A0A3Q0KSI0_SCHMA Loading...

Macrophage scavenger receptor-related AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KSI0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 565 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	21.1	Very low	22	Very low	260 Å²	260	177.3 Å²	177.3	100%	1.281	84%	0.839	S	S	*	*				0	132.5	0	-97.6	172.4	162.2	0	0	108.3
2	G	21.9	Very low	22.1	Very low	75 Å²	75	172.9 Å²	172.9	77%	0.773	83%	0.833	S	S	*	*			trans	141.3	92.2	172.4	0	0	0	0	0	113.8
3	N	21.1	Very low	22.5	Very low	156 Å²	156	165.1 Å²	165.1	83%	0.834	83%	0.825	S	S	*	*			trans	-54.9	132.7	173.9	-73.2	-44.7	0	0	0	113.2
4	Y	24.7	Very low	23	Very low	222 Å²	222	157.5 Å²	157.5	87%	0.871	81%	0.809	S	S	*	*			trans	-142.8	95.5	153.4	-88.6	-80.5	0	0	0	112
5	L	20.5	Very low	24	Very low	139 Å²	139	150.9 Å²	150.9	73%	0.728	78%	0.779	S	S	*	*			trans	29.8	101.3	141.3	-67	159.5	0	0	0	120.5
6	Q	20.9	Very low	25.3	Very low	124 Å²	124	144.3 Å²	144.3	58%	0.579	75%	0.75	S	S	*	*				25.3	101	115.8	-61.7	-104.9	-19.1	0	0	118.9	W8	Q6-W8 VanDerWaalsContact OE1-NE1 3.08Å
7	H	22.7	Very low	25.7	Very low	159 Å²	159	135.9 Å²	135.9	74%	0.736	71%	0.707	S	S	*	*			trans	-131.2	132.6	148	-75.2	-71.7	0	0	0	111.8	R61	H7-R61 PolarHBondContact O-NH2 2.89Å
8	W	22	Very low	26.6	Very low	204 Å²	204	129.8 Å²	129.8	77%	0.773	68%	0.676	S	S	*	*			trans	-92.1	131.4	-174.2	-65.8	76	0	0	0	110	Q6	Q6-W8 VanDerWaalsContact OE1-NE1 3.08Å
9	V	23.5	Very low	27	Very low	150 Å²	150	124.9 Å²	124.9	91%	0.909	65%	0.651	S	S	*	*			trans	-111.1	99.7	165.7	-178.3	0	0	0	0	107.1
10	R	20.8	Very low	27.1	Very low	221 Å²	221	124.9 Å²	124.9	83%	0.834	64%	0.643	S	S	*	*			trans	-91.6	127.2	175.5	-117.8	-174.3	-170.9	-160	4.2	109
11	R	22.6	Very low	27.1	Very low	240 Å²	240	122.6 Å²	122.6	91%	0.906	64%	0.642	S	S	*	*			trans	17.1	98.6	159.7	-69.1	-173.6	-175.1	-177.7	1.4	116.7
12	T	23.7	Very low	27.2	Very low	125 Å²	125	121.7 Å²	121.7	77%	0.767	63%	0.625	S	S	*	*			trans	-159.6	118.4	145.8	42.8	0	0	0	0	109.7
13	G	27.5	Very low	27.3	Very low	71 Å²	71	122.3 Å²	122.3	73%	0.732	61%	0.613	S	S	*	*			trans	102.2	86.2	166.5	0	0	0	0	0	114.4
14	G	28.6	Very low	27.3	Very low	59 Å²	59	120 Å²	120	61%	0.608	61%	0.605	S	S	*	*			trans	-60.2	135.9	162.8	0	0	0	0	0	109.8
15	V	39.2	Very low	27.2	Very low	58 Å²	58	114.1 Å²	114.1	35%	0.352	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.3	119.2	-179.8	178.7	0	0	0	0	107.7	V18 F56 T96	V15-V18 HydrophobicContact CB-CG2 4.43Å; V15-V18 HydrophobicContact CG1-CG2 3.64Å; V15-F56 HydrophobicContact CB-CB 4.19Å; V15-F56 PolarHBondContact N-O 3.32Å; V15-F56 VanDerWaalsContact N-O 3.09Å; V15-F56 PolarHBondContact O-N 3.26Å; V15-T96 HydrophobicContact CG1-CG2 3.42Å; V15-T96 VanDerWaalsContact CG1-CG2 3.42Å
16	S	43.9	Very low	27.5	Very low	46 Å²	46	116.4 Å²	116.4	32%	0.322	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.1	-33.9	-166.9	61.9	0	0	0	0	114.9	S54 E55 C89	S16-S54 CarbonylContact O-C 3.51Å; S16-S54 WeakPolarHBondContact O-CA 3.29Å; S16-S54 WeakPolarHBondContact O-CB 3.43Å; S16-S54 PolarHBondContact O-OG 3.22Å; S16-E55 PolarHBondContact O-N 3.43Å; S16-C89 PolarHBondContact O-SG 3.3Å; S16-C89 VanDerWaalsContact O-SG 3.41Å
17	C	32.6	Very low	27.6	Very low	2 Å²	2	115.6 Å²	115.6	1%	0.014	61%	0.609	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-155.1	123.5	179	-20.1	0	0	0	0	110.9	L53 C89 T96	C17-L53 WeakPolarHBondContact CA-O 3.16Å; C17-C89 HydrophobicContact CB-CB 4.17Å; C17-C89 WeakPolarHBondContact CB-SG 3.22Å; C17-C89 WeakPolarHBondContact SG-CB 3.4Å; C17-C89 CovalentContact SG-SG 2.07Å; C17-C89 PolarHBondContact SG-SG 3.05Å; C17-T96 VanDerWaalsContact O-CG2 3.23Å; C17-T96 WeakPolarHBondContact O-CG2 3.39Å; C17-T96 PolarHBondContact O-N 3.04Å
18	V	41.4	Very low	27.6	Very low	25 Å²	25	112.6 Å²	112.6	15%	0.152	61%	0.605	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.5	138	-175.7	-173.6	0	0	0	0	111.5	V15 L53 F56 T96	V15-V18 HydrophobicContact CB-CG2 4.43Å; V15-V18 HydrophobicContact CG1-CG2 3.64Å; V18-L53 PolarHBondContact N-O 2.72Å; V18-F56 HydrophobicContact CB-CD2 3.87Å; V18-F56 HydrophobicContact CB-CE2 3.49Å; V18-F56 VanDerWaalsContact CB-CE2 3.49Å; V18-F56 HydrophobicContact CB-CZ 4.12Å; V18-F56 HydrophobicContact CG2-CB 4.37Å; V18-F56 HydrophobicContact CG2-CD2 3.36Å; V18-F56 HydrophobicContact CG2-CE2 3.56Å; V18-F56 HydrophobicContact CG2-CG 3.92Å; V18-F56 HydrophobicContact CG2-CZ 4.32Å; V18-T96 HydrophobicContact CB-CG2 4.31Å; V18-T96 HydrophobicContact CG1-CG2 4.49Å; V18-T96 HydrophobicContact CG2-CG2 3.82Å
19	L	33.8	Very low	27.8	Very low	38 Å²	38	112.8 Å²	112.8	20%	0.199	61%	0.612	C	S	.	*			trans	-91.6	134.5	169.8	-70.6	167.6	0	0	0	111	A21	L19-A21 PolarHBondContact O-N 3.37Å
20	Y	30.1	Very low	28	Very low	124 Å²	124	112.8 Å²	112.8	49%	0.486	61%	0.605	S	S	.	*			trans	-82.8	99.8	167.6	-134.7	-91.7	0	0	0	108.2	L76	Y20-L76 HydrophobicContact CE2-CD1 4.46Å
21	A	26.6	Very low	28.4	Very low	77 Å²	77	111.3 Å²	111.3	64%	0.636	61%	0.605	S	S	*	*			trans	-81.5	128.9	167.9	0	0	0	0	0	108.4	L19 V23	L19-A21 PolarHBondContact O-N 3.37Å; A21-V23 PolarHBondContact O-N 2.64Å
22	W	22.7	Very low	28.7	Very low	240 Å²	240	103.9 Å²	103.9	91%	0.909	59%	0.59	S	S	*	*			trans	-49.5	122.8	-176.6	-73.4	67.4	0	0	0	111.6	V24	W22-V24 PolarHBondContact O-N 3.2Å
23	V	24.1	Very low	29.1	Very low	88 Å²	88	103.3 Å²	103.3	53%	0.533	59%	0.588	S	S	.	*			trans	-70.2	98.1	170	-179.2	0	0	0	0	106.8	A21 S25	A21-V23 PolarHBondContact O-N 2.64Å; V23-S25 PolarHBondContact O-N 3.09Å
24	V	22.5	Very low	29.4	Very low	108 Å²	108	103.9 Å²	103.9	66%	0.655	58%	0.579	S	S	*	*			trans	-73.2	114.4	167.9	-178.3	0	0	0	0	106.9	W22 F26	W22-V24 PolarHBondContact O-N 3.2Å; V24-F26 HydrophobicContact CG1-CD2 4.47Å; V24-F26 HydrophobicContact CG1-CE2 4.27Å; V24-F26 PolarHBondContact O-N 2.83Å
25	S	22.6	Very low	29.7	Very low	99 Å²	99	111.1 Å²	111.1	69%	0.692	59%	0.588	S	S	*	*			trans	-55.5	98.7	177.3	-61.9	0	0	0	0	111.5	V23 S27	V23-S25 PolarHBondContact O-N 3.09Å; S25-S27 PolarHBondContact O-N 3.37Å
26	F	25.9	Very low	29.6	Very low	187 Å²	187	110.3 Å²	110.3	82%	0.82	59%	0.592	S	S	*	*			trans	-90.7	80.3	163.8	-88.4	-87.4	0	0	0	109.2	V24 S28	V24-F26 HydrophobicContact CG1-CD2 4.47Å; V24-F26 HydrophobicContact CG1-CE2 4.27Å; V24-F26 PolarHBondContact O-N 2.83Å; F26-S28 PolarHBondContact O-N 2.74Å
27	S	22.8	Very low	29.1	Very low	107 Å²	107	112.2 Å²	112.2	75%	0.748	60%	0.601	S	S	*	*			trans	-73.9	94	159.3	53	0	0	0	0	107.9	S25	S25-S27 PolarHBondContact O-N 3.37Å
28	S	23.7	Very low	29.2	Very low	95 Å²	95	116.3 Å²	116.3	66%	0.664	63%	0.628	S	S	*	*			trans	144.3	95.7	158.4	-68.2	0	0	0	0	108.9	F26	F26-S28 PolarHBondContact O-N 2.74Å
29	F	25.4	Very low	29	Very low	208 Å²	208	118.3 Å²	118.3	91%	0.912	64%	0.637	S	S	*	*			trans	171.6	99.9	144.7	-96.6	-71.7	0	0	0	107.4	F31	F29-F31 VanDerWaalsContact C-N 3.29Å; F29-F31 PolarHBondContact O-N 2.78Å
30	I	28.4	Very low	29.2	Very low	151 Å²	151	123.7 Å²	123.7	77%	0.774	66%	0.663	S	S	*	*			trans	-81.2	7.8	-166.2	-76.9	170.8	0	0	0	114
31	F	28	Very low	29.7	Very low	190 Å²	190	122.6 Å²	122.6	83%	0.833	67%	0.665	S	S	*	*	S	Bend	trans	-132.4	74.5	-172.9	-72.9	-83.5	0	0	0	112.8	F29	F29-F31 VanDerWaalsContact C-N 3.29Å; F29-F31 PolarHBondContact O-N 2.78Å
32	S	29.8	Very low	30.5	Very low	84 Å²	84	119.6 Å²	119.6	59%	0.587	64%	0.64	S	S	*	*			trans	159.3	136.1	142.7	-74.9	0	0	0	0	110.8
33	P	31	Very low	31.4	Very low	112 Å²	112	116.1 Å²	116.1	73%	0.727	64%	0.638	S	S	*	*			trans	-68.8	137.4	177.5	27.4	-31.9	0	0	0	110.8	R35	P33-R35 PolarHBondContact O-N 3.15Å
34	P	34	Very low	32.3	Very low	83 Å²	83	121.3 Å²	121.3	54%	0.539	65%	0.648	S	S	.	*			trans	-65.5	132	-179.6	25.6	-32.8	0	0	0	110.9	L64	P34-L64 HydrophobicContact CG-CD1 3.77Å
35	R	35.2	Very low	33.1	Very low	212 Å²	212	127 Å²	127	80%	0.8	66%	0.658	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96.5	109.5	169.6	-67.1	-173	179.5	-163.6	1.4	108.3	P33 L101	P33-R35 PolarHBondContact O-N 3.15Å; R35-L101 PolarHBondContact O-N 2.82Å
36	G	36.6	Very low	34	Very low	41 Å²	41	125.7 Å²	125.7	42%	0.423	65%	0.649	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.2	134.2	169.1	0	0	0	0	0	110.2
37	V	34.7	Very low	34.9	Very low	85 Å²	85	121.7 Å²	121.7	52%	0.515	64%	0.644	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.6	126.1	172.1	-176.9	0	0	0	0	108.1	I39 V99	V37-I39 PolarHBondContact O-N 3.4Å; V37-V99 PolarHBondContact N-O 2.79Å
38	P	34.4	Very low	35.9	Very low	89 Å²	89	124 Å²	124	58%	0.578	65%	0.648	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-72.2	128.2	174.2	28.9	-32.2	0	0	0	110.3
39	I	37.6	Very low	37.1	Very low	67 Å²	67	121.7 Å²	121.7	34%	0.344	63%	0.632	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.8	100.7	174.6	-53.4	178	0	0	0	108.1	V37 T96 S97 V99	V37-I39 PolarHBondContact O-N 3.4Å; I39-T96 WeakPolarHBondContact O-CA 2.98Å; I39-T96 PolarHBondContact O-OG1 2.79Å; I39-S97 PolarHBondContact N-O 3.02Å; I39-S97 PolarHBondContact O-N 2.89Å; I39-S97 VanDerWaalsContact O-N 3.08Å; I39-V99 HydrophobicContact CD1-CB 4.27Å; I39-V99 HydrophobicContact CD1-CG2 3.6Å
40	M	36	Very low	38.5	Very low	150 Å²	150	116 Å²	116	74%	0.739	62%	0.617	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-72.2	138.4	171.1	-62.6	-171.4	-73.2	0	0	109.9
41	N	42.4	Very low	39.8	Very low	101 Å²	101	109.4 Å²	109.4	54%	0.54	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	60.9	43	-177.9	-57.5	-9.2	0	0	0	113.9	L43 S93 Q95	N41-L43 PolarHBondContact O-N 3.06Å; N41-S93 PolarHBondContact OD1-O 2.81Å; N41-Q95 VanDerWaalsContact CA-O 3.31Å; N41-Q95 WeakPolarHBondContact CA-O 3.11Å; N41-Q95 PolarHBondContact N-O 2.88Å; N41-Q95 VanDerWaalsContact N-O 3.1Å
42	S	42.2	Very low	41	Very low	15 Å²	15	106 Å²	106	11%	0.105	57%	0.574	C	S	.	*			trans	-68	113.5	178.2	161.5	0	0	0	0	111.5	R44 Q95 S97	S42-R44 PolarHBondContact O-N 2.87Å; S42-R44 PolarHBondContact OG-N 3.29Å; S42-R44 VanDerWaalsContact OG-N 3.16Å; S42-Q95 PolarHBondContact N-O 2.87Å; S42-S97 WeakPolarHBondContact CB-OG 3.26Å; S42-S97 PolarHBondContact OG-OG 2.85Å
43	L	42.4	Very low	42.4	Very low	166 Å²	166	103.6 Å²	103.6	87%	0.869	56%	0.555	S	S	*	*			trans	-68.9	-7.6	165.8	-94.5	88.8	0	0	0	113.5	N41 R45	N41-L43 PolarHBondContact O-N 3.06Å; L43-R45 PolarHBondContact O-N 2.9Å; L43-R45 VanDerWaalsContact O-N 3.09Å
44	R	42.2	Very low	43.8	Very low	197 Å²	197	98.3 Å²	98.3	74%	0.743	52%	0.521	S	S	*	.			trans	-73.6	103.3	178.9	-74.2	-169.6	-174.1	-149.4	2.3	110.4	S42	S42-R44 PolarHBondContact O-N 2.87Å; S42-R44 PolarHBondContact OG-N 3.29Å; S42-R44 VanDerWaalsContact OG-N 3.16Å
45	R	39.6	Very low	45	Very low	228 Å²	228	99.8 Å²	99.8	86%	0.86	52%	0.521	S	S	*	.			trans	-66.8	140.7	176	-67.3	-180	-163.5	170.8	4.6	112.2	L43	L43-R45 PolarHBondContact O-N 2.9Å; L43-R45 VanDerWaalsContact O-N 3.09Å
46	S	42.7	Very low	46.1	Very low	72 Å²	72	90.7 Å²	90.7	50%	0.503	49%	0.487	S	S	.	.				-96.9	121.7	127	163.7	0	0	0	0	105.6	N48 S49	S46-N48 PolarHBondContact O-N 3.01Å; S46-N48 VanDerWaalsContact O-N 3.1Å; S46-S49 WeakPolarHBondContact CB-OG 3.39Å; S46-S49 PolarHBondContact OG-OG 3Å
47	S	43.6	Very low	46.9	Very low	102 Å²	102	93.1 Å²	93.1	71%	0.713	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-10	-175.9	47.1	0	0	0	0	114.1
48	N	44.5	Very low	47.6	Very low	155 Å²	155	92.1 Å²	92.1	83%	0.829	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.6	23	-170.3	-77.3	-1.3	0	0	0	114.5	S46	S46-N48 PolarHBondContact O-N 3.01Å; S46-N48 VanDerWaalsContact O-N 3.1Å
49	S	49.5	Very low	48.1	Very low	47 Å²	47	92.3 Å²	92.3	33%	0.329	49%	0.486	S	S	.	.			trans	-125.4	115.6	175.9	57.7	0	0	0	0	111.9	S46	S46-S49 WeakPolarHBondContact CB-OG 3.39Å; S46-S49 PolarHBondContact OG-OG 3Å
50	S	54.5	Low	48.2	Very low	88 Å²	88	92.6 Å²	92.6	62%	0.615	51%	0.505	S	S	*	.			trans	-73.3	144.8	168.4	30	0	0	0	0	110.7	L52	S50-L52 PolarHBondContact O-N 3.37Å
51	P	55.2	Low	48.2	Very low	13 Å²	13	94.5 Å²	94.5	8%	0.084	50%	0.504	C	S	.	.			trans	-59.9	128.5	170.1	27.1	-33.4	0	0	0	108.8	L85	P51-L85 HydrophobicContact CB-CD2 3.8Å; P51-L85 HydrophobicContact CG-CD2 3.88Å; P51-L85 WeakPolarHBondContact O-CD1 3.38Å
52	L	52.2	Low	48	Very low	118 Å²	118	93.3 Å²	93.3	62%	0.618	50%	0.5	S	S	*	.			trans	-96.9	-26.5	-179.3	-92.4	122.3	0	0	0	112.9	S50	S50-L52 PolarHBondContact O-N 3.37Å
53	L	59.9	Low	47.6	Very low	34 Å²	34	99.6 Å²	99.6	18%	0.178	53%	0.532	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	132.9	-163.2	-65.9	169	0	0	0	109.9	C17 V18 F56 F81 T83	C17-L53 WeakPolarHBondContact CA-O 3.16Å; V18-L53 PolarHBondContact N-O 2.72Å; L53-F56 HydrophobicContact CB-CD2 4.22Å; L53-F56 HydrophobicContact CB-CE2 3.21Å; L53-F56 HydrophobicContact CB-CZ 3.55Å; L53-F56 HydrophobicContact CD1-CE1 4.38Å; L53-F56 HydrophobicContact CD1-CE2 4.07Å; L53-F56 HydrophobicContact CD1-CZ 3.45Å; L53-F56 VanDerWaalsContact CD1-CZ 3.45Å; L53-F56 HydrophobicContact CG-CE2 4.25Å; L53-F56 HydrophobicContact CG-CZ 4.1Å; L53-F81 HydrophobicContact CD2-CD2 3.34Å; L53-F81 HydrophobicContact CD2-CE2 3.51Å; L53-F81 HydrophobicContact CD2-CG 4.06Å; L53-F81 HydrophobicContact CD2-CZ 4.39Å; L53-T83 HydrophobicContact CD2-CG2 4.01Å
54	S	61.2	Low	47.3	Very low	2 Å²	2	96.6 Å²	96.6	1%	0.014	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	165.7	179	179	0	0	0	0	110.9	S16 F56 T82 P86 C89	S16-S54 CarbonylContact O-C 3.51Å; S16-S54 WeakPolarHBondContact O-CA 3.29Å; S16-S54 WeakPolarHBondContact O-CB 3.43Å; S16-S54 PolarHBondContact O-OG 3.22Å; S54-F56 PolarHBondContact O-N 2.97Å; S54-T82 WeakPolarHBondContact CB-OG1 3.06Å; S54-T82 PolarHBondContact N-O 3.46Å; S54-T82 PolarHBondContact O-N 3.39Å; S54-T82 PolarHBondContact O-OG1 2.93Å; S54-P86 WeakPolarHBondContact OG-CD 3.43Å; S54-C89 PolarHBondContact OG-SG 2.88Å
