-R545 PolarHBondContact OE1-NH1 3.02Å; E506-R545 IonicContact OE1-NH2 3.21Å; E506-R545 PolarHBondContact OE1-NH2 2.91Å; E506-R545 IonicContact OE2-CZ 2.81Å; E506-R545 IonicContact OE2-NH2 2.71Å; E506-R545 PolarHBondContact OE2-NH2 2.88Å; E506-K622 WeakPolarHBondContact OE1-CD 3.34Å
507	N	84	Confident	88.8	Confident	35 Å²	35	48.2 Å²	48.2	19%	0.187	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-7.4	179	-65.8	-64.2	0	0	0	114.2	D504 E509 K541	D504-N507 VanDerWaalsContact OD2-CB 3.28Å; D504-N507 WeakPolarHBondContact OD2-CB 3.34Å; D504-N507 PolarHBondContact OD2-N 3.39Å; D504-N507 PolarHBondContact OD2-ND2 3.41Å; N507-E509 VanDerWaalsContact C-N 3.32Å; N507-E509 HydrophobicContact CB-CG 4.08Å; N507-E509 PolarHBondContact O-N 3.23Å; N507-K541 HydrophobicContact CB-CB 4.04Å; N507-K541 HydrophobicContact CB-CD 4.15Å; N507-K541 PolarHBondContact ND2-O 3Å
508	K	86.7	Confident	88.9	Confident	165 Å²	165	47.7 Å²	47.7	72%	0.717	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.1	43.3	-179.3	-58.7	-179.6	-177.7	177.4	0	112.8	F503 D504	F503-K508 VanDerWaalsContact CZ-CA 3.47Å; F503-K508 HydrophobicContact CZ-CB 3.9Å; F503-K508 HydrophobicContact CZ-CG 4.44Å; D504-K508 WeakPolarHBondContact O-CA 3.46Å; D504-K508 PolarHBondContact O-N 3.23Å
509	E	89.9	Confident	88.9	Confident	32 Å²	32	47.7 Å²	47.7	15%	0.15	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	153.6	178.2	63.6	179.7	-157.6	0	0	112.3	F503 D504 N507 I511 P540 K541	F503-E509 WeakPolarHBondContact CD2-O 3.25Å; D504-E509 HydrophobicContact CB-CG 4.27Å; D504-E509 PolarHBondContact N-O 3.02Å; D504-E509 PolarHBondContact O-N 3.34Å; N507-E509 VanDerWaalsContact C-N 3.32Å; N507-E509 HydrophobicContact CB-CG 4.08Å; N507-E509 PolarHBondContact O-N 3.23Å; E509-I511 HydrophobicContact CG-CG1 4.14Å; E509-P540 WeakPolarHBondContact OE1-CA 3.44Å; E509-K541 PolarHBondContact OE1-N 2.97Å
510	T	91.9	Very high	88.9	Confident	37 Å²	37	48.1 Å²	48.1	23%	0.227	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	114.1	174.9	-55.3	0	0	0	0	108.5	M474 F485 V501	M474-T510 PolarHBondContact N-O 3.47Å; F485-T510 HydrophobicContact CE1-CG2 4.35Å; V501-T510 HydrophobicContact CG1-CG2 3.52Å
511	I	92.6	Very high	88.9	Confident	13 Å²	13	47.9 Å²	47.9	7%	0.067	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	129.8	177.5	-57.3	176.4	0	0	0	108.2	H502 D504 E509 P540	H502-I511 VanDerWaalsContact CE1-CB 3.43Å; H502-I511 WeakPolarHBondContact CE1-CB 3.13Å; H502-I511 WeakPolarHBondContact CE1-CG2 3.24Å; H502-I511 PolarHBondContact N-O 3.01Å; H502-I511 WeakPolarHBondContact NE2-CB 3.38Å; H502-I511 PolarHBondContact O-N 3.07Å; H502-I511 VanDerWaalsContact O-O 3.09Å; D504-I511 HydrophobicContact CB-CD1 3.82Å; D504-I511 HydrophobicContact CB-CG1 4.39Å; E509-I511 HydrophobicContact CG-CG1 4.14Å; I511-P540 HydrophobicContact CD1-CB 4.17Å; I511-P540 HydrophobicContact CG1-CB 4.49Å; I511-P540 HydrophobicContact CG2-CG 4.33Å
512	V	93.4	Very high	88.8	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.018	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.4	179.1	179.9	0	0	0	0	108	S471 V472 M474 F499 V501 L520	S471-V512 CarbonylContact C-O 3.51Å; S471-V512 WeakPolarHBondContact CA-O 2.91Å; V472-V512 PolarHBondContact N-O 3.37Å; V472-V512 PolarHBondContact O-N 3.18Å; M474-V512 HydrophobicContact CB-CG2 3.81Å; M474-V512 HydrophobicContact SD-CG2 4.13Å; F499-V512 HydrophobicContact CD2-CG1 3.89Å; F499-V512 HydrophobicContact CE1-CG1 3.98Å; F499-V512 HydrophobicContact CE2-CG1 3.13Å; F499-V512 HydrophobicContact CZ-CB 4.43Å; F499-V512 HydrophobicContact CZ-CG1 3.18Å; F499-V512 HydrophobicContact CZ-CG2 4.4Å; V501-V512 HydrophobicContact CG1-CG2 4.47Å; V501-V512 HydrophobicContact CG2-CG1 4.29Å; V501-V512 HydrophobicContact CG2-CG2 4.06Å; V512-L520 HydrophobicContact CG1-CD2 3.73Å
513	S	91.8	Very high	88.8	Confident	9 Å²	9	41.7 Å²	41.7	6%	0.063	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	142.9	-179.6	-52	0	0	0	0	110.6	I470 S471 K500	I470-S513 CarbonylContact O-C 3.57Å; I470-S513 WeakPolarHBondContact O-CA 3.3Å; S471-S513 PolarHBondContact OG-OG 2.91Å; K500-S513 PolarHBondContact N-O 3.1Å; K500-S513 VanDerWaalsContact N-O 3.14Å; K500-S513 PolarHBondContact O-N 2.82Å
514	G	90.8	Very high	89	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	-175.9	-178.8	0	0	0	0	0	113.9	P468 V469 I470	P468-G514 CarbonylContact C-O 3.59Å; P468-G514 WeakPolarHBondContact CA-O 3.33Å; P468-G514 WeakPolarHBondContact CB-O 3.45Å; V469-G514 PolarHBondContact N-O 2.92Å; I470-G514 WeakPolarHBondContact CG2-O 3.31Å; I470-G514 PolarHBondContact N-O 3.24Å; I470-G514 VanDerWaalsContact N-O 3.08Å; I470-G514 PolarHBondContact O-N 3.38Å
515	M	88.4	Confident	89.2	Confident	12 Å²	12	37.5 Å²	37.5	6%	0.059	19%	0.19	C	C	.	.	S	Bend	trans	-81	-11.6	-174.1	-64.3	-55.4	-63.8	0	0	115.3	D126 P466 V469 T498 H519 R723	D126-M515 WeakPolarHBondContact O-CB 3.18Å; P466-M515 HydrophobicContact CB-CE 3.82Å; P466-M515 HydrophobicContact CB-SD 4.27Å; P466-M515 HydrophobicContact CG-CE 3.63Å; P466-M515 HydrophobicContact CG-SD 3.85Å; V469-M515 WeakPolarHBondContact CG2-O 3.43Å; T498-M515 HydrophobicContact CG2-CG 4.16Å; T498-M515 HydrophobicContact CG2-SD 4.15Å; M515-H519 PolarHBondContact N-ND1 2.89Å; M515-R723 PolarHBondContact O-NH1 2.78Å; M515-R723 PolarHBondContact O-NH2 3.15Å
516	G	86.2	Confident	89.5	Confident	2 Å²	2	32.1 Å²	32.1	2%	0.021	16%	0.157	C	C	.	.			trans	177.2	174.1	178.7	0	0	0	0	0	113	D126 I470 H519 L520	D126-G516 WeakPolarHBondContact OD2-CA 3.34Å; I470-G516 VanDerWaalsContact CG2-C 3.48Å; I470-G516 WeakPolarHBondContact CG2-O 3.41Å; G516-H519 WeakPolarHBondContact O-CB 3.26Å; G516-H519 PolarHBondContact O-N 3.49Å; G516-L520 PolarHBondContact O-N 3.06Å
517	E	85.6	Confident	90.1	Very high	119 Å²	119	30 Å²	30	56%	0.556	15%	0.147	S	C	*	.	H	α-helix	trans	-66.8	-42.1	-177.7	-174.2	172.6	-175.3	0	0	111.6	I470 H519 L520 E521 T720	I470-E517 HydrophobicContact CD1-CB 4.14Å; E517-H519 VanDerWaalsContact C-N 3.27Å; E517-H519 PolarHBondContact O-N 2.72Å; E517-L520 PolarHBondContact O-N 3.15Å; E517-E521 WeakPolarHBondContact O-CB 3.47Å; E517-E521 PolarHBondContact O-N 3.4Å; E517-T720 PolarHBondContact OE2-OG1 3.17Å
518	L	88.2	Confident	90.4	Very high	35 Å²	35	33.3 Å²	33.3	18%	0.183	16%	0.161	C	C	.	.	H	α-helix	trans	-62.4	-37.7	176.4	176	69.5	0	0	0	110.9	I100 H124 D126 I522	I100-L518 HydrophobicContact CD1-CD2 4.17Å; H124-L518 VanDerWaalsContact CE1-CD2 3.5Å; H124-L518 WeakPolarHBondContact CE1-CD2 3.41Å; H124-L518 VanDerWaalsContact NE2-CD2 3.3Å; H124-L518 WeakPolarHBondContact NE2-CD2 3.31Å; D126-L518 WeakPolarHBondContact OD2-CB 3.4Å; D126-L518 PolarHBondContact OD2-N 2.98Å; L518-I522 HydrophobicContact CD1-CD1 3.74Å; L518-I522 HydrophobicContact CD1-CG1 4.16Å; L518-I522 HydrophobicContact CD2-CD1 4.43Å; L518-I522 HydrophobicContact CG-CD1 3.78Å; L518-I522 WeakPolarHBondContact O-CB 3.46Å; L518-I522 WeakPolarHBondContact O-CG1 3.37Å; L518-I522 PolarHBondContact O-N 2.94Å
519	H	90.5	Very high	90.5	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-51.7	-60.8	172.1	-164.9	-140.8	0	0	0	110.9	D126 F127 D496 M515 G516 E517 E521 I522 Y523	D126-H519 HydrophobicContact CB-CB 4Å; D126-H519 PolarHBondContact OD2-N 3.26Å; F127-H519 AromaticContact CD1-CD2 3.94Å; F127-H519 AromaticContact CE1-CD2 3.51Å; D496-H519 IonicContact OD2-CE1 2.84Å; D496-H519 IonicContact OD2-NE2 2.83Å; D496-H519 PolarHBondContact OD2-NE2 3.37Å; D496-H519 VanDerWaalsContact OD2-NE2 3.14Å; M515-H519 PolarHBondContact N-ND1 2.89Å; G516-H519 WeakPolarHBondContact O-CB 3.26Å; G516-H519 PolarHBondContact O-N 3.49Å; E517-H519 VanDerWaalsContact C-N 3.27Å; E517-H519 PolarHBondContact O-N 2.72Å; H519-E521 VanDerWaalsContact C-N 3.34Å; H519-E521 PolarHBondContact O-N 3.3Å; H519-I522 PolarHBondContact O-N 3.29Å; H519-Y523 AromaticContact CD2-CD2 3.85Å; H519-Y523 AromaticContact CD2-CE2 3.5Å; H519-Y523 AromaticContact CE1-CE2 3.9Å; H519-Y523 AromaticContact NE2-CD2 3.84Å; H519-Y523 AromaticContact NE2-CE2 3.14Å; H519-Y523 WeakPolarHBondContact NE2-CE2 3.45Å; H519-Y523 AromaticContact NE2-CZ 3.98Å; H519-Y523 VanDerWaalsContact O-CD2 3.3Å; H519-Y523 WeakPolarHBondContact O-CD2 3.31Å; H519-Y523 PolarHBondContact O-N 2.98Å; H519-Y523 VanDerWaalsContact O-N 3.11Å
520	L	91.6	Very high	90.4	Very high	13 Å²	13	32.6 Å²	32.6	7%	0.068	16%	0.156	C	C	.	.	H	α-helix	trans	-67.2	-34.9	-174.2	-63.2	-177.5	0	0	0	112.5	I470 V472 F499 V512 G516 E517 Y523 A524	I470-L520 HydrophobicContact CG1-CD1 4.39Å; I470-L520 HydrophobicContact CG2-CD1 3.72Å; I470-L520 HydrophobicContact CG2-CG 4.25Å; V472-L520 HydrophobicContact CB-CD1 3.86Å; V472-L520 HydrophobicContact CG2-CD1 3.48Å; V472-L520 VanDerWaalsContact CG2-CD1 3.48Å; F499-L520 HydrophobicContact CD2-CD2 4.2Å; F499-L520 HydrophobicContact CE2-CD2 3.98Å; V512-L520 HydrophobicContact CG1-CD2 3.73Å; G516-L520 PolarHBondContact O-N 3.06Å; E517-L520 PolarHBondContact O-N 3.15Å; L520-Y523 PolarHBondContact O-N 3.35Å; L520-A524 WeakPolarHBondContact O-CB 3.44Å; L520-A524 PolarHBondContact O-N 3.42Å
521	E	90.5	Very high	90.3	Very high	81 Å²	81	33 Å²	33	38%	0.379	15%	0.154	S	C	.	.	H	α-helix	trans	-61.5	-45.1	175.1	-164.6	-152.2	160.9	0	0	111.7	R98 E517 H519 A524 Q525	R98-E521 IonicContact CZ-OE1 3.37Å; R98-E521 IonicContact CZ-OE2 3.95Å; R98-E521 IonicContact NH1-OE1 3.72Å; R98-E521 IonicContact NH1-OE2 2.67Å; R98-E521 PolarHBondContact NH1-OE2 2.7Å; R98-E521 IonicContact NH2-OE1 3.87Å; R98-E521 PolarHBondContact NH2-OE1 2.83Å; R98-E521 IonicContact NH2-OE2 3.57Å; R98-E521 PolarHBondContact NH2-OE2 3.15Å; E517-E521 WeakPolarHBondContact O-CB 3.47Å; E517-E521 PolarHBondContact O-N 3.4Å; H519-E521 VanDerWaalsContact C-N 3.34Å; H519-E521 PolarHBondContact O-N 3.3Å; E521-A524 PolarHBondContact O-N 2.92Å; E521-Q525 WeakPolarHBondContact O-CG 3.4Å; E521-Q525 PolarHBondContact O-N 2.85Å; E521-Q525 PolarHBondContact OE1-NE2 3.06Å
522	I	91.1	Very high	90.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64	-43.8	177.5	-75.1	168	0	0	0	110.6	L94 I100 I102 F127 L518 H519 A524 Q525 R526	L94-I522 HydrophobicContact CD1-CG2 4.41Å; I100-I522 HydrophobicContact CD1-CD1 4.38Å; I102-I522 HydrophobicContact CD1-CD1 3.84Å; I102-I522 HydrophobicContact CD1-CG1 4.43Å; I102-I522 HydrophobicContact CD1-CG2 3.97Å; I102-I522 HydrophobicContact CG1-CD1 4.17Å; I102-I522 HydrophobicContact CG2-CG2 4.38Å; F127-I522 HydrophobicContact CE2-CD1 3.82Å; F127-I522 HydrophobicContact CZ-CB 4.46Å; F127-I522 HydrophobicContact CZ-CD1 3.55Å; F127-I522 HydrophobicContact CZ-CG2 4.35Å; L518-I522 HydrophobicContact CD1-CD1 3.74Å; L518-I522 HydrophobicContact CD1-CG1 4.16Å; L518-I522 HydrophobicContact CD2-CD1 4.43Å; L518-I522 HydrophobicContact CG-CD1 3.78Å; L518-I522 WeakPolarHBondContact O-CB 3.46Å; L518-I522 WeakPolarHBondContact O-CG1 3.37Å; L518-I522 PolarHBondContact O-N 2.94Å; H519-I522 PolarHBondContact O-N 3.29Å; I522-A524 VanDerWaalsContact C-N 3.32Å; I522-A524 PolarHBondContact O-N 3.49Å; I522-Q525 PolarHBondContact O-N 2.71Å; I522-R526 HydrophobicContact CG2-CG 4.41Å; I522-R526 WeakPolarHBondContact O-CG 3.24Å; I522-R526 PolarHBondContact O-N 2.7Å
523	Y	92	Very high	90.2	Very high	8 Å²	8	34.4 Å²	34.4	3%	0.031	17%	0.171	C	C	.	.	H	α-helix	trans	-64.1	-36.5	176.6	-86	-90.8	0	0	0	112.5	F492 D496 F499 H519 L520 R526 M527	F492-Y523 HydrophobicContact CB-CD1 3.87Å; F492-Y523 HydrophobicContact CB-CE1 3.69Å; F492-Y523 HydrophobicContact CD1-CD1 4.19Å; F492-Y523 HydrophobicContact CD1-CE1 4.01Å; F492-Y523 AromaticContact CD2-CD1 3.61Å; F492-Y523 HydrophobicContact CD2-CD1 3.61Å; F492-Y523 HydrophobicContact CD2-CE1 4.19Å; F492-Y523 HydrophobicContact CE2-CD1 4.1Å; F492-Y523 AromaticContact CG-CD1 3.65Å; F492-Y523 HydrophobicContact CG-CD1 3.65Å; F492-Y523 AromaticContact CG-CE1 3.72Å; F492-Y523 HydrophobicContact CG-CE1 3.72Å; D496-Y523 WeakPolarHBondContact CB-OH 3.07Å; D496-Y523 PolarHBondContact OD2-OH 2.85Å; F499-Y523 HydrophobicContact CD2-CD1 4.12Å; F499-Y523 HydrophobicContact CD2-CD2 4.27Å; F499-Y523 HydrophobicContact CD2-CE1 4.39Å; F499-Y523 HydrophobicContact CD2-CG 4.03Å; F499-Y523 HydrophobicContact CE2-CD1 4.02Å; F499-Y523 HydrophobicContact CE2-CD2 4.45Å; F499-Y523 AromaticContact CE2-CG 3.85Å; F499-Y523 HydrophobicContact CE2-CG 3.85Å; F499-Y523 HydrophobicContact CG-CE1 4.48Å; F499-Y523 HydrophobicContact CZ-CD1 4.39Å; H519-Y523 AromaticContact CD2-CD2 3.85Å; H519-Y523 AromaticContact CD2-CE2 3.5Å; H519-Y523 AromaticContact CE1-CE2 3.9Å; H519-Y523 AromaticContact NE2-CD2 3.84Å; H519-Y523 AromaticContact NE2-CE2 3.14Å; H519-Y523 WeakPolarHBondContact NE2-CE2 3.45Å; H519-Y523 AromaticContact NE2-CZ 3.98Å; H519-Y523 VanDerWaalsContact O-CD2 3.3Å; H519-Y523 WeakPolarHBondContact O-CD2 3.31Å; H519-Y523 PolarHBondContact O-N 2.98Å; H519-Y523 VanDerWaalsContact O-N 3.11Å; L520-Y523 PolarHBondContact O-N 3.35Å; Y523-R526 PolarHBondContact O-N 2.98Å; Y523-M527 WeakPolarHBondContact O-CG 3.45Å; Y523-M527 PolarHBondContact O-N 3.05Å
524	A	92.3	Very high	90.3	Very high	15 Å²	15	36.2 Å²	36.2	12%	0.124	18%	0.183	C	C	.	.	H	α-helix	trans	-63.7	-42.2	172.5	0	0	0	0	0	112.3	M474 L520 E521 I522 M527 E528 T537	M474-A524 HydrophobicContact CE-CB 3.82Å; L520-A524 WeakPolarHBondContact O-CB 3.44Å; L520-A524 PolarHBondContact O-N 3.42Å; E521-A524 PolarHBondContact O-N 2.92Å; I522-A524 VanDerWaalsContact C-N 3.32Å; I522-A524 PolarHBondContact O-N 3.49Å; A524-M527 WeakPolarHBondContact O-CB 3.29Å; A524-M527 PolarHBondContact O-N 3.11Å; A524-E528 PolarHBondContact O-N 2.96Å; A524-E528 VanDerWaalsContact O-N 3.12Å; A524-T537 HydrophobicContact CB-CG2 4.17Å
525	Q	91.8	Very high	90.3	Very high	44 Å²	44	37.4 Å²	37.4	21%	0.206	19%	0.191	C	C	.	.	H	α-helix	trans	-67.3	-35.8	175.1	-71.8	175.8	5.8	0	0	112.3	L94 E521 I522 E528 R529	L94-Q525 HydrophobicContact CD1-CB 4.12Å; L94-Q525 HydrophobicContact CD2-CB 4.22Å; E521-Q525 WeakPolarHBondContact O-CG 3.4Å; E521-Q525 PolarHBondContact O-N 2.85Å; E521-Q525 PolarHBondContact OE1-NE2 3.06Å; I522-Q525 PolarHBondContact O-N 2.71Å; Q525-E528 PolarHBondContact O-N 3.46Å; Q525-R529 WeakPolarHBondContact O-CG 3.44Å; Q525-R529 PolarHBondContact O-N 3.24Å
526	R	90.6	Very high	90.5	Very high	5 Å²	5	40.9 Å²	40.9	2%	0.019	21%	0.209	C	C	.	.	H	α-helix	trans	-63.8	-40.6	172.3	-72.2	-179.2	69.2	-169.1	1.2	111.4	L94 F492 E495 I522 Y523 E528 R529 E530	L94-R526 HydrophobicContact CD1-CG 3.66Å; F492-R526 HydrophobicContact CE2-CB 4.28Å; F492-R526 HydrophobicContact CZ-CB 3.81Å; E495-R526 IonicContact OE1-CZ 3.24Å; E495-R526 IonicContact OE1-NH1 2.7Å; E495-R526 PolarHBondContact OE1-NH1 3.48Å; E495-R526 IonicContact OE1-NH2 3.9Å; E495-R526 PolarHBondContact OE1-NH2 3.2Å; E495-R526 IonicContact OE2-NH2 3Å; E495-R526 PolarHBondContact OE2-NH2 3.11Å; I522-R526 HydrophobicContact CG2-CG 4.41Å; I522-R526 WeakPolarHBondContact O-CG 3.24Å; I522-R526 PolarHBondContact O-N 2.7Å; Y523-R526 PolarHBondContact O-N 2.98Å; R526-E528 VanDerWaalsContact C-N 3.31Å; R526-E528 PolarHBondContact O-N 3.15Å; R526-R529 PolarHBondContact O-N 2.75Å; R526-E530 IonicContact CZ-OE1 3.87Å; R526-E530 IonicContact NE-OE1 2.88Å; R526-E530 PolarHBondContact NE-OE1 3.25Å; R526-E530 IonicContact NH2-OE1 3.66Å; R526-E530 PolarHBondContact NH2-OE1 3.43Å; R526-E530 VanDerWaalsContact NH2-OE1 3.16Å; R526-E530 IonicContact NH2-OE2 3.82Å; R526-E530 VanDerWaalsContact O-CB 3.22Å; R526-E530 WeakPolarHBondContact O-CB 3.45Å; R526-E530 WeakPolarHBondContact O-CG 3.33Å; R526-E530 PolarHBondContact O-N 2.85Å
527	M	91.3	Very high	90.7	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-58.8	-42.9	173	-75.9	-55.4	-67.2	0	0	112.1	M474 F485 F492 Y523 A524 Y531 G532 C533	M474-M527 HydrophobicContact CE-CB 4.3Å; M474-M527 HydrophobicContact CE-CG 3.87Å; F485-M527 HydrophobicContact CB-CE 4.44Å; F485-M527 HydrophobicContact CD2-CE 3.89Å; F485-M527 HydrophobicContact CG-CE 4.49Å; F492-M527 HydrophobicContact CD2-CG 4.35Å; F492-M527 HydrophobicContact CD2-SD 3.8Å; F492-M527 HydrophobicContact CE2-CG 3.69Å; F492-M527 HydrophobicContact CE2-SD 3.24Å; F492-M527 WeakPolarHBondContact CE2-SD 3.41Å; F492-M527 HydrophobicContact CZ-SD 4.09Å; Y523-M527 WeakPolarHBondContact O-CG 3.45Å; Y523-M527 PolarHBondContact O-N 3.05Å; A524-M527 WeakPolarHBondContact O-CB 3.29Å; A524-M527 PolarHBondContact O-N 3.11Å; M527-Y531 HydrophobicContact CE-CD2 4.44Å; M527-Y531 WeakPolarHBondContact O-CB 3.42Å; M527-Y531 PolarHBondContact O-N 3.01Å; M527-Y531 HydrophobicContact SD-CD2 4.03Å; M527-Y531 HydrophobicContact SD-CE2 4.47Å; M527-G532 PolarHBondContact O-N 2.99Å; M527-C533 CarbonylContact C-O 3.59Å; M527-C533 HydrophobicContact CE-CB 4.36Å; M527-C533 PolarHBondContact O-N 3.04Å
528	E	91.5	Very high	90.8	Very high	105 Å²	105	40.4 Å²	40.4	49%	0.491	22%	0.221	S	C	.	.	H	α-helix	trans	-67.6	-45.9	178.9	-173.5	173.5	-163	0	0	112	A524 Q525 R526 G532 P534	A524-E528 PolarHBondContact O-N 2.96Å; A524-E528 VanDerWaalsContact O-N 3.12Å; Q525-E528 PolarHBondContact O-N 3.46Å; R526-E528 VanDerWaalsContact C-N 3.31Å; R526-E528 PolarHBondContact O-N 3.15Å; E528-G532 WeakPolarHBondContact O-CA 3.47Å; E528-G532 PolarHBondContact O-N 2.86Å; E528-P534 HydrophobicContact CG-CB 4.25Å
529	R	89	Confident	90.8	Very high	105 Å²	105	46.1 Å²	46.1	40%	0.396	24%	0.244	S	C	.	.	H	α-helix	trans	-81.3	-41.8	-175	-66.5	-170.8	-175.6	-168	10	114.5	E93 Q97 Q525 R526	E93-R529 IonicContact OE1-NH1 3.56Å; E93-R529 PolarHBondContact OE1-NH1 3.4Å; E93-R529 IonicContact OE2-CZ 2.94Å; E93-R529 IonicContact OE2-NH1 2.99Å; E93-R529 PolarHBondContact OE2-NH1 3.42Å; Q97-R529 VanDerWaalsContact NE2-NH1 3.2Å; Q97-R529 VanDerWaalsContact OE1-NH1 3.1Å; Q525-R529 WeakPolarHBondContact O-CG 3.44Å; Q525-R529 PolarHBondContact O-N 3.24Å; R526-R529 PolarHBondContact O-N 2.75Å
530	E	87.6	Confident	90.6	Very high	78 Å²	78	46.8 Å²	46.8	36%	0.364	25%	0.248	S	C	.	.	H	α-helix	trans	-81	-36.5	-177.1	-63	-175.1	-149.8	0	0	112.1	R491 R526	R491-E530 IonicContact CZ-OE2 2.73Å; R491-E530 IonicContact NH1-OE2 3.19Å; R491-E530 PolarHBondContact NH1-OE2 2.92Å; R491-E530 IonicContact NH2-OE2 2.81Å; R491-E530 PolarHBondContact NH2-OE2 3.3Å; R526-E530 IonicContact CZ-OE1 3.87Å; R526-E530 IonicContact NE-OE1 2.88Å; R526-E530 PolarHBondContact NE-OE1 3.25Å; R526-E530 IonicContact NH2-OE1 3.66Å; R526-E530 PolarHBondContact NH2-OE1 3.43Å; R526-E530 VanDerWaalsContact NH2-OE1 3.16Å; R526-E530 IonicContact NH2-OE2 3.82Å; R526-E530 VanDerWaalsContact O-CB 3.22Å; R526-E530 WeakPolarHBondContact O-CB 3.45Å; R526-E530 WeakPolarHBondContact O-CG 3.33Å; R526-E530 PolarHBondContact O-N 2.85Å
531	Y	88.9	Confident	90.4	Very high	46 Å²	46	52.2 Å²	52.2	18%	0.18	27%	0.272	C	S	.	.	H	α-helix	trans	-110.8	-6.2	-175.1	-67.4	-85.5	0	0	0	114	K484 R491 F492 M527 C533	K484-Y531 WeakPolarHBondContact CD-O 3.3Å; R491-Y531 WeakPolarHBondContact CD-OH 3.37Å; R491-Y531 PolarHBondContact NH1-OH 3.2Å; F492-Y531 HydrophobicContact CE1-CE2 4.36Å; F492-Y531 HydrophobicContact CZ-CD2 4.46Å; F492-Y531 AromaticContact CZ-CE2 3.99Å; F492-Y531 HydrophobicContact CZ-CE2 3.99Å; M527-Y531 HydrophobicContact CE-CD2 4.44Å; M527-Y531 WeakPolarHBondContact O-CB 3.42Å; M527-Y531 PolarHBondContact O-N 3.01Å; M527-Y531 HydrophobicContact SD-CD2 4.03Å; M527-Y531 HydrophobicContact SD-CE2 4.47Å; Y531-C533 PolarHBondContact O-N 2.92Å
532	G	91.2	Very high	90.3	Very high	44 Å²	44	48.9 Å²	48.9	45%	0.454	26%	0.256	S	S	.	.			trans	63.8	28.2	-175.3	0	0	0	0	0	112.4	M527 E528 P534	M527-G532 PolarHBondContact O-N 2.99Å; E528-G532 WeakPolarHBondContact O-CA 3.47Å; E528-G532 PolarHBondContact O-N 2.86Å; G532-P534 VanDerWaalsContact O-CD 3.31Å; G532-P534 WeakPolarHBondContact O-CD 3.38Å
533	C	92.8	Very high	90.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.264	C	S	.	.			trans	-114.8	88.3	-176.1	-178.8	0	0	0	0	110.1	D481 M527 Y531 C535	D481-C533 HydrophobicContact CB-CB 4.37Å; M527-C533 CarbonylContact C-O 3.59Å; M527-C533 HydrophobicContact CE-CB 4.36Å; M527-C533 PolarHBondContact O-N 3.04Å; Y531-C533 PolarHBondContact O-N 2.92Å; C533-C535 PolarHBondContact O-N 3.4Å; C533-C535 PolarHBondContact O-SG 3.37Å