55	E	59	Low	46.8	Very low	114 Å²	114	92.7 Å²	92.7	53%	0.533	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.7	47.4	172.9	-58.5	-176	-177.8	0	0	114.4	S16 N57 T82	S16-E55 PolarHBondContact O-N 3.43Å; E55-N57 PolarHBondContact O-N 2.04Å; E55-N57 VanDerWaalsContact O-N 3.15Å; E55-T82 HydrophobicContact CB-CG2 4.29Å
56	F	58	Low	46.7	Very low	21 Å²	21	88.1 Å²	88.1	9%	0.092	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	117.2	177.2	-88.4	-92.7	0	0	0	111.4	V15 V18 L53 S54 L76 F81	V15-F56 HydrophobicContact CB-CB 4.19Å; V15-F56 PolarHBondContact N-O 3.32Å; V15-F56 VanDerWaalsContact N-O 3.09Å; V15-F56 PolarHBondContact O-N 3.26Å; V18-F56 HydrophobicContact CB-CD2 3.87Å; V18-F56 HydrophobicContact CB-CE2 3.49Å; V18-F56 VanDerWaalsContact CB-CE2 3.49Å; V18-F56 HydrophobicContact CB-CZ 4.12Å; V18-F56 HydrophobicContact CG2-CB 4.37Å; V18-F56 HydrophobicContact CG2-CD2 3.36Å; V18-F56 HydrophobicContact CG2-CE2 3.56Å; V18-F56 HydrophobicContact CG2-CG 3.92Å; V18-F56 HydrophobicContact CG2-CZ 4.32Å; L53-F56 HydrophobicContact CB-CD2 4.22Å; L53-F56 HydrophobicContact CB-CE2 3.21Å; L53-F56 HydrophobicContact CB-CZ 3.55Å; L53-F56 HydrophobicContact CD1-CE1 4.38Å; L53-F56 HydrophobicContact CD1-CE2 4.07Å; L53-F56 HydrophobicContact CD1-CZ 3.45Å; L53-F56 VanDerWaalsContact CD1-CZ 3.45Å; L53-F56 HydrophobicContact CG-CE2 4.25Å; L53-F56 HydrophobicContact CG-CZ 4.1Å; S54-F56 PolarHBondContact O-N 2.97Å; F56-L76 HydrophobicContact CE1-CD2 4.33Å; F56-F81 HydrophobicContact CD1-CB 4.31Å; F56-F81 HydrophobicContact CE1-CB 4.4Å; F56-F81 HydrophobicContact CE1-CD1 4.48Å; F56-F81 HydrophobicContact CG-CB 4.42Å
57	N	52.5	Low	46.3	Very low	92 Å²	92	86.4 Å²	86.4	49%	0.492	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	95.5	172.4	-173.4	10.8	0	0	0	110	E55 C79 S80	E55-N57 PolarHBondContact O-N 2.04Å; E55-N57 VanDerWaalsContact O-N 3.15Å; N57-C79 CarbonylContact O-C 3.5Å; N57-C79 VanDerWaalsContact O-CA 3.23Å; N57-C79 WeakPolarHBondContact O-CA 3.46Å; N57-S80 PolarHBondContact N-O 3.38Å; N57-S80 PolarHBondContact O-N 2.76Å
58	C	50.5	Low	45.9	Very low	64 Å²	64	88 Å²	88	43%	0.432	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	131.2	179.8	-64.2	0	0	0	0	111.5	C79	C58-C79 WeakPolarHBondContact CA-SG 3.17Å; C58-C79 HydrophobicContact CB-CB 4Å; C58-C79 WeakPolarHBondContact CB-SG 3.34Å; C58-C79 WeakPolarHBondContact SG-CB 3Å; C58-C79 CovalentContact SG-SG 2.02Å; C58-C79 PolarHBondContact SG-SG 3.22Å
59	T	43.8	Very low	45.5	Very low	93 Å²	93	87.3 Å²	87.3	57%	0.571	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	127.7	169.1	57.2	0	0	0	0	110.1	V78	T59-V78 PolarHBondContact N-O 3.3Å; T59-V78 PolarHBondContact OG1-O 3.3Å
60	G	40.7	Very low	44.5	Very low	72 Å²	72	89.6 Å²	89.6	74%	0.742	53%	0.53	S	S	*	.	S	Bend	trans	107.3	161.2	172.2	0	0	0	0	0	115.8
61	R	35.5	Very low	43.5	Very low	190 Å²	190	92.5 Å²	92.5	72%	0.717	55%	0.545	S	S	*	.			trans	-82.6	133.1	173.4	-69.5	179.7	177.6	170.2	-2	109.1	H7	H7-R61 PolarHBondContact O-NH2 2.89Å
62	V	37.8	Very low	42.2	Very low	76 Å²	76	95 Å²	95	46%	0.461	57%	0.566	S	S	.	*			trans	-92.4	108	167.3	-177.4	0	0	0	0	107.6	L64 H75	V62-L64 PolarHBondContact O-N 3.45Å; V62-H75 WeakPolarHBondContact CG1-O 3.44Å; V62-H75 WeakPolarHBondContact CG2-O 3.46Å
63	L	34.1	Very low	41.1	Very low	147 Å²	147	93.8 Å²	93.8	77%	0.77	56%	0.564	S	S	*	*			trans	-82.7	109.2	169.1	-83.6	144.8	0	0	0	107.5	T65	L63-T65 VanDerWaalsContact C-N 3.32Å; L63-T65 PolarHBondContact O-N 3.3Å
64	L	37.4	Very low	40.1	Very low	104 Å²	104	95 Å²	95	55%	0.545	57%	0.573	S	S	.	*			trans	-71.1	94.6	163.8	-64.8	171	0	0	0	106.5	P34 V62 T74	P34-L64 HydrophobicContact CG-CD1 3.77Å; V62-L64 PolarHBondContact O-N 3.45Å; L64-T74 HydrophobicContact CD2-CG2 4.22Å
65	T	30.1	Very low	38.8	Very low	114 Å²	114	101.4 Å²	101.4	70%	0.699	60%	0.602	S	S	*	*			trans	-70.8	137.2	172.7	51	0	0	0	0	108.7	L63 G67	L63-T65 VanDerWaalsContact C-N 3.32Å; L63-T65 PolarHBondContact O-N 3.3Å; T65-G67 PolarHBondContact O-N 2.8Å
66	S	37.9	Very low	37.9	Very low	133 Å²	133	99.8 Å²	99.8	93%	0.93	60%	0.597	S	S	*	*	S	Bend	trans	-70.9	74.5	173.2	47.1	0	0	0	0	109.6
67	G	34.4	Very low	37.2	Very low	36 Å²	36	100.1 Å²	100.1	37%	0.371	61%	0.606	S	S	.	*	S	Bend	trans	-138.9	159.7	172.8	0	0	0	0	0	110.2	T65 L69	T65-G67 PolarHBondContact O-N 2.8Å; G67-L69 PolarHBondContact O-N 2.85Å; G67-L69 VanDerWaalsContact O-N 3.14Å
68	P	35.8	Very low	37	Very low	135 Å²	135	101.2 Å²	101.2	88%	0.877	62%	0.616	S	S	*	*			trans	-60.7	119.4	-177.1	24.2	-31.2	0	0	0	110.2	S70	P68-S70 PolarHBondContact O-N 2.04Å; P68-S70 VanDerWaalsContact O-N 3.07Å
69	L	35.1	Very low	37	Very low	140 Å²	140	99.3 Å²	99.3	73%	0.733	60%	0.603	S	S	*	*			trans	-64.8	108.1	179.4	-86.1	84.5	0	0	0	109.5	G67	G67-L69 PolarHBondContact O-N 2.85Å; G67-L69 VanDerWaalsContact O-N 3.14Å
70	S	28.3	Very low	37.6	Very low	95 Å²	95	98.4 Å²	98.4	66%	0.664	60%	0.601	S	S	*	*			trans	-57.2	134.1	156.6	177.2	0	0	0	0	108.1	P68 A72	P68-S70 PolarHBondContact O-N 2.04Å; P68-S70 VanDerWaalsContact O-N 3.07Å; S70-A72 PolarHBondContact O-N 2.79Å
71	T	34.1	Very low	38.6	Very low	149 Å²	149	100 Å²	100	91%	0.914	59%	0.587	S	S	*	*	S	Bend	trans	-63.2	9.1	-176.9	43.3	0	0	0	0	114.9
72	A	27.1	Very low	39.7	Very low	65 Å²	65	93 Å²	93	54%	0.537	57%	0.565	S	S	.	*	S	Bend	trans	-94.9	94.6	170.7	0	0	0	0	0	110.1	S70	S70-A72 PolarHBondContact O-N 2.79Å
73	T	30.3	Very low	40.9	Very low	93 Å²	93	94.1 Å²	94.1	57%	0.571	57%	0.573	S	S	*	*			trans	48.6	110.9	152.4	58.9	0	0	0	0	117.6	H75	T73-H75 PolarHBondContact O-CD2 2.81Å; T73-H75 PolarHBondContact O-N 3.44Å
74	T	37.8	Very low	42.2	Very low	59 Å²	59	95.1 Å²	95.1	36%	0.362	57%	0.573	S	S	.	*			trans	-43.3	97.7	153.2	-2.7	0	0	0	0	109.2	L64 L76	L64-T74 HydrophobicContact CD2-CG2 4.22Å; T74-L76 PolarHBondContact O-N 2.8Å
75	H	33.8	Very low	43.4	Very low	137 Å²	137	93.2 Å²	93.2	63%	0.634	56%	0.564	S	S	*	*			trans	-65.1	100.7	178.9	-89.7	-89.3	0	0	0	108.1	V62 T73 G77	V62-H75 WeakPolarHBondContact CG1-O 3.44Å; V62-H75 WeakPolarHBondContact CG2-O 3.46Å; T73-H75 PolarHBondContact O-CD2 2.81Å; T73-H75 PolarHBondContact O-N 3.44Å; H75-G77 PolarHBondContact O-N 2.76Å
76	L	40.8	Very low	45.1	Very low	81 Å²	81	89.9 Å²	89.9	42%	0.424	54%	0.544	S	S	.	.			trans	-63	85	154	-76.9	88.6	0	0	0	106.2	Y20 F56 T74 C79	Y20-L76 HydrophobicContact CE2-CD1 4.46Å; F56-L76 HydrophobicContact CE1-CD2 4.33Å; T74-L76 PolarHBondContact O-N 2.8Å; L76-C79 VanDerWaalsContact C-SG 3.59Å; L76-C79 PolarHBondContact O-SG 2.86Å
77	G	44.6	Very low	46.5	Very low	27 Å²	27	88.4 Å²	88.4	28%	0.278	53%	0.533	S	S	.	.			trans	36	-151.8	171.3	0	0	0	0	0	117.2	H75	H75-G77 PolarHBondContact O-N 2.76Å
78	V	47.8	Very low	47.8	Very low	115 Å²	115	90.7 Å²	90.7	70%	0.697	54%	0.54	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	104.2	156.7	179	0	0	0	0	105.5	T59	T59-V78 PolarHBondContact N-O 3.3Å; T59-V78 PolarHBondContact OG1-O 3.3Å
79	C	49.9	Very low	49	Very low	24 Å²	24	84.4 Å²	84.4	16%	0.162	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	138.5	175.1	-52.6	0	0	0	0	110.6	N57 C58 L76	N57-C79 CarbonylContact O-C 3.5Å; N57-C79 VanDerWaalsContact O-CA 3.23Å; N57-C79 WeakPolarHBondContact O-CA 3.46Å; C58-C79 WeakPolarHBondContact CA-SG 3.17Å; C58-C79 HydrophobicContact CB-CB 4Å; C58-C79 WeakPolarHBondContact CB-SG 3.34Å; C58-C79 WeakPolarHBondContact SG-CB 3Å; C58-C79 CovalentContact SG-SG 2.02Å; C58-C79 PolarHBondContact SG-SG 3.22Å; L76-C79 VanDerWaalsContact C-SG 3.59Å; L76-C79 PolarHBondContact O-SG 2.86Å
80	S	55.6	Low	50.1	Low	75 Å²	75	83.5 Å²	83.5	52%	0.524	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	144.5	158.7	102.6	0	0	0	0	108.7	N57	N57-S80 PolarHBondContact N-O 3.38Å; N57-S80 PolarHBondContact O-N 2.76Å
81	F	62.1	Low	51.6	Low	104 Å²	104	81 Å²	81	46%	0.456	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	163.9	177.6	55.6	-102.3	0	0	0	109.3	L53 F56 T83	L53-F81 HydrophobicContact CD2-CD2 3.34Å; L53-F81 HydrophobicContact CD2-CE2 3.51Å; L53-F81 HydrophobicContact CD2-CG 4.06Å; L53-F81 HydrophobicContact CD2-CZ 4.39Å; F56-F81 HydrophobicContact CD1-CB 4.31Å; F56-F81 HydrophobicContact CE1-CB 4.4Å; F56-F81 HydrophobicContact CE1-CD1 4.48Å; F56-F81 HydrophobicContact CG-CB 4.42Å; F81-T83 HydrophobicContact CE2-CG2 4.23Å
82	T	58.5	Low	52.6	Low	43 Å²	43	80.3 Å²	80.3	26%	0.264	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	138.7	172.8	59.2	0	0	0	0	110.8	S54 E55	S54-T82 WeakPolarHBondContact CB-OG1 3.06Å; S54-T82 PolarHBondContact N-O 3.46Å; S54-T82 PolarHBondContact O-N 3.39Å; S54-T82 PolarHBondContact O-OG1 2.93Å; E55-T82 HydrophobicContact CB-CG2 4.29Å
83	T	63.5	Low	53.9	Low	101 Å²	101	80.9 Å²	80.9	62%	0.62	47%	0.471	S	S	*	.	S	Bend	trans	-89.8	-19.4	171.3	53	0	0	0	0	112.1	L53 F81 L85	L53-T83 HydrophobicContact CD2-CG2 4.01Å; F81-T83 HydrophobicContact CE2-CG2 4.23Å; T83-L85 PolarHBondContact O-N 2.85Å
84	E	62.2	Low	55.1	Low	167 Å²	167	83.4 Å²	83.4	78%	0.78	47%	0.47	S	S	*	.	S	Bend	trans	-77.3	110.6	170.8	-68.9	-175.2	-178.8	0	0	109.2	P86	E84-P86 WeakPolarHBondContact O-CD 3.48Å
85	L	62.1	Low	55.7	Low	64 Å²	64	82.5 Å²	82.5	34%	0.335	46%	0.462	S	S	.	.			trans	-82.2	119.3	-178.8	-72.6	135.6	0	0	0	110	P51 T83 C89	P51-L85 HydrophobicContact CB-CD2 3.8Å; P51-L85 HydrophobicContact CG-CD2 3.88Å; P51-L85 WeakPolarHBondContact O-CD1 3.38Å; T83-L85 PolarHBondContact O-N 2.85Å; L85-C89 HydrophobicContact CD2-CB 3.97Å
86	P	66.6	Low	56.6	Low	44 Å²	44	76.5 Å²	76.5	29%	0.286	44%	0.435	S	S	.	.			trans	-57.5	145.6	168.5	-20.3	31.9	0	0	0	109.8	S54 E84 T88 C89	S54-P86 WeakPolarHBondContact OG-CD 3.43Å; E84-P86 WeakPolarHBondContact O-CD 3.48Å; P86-T88 PolarHBondContact O-N 2.61Å; P86-C89 WeakPolarHBondContact O-CB 3.38Å; P86-C89 PolarHBondContact O-N 2.9Å
87	S	66	Low	57.1	Low	102 Å²	102	73.8 Å²	73.8	71%	0.713	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-54.7	-23.5	176.6	56.5	0	0	0	0	112.9	L90	S87-L90 WeakPolarHBondContact O-CB 3.35Å; S87-L90 PolarHBondContact O-N 3.33Å
88	T	62.6	Low	57.2	Low	84 Å²	84	77.4 Å²	77.4	52%	0.515	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-72.3	-22	174.6	58	0	0	0	0	114.4	P86 L90 A91	P86-T88 PolarHBondContact O-N 2.61Å; T88-L90 VanDerWaalsContact C-N 3.33Å; T88-A91 WeakPolarHBondContact O-CB 3.3Å; T88-A91 PolarHBondContact O-N 2.93Å
89	C	59.3	Low	57	Low	3 Å²	3	74.5 Å²	74.5	2%	0.02	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-77.9	-17.6	173	-89.1	0	0	0	0	112.8	S16 C17 S54 L85 P86 A91	S16-C89 PolarHBondContact O-SG 3.3Å; S16-C89 VanDerWaalsContact O-SG 3.41Å; C17-C89 HydrophobicContact CB-CB 4.17Å; C17-C89 WeakPolarHBondContact CB-SG 3.22Å; C17-C89 WeakPolarHBondContact SG-CB 3.4Å; C17-C89 CovalentContact SG-SG 2.07Å; C17-C89 PolarHBondContact SG-SG 3.05Å; S54-C89 PolarHBondContact OG-SG 2.88Å; L85-C89 HydrophobicContact CD2-CB 3.97Å; P86-C89 WeakPolarHBondContact O-CB 3.38Å; P86-C89 PolarHBondContact O-N 2.9Å; C89-A91 PolarHBondContact O-N 2.97Å
90	L	58.8	Low	56.6	Low	121 Å²	121	77.8 Å²	77.8	63%	0.634	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-72.6	-16.1	170.4	-63	172.2	0	0	0	111.7	S87 T88 N92	S87-L90 WeakPolarHBondContact O-CB 3.35Å; S87-L90 PolarHBondContact O-N 3.33Å; T88-L90 VanDerWaalsContact C-N 3.33Å; L90-N92 PolarHBondContact O-N 3.48Å
91	A	59.8	Low	55.7	Low	43 Å²	43	78.2 Å²	78.2	36%	0.355	44%	0.435	S	S	.	.	S	Bend	trans	-74	122	174.7	0	0	0	0	0	110.3	T88 C89 S93 R94	T88-A91 WeakPolarHBondContact O-CB 3.3Å; T88-A91 PolarHBondContact O-N 2.93Å; C89-A91 PolarHBondContact O-N 2.97Å; A91-S93 PolarHBondContact O-N 2.84Å; A91-R94 PolarHBondContact O-N 2.78Å
92	N	55.2	Low	54.7	Low	134 Å²	134	80.1 Å²	80.1	72%	0.717	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-53.1	-19	-179.1	-67.1	-13.3	0	0	0	114.6	L90 R94	L90-N92 PolarHBondContact O-N 3.48Å; N92-R94 VanDerWaalsContact C-N 3.32Å; N92-R94 PolarHBondContact O-N 2.77Å
93	S	54.5	Low	53.8	Low	78 Å²	78	83 Å²	83	55%	0.545	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-80.5	-1.1	-177.3	56.9	0	0	0	0	115.1	N41 A91	N41-S93 PolarHBondContact OD1-O 2.81Å; A91-S93 PolarHBondContact O-N 2.84Å
94	R	56	Low	52.6	Low	145 Å²	145	81.6 Å²	81.6	55%	0.547	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-124.1	14.6	-177	-66.8	-155	176	-138.6	1.8	115.8	A91 N92	A91-R94 PolarHBondContact O-N 2.78Å; N92-R94 VanDerWaalsContact C-N 3.32Å; N92-R94 PolarHBondContact O-N 2.77Å
95	Q	50.9	Low	51.3	Low	40 Å²	40	82.6 Å²	82.6	19%	0.187	47%	0.473	C	S	.	.			trans	-87.6	140.3	177.9	-63.4	178	-8	0	0	111.1	N41 S42	N41-Q95 VanDerWaalsContact CA-O 3.31Å; N41-Q95 WeakPolarHBondContact CA-O 3.11Å; N41-Q95 PolarHBondContact N-O 2.88Å; N41-Q95 VanDerWaalsContact N-O 3.1Å; S42-Q95 PolarHBondContact N-O 2.87Å
96	T	51.7	Low	50.1	Low	12 Å²	12	84.9 Å²	84.9	7%	0.074	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	143.7	173.9	-169.3	0	0	0	0	111.4	V15 C17 V18 I39	V15-T96 HydrophobicContact CG1-CG2 3.42Å; V15-T96 VanDerWaalsContact CG1-CG2 3.42Å; C17-T96 VanDerWaalsContact O-CG2 3.23Å; C17-T96 WeakPolarHBondContact O-CG2 3.39Å; C17-T96 PolarHBondContact O-N 3.04Å; V18-T96 HydrophobicContact CB-CG2 4.31Å; V18-T96 HydrophobicContact CG1-CG2 4.49Å; V18-T96 HydrophobicContact CG2-CG2 3.82Å; I39-T96 WeakPolarHBondContact O-CA 2.98Å; I39-T96 PolarHBondContact O-OG1 2.79Å
97	S	51.2	Low	48.6	Very low	24 Å²	24	87.9 Å²	87.9	17%	0.168	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	148.9	173.8	70.1	0	0	0	0	110.3	I39 S42	I39-S97 PolarHBondContact N-O 3.02Å; I39-S97 PolarHBondContact O-N 2.89Å; I39-S97 VanDerWaalsContact O-N 3.08Å; S42-S97 WeakPolarHBondContact CB-OG 3.26Å; S42-S97 PolarHBondContact OG-OG 2.85Å
98	I	46.3	Very low	47	Very low	103 Å²	103	88.6 Å²	88.6	53%	0.528	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	123	175.9	-60.2	171.9	0	0	0	106.9