534	P	93.5	Very high	90.3	Very high	48 Å²	48	50.1 Å²	50.1	31%	0.312	27%	0.266	S	S	.	.			trans	-64.8	124.9	176.3	18	-23	0	0	0	110.5	S477 E528 G532	S477-P534 WeakPolarHBondContact CB-O 3.08Å; S477-P534 PolarHBondContact N-O 3.5Å; S477-P534 WeakPolarHBondContact OG-CG 3.19Å; S477-P534 PolarHBondContact OG-O 2.74Å; E528-P534 HydrophobicContact CG-CB 4.25Å; G532-P534 VanDerWaalsContact O-CD 3.31Å; G532-P534 WeakPolarHBondContact O-CD 3.38Å
535	C	92.4	Very high	90.4	Very high	24 Å²	24	51.4 Å²	51.4	16%	0.162	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	138.8	-175.2	-62.2	0	0	0	0	110.7	M474 K475 C533	M474-C535 HydrophobicContact CE-CB 3.38Å; M474-C535 HydrophobicContact CG-CB 4.03Å; K475-C535 CarbonylContact O-C 3.57Å; K475-C535 WeakPolarHBondContact O-CA 3.46Å; C533-C535 PolarHBondContact O-N 3.4Å; C533-C535 PolarHBondContact O-SG 3.37Å
536	I	91.8	Very high	90.5	Very high	86 Å²	86	49.3 Å²	49.3	44%	0.441	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	119.9	174.6	-56.3	169	0	0	0	107.2	K475	K475-I536 HydrophobicContact CG-CB 3.98Å; K475-I536 PolarHBondContact N-O 3.25Å; K475-I536 PolarHBondContact O-N 2.89Å
537	T	90.4	Very high	90.7	Very high	75 Å²	75	49.1 Å²	49.1	46%	0.46	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	136.5	172.9	49.9	0	0	0	0	110.1	V472 A473 M474 A524	V472-T537 HydrophobicContact CG1-CG2 4.09Å; A473-T537 CarbonylContact O-C 3.56Å; A473-T537 WeakPolarHBondContact O-CA 3.35Å; M474-T537 HydrophobicContact CG-CG2 4.48Å; A524-T537 HydrophobicContact CB-CG2 4.17Å
538	G	88.7	Confident	90.9	Very high	35 Å²	35	49.2 Å²	49.2	36%	0.361	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	171.4	177.8	0	0	0	0	0	112.2	V472 A473	V472-G538 VanDerWaalsContact CG1-O 3.27Å; V472-G538 WeakPolarHBondContact CG1-O 3.5Å; A473-G538 PolarHBondContact N-O 3.27Å; A473-G538 PolarHBondContact O-N 2.88Å
539	K	87.6	Confident	90.9	Very high	156 Å²	156	48 Å²	48	68%	0.678	26%	0.257	S	S	*	.	P	Polyproline II helix	trans	-63.8	133	173.4	-64.6	-173.4	179.3	-172.6	0	109.4	F716	K539-F716 HydrophobicContact CD-CB 4.3Å; K539-F716 HydrophobicContact CD-CD2 4.24Å; K539-F716 HydrophobicContact CD-CG 4.31Å
540	P	86.9	Confident	91	Very high	13 Å²	13	45.3 Å²	45.3	8%	0.084	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-52.2	139.1	167.2	-23.6	32.5	0	0	0	110.7	S471 E509 I511 V542 F716	S471-P540 WeakPolarHBondContact O-CD 3.37Å; S471-P540 WeakPolarHBondContact O-CG 3.28Å; E509-P540 WeakPolarHBondContact OE1-CA 3.44Å; I511-P540 HydrophobicContact CD1-CB 4.17Å; I511-P540 HydrophobicContact CG1-CB 4.49Å; I511-P540 HydrophobicContact CG2-CG 4.33Å; P540-V542 PolarHBondContact O-N 3.11Å; P540-F716 HydrophobicContact CB-CE1 3.99Å; P540-F716 HydrophobicContact CB-CZ 4.26Å; P540-F716 VanDerWaalsContact CD-CE1 3.48Å; P540-F716 HydrophobicContact CG-CE1 3.82Å; P540-F716 VanDerWaalsContact O-CZ 3.27Å; P540-F716 WeakPolarHBondContact O-CZ 3.5Å
541	K	86.9	Confident	91.4	Very high	128 Å²	128	45.2 Å²	45.2	56%	0.557	26%	0.264	S	S	*	.	P	Polyproline II helix	trans	-72.2	128.9	172.8	-72.9	-179.8	177.2	-177.5	0	108.8	N507 E509	N507-K541 HydrophobicContact CB-CB 4.04Å; N507-K541 HydrophobicContact CB-CD 4.15Å; N507-K541 PolarHBondContact ND2-O 3Å; E509-K541 PolarHBondContact OE1-N 2.97Å
542	V	88.6	Confident	91.8	Very high	10 Å²	10	43.9 Å²	43.9	6%	0.061	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-77.7	132.4	174	-179.5	0	0	0	0	108.3	P540 F544 P667 L712 N713 F716	P540-V542 PolarHBondContact O-N 3.11Å; V542-F544 VanDerWaalsContact C-N 3.34Å; V542-F544 HydrophobicContact CB-CD2 4.22Å; V542-F544 HydrophobicContact CB-CE2 3.71Å; V542-F544 HydrophobicContact CB-CZ 3.93Å; V542-F544 HydrophobicContact CG1-CD2 4.41Å; V542-F544 HydrophobicContact CG1-CE1 4.23Å; V542-F544 HydrophobicContact CG1-CE2 4.12Å; V542-F544 HydrophobicContact CG1-CZ 4.02Å; V542-F544 WeakPolarHBondContact O-CD2 3.37Å; V542-F544 PolarHBondContact O-N 3.45Å; V542-P667 VanDerWaalsContact CG1-CD 3.48Å; V542-P667 HydrophobicContact CG1-CG 3.45Å; V542-P667 VanDerWaalsContact CG1-CG 3.45Å; V542-L712 HydrophobicContact CG1-CD2 4.39Å; V542-L712 HydrophobicContact CG2-CG 4.42Å; V542-N713 HydrophobicContact CG2-CB 4.22Å; V542-F716 HydrophobicContact CG2-CE2 3.6Å; V542-F716 HydrophobicContact CG2-CZ 3.73Å
543	A	90.2	Very high	92	Very high	20 Å²	20	46.5 Å²	46.5	17%	0.165	27%	0.269	C	S	.	.			trans	-76	85	173.1	0	0	0	0	0	110.2	E506 Y739	E506-A543 WeakPolarHBondContact OE2-CB 3.49Å; A543-Y739 VanDerWaalsContact O-CE1 3.32Å; A543-Y739 WeakPolarHBondContact O-CE1 3.33Å; A543-Y739 PolarHBondContact O-OH 3.09Å
544	F	92.8	Very high	92.1	Very high	14 Å²	14	46.7 Å²	46.7	6%	0.061	27%	0.27	C	S	.	.			trans	-69.7	159.6	169.6	-64.4	-78.9	0	0	0	111	V542 H621 I664 L665 E666 N713 I750	V542-F544 VanDerWaalsContact C-N 3.34Å; V542-F544 HydrophobicContact CB-CD2 4.22Å; V542-F544 HydrophobicContact CB-CE2 3.71Å; V542-F544 HydrophobicContact CB-CZ 3.93Å; V542-F544 HydrophobicContact CG1-CD2 4.41Å; V542-F544 HydrophobicContact CG1-CE1 4.23Å; V542-F544 HydrophobicContact CG1-CE2 4.12Å; V542-F544 HydrophobicContact CG1-CZ 4.02Å; V542-F544 WeakPolarHBondContact O-CD2 3.37Å; V542-F544 PolarHBondContact O-N 3.45Å; F544-H621 AromaticContact CD2-NE2 3.92Å; F544-H621 WeakPolarHBondContact O-CB 3.42Å; F544-I664 HydrophobicContact CB-CG2 3.9Å; F544-I664 HydrophobicContact CD1-CG2 3.93Å; F544-I664 HydrophobicContact CG-CG2 4.18Å; F544-L665 WeakPolarHBondContact CA-O 3.37Å; F544-E666 HydrophobicContact CD1-CB 4Å; F544-E666 HydrophobicContact CE1-CB 3.82Å; F544-N713 HydrophobicContact CZ-CB 4.33Å; F544-I750 HydrophobicContact CD1-CD1 3.7Å; F544-I750 HydrophobicContact CD2-CD1 4Å; F544-I750 HydrophobicContact CE1-CD1 3.38Å; F544-I750 HydrophobicContact CE2-CD1 3.7Å; F544-I750 HydrophobicContact CE2-CG1 4.14Å; F544-I750 HydrophobicContact CG-CD1 4.01Å; F544-I750 HydrophobicContact CZ-CD1 3.38Å; F544-I750 HydrophobicContact CZ-CG1 4.17Å
545	R	93.4	Very high	92.2	Very high	42 Å²	42	49.4 Å²	49.4	16%	0.158	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	162.1	172.1	-54.6	-68.8	174.1	157.8	-11.2	110.2	E506 K622 I664 L665 Y739	E506-R545 VanDerWaalsContact CD-NH2 3.35Å; E506-R545 IonicContact OE1-CZ 3.3Å; E506-R545 IonicContact OE1-NE 3.96Å; E506-R545 IonicContact OE1-NH1 2.78Å; E506-R545 PolarHBondContact OE1-NH1 3.02Å; E506-R545 IonicContact OE1-NH2 3.21Å; E506-R545 PolarHBondContact OE1-NH2 2.91Å; E506-R545 IonicContact OE2-CZ 2.81Å; E506-R545 IonicContact OE2-NH2 2.71Å; E506-R545 PolarHBondContact OE2-NH2 2.88Å; R545-K622 WeakPolarHBondContact CA-O 3.3Å; R545-K622 VanDerWaalsContact NH1-CD 3.3Å; R545-I664 CarbonylContact O-C 3.57Å; R545-I664 WeakPolarHBondContact O-CA 3.12Å; R545-L665 HydrophobicContact CB-CB 4.15Å; R545-L665 HydrophobicContact CB-CD1 4.32Å; R545-L665 PolarHBondContact N-O 3.37Å; R545-L665 PolarHBondContact O-N 3.15Å; R545-Y739 HydrophobicContact CB-CE1 4.4Å; R545-Y739 HydrophobicContact CG-CD1 4.07Å; R545-Y739 HydrophobicContact CG-CD2 4.5Å; R545-Y739 HydrophobicContact CG-CE1 3.58Å; R545-Y739 HydrophobicContact CG-CE2 4.08Å; R545-Y739 PolarHBondContact NE-OH 2.77Å
546	E	94.4	Very high	92.4	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	140.1	172.6	-70.2	174	-145.3	0	0	109.6	G616 P617 L618 S619 G620 H621 K622 L623 S624 C663 I664	E546-G616 VanDerWaalsContact OE2-CA 3.29Å; E546-G616 WeakPolarHBondContact OE2-CA 3.44Å; E546-P617 WeakPolarHBondContact OE2-CD 3.41Å; E546-L618 HydrophobicContact CG-CB 4.47Å; E546-L618 VanDerWaalsContact OE2-CB 3.29Å; E546-L618 WeakPolarHBondContact OE2-CB 3.02Å; E546-L618 PolarHBondContact OE2-N 2.95Å; E546-S619 VanDerWaalsContact OE1-CA 3.3Å; E546-S619 WeakPolarHBondContact OE1-CA 3.35Å; E546-S619 WeakPolarHBondContact OE1-CB 3.32Å; E546-S619 PolarHBondContact OE1-N 2.8Å; E546-S619 PolarHBondContact OE1-OG 2.69Å; E546-G620 PolarHBondContact OE1-N 3.4Å; E546-G620 VanDerWaalsContact OE1-N 3.1Å; E546-H621 PolarHBondContact OE1-N 3.49Å; E546-K622 PolarHBondContact N-O 3.38Å; E546-L623 HydrophobicContact CB-CD2 3.54Å; E546-L623 HydrophobicContact CB-CG 4.41Å; E546-L623 CarbonylContact O-C 3.48Å; E546-L623 VanDerWaalsContact O-CA 3.31Å; E546-L623 WeakPolarHBondContact O-CA 3.3Å; E546-S624 PolarHBondContact O-N 2.88Å; E546-C663 WeakPolarHBondContact CA-O 3.49Å; E546-I664 HydrophobicContact CG-CG1 4.49Å
547	T	95.3	Very high	92.6	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.006	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	174.3	171.9	-164.3	0	0	0	0	111.1	S624 G625 L662 C663 L665	T547-S624 VanDerWaalsContact CB-O 3.22Å; T547-S624 WeakPolarHBondContact CB-O 3.43Å; T547-S624 PolarHBondContact OG1-O 3.2Å; T547-S624 VanDerWaalsContact OG1-O 3.11Å; T547-G625 PolarHBondContact OG1-O 3.2Å; T547-L662 WeakPolarHBondContact O-CA 3.45Å; T547-C663 WeakPolarHBondContact CG2-SG 3.42Å; T547-C663 PolarHBondContact N-O 3.44Å; T547-C663 PolarHBondContact O-N 3.5Å; T547-L665 HydrophobicContact CG2-CD1 3.85Å; T547-L665 HydrophobicContact CG2-CD2 3.76Å; T547-L665 HydrophobicContact CG2-CG 3.86Å
548	I	94.5	Very high	92.8	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.021	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	156.4	174	67.5	-179.1	0	0	0	110.2	L575 P577 L626 L657 A660 L662	I548-L575 HydrophobicContact CD1-CB 4.28Å; I548-L575 HydrophobicContact CD1-CD2 3.92Å; I548-L575 HydrophobicContact CD1-CG 3.79Å; I548-L575 WeakPolarHBondContact CD1-O 3.3Å; I548-L575 HydrophobicContact CG2-CD2 4.21Å; I548-P577 HydrophobicContact CG1-CB 3.99Å; I548-P577 HydrophobicContact CG1-CG 4.39Å; I548-P577 WeakPolarHBondContact O-CB 3.4Å; I548-L626 HydrophobicContact CB-CD2 4.31Å; I548-L626 HydrophobicContact CD1-CD2 4.06Å; I548-L626 HydrophobicContact CG1-CD2 3.73Å; I548-L626 HydrophobicContact CG2-CD2 4.03Å; I548-L657 HydrophobicContact CG2-CD2 4.28Å; I548-A660 HydrophobicContact CB-CB 4.19Å; I548-A660 HydrophobicContact CG2-CB 3.62Å; I548-L662 HydrophobicContact CG2-CD2 3.73Å
549	T	91.4	Very high	93	Very high	78 Å²	78	52.2 Å²	52.2	48%	0.479	27%	0.274	S	S	.	.	S	Bend	trans	-95.4	-27.9	177.8	56.2	0	0	0	0	114.3	T661 C663	T549-T661 PolarHBondContact N-O 2.96Å; T549-T661 VanDerWaalsContact N-O 3.15Å; T549-T661 PolarHBondContact OG1-O 3.48Å; T549-C663 HydrophobicContact CG2-CB 4.16Å
550	A	92.5	Very high	93	Very high	49 Å²	49	51 Å²	51	41%	0.405	27%	0.269	S	S	.	.	S	Bend	trans	-137.7	152.1	-175.7	0	0	0	0	0	111.1
551	P	95.4	Very high	92.7	Very high	77 Å²	77	57.6 Å²	57.6	50%	0.5	30%	0.299	S	S	.	.			trans	-57.1	133.6	172.8	-27.8	36.9	0	0	0	112.9	V574 L575 E576	P551-V574 HydrophobicContact CB-CG2 4.16Å; P551-L575 CarbonylContact C-O 3.59Å; P551-L575 VanDerWaalsContact CA-O 3.3Å; P551-L575 WeakPolarHBondContact CA-O 3.5Å; P551-E576 HydrophobicContact CB-CG 4.1Å; P551-E576 HydrophobicContact CG-CG 4.34Å
552	V	96.3	Very high	91.8	Very high	18 Å²	18	55.7 Å²	55.7	11%	0.109	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	119.2	178.3	-179.9	0	0	0	0	110.6	L575 N659 A660	V552-L575 PolarHBondContact N-O 3.23Å; V552-L575 PolarHBondContact O-N 3.12Å; V552-N659 HydrophobicContact CG1-CB 4.14Å; V552-A660 HydrophobicContact CG2-CB 3.82Å
553	P	96	Very high	91	Very high	98 Å²	98	60 Å²	60	64%	0.636	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	146.5	173.5	30.9	-34	0	0	0	110.8	G573	P553-G573 CarbonylContact C-O 3.58Å; P553-G573 WeakPolarHBondContact CA-O 3.33Å
554	F	95.3	Very high	90.2	Very high	4 Å²	4	61.8 Å²	61.8	2%	0.018	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	146.7	175.7	57.9	-101.4	0	0	0	111.3	I572 G573 V574 L575 F628 A652 A656	F554-I572 WeakPolarHBondContact O-CA 3.11Å; F554-G573 PolarHBondContact N-O 3.28Å; F554-G573 PolarHBondContact O-N 2.89Å; F554-V574 VanDerWaalsContact CE1-C 3.46Å; F554-L575 HydrophobicContact CD1-CB 4.16Å; F554-L575 HydrophobicContact CE1-CB 4.08Å; F554-F628 HydrophobicContact CE1-CD2 4.09Å; F554-F628 AromaticContact CE1-CE2 3.74Å; F554-F628 HydrophobicContact CE1-CE2 3.74Å; F554-F628 HydrophobicContact CE1-CZ 4.05Å; F554-F628 HydrophobicContact CE2-CE1 4.17Å; F554-F628 AromaticContact CE2-CE2 3.98Å; F554-F628 HydrophobicContact CE2-CE2 3.98Å; F554-F628 AromaticContact CE2-CZ 3.53Å; F554-F628 HydrophobicContact CE2-CZ 3.53Å; F554-F628 HydrophobicContact CZ-CD1 4.21Å; F554-F628 AromaticContact CZ-CD2 3.96Å; F554-F628 HydrophobicContact CZ-CD2 3.96Å; F554-F628 AromaticContact CZ-CE1 3.64Å; F554-F628 HydrophobicContact CZ-CE1 3.64Å; F554-F628 AromaticContact CZ-CE2 3.35Å; F554-F628 HydrophobicContact CZ-CE2 3.35Å; F554-F628 HydrophobicContact CZ-CG 4.37Å; F554-F628 AromaticContact CZ-CZ 3.17Å; F554-F628 HydrophobicContact CZ-CZ 3.17Å; F554-A652 HydrophobicContact CD2-CB 3.52Å; F554-A652 HydrophobicContact CE2-CB 3.77Å; F554-A652 HydrophobicContact CG-CB 4.15Å; F554-A656 HydrophobicContact CB-CB 4.26Å; F554-A656 HydrophobicContact CD1-CB 4.02Å
555	E	95.9	Very high	89.1	Confident	106 Å²	106	65 Å²	65	50%	0.495	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	105.9	171.5	171.5	173.2	-169.9	0	0	107.4	K570 I572 Q655	E555-K570 WeakPolarHBondContact OE1-CE 3.43Å; E555-K570 IonicContact OE1-NZ 2.64Å; E555-K570 PolarHBondContact OE1-NZ 2.94Å; E555-I572 HydrophobicContact CB-CG1 4.33Å; E555-I572 HydrophobicContact CG-CG1 3.98Å; E555-Q655 PolarHBondContact O-NE2 3.14Å; E555-Q655 VanDerWaalsContact O-NE2 3.15Å; E555-Q655 PolarHBondContact O-OE1 3.22Å
556	F	96.8	Very high	88.6	Confident	57 Å²	57	63.1 Å²	63.1	25%	0.25	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	133.1	-176.9	-172.6	-97.2	0	0	0	111.1	H558 K570 V571 A648 A652	F556-H558 HydrophobicContact CE1-CB 4.01Å; F556-K570 WeakPolarHBondContact O-CA 3.5Å; F556-V571 PolarHBondContact N-O 2.88Å; F556-V571 PolarHBondContact O-N 3.3Å; F556-A648 WeakPolarHBondContact CD1-O 3.49Å; F556-A652 HydrophobicContact CB-CB 3.96Å
557	T	95.4	Very high	88.5	Confident	62 Å²	62	65.8 Å²	65.8	38%	0.38	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	112.2	176.4	-56.8	0	0	0	0	109.9	Y568 K570	T557-Y568 HydrophobicContact CG2-CE2 3.87Å; T557-K570 HydrophobicContact CG2-CB 4.2Å; T557-K570 WeakPolarHBondContact OG1-CD 3.4Å; T557-K570 WeakPolarHBondContact OG1-CG 3.36Å
558	H	94.9	Very high	88.4	Confident	21 Å²	21	68.3 Å²	68.3	10%	0.097	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	111.1	168.6	-178	65.6	0	0	0	109.3	F556 Q567 Y568 G569 A648	F556-H558 HydrophobicContact CE1-CB 4.01Å; H558-Q567 PolarHBondContact NE2-OE1 3.07Å; H558-Y568 CarbonylContact O-C 3.57Å; H558-Y568 VanDerWaalsContact O-CA 3.32Å; H558-Y568 WeakPolarHBondContact O-CA 3.49Å; H558-G569 PolarHBondContact N-O 2.79Å; H558-G569 PolarHBondContact O-N 2.97Å; H558-A648 HydrophobicContact CB-CB 4.22Å
559	K	92.6	Very high	88.3	Confident	138 Å²	138	68.1 Å²	68.1	60%	0.6	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.9	119.1	173.9	-174.2	178.4	178.3	-178.8	0	110.1	Q567 Y568	K559-Q567 CarbonylContact C-O 3.58Å; K559-Q567 VanDerWaalsContact CA-O 3.31Å; K559-Q567 WeakPolarHBondContact CA-O 3.38Å; K559-Y568 HydrophobicContact CB-CD2 4.28Å; K559-Y568 HydrophobicContact CD-CD2 4.39Å; K559-Y568 HydrophobicContact CG-CD2 4.21Å
560	K	88.4	Confident	88.5	Confident	131 Å²	131	66.5 Å²	66.5	57%	0.57	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.4	123.7	168.4	-77.9	-174.3	176.7	179.7	0	109.8	Q567	K560-Q567 HydrophobicContact CB-CB 4.33Å; K560-Q567 PolarHBondContact N-O 3.41Å; K560-Q567 PolarHBondContact O-N 3.33Å
561	Q	80.6	Confident	88.7	Confident	152 Å²	152	64.2 Å²	64.2	71%	0.71	38%	0.38	S	S	*	.			trans	-119.4	80	176.6	-161.4	170.4	0.6	0	0	108.2
562	S	67.9	Low	88.7	Confident	88 Å²	88	62.6 Å²	62.6	62%	0.615	37%	0.366	S	S	*	.			trans	-82.5	146.2	157.6	43.3	0	0	0	0	107.4	G564	S562-G564 PolarHBondContact O-N 3.47Å
563	G	70.9	Confident	88.7	Confident	101 Å²	101	61.8 Å²	61.8	100%	1.041	36%	0.362	S	S	*	.	S	Bend	trans	-58.1	17.8	-165.4	0	0	0	0	0	120
564	G	73.4	Confident	88.7	Confident	57 Å²	57	58 Å²	58	59%	0.588	34%	0.337	S	S	*	.	S	Bend	trans	-117.4	-146.8	167.8	0	0	0	0	0	112	S562 G566	S562-G564 PolarHBondContact O-N 3.47Å; G564-G566 PolarHBondContact O-N 3.33Å
565	A	68.8	Low	88.7	Confident	82 Å²	82	57.8 Å²	57.8	68%	0.678	34%	0.336	S	S	*	.	S	Bend	trans	-56.1	120.3	175.2	0	0	0	0	0	110.2
566	G	84.5	Confident	88.6	Confident	2 Å²	2	55.5 Å²	55.5	2%	0.021	33%	0.326	C	S	.	.			trans	-73	175.8	-177.6	0	0	0	0	0	112.1	G564 D639	G564-G566 PolarHBondContact O-N 3.33Å; G566-D639 VanDerWaalsContact CA-OD1 3.28Å; G566-D639 WeakPolarHBondContact CA-OD1 3.43Å; G566-D639 PolarHBondContact N-OD1 2.96Å
567	Q	91	Very high	88.5	Confident	56 Å²	56	54.6 Å²	54.6	26%	0.262	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	122.6	166.4	-66.9	-177.2	-7.3	0	0	108.2	H558 K559 K560 D639	H558-Q567 PolarHBondContact NE2-OE1 3.07Å; K559-Q567 CarbonylContact C-O 3.58Å; K559-Q567 VanDerWaalsContact CA-O 3.31Å; K559-Q567 WeakPolarHBondContact CA-O 3.38Å; K560-Q567 HydrophobicContact CB-CB 4.33Å; K560-Q567 PolarHBondContact N-O 3.41Å; K560-Q567 PolarHBondContact O-N 3.33Å; Q567-D639 CarbonylContact C-O 3.47Å; Q567-D639 VanDerWaalsContact CA-O 3.26Å; Q567-D639 WeakPolarHBondContact CA-O 3.47Å
568	Y	92.9	Very high	88.4	Confident	53 Å²	53	52.1 Å²	52.1	21%	0.208	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	124.3	174.2	-175.9	-93.4	0	0	0	110.7	T557 H558 K559 A634 H636 D639 S640 S644	T557-Y568 HydrophobicContact CG2-CE2 3.87Å; H558-Y568 CarbonylContact O-C 3.57Å; H558-Y568 VanDerWaalsContact O-CA 3.32Å; H558-Y568 WeakPolarHBondContact O-CA 3.49Å; K559-Y568 HydrophobicContact CB-CD2 4.28Å; K559-Y568 HydrophobicContact CD-CD2 4.39Å; K559-Y568 HydrophobicContact CG-CD2 4.21Å; Y568-A634 HydrophobicContact CE1-CB 4.07Å; Y568-A634 WeakPolarHBondContact CE1-O 3.46Å; Y568-H636 HydrophobicContact CD1-CB 3.58Å; Y568-H636 HydrophobicContact CE1-CB 4.35Å; Y568-H636 HydrophobicContact CG-CB 3.86Å; Y568-D639 PolarHBondContact N-O 3.19Å; Y568-S640 WeakPolarHBondContact O-CA 3.26Å; Y568-S640 WeakPolarHBondContact O-CB 3.26Å; Y568-S640 PolarHBondContact O-OG 3.08Å; Y568-S644 PolarHBondContact O-OG 2.82Å; Y568-S644 VanDerWaalsContact O-OG 3.12Å
569	G	93.8	Very high	88.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	124.1	170.5	0	0	0	0	0	109.8	H558	H558-G569 PolarHBondContact N-O 2.79Å; H558-G569 PolarHBondContact O-N 2.97Å
570	K	95.4	Very high	87.5	Confident	45 Å²	45	53.2 Å²	53.2	20%	0.196	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	131.5	172.9	178.1	177.6	-172.2	-170	0	109	E555 F556 T557 G633 A634	E555-K570 WeakPolarHBondContact OE1-CE 3.43Å; E555-K570 IonicContact OE1-NZ 2.64Å; E555-K570 PolarHBondContact OE1-NZ 2.94Å; F556-K570 WeakPolarHBondContact O-CA 3.5Å; T557-K570 HydrophobicContact CG2-CB 4.2Å; T557-K570 WeakPolarHBondContact OG1-CD 3.4Å; T557-K570 WeakPolarHBondContact OG1-CG 3.36Å; K570-G633 CarbonylContact O-C 3.59Å; K570-G633 WeakPolarHBondContact O-CA 3.29Å; K570-A634 HydrophobicContact CB-CB 3.92Å; K570-A634 HydrophobicContact CD-CB 4.06Å; K570-A634 HydrophobicContact CG-CB 4.44Å; K570-A634 PolarHBondContact N-O 3.27Å; K570-A634 PolarHBondContact O-N 3.42Å
571	V	95.9	Very high	87.2	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	137.2	176.4	-62.6	0	0	0	0	109.5	F556 I597 V605 L630 F645 A648 A652	F556-V571 PolarHBondContact N-O 2.88Å; F556-V571 PolarHBondContact O-N 3.3Å; V571-I597 HydrophobicContact CG1-CD1 4.4Å; V571-V605 HydrophobicContact CG1-CG1 4.28Å; V571-V605 HydrophobicContact CG1-CG2 4.05Å; V571-L630 HydrophobicContact CB-CD1 4.03Å; V571-L630 HydrophobicContact CG1-CD1 4.19Å; V571-F645 HydrophobicContact CG1-CD1 4.02Å; V571-F645 HydrophobicContact CG1-CE1 4.26Å; V571-A648 HydrophobicContact CG1-CB 3.96Å; V571-A648 HydrophobicContact CG2-CB 4.01Å; V571-A648 WeakPolarHBondContact CG2-O 3.45Å; V571-A652 HydrophobicContact CG2-CB 3.59Å
572	I	95.8	Very high	87.4	Confident	43 Å²	43	51 Å²	51	22%	0.221	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	136.9	179.8	-56.8	162.2	0	0	0	107.3	F554 E555 Q631 D632	F554-I572 WeakPolarHBondContact O-CA 3.11Å; E555-I572 HydrophobicContact CB-CG1 4.33Å; E555-I572 HydrophobicContact CG-CG1 3.98Å; I572-Q631 PolarHBondContact O-N 3.36Å; I572-D632 WeakPolarHBondContact CA-O 3.36Å; I572-D632 WeakPolarHBondContact CB-O 3.34Å; I572-D632 HydrophobicContact CD1-CB 4.48Å; I572-D632 PolarHBondContact N-O 2.99Å; I572-D632 PolarHBondContact O-N 3.44Å; I572-D632 VanDerWaalsContact O-O 3.11Å
573	G	95.5	Very high	88.3	Confident	2 Å²	2	48.4 Å²	48.4	2%	0.021	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.1	-167.5	-178.1	0	0	0	0	0	113.2	P553 F554 V629	P553-G573 CarbonylContact C-O 3.58Å; P553-G573 WeakPolarHBondContact CA-O 3.33Å; F554-G573 PolarHBondContact N-O 3.28Å; F554-G573 PolarHBondContact O-N 2.89Å; G573-V629 WeakPolarHBondContact CA-O 3.28Å
574	V	96.5	Very high	89	Confident	18 Å²	18	47.1 Å²	47.1	11%	0.109	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	139	175.1	62.3	0	0	0	0	109.8	P551 F554 E576 V629	P551-V574 HydrophobicContact CB-CG2 4.16Å; F554-V574 VanDerWaalsContact CE1-C 3.46Å; V574-E576 HydrophobicContact CG1-CG 4.09Å; V574-E576 HydrophobicContact CG2-CG 3.89Å; V574-V629 HydrophobicContact CG1-CB 3.66Å; V574-V629 HydrophobicContact CG1-CG1 4.24Å; V574-V629 HydrophobicContact CG1-CG2 3.8Å; V574-V629 PolarHBondContact N-O 2.99Å; V574-V629 VanDerWaalsContact N-O 3.12Å; V574-V629 WeakPolarHBondContact O-CB 3.27Å; V574-V629 PolarHBondContact O-N 3.47Å
575	L	96.4	Very high	89.8	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	120.7	171.2	-170.3	74.8	0	0	0	107.8	I548 P551 V552 F554 F609 L626 R627 F628 L653 A656	I548-L575 HydrophobicContact CD1-CB 4.28Å; I548-L575 HydrophobicContact CD1-CD2 3.92Å; I548-L575 HydrophobicContact CD1-CG 3.79Å; I548-L575 WeakPolarHBondContact CD1-O 3.3Å; I548-L575 HydrophobicContact CG2-CD2 4.21Å; P551-L575 CarbonylContact C-O 3.59Å; P551-L575 VanDerWaalsContact CA-O 3.3Å; P551-L575 WeakPolarHBondContact CA-O 3.5Å; V552-L575 PolarHBondContact N-O 3.23Å; V552-L575 PolarHBondContact O-N 3.12Å; F554-L575 HydrophobicContact CD1-CB 4.16Å; F554-L575 HydrophobicContact CE1-CB 4.08Å; L575-F609 HydrophobicContact CD1-CE2 4.26Å; L575-L626 HydrophobicContact CD1-CB 4.38Å; L575-L626 HydrophobicContact CD2-CD2 4.43Å; L575-R627 WeakPolarHBondContact CA-O 3.35Å; L575-F628 HydrophobicContact CD1-CB 4.38Å; L575-F628 HydrophobicContact CD1-CD2 4.06Å; L575-L653 HydrophobicContact CD1-CD1 3.89Å; L575-L653 HydrophobicContact CD2-CD1 3.78Å; L575-A656 HydrophobicContact CB-CB 4.05Å; L575-A656 HydrophobicContact CD2-CB 3.78Å
576	E	94.3	Very high	91	Very high	58 Å²	58	48.9 Å²	48.9	27%	0.271	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	146	-176.8	-54.1	-171.7	149.3	0	0	110.9	P551 V574 R627 V629	P551-E576 HydrophobicContact CB-CG 4.1Å; P551-E576 HydrophobicContact CG-CG 4.34Å; V574-E576 HydrophobicContact CG1-CG 4.09Å; V574-E576 HydrophobicContact CG2-CG 3.89Å; E576-R627 HydrophobicContact CB-CB 4.34Å; E576-R627 PolarHBondContact N-O 2.81Å; E576-R627 PolarHBondContact O-N 2.79Å; E576-R627 IonicContact OE2-NH1 2.73Å; E576-V629 HydrophobicContact CG-CG2 4.45Å
577	P	94.6	Very high	91.5	Very high	37 Å²	37	52.5 Å²	52.5	24%	0.24	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	145.2	169.7	29.9	-31.9	0	0	0	110.5	I548	I548-P577 HydrophobicContact CG1-CB 3.99Å; I548-P577 HydrophobicContact CG1-CG 4.39Å; I548-P577 WeakPolarHBondContact O-CB 3.4Å
578	L	93.2	Very high	91.7	Very high	11 Å²	11	51.8 Å²	51.8	6%	0.058	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-82	163.5	167.5	-67.2	179.3	0	0	0	111.1	D582 Y583 K585 E587 G625 R627	L578-D582 HydrophobicContact CB-CB 4.47Å; L578-Y583 WeakPolarHBondContact O-CE1 3.26Å; L578-K585 HydrophobicContact CD1-CB 4.33Å; L578-E587 HydrophobicContact CD1-CB 4.19Å; L578-E587 HydrophobicContact CD2-CB 4.2Å; L578-E587 VanDerWaalsContact CD2-OE2 3.25Å; L578-E587 WeakPolarHBondContact CD2-OE2 3.43Å; L578-G625 PolarHBondContact N-O 3.46Å; L578-R627 HydrophobicContact CD2-CB 3.86Å; L578-R627 HydrophobicContact CG-CB 4.45Å
579	D	88.4	Confident	91.8	Very high	111 Å²	111	50.5 Å²	50.5	59%	0.594	26%	0.259	S	S	*	.	P	Polyproline II helix	trans	-61.3	151.8	174.9	-69.3	-47.4	0	0	0	111.4	E581 D582 Y583	D579-E581 PolarHBondContact O-N 2.97Å; D579-D582 PolarHBondContact O-N 3.35Å; D579-Y583 PolarHBondContact O-N 2.93Å
580	P	79.8	Confident	91.8	Very high	71 Å²	71	53.7 Å²	53.7	46%	0.461	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-57.3	-25.9	-176.1	-25.2	33.1	0	0	0	115.6	D582 Y583	P580-D582 VanDerWaalsContact C-N 3.28Å; P580-Y583 VanDerWaalsContact CA-CE2 3.41Å; P580-Y583 VanDerWaalsContact CA-CZ 3.45Å; P580-Y583 HydrophobicContact CB-CD2 4.16Å; P580-Y583 HydrophobicContact CB-CE1 4.49Å; P580-Y583 HydrophobicContact CB-CE2 3.6Å; P580-Y583 HydrophobicContact CG-CE2 4.24Å; P580-Y583 VanDerWaalsContact O-CD2 3.29Å; P580-Y583 WeakPolarHBondContact O-CD2 3.38Å
581	E	81.3	Confident	91.7	Very high	177 Å²	177	56.2 Å²	56.2	83%	0.827	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-71.4	-24.5	178.2	-66.3	162.1	-173.1	0	0	112.1	D579	D579-E581 PolarHBondContact O-N 2.97Å
582	D	85.5	Confident	91.4	Very high	59 Å²	59	57.1 Å²	57.1	32%	0.316	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-112.6	19.1	-176	-82.2	-36.2	0	0	0	113.3	L578 D579 P580 T584 K585	L578-D582 HydrophobicContact CB-CB 4.47Å; D579-D582 PolarHBondContact O-N 3.35Å; P580-D582 VanDerWaalsContact C-N 3.28Å; D582-T584 PolarHBondContact O-N 2.72Å; D582-K585 HydrophobicContact CB-CD 4.48Å; D582-K585 PolarHBondContact O-N 2.86Å; D582-K585 WeakPolarHBondContact OD1-CE 3.34Å; D582-K585 IonicContact OD1-NZ 2.95Å; D582-K585 PolarHBondContact OD1-NZ 2.98Å
583	Y	85.8	Confident	90.8	Very high	33 Å²	33	64 Å²	64	13%	0.129	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-8.8	178.2	-78.9	-22.7	0	0	0	115.6	L578 D579 P580 S624 G625 L665	L578-Y583 WeakPolarHBondContact O-CE1 3.26Å; D579-Y583 PolarHBondContact O-N 2.93Å; P580-Y583 VanDerWaalsContact CA-CE2 3.41Å; P580-Y583 VanDerWaalsContact CA-CZ 3.45Å; P580-Y583 HydrophobicContact CB-CD2 4.16Å; P580-Y583 HydrophobicContact CB-CE1 4.49Å; P580-Y583 HydrophobicContact CB-CE2 3.6Å; P580-Y583 HydrophobicContact CG-CE2 4.24Å; P580-Y583 VanDerWaalsContact O-CD2 3.29Å; P580-Y583 WeakPolarHBondContact O-CD2 3.38Å; Y583-S624 CarbonylContact O-C 3.53Å; Y583-S624 WeakPolarHBondContact O-CB 3.07Å; Y583-S624 PolarHBondContact O-OG 3.1Å; Y583-G625 PolarHBondContact O-N 3.39Å; Y583-L665 HydrophobicContact CD1-CD1 4.16Å; Y583-L665 HydrophobicContact CD2-CD1 3.79Å; Y583-L665 HydrophobicContact CD2-CD2 4.22Å; Y583-L665 HydrophobicContact CE2-CD1 4.37Å; Y583-L665 HydrophobicContact CE2-CD2 4.04Å; Y583-L665 HydrophobicContact CG-CD1 3.67Å
584	T	86.3	Confident	89.9	Confident	75 Å²	75	66.8 Å²	66.8	46%	0.46	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-13.2	175.3	47.4	0	0	0	0	114.1	D582 S624 Y736 Y739	D582-T584 PolarHBondContact O-N 2.72Å; T584-S624 VanDerWaalsContact C-OG 3.24Å; T584-S624 VanDerWaalsContact CA-OG 3.3Å; T584-S624 WeakPolarHBondContact CA-OG 3.45Å; T584-S624 PolarHBondContact O-OG 3.48Å; T584-Y736 WeakPolarHBondContact CG2-OH 3.31Å; T584-Y739 HydrophobicContact CG2-CD2 3.72Å; T584-Y739 HydrophobicContact CG2-CE2 3.9Å
585	K	91.2	Very high	89.3	Confident	116 Å²	116	70.2 Å²	70.2	50%	0.504	38%	0.377	S	S	.	.			trans	-99.3	157.1	-174.3	-64.1	174.7	-172.5	156.2	0	111.7	L578 D582 G625	L578-K585 HydrophobicContact CD1-CB 4.33Å; D582-K585 HydrophobicContact CB-CD 4.48Å; D582-K585 PolarHBondContact O-N 2.86Å; D582-K585 WeakPolarHBondContact OD1-CE 3.34Å; D582-K585 IonicContact OD1-NZ 2.95Å; D582-K585 PolarHBondContact OD1-NZ 2.98Å; K585-G625 WeakPolarHBondContact O-CA 3.31Å; K585-G625 PolarHBondContact O-N 2.83Å
586	L	94	Very high	88.8	Confident	59 Å²	59	73.7 Å²	73.7	31%	0.309	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.2	165.8	-68	171.2	0	0	0	106.7	F609 L610 C613 L626	L586-F609 HydrophobicContact CB-CE1 4.21Å; L586-F609 HydrophobicContact CB-CZ 4.4Å; L586-F609 HydrophobicContact CD2-CZ 4.07Å; L586-L610 HydrophobicContact CB-CD2 4.14Å; L586-L610 HydrophobicContact CD1-CD2 3.9Å; L586-C613 HydrophobicContact CD1-CB 3.65Å; L586-C613 HydrophobicContact CD2-CB 4.35Å; L586-L626 HydrophobicContact CD2-CB 3.91Å; L586-L626 HydrophobicContact CD2-CG 4.43Å
587	E	94.6	Very high	88.6	Confident	78 Å²	78	71.1 Å²	71.1	36%	0.364	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	135.2	180	-169.8	177	-180	0	0	109.7	L578 L626 R627 F628	L578-E587 HydrophobicContact CD1-CB 4.19Å; L578-E587 HydrophobicContact CD2-CB 4.2Å; L578-E587 VanDerWaalsContact CD2-OE2 3.25Å; L578-E587 WeakPolarHBondContact CD2-OE2 3.43Å; E587-L626 PolarHBondContact N-O 3.46Å; E587-R627 HydrophobicContact CB-CB 4.27Å; E587-R627 HydrophobicContact CB-CG 4.19Å; E587-R627 VanDerWaalsContact CD-NE 3.32Å; E587-R627 HydrophobicContact CG-CG 4.28Å; E587-R627 CarbonylContact O-C 3.52Å; E587-R627 VanDerWaalsContact O-CA 3.3Å; E587-R627 WeakPolarHBondContact O-CA 3.4Å; E587-R627 IonicContact OE1-NE 3.48Å; E587-R627 IonicContact OE1-NH2 3.41Å; E587-R627 IonicContact OE2-CZ 3.68Å; E587-R627 IonicContact OE2-NE 2.97Å; E587-R627 PolarHBondContact OE2-NE 3.44Å; E587-R627 IonicContact OE2-NH2 3.51Å; E587-R627 PolarHBondContact OE2-NH2 3.33Å; E587-F628 PolarHBondContact O-N 3.33Å
588	F	95.7	Very high	88.4	Confident	42 Å²	42	70.7 Å²	70.7	18%	0.184	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	125.1	172.5	-177.3	-87.9	0	0	0	108.4	D590 V602 V605 E606 F609 F628 L630	F588-D590 HydrophobicContact CE1-CB 4.34Å; F588-V602 HydrophobicContact CE1-CG1 3.67Å; F588-V602 HydrophobicContact CZ-CG1 3.96Å; F588-V605 HydrophobicContact CE2-CG1 4.26Å; F588-E606 HydrophobicContact CB-CG 3.97Å; F588-E606 HydrophobicContact CD1-CB 4.1Å; F588-E606 HydrophobicContact CD1-CG 4.1Å; F588-E606 HydrophobicContact CD2-CB 3.92Å; F588-E606 HydrophobicContact CD2-CG 4.02Å; F588-E606 HydrophobicContact CE1-CB 4.17Å; F588-E606 HydrophobicContact CE2-CB 3.97Å; F588-E606 HydrophobicContact CG-CB 3.98Å; F588-E606 HydrophobicContact CG-CG 3.76Å; F588-E606 HydrophobicContact CZ-CB 4.1Å; F588-F609 HydrophobicContact CD2-CD1 4.29Å; F588-F628 HydrophobicContact CD2-CB 4.06Å; F588-F628 AromaticContact CD2-CD1 3.73Å; F588-F628 HydrophobicContact CD2-CD1 3.73Å; F588-F628 HydrophobicContact CD2-CG 4.22Å; F588-F628 AromaticContact CE2-CD1 3.46Å; F588-F628 HydrophobicContact CE2-CD1 3.46Å; F588-F628 VanDerWaalsContact CE2-CD1 3.46Å; F588-F628 AromaticContact CE2-CE1 3.94Å; F588-F628 HydrophobicContact CE2-CE1 3.94Å; F588-F628 HydrophobicContact CE2-CG 4.35Å; F588-L630 HydrophobicContact CZ-CB 4.08Å; F588-L630 HydrophobicContact CZ-CD2 4.12Å
589	S	94.8	Very high	88.2	Confident	26 Å²	26	77.1 Å²	77.1	18%	0.182	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	126.5	-178.5	52.1	0	0	0	0	109.8	F628 V629 L630	S589-F628 PolarHBondContact N-O 3.13Å; S589-F628 PolarHBondContact OG-O 3.37Å; S589-V629 WeakPolarHBondContact O-CA 3.48Å; S589-V629 WeakPolarHBondContact OG-CA 3.27Å; S589-V629 WeakPolarHBondContact OG-CG2 3.47Å; S589-L630 PolarHBondContact O-N 3Å
590	D	93.8	Very high	88.3	Confident	67 Å²	67	78.8 Å²	78.8	36%	0.358	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	107.4	178.1	178.2	17.9	0	0	0	109.6	F588 T592 V602	F588-D590 HydrophobicContact CE1-CB 4.34Å; D590-T592 VanDerWaalsContact OD1-CB 3.23Å; D590-T592 WeakPolarHBondContact OD1-CB 3.34Å; D590-T592 WeakPolarHBondContact OD1-CG2 3.43Å; D590-T592 PolarHBondContact OD1-N 2.87Å; D590-T592 PolarHBondContact OD1-OG1 2.92Å; D590-T592 PolarHBondContact OD2-OG1 3.31Å; D590-V602 HydrophobicContact CB-CG1 4.33Å
591	E	93.2	Very high	88.9	Confident	97 Å²	97	76.9 Å²	76.9	45%	0.453	40%	0.397	S	S	.	.			trans	-104.6	17.2	174.8	-62.4	-172.1	158	0	0	111.7	F593 V629 L630	E591-F593 WeakPolarHBondContact O-CD2 3.45Å; E591-F593 VanDerWaalsContact O-CE2 3.25Å; E591-F593 WeakPolarHBondContact O-CE2 3.22Å; E591-F593 PolarHBondContact O-N 3.13Å; E591-V629 HydrophobicContact CB-CG1 4.39Å; E591-V629 HydrophobicContact CG-CG1 3.74Å; E591-V629 WeakPolarHBondContact OE2-CG1 3.12Å; E591-L630 CarbonylContact C-O 3.49Å; E591-L630 WeakPolarHBondContact CA-O 3.35Å; E591-L630 PolarHBondContact N-O 2.87Å
592	T	89.1	Confident	89.5	Confident	20 Å²	20	69 Å²	69	12%	0.123	36%	0.361	C	S	.	.			trans	-67	125.1	-176.9	60.3	0	0	0	0	112.7	D590 I597 L630 Q631	D590-T592 VanDerWaalsContact OD1-CB 3.23Å; D590-T592 WeakPolarHBondContact OD1-CB 3.34Å; D590-T592 WeakPolarHBondContact OD1-CG2 3.43Å; D590-T592 PolarHBondContact OD1-N 2.87Å; D590-T592 PolarHBondContact OD1-OG1 2.92Å; D590-T592 PolarHBondContact OD2-OG1 3.31Å; T592-I597 HydrophobicContact CG2-CD1 4.35Å; T592-L630 HydrophobicContact CG2-CD2 3.98Å; T592-L630 HydrophobicContact CG2-CG 3.75Å; T592-L630 PolarHBondContact N-O 3.2Å; T592-Q631 WeakPolarHBondContact CA-O 3.48Å
593	F	83.8	Confident	90	Very high	186 Å²	186	70 Å²	70	82%	0.816	37%	0.37	S	S	*	.			trans	-104.3	116.1	173.2	-64.6	-81.7	0	0	0	110.4	E591	E591-F593 WeakPolarHBondContact O-CD2 3.45Å; E591-F593 VanDerWaalsContact O-CE2 3.25Å; E591-F593 WeakPolarHBondContact O-CE2 3.22Å; E591-F593 PolarHBondContact O-N 3.13Å
594	G	76.9	Confident	90.4	Very high	61 Å²	61	68.5 Å²	68.5	63%	0.629	37%	0.365	S	S	*	.	S	Bend	trans	103.1	-153	176.3	0	0	0	0	0	114.5
595	S	82.5	Confident	90.9	Very high	91 Å²	91	65 Å²	65	64%	0.636	34%	0.343	S	S	*	.	S	Bend	trans	-116.3	18	-174	63.2	0	0	0	0	113.9	I597 H635	S595-I597 VanDerWaalsContact C-N 3.32Å; S595-I597 PolarHBondContact O-N 2.91Å; S595-H635 PolarHBondContact O-CE1 3Å; S595-H635 VanDerWaalsContact O-CE1 3.3Å
596	N	86.8	Confident	91.1	Very high	73 Å²	73	63 Å²	63	39%	0.39	34%	0.336	S	S	.	.	S	Bend	trans	-65.3	-34.5	-177.8	-76.3	-6.3	0	0	0	112.8	D632 H635	N596-D632 VanDerWaalsContact CB-OD1 3.23Å; N596-D632 WeakPolarHBondContact CB-OD1 3.35Å; N596-D632 PolarHBondContact ND2-OD1 3.27Å; N596-D632 PolarHBondContact ND2-OD2 2.92Å; N596-H635 PolarHBondContact O-N 2.64Å; N596-H635 PolarHBondContact O-ND1 2.66Å
597	I	89.3	Confident	91.1	Very high	3 Å²	3	65.2 Å²	65.2	2%	0.015	34%	0.343	C	S	.	.	S	Bend	trans	-113.3	121.5	164.2	-60.9	175.7	0	0	0	106.9	V571 T592 S595 K599 V602 L630 F645	V571-I597 HydrophobicContact CG1-CD1 4.4Å; T592-I597 HydrophobicContact CG2-CD1 4.35Å; S595-I597 VanDerWaalsContact C-N 3.32Å; S595-I597 PolarHBondContact O-N 2.91Å; I597-K599 PolarHBondContact O-N 3.42Å; I597-V602 HydrophobicContact CG2-CG2 4.25Å; I597-L630 HydrophobicContact CD1-CD1 3.87Å; I597-L630 HydrophobicContact CD1-CD2 4.02Å; I597-L630 HydrophobicContact CD1-CG 4.2Å; I597-F645 HydrophobicContact CD1-CE1 4.4Å; I597-F645 HydrophobicContact CG1-CE1 4.13Å; I597-F645 HydrophobicContact CG2-CD1 4.44Å; I597-F645 HydrophobicContact CG2-CE1 3.89Å; I597-F645 HydrophobicContact CG2-CZ 4.12Å
598	P	90.1	Very high	91.1	Very high	28 Å²	28	61.5 Å²	61.5	18%	0.182	33%	0.326	C	S	.	.			trans	-58.9	126.9	172.4	-25	34.5	0	0	0	110.7	Q600 F601 H635	P598-Q600 HydrophobicContact CB-CG 3.95Å; P598-Q600 PolarHBondContact O-N 2.99Å; P598-F601 HydrophobicContact CB-CD2 3.77Å; P598-F601 HydrophobicContact CB-CE2 4.14Å; P598-F601 HydrophobicContact CG-CD2 3.84Å; P598-F601 HydrophobicContact CG-CE2 4.04Å; P598-F601 PolarHBondContact O-N 3Å; P598-H635 HydrophobicContact CG-CB 4.35Å
599	K	89.4	Confident	91.1	Very high	146 Å²	146	59.5 Å²	59.5	64%	0.635	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-55.5	-27.1	-176	-67.4	-151.7	172.9	-151.5	0	114.5	I597 F601 V602	I597-K599 PolarHBondContact O-N 3.42Å; K599-F601 PolarHBondContact O-N 3.11Å; K599-V602 PolarHBondContact O-N 2.96Å
600	Q	90.3	Very high	91.1	Very high	146 Å²	146	61.7 Å²	61.7	68%	0.682	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-61.7	-22	173.9	65.2	-173.7	8.3	0	0	114.1	P598	P598-Q600 HydrophobicContact CB-CG 3.95Å; P598-Q600 PolarHBondContact O-N 2.99Å
601	F	93	Very high	91.1	Very high	31 Å²	31	62.2 Å²	62.2	14%	0.136	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-99.5	-5.7	-179.6	-60.6	-43.3	0	0	0	113.7	P598 K599 A604 V605 F645	P598-F601 HydrophobicContact CB-CD2 3.77Å; P598-F601 HydrophobicContact CB-CE2 4.14Å; P598-F601 HydrophobicContact CG-CD2 3.84Å; P598-F601 HydrophobicContact CG-CE2 4.04Å; P598-F601 PolarHBondContact O-N 3Å; K599-F601 PolarHBondContact O-N 3.11Å; F601-A604 WeakPolarHBondContact O-CA 3.32Å; F601-A604 WeakPolarHBondContact O-CB 3.35Å; F601-A604 PolarHBondContact O-N 3.33Å; F601-V605 PolarHBondContact O-N 3.31Å; F601-V605 VanDerWaalsContact O-N 3.15Å; F601-F645 HydrophobicContact CB-CB 4.28Å; F601-F645 HydrophobicContact CB-CD2 3.58Å; F601-F645 HydrophobicContact CB-CE2 4.06Å; F601-F645 HydrophobicContact CB-CG 3.94Å; F601-F645 AromaticContact CD2-CD2 3.69Å; F601-F645 HydrophobicContact CD2-CD2 3.69Å; F601-F645 AromaticContact CD2-CE2 3.56Å; F601-F645 HydrophobicContact CD2-CE2 3.56Å; F601-F645 HydrophobicContact CE2-CE2 4.29Å; F601-F645 AromaticContact CG-CD2 3.72Å; F601-F645 HydrophobicContact CG-CD2 3.72Å; F601-F645 HydrophobicContact CG-CE2 4.07Å
602	V	93.6	Very high	91.1	Very high	13 Å²	13	58.6 Å²	58.6	8%	0.079	32%	0.316	C	S	.	.	H	α-helix	trans	-60.1	-45.4	175.7	176.1	0	0	0	0	111.8	F588 D590 I597 K599 A604 V605 E606 L630	F588-V602 HydrophobicContact CE1-CG1 3.67Å; F588-V602 HydrophobicContact CZ-CG1 3.96Å; D590-V602 HydrophobicContact CB-CG1 4.33Å; I597-V602 HydrophobicContact CG2-CG2 4.25Å; K599-V602 PolarHBondContact O-N 2.96Å; V602-A604 PolarHBondContact O-N 3.12Å; V602-A604 VanDerWaalsContact O-N 3.13Å; V602-V605 WeakPolarHBondContact O-CB 3.43Å; V602-V605 PolarHBondContact O-N 3.44Å; V602-E606 PolarHBondContact O-N 3.17Å; V602-L630 HydrophobicContact CG1-CD2 4.32Å; V602-L630 HydrophobicContact CG2-CD2 4.3Å
603	P	95.4	Very high	91.4	Very high	78 Å²	78	57.8 Å²	57.8	51%	0.506	31%	0.311	S	S	.	.	H	α-helix	trans	-60.6	-25.5	174	-23.9	35	0	0	0	113.5	K607	P603-K607 VanDerWaalsContact O-CB 3.29Å; P603-K607 WeakPolarHBondContact O-CB 3.3Å; P603-K607 PolarHBondContact O-N 3.33Å
604	A	95.4	Very high	91.7	Very high	3 Å²	3	55.4 Å²	55.4	3%	0.025	30%	0.302	C	S	.	.	H	α-helix	trans	-72.5	-38.8	176.3	0	0	0	0	0	111.6	F601 V602 G608 E642 F645 I646	F601-A604 WeakPolarHBondContact O-CA 3.32Å; F601-A604 WeakPolarHBondContact O-CB 3.35Å; F601-A604 PolarHBondContact O-N 3.33Å; V602-A604 PolarHBondContact O-N 3.12Å; V602-A604 VanDerWaalsContact O-N 3.13Å; A604-G608 PolarHBondContact O-N 2.7Å; A604-E642 HydrophobicContact CB-CB 4.45Å; A604-E642 HydrophobicContact CB-CG 3.47Å; A604-E642 VanDerWaalsContact CB-CG 3.47Å; A604-F645 HydrophobicContact CB-CB 4.25Å; A604-I646 HydrophobicContact CB-CG1 4.04Å; A604-I646 WeakPolarHBondContact O-CA 3.32Å; A604-I646 WeakPolarHBondContact O-CG1 3.34Å
605	V	95	Very high	92.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-65.2	-46.6	172.8	-177.6	0	0	0	0	110.1	V571 F588 F601 V602 K607 G608 F609 F628 F645	V571-V605 HydrophobicContact CG1-CG1 4.28Å; V571-V605 HydrophobicContact CG1-CG2 4.05Å; F588-V605 HydrophobicContact CE2-CG1 4.26Å; F601-V605 PolarHBondContact O-N 3.31Å; F601-V605 VanDerWaalsContact O-N 3.15Å; V602-V605 WeakPolarHBondContact O-CB 3.43Å; V602-V605 PolarHBondContact O-N 3.44Å; V605-K607 VanDerWaalsContact C-N 3.34Å; V605-K607 PolarHBondContact O-N 3.37Å; V605-G608 PolarHBondContact O-N 3.39Å; V605-G608 VanDerWaalsContact O-N 3.15Å; V605-F609 PolarHBondContact O-N 2.94Å; V605-F628 HydrophobicContact CG1-CE1 4.01Å; V605-F628 HydrophobicContact CG1-CZ 4.34Å; V605-F645 HydrophobicContact CG2-CB 3.79Å; V605-F645 HydrophobicContact CG2-CD1 3.7Å; V605-F645 HydrophobicContact CG2-CG 4.14Å
606	E	95.6	Very high	92.5	Very high	75 Å²	75	55.1 Å²	55.1	35%	0.35	27%	0.273	S	S	.	.	H	α-helix	trans	-56.8	-47.4	176.6	-178.5	-178.9	-173.4	0	0	111.3	F588 V602 G608 F609 L610	F588-E606 HydrophobicContact CB-CG 3.97Å; F588-E606 HydrophobicContact CD1-CB 4.1Å; F588-E606 HydrophobicContact CD1-CG 4.1Å; F588-E606 HydrophobicContact CD2-CB 3.92Å; F588-E606 HydrophobicContact CD2-CG 4.02Å; F588-E606 HydrophobicContact CE1-CB 4.17Å; F588-E606 HydrophobicContact CE2-CB 3.97Å; F588-E606 HydrophobicContact CG-CB 3.98Å; F588-E606 HydrophobicContact CG-CG 3.76Å; F588-E606 HydrophobicContact CZ-CB 4.1Å; V602-E606 PolarHBondContact O-N 3.17Å; E606-G608 PolarHBondContact O-N 3.09Å; E606-F609 WeakPolarHBondContact O-CB 3.35Å; E606-F609 PolarHBondContact O-N 3.33Å; E606-L610 HydrophobicContact CG-CD1 4.18Å; E606-L610 WeakPolarHBondContact O-CG 3.49Å; E606-L610 PolarHBondContact O-N 3.42Å