99	V	44.7	Very low	45.9	Very low	53 Å²	53	90.4 Å²	90.4	32%	0.321	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	121.3	173.7	178	0	0	0	0	108.2	V37 I39 L101	V37-V99 PolarHBondContact N-O 2.79Å; I39-V99 HydrophobicContact CD1-CB 4.27Å; I39-V99 HydrophobicContact CD1-CG2 3.6Å; V99-L101 HydrophobicContact CG1-CD2 4.49Å
100	C	40.1	Very low	44.9	Very low	93 Å²	93	97 Å²	97	63%	0.628	56%	0.559	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.1	132.7	171	-62.5	0	0	0	0	109
101	L	36.9	Very low	43.9	Very low	84 Å²	84	97.1 Å²	97.1	44%	0.44	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.4	133.2	176.4	-64.2	172.3	0	0	0	109.9	R35 V99	R35-L101 PolarHBondContact O-N 2.82Å; V99-L101 HydrophobicContact CG1-CD2 4.49Å
102	D	40.8	Very low	42.8	Very low	145 Å²	145	103.1 Å²	103.1	78%	0.775	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-66.7	142.3	173	-62.1	-38.7	0	0	0	110.8	A104	D102-A104 PolarHBondContact O-N 3.22Å
103	P	40.1	Very low	42.1	Very low	103 Å²	103	101.4 Å²	101.4	67%	0.669	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-66.3	131.2	175.7	25.8	-30.9	0	0	0	110.6
104	A	38.6	Very low	41.4	Very low	72 Å²	72	101.3 Å²	101.3	60%	0.595	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-94	134.7	178.4	0	0	0	0	0	111.6	D102 T106	D102-A104 PolarHBondContact O-N 3.22Å; A104-T106 PolarHBondContact O-N 3.21Å
105	E	34.8	Very low	40.8	Very low	187 Å²	187	100.8 Å²	100.8	87%	0.874	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-69.7	127.7	173	-72.8	-171.6	165.6	0	0	111.2	T107	E105-T107 PolarHBondContact O-N 3.19Å
106	T	36.4	Very low	40.6	Very low	112 Å²	112	104.3 Å²	104.3	69%	0.687	61%	0.613	S	S	*	*			trans	-88.6	99.6	-179.4	-45.8	0	0	0	0	108.8	A104	A104-T106 PolarHBondContact O-N 3.21Å
107	T	36.3	Very low	40.3	Very low	107 Å²	107	110.7 Å²	110.7	66%	0.656	64%	0.643	S	S	*	*			trans	-81.2	120.6	167.7	31.8	0	0	0	0	110	E105	E105-T107 PolarHBondContact O-N 3.19Å
108	T	32.9	Very low	40.1	Very low	117 Å²	117	115.4 Å²	115.4	72%	0.718	67%	0.671	S	S	*	*			trans	-90.2	106.3	170.1	41.1	0	0	0	0	108.9
109	T	38.2	Very low	40.4	Very low	123 Å²	123	113 Å²	113	76%	0.755	66%	0.659	S	S	*	*			trans	-109.8	104.4	164.1	22.1	0	0	0	0	109.3
110	T	37.7	Very low	41	Very low	140 Å²	140	114.5 Å²	114.5	86%	0.859	68%	0.677	S	S	*	*			trans	-88.4	93.5	163.8	49	0	0	0	0	107.8
111	T	38.3	Very low	41.8	Very low	124 Å²	124	114.7 Å²	114.7	76%	0.761	68%	0.677	S	S	*	*			trans	-121.8	132.5	166.4	52.8	0	0	0	0	109.1
112	L	37.8	Very low	43.2	Very low	169 Å²	169	112.4 Å²	112.4	89%	0.885	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-66.8	141.4	178.1	-73	160.6	0	0	0	109.9	P114	L112-P114 WeakPolarHBondContact O-CD 3.34Å
113	A	40	Very low	44.3	Very low	99 Å²	99	110.5 Å²	110.5	82%	0.818	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-61	120.5	179.5	0	0	0	0	0	111.1
114	P	40.2	Very low	45.6	Very low	75 Å²	75	108.4 Å²	108.4	49%	0.487	64%	0.643	S	S	.	*	P	Polyproline II helix	trans	-70.8	149.6	176.7	-14.4	28.1	0	0	0	112.3	L112 Y116 V209	L112-P114 WeakPolarHBondContact O-CD 3.34Å; P114-Y116 PolarHBondContact O-N 2.9Å; P114-V209 HydrophobicContact CG-CG1 4.03Å
115	N	43.1	Very low	46.8	Very low	134 Å²	134	112 Å²	112	72%	0.717	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-62.8	116.1	165.8	-93.5	-27	0	0	0	109.7	M117	N115-M117 PolarHBondContact O-N 3.06Å
116	Y	47	Very low	47.8	Very low	115 Å²	115	106 Å²	106	45%	0.451	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.9	-4.5	-173	38.8	-92.9	0	0	0	115.5	P114 T393	P114-Y116 PolarHBondContact O-N 2.9Å; Y116-T393 HydrophobicContact CE1-CG2 4.02Å
117	M	45.5	Very low	48.6	Very low	146 Å²	146	106.4 Å²	106.4	72%	0.719	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-10	-172.2	-104.7	176.9	-169.6	0	0	115.8	N115	N115-M117 PolarHBondContact O-N 3.06Å
118	T	46	Very low	49.2	Very low	123 Å²	123	107.4 Å²	107.4	76%	0.755	64%	0.64	S	S	*	*			trans	-143.1	73.4	-175.3	50.3	0	0	0	0	112.2
119	L	53.4	Low	50	Low	53 Å²	53	107.9 Å²	107.9	28%	0.277	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-98.7	150.7	160.6	-76.6	95.7	0	0	0	109.2	N210	L119-N210 HydrophobicContact CD2-CB 3.9Å
120	A	56.6	Low	50.9	Low	84 Å²	84	103.1 Å²	103.1	69%	0.694	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-60.7	142.5	-178.2	0	0	0	0	0	112
121	P	56.9	Low	52.9	Low	96 Å²	96	99.6 Å²	99.6	62%	0.623	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-58.4	142.2	176.7	-22.6	32.2	0	0	0	112.2	D179	P121-D179 WeakPolarHBondContact CB-OD1 3.21Å
122	V	65.8	Low	55.2	Low	37 Å²	37	94.7 Å²	94.7	22%	0.224	55%	0.551	C	S	.	*	P	Polyproline II helix	trans	-82.6	134.4	174.7	179	0	0	0	0	109.9	C124 R172	V122-C124 PolarHBondContact O-N 3.13Å; V122-C124 VanDerWaalsContact O-N 3.12Å; V122-C124 PolarHBondContact O-SG 3.23Å; V122-R172 HydrophobicContact CG2-CB 3.95Å; V122-R172 HydrophobicContact CG2-CG 3.94Å
123	N	65	Low	57.7	Low	105 Å²	105	91.5 Å²	91.5	56%	0.561	53%	0.527	S	S	*	.			trans	-72.4	104.1	175.7	-175	0.6	0	0	0	110.3	N125 S126	N123-N125 PolarHBondContact O-N 3.15Å; N123-N125 WeakPolarHBondContact OD1-CB 3.39Å; N123-N125 PolarHBondContact OD1-N 3.47Å; N123-N125 VanDerWaalsContact OD1-N 3.1Å; N123-S126 PolarHBondContact O-OG 2.81Å
124	C	66.1	Low	60.1	Low	58 Å²	58	88.2 Å²	88.2	39%	0.392	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-2.5	-178.1	-57.1	0	0	0	0	113.7	V122 C175	V122-C124 PolarHBondContact O-N 3.13Å; V122-C124 VanDerWaalsContact O-N 3.12Å; V122-C124 PolarHBondContact O-SG 3.23Å; C124-C175 HydrophobicContact CB-CB 4.01Å; C124-C175 VanDerWaalsContact SG-CB 3.58Å
125	N	64.2	Low	62.5	Low	148 Å²	148	86.1 Å²	86.1	79%	0.791	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-9.5	179.7	-65.9	-9.1	0	0	0	113.5	N123 S127	N123-N125 PolarHBondContact O-N 3.15Å; N123-N125 WeakPolarHBondContact OD1-CB 3.39Å; N123-N125 PolarHBondContact OD1-N 3.47Å; N123-N125 VanDerWaalsContact OD1-N 3.1Å; N125-S127 PolarHBondContact O-N 3.44Å
126	S	57.5	Low	64.6	Low	62 Å²	62	85 Å²	85	43%	0.434	48%	0.476	S	S	.	.			trans	-87.9	104.6	175.9	61.8	0	0	0	0	110.3	N123 D128	N123-S126 PolarHBondContact O-OG 2.81Å; S126-D128 PolarHBondContact O-N 2.87Å; S126-D128 VanDerWaalsContact O-N 3.09Å
127	S	53.1	Low	66.4	Low	119 Å²	119	81.9 Å²	81.9	83%	0.832	48%	0.479	S	S	*	.			trans	-72.3	11.6	173.2	54.2	0	0	0	0	114.3	N125 Y129	N125-S127 PolarHBondContact O-N 3.44Å; S127-Y129 PolarHBondContact O-N 3.46Å
128	D	48	Very low	68.3	Low	129 Å²	129	77.9 Å²	77.9	69%	0.69	46%	0.463	S	S	*	.			trans	-95.1	12	-156	-118.3	4.6	0	0	0	116.2	S126	S126-D128 PolarHBondContact O-N 2.87Å; S126-D128 VanDerWaalsContact O-N 3.09Å
129	Y	50.7	Low	70	Confident	127 Å²	127	78.5 Å²	78.5	50%	0.498	46%	0.461	S	S	.	.	S	Bend	trans	-133.4	132.7	-177.6	-57.9	-63.8	0	0	0	113	S127 S131 N215	S127-Y129 PolarHBondContact O-N 3.46Å; Y129-S131 PolarHBondContact O-N 3.47Å; Y129-N215 WeakPolarHBondContact CD1-ND2 3.35Å; Y129-N215 WeakPolarHBondContact CE1-ND2 3.48Å
130	S	55.4	Low	71.5	Confident	22 Å²	22	78.1 Å²	78.1	15%	0.154	46%	0.46	C	S	.	.			trans	-9.3	103.6	177.8	-50.6	0	0	0	0	114.3	I132 M173	S130-I132 PolarHBondContact O-N 2.92Å; S130-M173 WeakPolarHBondContact O-CE 3.06Å
131	S	79.9	Confident	73	Confident	67 Å²	67	74.3 Å²	74.3	47%	0.469	43%	0.428	S	S	.	.			trans	-55.5	117	-177.2	-50.5	0	0	0	0	110.7	Y129 K147 W154	Y129-S131 PolarHBondContact O-N 3.47Å; S131-K147 WeakPolarHBondContact O-CB 3.42Å; S131-K147 PolarHBondContact O-N 3.43Å; S131-W154 WeakPolarHBondContact O-CZ3 3.42Å
132	I	88.1	Confident	74.6	Confident	21 Å²	21	69.7 Å²	69.7	11%	0.108	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	145.1	169.3	170	172.9	0	0	0	108.5	S130 V144 E145 L170 M173 L174 L237	S130-I132 PolarHBondContact O-N 2.92Å; I132-V144 HydrophobicContact CD1-CG1 3.81Å; I132-V144 HydrophobicContact CG1-CG1 4.2Å; I132-E145 CarbonylContact C-O 3.51Å; I132-E145 WeakPolarHBondContact CA-O 3.34Å; I132-L170 HydrophobicContact CD1-CB 3.68Å; I132-L170 HydrophobicContact CD1-CD1 4Å; I132-L170 HydrophobicContact CD1-CD2 4.14Å; I132-L170 HydrophobicContact CD1-CG 4.15Å; I132-M173 HydrophobicContact CG2-CB 3.58Å; I132-M173 HydrophobicContact CG2-CE 4.16Å; I132-L174 HydrophobicContact CD1-CD1 4.28Å; I132-L174 HydrophobicContact CD1-CD2 4.45Å; I132-L174 HydrophobicContact CD1-CG 4.13Å; I132-L174 HydrophobicContact CG1-CD2 4.06Å; I132-L174 HydrophobicContact CG1-CG 4.26Å; I132-L174 HydrophobicContact CG2-CD2 4.1Å; I132-L174 HydrophobicContact CG2-CG 4.14Å; I132-L237 HydrophobicContact CD1-CD2 4.49Å
133	R	90.1	Very high	75.8	Confident	101 Å²	101	68.5 Å²	68.5	38%	0.381	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	156.3	168	71.2	-176.6	-178.8	-179.9	1.1	111.2	V135 E145 W154	R133-V135 HydrophobicContact CG-CG2 3.93Å; R133-E145 HydrophobicContact CG-CB 3.9Å; R133-E145 IonicContact CZ-OE2 3.19Å; R133-E145 PolarHBondContact N-O 3.25Å; R133-E145 IonicContact NE-OE2 3.83Å; R133-E145 PolarHBondContact NE-OE2 3.23Å; R133-E145 IonicContact NH2-OE2 2.67Å; R133-E145 PolarHBondContact NH2-OE2 2.8Å; R133-E145 PolarHBondContact O-N 3.33Å; R133-W154 HydrophobicContact CB-CH2 4.02Å; R133-W154 HydrophobicContact CB-CZ3 3.99Å; R133-W154 HydrophobicContact CG-CE3 3.92Å; R133-W154 HydrophobicContact CG-CH2 3.87Å; R133-W154 HydrophobicContact CG-CZ3 3.5Å; R133-W154 VanDerWaalsContact CG-CZ3 3.5Å
134	L	90.5	Very high	77.1	Confident	30 Å²	30	63.5 Å²	63.5	16%	0.157	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	128.8	170.9	-61.5	-177.6	0	0	0	109.2	A141 R143 V144 L174 L237	L134-A141 VanDerWaalsContact CD1-N 3.29Å; L134-R143 WeakPolarHBondContact CA-O 3.42Å; L134-V144 HydrophobicContact CD2-CG2 4.21Å; L134-L174 HydrophobicContact CD1-CD1 3.55Å; L134-L174 HydrophobicContact CD2-CD1 3.88Å; L134-L174 HydrophobicContact CG-CD1 3.61Å; L134-L174 HydrophobicContact CG-CD2 4.15Å; L134-L237 HydrophobicContact CD2-CB 4.03Å; L134-L237 HydrophobicContact CD2-CD2 4.37Å
135	V	90.2	Very high	78.4	Confident	32 Å²	32	61.3 Å²	61.3	19%	0.194	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	150.4	-178.1	-171.8	0	0	0	0	110.2	R133 G137 G142 R143 E145	R133-V135 HydrophobicContact CG-CG2 3.93Å; V135-G137 VanDerWaalsContact C-N 3.27Å; V135-G137 PolarHBondContact O-N 2.98Å; V135-G142 CarbonylContact O-C 3.55Å; V135-G142 WeakPolarHBondContact O-CA 3.45Å; V135-R143 VanDerWaalsContact CG1-NH2 3.35Å; V135-R143 PolarHBondContact N-O 2.76Å; V135-R143 PolarHBondContact O-N 2.57Å; V135-E145 HydrophobicContact CG2-CB 4.36Å; V135-E145 VanDerWaalsContact CG2-CD 3.48Å; V135-E145 HydrophobicContact CG2-CG 4.02Å
136	D	87.7	Confident	79.7	Confident	109 Å²	109	54.3 Å²	54.3	58%	0.583	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	58	32.4	179.2	-57.9	-35.7	0	0	0	114.9	R143 Y191	D136-R143 IonicContact OD2-CZ 2.88Å; D136-R143 IonicContact OD2-NH1 2.81Å; D136-R143 PolarHBondContact OD2-NH1 3.47Å; D136-R143 IonicContact OD2-NH2 3.19Å; D136-R143 PolarHBondContact OD2-NH2 2.82Å; D136-Y191 WeakPolarHBondContact O-CD1 3.43Å
137	G	84.4	Confident	81.2	Confident	50 Å²	50	54.1 Å²	54.1	52%	0.515	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	-137.1	173.1	0	0	0	0	0	112.9	V135 A141	V135-G137 VanDerWaalsContact C-N 3.27Å; V135-G137 PolarHBondContact O-N 2.98Å; G137-A141 CarbonylContact C-O 3.56Å; G137-A141 WeakPolarHBondContact CA-O 3.4Å
138	T	84.8	Confident	82.9	Confident	63 Å²	63	49.4 Å²	49.4	39%	0.387	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	175	178.1	70.4	0	0	0	0	111	N140 A141	T138-N140 PolarHBondContact O-N 3.2Å; T138-N140 PolarHBondContact OG1-N 2.79Å; T138-A141 PolarHBondContact N-O 3.34Å; T138-A141 PolarHBondContact O-N 2.85Å; T138-A141 VanDerWaalsContact O-N 3.16Å; T138-A141 PolarHBondContact OG1-N 2.86Å; T138-A141 VanDerWaalsContact OG1-N 3.14Å
139	N	81.7	Confident	84.5	Confident	135 Å²	135	46.6 Å²	46.6	72%	0.722	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-15.6	173.1	-63.2	-13.8	0	0	0	113.8	T176	N139-T176 PolarHBondContact O-OG1 3.21Å
140	N	85.4	Confident	86.1	Confident	45 Å²	45	48.6 Å²	48.6	24%	0.241	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.8	2	-176.5	-62.3	1.3	0	0	0	112.6	T138 T176 C239 G240	T138-N140 PolarHBondContact O-N 3.2Å; T138-N140 PolarHBondContact OG1-N 2.79Å; N140-T176 WeakPolarHBondContact OD1-CB 3.39Å; N140-T176 PolarHBondContact OD1-OG1 3.31Å; N140-C239 WeakPolarHBondContact O-CA 3.21Å; N140-C239 PolarHBondContact O-N 3.17Å; N140-G240 PolarHBondContact O-N 2.99Å
141	A	87.8	Confident	87.6	Confident	4 Å²	4	51 Å²	51	3%	0.033	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	123.8	-176.4	0	0	0	0	0	111.3	L134 G137 T138 Y191 L237 Q238	L134-A141 VanDerWaalsContact CD1-N 3.29Å; G137-A141 CarbonylContact C-O 3.56Å; G137-A141 WeakPolarHBondContact CA-O 3.4Å; T138-A141 PolarHBondContact N-O 3.34Å; T138-A141 PolarHBondContact O-N 2.85Å; T138-A141 VanDerWaalsContact O-N 3.16Å; T138-A141 PolarHBondContact OG1-N 2.86Å; T138-A141 VanDerWaalsContact OG1-N 3.14Å; A141-Y191 HydrophobicContact CB-CE1 4.48Å; A141-Y191 WeakPolarHBondContact CB-OH 3.47Å; A141-L237 CarbonylContact C-O 3.58Å; A141-L237 VanDerWaalsContact CA-O 3.23Å; A141-L237 WeakPolarHBondContact CA-O 3.37Å; A141-Q238 VanDerWaalsContact CB-OE1 3.28Å
142	G	89.8	Confident	88	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.7	177.6	179.7	0	0	0	0	0	113.8	V135 Y191 G236 L237	V135-G142 CarbonylContact O-C 3.55Å; V135-G142 WeakPolarHBondContact O-CA 3.45Å; G142-Y191 VanDerWaalsContact CA-CE2 3.42Å; G142-Y191 VanDerWaalsContact N-CE2 3.26Å; G142-Y191 WeakPolarHBondContact O-CD2 3.48Å; G142-G236 CarbonylContact O-C 3.42Å; G142-G236 VanDerWaalsContact O-CA 3.29Å; G142-G236 WeakPolarHBondContact O-CA 3.48Å; G142-L237 PolarHBondContact N-O 2.65Å; G142-L237 PolarHBondContact O-N 2.73Å