607	K	95.6	Very high	92.7	Very high	105 Å²	105	55.1 Å²	55.1	46%	0.457	28%	0.277	S	S	.	.	H	α-helix	trans	-59	-44.8	175.1	-173.2	-179.1	-176.3	-178.8	0	112.4	P603 V605 F609 L610 D611	P603-K607 VanDerWaalsContact O-CB 3.29Å; P603-K607 WeakPolarHBondContact O-CB 3.3Å; P603-K607 PolarHBondContact O-N 3.33Å; V605-K607 VanDerWaalsContact C-N 3.34Å; V605-K607 PolarHBondContact O-N 3.37Å; K607-F609 VanDerWaalsContact C-N 3.29Å; K607-F609 PolarHBondContact O-N 3.45Å; K607-L610 PolarHBondContact O-N 2.78Å; K607-D611 WeakPolarHBondContact O-CB 3.4Å; K607-D611 VanDerWaalsContact O-CG 3.25Å; K607-D611 PolarHBondContact O-N 3.4Å
608	G	94.8	Very high	92.7	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.4	-33.8	176.6	0	0	0	0	0	113.5	A604 V605 E606 A612	A604-G608 PolarHBondContact O-N 2.7Å; V605-G608 PolarHBondContact O-N 3.39Å; V605-G608 VanDerWaalsContact O-N 3.15Å; E606-G608 PolarHBondContact O-N 3.09Å; G608-A612 VanDerWaalsContact O-CB 3.23Å; G608-A612 WeakPolarHBondContact O-CB 3.5Å; G608-A612 PolarHBondContact O-N 2.84Å
609	F	95.1	Very high	92.8	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-66	-52.5	171.4	161.9	-111.5	0	0	0	111.5	L575 L586 F588 V605 E606 K607 D611 A612 C613 L626 F628 L653	L575-F609 HydrophobicContact CD1-CE2 4.26Å; L586-F609 HydrophobicContact CB-CE1 4.21Å; L586-F609 HydrophobicContact CB-CZ 4.4Å; L586-F609 HydrophobicContact CD2-CZ 4.07Å; F588-F609 HydrophobicContact CD2-CD1 4.29Å; V605-F609 PolarHBondContact O-N 2.94Å; E606-F609 WeakPolarHBondContact O-CB 3.35Å; E606-F609 PolarHBondContact O-N 3.33Å; K607-F609 VanDerWaalsContact C-N 3.29Å; K607-F609 PolarHBondContact O-N 3.45Å; F609-D611 PolarHBondContact O-N 3.46Å; F609-A612 PolarHBondContact O-N 3.3Å; F609-A612 VanDerWaalsContact O-N 3.15Å; F609-C613 WeakPolarHBondContact CE2-SG 3.37Å; F609-C613 PolarHBondContact O-N 3.37Å; F609-C613 PolarHBondContact O-SG 3.23Å; F609-C613 VanDerWaalsContact O-SG 3.39Å; F609-L626 HydrophobicContact CZ-CB 4.33Å; F609-F628 HydrophobicContact CB-CD2 4.31Å; F609-F628 HydrophobicContact CB-CG 4.45Å; F609-F628 HydrophobicContact CD1-CB 4.01Å; F609-F628 HydrophobicContact CD1-CG 4.5Å; F609-F628 HydrophobicContact CD2-CB 3.86Å; F609-F628 AromaticContact CD2-CD2 3.49Å; F609-F628 HydrophobicContact CD2-CD2 3.49Å; F609-F628 VanDerWaalsContact CD2-CD2 3.49Å; F609-F628 HydrophobicContact CD2-CE2 4.3Å; F609-F628 AromaticContact CD2-CG 3.92Å; F609-F628 HydrophobicContact CD2-CG 3.92Å; F609-F628 HydrophobicContact CE1-CB 3.91Å; F609-F628 HydrophobicContact CE2-CB 3.76Å; F609-F628 AromaticContact CE2-CD2 3.96Å; F609-F628 HydrophobicContact CE2-CD2 3.96Å; F609-F628 HydrophobicContact CE2-CG 4.27Å; F609-F628 HydrophobicContact CG-CB 3.98Å; F609-F628 AromaticContact CG-CD2 3.97Å; F609-F628 HydrophobicContact CG-CD2 3.97Å; F609-F628 HydrophobicContact CG-CG 4.04Å; F609-F628 HydrophobicContact CZ-CB 3.78Å; F609-L653 HydrophobicContact CD2-CD1 4.08Å; F609-L653 HydrophobicContact CD2-CD2 4.15Å; F609-L653 HydrophobicContact CE2-CD1 4.03Å; F609-L653 HydrophobicContact CE2-CD2 4.5Å
610	L	94.6	Very high	92.7	Very high	72 Å²	72	50 Å²	50	38%	0.377	26%	0.261	S	S	.	.	H	α-helix	trans	-59.5	-45.4	-179.9	-69.4	173.7	0	0	0	112.3	L586 E606 K607 A612 C613	L586-L610 HydrophobicContact CB-CD2 4.14Å; L586-L610 HydrophobicContact CD1-CD2 3.9Å; E606-L610 HydrophobicContact CG-CD1 4.18Å; E606-L610 WeakPolarHBondContact O-CG 3.49Å; E606-L610 PolarHBondContact O-N 3.42Å; K607-L610 PolarHBondContact O-N 2.78Å; L610-A612 VanDerWaalsContact C-N 3.29Å; L610-A612 PolarHBondContact O-N 3.44Å; L610-C613 PolarHBondContact O-N 2.96Å; L610-C613 VanDerWaalsContact O-N 3.16Å
611	D	93.7	Very high	92.8	Very high	79 Å²	79	44.9 Å²	44.9	42%	0.422	24%	0.237	S	C	.	.	H	α-helix	trans	-62.5	-37	177.4	-72.1	-9.8	0	0	0	111.2	K607 F609 C613 E614	K607-D611 WeakPolarHBondContact O-CB 3.4Å; K607-D611 VanDerWaalsContact O-CG 3.25Å; K607-D611 PolarHBondContact O-N 3.4Å; F609-D611 PolarHBondContact O-N 3.46Å; D611-C613 VanDerWaalsContact C-N 3.34Å; D611-E614 PolarHBondContact O-N 3.03Å
612	A	93.4	Very high	92.8	Very high	21 Å²	21	47.4 Å²	47.4	17%	0.174	25%	0.248	C	C	.	.	H	α-helix	trans	-74.4	-23.4	177.8	0	0	0	0	0	113.3	G608 F609 L610 E614 E650 L653	G608-A612 VanDerWaalsContact O-CB 3.23Å; G608-A612 WeakPolarHBondContact O-CB 3.5Å; G608-A612 PolarHBondContact O-N 2.84Å; F609-A612 PolarHBondContact O-N 3.3Å; F609-A612 VanDerWaalsContact O-N 3.15Å; L610-A612 VanDerWaalsContact C-N 3.29Å; L610-A612 PolarHBondContact O-N 3.44Å; A612-E614 VanDerWaalsContact C-N 3.3Å; A612-E614 PolarHBondContact O-N 3.49Å; A612-E650 HydrophobicContact CB-CB 4.45Å; A612-E650 HydrophobicContact CB-CG 4.23Å; A612-L653 HydrophobicContact CB-CD2 3.53Å
613	C	94	Very high	92.8	Very high	3 Å²	3	47 Å²	47	2%	0.02	25%	0.245	C	C	.	.	H	α-helix	trans	-74.6	-15	175.7	-74.8	0	0	0	0	114	L586 F609 L610 D611 K615 L623	L586-C613 HydrophobicContact CD1-CB 3.65Å; L586-C613 HydrophobicContact CD2-CB 4.35Å; F609-C613 WeakPolarHBondContact CE2-SG 3.37Å; F609-C613 PolarHBondContact O-N 3.37Å; F609-C613 PolarHBondContact O-SG 3.23Å; F609-C613 VanDerWaalsContact O-SG 3.39Å; L610-C613 PolarHBondContact O-N 2.96Å; L610-C613 VanDerWaalsContact O-N 3.16Å; D611-C613 VanDerWaalsContact C-N 3.34Å; C613-K615 PolarHBondContact O-N 3.42Å; C613-L623 HydrophobicContact CB-CB 4.07Å; C613-L623 PolarHBondContact O-N 3.07Å
614	E	90.8	Very high	92.7	Very high	136 Å²	136	43.3 Å²	43.3	64%	0.636	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-26.9	179.9	-68.3	-162.2	150.7	0	0	113.5	D611 A612 K622	D611-E614 PolarHBondContact O-N 3.03Å; A612-E614 VanDerWaalsContact C-N 3.3Å; A612-E614 PolarHBondContact O-N 3.49Å; E614-K622 WeakPolarHBondContact O-CG 3.41Å
615	K	88.2	Confident	92.6	Very high	143 Å²	143	43.2 Å²	43.2	62%	0.622	22%	0.22	S	C	*	.	S	Bend	trans	-136.4	106.9	-177.1	-167.9	176.9	-176.8	-178.8	0	112.1	C613	C613-K615 PolarHBondContact O-N 3.42Å
616	G	89.4	Confident	92.6	Very high	2 Å²	2	43.2 Å²	43.2	2%	0.021	22%	0.22	C	C	.	.			trans	-70.4	147.8	175.8	0	0	0	0	0	113.2	E546 G620 H621	E546-G616 VanDerWaalsContact OE2-CA 3.29Å; E546-G616 WeakPolarHBondContact OE2-CA 3.44Å; G616-G620 VanDerWaalsContact O-CA 3.3Å; G616-G620 WeakPolarHBondContact O-CA 3.49Å; G616-G620 PolarHBondContact O-N 3.39Å; G616-H621 VanDerWaalsContact CA-O 3.27Å; G616-H621 WeakPolarHBondContact CA-O 3.38Å; G616-H621 PolarHBondContact N-O 3.14Å
617	P	90.5	Very high	92.6	Very high	73 Å²	73	43.1 Å²	43.1	47%	0.474	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-21.6	-178.1	31.7	-35.6	0	0	0	113.5	E546 L657 L662	E546-P617 WeakPolarHBondContact OE2-CD 3.41Å; P617-L657 HydrophobicContact CG-CB 4.31Å; P617-L657 HydrophobicContact CG-CD1 4.19Å; P617-L662 HydrophobicContact CG-CD1 3.56Å
618	L	89.8	Confident	92.7	Very high	41 Å²	41	38.1 Å²	38.1	22%	0.215	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-49.3	-169.9	-175.3	63.2	0	0	0	112.5	E546 L662 I664 I751 Y754	E546-L618 HydrophobicContact CG-CB 4.47Å; E546-L618 VanDerWaalsContact OE2-CB 3.29Å; E546-L618 WeakPolarHBondContact OE2-CB 3.02Å; E546-L618 PolarHBondContact OE2-N 2.95Å; L618-L662 HydrophobicContact CB-CD1 4.33Å; L618-L662 HydrophobicContact CD2-CB 4.03Å; L618-I664 HydrophobicContact CD2-CD1 4.16Å; L618-I664 HydrophobicContact CD2-CG1 3.76Å; L618-I751 HydrophobicContact CD1-CD1 3.74Å; L618-I751 HydrophobicContact CD1-CG1 3.96Å; L618-I751 HydrophobicContact CD2-CD1 4.14Å; L618-I751 HydrophobicContact CD2-CG1 4.44Å; L618-I751 HydrophobicContact CG-CD1 3.98Å; L618-I751 HydrophobicContact CG-CG1 3.92Å; L618-Y754 VanDerWaalsContact O-CD1 3.31Å; L618-Y754 WeakPolarHBondContact O-CD1 3.29Å
619	S	90.4	Very high	92.8	Very high	4 Å²	4	38.3 Å²	38.3	3%	0.028	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129	-2	-175	68.4	0	0	0	0	113.6	E546 H621 Y754	E546-S619 VanDerWaalsContact OE1-CA 3.3Å; E546-S619 WeakPolarHBondContact OE1-CA 3.35Å; E546-S619 WeakPolarHBondContact OE1-CB 3.32Å; E546-S619 PolarHBondContact OE1-N 2.8Å; E546-S619 PolarHBondContact OE1-OG 2.69Å; S619-H621 VanDerWaalsContact C-N 3.28Å; S619-H621 WeakPolarHBondContact CB-ND1 3.18Å; S619-H621 PolarHBondContact O-N 2.99Å; S619-H621 PolarHBondContact O-ND1 2.98Å; S619-H621 PolarHBondContact OG-ND1 2.61Å; S619-Y754 WeakPolarHBondContact O-CD2 3.48Å
620	G	88.1	Confident	92.8	Very high	25 Å²	25	38.3 Å²	38.3	26%	0.258	20%	0.196	S	C	.	.	S	Bend	trans	78	9.7	-179.5	0	0	0	0	0	114.3	E546 G616	E546-G620 PolarHBondContact OE1-N 3.4Å; E546-G620 VanDerWaalsContact OE1-N 3.1Å; G616-G620 VanDerWaalsContact O-CA 3.3Å; G616-G620 WeakPolarHBondContact O-CA 3.49Å; G616-G620 PolarHBondContact O-N 3.39Å
621	H	91.8	Very high	92.8	Very high	39 Å²	39	38.8 Å²	38.8	18%	0.181	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-88.9	167.7	176.5	-65.5	92.9	0	0	0	111.2	F544 E546 G616 S619	F544-H621 AromaticContact CD2-NE2 3.92Å; F544-H621 WeakPolarHBondContact O-CB 3.42Å; E546-H621 PolarHBondContact OE1-N 3.49Å; G616-H621 VanDerWaalsContact CA-O 3.27Å; G616-H621 WeakPolarHBondContact CA-O 3.38Å; G616-H621 PolarHBondContact N-O 3.14Å; S619-H621 VanDerWaalsContact C-N 3.28Å; S619-H621 WeakPolarHBondContact CB-ND1 3.18Å; S619-H621 PolarHBondContact O-N 2.99Å; S619-H621 PolarHBondContact O-ND1 2.98Å; S619-H621 PolarHBondContact OG-ND1 2.61Å
622	K	92.7	Very high	92.7	Very high	83 Å²	83	37.8 Å²	37.8	36%	0.361	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	137.4	179.8	-69.7	-178.9	-179.3	177.4	0	111.3	E506 R545 E546 E614	E506-K622 WeakPolarHBondContact OE1-CD 3.34Å; R545-K622 WeakPolarHBondContact CA-O 3.3Å; R545-K622 VanDerWaalsContact NH1-CD 3.3Å; E546-K622 PolarHBondContact N-O 3.38Å; E614-K622 WeakPolarHBondContact O-CG 3.41Å
623	L	94.1	Very high	92.6	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.021	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	133.6	168.7	-69.7	162.4	0	0	0	108.9	E546 C613 L626 L653 L657	E546-L623 HydrophobicContact CB-CD2 3.54Å; E546-L623 HydrophobicContact CB-CG 4.41Å; E546-L623 CarbonylContact O-C 3.48Å; E546-L623 VanDerWaalsContact O-CA 3.31Å; E546-L623 WeakPolarHBondContact O-CA 3.3Å; C613-L623 HydrophobicContact CB-CB 4.07Å; C613-L623 PolarHBondContact O-N 3.07Å; L623-L626 HydrophobicContact CB-CD1 3.83Å; L623-L626 HydrophobicContact CD2-CD1 4.39Å; L623-L653 HydrophobicContact CD1-CD2 4.36Å; L623-L657 HydrophobicContact CD1-CD1 3.58Å; L623-L657 HydrophobicContact CD1-CD2 4.17Å; L623-L657 HydrophobicContact CD2-CD2 3.97Å
624	S	92.8	Very high	92.6	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.014	20%	0.197	C	C	.	.			trans	-151.2	157.9	-174.1	-161.7	0	0	0	0	110.7	E546 T547 Y583 T584	E546-S624 PolarHBondContact O-N 2.88Å; T547-S624 VanDerWaalsContact CB-O 3.22Å; T547-S624 WeakPolarHBondContact CB-O 3.43Å; T547-S624 PolarHBondContact OG1-O 3.2Å; T547-S624 VanDerWaalsContact OG1-O 3.11Å; Y583-S624 CarbonylContact O-C 3.53Å; Y583-S624 WeakPolarHBondContact O-CB 3.07Å; Y583-S624 PolarHBondContact O-OG 3.1Å; T584-S624 VanDerWaalsContact C-OG 3.24Å; T584-S624 VanDerWaalsContact CA-OG 3.3Å; T584-S624 WeakPolarHBondContact CA-OG 3.45Å; T584-S624 PolarHBondContact O-OG 3.48Å
625	G	93.9	Very high	92.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.182	C	C	.	.	S	Bend	trans	70.1	37.9	-177.4	0	0	0	0	0	112.4	T547 L578 Y583 K585	T547-G625 PolarHBondContact OG1-O 3.2Å; L578-G625 PolarHBondContact N-O 3.46Å; Y583-G625 PolarHBondContact O-N 3.39Å; K585-G625 WeakPolarHBondContact O-CA 3.31Å; K585-G625 PolarHBondContact O-N 2.83Å
626	L	95.3	Very high	92.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	136	-177.8	-63	176.8	0	0	0	110.4	I548 L575 L586 E587 F609 L623	I548-L626 HydrophobicContact CB-CD2 4.31Å; I548-L626 HydrophobicContact CD1-CD2 4.06Å; I548-L626 HydrophobicContact CG1-CD2 3.73Å; I548-L626 HydrophobicContact CG2-CD2 4.03Å; L575-L626 HydrophobicContact CD1-CB 4.38Å; L575-L626 HydrophobicContact CD2-CD2 4.43Å; L586-L626 HydrophobicContact CD2-CB 3.91Å; L586-L626 HydrophobicContact CD2-CG 4.43Å; E587-L626 PolarHBondContact N-O 3.46Å; F609-L626 HydrophobicContact CZ-CB 4.33Å; L623-L626 HydrophobicContact CB-CD1 3.83Å; L623-L626 HydrophobicContact CD2-CD1 4.39Å
627	R	96.1	Very high	92.5	Very high	73 Å²	73	41 Å²	41	28%	0.275	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	118.5	168	-176.4	-179.2	-66.7	150.6	-0.5	109.9	L575 E576 L578 E587 V629	L575-R627 WeakPolarHBondContact CA-O 3.35Å; E576-R627 HydrophobicContact CB-CB 4.34Å; E576-R627 PolarHBondContact N-O 2.81Å; E576-R627 PolarHBondContact O-N 2.79Å; E576-R627 IonicContact OE2-NH1 2.73Å; L578-R627 HydrophobicContact CD2-CB 3.86Å; L578-R627 HydrophobicContact CG-CB 4.45Å; E587-R627 HydrophobicContact CB-CB 4.27Å; E587-R627 HydrophobicContact CB-CG 4.19Å; E587-R627 VanDerWaalsContact CD-NE 3.32Å; E587-R627 HydrophobicContact CG-CG 4.28Å; E587-R627 CarbonylContact O-C 3.52Å; E587-R627 VanDerWaalsContact O-CA 3.3Å; E587-R627 WeakPolarHBondContact O-CA 3.4Å; E587-R627 IonicContact OE1-NE 3.48Å; E587-R627 IonicContact OE1-NH2 3.41Å; E587-R627 IonicContact OE2-CZ 3.68Å; E587-R627 IonicContact OE2-NE 2.97Å; E587-R627 PolarHBondContact OE2-NE 3.44Å; E587-R627 IonicContact OE2-NH2 3.51Å; E587-R627 PolarHBondContact OE2-NH2 3.33Å; R627-V629 HydrophobicContact CG-CG2 3.9Å
628	F	96.7	Very high	92.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	109.3	172	-167.2	-81.1	0	0	0	109.2	F554 L575 E587 F588 S589 V605 F609 L630 A652	F554-F628 HydrophobicContact CE1-CD2 4.09Å; F554-F628 AromaticContact CE1-CE2 3.74Å; F554-F628 HydrophobicContact CE1-CE2 3.74Å; F554-F628 HydrophobicContact CE1-CZ 4.05Å; F554-F628 HydrophobicContact CE2-CE1 4.17Å; F554-F628 AromaticContact CE2-CE2 3.98Å; F554-F628 HydrophobicContact CE2-CE2 3.98Å; F554-F628 AromaticContact CE2-CZ 3.53Å; F554-F628 HydrophobicContact CE2-CZ 3.53Å; F554-F628 HydrophobicContact CZ-CD1 4.21Å; F554-F628 AromaticContact CZ-CD2 3.96Å; F554-F628 HydrophobicContact CZ-CD2 3.96Å; F554-F628 AromaticContact CZ-CE1 3.64Å; F554-F628 HydrophobicContact CZ-CE1 3.64Å; F554-F628 AromaticContact CZ-CE2 3.35Å; F554-F628 HydrophobicContact CZ-CE2 3.35Å; F554-F628 HydrophobicContact CZ-CG 4.37Å; F554-F628 AromaticContact CZ-CZ 3.17Å; F554-F628 HydrophobicContact CZ-CZ 3.17Å; L575-F628 HydrophobicContact CD1-CB 4.38Å; L575-F628 HydrophobicContact CD1-CD2 4.06Å; E587-F628 PolarHBondContact O-N 3.33Å; F588-F628 HydrophobicContact CD2-CB 4.06Å; F588-F628 AromaticContact CD2-CD1 3.73Å; F588-F628 HydrophobicContact CD2-CD1 3.73Å; F588-F628 HydrophobicContact CD2-CG 4.22Å; F588-F628 AromaticContact CE2-CD1 3.46Å; F588-F628 HydrophobicContact CE2-CD1 3.46Å; F588-F628 VanDerWaalsContact CE2-CD1 3.46Å; F588-F628 AromaticContact CE2-CE1 3.94Å; F588-F628 HydrophobicContact CE2-CE1 3.94Å; F588-F628 HydrophobicContact CE2-CG 4.35Å; S589-F628 PolarHBondContact N-O 3.13Å; S589-F628 PolarHBondContact OG-O 3.37Å; V605-F628 HydrophobicContact CG1-CE1 4.01Å; V605-F628 HydrophobicContact CG1-CZ 4.34Å; F609-F628 HydrophobicContact CB-CD2 4.31Å; F609-F628 HydrophobicContact CB-CG 4.45Å; F609-F628 HydrophobicContact CD1-CB 4.01Å; F609-F628 HydrophobicContact CD1-CG 4.5Å; F609-F628 HydrophobicContact CD2-CB 3.86Å; F609-F628 AromaticContact CD2-CD2 3.49Å; F609-F628 HydrophobicContact CD2-CD2 3.49Å; F609-F628 VanDerWaalsContact CD2-CD2 3.49Å; F609-F628 HydrophobicContact CD2-CE2 4.3Å; F609-F628 AromaticContact CD2-CG 3.92Å; F609-F628 HydrophobicContact CD2-CG 3.92Å; F609-F628 HydrophobicContact CE1-CB 3.91Å; F609-F628 HydrophobicContact CE2-CB 3.76Å; F609-F628 AromaticContact CE2-CD2 3.96Å; F609-F628 HydrophobicContact CE2-CD2 3.96Å; F609-F628 HydrophobicContact CE2-CG 4.27Å; F609-F628 HydrophobicContact CG-CB 3.98Å; F609-F628 AromaticContact CG-CD2 3.97Å; F609-F628 HydrophobicContact CG-CD2 3.97Å; F609-F628 HydrophobicContact CG-CG 4.04Å; F609-F628 HydrophobicContact CZ-CB 3.78Å; F628-L630 HydrophobicContact CE1-CB 4.38Å; F628-L630 HydrophobicContact CE1-CD1 4.44Å; F628-A652 HydrophobicContact CE2-CB 4.32Å; F628-A652 HydrophobicContact CZ-CB 4.21Å
629	V	96.9	Very high	92	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.024	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	110.5	178.5	-169.5	0	0	0	0	108.9	G573 V574 E576 S589 E591 R627 Q631	G573-V629 WeakPolarHBondContact CA-O 3.28Å; V574-V629 HydrophobicContact CG1-CB 3.66Å; V574-V629 HydrophobicContact CG1-CG1 4.24Å; V574-V629 HydrophobicContact CG1-CG2 3.8Å; V574-V629 PolarHBondContact N-O 2.99Å; V574-V629 VanDerWaalsContact N-O 3.12Å; V574-V629 WeakPolarHBondContact O-CB 3.27Å; V574-V629 PolarHBondContact O-N 3.47Å; E576-V629 HydrophobicContact CG-CG2 4.45Å; S589-V629 WeakPolarHBondContact O-CA 3.48Å; S589-V629 WeakPolarHBondContact OG-CA 3.27Å; S589-V629 WeakPolarHBondContact OG-CG2 3.47Å; E591-V629 HydrophobicContact CB-CG1 4.39Å; E591-V629 HydrophobicContact CG-CG1 3.74Å; E591-V629 WeakPolarHBondContact OE2-CG1 3.12Å; R627-V629 HydrophobicContact CG-CG2 3.9Å; V629-Q631 HydrophobicContact CG1-CG 4.1Å
630	L	95.9	Very high	92	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	113.6	175.6	-177.3	66.1	0	0	0	109.3	V571 F588 S589 E591 T592 I597 V602 F628	V571-L630 HydrophobicContact CB-CD1 4.03Å; V571-L630 HydrophobicContact CG1-CD1 4.19Å; F588-L630 HydrophobicContact CZ-CB 4.08Å; F588-L630 HydrophobicContact CZ-CD2 4.12Å; S589-L630 PolarHBondContact O-N 3Å; E591-L630 CarbonylContact C-O 3.49Å; E591-L630 WeakPolarHBondContact CA-O 3.35Å; E591-L630 PolarHBondContact N-O 2.87Å; T592-L630 HydrophobicContact CG2-CD2 3.98Å; T592-L630 HydrophobicContact CG2-CG 3.75Å; T592-L630 PolarHBondContact N-O 3.2Å; I597-L630 HydrophobicContact CD1-CD1 3.87Å; I597-L630 HydrophobicContact CD1-CD2 4.02Å; I597-L630 HydrophobicContact CD1-CG 4.2Å; V602-L630 HydrophobicContact CG1-CD2 4.32Å; V602-L630 HydrophobicContact CG2-CD2 4.3Å; F628-L630 HydrophobicContact CE1-CB 4.38Å; F628-L630 HydrophobicContact CE1-CD1 4.44Å
631	Q	94.1	Very high	92.2	Very high	83 Å²	83	45 Å²	45	39%	0.388	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-47.6	-173.9	-68.3	-177.7	-27.6	0	0	113	I572 T592 V629	I572-Q631 PolarHBondContact O-N 3.36Å; T592-Q631 WeakPolarHBondContact CA-O 3.48Å; V629-Q631 HydrophobicContact CG1-CG 4.1Å
632	D	91.8	Very high	92.2	Very high	58 Å²	58	48.2 Å²	48.2	31%	0.31	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	177.7	-179.1	-158.3	-0.6	0	0	0	110.3	I572 N596	I572-D632 WeakPolarHBondContact CA-O 3.36Å; I572-D632 WeakPolarHBondContact CB-O 3.34Å; I572-D632 HydrophobicContact CD1-CB 4.48Å; I572-D632 PolarHBondContact N-O 2.99Å; I572-D632 PolarHBondContact O-N 3.44Å; I572-D632 VanDerWaalsContact O-O 3.11Å; N596-D632 VanDerWaalsContact CB-OD1 3.23Å; N596-D632 WeakPolarHBondContact CB-OD1 3.35Å; N596-D632 PolarHBondContact ND2-OD1 3.27Å; N596-D632 PolarHBondContact ND2-OD2 2.92Å
633	G	92.5	Very high	92.2	Very high	8 Å²	8	48.8 Å²	48.8	8%	0.082	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.7	-160.9	176	0	0	0	0	0	112.8	K570	K570-G633 CarbonylContact O-C 3.59Å; K570-G633 WeakPolarHBondContact O-CA 3.29Å
634	A	92.8	Very high	92.2	Very high	27 Å²	27	48.6 Å²	48.6	22%	0.223	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	144.8	171.6	0	0	0	0	0	110.5	Y568 K570	Y568-A634 HydrophobicContact CE1-CB 4.07Å; Y568-A634 WeakPolarHBondContact CE1-O 3.46Å; K570-A634 HydrophobicContact CB-CB 3.92Å; K570-A634 HydrophobicContact CD-CB 4.06Å; K570-A634 HydrophobicContact CG-CB 4.44Å; K570-A634 PolarHBondContact N-O 3.27Å; K570-A634 PolarHBondContact O-N 3.42Å
635	H	92.4	Very high	92.3	Very high	72 Å²	72	48.5 Å²	48.5	33%	0.333	25%	0.248	S	C	.	.			trans	-121.2	160.7	172.2	74.4	-79.9	0	0	0	110.4	S595 N596 P598 S640 F645	S595-H635 PolarHBondContact O-CE1 3Å; S595-H635 VanDerWaalsContact O-CE1 3.3Å; N596-H635 PolarHBondContact O-N 2.64Å; N596-H635 PolarHBondContact O-ND1 2.66Å; P598-H635 HydrophobicContact CG-CB 4.35Å; H635-S640 WeakPolarHBondContact CA-OG 3.39Å; H635-S640 WeakPolarHBondContact CB-OG 3.39Å; H635-F645 HydrophobicContact CB-CE2 4.35Å; H635-F645 HydrophobicContact CB-CZ 4.03Å
636	H	90.8	Very high	92.4	Very high	88 Å²	88	49.6 Å²	49.6	41%	0.407	25%	0.254	S	S	.	.			trans	-116.2	135.9	171.7	-172.3	-107.4	0	0	0	107.9	Y568 V638 D639 S640	Y568-H636 HydrophobicContact CD1-CB 3.58Å; Y568-H636 HydrophobicContact CE1-CB 4.35Å; Y568-H636 HydrophobicContact CG-CB 3.86Å; H636-V638 PolarHBondContact O-N 2.93Å; H636-V638 VanDerWaalsContact O-N 3.09Å; H636-D639 HydrophobicContact CB-CB 4.21Å; H636-D639 IonicContact CE1-OD2 3.19Å; H636-D639 PolarHBondContact CE1-OD2 3.44Å; H636-D639 IonicContact CG-OD2 3.82Å; H636-D639 PolarHBondContact ND1-N 2.91Å; H636-D639 IonicContact ND1-OD2 2.85Å; H636-D639 PolarHBondContact ND1-OD2 2.9Å; H636-S640 PolarHBondContact N-OG 3.44Å; H636-S640 WeakPolarHBondContact O-CB 3.45Å; H636-S640 PolarHBondContact O-N 3.04Å; H636-S640 PolarHBondContact O-OG 2.85Å
637	M	82.9	Confident	92.4	Very high	177 Å²	177	55.4 Å²	55.4	87%	0.872	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-29	-171.2	-70.1	179.4	63.1	0	0	114.2
638	V	83.8	Confident	92.3	Very high	108 Å²	108	51.9 Å²	51.9	66%	0.655	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-29.8	-174.2	-176.5	0	0	0	0	112.5	H636	H636-V638 PolarHBondContact O-N 2.93Å; H636-V638 VanDerWaalsContact O-N 3.09Å
639	D	87.3	Confident	92.3	Very high	35 Å²	35	51.9 Å²	51.9	19%	0.187	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-3.7	-170.1	-59.9	-42.3	0	0	0	113.3	G566 Q567 Y568 H636	G566-D639 VanDerWaalsContact CA-OD1 3.28Å; G566-D639 WeakPolarHBondContact CA-OD1 3.43Å; G566-D639 PolarHBondContact N-OD1 2.96Å; Q567-D639 CarbonylContact C-O 3.47Å; Q567-D639 VanDerWaalsContact CA-O 3.26Å; Q567-D639 WeakPolarHBondContact CA-O 3.47Å; Y568-D639 PolarHBondContact N-O 3.19Å; H636-D639 HydrophobicContact CB-CB 4.21Å; H636-D639 IonicContact CE1-OD2 3.19Å; H636-D639 PolarHBondContact CE1-OD2 3.44Å; H636-D639 IonicContact CG-OD2 3.82Å; H636-D639 PolarHBondContact ND1-N 2.91Å; H636-D639 IonicContact ND1-OD2 2.85Å; H636-D639 PolarHBondContact ND1-OD2 2.9Å
640	S	89.8	Confident	92.2	Very high	12 Å²	12	53.1 Å²	53.1	8%	0.084	27%	0.268	C	S	.	.			trans	-89.5	118.2	177.9	-71.9	0	0	0	0	112.1	Y568 H635 H636	Y568-S640 WeakPolarHBondContact O-CA 3.26Å; Y568-S640 WeakPolarHBondContact O-CB 3.26Å; Y568-S640 PolarHBondContact O-OG 3.08Å; H635-S640 WeakPolarHBondContact CA-OG 3.39Å; H635-S640 WeakPolarHBondContact CB-OG 3.39Å; H636-S640 PolarHBondContact N-OG 3.44Å; H636-S640 WeakPolarHBondContact O-CB 3.45Å; H636-S640 PolarHBondContact O-N 3.04Å; H636-S640 PolarHBondContact O-OG 2.85Å
641	N	91.1	Very high	92.1	Very high	72 Å²	72	53.6 Å²	53.6	39%	0.385	27%	0.272	S	S	.	.			trans	-130	170.3	-180	-63.9	-40	0	0	0	110.2	I643 S644 F645	N641-I643 VanDerWaalsContact C-N 3.28Å; N641-I643 PolarHBondContact O-N 3.34Å; N641-S644 PolarHBondContact N-OG 2.94Å; N641-S644 PolarHBondContact O-N 2.98Å; N641-S644 VanDerWaalsContact O-N 3.12Å; N641-S644 PolarHBondContact O-OG 2.81Å; N641-F645 PolarHBondContact O-N 2.81Å
642	E	92.3	Very high	92.2	Very high	107 Å²	107	49.6 Å²	49.6	50%	0.5	25%	0.254	S	S	.	.	H	α-helix	trans	-55.1	-44.8	176.3	-165.5	-175.4	160.8	0	0	111.9	A604 S644 F645 I646	A604-E642 HydrophobicContact CB-CB 4.45Å; A604-E642 HydrophobicContact CB-CG 3.47Å; A604-E642 VanDerWaalsContact CB-CG 3.47Å; E642-S644 VanDerWaalsContact C-N 3.31Å; E642-S644 PolarHBondContact O-N 2.91Å; E642-F645 PolarHBondContact O-N 2.9Å; E642-I646 HydrophobicContact CG-CD1 4.22Å; E642-I646 WeakPolarHBondContact O-CG1 3.44Å; E642-I646 PolarHBondContact O-N 3.06Å
643	I	92.4	Very high	92.4	Very high	95 Å²	95	47 Å²	47	49%	0.487	24%	0.24	S	C	.	.	H	α-helix	trans	-62.7	-35.8	179.8	-59.4	168.7	0	0	0	111.9	N641 F645 I646 R647	N641-I643 VanDerWaalsContact C-N 3.28Å; N641-I643 PolarHBondContact O-N 3.34Å; I643-F645 VanDerWaalsContact C-N 3.3Å; I643-F645 PolarHBondContact O-N 2.81Å; I643-I646 PolarHBondContact O-N 3.3Å; I643-R647 HydrophobicContact CG2-CG 4.37Å; I643-R647 VanDerWaalsContact O-CG 3.31Å; I643-R647 WeakPolarHBondContact O-CG 3.47Å; I643-R647 PolarHBondContact O-N 3.4Å
644	S	93.9	Very high	92.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-68.2	-33.8	179.8	54.8	0	0	0	0	111.6	Y568 N641 E642 A648	Y568-S644 PolarHBondContact O-OG 2.82Å; Y568-S644 VanDerWaalsContact O-OG 3.12Å; N641-S644 PolarHBondContact N-OG 2.94Å; N641-S644 PolarHBondContact O-N 2.98Å; N641-S644 VanDerWaalsContact O-N 3.12Å; N641-S644 PolarHBondContact O-OG 2.81Å; E642-S644 VanDerWaalsContact C-N 3.31Å; E642-S644 PolarHBondContact O-N 2.91Å; S644-A648 VanDerWaalsContact O-CB 3.28Å; S644-A648 WeakPolarHBondContact O-CB 3.43Å; S644-A648 PolarHBondContact O-N 3.44Å
645	F	95.1	Very high	92.5	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-78	-34.4	175.8	-82.4	-73.5	0	0	0	113.3	V571 I597 F601 A604 V605 H635 N641 E642 I643 A648 G649	V571-F645 HydrophobicContact CG1-CD1 4.02Å; V571-F645 HydrophobicContact CG1-CE1 4.26Å; I597-F645 HydrophobicContact CD1-CE1 4.4Å; I597-F645 HydrophobicContact CG1-CE1 4.13Å; I597-F645 HydrophobicContact CG2-CD1 4.44Å; I597-F645 HydrophobicContact CG2-CE1 3.89Å; I597-F645 HydrophobicContact CG2-CZ 4.12Å; F601-F645 HydrophobicContact CB-CB 4.28Å; F601-F645 HydrophobicContact CB-CD2 3.58Å; F601-F645 HydrophobicContact CB-CE2 4.06Å; F601-F645 HydrophobicContact CB-CG 3.94Å; F601-F645 AromaticContact CD2-CD2 3.69Å; F601-F645 HydrophobicContact CD2-CD2 3.69Å; F601-F645 AromaticContact CD2-CE2 3.56Å; F601-F645 HydrophobicContact CD2-CE2 3.56Å; F601-F645 HydrophobicContact CE2-CE2 4.29Å; F601-F645 AromaticContact CG-CD2 3.72Å; F601-F645 HydrophobicContact CG-CD2 3.72Å; F601-F645 HydrophobicContact CG-CE2 4.07Å; A604-F645 HydrophobicContact CB-CB 4.25Å; V605-F645 HydrophobicContact CG2-CB 3.79Å; V605-F645 HydrophobicContact CG2-CD1 3.7Å; V605-F645 HydrophobicContact CG2-CG 4.14Å; H635-F645 HydrophobicContact CB-CE2 4.35Å; H635-F645 HydrophobicContact CB-CZ 4.03Å; N641-F645 PolarHBondContact O-N 2.81Å; E642-F645 PolarHBondContact O-N 2.9Å; I643-F645 VanDerWaalsContact C-N 3.3Å; I643-F645 PolarHBondContact O-N 2.81Å; F645-A648 PolarHBondContact O-N 3.3Å; F645-G649 PolarHBondContact O-N 3.06Å
646	I	95.8	Very high	92.6	Very high	23 Å²	23	51.3 Å²	51.3	12%	0.118	25%	0.252	C	S	.	.	H	α-helix	trans	-57	-50.9	168.3	-68.3	165.7	0	0	0	109.9	A604 E642 I643 A648 G649 E650	A604-I646 HydrophobicContact CB-CG1 4.04Å; A604-I646 WeakPolarHBondContact O-CA 3.32Å; A604-I646 WeakPolarHBondContact O-CG1 3.34Å; E642-I646 HydrophobicContact CG-CD1 4.22Å; E642-I646 WeakPolarHBondContact O-CG1 3.44Å; E642-I646 PolarHBondContact O-N 3.06Å; I643-I646 PolarHBondContact O-N 3.3Å; I646-A648 VanDerWaalsContact C-N 3.33Å; I646-A648 PolarHBondContact O-N 2.82Å; I646-G649 PolarHBondContact O-N 2.87Å; I646-E650 WeakPolarHBondContact O-CG 3.31Å; I646-E650 PolarHBondContact O-N 3.02Å
647	R	95.6	Very high	92.7	Very high	121 Å²	121	47.9 Å²	47.9	46%	0.457	24%	0.236	S	C	.	.	H	α-helix	trans	-66.7	-33.3	178.9	-66.2	-58.4	-175.9	179.8	-4.2	113.2	I643 E650 G651	I643-R647 HydrophobicContact CG2-CG 4.37Å; I643-R647 VanDerWaalsContact O-CG 3.31Å; I643-R647 WeakPolarHBondContact O-CG 3.47Å; I643-R647 PolarHBondContact O-N 3.4Å; R647-E650 WeakPolarHBondContact CD-OE2 3.35Å; R647-E650 IonicContact CZ-OE1 3.74Å; R647-E650 IonicContact CZ-OE2 3.74Å; R647-E650 IonicContact NE-OE2 3.99Å; R647-E650 IonicContact NH1-OE1 2.79Å; R647-E650 PolarHBondContact NH1-OE1 2.96Å; R647-E650 IonicContact NH1-OE2 3.28Å; R647-E650 PolarHBondContact NH1-OE2 2.67Å; R647-G651 PolarHBondContact O-N 3.34Å
648	A	95.4	Very high	93.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.3	-43.4	174.1	0	0	0	0	0	111	F556 H558 V571 S644 F645 I646 G651 A652	F556-A648 WeakPolarHBondContact CD1-O 3.49Å; H558-A648 HydrophobicContact CB-CB 4.22Å; V571-A648 HydrophobicContact CG1-CB 3.96Å; V571-A648 HydrophobicContact CG2-CB 4.01Å; V571-A648 WeakPolarHBondContact CG2-O 3.45Å; S644-A648 VanDerWaalsContact O-CB 3.28Å; S644-A648 WeakPolarHBondContact O-CB 3.43Å; S644-A648 PolarHBondContact O-N 3.44Å; F645-A648 PolarHBondContact O-N 3.3Å; I646-A648 VanDerWaalsContact C-N 3.33Å; I646-A648 PolarHBondContact O-N 2.82Å; A648-G651 PolarHBondContact O-N 3.11Å; A648-A652 VanDerWaalsContact O-CB 3.24Å; A648-A652 WeakPolarHBondContact O-CB 3.34Å; A648-A652 PolarHBondContact O-N 3.22Å
649	G	95	Very high	93.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.8	-48	173.2	0	0	0	0	0	113	F645 I646 G651 A652 L653	F645-G649 PolarHBondContact O-N 3.06Å; I646-G649 PolarHBondContact O-N 2.87Å; G649-G651 VanDerWaalsContact C-N 3.32Å; G649-G651 PolarHBondContact O-N 3.42Å; G649-A652 PolarHBondContact O-N 3.08Å; G649-L653 PolarHBondContact O-N 2.97Å
650	E	95.3	Very high	93.8	Very high	30 Å²	30	42.5 Å²	42.5	14%	0.14	22%	0.22	C	C	.	.	H	α-helix	trans	-57.7	-43.3	175.1	-71.6	176.2	-161.5	0	0	112.2	A612 I646 R647 K654	A612-E650 HydrophobicContact CB-CB 4.45Å; A612-E650 HydrophobicContact CB-CG 4.23Å; I646-E650 WeakPolarHBondContact O-CG 3.31Å; I646-E650 PolarHBondContact O-N 3.02Å; R647-E650 WeakPolarHBondContact CD-OE2 3.35Å; R647-E650 IonicContact CZ-OE1 3.74Å; R647-E650 IonicContact CZ-OE2 3.74Å; R647-E650 IonicContact NE-OE2 3.99Å; R647-E650 IonicContact NH1-OE1 2.79Å; R647-E650 PolarHBondContact NH1-OE1 2.96Å; R647-E650 IonicContact NH1-OE2 3.28Å; R647-E650 PolarHBondContact NH1-OE2 2.67Å; E650-K654 WeakPolarHBondContact O-CG 3.41Å; E650-K654 PolarHBondContact O-N 3.27Å; E650-K654 VanDerWaalsContact O-N 3.1Å
651	G	94.7	Very high	93.9	Very high	9 Å²	9	46.8 Å²	46.8	9%	0.093	25%	0.246	C	C	.	.	H	α-helix	trans	-72.3	-38.2	-178.6	0	0	0	0	0	113.1	R647 A648 G649 K654 Q655	R647-G651 PolarHBondContact O-N 3.34Å; A648-G651 PolarHBondContact O-N 3.11Å; G649-G651 VanDerWaalsContact C-N 3.32Å; G649-G651 PolarHBondContact O-N 3.42Å; G651-K654 PolarHBondContact O-N 3.33Å; G651-Q655 WeakPolarHBondContact O-CB 3.49Å; G651-Q655 PolarHBondContact O-N 3.33Å
652	A	95.6	Very high	94	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59	-48	172.6	0	0	0	0	0	111.7	F554 F556 V571 F628 A648 G649 K654 Q655 A656	F554-A652 HydrophobicContact CD2-CB 3.52Å; F554-A652 HydrophobicContact CE2-CB 3.77Å; F554-A652 HydrophobicContact CG-CB 4.15Å; F556-A652 HydrophobicContact CB-CB 3.96Å; V571-A652 HydrophobicContact CG2-CB 3.59Å; F628-A652 HydrophobicContact CE2-CB 4.32Å; F628-A652 HydrophobicContact CZ-CB 4.21Å; A648-A652 VanDerWaalsContact O-CB 3.24Å; A648-A652 WeakPolarHBondContact O-CB 3.34Å; A648-A652 PolarHBondContact O-N 3.22Å; G649-A652 PolarHBondContact O-N 3.08Å; A652-K654 PolarHBondContact O-N 3.09Å; A652-Q655 PolarHBondContact O-N 3.41Å; A652-A656 WeakPolarHBondContact O-CB 3.28Å; A652-A656 PolarHBondContact O-N 3.23Å
653	L	95.4	Very high	94.1	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-61	-45.9	176.2	-173.6	66.5	0	0	0	110.9	L575 F609 A612 L623 G649 Q655 A656 L657	L575-L653 HydrophobicContact CD1-CD1 3.89Å; L575-L653 HydrophobicContact CD2-CD1 3.78Å; F609-L653 HydrophobicContact CD2-CD1 4.08Å; F609-L653 HydrophobicContact CD2-CD2 4.15Å; F609-L653 HydrophobicContact CE2-CD1 4.03Å; F609-L653 HydrophobicContact CE2-CD2 4.5Å; A612-L653 HydrophobicContact CB-CD2 3.53Å; L623-L653 HydrophobicContact CD1-CD2 4.36Å; G649-L653 PolarHBondContact O-N 2.97Å; L653-Q655 VanDerWaalsContact C-N 3.32Å; L653-Q655 PolarHBondContact O-N 3.34Å; L653-A656 PolarHBondContact O-N 3.49Å; L653-L657 HydrophobicContact CD1-CD1 4.37Å; L653-L657 HydrophobicContact CD1-CG 4.28Å; L653-L657 HydrophobicContact CD2-CD1 4.3Å; L653-L657 HydrophobicContact CG-CD1 3.83Å; L653-L657 HydrophobicContact CG-CG 4.18Å; L653-L657 WeakPolarHBondContact O-CB 3.3Å; L653-L657 WeakPolarHBondContact O-CG 3.47Å; L653-L657 PolarHBondContact O-N 2.83Å
654	K	93.7	Very high	94.2	Very high	132 Å²	132	35.8 Å²	35.8	57%	0.574	19%	0.193	S	C	*	.	H	α-helix	trans	-60.1	-40	177.7	-75.5	171	-175.5	167.9	0	113.1	E650 G651 A652 A658	E650-K654 WeakPolarHBondContact O-CG 3.41Å; E650-K654 PolarHBondContact O-N 3.27Å; E650-K654 VanDerWaalsContact O-N 3.1Å; G651-K654 PolarHBondContact O-N 3.33Å; A652-K654 PolarHBondContact O-N 3.09Å; K654-A658 WeakPolarHBondContact O-CB 3.09Å; K654-A658 PolarHBondContact O-N 2.94Å
655	Q	93.8	Very high	94.2	Very high	67 Å²	67	35.8 Å²	35.8	31%	0.313	19%	0.193	S	C	.	.	H	α-helix	trans	-66.6	-42.8	176.4	-179	177	-14	0	0	111.4	E555 G651 A652 L653 A658 N659	E555-Q655 PolarHBondContact O-NE2 3.14Å; E555-Q655 VanDerWaalsContact O-NE2 3.15Å; E555-Q655 PolarHBondContact O-OE1 3.22Å; G651-Q655 WeakPolarHBondContact O-CB 3.49Å; G651-Q655 PolarHBondContact O-N 3.33Å; A652-Q655 PolarHBondContact O-N 3.41Å; L653-Q655 VanDerWaalsContact C-N 3.32Å; L653-Q655 PolarHBondContact O-N 3.34Å; Q655-A658 PolarHBondContact O-N 2.89Å; Q655-N659 PolarHBondContact O-N 2.77Å; Q655-N659 PolarHBondContact O-ND2 2.89Å
656	A	94.3	Very high	94.2	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.9	-49.2	174.8	0	0	0	0	0	111	F554 L575 A652 L653 A658 N659 A660	F554-A656 HydrophobicContact CB-CB 4.26Å; F554-A656 HydrophobicContact CD1-CB 4.02Å; L575-A656 HydrophobicContact CB-CB 4.05Å; L575-A656 HydrophobicContact CD2-CB 3.78Å; A652-A656 WeakPolarHBondContact O-CB 3.28Å; A652-A656 PolarHBondContact O-N 3.23Å; L653-A656 PolarHBondContact O-N 3.49Å; A656-A658 VanDerWaalsContact C-N 3.31Å; A656-A658 PolarHBondContact O-N 3Å; A656-N659 CarbonylContact O-C 3.55Å; A656-N659 PolarHBondContact O-N 2.91Å; A656-A660 WeakPolarHBondContact O-CB 3.38Å; A656-A660 PolarHBondContact O-N 2.84Å
657	L	93.6	Very high	94	Very high	15 Å²	15	35 Å²	35	8%	0.079	19%	0.189	C	C	.	.	H	α-helix	trans	-63.3	-32	179.3	-66	171.2	0	0	0	113.3	I548 P617 L623 L653 N659 L662	I548-L657 HydrophobicContact CG2-CD2 4.28Å; P617-L657 HydrophobicContact CG-CB 4.31Å; P617-L657 HydrophobicContact CG-CD1 4.19Å; L623-L657 HydrophobicContact CD1-CD1 3.58Å; L623-L657 HydrophobicContact CD1-CD2 4.17Å; L623-L657 HydrophobicContact CD2-CD2 3.97Å; L653-L657 HydrophobicContact CD1-CD1 4.37Å; L653-L657 HydrophobicContact CD1-CG 4.28Å; L653-L657 HydrophobicContact CD2-CD1 4.3Å; L653-L657 HydrophobicContact CG-CD1 3.83Å; L653-L657 HydrophobicContact CG-CG 4.18Å; L653-L657 WeakPolarHBondContact O-CB 3.3Å; L653-L657 WeakPolarHBondContact O-CG 3.47Å; L653-L657 PolarHBondContact O-N 2.83Å; L657-N659 VanDerWaalsContact C-N 3.33Å; L657-L662 HydrophobicContact CD2-CD2 3.54Å
658	A	92.1	Very high	94	Very high	81 Å²	81	29.4 Å²	29.4	67%	0.669	17%	0.168	S	C	*	.	H	α-helix	trans	-70.4	-30.5	177.1	0	0	0	0	0	112.9	K654 Q655 A656	K654-A658 WeakPolarHBondContact O-CB 3.09Å; K654-A658 PolarHBondContact O-N 2.94Å; Q655-A658 PolarHBondContact O-N 2.89Å; A656-A658 VanDerWaalsContact C-N 3.31Å; A656-A658 PolarHBondContact O-N 3Å
659	N	92.2	Very high	94	Very high	113 Å²	113	30.2 Å²	30.2	60%	0.604	17%	0.172	S	C	*	.	H	α-helix	trans	-97.6	-14.1	179.8	-63.7	-21.3	0	0	0	112.7	V552 Q655 A656 L657	V552-N659 HydrophobicContact CG1-CB 4.14Å; Q655-N659 PolarHBondContact O-N 2.77Å; Q655-N659 PolarHBondContact O-ND2 2.89Å; A656-N659 CarbonylContact O-C 3.55Å; A656-N659 PolarHBondContact O-N 2.91Å; L657-N659 VanDerWaalsContact C-N 3.33Å
660	A	92.7	Very high	94	Very high	14 Å²	14	31.5 Å²	31.5	12%	0.116	18%	0.183	C	C	.	.	S	Bend	trans	-82	148.2	178.1	0	0	0	0	0	111.8	I548 V552 A656 L662	I548-A660 HydrophobicContact CB-CB 4.19Å; I548-A660 HydrophobicContact CG2-CB 3.62Å; V552-A660 HydrophobicContact CG2-CB 3.82Å; A656-A660 WeakPolarHBondContact O-CB 3.38Å; A656-A660 PolarHBondContact O-N 2.84Å; A660-L662 PolarHBondContact O-N 2.9Å
661	T	91.1	Very high	94	Very high	101 Å²	101	30.3 Å²	30.3	62%	0.62	18%	0.177	S	C	*	.			trans	-82.8	109	165.6	-55.8	0	0	0	0	108.3	T549	T549-T661 PolarHBondContact N-O 2.96Å; T549-T661 VanDerWaalsContact N-O 3.15Å; T549-T661 PolarHBondContact OG1-O 3.48Å
662	L	93.5	Very high	93.9	Very high	28 Å²	28	33.8 Å²	33.8	15%	0.147	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	139.4	-179.8	-62.5	170.7	0	0	0	111.1	T547 I548 P617 L618 L657 A660	T547-L662 WeakPolarHBondContact O-CA 3.45Å; I548-L662 HydrophobicContact CG2-CD2 3.73Å; P617-L662 HydrophobicContact CG-CD1 3.56Å; L618-L662 HydrophobicContact CB-CD1 4.33Å; L618-L662 HydrophobicContact CD2-CB 4.03Å; L657-L662 HydrophobicContact CD2-CD2 3.54Å; A660-L662 PolarHBondContact O-N 2.9Å
663	C	94.2	Very high	93.9	Very high	16 Å²	16	33.8 Å²	33.8	11%	0.108	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	155	170.1	65.7	0	0	0	0	110.9	E546 T547 T549	E546-C663 WeakPolarHBondContact CA-O 3.49Å; T547-C663 WeakPolarHBondContact CG2-SG 3.42Å; T547-C663 PolarHBondContact N-O 3.44Å; T547-C663 PolarHBondContact O-N 3.5Å; T549-C663 HydrophobicContact CG2-CB 4.16Å
664	I	95.1	Very high	93.7	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	134.5	175.9	-59.1	-177.4	0	0	0	107.9	F544 R545 E546 L618 C742 Q747 I750 I751	F544-I664 HydrophobicContact CB-CG2 3.9Å; F544-I664 HydrophobicContact CD1-CG2 3.93Å; F544-I664 HydrophobicContact CG-CG2 4.18Å; R545-I664 CarbonylContact O-C 3.57Å; R545-I664 WeakPolarHBondContact O-CA 3.12Å; E546-I664 HydrophobicContact CG-CG1 4.49Å; L618-I664 HydrophobicContact CD2-CD1 4.16Å; L618-I664 HydrophobicContact CD2-CG1 3.76Å; I664-C742 WeakPolarHBondContact O-CB 3.17Å; I664-C742 PolarHBondContact O-N 3.47Å; I664-Q747 HydrophobicContact CB-CG 4.25Å; I664-Q747 HydrophobicContact CD1-CG 3.94Å; I664-Q747 HydrophobicContact CG1-CG 3.99Å; I664-I750 HydrophobicContact CD1-CB 4.16Å; I664-I750 HydrophobicContact CD1-CG2 3.88Å; I664-I750 HydrophobicContact CG2-CD1 4.32Å; I664-I751 HydrophobicContact CD1-CG1 4.08Å
665	L	94.4	Very high	93.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	139.9	172.7	-50.2	177.1	0	0	0	110.1	F544 R545 T547 Y583 Y739 Q740 P741	F544-L665 WeakPolarHBondContact CA-O 3.37Å; R545-L665 HydrophobicContact CB-CB 4.15Å; R545-L665 HydrophobicContact CB-CD1 4.32Å; R545-L665 PolarHBondContact N-O 3.37Å; R545-L665 PolarHBondContact O-N 3.15Å; T547-L665 HydrophobicContact CG2-CD1 3.85Å; T547-L665 HydrophobicContact CG2-CD2 3.76Å; T547-L665 HydrophobicContact CG2-CG 3.86Å; Y583-L665 HydrophobicContact CD1-CD1 4.16Å; Y583-L665 HydrophobicContact CD2-CD1 3.79Å; Y583-L665 HydrophobicContact CD2-CD2 4.22Å; Y583-L665 HydrophobicContact CE2-CD1 4.37Å; Y583-L665 HydrophobicContact CE2-CD2 4.04Å; Y583-L665 HydrophobicContact CG-CD1 3.67Å; L665-Y739 HydrophobicContact CB-CD1 3.86Å; L665-Y739 HydrophobicContact CB-CG 4.39Å; L665-Q740 CarbonylContact C-O 3.59Å; L665-Q740 WeakPolarHBondContact CA-O 3.44Å; L665-P741 HydrophobicContact CD2-CB 4.38Å; L665-P741 HydrophobicContact CD2-CG 4.1Å
666	E	93.9	Very high	93.3	Very high	3 Å²	3	27.1 Å²	27.1	1%	0.014	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	147.3	173.8	69.2	-173.3	169.2	0	0	111.2	F544 Y739 Q740 C742	F544-E666 HydrophobicContact CD1-CB 4Å; F544-E666 HydrophobicContact CE1-CB 3.82Å; E666-Y739 WeakPolarHBondContact O-CA 3.41Å; E666-Y739 WeakPolarHBondContact O-CD1 3.48Å; E666-Q740 HydrophobicContact CG-CG 4.01Å; E666-Q740 PolarHBondContact N-O 3.41Å; E666-Q740 PolarHBondContact O-N 3.38Å; E666-Q740 PolarHBondContact OE1-NE2 3.05Å; E666-C742 HydrophobicContact CB-CB 4.25Å; E666-C742 HydrophobicContact CG-CB 4.24Å; E666-C742 PolarHBondContact OE2-SG 2.74Å
667	P	93.4	Very high	93.1	Very high	4 Å²	4	30.8 Å²	30.8	3%	0.026	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	136.1	176.6	29.5	-29.9	0	0	0	111.2	V542 L712 Y736 Y739	V542-P667 VanDerWaalsContact CG1-CD 3.48Å; V542-P667 HydrophobicContact CG1-CG 3.45Å; V542-P667 VanDerWaalsContact CG1-CG 3.45Å; P667-L712 HydrophobicContact CG-CB 4Å; P667-L712 HydrophobicContact CG-CD2 4.07Å; P667-L712 PolarHBondContact O-N 3.49Å; P667-Y736 HydrophobicContact CB-CD2 4.12Å; P667-Y736 HydrophobicContact CB-CE2 3.96Å; P667-Y739 HydrophobicContact CB-CD1 4.28Å; P667-Y739 HydrophobicContact CB-CE1 3.85Å; P667-Y739 HydrophobicContact CG-CE1 4.17Å