143	R	91.4	Very high	88.1	Confident	12 Å²	12	56.8 Å²	56.8	5%	0.045	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	134.8	170	-176.8	175.5	59.5	-99.4	-2.1	109.3	L134 V135 D136 E145 Y191 D234	L134-R143 WeakPolarHBondContact CA-O 3.42Å; V135-R143 VanDerWaalsContact CG1-NH2 3.35Å; V135-R143 PolarHBondContact N-O 2.76Å; V135-R143 PolarHBondContact O-N 2.57Å; D136-R143 IonicContact OD2-CZ 2.88Å; D136-R143 IonicContact OD2-NH1 2.81Å; D136-R143 PolarHBondContact OD2-NH1 3.47Å; D136-R143 IonicContact OD2-NH2 3.19Å; D136-R143 PolarHBondContact OD2-NH2 2.82Å; R143-E145 IonicContact NE-OE1 3.81Å; R143-E145 IonicContact NH2-OE1 3.6Å; R143-E145 PolarHBondContact O-N 2.84Å; R143-Y191 PolarHBondContact NH1-O 3.5Å; R143-D234 HydrophobicContact CG-CB 4.26Å
144	V	92.2	Very high	88.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	120.3	-177.5	-177.7	0	0	0	0	110.4	I132 L134 I157 L170 I235 L237	I132-V144 HydrophobicContact CD1-CG1 3.81Å; I132-V144 HydrophobicContact CG1-CG1 4.2Å; L134-V144 HydrophobicContact CD2-CG2 4.21Å; V144-I157 HydrophobicContact CG1-CD1 3.76Å; V144-I157 HydrophobicContact CG1-CG1 4.26Å; V144-L170 HydrophobicContact CG1-CD1 3.79Å; V144-I235 HydrophobicContact CB-CG2 4.32Å; V144-I235 HydrophobicContact CG2-CG2 4.35Å; V144-I235 PolarHBondContact N-O 2.71Å; V144-L237 HydrophobicContact CG2-CB 3.41Å; V144-L237 VanDerWaalsContact CG2-CB 3.41Å; V144-L237 HydrophobicContact CG2-CD2 4.24Å; V144-L237 HydrophobicContact CG2-CG 4.42Å
145	E	93.3	Very high	88.3	Confident	11 Å²	11	54.2 Å²	54.2	5%	0.051	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.3	167.2	-70.3	-178.5	-167.7	0	0	110.3	I132 R133 V135 R143 W154 G155 T156	I132-E145 CarbonylContact C-O 3.51Å; I132-E145 WeakPolarHBondContact CA-O 3.34Å; R133-E145 HydrophobicContact CG-CB 3.9Å; R133-E145 IonicContact CZ-OE2 3.19Å; R133-E145 PolarHBondContact N-O 3.25Å; R133-E145 IonicContact NE-OE2 3.83Å; R133-E145 PolarHBondContact NE-OE2 3.23Å; R133-E145 IonicContact NH2-OE2 2.67Å; R133-E145 PolarHBondContact NH2-OE2 2.8Å; R133-E145 PolarHBondContact O-N 3.33Å; V135-E145 HydrophobicContact CG2-CB 4.36Å; V135-E145 VanDerWaalsContact CG2-CD 3.48Å; V135-E145 HydrophobicContact CG2-CG 4.02Å; R143-E145 IonicContact NE-OE1 3.81Å; R143-E145 IonicContact NH2-OE1 3.6Å; R143-E145 PolarHBondContact O-N 2.84Å; E145-W154 HydrophobicContact CB-CE3 4.07Å; E145-G155 CarbonylContact C-O 3.52Å; E145-G155 VanDerWaalsContact CA-O 3.28Å; E145-G155 WeakPolarHBondContact CA-O 2.99Å; E145-T156 HydrophobicContact CG-CG2 4.19Å
146	V	91.5	Very high	88.4	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.012	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	138.8	179.8	64.3	0	0	0	0	110	G155 I157 H201 L202 L214 W223	V146-G155 PolarHBondContact N-O 3.2Å; V146-G155 PolarHBondContact O-N 3.13Å; V146-I157 HydrophobicContact CB-CD1 4.37Å; V146-I157 HydrophobicContact CG1-CD1 4.16Å; V146-I157 HydrophobicContact CG1-CG1 3.9Å; V146-H201 HydrophobicContact CG1-CB 4.12Å; V146-H201 PolarHBondContact O-CD2 3.28Å; V146-L202 HydrophobicContact CG1-CD1 4.11Å; V146-L214 HydrophobicContact CG2-CD2 4.05Å; V146-W223 HydrophobicContact CG1-CH2 4.41Å; V146-W223 HydrophobicContact CG1-CZ3 4.05Å; V146-W223 HydrophobicContact CG2-CH2 3.74Å; V146-W223 HydrophobicContact CG2-CZ3 4.16Å
147	K	89.7	Confident	88.6	Confident	58 Å²	58	47.5 Å²	47.5	25%	0.252	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	124.2	176.1	-161.6	-179.2	-171.4	-162.6	0	110.4	S131 N152 W154	S131-K147 WeakPolarHBondContact O-CB 3.42Å; S131-K147 PolarHBondContact O-N 3.43Å; K147-N152 WeakPolarHBondContact CE-O 3.07Å; K147-N152 WeakPolarHBondContact CE-OD1 3.45Å; K147-N152 PolarHBondContact NZ-OD1 3.07Å; K147-W154 HydrophobicContact CB-CD2 4.24Å; K147-W154 HydrophobicContact CB-CE3 4.02Å; K147-W154 HydrophobicContact CB-CH2 4.16Å; K147-W154 HydrophobicContact CB-CZ2 4.37Å; K147-W154 HydrophobicContact CB-CZ3 3.98Å; K147-W154 HydrophobicContact CD-CZ2 4.28Å; K147-W154 HydrophobicContact CG-CD2 4.43Å
148	H	88.3	Confident	88.6	Confident	20 Å²	20	45.2 Å²	45.2	9%	0.093	23%	0.232	C	C	.	.			trans	-66.5	129.7	176.9	-173.7	-59.9	0	0	0	110.8	Q150 T151 N152 Q153 H201 W223	H148-Q150 PolarHBondContact ND1-N 3.18Å; H148-Q150 PolarHBondContact O-N 3.18Å; H148-T151 VanDerWaalsContact CB-OG1 3.29Å; H148-T151 WeakPolarHBondContact CB-OG1 3.2Å; H148-T151 VanDerWaalsContact CG-OG1 3.29Å; H148-T151 PolarHBondContact ND1-N 2.86Å; H148-T151 PolarHBondContact ND1-OG1 3.41Å; H148-N152 VanDerWaalsContact O-CA 3.24Å; H148-N152 WeakPolarHBondContact O-CA 3.34Å; H148-N152 PolarHBondContact O-N 3.09Å; H148-Q153 PolarHBondContact N-O 3.03Å; H148-H201 AromaticContact CD2-CE1 3.91Å; H148-H201 AromaticContact CD2-ND1 3.83Å; H148-W223 HydrophobicContact CB-CE3 4.11Å; H148-W223 HydrophobicContact CB-CZ3 4.15Å; H148-W223 AromaticContact CD2-CE3 3.57Å; H148-W223 AromaticContact CG-CE3 3.89Å; H148-W223 WeakPolarHBondContact NE2-CB 3.38Å; H148-W223 AromaticContact NE2-CG 3.9Å
149	P	82.5	Confident	88.5	Confident	69 Å²	69	42.7 Å²	42.7	45%	0.448	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-39	-171.6	22	-33.1	0	0	0	113.4	W223	P149-W223 HydrophobicContact CG-CD2 4.42Å; P149-W223 HydrophobicContact CG-CZ2 3.93Å
150	Q	84.2	Confident	88.5	Confident	170 Å²	170	37.2 Å²	37.2	79%	0.794	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-47.4	-179	-57.3	174	-18.5	0	0	113.8	H148	H148-Q150 PolarHBondContact ND1-N 3.18Å; H148-Q150 PolarHBondContact O-N 3.18Å
151	T	86.7	Confident	88.2	Confident	72 Å²	72	36.8 Å²	36.8	44%	0.442	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-11.9	-176	62.3	0	0	0	0	113.8	H148 Q153	H148-T151 VanDerWaalsContact CB-OG1 3.29Å; H148-T151 WeakPolarHBondContact CB-OG1 3.2Å; H148-T151 VanDerWaalsContact CG-OG1 3.29Å; H148-T151 PolarHBondContact ND1-N 2.86Å; H148-T151 PolarHBondContact ND1-OG1 3.41Å; T151-Q153 PolarHBondContact O-N 3.31Å; T151-Q153 VanDerWaalsContact O-N 3.11Å; T151-Q153 PolarHBondContact OG1-N 3.44Å
152	N	87.1	Confident	88.1	Confident	95 Å²	95	36.7 Å²	36.7	51%	0.508	19%	0.193	S	C	.	.			trans	57.1	17.6	-173.2	-80	-74.8	0	0	0	114.6	K147 H148	K147-N152 WeakPolarHBondContact CE-O 3.07Å; K147-N152 WeakPolarHBondContact CE-OD1 3.45Å; K147-N152 PolarHBondContact NZ-OD1 3.07Å; H148-N152 VanDerWaalsContact O-CA 3.24Å; H148-N152 WeakPolarHBondContact O-CA 3.34Å; H148-N152 PolarHBondContact O-N 3.09Å
153	Q	91	Very high	87.7	Confident	115 Å²	115	38.1 Å²	38.1	54%	0.537	20%	0.201	S	C	.	.			trans	-88.8	137.2	179.2	-67.3	178.5	-1.9	0	0	111.4	H148 T151 H201	H148-Q153 PolarHBondContact N-O 3.03Å; T151-Q153 PolarHBondContact O-N 3.31Å; T151-Q153 VanDerWaalsContact O-N 3.11Å; T151-Q153 PolarHBondContact OG1-N 3.44Å; Q153-H201 PolarHBondContact O-NE2 2.83Å
154	W	92.5	Very high	87.4	Confident	77 Å²	77	38.3 Å²	38.3	29%	0.292	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	142	170.8	-68.4	101.4	0	0	0	110.7	S131 R133 E145 K147 P199	S131-W154 WeakPolarHBondContact O-CZ3 3.42Å; R133-W154 HydrophobicContact CB-CH2 4.02Å; R133-W154 HydrophobicContact CB-CZ3 3.99Å; R133-W154 HydrophobicContact CG-CE3 3.92Å; R133-W154 HydrophobicContact CG-CH2 3.87Å; R133-W154 HydrophobicContact CG-CZ3 3.5Å; R133-W154 VanDerWaalsContact CG-CZ3 3.5Å; E145-W154 HydrophobicContact CB-CE3 4.07Å; K147-W154 HydrophobicContact CB-CD2 4.24Å; K147-W154 HydrophobicContact CB-CE3 4.02Å; K147-W154 HydrophobicContact CB-CH2 4.16Å; K147-W154 HydrophobicContact CB-CZ2 4.37Å; K147-W154 HydrophobicContact CB-CZ3 3.98Å; K147-W154 HydrophobicContact CD-CZ2 4.28Å; K147-W154 HydrophobicContact CG-CD2 4.43Å; W154-P199 WeakPolarHBondContact O-CD 3.33Å; W154-P199 WeakPolarHBondContact O-CG 3.12Å
155	G	92.6	Very high	87.1	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	168.9	173.9	0	0	0	0	0	111.8	E145 V146 P199 H201	E145-G155 CarbonylContact C-O 3.52Å; E145-G155 VanDerWaalsContact CA-O 3.28Å; E145-G155 WeakPolarHBondContact CA-O 2.99Å; V146-G155 PolarHBondContact N-O 3.2Å; V146-G155 PolarHBondContact O-N 3.13Å; G155-P199 CarbonylContact C-O 3.39Å; G155-P199 WeakPolarHBondContact CA-O 2.98Å; G155-H201 WeakPolarHBondContact CA-CD2 3.26Å; G155-H201 PolarHBondContact N-CD2 2.91Å; G155-H201 VanDerWaalsContact N-CD2 3.33Å; G155-H201 PolarHBondContact N-NE2 3.47Å
156	T	91.5	Very high	86.9	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	168	-173.9	61.4	0	0	0	0	112.2	E145 A194 T198 P199 H201 D234	E145-T156 HydrophobicContact CG-CG2 4.19Å; T156-A194 HydrophobicContact CG2-CB 3.52Å; T156-T198 HydrophobicContact CG2-CG2 4.21Å; T156-P199 PolarHBondContact N-O 2.78Å; T156-H201 PolarHBondContact O-N 3.04Å; T156-D234 WeakPolarHBondContact CB-OD1 3.5Å; T156-D234 HydrophobicContact CG2-CB 4.46Å; T156-D234 PolarHBondContact OG1-OD1 3.29Å
157	I	91.5	Very high	86.7	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	132.5	172.1	-56.5	-178.4	0	0	0	108.3	V144 V146 F162 L170 L202 L205 I235	V144-I157 HydrophobicContact CG1-CD1 3.76Å; V144-I157 HydrophobicContact CG1-CG1 4.26Å; V146-I157 HydrophobicContact CB-CD1 4.37Å; V146-I157 HydrophobicContact CG1-CD1 4.16Å; V146-I157 HydrophobicContact CG1-CG1 3.9Å; I157-F162 HydrophobicContact CG2-CD2 3.75Å; I157-F162 HydrophobicContact CG2-CE2 4.1Å; I157-L170 HydrophobicContact CD1-CD1 3.77Å; I157-L202 HydrophobicContact CD1-CD1 4.25Å; I157-L202 HydrophobicContact CG1-CB 4.35Å; I157-L202 HydrophobicContact CG1-CD1 4.35Å; I157-L202 HydrophobicContact CG2-CB 4.25Å; I157-L205 HydrophobicContact CD1-CD1 4.31Å; I157-L205 HydrophobicContact CG2-CD1 3.77Å; I157-L205 HydrophobicContact CG2-CG 4.47Å; I157-I235 HydrophobicContact CB-CG2 3.92Å; I157-I235 HydrophobicContact CG2-CG2 4.1Å; I157-I235 WeakPolarHBondContact O-CG2 3.39Å; I157-I235 PolarHBondContact O-N 3.06Å
158	C	84.7	Confident	86.6	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.007	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-76.5	141.7	176.4	-175.2	0	0	0	0	111.1	D160 I200 L202 C229	C158-D160 PolarHBondContact O-N 3.27Å; C158-I200 HydrophobicContact CB-CG2 4Å; C158-L202 WeakPolarHBondContact CB-O 2.94Å; C158-L202 PolarHBondContact N-O 3.1Å; C158-C229 HydrophobicContact CB-CB 3.7Å; C158-C229 WeakPolarHBondContact CB-SG 3.4Å; C158-C229 WeakPolarHBondContact SG-CB 3.3Å; C158-C229 CovalentContact SG-SG 2.04Å; C158-C229 PolarHBondContact SG-SG 2.81Å
159	A	83.4	Confident	86.5	Confident	10 Å²	10	37.4 Å²	37.4	8%	0.083	20%	0.199	C	C	.	.	S	Bend	trans	-64.1	-18.7	176	0	0	0	0	0	114.6	G161 F162 L188 M233 I235	A159-G161 PolarHBondContact O-N 2.91Å; A159-G161 VanDerWaalsContact O-N 3.09Å; A159-F162 PolarHBondContact O-N 3.33Å; A159-L188 HydrophobicContact CB-CD2 3.51Å; A159-M233 HydrophobicContact CB-CB 4.46Å; A159-M233 VanDerWaalsContact CB-O 3.29Å; A159-M233 WeakPolarHBondContact CB-O 3.48Å; A159-M233 PolarHBondContact N-O 2.98Å; A159-I235 HydrophobicContact CB-CB 4.4Å; A159-I235 HydrophobicContact CB-CD1 3.98Å
160	D	81.3	Confident	86.8	Confident	20 Å²	20	34.3 Å²	34.3	11%	0.107	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	114.3	179.8	-172	35.9	0	0	0	110.5	C158 F162 R204 M233 K422	C158-D160 PolarHBondContact O-N 3.27Å; D160-F162 PolarHBondContact O-N 3.04Å; D160-R204 WeakPolarHBondContact O-CA 3.4Å; D160-R204 PolarHBondContact O-N 2.68Å; D160-R204 VanDerWaalsContact OD2-CG 3.31Å; D160-R204 WeakPolarHBondContact OD2-CG 3.46Å; D160-M233 HydrophobicContact CB-CE 4.02Å; D160-K422 IonicContact OD1-NZ 2.57Å
161	G	79.7	Confident	86.9	Confident	36 Å²	36	26.3 Å²	26.3	37%	0.371	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	-2.2	-175.1	0	0	0	0	0	115.7	A159 D163	A159-G161 PolarHBondContact O-N 2.91Å; A159-G161 VanDerWaalsContact O-N 3.09Å; G161-D163 PolarHBondContact O-N 3.34Å; G161-D163 VanDerWaalsContact O-N 3.15Å
162	F	85.8	Confident	86.7	Confident	3 Å²	3	23.4 Å²	23.4	1%	0.013	12%	0.122	C	C	.	.			trans	-74.3	105.9	178	-164.9	-78.6	0	0	0	110.7	I157 A159 D160 A166 A167 L170 P186 L205 I235	I157-F162 HydrophobicContact CG2-CD2 3.75Å; I157-F162 HydrophobicContact CG2-CE2 4.1Å; A159-F162 PolarHBondContact O-N 3.33Å; D160-F162 PolarHBondContact O-N 3.04Å; F162-A166 HydrophobicContact CD1-CB 4.27Å; F162-A166 HydrophobicContact CD2-CB 4.03Å; F162-A166 HydrophobicContact CE1-CB 4.22Å; F162-A166 HydrophobicContact CE2-CB 3.96Å; F162-A166 HydrophobicContact CG-CB 4.2Å; F162-A166 HydrophobicContact CZ-CB 4.06Å; F162-A167 HydrophobicContact CE1-CB 3.94Å; F162-L170 HydrophobicContact CE2-CD1 3.61Å; F162-L170 HydrophobicContact CZ-CD1 3.74Å; F162-L170 HydrophobicContact CZ-CG 4.47Å; F162-P186 HydrophobicContact CD1-CB 3.74Å; F162-P186 HydrophobicContact CE1-CB 3.81Å; F162-L205 HydrophobicContact CD2-CD1 3.9Å; F162-L205 HydrophobicContact CE2-CD1 4.06Å; F162-I235 HydrophobicContact CB-CG1 4.26Å; F162-I235 HydrophobicContact CD1-CD1 4.37Å; F162-I235 HydrophobicContact CD1-CG1 3.58Å; F162-I235 HydrophobicContact CD1-CG2 4.38Å; F162-I235 HydrophobicContact CD2-CG1 4.43Å; F162-I235 HydrophobicContact CD2-CG2 3.81Å; F162-I235 HydrophobicContact CE1-CG1 3.95Å; F162-I235 HydrophobicContact CE1-CG2 4.44Å; F162-I235 HydrophobicContact CE2-CG2 3.9Å; F162-I235 HydrophobicContact CG-CB 4.38Å; F162-I235 HydrophobicContact CG-CG1 3.84Å; F162-I235 HydrophobicContact CG-CG2 4.06Å; F162-I235 HydrophobicContact CZ-CG2 4.22Å
163	D	81.6	Confident	86.5	Confident	30 Å²	30	20.4 Å²	20.4	16%	0.16	11%	0.105	C	C	.	.			trans	-106.6	-176.6	-175	77.5	-9.4	0	0	0	113.2	G161 N165 A166 A167	G161-D163 PolarHBondContact O-N 3.34Å; G161-D163 VanDerWaalsContact O-N 3.15Å; D163-N165 PolarHBondContact O-N 3.43Å; D163-N165 WeakPolarHBondContact OD1-CA 3.2Å; D163-N165 WeakPolarHBondContact OD1-CB 3.47Å; D163-N165 PolarHBondContact OD1-N 2.93Å; D163-N165 PolarHBondContact OD2-ND2 3.3Å; D163-A166 PolarHBondContact O-N 3.46Å; D163-A166 PolarHBondContact OD1-N 2.78Å; D163-A167 PolarHBondContact O-N 2.96Å
164	L	83.9	Confident	86.1	Confident	16 Å²	16	16.3 Å²	16.3	8%	0.084	9%	0.087	C	C	.	.	H	α-helix	trans	-59.8	-29.8	175.6	-77.4	166.9	0	0	0	113.6	R168 F391 S460	L164-R168 WeakPolarHBondContact O-CG 3.18Å; L164-R168 PolarHBondContact O-N 2.94Å; L164-R168 VanDerWaalsContact O-N 3.11Å; L164-F391 HydrophobicContact CD2-CD1 4.2Å; L164-S460 WeakPolarHBondContact CD1-OG 3.46Å; L164-S460 PolarHBondContact N-O 3.21Å
165	N	86.4	Confident	85.3	Confident	34 Å²	34	15.1 Å²	15.1	18%	0.182	9%	0.09	C	C	.	.	H	α-helix	trans	-75.5	-40.3	-180	-58	-54.4	0	0	0	110.8	D163 A167 R168 A169 C207	D163-N165 PolarHBondContact O-N 3.43Å; D163-N165 WeakPolarHBondContact OD1-CA 3.2Å; D163-N165 WeakPolarHBondContact OD1-CB 3.47Å; D163-N165 PolarHBondContact OD1-N 2.93Å; D163-N165 PolarHBondContact OD2-ND2 3.3Å; N165-A167 VanDerWaalsContact C-N 3.32Å; N165-A167 PolarHBondContact O-N 3.39Å; N165-R168 PolarHBondContact O-N 2.77Å; N165-A169 PolarHBondContact O-N 2.79Å; N165-C207 HydrophobicContact CB-CB 4.13Å; N165-C207 VanDerWaalsContact CB-O 3.3Å; N165-C207 WeakPolarHBondContact CB-O 3.37Å
166	A	88.7	Confident	84	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60.2	-43	171.3	0	0	0	0	0	111.6	F162 D163 R168 A169 L170 L205 C207	F162-A166 HydrophobicContact CD1-CB 4.27Å; F162-A166 HydrophobicContact CD2-CB 4.03Å; F162-A166 HydrophobicContact CE1-CB 4.22Å; F162-A166 HydrophobicContact CE2-CB 3.96Å; F162-A166 HydrophobicContact CG-CB 4.2Å; F162-A166 HydrophobicContact CZ-CB 4.06Å; D163-A166 PolarHBondContact O-N 3.46Å; D163-A166 PolarHBondContact OD1-N 2.78Å; A166-R168 PolarHBondContact O-N 3.3Å; A166-A169 PolarHBondContact O-N 3.27Å; A166-L170 WeakPolarHBondContact O-CG 3.38Å; A166-L170 PolarHBondContact O-N 3.2Å; A166-L205 HydrophobicContact CB-CB 4.43Å; A166-C207 WeakPolarHBondContact CA-SG 3.4Å; A166-C207 HydrophobicContact CB-CB 4.39Å
167	A	88.8	Confident	82.4	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-57.1	-47.2	174.3	0	0	0	0	0	112.4	F162 D163 N165 L170 C171 P186 L237	F162-A167 HydrophobicContact CE1-CB 3.94Å; D163-A167 PolarHBondContact O-N 2.96Å; N165-A167 VanDerWaalsContact C-N 3.32Å; N165-A167 PolarHBondContact O-N 3.39Å; A167-L170 PolarHBondContact O-N 3.07Å; A167-C171 PolarHBondContact O-N 3.43Å; A167-C171 PolarHBondContact O-SG 2.68Å; A167-C171 VanDerWaalsContact O-SG 3.37Å; A167-P186 HydrophobicContact CB-CB 4.43Å; A167-P186 HydrophobicContact CB-CG 4.44Å; A167-L237 VanDerWaalsContact CA-CD1 3.47Å; A167-L237 HydrophobicContact CB-CD1 3.46Å; A167-L237 VanDerWaalsContact CB-CD1 3.46Å
168	R	86	Confident	80.6	Confident	38 Å²	38	20.2 Å²	20.2	14%	0.143	12%	0.123	C	C	.	.	H	α-helix	trans	-63.5	-42.9	178.2	-73.6	171.7	-177.5	155.6	0.5	112.9	L164 N165 A166 L170 C171 R172 L181 A184	L164-R168 WeakPolarHBondContact O-CG 3.18Å; L164-R168 PolarHBondContact O-N 2.94Å; L164-R168 VanDerWaalsContact O-N 3.11Å; N165-R168 PolarHBondContact O-N 2.77Å; A166-R168 PolarHBondContact O-N 3.3Å; R168-L170 VanDerWaalsContact C-N 3.3Å; R168-L170 PolarHBondContact O-N 3.14Å; R168-C171 PolarHBondContact O-N 3.39Å; R168-R172 WeakPolarHBondContact O-CG 2.97Å; R168-R172 PolarHBondContact O-N 3.2Å; R168-R172 VanDerWaalsContact O-N 3.09Å; R168-L181 HydrophobicContact CB-CD2 4.13Å; R168-L181 HydrophobicContact CG-CD2 4.12Å; R168-A184 HydrophobicContact CG-CB 3.9Å
169	A	86.5	Confident	79.1	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-59.5	-43.1	176.7	0	0	0	0	0	111.2	N165 A166 R172 M173 A211	N165-A169 PolarHBondContact O-N 2.79Å; A166-A169 PolarHBondContact O-N 3.27Å; A169-R172 WeakPolarHBondContact O-CB 3.48Å; A169-R172 PolarHBondContact O-N 2.82Å; A169-M173 WeakPolarHBondContact O-CG 3.28Å; A169-M173 PolarHBondContact O-N 3.05Å; A169-A211 HydrophobicContact CB-CB 3.7Å
170	L	88.1	Confident	78.1	Confident	4 Å²	4	29.2 Å²	29.2	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-73.9	-36.4	179.4	-66.9	-166.2	0	0	0	113.5	I132 V144 I157 F162 A166 A167 R168 R172 M173 L174 L214 L237	I132-L170 HydrophobicContact CD1-CB 3.68Å; I132-L170 HydrophobicContact CD1-CD1 4Å; I132-L170 HydrophobicContact CD1-CD2 4.14Å; I132-L170 HydrophobicContact CD1-CG 4.15Å; V144-L170 HydrophobicContact CG1-CD1 3.79Å; I157-L170 HydrophobicContact CD1-CD1 3.77Å; F162-L170 HydrophobicContact CE2-CD1 3.61Å; F162-L170 HydrophobicContact CZ-CD1 3.74Å; F162-L170 HydrophobicContact CZ-CG 4.47Å; A166-L170 WeakPolarHBondContact O-CG 3.38Å; A166-L170 PolarHBondContact O-N 3.2Å; A167-L170 PolarHBondContact O-N 3.07Å; R168-L170 VanDerWaalsContact C-N 3.3Å; R168-L170 PolarHBondContact O-N 3.14Å; L170-R172 PolarHBondContact O-N 3.05Å; L170-M173 HydrophobicContact CD2-SD 3.71Å; L170-M173 WeakPolarHBondContact O-CB 3.24Å; L170-M173 PolarHBondContact O-N 3.07Å; L170-M173 VanDerWaalsContact O-N 3.16Å; L170-L174 PolarHBondContact O-N 3.4Å; L170-L174 VanDerWaalsContact O-N 3.16Å; L170-L214 HydrophobicContact CD2-CB 4.25Å; L170-L214 HydrophobicContact CD2-CD1 4.38Å; L170-L237 HydrophobicContact CB-CD2 3.68Å
171	C	86.4	Confident	77.5	Confident	2 Å²	2	29.2 Å²	29.2	1%	0.014	17%	0.169	C	C	.	.	H	α-helix	trans	-62.8	-33.2	173.3	-72.8	0	0	0	0	112.5	A167 R168 L174 A184 C239	A167-C171 PolarHBondContact O-N 3.43Å; A167-C171 PolarHBondContact O-SG 2.68Å; A167-C171 VanDerWaalsContact O-SG 3.37Å; R168-C171 PolarHBondContact O-N 3.39Å; C171-L174 PolarHBondContact O-N 3.19Å; C171-A184 HydrophobicContact CB-CB 3.89Å; C171-A184 VanDerWaalsContact SG-CB 3.58Å; C171-C239 WeakPolarHBondContact CA-SG 3.36Å; C171-C239 HydrophobicContact CB-CB 3.72Å; C171-C239 WeakPolarHBondContact CB-SG 3.37Å; C171-C239 WeakPolarHBondContact SG-CA 3.31Å; C171-C239 WeakPolarHBondContact SG-CB 3.45Å; C171-C239 CovalentContact SG-SG 2.04Å; C171-C239 PolarHBondContact SG-SG 3.37Å
172	R	83.5	Confident	77	Confident	10 Å²	10	32.6 Å²	32.6	4%	0.038	18%	0.176	C	C	.	.	H	α-helix	trans	-66.3	-40.1	172.8	-77.7	172.6	174.9	-175.3	-9.4	112.7	V122 R168 A169 L170 L174 C175 L181 N210 A211 S212	V122-R172 HydrophobicContact CG2-CB 3.95Å; V122-R172 HydrophobicContact CG2-CG 3.94Å; R168-R172 WeakPolarHBondContact O-CG 2.97Å; R168-R172 PolarHBondContact O-N 3.2Å; R168-R172 VanDerWaalsContact O-N 3.09Å; A169-R172 WeakPolarHBondContact O-CB 3.48Å; A169-R172 PolarHBondContact O-N 2.82Å; L170-R172 PolarHBondContact O-N 3.05Å; R172-L174 VanDerWaalsContact C-N 3.29Å; R172-L174 PolarHBondContact O-N 2.75Å; R172-C175 PolarHBondContact O-N 3.13Å; R172-L181 HydrophobicContact CG-CD2 4.15Å; R172-N210 PolarHBondContact NH1-O 2.91Å; R172-N210 VanDerWaalsContact NH1-O 3.16Å; R172-A211 PolarHBondContact NH1-O 2.94Å; R172-S212 WeakPolarHBondContact CB-O 3.38Å
173	M	83.3	Confident	76.7	Confident	33 Å²	33	35.5 Å²	35.5	16%	0.163	19%	0.187	C	C	.	.	H	α-helix	trans	-63.7	-33.2	175.8	-69.5	-179.8	68	0	0	113	S130 I132 A169 L170 C175 L214	S130-M173 WeakPolarHBondContact O-CE 3.06Å; I132-M173 HydrophobicContact CG2-CB 3.58Å; I132-M173 HydrophobicContact CG2-CE 4.16Å; A169-M173 WeakPolarHBondContact O-CG 3.28Å; A169-M173 PolarHBondContact O-N 3.05Å; L170-M173 HydrophobicContact CD2-SD 3.71Å; L170-M173 WeakPolarHBondContact O-CB 3.24Å; L170-M173 PolarHBondContact O-N 3.07Å; L170-M173 VanDerWaalsContact O-N 3.16Å; M173-C175 PolarHBondContact O-N 3.05Å; M173-L214 HydrophobicContact CE-CB 4.38Å; M173-L214 HydrophobicContact SD-CB 3.78Å; M173-L214 PolarHBondContact SD-N 2.96Å
174	L	83	Confident	76.9	Confident	28 Å²	28	34 Å²	34	15%	0.147	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-19.3	178.7	-76.5	165.5	0	0	0	113.7	I132 L134 L170 C171 R172 T176 L237	I132-L174 HydrophobicContact CD1-CD1 4.28Å; I132-L174 HydrophobicContact CD1-CD2 4.45Å; I132-L174 HydrophobicContact CD1-CG 4.13Å; I132-L174 HydrophobicContact CG1-CD2 4.06Å; I132-L174 HydrophobicContact CG1-CG 4.26Å; I132-L174 HydrophobicContact CG2-CD2 4.1Å; I132-L174 HydrophobicContact CG2-CG 4.14Å; L134-L174 HydrophobicContact CD1-CD1 3.55Å; L134-L174 HydrophobicContact CD2-CD1 3.88Å; L134-L174 HydrophobicContact CG-CD1 3.61Å; L134-L174 HydrophobicContact CG-CD2 4.15Å; L170-L174 PolarHBondContact O-N 3.4Å; L170-L174 VanDerWaalsContact O-N 3.16Å; C171-L174 PolarHBondContact O-N 3.19Å; R172-L174 VanDerWaalsContact C-N 3.29Å; R172-L174 PolarHBondContact O-N 2.75Å; L174-T176 WeakPolarHBondContact O-CG2 3.4Å; L174-T176 PolarHBondContact O-N 3.17Å; L174-L237 HydrophobicContact CD1-CD2 4.09Å
175	C	74.9	Confident	77	Confident	53 Å²	53	33.9 Å²	33.9	36%	0.358	18%	0.178	S	C	.	.			trans	57	1.8	-178.5	-57.3	0	0	0	0	115.4	C124 R172 M173	C124-C175 HydrophobicContact CB-CB 4.01Å; C124-C175 VanDerWaalsContact SG-CB 3.58Å; R172-C175 PolarHBondContact O-N 3.13Å; M173-C175 PolarHBondContact O-N 3.05Å
176	T	66.2	Low	77.1	Confident	62 Å²	62	32.3 Å²	32.3	38%	0.38	17%	0.169	S	C	.	.	S	Bend	trans	-82.3	-13.6	-177.8	56.3	0	0	0	0	113.4	N139 N140 L174	N139-T176 PolarHBondContact O-OG1 3.21Å; N140-T176 WeakPolarHBondContact OD1-CB 3.39Å; N140-T176 PolarHBondContact OD1-OG1 3.31Å; L174-T176 WeakPolarHBondContact O-CG2 3.4Å; L174-T176 PolarHBondContact O-N 3.17Å
177	S	57.5	Low	77	Confident	21 Å²	21	32.3 Å²	32.3	15%	0.147	17%	0.169	C	C	.	.	S	Bend	trans	-154.5	31.6	177.8	66.9	0	0	0	0	113.9	D179 N180 C239	S177-D179 PolarHBondContact O-N 2.77Å; S177-N180 PolarHBondContact O-N 3.49Å; S177-C239 WeakPolarHBondContact CB-O 3.28Å; S177-C239 WeakPolarHBondContact OG-CB 3.49Å; S177-C239 PolarHBondContact OG-O 3.12Å
178	S	53.7	Low	76.7	Confident	23 Å²	23	32.5 Å²	32.5	16%	0.161	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.3	-31	-168.2	45	0	0	0	0	115.7
179	D	53.5	Low	76.2	Confident	106 Å²	106	33.4 Å²	33.4	57%	0.567	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-20.3	-178.5	-63.2	-24.7	0	0	0	114.4	P121 S177 L181	P121-D179 WeakPolarHBondContact CB-OD1 3.21Å; S177-D179 PolarHBondContact O-N 2.77Å; D179-L181 PolarHBondContact O-N 2.83Å
180	N	62.5	Low	75.7	Confident	95 Å²	95	37 Å²	37	51%	0.508	19%	0.193	S	C	.	.			trans	-97.8	62.5	-179.1	-90.8	-17.1	0	0	0	112	S177 Q182 Y183	S177-N180 PolarHBondContact O-N 3.49Å; N180-Q182 PolarHBondContact O-N 2.93Å; N180-Y183 HydrophobicContact CB-CD2 4.13Å; N180-Y183 HydrophobicContact CB-CE2 4.35Å; N180-Y183 PolarHBondContact O-N 3.01Å
181	L	68.5	Low	75.4	Confident	19 Å²	19	38.1 Å²	38.1	10%	0.099	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-60.2	-9.6	172.4	-62.1	169.2	0	0	0	113.4	R168 R172 D179 Y183 A184 F391	R168-L181 HydrophobicContact CB-CD2 4.13Å; R168-L181 HydrophobicContact CG-CD2 4.12Å; R172-L181 HydrophobicContact CG-CD2 4.15Å; D179-L181 PolarHBondContact O-N 2.83Å; L181-Y183 PolarHBondContact O-N 2.82Å; L181-A184 HydrophobicContact CD2-CB 4.17Å; L181-A184 PolarHBondContact O-N 3.34Å; L181-A184 VanDerWaalsContact O-N 3.12Å; L181-F391 WeakPolarHBondContact O-CZ 3.16Å
182	Q	69.6	Low	75.1	Confident	108 Å²	108	40.1 Å²	40.1	51%	0.505	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-58.6	-9.7	167.9	-161.6	-174.4	29	0	0	113.2	N180 Q390 F391	N180-Q182 PolarHBondContact O-N 2.93Å; Q182-Q390 PolarHBondContact O-NE2 2.82Å; Q182-F391 VanDerWaalsContact C-CE2 3.48Å; Q182-F391 HydrophobicContact CG-CE2 4.24Å; Q182-F391 WeakPolarHBondContact O-CE2 3.49Å; Q182-F391 WeakPolarHBondContact O-CZ 3.02Å
183	Y	78.6	Confident	75.1	Confident	63 Å²	63	42.3 Å²	42.3	25%	0.247	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-117.5	2.6	173.1	-53.8	-69.6	0	0	0	115	N180 L181 Y185 Q238 C239 G240 P241	N180-Y183 HydrophobicContact CB-CD2 4.13Å; N180-Y183 HydrophobicContact CB-CE2 4.35Å; N180-Y183 PolarHBondContact O-N 3.01Å; L181-Y183 PolarHBondContact O-N 2.82Å; Y183-Y185 VanDerWaalsContact O-CD1 3.26Å; Y183-Y185 WeakPolarHBondContact O-CD1 3.36Å; Y183-Y185 PolarHBondContact O-N 3.35Å; Y183-Q238 CarbonylContact O-C 3.19Å; Y183-Q238 VanDerWaalsContact O-C 3.24Å; Y183-C239 WeakPolarHBondContact CB-O 3.42Å; Y183-G240 VanDerWaalsContact CB-O 3.27Å; Y183-G240 WeakPolarHBondContact CB-O 3.41Å; Y183-G240 VanDerWaalsContact CG-C 3.48Å; Y183-P241 HydrophobicContact CD1-CB 4.35Å; Y183-P241 HydrophobicContact CE1-CB 4.04Å; Y183-P241 HydrophobicContact CE2-CB 4.33Å
184	A	84.6	Confident	75.2	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.23	C	C	.	.			trans	-86.5	97.3	-172.6	0	0	0	0	0	113	R168 C171 L181 Q238 F391	R168-A184 HydrophobicContact CG-CB 3.9Å; C171-A184 HydrophobicContact CB-CB 3.89Å; C171-A184 VanDerWaalsContact SG-CB 3.58Å; L181-A184 HydrophobicContact CD2-CB 4.17Å; L181-A184 PolarHBondContact O-N 3.34Å; L181-A184 VanDerWaalsContact O-N 3.12Å; A184-Q238 CarbonylContact C-O 3.56Å; A184-Q238 WeakPolarHBondContact CA-O 3.34Å; A184-F391 WeakPolarHBondContact O-CE1 3.38Å
185	Y	86.4	Confident	75.3	Confident	13 Å²	13	42.9 Å²	42.9	5%	0.051	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	153.2	177.2	68.2	-80.4	0	0	0	113	Y183 V187 Q238 Q390 I458	Y183-Y185 VanDerWaalsContact O-CD1 3.26Å; Y183-Y185 WeakPolarHBondContact O-CD1 3.36Å; Y183-Y185 PolarHBondContact O-N 3.35Å; Y185-V187 HydrophobicContact CD2-CG1 3.74Å; Y185-V187 HydrophobicContact CE2-CG1 3.26Å; Y185-Q238 HydrophobicContact CD1-CB 3.95Å; Y185-Q238 HydrophobicContact CD1-CG 4.18Å; Y185-Q238 HydrophobicContact CE1-CB 3.51Å; Y185-Q238 HydrophobicContact CE1-CG 3.4Å; Y185-Q238 VanDerWaalsContact CE1-CG 3.4Å; Y185-Q238 HydrophobicContact CE2-CB 4.32Å; Y185-Q238 PolarHBondContact N-O 2.99Å; Y185-Q238 PolarHBondContact O-N 3.16Å; Y185-Q390 HydrophobicContact CD1-CG 4.04Å; Y185-Q390 HydrophobicContact CE1-CG 4.23Å; Y185-Q390 VanDerWaalsContact CE1-NE2 3.27Å; Y185-Q390 HydrophobicContact CG-CG 4.49Å; Y185-I458 HydrophobicContact CD2-CD1 4Å; Y185-I458 HydrophobicContact CD2-CG1 4.11Å; Y185-I458 HydrophobicContact CD2-CG2 4.3Å; Y185-I458 HydrophobicContact CE2-CD1 4.06Å; Y185-I458 HydrophobicContact CE2-CG1 4.29Å
186	P	90	Very high	75.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	145.6	176.5	29.4	-30.9	0	0	0	111.5	F162 A167 I235 I458 P459	F162-P186 HydrophobicContact CD1-CB 3.74Å; F162-P186 HydrophobicContact CE1-CB 3.81Å; A167-P186 HydrophobicContact CB-CB 4.43Å; A167-P186 HydrophobicContact CB-CG 4.44Å; P186-I235 HydrophobicContact CB-CD1 4.09Å; P186-I235 HydrophobicContact CB-CG1 4.28Å; P186-I458 HydrophobicContact CG-CG2 4.39Å; P186-P459 HydrophobicContact CB-CG 3.96Å; P186-P459 HydrophobicContact CG-CG 3.87Å; P186-P459 WeakPolarHBondContact CG-O 3.49Å