668	I	94.5	Very high	93	Very high	2 Å²	2	36 Å²	36	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	134.3	176.9	-61.3	-65.8	0	0	0	109.7	D709 P711 C737 R738 Q740	I668-D709 HydrophobicContact CG2-CB 3.77Å; I668-P711 HydrophobicContact CD1-CB 4.13Å; I668-P711 HydrophobicContact CD1-CG 3.83Å; I668-C737 WeakPolarHBondContact O-CB 3.43Å; I668-C737 PolarHBondContact O-N 2.99Å; I668-R738 HydrophobicContact CB-CG 4.29Å; I668-R738 PolarHBondContact N-O 3.2Å; I668-Q740 HydrophobicContact CD1-CG 3.65Å; I668-Q740 HydrophobicContact CG1-CB 4.11Å; I668-Q740 VanDerWaalsContact CG1-CD 3.44Å; I668-Q740 HydrophobicContact CG1-CG 3.52Å
669	M	94.6	Very high	93.1	Very high	17 Å²	17	33 Å²	33	8%	0.084	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	130	177	-53.2	-56.8	-68	0	0	109	V671 D709 V710 L712 M734 E735	M669-V671 HydrophobicContact CB-CG2 4.13Å; M669-V671 PolarHBondContact O-N 2.95Å; M669-D709 WeakPolarHBondContact O-CA 3.39Å; M669-V710 WeakPolarHBondContact CB-O 3.46Å; M669-V710 PolarHBondContact N-O 3.41Å; M669-V710 PolarHBondContact O-N 3.11Å; M669-L712 HydrophobicContact CE-CD1 4.38Å; M669-L712 HydrophobicContact CG-CB 3.78Å; M669-L712 HydrophobicContact CG-CD1 3.84Å; M669-L712 HydrophobicContact CG-CG 4.34Å; M669-L712 HydrophobicContact SD-CB 4.03Å; M669-L712 HydrophobicContact SD-CD1 3.92Å; M669-L712 HydrophobicContact SD-CD2 4.24Å; M669-L712 HydrophobicContact SD-CG 4.27Å; M669-M734 HydrophobicContact CB-CB 4.22Å; M669-M734 HydrophobicContact CB-SD 4.37Å; M669-M734 HydrophobicContact CE-CB 4.26Å; M669-M734 HydrophobicContact CE-CE 4.46Å; M669-M734 HydrophobicContact CE-CG 3.86Å; M669-M734 HydrophobicContact CE-SD 4.08Å; M669-M734 HydrophobicContact CG-SD 4.19Å; M669-E735 CarbonylContact C-O 3.49Å; M669-E735 VanDerWaalsContact CA-O 3.23Å; M669-E735 WeakPolarHBondContact CA-O 3.32Å; M669-E735 VanDerWaalsContact CE-C 3.43Å
670	A	95.4	Very high	93.2	Very high	28 Å²	28	30.3 Å²	30.3	23%	0.231	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	117.6	162.5	0	0	0	0	0	107.1	M734 E735 C737	A670-M734 CarbonylContact O-C 3.54Å; A670-M734 WeakPolarHBondContact O-CA 3.49Å; A670-E735 HydrophobicContact CB-CG 4.1Å; A670-E735 PolarHBondContact N-O 3.31Å; A670-E735 PolarHBondContact O-N 2.77Å; A670-C737 HydrophobicContact CB-CB 4.04Å
671	V	94.9	Very high	93.3	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.024	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.6	-174.9	-171.9	0	0	0	0	108.9	M669 I673 H707 A708 V710 M715 Y732 T733 M734	M669-V671 HydrophobicContact CB-CG2 4.13Å; M669-V671 PolarHBondContact O-N 2.95Å; V671-I673 HydrophobicContact CG1-CD1 4.08Å; V671-I673 HydrophobicContact CG1-CG1 3.87Å; V671-H707 WeakPolarHBondContact O-CA 3.46Å; V671-A708 WeakPolarHBondContact CA-O 3.39Å; V671-A708 WeakPolarHBondContact CB-O 3.39Å; V671-A708 PolarHBondContact N-O 2.59Å; V671-A708 PolarHBondContact O-N 3.25Å; V671-V710 HydrophobicContact CB-CG2 4.26Å; V671-V710 HydrophobicContact CG2-CB 3.92Å; V671-V710 HydrophobicContact CG2-CG2 3.65Å; V671-M715 HydrophobicContact CG1-CE 4.01Å; V671-M715 HydrophobicContact CG2-CE 3.81Å; V671-M715 HydrophobicContact CG2-SD 4.14Å; V671-Y732 HydrophobicContact CG1-CD2 3.97Å; V671-T733 WeakPolarHBondContact CA-O 3.46Å; V671-M734 HydrophobicContact CG2-CB 4.08Å
672	E	94.1	Very high	93.5	Very high	82 Å²	82	32.2 Å²	32.2	38%	0.383	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	120.2	172.3	-176.3	179.1	-179.3	0	0	108.8	T705 L706 H707 Y732 T733	E672-T705 HydrophobicContact CG-CG2 3.55Å; E672-T705 VanDerWaalsContact OE1-CG2 3.25Å; E672-T705 WeakPolarHBondContact OE1-CG2 3.41Å; E672-L706 WeakPolarHBondContact CA-O 3.3Å; E672-H707 IonicContact OE1-CE1 3.58Å; E672-Y732 CarbonylContact O-C 3.56Å; E672-Y732 WeakPolarHBondContact O-CA 3.36Å; E672-T733 PolarHBondContact N-O 2.99Å; E672-T733 PolarHBondContact O-N 2.87Å
673	I	94	Very high	93.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126	-178	-61.2	153.9	0	0	0	109.7	V671 V683 I687 T705 L706 Y718 L722 E731	V671-I673 HydrophobicContact CG1-CD1 4.08Å; V671-I673 HydrophobicContact CG1-CG1 3.87Å; I673-V683 HydrophobicContact CD1-CG1 4.03Å; I673-V683 HydrophobicContact CG2-CG1 3.84Å; I673-I687 HydrophobicContact CD1-CD1 3.66Å; I673-I687 HydrophobicContact CD1-CG1 3.75Å; I673-T705 CarbonylContact O-C 3.54Å; I673-T705 VanDerWaalsContact O-CA 3.26Å; I673-T705 WeakPolarHBondContact O-CA 3.45Å; I673-L706 HydrophobicContact CB-CB 4.4Å; I673-L706 HydrophobicContact CD1-CD2 4.39Å; I673-L706 PolarHBondContact N-O 2.97Å; I673-L706 PolarHBondContact O-N 3.44Å; I673-Y718 HydrophobicContact CD1-CE1 3.99Å; I673-Y718 WeakPolarHBondContact CD1-OH 3.13Å; I673-Y718 HydrophobicContact CG1-CE1 4.26Å; I673-L722 HydrophobicContact CG2-CD1 3.99Å; I673-L722 HydrophobicContact CG2-CD2 4.11Å; I673-E731 WeakPolarHBondContact CA-O 3.31Å
674	V	91.4	Very high	93.8	Very high	52 Å²	52	32.4 Å²	32.4	32%	0.315	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	126.1	174.4	-179	0	0	0	0	109	Y703 F704 T705 G730 E731	V674-Y703 HydrophobicContact CG1-CD1 3.94Å; V674-F704 WeakPolarHBondContact CA-O 3.42Å; V674-T705 HydrophobicContact CG2-CG2 4.13Å; V674-G730 WeakPolarHBondContact O-CA 3.1Å; V674-E731 PolarHBondContact N-O 2.92Å; V674-E731 PolarHBondContact O-N 3.4Å
675	G	90.3	Very high	93.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	168.7	178.8	0	0	0	0	0	113.4	Y703 F704	G675-Y703 VanDerWaalsContact C-CD1 3.45Å; G675-Y703 CarbonylContact O-C 3.55Å; G675-Y703 WeakPolarHBondContact O-CA 3.41Å; G675-Y703 WeakPolarHBondContact O-CD1 3.25Å; G675-F704 PolarHBondContact N-O 2.92Å; G675-F704 WeakPolarHBondContact O-CD1 3.37Å; G675-F704 WeakPolarHBondContact O-CE1 3.49Å; G675-F704 PolarHBondContact O-N 3.21Å
676	P	89.7	Confident	93.9	Very high	10 Å²	10	35 Å²	35	7%	0.065	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	146.7	178.9	-9.9	23.3	0	0	0	112.7	E678 F679 D702 Y703 F704 K729	P676-E678 HydrophobicContact CB-CG 4.21Å; P676-E678 PolarHBondContact O-N 3.47Å; P676-F679 HydrophobicContact CB-CD2 4.34Å; P676-F679 HydrophobicContact CG-CD2 4.07Å; P676-F679 HydrophobicContact CG-CE2 4.36Å; P676-F679 PolarHBondContact O-N 3.14Å; P676-D702 WeakPolarHBondContact CA-O 3.41Å; P676-Y703 HydrophobicContact CG-CE1 4.14Å; P676-F704 VanDerWaalsContact O-CE1 3.28Å; P676-F704 WeakPolarHBondContact O-CE1 3.34Å; P676-K729 HydrophobicContact CG-CB 3.67Å; P676-K729 HydrophobicContact CG-CD 3.53Å; P676-K729 HydrophobicContact CG-CG 4.28Å
677	N	90.6	Very high	94	Very high	76 Å²	76	34.8 Å²	34.8	41%	0.406	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-55.7	-29.9	-176.9	-67.4	-26.5	0	0	0	114.2	F679 Q680 D702 F704	N677-F679 PolarHBondContact O-N 3.21Å; N677-Q680 WeakPolarHBondContact O-CB 3.4Å; N677-Q680 PolarHBondContact O-N 2.58Å; N677-D702 PolarHBondContact N-O 2.84Å; N677-D702 VanDerWaalsContact N-O 3.1Å; N677-F704 PolarHBondContact OD1-N 3.39Å
678	E	91.6	Very high	94.1	Very high	124 Å²	124	38.9 Å²	38.9	58%	0.579	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-61.9	-25.6	179.6	71.8	-166.1	157.5	0	0	113.6	P676 K729	P676-E678 HydrophobicContact CB-CG 4.21Å; P676-E678 PolarHBondContact O-N 3.47Å; E678-K729 IonicContact OE1-NZ 2.89Å; E678-K729 PolarHBondContact OE1-NZ 3.38Å
679	F	94.1	Very high	94.1	Very high	18 Å²	18	46.9 Å²	46.9	8%	0.079	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-106.6	5.2	-177.7	-55.4	-61.4	0	0	0	113.9	P676 N677 G681 Q682 V683 C725 T726 E727 K729	P676-F679 HydrophobicContact CB-CD2 4.34Å; P676-F679 HydrophobicContact CG-CD2 4.07Å; P676-F679 HydrophobicContact CG-CE2 4.36Å; P676-F679 PolarHBondContact O-N 3.14Å; N677-F679 PolarHBondContact O-N 3.21Å; F679-G681 VanDerWaalsContact C-N 3.3Å; F679-G681 PolarHBondContact O-N 3.43Å; F679-Q682 PolarHBondContact O-N 2.94Å; F679-V683 PolarHBondContact O-N 3.27Å; F679-V683 VanDerWaalsContact O-N 3.08Å; F679-C725 VanDerWaalsContact CD1-O 3.29Å; F679-C725 WeakPolarHBondContact CD1-O 3.35Å; F679-T726 HydrophobicContact CB-CG2 4Å; F679-T726 HydrophobicContact CD2-CG2 4.5Å; F679-T726 WeakPolarHBondContact CE2-O 3.42Å; F679-T726 HydrophobicContact CG-CG2 4.46Å; F679-E727 HydrophobicContact CE1-CG 4.1Å; F679-E727 HydrophobicContact CE2-CB 4.33Å; F679-E727 HydrophobicContact CE2-CG 4.26Å; F679-E727 HydrophobicContact CZ-CB 4.1Å; F679-E727 HydrophobicContact CZ-CG 3.55Å; F679-K729 HydrophobicContact CE2-CD 4.25Å
680	Q	93.9	Very high	94.1	Very high	57 Å²	57	48.1 Å²	48.1	27%	0.266	26%	0.256	S	S	.	.	H	α-helix	trans	-52.8	-45.8	-175.3	-172.2	-176.6	20.4	0	0	112.6	N677 Q682 V683 I684 F704	N677-Q680 WeakPolarHBondContact O-CB 3.4Å; N677-Q680 PolarHBondContact O-N 2.58Å; Q680-Q682 VanDerWaalsContact C-N 3.3Å; Q680-Q682 PolarHBondContact O-N 3.36Å; Q680-V683 PolarHBondContact O-N 2.88Å; Q680-I684 HydrophobicContact CG-CD1 4Å; Q680-I684 WeakPolarHBondContact O-CG1 3.33Å; Q680-I684 PolarHBondContact O-N 2.75Å; Q680-F704 HydrophobicContact CB-CD1 4.01Å; Q680-F704 HydrophobicContact CB-CE1 3.74Å; Q680-F704 HydrophobicContact CB-CZ 4.07Å; Q680-F704 HydrophobicContact CG-CD1 4.18Å; Q680-F704 HydrophobicContact CG-CD2 4.21Å; Q680-F704 HydrophobicContact CG-CE1 4.12Å; Q680-F704 HydrophobicContact CG-CE2 4.15Å; Q680-F704 HydrophobicContact CG-CG 4.23Å; Q680-F704 HydrophobicContact CG-CZ 4.11Å
681	G	95.1	Very high	94.1	Very high	56 Å²	56	52 Å²	52	58%	0.577	27%	0.27	S	S	*	.	H	α-helix	trans	-62.3	-34.3	178.6	0	0	0	0	0	113.7	F679 A685	F679-G681 VanDerWaalsContact C-N 3.3Å; F679-G681 PolarHBondContact O-N 3.43Å; G681-A685 WeakPolarHBondContact O-CB 3.33Å; G681-A685 PolarHBondContact O-N 2.89Å; G681-A685 VanDerWaalsContact O-N 3.09Å
682	Q	95.8	Very high	94	Very high	99 Å²	99	52.2 Å²	52.2	46%	0.463	27%	0.272	S	S	.	.	H	α-helix	trans	-74	-37.7	178.4	-59.1	-174	11.6	0	0	111.7	F679 Q680 A685 G686 C725	F679-Q682 PolarHBondContact O-N 2.94Å; Q680-Q682 VanDerWaalsContact C-N 3.3Å; Q680-Q682 PolarHBondContact O-N 3.36Å; Q682-A685 PolarHBondContact O-N 3Å; Q682-G686 PolarHBondContact O-N 2.91Å; Q682-C725 HydrophobicContact CB-CB 4.18Å; Q682-C725 PolarHBondContact OE1-O 2.77Å
683	V	96.1	Very high	94.2	Very high	1 Å²	1	53 Å²	53	1%	0.006	28%	0.282	C	S	.	.	H	α-helix	trans	-64.8	-46.7	176	175	0	0	0	0	110.8	I673 F679 Q680 A685 G686 I687 F704 L706 L722 T726	I673-V683 HydrophobicContact CD1-CG1 4.03Å; I673-V683 HydrophobicContact CG2-CG1 3.84Å; F679-V683 PolarHBondContact O-N 3.27Å; F679-V683 VanDerWaalsContact O-N 3.08Å; Q680-V683 PolarHBondContact O-N 2.88Å; V683-A685 VanDerWaalsContact C-N 3.33Å; V683-A685 PolarHBondContact O-N 2.88Å; V683-G686 PolarHBondContact O-N 3.19Å; V683-G686 VanDerWaalsContact O-N 3.11Å; V683-I687 PolarHBondContact O-N 3.29Å; V683-F704 HydrophobicContact CB-CZ 3.97Å; V683-F704 HydrophobicContact CG1-CE2 4.34Å; V683-F704 HydrophobicContact CG1-CZ 4.17Å; V683-F704 HydrophobicContact CG2-CZ 3.97Å; V683-L706 HydrophobicContact CG1-CD2 3.92Å; V683-L722 HydrophobicContact CG1-CD1 4.32Å; V683-L722 HydrophobicContact CG2-CD1 3.84Å; V683-T726 HydrophobicContact CG2-CG2 3.62Å
684	I	96.1	Very high	94.3	Very high	47 Å²	47	55.9 Å²	55.9	24%	0.241	30%	0.297	C	S	.	.	H	α-helix	trans	-58.9	-44.8	175.8	-69.7	170.3	0	0	0	110.8	Q680 G686 I687 N688 I694 L706	Q680-I684 HydrophobicContact CG-CD1 4Å; Q680-I684 WeakPolarHBondContact O-CG1 3.33Å; Q680-I684 PolarHBondContact O-N 2.75Å; I684-G686 VanDerWaalsContact C-N 3.3Å; I684-G686 PolarHBondContact O-N 3.2Å; I684-I687 PolarHBondContact O-N 3.01Å; I684-N688 WeakPolarHBondContact O-CB 3.34Å; I684-N688 PolarHBondContact O-N 2.97Å; I684-N688 PolarHBondContact O-ND2 3.28Å; I684-I694 HydrophobicContact CB-CD1 4.34Å; I684-I694 HydrophobicContact CG1-CD1 4.08Å; I684-I694 HydrophobicContact CG2-CD1 3.81Å; I684-L706 HydrophobicContact CG1-CD2 4.15Å
685	A	95.9	Very high	94.5	Very high	47 Å²	47	57.7 Å²	57.7	39%	0.388	31%	0.308	S	S	.	.	H	α-helix	trans	-62.2	-37.5	176.4	0	0	0	0	0	112.5	G681 Q682 V683 R689	G681-A685 WeakPolarHBondContact O-CB 3.33Å; G681-A685 PolarHBondContact O-N 2.89Å; G681-A685 VanDerWaalsContact O-N 3.09Å; Q682-A685 PolarHBondContact O-N 3Å; V683-A685 VanDerWaalsContact C-N 3.33Å; V683-A685 PolarHBondContact O-N 2.88Å; A685-R689 WeakPolarHBondContact O-CB 3.48Å; A685-R689 PolarHBondContact O-N 2.82Å; A685-R689 VanDerWaalsContact O-N 3.07Å
686	G	95.5	Very high	94.7	Very high	7 Å²	7	59 Å²	59	7%	0.072	32%	0.322	C	S	.	.	H	α-helix	trans	-65.1	-43	175.4	0	0	0	0	0	113.1	Q682 V683 I684 R689 R690	Q682-G686 PolarHBondContact O-N 2.91Å; V683-G686 PolarHBondContact O-N 3.19Å; V683-G686 VanDerWaalsContact O-N 3.11Å; I684-G686 VanDerWaalsContact C-N 3.3Å; I684-G686 PolarHBondContact O-N 3.2Å; G686-R689 PolarHBondContact O-N 3.12Å; G686-R690 PolarHBondContact O-N 3.41Å
687	I	96.3	Very high	94.9	Very high	0 Å²	0	64 Å²	64	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-64.8	-46.5	176.2	-73	-54.4	0	0	0	111.5	I673 V683 I684 R689 R690 H691 G692 I694 L706 A708 V710 Y718	I673-I687 HydrophobicContact CD1-CD1 3.66Å; I673-I687 HydrophobicContact CD1-CG1 3.75Å; V683-I687 PolarHBondContact O-N 3.29Å; I684-I687 PolarHBondContact O-N 3.01Å; I687-R689 VanDerWaalsContact C-N 3.27Å; I687-R689 PolarHBondContact O-N 3.36Å; I687-R690 CarbonylContact O-C 3.51Å; I687-R690 WeakPolarHBondContact O-CA 3.46Å; I687-R690 PolarHBondContact O-N 2.97Å; I687-H691 PolarHBondContact O-N 3.5Å; I687-G692 PolarHBondContact O-N 2.97Å; I687-I694 HydrophobicContact CG2-CG1 4.03Å; I687-L706 HydrophobicContact CG1-CD2 4.42Å; I687-A708 HydrophobicContact CG2-CB 3.96Å; I687-V710 HydrophobicContact CD1-CG2 4.02Å; I687-V710 HydrophobicContact CG2-CG2 4.5Å; I687-Y718 HydrophobicContact CD1-CE1 4.27Å; I687-Y718 HydrophobicContact CD1-CE2 4.05Å; I687-Y718 WeakPolarHBondContact CD1-OH 3.38Å
688	N	95.5	Very high	95	Very high	90 Å²	90	64.9 Å²	64.9	48%	0.481	35%	0.349	S	S	.	.	H	α-helix	trans	-62	-35.7	178.1	-72.6	-25.6	0	0	0	112.3	I684 R690 H691	I684-N688 WeakPolarHBondContact O-CB 3.34Å; I684-N688 PolarHBondContact O-N 2.97Å; I684-N688 PolarHBondContact O-ND2 3.28Å; N688-R690 PolarHBondContact O-N 3.33Å; N688-H691 PolarHBondContact O-N 2.86Å
689	R	95.1	Very high	94.7	Very high	170 Å²	170	62.1 Å²	62.1	64%	0.642	35%	0.354	S	S	*	.	H	α-helix	trans	-64.3	-29.1	175.1	-174.6	-176.1	-62.6	162	-2.8	112.5	A685 G686 I687 H691 E721	A685-R689 WeakPolarHBondContact O-CB 3.48Å; A685-R689 PolarHBondContact O-N 2.82Å; A685-R689 VanDerWaalsContact O-N 3.07Å; G686-R689 PolarHBondContact O-N 3.12Å; I687-R689 VanDerWaalsContact C-N 3.27Å; I687-R689 PolarHBondContact O-N 3.36Å; R689-H691 VanDerWaalsContact C-N 3.29Å; R689-E721 IonicContact CZ-OE1 3.26Å; R689-E721 IonicContact NH1-OE1 3.74Å; R689-E721 PolarHBondContact NH1-OE1 3.47Å
690	R	94.2	Very high	94.1	Very high	43 Å²	43	66.3 Å²	66.3	16%	0.162	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	24.3	179.6	-67.6	179.9	178.1	-97.1	4.8	112.6	G686 I687 N688 G692 V710 D714 F716 E721	G686-R690 PolarHBondContact O-N 3.41Å; I687-R690 CarbonylContact O-C 3.51Å; I687-R690 WeakPolarHBondContact O-CA 3.46Å; I687-R690 PolarHBondContact O-N 2.97Å; N688-R690 PolarHBondContact O-N 3.33Å; R690-G692 PolarHBondContact O-N 3.19Å; R690-V710 HydrophobicContact CB-CG1 4.26Å; R690-V710 WeakPolarHBondContact O-CG1 3.24Å; R690-D714 HydrophobicContact CB-CB 4.24Å; R690-D714 WeakPolarHBondContact CD-O 3.48Å; R690-D714 PolarHBondContact NH1-O 2.98Å; R690-F716 PolarHBondContact NH1-O 3.13Å; R690-E721 IonicContact CZ-OE2 3.01Å; R690-E721 VanDerWaalsContact CZ-OE2 3.24Å; R690-E721 IonicContact NE-OE2 2.88Å; R690-E721 PolarHBondContact NE-OE2 3.19Å; R690-E721 IonicContact NH2-OE2 3.93Å; R690-E721 PolarHBondContact NH2-OE2 3.1Å
691	H	95	Very high	93.2	Very high	110 Å²	110	72.2 Å²	72.2	51%	0.509	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	24.9	178.2	-54.5	-70.3	0	0	0	113.8	I687 N688 R689 D714	I687-H691 PolarHBondContact O-N 3.5Å; N688-H691 PolarHBondContact O-N 2.86Å; R689-H691 VanDerWaalsContact C-N 3.29Å; H691-D714 IonicContact CD2-OD2 2.91Å; H691-D714 PolarHBondContact CD2-OD2 3.31Å
692	G	94.8	Very high	92.6	Very high	7 Å²	7	75.2 Å²	75.2	7%	0.072	41%	0.411	C	S	.	.			trans	-79.3	146.2	177.3	0	0	0	0	0	112.5	I687 R690 D709	I687-G692 PolarHBondContact O-N 2.97Å; R690-G692 PolarHBondContact O-N 3.19Å; G692-D709 CarbonylContact C-O 3.58Å; G692-D709 VanDerWaalsContact CA-O 3.26Å; G692-D709 WeakPolarHBondContact CA-O 3.36Å
693	V	96.4	Very high	92.3	Very high	99 Å²	99	73.2 Å²	73.2	60%	0.6	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.8	117.4	176.1	-178	0	0	0	0	108.6	T695 A708 D709	V693-T695 PolarHBondContact O-N 2.92Å; V693-A708 CarbonylContact O-C 3.57Å; V693-A708 VanDerWaalsContact O-CA 3.31Å; V693-A708 WeakPolarHBondContact O-CA 3.35Å; V693-D709 PolarHBondContact N-O 3.43Å; V693-D709 PolarHBondContact O-N 3.29Å
694	I	97	Very high	92.1	Very high	60 Å²	60	73.4 Å²	73.4	31%	0.308	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	127.1	179.8	-62.6	167.8	0	0	0	109.1	I684 I687 L706 A708	I684-I694 HydrophobicContact CB-CD1 4.34Å; I684-I694 HydrophobicContact CG1-CD1 4.08Å; I684-I694 HydrophobicContact CG2-CD1 3.81Å; I687-I694 HydrophobicContact CG2-CG1 4.03Å; I694-L706 HydrophobicContact CD1-CD1 4.41Å; I694-L706 HydrophobicContact CG1-CD1 4.46Å; I694-L706 HydrophobicContact CG2-CD1 3.65Å; I694-A708 HydrophobicContact CG1-CB 4.34Å
695	T	95.4	Very high	92	Very high	90 Å²	90	72.1 Å²	72.1	55%	0.552	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	-36.7	179.9	53.9	0	0	0	0	111.8	V693 H707	V693-T695 PolarHBondContact O-N 2.92Å; T695-H707 PolarHBondContact N-O 3.14Å; T695-H707 WeakPolarHBondContact OG1-CB 3.35Å; T695-H707 PolarHBondContact OG1-O 3.47Å; T695-H707 VanDerWaalsContact OG1-O 3.11Å
696	G	94.1	Very high	92	Very high	28 Å²	28	69.9 Å²	69.9	29%	0.289	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	171.9	-178.7	0	0	0	0	0	113.2	H707	G696-H707 PolarHBondContact N-O 2.64Å; G696-H707 PolarHBondContact O-N 2.83Å
697	Q	93.7	Very high	92	Very high	114 Å²	114	72.2 Å²	72.2	53%	0.533	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	139.7	173.2	68	-178.1	5.1	0	0	109.8	T705 L706	Q697-T705 CarbonylContact C-O 3.58Å; Q697-T705 VanDerWaalsContact CA-O 3.31Å; Q697-T705 WeakPolarHBondContact CA-O 3.49Å; Q697-L706 HydrophobicContact CB-CD1 4.06Å
698	D	92.9	Very high	92.1	Very high	96 Å²	96	72.2 Å²	72.2	51%	0.513	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	153.7	173.2	-60.9	-51	0	0	0	109.4	F704 T705 H707	D698-F704 CarbonylContact O-C 3.49Å; D698-F704 WeakPolarHBondContact O-CA 3.25Å; D698-T705 PolarHBondContact N-O 3.11Å; D698-T705 PolarHBondContact O-N 2.92Å; D698-H707 IonicContact OD2-CD2 2.69Å; D698-H707 IonicContact OD2-NE2 3.49Å; D698-H707 PolarHBondContact OD2-NE2 3.11Å
699	G	85.8	Confident	92.1	Very high	65 Å²	65	69.2 Å²	69.2	67%	0.67	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.1	132	-179.3	0	0	0	0	0	111.4
700	V	80.9	Confident	92.2	Very high	107 Å²	107	61.1 Å²	61.1	65%	0.648	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129	123	170.6	179.9	0	0	0	0	106.6	D702 Y703	V700-D702 PolarHBondContact O-N 3.02Å; V700-Y703 CarbonylContact C-O 3.57Å; V700-Y703 PolarHBondContact N-O 3.29Å; V700-Y703 CarbonylContact O-C 3.58Å; V700-Y703 WeakPolarHBondContact O-CA 3.45Å; V700-Y703 PolarHBondContact O-N 3.12Å
701	E	76.4	Confident	92.3	Very high	180 Å²	180	59.2 Å²	59.2	84%	0.841	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-8.9	115	-176.4	-157	172.8	-166.2	0	0	116.1	Y703	E701-Y703 PolarHBondContact O-N 2.99Å; E701-Y703 VanDerWaalsContact O-N 3.08Å
702	D	82.3	Confident	92.1	Very high	120 Å²	120	56 Å²	56	64%	0.642	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	-14.7	-173.6	-63	-30.3	0	0	0	118	P676 N677 V700	P676-D702 WeakPolarHBondContact CA-O 3.41Å; N677-D702 PolarHBondContact N-O 2.84Å; N677-D702 VanDerWaalsContact N-O 3.1Å; V700-D702 PolarHBondContact O-N 3.02Å
703	Y	88.1	Confident	92	Very high	57 Å²	57	57.9 Å²	57.9	22%	0.224	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	151.3	176.5	-78.7	-102	0	0	0	112.4	V674 G675 P676 V700 E701	V674-Y703 HydrophobicContact CG1-CD1 3.94Å; G675-Y703 VanDerWaalsContact C-CD1 3.45Å; G675-Y703 CarbonylContact O-C 3.55Å; G675-Y703 WeakPolarHBondContact O-CA 3.41Å; G675-Y703 WeakPolarHBondContact O-CD1 3.25Å; P676-Y703 HydrophobicContact CG-CE1 4.14Å; V700-Y703 CarbonylContact C-O 3.57Å; V700-Y703 PolarHBondContact N-O 3.29Å; V700-Y703 CarbonylContact O-C 3.58Å; V700-Y703 WeakPolarHBondContact O-CA 3.45Å; V700-Y703 PolarHBondContact O-N 3.12Å; E701-Y703 PolarHBondContact O-N 2.99Å; E701-Y703 VanDerWaalsContact O-N 3.08Å
704	F	93.3	Very high	91.8	Very high	4 Å²	4	55 Å²	55	2%	0.018	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	150.9	168.1	74.5	-83.4	0	0	0	109.7	V674 G675 P676 N677 Q680 V683 D698 L706	V674-F704 WeakPolarHBondContact CA-O 3.42Å; G675-F704 PolarHBondContact N-O 2.92Å; G675-F704 WeakPolarHBondContact O-CD1 3.37Å; G675-F704 WeakPolarHBondContact O-CE1 3.49Å; G675-F704 PolarHBondContact O-N 3.21Å; P676-F704 VanDerWaalsContact O-CE1 3.28Å; P676-F704 WeakPolarHBondContact O-CE1 3.34Å; N677-F704 PolarHBondContact OD1-N 3.39Å; Q680-F704 HydrophobicContact CB-CD1 4.01Å; Q680-F704 HydrophobicContact CB-CE1 3.74Å; Q680-F704 HydrophobicContact CB-CZ 4.07Å; Q680-F704 HydrophobicContact CG-CD1 4.18Å; Q680-F704 HydrophobicContact CG-CD2 4.21Å; Q680-F704 HydrophobicContact CG-CE1 4.12Å; Q680-F704 HydrophobicContact CG-CE2 4.15Å; Q680-F704 HydrophobicContact CG-CG 4.23Å; Q680-F704 HydrophobicContact CG-CZ 4.11Å; V683-F704 HydrophobicContact CB-CZ 3.97Å; V683-F704 HydrophobicContact CG1-CE2 4.34Å; V683-F704 HydrophobicContact CG1-CZ 4.17Å; V683-F704 HydrophobicContact CG2-CZ 3.97Å; D698-F704 CarbonylContact O-C 3.49Å; D698-F704 WeakPolarHBondContact O-CA 3.25Å; F704-L706 HydrophobicContact CD2-CB 3.94Å; F704-L706 HydrophobicContact CE2-CB 3.73Å
705	T	93.8	Very high	91.5	Very high	21 Å²	21	52.3 Å²	52.3	13%	0.129	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	119.8	171	-53.9	0	0	0	0	107.4	E672 I673 V674 Q697 D698	E672-T705 HydrophobicContact CG-CG2 3.55Å; E672-T705 VanDerWaalsContact OE1-CG2 3.25Å; E672-T705 WeakPolarHBondContact OE1-CG2 3.41Å; I673-T705 CarbonylContact O-C 3.54Å; I673-T705 VanDerWaalsContact O-CA 3.26Å; I673-T705 WeakPolarHBondContact O-CA 3.45Å; V674-T705 HydrophobicContact CG2-CG2 4.13Å; Q697-T705 CarbonylContact C-O 3.58Å; Q697-T705 VanDerWaalsContact CA-O 3.31Å; Q697-T705 WeakPolarHBondContact CA-O 3.49Å; D698-T705 PolarHBondContact N-O 3.11Å; D698-T705 PolarHBondContact O-N 2.92Å
706	L	95.6	Very high	91.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126.3	-178.7	-178.6	74.2	0	0	0	109.5	E672 I673 V683 I684 I687 I694 Q697 F704	E672-L706 WeakPolarHBondContact CA-O 3.3Å; I673-L706 HydrophobicContact CB-CB 4.4Å; I673-L706 HydrophobicContact CD1-CD2 4.39Å; I673-L706 PolarHBondContact N-O 2.97Å; I673-L706 PolarHBondContact O-N 3.44Å; V683-L706 HydrophobicContact CG1-CD2 3.92Å; I684-L706 HydrophobicContact CG1-CD2 4.15Å; I687-L706 HydrophobicContact CG1-CD2 4.42Å; I694-L706 HydrophobicContact CD1-CD1 4.41Å; I694-L706 HydrophobicContact CG1-CD1 4.46Å; I694-L706 HydrophobicContact CG2-CD1 3.65Å; Q697-L706 HydrophobicContact CB-CD1 4.06Å; F704-L706 HydrophobicContact CD2-CB 3.94Å; F704-L706 HydrophobicContact CE2-CB 3.73Å
707	H	96.3	Very high	90.7	Very high	55 Å²	55	50.3 Å²	50.3	26%	0.255	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	127.7	176.5	-57.7	-70.3	0	0	0	109.6	V671 E672 T695 G696 D698	V671-H707 WeakPolarHBondContact O-CA 3.46Å; E672-H707 IonicContact OE1-CE1 3.58Å; T695-H707 PolarHBondContact N-O 3.14Å; T695-H707 WeakPolarHBondContact OG1-CB 3.35Å; T695-H707 PolarHBondContact OG1-O 3.47Å; T695-H707 VanDerWaalsContact OG1-O 3.11Å; G696-H707 PolarHBondContact N-O 2.64Å; G696-H707 PolarHBondContact O-N 2.83Å; D698-H707 IonicContact OD2-CD2 2.69Å; D698-H707 IonicContact OD2-NE2 3.49Å; D698-H707 PolarHBondContact OD2-NE2 3.11Å
708	A	97.1	Very high	90.5	Very high	1 Å²	1	45 Å²	45	1%	0.008	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	145.3	-179.7	0	0	0	0	0	112.7	V671 I687 V693 I694 V710	V671-A708 WeakPolarHBondContact CA-O 3.39Å; V671-A708 WeakPolarHBondContact CB-O 3.39Å; V671-A708 PolarHBondContact N-O 2.59Å; V671-A708 PolarHBondContact O-N 3.25Å; I687-A708 HydrophobicContact CG2-CB 3.96Å; V693-A708 CarbonylContact O-C 3.57Å; V693-A708 VanDerWaalsContact O-CA 3.31Å; V693-A708 WeakPolarHBondContact O-CA 3.35Å; I694-A708 HydrophobicContact CG1-CB 4.34Å; A708-V710 HydrophobicContact CB-CG2 4.23Å
709	D	96.8	Very high	90.3	Very high	27 Å²	27	40.7 Å²	40.7	14%	0.144	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	118.7	170.6	-78.1	2.9	0	0	0	108.7	I668 M669 G692 V693 R738	I668-D709 HydrophobicContact CG2-CB 3.77Å; M669-D709 WeakPolarHBondContact O-CA 3.39Å; G692-D709 CarbonylContact C-O 3.58Å; G692-D709 VanDerWaalsContact CA-O 3.26Å; G692-D709 WeakPolarHBondContact CA-O 3.36Å; V693-D709 PolarHBondContact N-O 3.43Å; V693-D709 PolarHBondContact O-N 3.29Å; D709-R738 IonicContact OD2-CZ 3.2Å; D709-R738 IonicContact OD2-NH2 2.79Å; D709-R738 PolarHBondContact OD2-NH2 3.26Å
710	V	96.4	Very high	90.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	135.2	-177.3	-165	0	0	0	0	111.2	M669 V671 I687 R690 A708 L712 M715	M669-V710 WeakPolarHBondContact CB-O 3.46Å; M669-V710 PolarHBondContact N-O 3.41Å; M669-V710 PolarHBondContact O-N 3.11Å; V671-V710 HydrophobicContact CB-CG2 4.26Å; V671-V710 HydrophobicContact CG2-CB 3.92Å; V671-V710 HydrophobicContact CG2-CG2 3.65Å; I687-V710 HydrophobicContact CD1-CG2 4.02Å; I687-V710 HydrophobicContact CG2-CG2 4.5Å; R690-V710 HydrophobicContact CB-CG1 4.26Å; R690-V710 WeakPolarHBondContact O-CG1 3.24Å; A708-V710 HydrophobicContact CB-CG2 4.23Å; V710-L712 PolarHBondContact O-N 3.07Å; V710-M715 HydrophobicContact CB-CG 4.09Å; V710-M715 HydrophobicContact CB-SD 3.71Å; V710-M715 HydrophobicContact CG1-CG 3.9Å; V710-M715 HydrophobicContact CG1-SD 3.49Å; V710-M715 WeakPolarHBondContact CG1-SD 3.41Å; V710-M715 HydrophobicContact CG2-SD 4.16Å
711	P	95.7	Very high	90.9	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.019	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	131.5	173.7	-23.7	33.9	0	0	0	112.4	I668 N713 D714 M715	I668-P711 HydrophobicContact CD1-CB 4.13Å; I668-P711 HydrophobicContact CD1-CG 3.83Å; P711-N713 PolarHBondContact O-N 3.2Å; P711-N713 VanDerWaalsContact O-N 3.16Å; P711-D714 PolarHBondContact O-N 3.48Å; P711-M715 PolarHBondContact O-N 3.4Å
712	L	92.2	Very high	91.7	Very high	41 Å²	41	28.9 Å²	28.9	22%	0.215	16%	0.157	C	C	.	.	H	α-helix	trans	-58.2	-33.4	179.7	-179.1	58.3	0	0	0	112.2	V542 P667 M669 V710 D714 M715 M734	V542-L712 HydrophobicContact CG1-CD2 4.39Å; V542-L712 HydrophobicContact CG2-CG 4.42Å; P667-L712 HydrophobicContact CG-CB 4Å; P667-L712 HydrophobicContact CG-CD2 4.07Å; P667-L712 PolarHBondContact O-N 3.49Å; M669-L712 HydrophobicContact CE-CD1 4.38Å; M669-L712 HydrophobicContact CG-CB 3.78Å; M669-L712 HydrophobicContact CG-CD1 3.84Å; M669-L712 HydrophobicContact CG-CG 4.34Å; M669-L712 HydrophobicContact SD-CB 4.03Å; M669-L712 HydrophobicContact SD-CD1 3.92Å; M669-L712 HydrophobicContact SD-CD2 4.24Å; M669-L712 HydrophobicContact SD-CG 4.27Å; V710-L712 PolarHBondContact O-N 3.07Å; L712-D714 PolarHBondContact O-N 3.23Å; L712-M715 PolarHBondContact O-N 3.32Å; L712-M734 HydrophobicContact CD1-CE 4.13Å
713	N	92.4	Very high	92	Very high	48 Å²	48	25.6 Å²	25.6	26%	0.257	14%	0.136	S	C	.	.	H	α-helix	trans	-60.2	-29.2	177.7	-174.7	59	0	0	0	113	V542 F544 P711 F716	V542-N713 HydrophobicContact CG2-CB 4.22Å; F544-N713 HydrophobicContact CZ-CB 4.33Å; P711-N713 PolarHBondContact O-N 3.2Å; P711-N713 VanDerWaalsContact O-N 3.16Å; N713-F716 VanDerWaalsContact O-CD2 3.26Å; N713-F716 WeakPolarHBondContact O-CD2 3.45Å
714	D	92.3	Very high	92.1	Very high	37 Å²	37	27.3 Å²	27.3	20%	0.198	16%	0.156	C	C	.	.	H	α-helix	trans	-99.7	-2.3	-179.3	-64.7	-33.9	0	0	0	113	R690 H691 P711 L712	R690-D714 HydrophobicContact CB-CB 4.24Å; R690-D714 WeakPolarHBondContact CD-O 3.48Å; R690-D714 PolarHBondContact NH1-O 2.98Å; H691-D714 IonicContact CD2-OD2 2.91Å; H691-D714 PolarHBondContact CD2-OD2 3.31Å; P711-D714 PolarHBondContact O-N 3.48Å; L712-D714 PolarHBondContact O-N 3.23Å
715	M	90.6	Very high	92.1	Very high	4 Å²	4	28.6 Å²	28.6	2%	0.02	17%	0.165	C	C	.	.	H	α-helix	trans	-82.5	-13.1	177.4	-74.3	-60.5	-71	0	0	113.9	V671 V710 P711 L712 G717 Y718 Y732 M734	V671-M715 HydrophobicContact CG1-CE 4.01Å; V671-M715 HydrophobicContact CG2-CE 3.81Å; V671-M715 HydrophobicContact CG2-SD 4.14Å; V710-M715 HydrophobicContact CB-CG 4.09Å; V710-M715 HydrophobicContact CB-SD 3.71Å; V710-M715 HydrophobicContact CG1-CG 3.9Å; V710-M715 HydrophobicContact CG1-SD 3.49Å; V710-M715 WeakPolarHBondContact CG1-SD 3.41Å; V710-M715 HydrophobicContact CG2-SD 4.16Å; P711-M715 PolarHBondContact O-N 3.4Å; L712-M715 PolarHBondContact O-N 3.32Å; M715-G717 PolarHBondContact O-N 2.82Å; M715-Y718 HydrophobicContact CE-CD1 3.59Å; M715-Y718 HydrophobicContact CE-CE1 4.31Å; M715-Y718 HydrophobicContact CE-CG 4.06Å; M715-Y718 VanDerWaalsContact O-CB 3.24Å; M715-Y718 WeakPolarHBondContact O-CB 3.43Å; M715-Y718 PolarHBondContact O-N 2.94Å; M715-Y718 HydrophobicContact SD-CD1 4.39Å; M715-Y718 HydrophobicContact SD-CG 4.39Å; M715-Y732 HydrophobicContact CE-CD2 3.89Å; M715-Y732 HydrophobicContact CE-CE2 3.49Å; M715-Y732 VanDerWaalsContact CE-CE2 3.49Å; M715-M734 HydrophobicContact CB-SD 4.19Å; M715-M734 HydrophobicContact CE-SD 3.86Å; M715-M734 HydrophobicContact CG-SD 4.23Å
716	F	86.8	Confident	92	Very high	40 Å²	40	27.6 Å²	27.6	18%	0.175	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	127	179.6	-62.7	-64.2	0	0	0	112	K539 P540 V542 R690 N713 Y718	K539-F716 HydrophobicContact CD-CB 4.3Å; K539-F716 HydrophobicContact CD-CD2 4.24Å; K539-F716 HydrophobicContact CD-CG 4.31Å; P540-F716 HydrophobicContact CB-CE1 3.99Å; P540-F716 HydrophobicContact CB-CZ 4.26Å; P540-F716 VanDerWaalsContact CD-CE1 3.48Å; P540-F716 HydrophobicContact CG-CE1 3.82Å; P540-F716 VanDerWaalsContact O-CZ 3.27Å; P540-F716 WeakPolarHBondContact O-CZ 3.5Å; V542-F716 HydrophobicContact CG2-CE2 3.6Å; V542-F716 HydrophobicContact CG2-CZ 3.73Å; R690-F716 PolarHBondContact NH1-O 3.13Å; N713-F716 VanDerWaalsContact O-CD2 3.26Å; N713-F716 WeakPolarHBondContact O-CD2 3.45Å; F716-Y718 VanDerWaalsContact C-N 3.27Å; F716-Y718 PolarHBondContact O-N 3.35Å
717	G	85	Confident	91.5	Very high	37 Å²	37	33.5 Å²	33.5	38%	0.381	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.5	6.3	-178.6	0	0	0	0	0	114.8	M715 S719 T720 E721	M715-G717 PolarHBondContact O-N 2.82Å; G717-S719 VanDerWaalsContact C-N 3.31Å; G717-S719 PolarHBondContact O-N 3.35Å; G717-T720 PolarHBondContact O-N 3.02Å; G717-E721 PolarHBondContact O-N 2.92Å
718	Y	90.4	Very high	90.9	Very high	3 Å²	3	32 Å²	32	1%	0.012	19%	0.186	C	C	.	.	H	α-helix	trans	-61.5	-38.3	179.6	-177.3	-118.2	0	0	0	112.5	I673 I687 M715 F716 T720 E721 L722 Y732	I673-Y718 HydrophobicContact CD1-CE1 3.99Å; I673-Y718 WeakPolarHBondContact CD1-OH 3.13Å; I673-Y718 HydrophobicContact CG1-CE1 4.26Å; I687-Y718 HydrophobicContact CD1-CE1 4.27Å; I687-Y718 HydrophobicContact CD1-CE2 4.05Å; I687-Y718 WeakPolarHBondContact CD1-OH 3.38Å; M715-Y718 HydrophobicContact CE-CD1 3.59Å; M715-Y718 HydrophobicContact CE-CE1 4.31Å; M715-Y718 HydrophobicContact CE-CG 4.06Å; M715-Y718 VanDerWaalsContact O-CB 3.24Å; M715-Y718 WeakPolarHBondContact O-CB 3.43Å; M715-Y718 PolarHBondContact O-N 2.94Å; M715-Y718 HydrophobicContact SD-CD1 4.39Å; M715-Y718 HydrophobicContact SD-CG 4.39Å; F716-Y718 VanDerWaalsContact C-N 3.27Å; F716-Y718 PolarHBondContact O-N 3.35Å; Y718-T720 PolarHBondContact O-N 3.43Å; Y718-E721 PolarHBondContact O-N 3.5Å; Y718-E721 VanDerWaalsContact O-N 3.15Å; Y718-L722 HydrophobicContact CE1-CB 4.18Å; Y718-L722 HydrophobicContact CE1-CD2 3.95Å; Y718-L722 HydrophobicContact CE1-CG 4.47Å; Y718-L722 HydrophobicContact CE2-CB 4.43Å; Y718-L722 WeakPolarHBondContact O-CB 3.22Å; Y718-L722 PolarHBondContact O-N 3.3Å; Y718-Y732 HydrophobicContact CD1-CD1 4.12Å; Y718-Y732 HydrophobicContact CD1-CD2 4.05Å; Y718-Y732 HydrophobicContact CD1-CE1 4.19Å; Y718-Y732 HydrophobicContact CD1-CE2 4.07Å; Y718-Y732 HydrophobicContact CD1-CG 4.06Å; Y718-Y732 HydrophobicContact CE1-CD1 4.42Å; Y718-Y732 HydrophobicContact CE1-CD2 4.36Å; Y718-Y732 HydrophobicContact CE1-CG 4.13Å
719	S	88.5	Confident	90.3	Very high	5 Å²	5	33.7 Å²	33.7	4%	0.035	19%	0.193	C	C	.	.	H	α-helix	trans	-53.1	-39.6	177.5	-170.9	0	0	0	0	113.5	V469 G717 R723	V469-S719 WeakPolarHBondContact CG2-OG 3.39Å; G717-S719 VanDerWaalsContact C-N 3.31Å; G717-S719 PolarHBondContact O-N 3.35Å; S719-R723 WeakPolarHBondContact O-CB 3.46Å; S719-R723 VanDerWaalsContact O-CG 3.28Å; S719-R723 WeakPolarHBondContact O-CG 3.19Å; S719-R723 PolarHBondContact O-N 3.11Å; S719-R723 VanDerWaalsContact O-N 3.15Å
720	T	88.2	Confident	89.9	Confident	55 Å²	55	32.5 Å²	32.5	34%	0.337	19%	0.187	S	C	.	.	H	α-helix	trans	-73.5	-41.5	-178.2	-55	0	0	0	0	110.8	E517 G717 Y718 S724	E517-T720 PolarHBondContact OE2-OG1 3.17Å; G717-T720 PolarHBondContact O-N 3.02Å; Y718-T720 PolarHBondContact O-N 3.43Å; T720-S724 WeakPolarHBondContact O-CB 3.29Å; T720-S724 PolarHBondContact O-N 2.97Å; T720-S724 PolarHBondContact O-OG 3.35Å
721	E	91.9	Very high	89.5	Confident	48 Å²	48	37.8 Å²	37.8	22%	0.224	21%	0.212	C	C	.	.	H	α-helix	trans	-66	-47.3	176.3	-175.5	176.2	-167.5	0	0	111.5	R689 R690 G717 Y718 R723 S724 C725	R689-E721 IonicContact CZ-OE1 3.26Å; R689-E721 IonicContact NH1-OE1 3.74Å; R689-E721 PolarHBondContact NH1-OE1 3.47Å; R690-E721 IonicContact CZ-OE2 3.01Å; R690-E721 VanDerWaalsContact CZ-OE2 3.24Å; R690-E721 IonicContact NE-OE2 2.88Å; R690-E721 PolarHBondContact NE-OE2 3.19Å; R690-E721 IonicContact NH2-OE2 3.93Å; R690-E721 PolarHBondContact NH2-OE2 3.1Å; G717-E721 PolarHBondContact O-N 2.92Å; Y718-E721 PolarHBondContact O-N 3.5Å; Y718-E721 VanDerWaalsContact O-N 3.15Å; E721-R723 PolarHBondContact O-N 2.69Å; E721-S724 WeakPolarHBondContact O-CB 3.46Å; E721-S724 PolarHBondContact O-N 3.36Å; E721-S724 VanDerWaalsContact O-N 3.09Å; E721-C725 PolarHBondContact O-N 2.83Å; E721-C725 PolarHBondContact O-SG 2.8Å; E721-C725 VanDerWaalsContact O-SG 3.42Å
722	L	92.4	Very high	89.2	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-58.8	-48.4	179.4	177.7	63.7	0	0	0	111.3	I673 V683 Y718 S724 C725 T726 Y732	I673-L722 HydrophobicContact CG2-CD1 3.99Å; I673-L722 HydrophobicContact CG2-CD2 4.11Å; V683-L722 HydrophobicContact CG1-CD1 4.32Å; V683-L722 HydrophobicContact CG2-CD1 3.84Å; Y718-L722 HydrophobicContact CE1-CB 4.18Å; Y718-L722 HydrophobicContact CE1-CD2 3.95Å; Y718-L722 HydrophobicContact CE1-CG 4.47Å; Y718-L722 HydrophobicContact CE2-CB 4.43Å; Y718-L722 WeakPolarHBondContact O-CB 3.22Å; Y718-L722 PolarHBondContact O-N 3.3Å; L722-S724 VanDerWaalsContact C-N 3.27Å; L722-S724 PolarHBondContact O-N 2.89Å; L722-C725 PolarHBondContact O-N 2.82Å; L722-C725 PolarHBondContact O-SG 2.9Å; L722-T726 HydrophobicContact CD1-CG2 3.88Å; L722-T726 WeakPolarHBondContact O-CB 3.46Å; L722-T726 WeakPolarHBondContact O-CG2 3.48Å; L722-T726 PolarHBondContact O-N 2.92Å; L722-T726 PolarHBondContact O-OG1 3.32Å; L722-Y732 HydrophobicContact CD2-CD1 3.84Å; L722-Y732 HydrophobicContact CD2-CG 4.2Å
723	R	88.8	Confident	89	Confident	51 Å²	51	40.5 Å²	40.5	19%	0.192	23%	0.228	C	C	.	.	H	α-helix	trans	-63.2	-36.2	176.4	-73.3	178.7	-177.6	173.7	4	111.5	D126 M515 S719 E721 E727 G728	D126-R723 IonicContact OD1-NH1 2.81Å; D126-R723 PolarHBondContact OD1-NH1 2.66Å; M515-R723 PolarHBondContact O-NH1 2.78Å; M515-R723 PolarHBondContact O-NH2 3.15Å; S719-R723 WeakPolarHBondContact O-CB 3.46Å; S719-R723 VanDerWaalsContact O-CG 3.28Å; S719-R723 WeakPolarHBondContact O-CG 3.19Å; S719-R723 PolarHBondContact O-N 3.11Å; S719-R723 VanDerWaalsContact O-N 3.15Å; E721-R723 PolarHBondContact O-N 2.69Å; R723-E727 CarbonylContact O-C 3.52Å; R723-E727 PolarHBondContact O-N 3.11Å; R723-G728 WeakPolarHBondContact O-CA 3.35Å; R723-G728 PolarHBondContact O-N 3.37Å
724	S	90.7	Very high	88.9	Confident	93 Å²	93	41.6 Å²	41.6	65%	0.65	23%	0.232	S	C	*	.	H	α-helix	trans	-68.3	-42.3	179.9	-60.4	0	0	0	0	112.4	T720 E721 L722	T720-S724 WeakPolarHBondContact O-CB 3.29Å; T720-S724 PolarHBondContact O-N 2.97Å; T720-S724 PolarHBondContact O-OG 3.35Å; E721-S724 WeakPolarHBondContact O-CB 3.46Å; E721-S724 PolarHBondContact O-N 3.36Å; E721-S724 VanDerWaalsContact O-N 3.09Å; L722-S724 VanDerWaalsContact C-N 3.27Å; L722-S724 PolarHBondContact O-N 2.89Å
725	C	93	Very high	88.8	Confident	31 Å²	31	46.4 Å²	46.4	21%	0.209	25%	0.254	C	S	.	.	H	α-helix	trans	-77.3	-26.7	-179.8	67.7	0	0	0	0	113.4	F679 Q682 E721 L722	F679-C725 VanDerWaalsContact CD1-O 3.29Å; F679-C725 WeakPolarHBondContact CD1-O 3.35Å; Q682-C725 HydrophobicContact CB-CB 4.18Å; Q682-C725 PolarHBondContact OE1-O 2.77Å; E721-C725 PolarHBondContact O-N 2.83Å; E721-C725 PolarHBondContact O-SG 2.8Å; E721-C725 VanDerWaalsContact O-SG 3.42Å; L722-C725 PolarHBondContact O-N 2.82Å; L722-C725 PolarHBondContact O-SG 2.9Å
726	T	90.1	Very high	88.7	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	16.1	-179.8	61.3	0	0	0	0	114.2	F679 V683 L722 G728 K729 G730	F679-T726 HydrophobicContact CB-CG2 4Å; F679-T726 HydrophobicContact CD2-CG2 4.5Å; F679-T726 WeakPolarHBondContact CE2-O 3.42Å; F679-T726 HydrophobicContact CG-CG2 4.46Å; V683-T726 HydrophobicContact CG2-CG2 3.62Å; L722-T726 HydrophobicContact CD1-CG2 3.88Å; L722-T726 WeakPolarHBondContact O-CB 3.46Å; L722-T726 WeakPolarHBondContact O-CG2 3.48Å; L722-T726 PolarHBondContact O-N 2.92Å; L722-T726 PolarHBondContact O-OG1 3.32Å; T726-G728 PolarHBondContact O-N 3.09Å; T726-G728 VanDerWaalsContact O-N 3.11Å; T726-K729 WeakPolarHBondContact O-CB 3.35Å; T726-K729 PolarHBondContact O-N 3.02Å; T726-G730 WeakPolarHBondContact OG1-CA 3.21Å; T726-G730 PolarHBondContact OG1-N 3.08Å
727	E	86.8	Confident	88.9	Confident	123 Å²	123	52.5 Å²	52.5	58%	0.575	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	31.4	-173.8	-60.8	-175.5	165.6	0	0	113.9	C153 F679 R723 K729	C153-E727 VanDerWaalsContact CB-O 3.32Å; C153-E727 WeakPolarHBondContact CB-O 3.14Å; C153-E727 PolarHBondContact SG-O 3.21Å; F679-E727 HydrophobicContact CE1-CG 4.1Å; F679-E727 HydrophobicContact CE2-CB 4.33Å; F679-E727 HydrophobicContact CE2-CG 4.26Å; F679-E727 HydrophobicContact CZ-CB 4.1Å; F679-E727 HydrophobicContact CZ-CG 3.55Å; R723-E727 CarbonylContact O-C 3.52Å; R723-E727 PolarHBondContact O-N 3.11Å; E727-K729 VanDerWaalsContact C-N 3.33Å; E727-K729 IonicContact OE2-NZ 3.86Å
728	G	83.4	Confident	89.2	Confident	23 Å²	23	56.6 Å²	56.6	24%	0.237	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	12.8	179.8	0	0	0	0	0	114.5	R723 T726	R723-G728 WeakPolarHBondContact O-CA 3.35Å; R723-G728 PolarHBondContact O-N 3.37Å; T726-G728 PolarHBondContact O-N 3.09Å; T726-G728 VanDerWaalsContact O-N 3.11Å
729	K	84.9	Confident	89.4	Confident	37 Å²	37	57.2 Å²	57.2	16%	0.161	29%	0.291	C	S	.	.			trans	-94.4	-17.4	179.7	-58.4	172.9	-169	169	0	113.7	C153 P676 E678 F679 T726 E727	C153-K729 HydrophobicContact CB-CG 3.8Å; P676-K729 HydrophobicContact CG-CB 3.67Å; P676-K729 HydrophobicContact CG-CD 3.53Å; P676-K729 HydrophobicContact CG-CG 4.28Å; E678-K729 IonicContact OE1-NZ 2.89Å; E678-K729 PolarHBondContact OE1-NZ 3.38Å; F679-K729 HydrophobicContact CE2-CD 4.25Å; T726-K729 WeakPolarHBondContact O-CB 3.35Å; T726-K729 PolarHBondContact O-N 3.02Å; E727-K729 VanDerWaalsContact C-N 3.33Å; E727-K729 IonicContact OE2-NZ 3.86Å
730	G	87.6	Confident	89.6	Confident	2 Å²	2	60.1 Å²	60.1	2%	0.021	30%	0.304	C	S	.	.			trans	-81.4	134	-179.7	0	0	0	0	0	112.6	V674 T726	V674-G730 WeakPolarHBondContact O-CA 3.1Å; T726-G730 WeakPolarHBondContact OG1-CA 3.21Å; T726-G730 PolarHBondContact OG1-N 3.08Å
731	E	87.1	Confident	89.8	Confident	111 Å²	111	60.8 Å²	60.8	52%	0.519	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	150.2	175.1	-65.7	174.9	-165	0	0	108.6	I673 V674	I673-E731 WeakPolarHBondContact CA-O 3.31Å; V674-E731 PolarHBondContact N-O 2.92Å; V674-E731 PolarHBondContact O-N 3.4Å