187	V	84.7	Confident	76.6	Confident	1 Å²	1	50 Å²	50	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	132.2	174.7	-66.8	0	0	0	0	111.4	Y185 L190 Y191 G236 Q238	Y185-V187 HydrophobicContact CD2-CG1 3.74Å; Y185-V187 HydrophobicContact CE2-CG1 3.26Å; V187-L190 HydrophobicContact CG2-CB 4.45Å; V187-L190 HydrophobicContact CG2-CD2 4.45Å; V187-Y191 HydrophobicContact CG2-CD2 3.85Å; V187-Y191 HydrophobicContact CG2-CE2 3.33Å; V187-G236 VanDerWaalsContact CG2-C 3.48Å; V187-G236 PolarHBondContact N-O 2.82Å; V187-G236 VanDerWaalsContact O-CA 3.28Å; V187-G236 WeakPolarHBondContact O-CA 3.4Å; V187-G236 PolarHBondContact O-N 2.87Å; V187-Q238 HydrophobicContact CG1-CB 4.48Å
188	L	82.5	Confident	78.2	Confident	4 Å²	4	50.4 Å²	50.4	2%	0.021	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-98	146.7	173.9	-70	170.2	0	0	0	111.4	A159 L190 I235 V457 P459 Q507	A159-L188 HydrophobicContact CB-CD2 3.51Å; L188-L190 PolarHBondContact O-N 3.07Å; L188-I235 HydrophobicContact CD2-CD1 3.51Å; L188-I235 HydrophobicContact CG-CD1 4Å; L188-V457 HydrophobicContact CB-CB 4.29Å; L188-V457 HydrophobicContact CD1-CB 4.34Å; L188-V457 HydrophobicContact CD1-CG1 4.04Å; L188-V457 PolarHBondContact N-O 2.87Å; L188-V457 VanDerWaalsContact N-O 3.15Å; L188-P459 HydrophobicContact CD1-CG 4.22Å; L188-P459 HydrophobicContact CG-CG 4.35Å; L188-Q507 HydrophobicContact CD1-CG 4.02Å
189	Y	77.1	Confident	80	Confident	57 Å²	57	51.5 Å²	51.5	22%	0.224	29%	0.294	C	S	.	.	S	Bend	trans	65.4	-5.9	169.3	-39.1	-51.2	0	0	0	116.9	R448 V457 Y508 C509	Y189-R448 VanDerWaalsContact CE2-O 3.27Å; Y189-R448 WeakPolarHBondContact CE2-O 3Å; Y189-R448 PolarHBondContact OH-O 2.82Å; Y189-V457 HydrophobicContact CD2-CG2 4.42Å; Y189-V457 HydrophobicContact CE2-CB 4.38Å; Y189-V457 HydrophobicContact CE2-CG2 4.21Å; Y189-Y508 VanDerWaalsContact OH-C 3.24Å; Y189-Y508 WeakPolarHBondContact OH-CA 3.39Å; Y189-Y508 PolarHBondContact OH-N 3.46Å; Y189-C509 HydrophobicContact CD1-CB 3.89Å; Y189-C509 HydrophobicContact CE1-CB 3.66Å
190	L	76.1	Confident	81.6	Confident	74 Å²	74	47.8 Å²	47.8	39%	0.387	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-37.7	-172.8	-170.9	62.1	0	0	0	113.6	V187 L188 T456	V187-L190 HydrophobicContact CG2-CB 4.45Å; V187-L190 HydrophobicContact CG2-CD2 4.45Å; L188-L190 PolarHBondContact O-N 3.07Å; L190-T456 HydrophobicContact CD1-CG2 4.44Å; L190-T456 HydrophobicContact CD2-CG2 4.25Å
191	Y	81.8	Confident	82.9	Confident	28 Å²	28	43.6 Å²	43.6	11%	0.11	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	24.4	-175.1	-53	-62.5	0	0	0	113	D136 A141 G142 R143 V187 Q238	D136-Y191 WeakPolarHBondContact O-CD1 3.43Å; A141-Y191 HydrophobicContact CB-CE1 4.48Å; A141-Y191 WeakPolarHBondContact CB-OH 3.47Å; G142-Y191 VanDerWaalsContact CA-CE2 3.42Å; G142-Y191 VanDerWaalsContact N-CE2 3.26Å; G142-Y191 WeakPolarHBondContact O-CD2 3.48Å; R143-Y191 PolarHBondContact NH1-O 3.5Å; V187-Y191 HydrophobicContact CG2-CD2 3.85Å; V187-Y191 HydrophobicContact CG2-CE2 3.33Å; Y191-Q238 PolarHBondContact OH-OE1 3.14Å
192	G	78.9	Confident	83.9	Confident	45 Å²	45	42.7 Å²	42.7	46%	0.464	25%	0.246	S	C	.	.			trans	63.9	-170.9	-177.8	0	0	0	0	0	114.4
193	S	83.2	Confident	84.7	Confident	55 Å²	55	37.6 Å²	37.6	39%	0.385	22%	0.222	S	C	.	.			trans	-117.4	145.9	-178.7	57.8	0	0	0	0	110.4	H231	S193-H231 WeakPolarHBondContact CB-O 2.73Å
194	A	85.4	Confident	85	Confident	7 Å²	7	38.8 Å²	38.8	6%	0.058	23%	0.227	C	C	.	.			trans	-67.1	161.1	173.9	0	0	0	0	0	111.5	T156 T198 H231 D234	T156-A194 HydrophobicContact CG2-CB 3.52Å; A194-T198 HydrophobicContact CB-CG2 4.16Å; A194-H231 WeakPolarHBondContact O-CB 3.39Å; A194-D234 WeakPolarHBondContact CB-OD2 3.37Å; A194-D234 PolarHBondContact N-OD2 2.62Å
195	S	85	Confident	85	Confident	67 Å²	67	39 Å²	39	47%	0.469	23%	0.227	S	C	.	.			trans	-66.6	148.3	174.5	58.6	0	0	0	0	111.1	S197 T198 H231	S195-S197 PolarHBondContact O-N 2.89Å; S195-S197 PolarHBondContact OG-OG 2.82Å; S195-T198 WeakPolarHBondContact O-CB 3.47Å; S195-T198 PolarHBondContact O-N 2.84Å; S195-T198 PolarHBondContact O-OG1 2.88Å; S195-T198 PolarHBondContact OG-OG1 2.93Å; S195-H231 PolarHBondContact O-NE2 2.62Å
196	N	84	Confident	85	Confident	157 Å²	157	43.7 Å²	43.7	84%	0.84	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-10.6	177.7	-68.7	-24.1	0	0	0	115.7
197	S	86.2	Confident	84.7	Confident	107 Å²	107	44.3 Å²	44.3	75%	0.748	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-12.8	173.2	56.4	0	0	0	0	113.6	S195	S195-S197 PolarHBondContact O-N 2.89Å; S195-S197 PolarHBondContact OG-OG 2.82Å
198	T	89.8	Confident	84.7	Confident	29 Å²	29	47 Å²	47	18%	0.178	27%	0.271	C	S	.	.	S	Bend	trans	-87.5	130.4	-179.8	-55.9	0	0	0	0	109.4	T156 A194 S195 H231	T156-T198 HydrophobicContact CG2-CG2 4.21Å; A194-T198 HydrophobicContact CB-CG2 4.16Å; S195-T198 WeakPolarHBondContact O-CB 3.47Å; S195-T198 PolarHBondContact O-N 2.84Å; S195-T198 PolarHBondContact O-OG1 2.88Å; S195-T198 PolarHBondContact OG-OG1 2.93Å; T198-H231 PolarHBondContact O-CE1 3.15Å; T198-H231 PolarHBondContact O-NE2 3.27Å
199	P	90.7	Very high	84.6	Confident	47 Å²	47	49.5 Å²	49.5	31%	0.305	29%	0.287	S	S	.	.			trans	-72.1	146.7	178.4	27.8	-33.6	0	0	0	111.8	W154 G155 T156	W154-P199 WeakPolarHBondContact O-CD 3.33Å; W154-P199 WeakPolarHBondContact O-CG 3.12Å; G155-P199 CarbonylContact C-O 3.39Å; G155-P199 WeakPolarHBondContact CA-O 2.98Å; T156-P199 PolarHBondContact N-O 2.78Å
200	I	87.7	Confident	84.8	Confident	28 Å²	28	52.1 Å²	52.1	14%	0.144	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	108.7	165.1	-53.2	176.8	0	0	0	107	C158 A226 C229	C158-I200 HydrophobicContact CB-CG2 4Å; I200-A226 HydrophobicContact CB-CB 4.09Å; I200-A226 HydrophobicContact CG2-CB 3.59Å; I200-C229 HydrophobicContact CD1-CB 3.95Å; I200-C229 HydrophobicContact CG2-CB 4.31Å
201	H	91	Very high	85.3	Confident	6 Å²	6	48.7 Å²	48.7	3%	0.028	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	-36.9	-172.5	-79.2	-42.8	0	0	0	113.2	V146 H148 Q153 G155 T156 W223 G224	V146-H201 HydrophobicContact CG1-CB 4.12Å; V146-H201 PolarHBondContact O-CD2 3.28Å; H148-H201 AromaticContact CD2-CE1 3.91Å; H148-H201 AromaticContact CD2-ND1 3.83Å; Q153-H201 PolarHBondContact O-NE2 2.83Å; G155-H201 WeakPolarHBondContact CA-CD2 3.26Å; G155-H201 PolarHBondContact N-CD2 2.91Å; G155-H201 VanDerWaalsContact N-CD2 3.33Å; G155-H201 PolarHBondContact N-NE2 3.47Å; T156-H201 PolarHBondContact O-N 3.04Å; H201-W223 HydrophobicContact CB-CE3 3.92Å; H201-W223 HydrophobicContact CB-CZ3 4.08Å; H201-W223 CarbonylContact O-C 3.6Å; H201-G224 PolarHBondContact O-N 3.13Å
202	L	89.5	Confident	85.3	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	143.1	-167.4	-60.8	168.1	0	0	0	111.3	V146 I157 C158 L205 L214 L219 W223	V146-L202 HydrophobicContact CG1-CD1 4.11Å; I157-L202 HydrophobicContact CD1-CD1 4.25Å; I157-L202 HydrophobicContact CG1-CB 4.35Å; I157-L202 HydrophobicContact CG1-CD1 4.35Å; I157-L202 HydrophobicContact CG2-CB 4.25Å; C158-L202 WeakPolarHBondContact CB-O 2.94Å; C158-L202 PolarHBondContact N-O 3.1Å; L202-L205 HydrophobicContact CB-CD2 4.2Å; L202-L205 HydrophobicContact CD1-CD2 4.38Å; L202-L214 HydrophobicContact CD1-CD1 4.08Å; L202-L214 HydrophobicContact CD1-CD2 3.49Å; L202-L214 VanDerWaalsContact CD1-CD2 3.49Å; L202-L214 HydrophobicContact CD1-CG 4.31Å; L202-L219 HydrophobicContact CD2-CB 4.17Å; L202-L219 HydrophobicContact CD2-CD1 4.33Å; L202-L219 HydrophobicContact CD2-CD2 4.39Å; L202-W223 HydrophobicContact CD1-CH2 4.36Å; L202-W223 HydrophobicContact CD1-CZ3 4.35Å; L202-W223 HydrophobicContact CD2-CD2 4.17Å; L202-W223 HydrophobicContact CD2-CE3 4.3Å; L202-W223 HydrophobicContact CD2-CG 4.46Å; L202-W223 HydrophobicContact CG-CE3 4.47Å
203	S	86.6	Confident	85.5	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.007	28%	0.278	C	S	.	.			trans	-144.3	164.1	166	78.8	0	0	0	0	110	L205 S225	S203-L205 PolarHBondContact O-N 2.77Å; S203-S225 PolarHBondContact OG-O 2.82Å
204	R	83.2	Confident	85.5	Confident	89 Å²	89	45.2 Å²	45.2	34%	0.336	26%	0.26	S	S	.	.	S	Bend	trans	55.6	50	177.9	-59.7	175.1	-68	171.5	0.1	112.2	D160 G220	D160-R204 WeakPolarHBondContact O-CA 3.4Å; D160-R204 PolarHBondContact O-N 2.68Å; D160-R204 VanDerWaalsContact OD2-CG 3.31Å; D160-R204 WeakPolarHBondContact OD2-CG 3.46Å; R204-G220 VanDerWaalsContact O-CA 3.32Å; R204-G220 WeakPolarHBondContact O-CA 3.15Å; R204-G220 PolarHBondContact O-N 3Å
205	L	86.3	Confident	85.5	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.016	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	128.6	175.1	-66.8	-176.7	0	0	0	109.9	I157 F162 A166 L202 S203 L214 L219	I157-L205 HydrophobicContact CD1-CD1 4.31Å; I157-L205 HydrophobicContact CG2-CD1 3.77Å; I157-L205 HydrophobicContact CG2-CG 4.47Å; F162-L205 HydrophobicContact CD2-CD1 3.9Å; F162-L205 HydrophobicContact CE2-CD1 4.06Å; A166-L205 HydrophobicContact CB-CB 4.43Å; L202-L205 HydrophobicContact CB-CD2 4.2Å; L202-L205 HydrophobicContact CD1-CD2 4.38Å; S203-L205 PolarHBondContact O-N 2.77Å; L205-L214 HydrophobicContact CD1-CD1 3.92Å; L205-L214 HydrophobicContact CD2-CD1 3.96Å; L205-L219 HydrophobicContact CD2-CD2 3.6Å
206	E	84.4	Confident	85.5	Confident	113 Å²	113	49.4 Å²	49.4	53%	0.528	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	109.2	169.5	-61.7	177.1	-179.3	0	0	108.5	C217 K218	E206-C217 CarbonylContact O-C 3.58Å; E206-C217 WeakPolarHBondContact O-CA 3.44Å; E206-K218 HydrophobicContact CB-CB 4.23Å; E206-K218 PolarHBondContact N-O 3.48Å; E206-K218 VanDerWaalsContact N-O 3.09Å; E206-K218 PolarHBondContact O-N 2.82Å; E206-K218 IonicContact OE2-NZ 2.84Å
207	C	85.4	Confident	85.6	Confident	12 Å²	12	42.4 Å²	42.4	8%	0.081	24%	0.239	C	C	.	.			trans	-109	134.7	-179.5	-61.6	0	0	0	0	110.8	N165 A166 A211 C217	N165-C207 HydrophobicContact CB-CB 4.13Å; N165-C207 VanDerWaalsContact CB-O 3.3Å; N165-C207 WeakPolarHBondContact CB-O 3.37Å; A166-C207 WeakPolarHBondContact CA-SG 3.4Å; A166-C207 HydrophobicContact CB-CB 4.39Å; C207-A211 HydrophobicContact CB-CB 4.07Å; C207-C217 HydrophobicContact CB-CB 4.02Å; C207-C217 WeakPolarHBondContact CB-SG 3.02Å; C207-C217 WeakPolarHBondContact SG-CB 3.34Å; C207-C217 CovalentContact SG-SG 2.02Å; C207-C217 PolarHBondContact SG-SG 3.04Å
208	P	84.9	Confident	85.7	Confident	57 Å²	57	43.8 Å²	43.8	37%	0.37	23%	0.232	S	C	.	.			trans	-68	158.6	169.8	29.2	-34.7	0	0	0	111.1	N210 A211 D216	P208-N210 PolarHBondContact O-N 3.38Å; P208-N210 VanDerWaalsContact O-N 3.14Å; P208-A211 HydrophobicContact CG-CB 3.98Å; P208-A211 WeakPolarHBondContact O-CB 3.42Å; P208-A211 PolarHBondContact O-N 3.07Å; P208-D216 WeakPolarHBondContact CD-O 3.39Å
209	V	79.7	Confident	85.6	Confident	57 Å²	57	44.1 Å²	44.1	35%	0.345	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-30.5	-176.6	-178	0	0	0	0	112.9	P114	P114-V209 HydrophobicContact CG-CG1 4.03Å
210	N	81.2	Confident	85.1	Confident	113 Å²	113	44 Å²	44	60%	0.604	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	3.6	178.7	67.4	-28.2	0	0	0	114.2	L119 R172 P208 S212	L119-N210 HydrophobicContact CD2-CB 3.9Å; R172-N210 PolarHBondContact NH1-O 2.91Å; R172-N210 VanDerWaalsContact NH1-O 3.16Å; P208-N210 PolarHBondContact O-N 3.38Å; P208-N210 VanDerWaalsContact O-N 3.14Å; N210-S212 PolarHBondContact O-N 2.71Å
211	A	86.2	Confident	84.7	Confident	2 Å²	2	44.6 Å²	44.6	2%	0.017	25%	0.252	C	S	.	.			trans	-53.5	129.7	178.3	0	0	0	0	0	111.3	A169 R172 C207 P208 D216	A169-A211 HydrophobicContact CB-CB 3.7Å; R172-A211 PolarHBondContact NH1-O 2.94Å; C207-A211 HydrophobicContact CB-CB 4.07Å; P208-A211 HydrophobicContact CG-CB 3.98Å; P208-A211 WeakPolarHBondContact O-CB 3.42Å; P208-A211 PolarHBondContact O-N 3.07Å; A211-D216 HydrophobicContact CB-CB 3.77Å
212	S	81.9	Confident	84.4	Confident	44 Å²	44	45.6 Å²	45.6	31%	0.308	26%	0.264	S	S	.	.			trans	-108.1	-19	178.2	64.3	0	0	0	0	112.2	R172 N210 D216	R172-S212 WeakPolarHBondContact CB-O 3.38Å; N210-S212 PolarHBondContact O-N 2.71Å; S212-D216 PolarHBondContact N-OD2 3.14Å; S212-D216 PolarHBondContact OG-OD2 2.98Å
213	S	82.8	Confident	84.2	Confident	10 Å²	10	48.7 Å²	48.7	7%	0.07	28%	0.276	C	S	.	.	S	Bend	trans	-143.8	164.7	-178.1	72.1	0	0	0	0	111.2	N215 D216	S213-N215 PolarHBondContact O-N 3.09Å; S213-N215 PolarHBondContact OG-N 3.06Å; S213-D216 PolarHBondContact N-OD2 2.7Å; S213-D216 WeakPolarHBondContact O-CB 3.44Å; S213-D216 PolarHBondContact O-N 3.48Å; S213-D216 VanDerWaalsContact O-N 3.15Å; S213-D216 PolarHBondContact OG-OD2 3.22Å
214	L	84.7	Confident	84.1	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-61.1	-23.4	172.4	-175.1	64.1	0	0	0	112.5	V146 L170 M173 L202 L205 D216 C217 L219 W223	V146-L214 HydrophobicContact CG2-CD2 4.05Å; L170-L214 HydrophobicContact CD2-CB 4.25Å; L170-L214 HydrophobicContact CD2-CD1 4.38Å; M173-L214 HydrophobicContact CE-CB 4.38Å; M173-L214 HydrophobicContact SD-CB 3.78Å; M173-L214 PolarHBondContact SD-N 2.96Å; L202-L214 HydrophobicContact CD1-CD1 4.08Å; L202-L214 HydrophobicContact CD1-CD2 3.49Å; L202-L214 VanDerWaalsContact CD1-CD2 3.49Å; L202-L214 HydrophobicContact CD1-CG 4.31Å; L205-L214 HydrophobicContact CD1-CD1 3.92Å; L205-L214 HydrophobicContact CD2-CD1 3.96Å; L214-D216 VanDerWaalsContact C-N 3.3Å; L214-D216 PolarHBondContact O-N 2.9Å; L214-C217 WeakPolarHBondContact O-CB 3.47Å; L214-C217 PolarHBondContact O-N 3.05Å; L214-L219 HydrophobicContact CD1-CD2 3.57Å; L214-L219 HydrophobicContact CD2-CD2 4.42Å; L214-L219 HydrophobicContact CG-CD2 3.72Å; L214-W223 HydrophobicContact CD2-CH2 4.14Å; L214-W223 HydrophobicContact CD2-CZ2 4.17Å