732	Y	91.3	Very high	89.9	Confident	22 Å²	22	59 Å²	59	9%	0.086	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	149.6	174	81.3	-72	0	0	0	110.8	V469 V671 E672 M715 Y718 L722 M734	V469-Y732 HydrophobicContact CB-CE1 4.24Å; V469-Y732 PolarHBondContact O-OH 2.9Å; V671-Y732 HydrophobicContact CG1-CD2 3.97Å; E672-Y732 CarbonylContact O-C 3.56Å; E672-Y732 WeakPolarHBondContact O-CA 3.36Å; M715-Y732 HydrophobicContact CE-CD2 3.89Å; M715-Y732 HydrophobicContact CE-CE2 3.49Å; M715-Y732 VanDerWaalsContact CE-CE2 3.49Å; Y718-Y732 HydrophobicContact CD1-CD1 4.12Å; Y718-Y732 HydrophobicContact CD1-CD2 4.05Å; Y718-Y732 HydrophobicContact CD1-CE1 4.19Å; Y718-Y732 HydrophobicContact CD1-CE2 4.07Å; Y718-Y732 HydrophobicContact CD1-CG 4.06Å; Y718-Y732 HydrophobicContact CE1-CD1 4.42Å; Y718-Y732 HydrophobicContact CE1-CD2 4.36Å; Y718-Y732 HydrophobicContact CE1-CG 4.13Å; L722-Y732 HydrophobicContact CD2-CD1 3.84Å; L722-Y732 HydrophobicContact CD2-CG 4.2Å; Y732-M734 HydrophobicContact CE2-CG 4.24Å; Y732-M734 HydrophobicContact CE2-SD 4.04Å
733	T	87	Confident	90	Very high	80 Å²	80	62.3 Å²	62.3	49%	0.491	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	154.6	166.7	65.4	0	0	0	0	108.6	V671 E672	V671-T733 WeakPolarHBondContact CA-O 3.46Å; E672-T733 PolarHBondContact N-O 2.99Å; E672-T733 PolarHBondContact O-N 2.87Å
734	M	90.3	Very high	90.2	Very high	71 Å²	71	64.4 Å²	64.4	35%	0.35	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	143.1	175.7	68.7	177.6	-178.3	0	0	111.5	M669 A670 V671 L712 M715 Y732	M669-M734 HydrophobicContact CB-CB 4.22Å; M669-M734 HydrophobicContact CB-SD 4.37Å; M669-M734 HydrophobicContact CE-CB 4.26Å; M669-M734 HydrophobicContact CE-CE 4.46Å; M669-M734 HydrophobicContact CE-CG 3.86Å; M669-M734 HydrophobicContact CE-SD 4.08Å; M669-M734 HydrophobicContact CG-SD 4.19Å; A670-M734 CarbonylContact O-C 3.54Å; A670-M734 WeakPolarHBondContact O-CA 3.49Å; V671-M734 HydrophobicContact CG2-CB 4.08Å; L712-M734 HydrophobicContact CD1-CE 4.13Å; M715-M734 HydrophobicContact CB-SD 4.19Å; M715-M734 HydrophobicContact CE-SD 3.86Å; M715-M734 HydrophobicContact CG-SD 4.23Å; Y732-M734 HydrophobicContact CE2-CG 4.24Å; Y732-M734 HydrophobicContact CE2-SD 4.04Å
735	E	89.1	Confident	90.3	Very high	138 Å²	138	63.9 Å²	63.9	65%	0.645	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.3	153.8	176.4	62.2	179.1	-177.2	0	0	111.2	M669 A670 C737	M669-E735 CarbonylContact C-O 3.49Å; M669-E735 VanDerWaalsContact CA-O 3.23Å; M669-E735 WeakPolarHBondContact CA-O 3.32Å; M669-E735 VanDerWaalsContact CE-C 3.43Å; A670-E735 HydrophobicContact CB-CG 4.1Å; A670-E735 PolarHBondContact N-O 3.31Å; A670-E735 PolarHBondContact O-N 2.77Å; E735-C737 PolarHBondContact O-N 3.47Å
736	Y	89.9	Confident	90.3	Very high	112 Å²	112	63.5 Å²	63.5	44%	0.439	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	125.3	176	168.7	-95.7	0	0	0	109.5	T584 P667 Y739	T584-Y736 WeakPolarHBondContact CG2-OH 3.31Å; P667-Y736 HydrophobicContact CB-CD2 4.12Å; P667-Y736 HydrophobicContact CB-CE2 3.96Å; Y736-Y739 HydrophobicContact CE2-CD2 4.07Å; Y736-Y739 AromaticContact CE2-CE2 3.9Å; Y736-Y739 HydrophobicContact CE2-CE2 3.9Å; Y736-Y739 AromaticContact CZ-CD2 3.96Å; Y736-Y739 AromaticContact CZ-CE2 3.99Å; Y736-Y739 WeakPolarHBondContact OH-CD2 3.14Å; Y736-Y739 WeakPolarHBondContact OH-CE2 3.35Å
737	C	90.9	Very high	90.5	Very high	60 Å²	60	65.4 Å²	65.4	41%	0.405	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-62.5	179.8	179.8	0	0	0	0	111.1	I668 A670 E735	I668-C737 WeakPolarHBondContact O-CB 3.43Å; I668-C737 PolarHBondContact O-N 2.99Å; A670-C737 HydrophobicContact CB-CB 4.04Å; E735-C737 PolarHBondContact O-N 3.47Å
738	R	91.6	Very high	90.8	Very high	122 Å²	122	65.6 Å²	65.6	46%	0.46	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	175.6	-174.2	59.6	-177.1	165.1	-179.7	-6.8	112.2	I668 D709	I668-R738 HydrophobicContact CB-CG 4.29Å; I668-R738 PolarHBondContact N-O 3.2Å; D709-R738 IonicContact OD2-CZ 3.2Å; D709-R738 IonicContact OD2-NH2 2.79Å; D709-R738 PolarHBondContact OD2-NH2 3.26Å
739	Y	93.2	Very high	91.2	Very high	17 Å²	17	68.1 Å²	68.1	7%	0.067	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	148.5	164.4	-84.3	-83.3	0	0	0	110.9	A543 R545 T584 L665 E666 P667 Y736	A543-Y739 VanDerWaalsContact O-CE1 3.32Å; A543-Y739 WeakPolarHBondContact O-CE1 3.33Å; A543-Y739 PolarHBondContact O-OH 3.09Å; R545-Y739 HydrophobicContact CB-CE1 4.4Å; R545-Y739 HydrophobicContact CG-CD1 4.07Å; R545-Y739 HydrophobicContact CG-CD2 4.5Å; R545-Y739 HydrophobicContact CG-CE1 3.58Å; R545-Y739 HydrophobicContact CG-CE2 4.08Å; R545-Y739 PolarHBondContact NE-OH 2.77Å; T584-Y739 HydrophobicContact CG2-CD2 3.72Å; T584-Y739 HydrophobicContact CG2-CE2 3.9Å; L665-Y739 HydrophobicContact CB-CD1 3.86Å; L665-Y739 HydrophobicContact CB-CG 4.39Å; E666-Y739 WeakPolarHBondContact O-CA 3.41Å; E666-Y739 WeakPolarHBondContact O-CD1 3.48Å; P667-Y739 HydrophobicContact CB-CD1 4.28Å; P667-Y739 HydrophobicContact CB-CE1 3.85Å; P667-Y739 HydrophobicContact CG-CE1 4.17Å; Y736-Y739 HydrophobicContact CE2-CD2 4.07Å; Y736-Y739 AromaticContact CE2-CE2 3.9Å; Y736-Y739 HydrophobicContact CE2-CE2 3.9Å; Y736-Y739 AromaticContact CZ-CD2 3.96Å; Y736-Y739 AromaticContact CZ-CE2 3.99Å; Y736-Y739 WeakPolarHBondContact OH-CD2 3.14Å; Y736-Y739 WeakPolarHBondContact OH-CE2 3.35Å
740	Q	92.8	Very high	91.5	Very high	65 Å²	65	67 Å²	67	30%	0.304	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	158.4	170.6	75.2	176.8	10.7	0	0	111	L665 E666 I668 C742	L665-Q740 CarbonylContact C-O 3.59Å; L665-Q740 WeakPolarHBondContact CA-O 3.44Å; E666-Q740 HydrophobicContact CG-CG 4.01Å; E666-Q740 PolarHBondContact N-O 3.41Å; E666-Q740 PolarHBondContact O-N 3.38Å; E666-Q740 PolarHBondContact OE1-NE2 3.05Å; I668-Q740 HydrophobicContact CD1-CG 3.65Å; I668-Q740 HydrophobicContact CG1-CB 4.11Å; I668-Q740 VanDerWaalsContact CG1-CD 3.44Å; I668-Q740 HydrophobicContact CG1-CG 3.52Å; Q740-C742 PolarHBondContact O-N 2.85Å
741	P	93.3	Very high	91.8	Very high	70 Å²	70	68.6 Å²	68.6	46%	0.455	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	128.6	169.8	-23.5	35.3	0	0	0	111.4	L665	L665-P741 HydrophobicContact CD2-CB 4.38Å; L665-P741 HydrophobicContact CD2-CG 4.1Å
742	C	93.9	Very high	92	Very high	10 Å²	10	66 Å²	66	7%	0.068	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-70.3	155.2	-179.5	-163.7	0	0	0	0	110.9	I664 E666 Q740 T746	I664-C742 WeakPolarHBondContact O-CB 3.17Å; I664-C742 PolarHBondContact O-N 3.47Å; E666-C742 HydrophobicContact CB-CB 4.25Å; E666-C742 HydrophobicContact CG-CB 4.24Å; E666-C742 PolarHBondContact OE2-SG 2.74Å; Q740-C742 PolarHBondContact O-N 2.85Å; C742-T746 WeakPolarHBondContact SG-CB 3.44Å; C742-T746 PolarHBondContact SG-OG1 2.83Å
743	L	94.2	Very high	91.9	Very high	70 Å²	70	70.7 Å²	70.7	37%	0.366	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-62.1	149.7	173.5	-63.7	172.4	0	0	0	111	S745 T746 Q747	L743-S745 VanDerWaalsContact C-N 3.25Å; L743-S745 PolarHBondContact O-N 3.39Å; L743-T746 WeakPolarHBondContact CB-OG1 3.45Å; L743-T746 PolarHBondContact N-OG1 3.44Å; L743-T746 PolarHBondContact O-N 3.3Å; L743-T746 PolarHBondContact O-OG1 3.35Å; L743-Q747 WeakPolarHBondContact O-CB 3.45Å; L743-Q747 PolarHBondContact O-N 3.04Å
744	P	93.1	Very high	92.1	Very high	96 Å²	96	69.4 Å²	69.4	62%	0.623	35%	0.351	S	S	*	.	H	α-helix	trans	-57.8	-36.8	179.8	-27.2	35.2	0	0	0	113.6	Q747 E748	P744-Q747 PolarHBondContact O-N 2.91Å; P744-E748 WeakPolarHBondContact O-CG 3.43Å; P744-E748 PolarHBondContact O-N 3.32Å
745	S	93.8	Very high	92	Very high	81 Å²	81	68 Å²	68	57%	0.566	34%	0.344	S	S	*	.	H	α-helix	trans	-65.2	-44.1	179.5	50.3	0	0	0	0	112.8	L743 D749	L743-S745 VanDerWaalsContact C-N 3.25Å; L743-S745 PolarHBondContact O-N 3.39Å; S745-D749 PolarHBondContact O-N 2.9Å; S745-D749 VanDerWaalsContact O-N 3.13Å
746	T	92.4	Very high	92.1	Very high	23 Å²	23	64.3 Å²	64.3	14%	0.141	33%	0.327	C	S	.	.	H	α-helix	trans	-72.5	-38.1	177.7	39.8	0	0	0	0	111	C742 L743 D749 I750	C742-T746 WeakPolarHBondContact SG-CB 3.44Å; C742-T746 PolarHBondContact SG-OG1 2.83Å; L743-T746 WeakPolarHBondContact CB-OG1 3.45Å; L743-T746 PolarHBondContact N-OG1 3.44Å; L743-T746 PolarHBondContact O-N 3.3Å; L743-T746 PolarHBondContact O-OG1 3.35Å; T746-D749 PolarHBondContact O-N 2.77Å; T746-I750 WeakPolarHBondContact O-CD1 3.39Å; T746-I750 VanDerWaalsContact O-CG1 3.23Å; T746-I750 WeakPolarHBondContact O-CG1 3.4Å; T746-I750 PolarHBondContact O-N 3.45Å
747	Q	93.6	Very high	91.9	Very high	40 Å²	40	63.1 Å²	63.1	19%	0.187	34%	0.34	C	S	.	.	H	α-helix	trans	-58	-48.6	172.6	179.4	172.9	-8.5	0	0	111.5	I664 L743 P744 D749 I750 I751	I664-Q747 HydrophobicContact CB-CG 4.25Å; I664-Q747 HydrophobicContact CD1-CG 3.94Å; I664-Q747 HydrophobicContact CG1-CG 3.99Å; L743-Q747 WeakPolarHBondContact O-CB 3.45Å; L743-Q747 PolarHBondContact O-N 3.04Å; P744-Q747 PolarHBondContact O-N 2.91Å; Q747-D749 PolarHBondContact O-N 2.88Å; Q747-I750 PolarHBondContact O-N 3.18Å; Q747-I751 HydrophobicContact CG-CD1 3.89Å; Q747-I751 WeakPolarHBondContact O-CD1 3.3Å; Q747-I751 VanDerWaalsContact O-CG1 3.26Å; Q747-I751 WeakPolarHBondContact O-CG1 3.5Å; Q747-I751 PolarHBondContact O-N 3.07Å
748	E	93.2	Very high	91.7	Very high	128 Å²	128	63.1 Å²	63.1	60%	0.598	34%	0.339	S	S	*	.	H	α-helix	trans	-62.2	-40.6	176.4	-76.9	-175.2	-178.7	0	0	112.7	P744 I750 I751 N752	P744-E748 WeakPolarHBondContact O-CG 3.43Å; P744-E748 PolarHBondContact O-N 3.32Å; E748-I750 PolarHBondContact O-N 3.48Å; E748-I751 PolarHBondContact O-N 3.38Å; E748-N752 WeakPolarHBondContact O-CB 3.31Å; E748-N752 VanDerWaalsContact O-CG 3.22Å; E748-N752 PolarHBondContact O-N 3.16Å; E748-N752 PolarHBondContact O-ND2 3.23Å
749	D	92.7	Very high	91.3	Very high	75 Å²	75	60.2 Å²	60.2	40%	0.401	35%	0.347	S	S	.	.	H	α-helix	trans	-62.6	-41.8	177.6	-172.7	38.1	0	0	0	111.7	S745 T746 Q747 N752 K753	S745-D749 PolarHBondContact O-N 2.9Å; S745-D749 VanDerWaalsContact O-N 3.13Å; T746-D749 PolarHBondContact O-N 2.77Å; Q747-D749 PolarHBondContact O-N 2.88Å; D749-N752 PolarHBondContact O-N 2.9Å; D749-K753 WeakPolarHBondContact O-CG 3.36Å; D749-K753 PolarHBondContact O-N 3.44Å; D749-K753 WeakPolarHBondContact OD1-CE 3.37Å; D749-K753 IonicContact OD1-NZ 3.76Å; D749-K753 VanDerWaalsContact OD2-CE 3.24Å; D749-K753 WeakPolarHBondContact OD2-CE 3.4Å; D749-K753 IonicContact OD2-NZ 3.48Å; D749-K753 PolarHBondContact OD2-NZ 2.97Å
750	I	91.6	Very high	90.7	Very high	15 Å²	15	66 Å²	66	8%	0.077	38%	0.375	C	S	.	.	H	α-helix	trans	-65.9	-44.8	177.4	-65.3	160.5	0	0	0	111.1	F544 I664 T746 Q747 E748 N752 K753 Y754	F544-I750 HydrophobicContact CD1-CD1 3.7Å; F544-I750 HydrophobicContact CD2-CD1 4Å; F544-I750 HydrophobicContact CE1-CD1 3.38Å; F544-I750 HydrophobicContact CE2-CD1 3.7Å; F544-I750 HydrophobicContact CE2-CG1 4.14Å; F544-I750 HydrophobicContact CG-CD1 4.01Å; F544-I750 HydrophobicContact CZ-CD1 3.38Å; F544-I750 HydrophobicContact CZ-CG1 4.17Å; I664-I750 HydrophobicContact CD1-CB 4.16Å; I664-I750 HydrophobicContact CD1-CG2 3.88Å; I664-I750 HydrophobicContact CG2-CD1 4.32Å; T746-I750 WeakPolarHBondContact O-CD1 3.39Å; T746-I750 VanDerWaalsContact O-CG1 3.23Å; T746-I750 WeakPolarHBondContact O-CG1 3.4Å; T746-I750 PolarHBondContact O-N 3.45Å; Q747-I750 PolarHBondContact O-N 3.18Å; E748-I750 PolarHBondContact O-N 3.48Å; I750-N752 VanDerWaalsContact C-N 3.33Å; I750-N752 PolarHBondContact O-N 2.74Å; I750-K753 PolarHBondContact O-N 3.37Å; I750-Y754 PolarHBondContact O-N 3.46Å
751	I	92.3	Very high	89.8	Confident	35 Å²	35	66.3 Å²	66.3	18%	0.179	38%	0.378	C	S	.	.	H	α-helix	trans	-59.5	-47.2	176.6	-68.1	164.3	0	0	0	110	L618 I664 Q747 E748 K753 Y754 L755	L618-I751 HydrophobicContact CD1-CD1 3.74Å; L618-I751 HydrophobicContact CD1-CG1 3.96Å; L618-I751 HydrophobicContact CD2-CD1 4.14Å; L618-I751 HydrophobicContact CD2-CG1 4.44Å; L618-I751 HydrophobicContact CG-CD1 3.98Å; L618-I751 HydrophobicContact CG-CG1 3.92Å; I664-I751 HydrophobicContact CD1-CG1 4.08Å; Q747-I751 HydrophobicContact CG-CD1 3.89Å; Q747-I751 WeakPolarHBondContact O-CD1 3.3Å; Q747-I751 VanDerWaalsContact O-CG1 3.26Å; Q747-I751 WeakPolarHBondContact O-CG1 3.5Å; Q747-I751 PolarHBondContact O-N 3.07Å; E748-I751 PolarHBondContact O-N 3.38Å; I751-K753 PolarHBondContact O-N 3.28Å; I751-Y754 PolarHBondContact O-N 3.43Å; I751-Y754 VanDerWaalsContact O-N 3.16Å; I751-L755 HydrophobicContact CG2-CD1 3.88Å; I751-L755 HydrophobicContact CG2-CG 4.3Å; I751-L755 WeakPolarHBondContact O-CG 3.49Å; I751-L755 PolarHBondContact O-N 3.14Å
752	N	91.8	Very high	88.2	Confident	57 Å²	57	68.3 Å²	68.3	31%	0.305	39%	0.391	S	S	.	.	H	α-helix	trans	-60	-44.9	178	-74.2	-42.8	0	0	0	111.8	E748 D749 I750 Y754 L755 E756	E748-N752 WeakPolarHBondContact O-CB 3.31Å; E748-N752 VanDerWaalsContact O-CG 3.22Å; E748-N752 PolarHBondContact O-N 3.16Å; E748-N752 PolarHBondContact O-ND2 3.23Å; D749-N752 PolarHBondContact O-N 2.9Å; I750-N752 VanDerWaalsContact C-N 3.33Å; I750-N752 PolarHBondContact O-N 2.74Å; N752-Y754 VanDerWaalsContact C-N 3.29Å; N752-Y754 PolarHBondContact O-N 3.22Å; N752-L755 PolarHBondContact O-N 3.01Å; N752-E756 WeakPolarHBondContact O-CG 3.49Å; N752-E756 PolarHBondContact O-N 3.46Å
753	K	89.5	Confident	86.5	Confident	119 Å²	119	72.3 Å²	72.3	52%	0.517	41%	0.414	S	S	.	.	H	α-helix	trans	-59.9	-39.1	175.5	-75.6	172.3	-170.9	160	0	112.2	D749 I750 I751 A757	D749-K753 WeakPolarHBondContact O-CG 3.36Å; D749-K753 PolarHBondContact O-N 3.44Å; D749-K753 WeakPolarHBondContact OD1-CE 3.37Å; D749-K753 IonicContact OD1-NZ 3.76Å; D749-K753 VanDerWaalsContact OD2-CE 3.24Å; D749-K753 WeakPolarHBondContact OD2-CE 3.4Å; D749-K753 IonicContact OD2-NZ 3.48Å; D749-K753 PolarHBondContact OD2-NZ 2.97Å; I750-K753 PolarHBondContact O-N 3.37Å; I751-K753 PolarHBondContact O-N 3.28Å; K753-A757 VanDerWaalsContact O-CB 3.3Å; K753-A757 WeakPolarHBondContact O-CB 3.3Å; K753-A757 PolarHBondContact O-N 3.22Å
754	Y	90.1	Very high	84.6	Confident	53 Å²	53	76.9 Å²	76.9	21%	0.208	43%	0.431	C	S	.	.	H	α-helix	trans	-68.5	-41.5	176.8	179.3	-114	0	0	0	112.4	L618 S619 I750 I751 N752 E756 A757 T758	L618-Y754 VanDerWaalsContact O-CD1 3.31Å; L618-Y754 WeakPolarHBondContact O-CD1 3.29Å; S619-Y754 WeakPolarHBondContact O-CD2 3.48Å; I750-Y754 PolarHBondContact O-N 3.46Å; I751-Y754 PolarHBondContact O-N 3.43Å; I751-Y754 VanDerWaalsContact O-N 3.16Å; N752-Y754 VanDerWaalsContact C-N 3.29Å; N752-Y754 PolarHBondContact O-N 3.22Å; Y754-E756 PolarHBondContact O-N 2.95Å; Y754-A757 PolarHBondContact O-N 2.94Å; Y754-T758 HydrophobicContact CD2-CG2 4.17Å; Y754-T758 HydrophobicContact CE1-CG2 4.17Å; Y754-T758 HydrophobicContact CE2-CG2 3.73Å; Y754-T758 WeakPolarHBondContact O-CB 3.4Å; Y754-T758 WeakPolarHBondContact O-CG2 3.47Å; Y754-T758 PolarHBondContact O-N 3.04Å; Y754-T758 PolarHBondContact O-OG1 2.98Å
755	L	89.9	Confident	82.3	Confident	42 Å²	42	81.5 Å²	81.5	22%	0.22	44%	0.442	C	S	.	.	H	α-helix	trans	-66.2	-35.6	176.4	-69.2	175.3	0	0	0	112.6	I751 N752 T758 G759 Q760 L761	I751-L755 HydrophobicContact CG2-CD1 3.88Å; I751-L755 HydrophobicContact CG2-CG 4.3Å; I751-L755 WeakPolarHBondContact O-CG 3.49Å; I751-L755 PolarHBondContact O-N 3.14Å; N752-L755 PolarHBondContact O-N 3.01Å; L755-T758 WeakPolarHBondContact CA-OG1 3.36Å; L755-T758 PolarHBondContact O-OG1 3.5Å; L755-G759 PolarHBondContact O-N 3.17Å; L755-Q760 HydrophobicContact CD2-CB 4.29Å; L755-Q760 VanDerWaalsContact CD2-OE1 3.27Å; L755-Q760 PolarHBondContact O-N 3.3Å; L755-L761 HydrophobicContact CB-CB 4.3Å; L755-L761 HydrophobicContact CB-CD1 3.63Å; L755-L761 HydrophobicContact CB-CG 3.9Å; L755-L761 HydrophobicContact CD1-CD1 3.62Å; L755-L761 HydrophobicContact CD1-CG 4.26Å; L755-L761 HydrophobicContact CG-CD1 4.28Å; L755-L761 PolarHBondContact O-N 3.31Å
756	E	90.1	Very high	79.8	Confident	60 Å²	60	80.7 Å²	80.7	28%	0.28	45%	0.447	S	S	.	.	H	α-helix	trans	-68.6	-42.2	172.1	-73.1	-171.4	165.2	0	0	111.3	N752 Y754 T758 G759 K764	N752-E756 WeakPolarHBondContact O-CG 3.49Å; N752-E756 PolarHBondContact O-N 3.46Å; Y754-E756 PolarHBondContact O-N 2.95Å; E756-T758 VanDerWaalsContact C-N 3.32Å; E756-T758 PolarHBondContact O-N 3.19Å; E756-G759 PolarHBondContact O-N 2.96Å; E756-K764 PolarHBondContact OE1-N 2.9Å
757	A	86.6	Confident	77.2	Confident	87 Å²	87	90.2 Å²	90.2	72%	0.719	49%	0.486	S	S	*	.	H	α-helix	trans	-67.2	-30.8	178.1	0	0	0	0	0	113.2	K753 Y754 G759	K753-A757 VanDerWaalsContact O-CB 3.3Å; K753-A757 WeakPolarHBondContact O-CB 3.3Å; K753-A757 PolarHBondContact O-N 3.22Å; Y754-A757 PolarHBondContact O-N 2.94Å; A757-G759 VanDerWaalsContact C-N 3.33Å
758	T	86.9	Confident	74.9	Confident	60 Å²	60	92.5 Å²	92.5	37%	0.368	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-7	175.3	52.6	0	0	0	0	113.2	Y754 L755 E756 Q760	Y754-T758 HydrophobicContact CD2-CG2 4.17Å; Y754-T758 HydrophobicContact CE1-CG2 4.17Å; Y754-T758 HydrophobicContact CE2-CG2 3.73Å; Y754-T758 WeakPolarHBondContact O-CB 3.4Å; Y754-T758 WeakPolarHBondContact O-CG2 3.47Å; Y754-T758 PolarHBondContact O-N 3.04Å; Y754-T758 PolarHBondContact O-OG1 2.98Å; L755-T758 WeakPolarHBondContact CA-OG1 3.36Å; L755-T758 PolarHBondContact O-OG1 3.5Å; E756-T758 VanDerWaalsContact C-N 3.32Å; E756-T758 PolarHBondContact O-N 3.19Å; T758-Q760 VanDerWaalsContact C-N 3.26Å; T758-Q760 PolarHBondContact O-N 2.97Å
759	G	83.5	Confident	72.2	Confident	61 Å²	61	96 Å²	96	63%	0.629	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.2	12.4	178.5	0	0	0	0	0	114.5	L755 E756 A757	L755-G759 PolarHBondContact O-N 3.17Å; E756-G759 PolarHBondContact O-N 2.96Å; A757-G759 VanDerWaalsContact C-N 3.33Å
760	Q	78.6	Confident	69.3	Low	140 Å²	140	104.1 Å²	104.1	65%	0.654	57%	0.568	S	S	*	*	S	Bend	trans	-78.6	-25.8	178.7	-66.1	-179.7	-1.4	0	0	111.9	L755 T758	L755-Q760 HydrophobicContact CD2-CB 4.29Å; L755-Q760 VanDerWaalsContact CD2-OE1 3.27Å; L755-Q760 PolarHBondContact O-N 3.3Å; T758-Q760 VanDerWaalsContact C-N 3.26Å; T758-Q760 PolarHBondContact O-N 2.97Å
761	L	74.1	Confident	68.2	Low	70 Å²	70	108.6 Å²	108.6	37%	0.366	59%	0.593	S	S	.	*	S	Bend	trans	-112	143	167.6	-70.9	176.9	0	0	0	110.6	L755 V763	L755-L761 HydrophobicContact CB-CB 4.3Å; L755-L761 HydrophobicContact CB-CD1 3.63Å; L755-L761 HydrophobicContact CB-CG 3.9Å; L755-L761 HydrophobicContact CD1-CD1 3.62Å; L755-L761 HydrophobicContact CD1-CG 4.26Å; L755-L761 HydrophobicContact CG-CD1 4.28Å; L755-L761 PolarHBondContact O-N 3.31Å; L761-V763 PolarHBondContact O-N 3.45Å
762	P	59.9	Low	66.9	Low	112 Å²	112	112.5 Å²	112.5	73%	0.727	62%	0.615	S	S	*	*			trans	-62.8	127	168.3	26.5	-31.2	0	0	0	108.5	K764	P762-K764 PolarHBondContact O-N 3.15Å; P762-K764 VanDerWaalsContact O-N 3.12Å
763	V	58.2	Low	65.5	Low	94 Å²	94	115.6 Å²	115.6	57%	0.57	63%	0.632	S	S	*	*			trans	-46.3	124.2	171.9	179.6	0	0	0	0	107.7	L761 K765	L761-V763 PolarHBondContact O-N 3.45Å; V763-K765 PolarHBondContact O-N 3.4Å
764	K	55.2	Low	64.1	Low	166 Å²	166	115.4 Å²	115.4	72%	0.722	64%	0.639	S	S	*	*			trans	-62.2	78.5	173.9	-77.5	-179.6	-179.4	170.3	0	109.3	E756 P762 G766	E756-K764 PolarHBondContact OE1-N 2.9Å; P762-K764 PolarHBondContact O-N 3.15Å; P762-K764 VanDerWaalsContact O-N 3.12Å; K764-G766 PolarHBondContact O-N 3.4Å
765	K	45	Very low	62.5	Low	193 Å²	193	119.3 Å²	119.3	84%	0.839	67%	0.666	S	S	*	*			trans	-62.3	106	159.5	-78.5	-173.7	177.4	178.8	0	104.7	V763 K767	V763-K765 PolarHBondContact O-N 3.4Å; K765-K767 PolarHBondContact O-N 3.16Å
766	G	40.1	Very low	60.7	Low	65 Å²	65	124.4 Å²	124.4	67%	0.67	70%	0.695	S	S	*	*			trans	-42.5	126.5	-173.6	0	0	0	0	0	111.5	K764 A768	K764-G766 PolarHBondContact O-N 3.4Å; G766-A768 PolarHBondContact O-N 3.02Å
767	K	39	Very low	58.6	Low	223 Å²	223	129 Å²	129	97%	0.97	73%	0.725	S	S	*	*			trans	-64.6	81.4	157.7	-77	-177.3	175.6	179.1	0	107.2	K765	K765-K767 PolarHBondContact O-N 3.16Å
768	A	45.1	Very low	56.4	Low	88 Å²	88	132.2 Å²	132.2	73%	0.727	73%	0.726	S	S	*	*			trans	-141.5	63.2	170	0	0	0	0	0	107.6	G766	G766-A768 PolarHBondContact O-N 3.02Å
769	K	35.8	Very low	53.9	Low	201 Å²	201	138.3 Å²	138.3	87%	0.874	76%	0.755	S	S	*	*			trans	-174	80.5	159.5	-102.7	176.2	-170.3	-172.3	0	107
770	N	32.1	Very low	51.2	Low	246 Å²	246	145.3 Å²	145.3	100%	1.316	77%	0.767	S	S	*	*			trans	-162.7	0	143.1	-91.9	-5.8	0	0	0	107.3

Retrieved 770 of 770 residues in 388.1 ms (Link to these results)

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