215	N	83.8	Confident	84	Confident	88 Å²	88	49.1 Å²	49.1	47%	0.471	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-72.8	-23	177.6	-69.2	-18.9	0	0	0	113.2	Y129 S213 C217	Y129-N215 WeakPolarHBondContact CD1-ND2 3.35Å; Y129-N215 WeakPolarHBondContact CE1-ND2 3.48Å; S213-N215 PolarHBondContact O-N 3.09Å; S213-N215 PolarHBondContact OG-N 3.06Å; N215-C217 PolarHBondContact O-N 2.91Å
216	D	85.1	Confident	83.8	Confident	73 Å²	73	49.9 Å²	49.9	39%	0.39	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-75	-13.1	173.7	-56.6	-40.1	0	0	0	111.4	P208 A211 S212 S213 L214	P208-D216 WeakPolarHBondContact CD-O 3.39Å; A211-D216 HydrophobicContact CB-CB 3.77Å; S212-D216 PolarHBondContact N-OD2 3.14Å; S212-D216 PolarHBondContact OG-OD2 2.98Å; S213-D216 PolarHBondContact N-OD2 2.7Å; S213-D216 WeakPolarHBondContact O-CB 3.44Å; S213-D216 PolarHBondContact O-N 3.48Å; S213-D216 VanDerWaalsContact O-N 3.15Å; S213-D216 PolarHBondContact OG-OD2 3.22Å; L214-D216 VanDerWaalsContact C-N 3.3Å; L214-D216 PolarHBondContact O-N 2.9Å
217	C	86.7	Confident	83.4	Confident	11 Å²	11	47.2 Å²	47.2	7%	0.074	30%	0.301	C	S	.	.	S	Bend	trans	-95.2	148.3	-177.4	-52	0	0	0	0	111.9	E206 C207 L214 N215 L219	E206-C217 CarbonylContact O-C 3.58Å; E206-C217 WeakPolarHBondContact O-CA 3.44Å; C207-C217 HydrophobicContact CB-CB 4.02Å; C207-C217 WeakPolarHBondContact CB-SG 3.02Å; C207-C217 WeakPolarHBondContact SG-CB 3.34Å; C207-C217 CovalentContact SG-SG 2.02Å; C207-C217 PolarHBondContact SG-SG 3.04Å; L214-C217 WeakPolarHBondContact O-CB 3.47Å; L214-C217 PolarHBondContact O-N 3.05Å; N215-C217 PolarHBondContact O-N 2.91Å; C217-L219 HydrophobicContact CB-CD2 4.44Å; C217-L219 PolarHBondContact O-N 2.84Å
218	K	87.8	Confident	82.8	Confident	135 Å²	135	48.2 Å²	48.2	59%	0.587	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	122.1	165.4	-60.4	178.9	-176	170.7	0	109	E206 G220	E206-K218 HydrophobicContact CB-CB 4.23Å; E206-K218 PolarHBondContact N-O 3.48Å; E206-K218 VanDerWaalsContact N-O 3.09Å; E206-K218 PolarHBondContact O-N 2.82Å; E206-K218 IonicContact OE2-NZ 2.84Å; K218-G220 PolarHBondContact O-N 3.42Å; K218-G220 VanDerWaalsContact O-N 3.09Å
219	L	87	Confident	82.7	Confident	36 Å²	36	46.4 Å²	46.4	19%	0.188	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	43	-174.8	-55.6	-174.4	0	0	0	113.1	L202 L205 L214 C217 G221 G222	L202-L219 HydrophobicContact CD2-CB 4.17Å; L202-L219 HydrophobicContact CD2-CD1 4.33Å; L202-L219 HydrophobicContact CD2-CD2 4.39Å; L205-L219 HydrophobicContact CD2-CD2 3.6Å; L214-L219 HydrophobicContact CD1-CD2 3.57Å; L214-L219 HydrophobicContact CD2-CD2 4.42Å; L214-L219 HydrophobicContact CG-CD2 3.72Å; C217-L219 HydrophobicContact CB-CD2 4.44Å; C217-L219 PolarHBondContact O-N 2.84Å; L219-G221 PolarHBondContact O-N 3.39Å; L219-G222 WeakPolarHBondContact O-CA 3.49Å; L219-G222 PolarHBondContact O-N 2.89Å
220	G	80.3	Confident	82.7	Confident	44 Å²	44	46.6 Å²	46.6	45%	0.454	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.6	-107.5	178	0	0	0	0	0	113.9	R204 K218	R204-G220 VanDerWaalsContact O-CA 3.32Å; R204-G220 WeakPolarHBondContact O-CA 3.15Å; R204-G220 PolarHBondContact O-N 3Å; K218-G220 PolarHBondContact O-N 3.42Å; K218-G220 VanDerWaalsContact O-N 3.09Å
221	G	80	Confident	82.8	Confident	41 Å²	41	42.1 Å²	42.1	42%	0.423	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	3.8	178	0	0	0	0	0	116	L219 S225	L219-G221 PolarHBondContact O-N 3.39Å; G221-S225 VanDerWaalsContact C-CB 3.46Å; G221-S225 WeakPolarHBondContact O-CB 3.49Å; G221-S225 PolarHBondContact O-OG 3.27Å
222	G	84.8	Confident	82.4	Confident	27 Å²	27	43.1 Å²	43.1	28%	0.278	29%	0.289	S	S	.	.			trans	90.9	178	-171.5	0	0	0	0	0	113.6	L219 S225	L219-G222 WeakPolarHBondContact O-CA 3.49Å; L219-G222 PolarHBondContact O-N 2.89Å; G222-S225 WeakPolarHBondContact O-CB 3.21Å; G222-S225 PolarHBondContact O-N 2.98Å
223	W	85.8	Confident	82.3	Confident	66 Å²	66	41.2 Å²	41.2	25%	0.25	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	134	178.1	-69.4	89.1	0	0	0	112	V146 H148 P149 H201 L202 L214 S225	V146-W223 HydrophobicContact CG1-CH2 4.41Å; V146-W223 HydrophobicContact CG1-CZ3 4.05Å; V146-W223 HydrophobicContact CG2-CH2 3.74Å; V146-W223 HydrophobicContact CG2-CZ3 4.16Å; H148-W223 HydrophobicContact CB-CE3 4.11Å; H148-W223 HydrophobicContact CB-CZ3 4.15Å; H148-W223 AromaticContact CD2-CE3 3.57Å; H148-W223 AromaticContact CG-CE3 3.89Å; H148-W223 WeakPolarHBondContact NE2-CB 3.38Å; H148-W223 AromaticContact NE2-CG 3.9Å; P149-W223 HydrophobicContact CG-CD2 4.42Å; P149-W223 HydrophobicContact CG-CZ2 3.93Å; H201-W223 HydrophobicContact CB-CE3 3.92Å; H201-W223 HydrophobicContact CB-CZ3 4.08Å; H201-W223 CarbonylContact O-C 3.6Å; L202-W223 HydrophobicContact CD1-CH2 4.36Å; L202-W223 HydrophobicContact CD1-CZ3 4.35Å; L202-W223 HydrophobicContact CD2-CD2 4.17Å; L202-W223 HydrophobicContact CD2-CE3 4.3Å; L202-W223 HydrophobicContact CD2-CG 4.46Å; L202-W223 HydrophobicContact CG-CE3 4.47Å; L214-W223 HydrophobicContact CD2-CH2 4.14Å; L214-W223 HydrophobicContact CD2-CZ2 4.17Å; W223-S225 PolarHBondContact O-N 3.46Å
224	G	83.4	Confident	82.5	Confident	55 Å²	55	41.1 Å²	41.1	57%	0.567	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	-1	-176.8	0	0	0	0	0	114.6	H201 A226	H201-G224 PolarHBondContact O-N 3.13Å; G224-A226 PolarHBondContact O-N 2.75Å
225	S	82.3	Confident	82.7	Confident	43 Å²	43	41 Å²	41	30%	0.301	27%	0.273	S	S	.	.			trans	-100.7	83.4	-176.5	-167.9	0	0	0	0	111.2	S203 G221 G222 W223 P227	S203-S225 PolarHBondContact OG-O 2.82Å; G221-S225 VanDerWaalsContact C-CB 3.46Å; G221-S225 WeakPolarHBondContact O-CB 3.49Å; G221-S225 PolarHBondContact O-OG 3.27Å; G222-S225 WeakPolarHBondContact O-CB 3.21Å; G222-S225 PolarHBondContact O-N 2.98Å; W223-S225 PolarHBondContact O-N 3.46Å; S225-P227 VanDerWaalsContact C-CD 3.44Å; S225-P227 WeakPolarHBondContact O-CD 3.35Å
226	A	81.5	Confident	82.9	Confident	20 Å²	20	37 Å²	37	17%	0.165	25%	0.253	C	S	.	.			trans	-121.9	63.8	178.7	0	0	0	0	0	112.3	I200 G224 G228 C229	I200-A226 HydrophobicContact CB-CB 4.09Å; I200-A226 HydrophobicContact CG2-CB 3.59Å; G224-A226 PolarHBondContact O-N 2.75Å; A226-G228 PolarHBondContact O-N 2.05Å; A226-C229 HydrophobicContact CB-CB 3.99Å; A226-C229 PolarHBondContact O-N 2.86Å
227	P	75.8	Confident	83.2	Confident	56 Å²	56	33.6 Å²	33.6	36%	0.364	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	127.2	-174.6	26.6	-34.4	0	0	0	111.7	S225 C229	S225-P227 VanDerWaalsContact C-CD 3.44Å; S225-P227 WeakPolarHBondContact O-CD 3.35Å; P227-C229 PolarHBondContact O-N 2.87Å
228	G	74	Confident	83.2	Confident	33 Å²	33	33.6 Å²	33.6	34%	0.34	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	-7.1	179.5	0	0	0	0	0	114.7	A226 Q506	A226-G228 PolarHBondContact O-N 2.05Å; G228-Q506 VanDerWaalsContact C-NE2 3.26Å; G228-Q506 PolarHBondContact O-NE2 3.49Å; G228-Q506 PolarHBondContact O-OE1 2.91Å
229	C	81.2	Confident	83	Confident	19 Å²	19	27.1 Å²	27.1	13%	0.128	21%	0.205	C	C	.	.			trans	-74.6	146	178.2	-70.1	0	0	0	0	111.5	C158 I200 A226 P227	C158-C229 HydrophobicContact CB-CB 3.7Å; C158-C229 WeakPolarHBondContact CB-SG 3.4Å; C158-C229 WeakPolarHBondContact SG-CB 3.3Å; C158-C229 CovalentContact SG-SG 2.04Å; C158-C229 PolarHBondContact SG-SG 2.81Å; I200-C229 HydrophobicContact CD1-CB 3.95Å; I200-C229 HydrophobicContact CG2-CB 4.31Å; A226-C229 HydrophobicContact CB-CB 3.99Å; A226-C229 PolarHBondContact O-N 2.86Å; P227-C229 PolarHBondContact O-N 2.87Å
230	T	80.7	Confident	82.7	Confident	61 Å²	61	25.4 Å²	25.4	37%	0.374	20%	0.196	S	C	.	.			trans	-127.5	163.9	171.9	68.6	0	0	0	0	109	G232 M233	T230-G232 PolarHBondContact O-N 3.25Å; T230-G232 VanDerWaalsContact O-N 3.14Å; T230-G232 PolarHBondContact OG1-N 3.26Å; T230-M233 WeakPolarHBondContact O-CA 3.47Å; T230-M233 VanDerWaalsContact O-CB 3.28Å; T230-M233 WeakPolarHBondContact O-CB 3.15Å; T230-M233 PolarHBondContact O-N 3.23Å
231	H	83.5	Confident	82.3	Confident	20 Å²	20	26.8 Å²	26.8	9%	0.093	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-62.5	-19.4	176	-75.2	-63	0	0	0	113.9	S193 A194 S195 T198 M233 D234	S193-H231 WeakPolarHBondContact CB-O 2.73Å; A194-H231 WeakPolarHBondContact O-CB 3.39Å; S195-H231 PolarHBondContact O-NE2 2.62Å; T198-H231 PolarHBondContact O-CE1 3.15Å; T198-H231 PolarHBondContact O-NE2 3.27Å; H231-M233 PolarHBondContact O-N 2.83Å; H231-M233 VanDerWaalsContact O-N 3.11Å; H231-D234 IonicContact CG-OD2 3.3Å; H231-D234 IonicContact ND1-OD1 2.88Å; H231-D234 PolarHBondContact ND1-OD1 2.87Å; H231-D234 IonicContact ND1-OD2 3.57Å; H231-D234 PolarHBondContact ND1-OD2 3.07Å; H231-D234 WeakPolarHBondContact O-CB 3.35Å; H231-D234 VanDerWaalsContact O-CG 3.22Å; H231-D234 PolarHBondContact O-N 2.91Å
232	G	78.2	Confident	81.6	Confident	23 Å²	23	27 Å²	27	24%	0.237	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-64.5	-9.6	169.2	0	0	0	0	0	113.8	T230	T230-G232 PolarHBondContact O-N 3.25Å; T230-G232 VanDerWaalsContact O-N 3.14Å; T230-G232 PolarHBondContact OG1-N 3.26Å
233	M	79.8	Confident	80.3	Confident	3 Å²	3	30.6 Å²	30.6	2%	0.015	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-106.1	7.7	174.3	-63.5	178.5	77.6	0	0	113	A159 D160 T230 H231 I235 Q506 Y508	A159-M233 HydrophobicContact CB-CB 4.46Å; A159-M233 VanDerWaalsContact CB-O 3.29Å; A159-M233 WeakPolarHBondContact CB-O 3.48Å; A159-M233 PolarHBondContact N-O 2.98Å; D160-M233 HydrophobicContact CB-CE 4.02Å; T230-M233 WeakPolarHBondContact O-CA 3.47Å; T230-M233 VanDerWaalsContact O-CB 3.28Å; T230-M233 WeakPolarHBondContact O-CB 3.15Å; T230-M233 PolarHBondContact O-N 3.23Å; H231-M233 PolarHBondContact O-N 2.83Å; H231-M233 VanDerWaalsContact O-N 3.11Å; M233-I235 PolarHBondContact O-N 3.35Å; M233-Q506 HydrophobicContact CE-CB 3.97Å; M233-Q506 HydrophobicContact CE-CG 4.25Å; M233-Q506 HydrophobicContact SD-CB 4.1Å; M233-Q506 HydrophobicContact SD-CG 4.38Å; M233-Y508 HydrophobicContact CG-CG 4.03Å; M233-Y508 HydrophobicContact SD-CD1 4.44Å
234	D	86	Confident	78.4	Confident	8 Å²	8	31.9 Å²	31.9	4%	0.043	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-60.9	125.8	177.6	-70.3	-22.9	0	0	0	109.7	R143 T156 A194 H231	R143-D234 HydrophobicContact CG-CB 4.26Å; T156-D234 WeakPolarHBondContact CB-OD1 3.5Å; T156-D234 HydrophobicContact CG2-CB 4.46Å; T156-D234 PolarHBondContact OG1-OD1 3.29Å; A194-D234 WeakPolarHBondContact CB-OD2 3.37Å; A194-D234 PolarHBondContact N-OD2 2.62Å; H231-D234 IonicContact CG-OD2 3.3Å; H231-D234 IonicContact ND1-OD1 2.88Å; H231-D234 PolarHBondContact ND1-OD1 2.87Å; H231-D234 IonicContact ND1-OD2 3.57Å; H231-D234 PolarHBondContact ND1-OD2 3.07Å; H231-D234 WeakPolarHBondContact O-CB 3.35Å; H231-D234 VanDerWaalsContact O-CG 3.22Å; H231-D234 PolarHBondContact O-N 2.91Å
235	I	88.1	Confident	76.5	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-85.8	139	-175.7	-162.3	59.6	0	0	0	111.4	V144 I157 A159 F162 P186 L188 M233 P459	V144-I235 HydrophobicContact CB-CG2 4.32Å; V144-I235 HydrophobicContact CG2-CG2 4.35Å; V144-I235 PolarHBondContact N-O 2.71Å; I157-I235 HydrophobicContact CB-CG2 3.92Å; I157-I235 HydrophobicContact CG2-CG2 4.1Å; I157-I235 WeakPolarHBondContact O-CG2 3.39Å; I157-I235 PolarHBondContact O-N 3.06Å; A159-I235 HydrophobicContact CB-CB 4.4Å; A159-I235 HydrophobicContact CB-CD1 3.98Å; F162-I235 HydrophobicContact CB-CG1 4.26Å; F162-I235 HydrophobicContact CD1-CD1 4.37Å; F162-I235 HydrophobicContact CD1-CG1 3.58Å; F162-I235 HydrophobicContact CD1-CG2 4.38Å; F162-I235 HydrophobicContact CD2-CG1 4.43Å; F162-I235 HydrophobicContact CD2-CG2 3.81Å; F162-I235 HydrophobicContact CE1-CG1 3.95Å; F162-I235 HydrophobicContact CE1-CG2 4.44Å; F162-I235 HydrophobicContact CE2-CG2 3.9Å; F162-I235 HydrophobicContact CG-CB 4.38Å; F162-I235 HydrophobicContact CG-CG1 3.84Å; F162-I235 HydrophobicContact CG-CG2 4.06Å; F162-I235 HydrophobicContact CZ-CG2 4.22Å; P186-I235 HydrophobicContact CB-CD1 4.09Å; P186-I235 HydrophobicContact CB-CG1 4.28Å; L188-I235 HydrophobicContact CD2-CD1 3.51Å; L188-I235 HydrophobicContact CG-CD1 4Å; M233-I235 PolarHBondContact O-N 3.35Å; I235-P459 HydrophobicContact CD1-CG 4.26Å
236	G	89.7	Confident	74.4	Confident	4 Å²	4	42.2 Å²	42.2	4%	0.041	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	162.7	168.2	0	0	0	0	0	112.2	G142 V187	G142-G236 CarbonylContact O-C 3.42Å; G142-G236 VanDerWaalsContact O-CA 3.29Å; G142-G236 WeakPolarHBondContact O-CA 3.48Å; V187-G236 VanDerWaalsContact CG2-C 3.48Å; V187-G236 PolarHBondContact N-O 2.82Å; V187-G236 VanDerWaalsContact O-CA 3.28Å; V187-G236 WeakPolarHBondContact O-CA 3.4Å; V187-G236 PolarHBondContact O-N 2.87Å
237	L	89.8	Confident	72.5	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	130.8	-178.3	-172.5	66.6	0	0	0	109.9	I132 L134 A141 G142 V144 A167 L170 L174 C239	I132-L237 HydrophobicContact CD1-CD2 4.49Å; L134-L237 HydrophobicContact CD2-CB 4.03Å; L134-L237 HydrophobicContact CD2-CD2 4.37Å; A141-L237 CarbonylContact C-O 3.58Å; A141-L237 VanDerWaalsContact CA-O 3.23Å; A141-L237 WeakPolarHBondContact CA-O 3.37Å; G142-L237 PolarHBondContact N-O 2.65Å; G142-L237 PolarHBondContact O-N 2.73Å; V144-L237 HydrophobicContact CG2-CB 3.41Å; V144-L237 VanDerWaalsContact CG2-CB 3.41Å; V144-L237 HydrophobicContact CG2-CD2 4.24Å; V144-L237 HydrophobicContact CG2-CG 4.42Å; A167-L237 VanDerWaalsContact CA-CD1 3.47Å; A167-L237 HydrophobicContact CB-CD1 3.46Å; A167-L237 VanDerWaalsContact CB-CD1 3.46Å; L170-L237 HydrophobicContact CB-CD2 3.68Å; L174-L237 HydrophobicContact CD1-CD2 4.09Å; L237-C239 WeakPolarHBondContact CD2-SG 3.01Å; L237-C239 WeakPolarHBondContact CG-SG 2.85Å
238	Q	87.1	Confident	70.9	Confident	11 Å²	11	48 Å²	48	5%	0.051	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	128.9	165.5	-177.2	74.7	55.5	0	0	106.9	A141 Y183 A184 Y185 V187 Y191 G240	A141-Q238 VanDerWaalsContact CB-OE1 3.28Å; Y183-Q238 CarbonylContact O-C 3.19Å; Y183-Q238 VanDerWaalsContact O-C 3.24Å; A184-Q238 CarbonylContact C-O 3.56Å; A184-Q238 WeakPolarHBondContact CA-O 3.34Å; Y185-Q238 HydrophobicContact CD1-CB 3.95Å; Y185-Q238 HydrophobicContact CD1-CG 4.18Å; Y185-Q238 HydrophobicContact CE1-CB 3.51Å; Y185-Q238 HydrophobicContact CE1-CG 3.4Å; Y185-Q238 VanDerWaalsContact CE1-CG 3.4Å; Y185-Q238 HydrophobicContact CE2-CB 4.32Å; Y185-Q238 PolarHBondContact N-O 2.99Å; Y185-Q238 PolarHBondContact O-N 3.16Å; V187-Q238 HydrophobicContact CG1-CB 4.48Å; Y191-Q238 PolarHBondContact OH-OE1 3.14Å; Q238-G240 PolarHBondContact NE2-O 3.3Å
239	C	84.6	Confident	69.5	Low	0 Å²	0	52.4 Å²	52.4	0%	0	31%	0.314	C	S	.	.			trans	-124.3	-18.9	-178.6	-62.4	0	0	0	0	113.4	N140 C171 S177 Y183 L237	N140-C239 WeakPolarHBondContact O-CA 3.21Å; N140-C239 PolarHBondContact O-N 3.17Å; C171-C239 WeakPolarHBondContact CA-SG 3.36Å; C171-C239 HydrophobicContact CB-CB 3.72Å; C171-C239 WeakPolarHBondContact CB-SG 3.37Å; C171-C239 WeakPolarHBondContact SG-CA 3.31Å; C171-C239 WeakPolarHBondContact SG-CB 3.45Å; C171-C239 CovalentContact SG-SG 2.04Å; C171-C239 PolarHBondContact SG-SG 3.37Å; S177-C239 WeakPolarHBondContact CB-O 3.28Å; S177-C239 WeakPolarHBondContact OG-CB 3.49Å; S177-C239 PolarHBondContact OG-O 3.12Å; Y183-C239 WeakPolarHBondContact CB-O 3.42Å; L237-C239 WeakPolarHBondContact CD2-SG 3.01Å; L237-C239 WeakPolarHBondContact CG-SG 2.85Å
240	G	80.5	Confident	68	Low	0 Å²	0	56.6 Å²	56.6	0%	0	33%	0.33	C	S	.	.	S	Bend	trans	-121.6	176.7	178.5	0	0	0	0	0	112.1	N140 Y183 Q238	N140-G240 PolarHBondContact O-N 2.99Å; Y183-G240 VanDerWaalsContact CB-O 3.27Å; Y183-G240 WeakPolarHBondContact CB-O 3.41Å; Y183-G240 VanDerWaalsContact CG-C 3.48Å; Q238-G240 PolarHBondContact NE2-O 3.3Å
241	P	70.8	Confident	67	Low	73 Å²	73	55.5 Å²	55.5	47%	0.474	32%	0.319	S	S	.	.			trans	-54.3	138.8	173.1	23.6	-32.4	0	0	0	109.5	Y183 S243	Y183-P241 HydrophobicContact CD1-CB 4.35Å; Y183-P241 HydrophobicContact CE1-CB 4.04Å; Y183-P241 HydrophobicContact CE2-CB 4.33Å; P241-S243 PolarHBondContact O-N 2.97Å
242	P	65.5	Low	66	Low	44 Å²	44	63 Å²	63	29%	0.286	35%	0.347	S	S	.	.			trans	-55.6	137.6	171	22.8	-30.6	0	0	0	107.9	T244	P242-T244 HydrophobicContact CB-CG2 4.27Å; P242-T244 HydrophobicContact CG-CG2 4.05Å; P242-T244 PolarHBondContact O-N 2.71Å; P242-T244 PolarHBondContact O-OG1 3.26Å
243	S	58.6	Low	65.8	Low	104 Å²	104	62.2 Å²	62.2	73%	0.727	34%	0.338	S	S	*	.			trans	-64.2	74.6	169.2	-69.2	0	0	0	0	108.5	P241 T245	P241-S243 PolarHBondContact O-N 2.97Å; S243-T245 PolarHBondContact O-N 3.02Å; S243-T245 VanDerWaalsContact O-N 3.16Å
244	T	46	Very low	65.6	Low	92 Å²	92	67.1 Å²	67.1	56%	0.564	36%	0.364	S	S	*	.			trans	-74.6	104.1	171	44.6	0	0	0	0	104.7	P242 K246	P242-T244 HydrophobicContact CB-CG2 4.27Å; P242-T244 HydrophobicContact CG-CG2 4.05Å; P242-T244 PolarHBondContact O-N 2.71Å; P242-T244 PolarHBondContact O-OG1 3.26Å; T244-K246 PolarHBondContact O-N 3.02Å
245	T	42.8	Very low	65.2	Low	123 Å²	123	71.2 Å²	71.2	76%	0.755	38%	0.382	S	S	*	.			trans	-50.5	105.4	140.4	36.4	0	0	0	0	104.2	S243 V247	S243-T245 PolarHBondContact O-N 3.02Å; S243-T245 VanDerWaalsContact O-N 3.16Å; T245-V247 PolarHBondContact O-N 3.46Å
246	K	37.4	Very low	64.8	Low	192 Å²	192	77.9 Å²	77.9	84%	0.835	41%	0.408	S	S	*	.			trans	-62.1	81	164.8	-79.1	-176.9	175.6	-179.9	0	105.5	T244 S248	T244-K246 PolarHBondContact O-N 3.02Å; K246-S248 PolarHBondContact O-N 3.08Å; K246-S248 VanDerWaalsContact O-N 3.09Å
247	V	42	Very low	64.3	Low	93 Å²	93	79.4 Å²	79.4	56%	0.564	42%	0.417	S	S	*	.			trans	-72.9	96.4	152.7	-157.7	0	0	0	0	101.9	T245 D249	T245-V247 PolarHBondContact O-N 3.46Å; V247-D249 WeakPolarHBondContact CG1-OD1 3.49Å; V247-D249 PolarHBondContact O-N 2.82Å
248	S	42.1	Very low	63.6	Low	104 Å²	104	82.9 Å²	82.9	73%	0.727	44%	0.436	S	S	*	.			trans	-64.3	80.8	165.5	52.4	0	0	0	0	106.2	K246 F250	K246-S248 PolarHBondContact O-N 3.08Å; K246-S248 VanDerWaalsContact O-N 3.09Å; S248-F250 PolarHBondContact O-N 2.77Å; S248-F250 VanDerWaalsContact O-N 3.14Å
249	D	45	Very low	62.9	Low	126 Å²	126	90.2 Å²	90.2	67%	0.674	47%	0.47	S	S	*	.			trans	-69.4	-6.4	-173.6	-84.6	-30.8	0	0	0	112.9	V247 Y251	V247-D249 WeakPolarHBondContact CG1-OD1 3.49Å; V247-D249 PolarHBondContact O-N 2.82Å; D249-Y251 PolarHBondContact O-N 3.09Å
250	F	50.6	Low	62.5	Low	107 Å²	107	94.4 Å²	94.4	47%	0.469	50%	0.496	S	S	.	.			trans	-88.9	77.2	169.9	-68.7	-74.7	0	0	0	110.3	S248 R252 L343 M345 P403	S248-F250 PolarHBondContact O-N 2.77Å; S248-F250 VanDerWaalsContact O-N 3.14Å; F250-R252 PolarHBondContact O-N 3.11Å; F250-L343 HydrophobicContact CE1-CD1 4.33Å; F250-M345 HydrophobicContact CD1-CE 4.16Å; F250-P403 HydrophobicContact CZ-CB 3.75Å
251	Y	58.3	Low	62.5	Low	39 Å²	39	96.2 Å²	96.2	15%	0.153	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-58.8	118.6	164.4	174	-94.4	0	0	0	109.2	D249 P253 Y266 D267 C270 N271	D249-Y251 PolarHBondContact O-N 3.09Å; Y251-P253 HydrophobicContact CE1-CB 4.13Å; Y251-Y266 HydrophobicContact CE1-CD1 4.31Å; Y251-D267 HydrophobicContact CE2-CB 4.01Å; Y251-D267 WeakPolarHBondContact OH-CB 3.44Å; Y251-D267 PolarHBondContact OH-N 3.34Å; Y251-C270 HydrophobicContact CD2-CB 3.24Å; Y251-C270 VanDerWaalsContact CD2-SG 3.56Å; Y251-C270 HydrophobicContact CE2-CB 3.63Å; Y251-C270 HydrophobicContact CG-CB 3.81Å; Y251-N271 WeakPolarHBondContact CD1-ND2 3.46Å; Y251-N271 VanDerWaalsContact CE1-ND2 3.26Å; Y251-N271 WeakPolarHBondContact CE1-ND2 3.33Å; Y251-N271 VanDerWaalsContact CG-ND2 3.32Å
252	R	62.9	Low	63.1	Low	176 Å²	176	92.8 Å²	92.8	66%	0.664	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-101.4	122.7	173	-173.5	175.5	177.1	155.8	-0.1	108.1	F250	F250-R252 PolarHBondContact O-N 3.11Å
253	P	73.7	Confident	63.9	Low	8 Å²	8	92.4 Å²	92.4	5%	0.052	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-65.3	149.7	175.5	28.8	-33.8	0	0	0	110.5	Y251 V264 I265 Y266 F347	Y251-P253 HydrophobicContact CE1-CB 4.13Å; P253-V264 HydrophobicContact CB-CG1 3.96Å; P253-V264 HydrophobicContact CG-CG1 4.1Å; P253-I265 WeakPolarHBondContact CA-O 3.31Å; P253-I265 WeakPolarHBondContact CB-O 3.22Å; P253-Y266 HydrophobicContact CB-CD1 3.66Å; P253-Y266 HydrophobicContact CB-CE1 3.63Å; P253-Y266 HydrophobicContact CB-CE2 4.5Å; P253-Y266 HydrophobicContact CB-CG 4.1Å; P253-Y266 HydrophobicContact CG-CD1 4.15Å; P253-Y266 HydrophobicContact CG-CE1 3.62Å; P253-F347 HydrophobicContact CG-CD1 3.96Å; P253-F347 HydrophobicContact CG-CD2 4.11Å; P253-F347 HydrophobicContact CG-CE1 3.82Å; P253-F347 HydrophobicContact CG-CE2 3.96Å; P253-F347 HydrophobicContact CG-CG 4.1Å; P253-F347 HydrophobicContact CG-CZ 3.79Å
254	D	76.2	Confident	65.2	Low	106 Å²	106	87.6 Å²	87.6	57%	0.567	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	144.3	171.7	-69	-47.2	0	0	0	109.5	I265	D254-I265 HydrophobicContact CB-CB 4.22Å; D254-I265 PolarHBondContact N-O 2.75Å; D254-I265 PolarHBondContact O-N 3.16Å
255	F	78	Confident	66.9	Low	94 Å²	94	85.5 Å²	85.5	41%	0.412	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	140.8	179	74.9	-83.9	0	0	0	111.2	I263 V349	F255-I263 WeakPolarHBondContact CA-O 3.18Å; F255-V349 HydrophobicContact CD2-CG1 4.02Å
256	Y	78.6	Confident	68.8	Low	139 Å²	139	79.7 Å²	79.7	55%	0.545	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	133.2	175.5	175.2	-93.9	0	0	0	109.5	N258 I263	Y256-N258 HydrophobicContact CE1-CB 4.03Å; Y256-I263 HydrophobicContact CD1-CD1 4.29Å; Y256-I263 PolarHBondContact N-O 3.08Å; Y256-I263 PolarHBondContact O-N 3.06Å
257	C	80	Confident	70.7	Confident	36 Å²	36	72.6 Å²	72.6	24%	0.243	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	124	174.1	-58.5	0	0	0	0	109.6	C351	C257-C351 HydrophobicContact CB-CB 3.64Å; C257-C351 WeakPolarHBondContact CB-SG 3.38Å; C257-C351 WeakPolarHBondContact SG-CA 3.14Å; C257-C351 WeakPolarHBondContact SG-CB 3.25Å; C257-C351 CovalentContact SG-SG 2.04Å; C257-C351 PolarHBondContact SG-SG 2.99Å
258	N	76.2	Confident	72.6	Confident	73 Å²	73	70.7 Å²	70.7	39%	0.39	35%	0.351	S	S	.	.			trans	-87.8	-179.9	163.4	-163.3	0.4	0	0	0	110	Y256 T260 T261 L307	Y256-N258 HydrophobicContact CE1-CB 4.03Å; N258-T260 PolarHBondContact O-N 2.86Å; N258-T261 WeakPolarHBondContact CB-O 3.49Å; N258-T261 PolarHBondContact N-O 2.89Å; N258-L307 WeakPolarHBondContact O-CD1 3.2Å
259	Q	70.7	Confident	74.2	Confident	165 Å²	165	70.2 Å²	70.2	77%	0.771	35%	0.348	S	S	*	.	S	Bend	trans	-62.1	-25.5	174.8	-61.5	-176.9	-3.4	0	0	113.1
260	T	76.5	Confident	75.3	Confident	88 Å²	88	67.6 Å²	67.6	54%	0.54	34%	0.338	S	S	.	.	S	Bend	trans	-123.6	-25	-173.6	53.7	0	0	0	0	114.3	N258 L307	N258-T260 PolarHBondContact O-N 2.86Å; T260-L307 WeakPolarHBondContact O-CB 3.4Å; T260-L307 WeakPolarHBondContact O-CG 3.48Å; T260-L307 PolarHBondContact O-N 2.82Å
261	T	80.5	Confident	76.1	Confident	39 Å²	39	63.2 Å²	63.2	24%	0.239	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	139.5	-171.9	51.9	0	0	0	0	111.6	N258 I305	N258-T261 WeakPolarHBondContact CB-O 3.49Å; N258-T261 PolarHBondContact N-O 2.89Å; T261-I305 CarbonylContact C-O 3.55Å; T261-I305 WeakPolarHBondContact CA-O 3.25Å
262	A	84	Confident	76.6	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.008	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	135.7	164.2	0	0	0	0	0	109.3	I305 L307 L326	A262-I305 HydrophobicContact CB-CB 4.43Å; A262-I305 PolarHBondContact N-O 2.92Å; A262-I305 PolarHBondContact O-N 3.32Å; A262-L307 HydrophobicContact CB-CD2 3.92Å; A262-L326 HydrophobicContact CB-CD1 3.84Å
263	I	82.9	Confident	77	Confident	36 Å²	36	61.5 Å²	61.5	19%	0.185	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	125.6	178.7	-52.8	176.6	0	0	0	107.6	F255 Y256 I265 L302 A303 Y304	F255-I263 WeakPolarHBondContact CA-O 3.18Å; Y256-I263 HydrophobicContact CD1-CD1 4.29Å; Y256-I263 PolarHBondContact N-O 3.08Å; Y256-I263 PolarHBondContact O-N 3.06Å; I263-I265 HydrophobicContact CG2-CG1 4.27Å; I263-L302 HydrophobicContact CG2-CD2 4.33Å; I263-A303 WeakPolarHBondContact CA-O 3.24Å; I263-Y304 HydrophobicContact CD1-CD1 4.24Å; I263-Y304 HydrophobicContact CD1-CE1 4.1Å; I263-Y304 HydrophobicContact CG1-CD1 3.97Å; I263-Y304 HydrophobicContact CG1-CE1 4.25Å; I263-Y304 HydrophobicContact CG2-CD1 4.44Å; I263-Y304 HydrophobicContact CG2-CE1 4.28Å
264	V	84.6	Confident	76.9	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.012	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	128.1	177.8	-168.6	0	0	0	0	108.6	P253 Y266 L302 A303 I305 L328 V349	P253-V264 HydrophobicContact CB-CG1 3.96Å; P253-V264 HydrophobicContact CG-CG1 4.1Å; V264-Y266 HydrophobicContact CB-CE2 4.07Å; V264-Y266 HydrophobicContact CG1-CD2 4.16Å; V264-Y266 HydrophobicContact CG1-CE2 3.41Å; V264-Y266 VanDerWaalsContact CG1-CE2 3.41Å; V264-L302 CarbonylContact O-C 3.59Å; V264-L302 WeakPolarHBondContact O-CA 3.27Å; V264-A303 HydrophobicContact CB-CB 4.28Å; V264-A303 PolarHBondContact N-O 2.86Å; V264-A303 PolarHBondContact O-N 3.43Å; V264-I305 HydrophobicContact CG2-CD1 4Å; V264-L328 HydrophobicContact CG2-CD1 3.57Å; V264-L328 HydrophobicContact CG2-CD2 4.5Å; V264-V349 HydrophobicContact CG2-CG2 4.35Å
265	I	82.1	Confident	77.2	Confident	48 Å²	48	59.5 Å²	59.5	25%	0.246	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	118.9	-172.3	-43.5	-177.7	0	0	0	108.5	P253 D254 I263 H300 L302	P253-I265 WeakPolarHBondContact CA-O 3.31Å; P253-I265 WeakPolarHBondContact CB-O 3.22Å; D254-I265 HydrophobicContact CB-CB 4.22Å; D254-I265 PolarHBondContact N-O 2.75Å; D254-I265 PolarHBondContact O-N 3.16Å; I263-I265 HydrophobicContact CG2-CG1 4.27Å; I265-H300 HydrophobicContact CG2-CB 4.18Å; I265-L302 HydrophobicContact CB-CD2 4.37Å; I265-L302 HydrophobicContact CD1-CD2 4.38Å; I265-L302 HydrophobicContact CG1-CD2 3.89Å; I265-L302 HydrophobicContact CG2-CD2 4.05Å
266	Y	82.5	Confident	77.4	Confident	1 Å²	1	57 Å²	57	0%	0.004	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	121.8	175.2	-62	-95.2	0	0	0	109.6	Y251 P253 V264 L274 I279 H300 I301 F347	Y251-Y266 HydrophobicContact CE1-CD1 4.31Å; P253-Y266 HydrophobicContact CB-CD1 3.66Å; P253-Y266 HydrophobicContact CB-CE1 3.63Å; P253-Y266 HydrophobicContact CB-CE2 4.5Å; P253-Y266 HydrophobicContact CB-CG 4.1Å; P253-Y266 HydrophobicContact CG-CD1 4.15Å; P253-Y266 HydrophobicContact CG-CE1 3.62Å; V264-Y266 HydrophobicContact CB-CE2 4.07Å; V264-Y266 HydrophobicContact CG1-CD2 4.16Å; V264-Y266 HydrophobicContact CG1-CE2 3.41Å; V264-Y266 VanDerWaalsContact CG1-CE2 3.41Å; Y266-L274 HydrophobicContact CD1-CD2 3.96Å; Y266-L274 HydrophobicContact CD2-CD2 4.47Å; Y266-L274 HydrophobicContact CG-CD2 3.71Å; Y266-I279 HydrophobicContact CD1-CD1 4.4Å; Y266-I279 HydrophobicContact CD2-CD1 4.19Å; Y266-I279 HydrophobicContact CD2-CG1 4.46Å; Y266-I279 HydrophobicContact CE1-CD1 3.95Å; Y266-I279 HydrophobicContact CE2-CD1 3.71Å; Y266-I279 HydrophobicContact CE2-CG1 4.12Å; Y266-I279 HydrophobicContact CE2-CG2 4.22Å; Y266-H300 CarbonylContact O-C 3.45Å; Y266-H300 WeakPolarHBondContact O-CA 3.17Å; Y266-H300 WeakPolarHBondContact O-CB 3.21Å; Y266-I301 PolarHBondContact N-O 3.41Å; Y266-I301 PolarHBondContact O-N 3.33Å; Y266-F347 HydrophobicContact CE1-CD2 4.45Å; Y266-F347 AromaticContact CE1-CE2 3.88Å; Y266-F347 HydrophobicContact CE1-CE2 3.88Å; Y266-F347 HydrophobicContact CE1-CZ 4.5Å
267	D	78	Confident	77.4	Confident	44 Å²	44	54.8 Å²	54.8	24%	0.235	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	122.3	173.8	-170.6	-23.1	0	0	0	109.6	Y251 S269 C270 N271	Y251-D267 HydrophobicContact CE2-CB 4.01Å; Y251-D267 WeakPolarHBondContact OH-CB 3.44Å; Y251-D267 PolarHBondContact OH-N 3.34Å; D267-S269 VanDerWaalsContact C-N 3.29Å; D267-S269 VanDerWaalsContact OD1-CB 3.22Å; D267-S269 WeakPolarHBondContact OD1-CB 3.4Å; D267-S269 PolarHBondContact OD1-N 2.97Å; D267-S269 PolarHBondContact OD1-OG 2.77Å; D267-S269 PolarHBondContact OD2-OG 3.47Å; D267-S269 VanDerWaalsContact OD2-OG 3.07Å; D267-C270 PolarHBondContact O-N 2.96Å; D267-N271 PolarHBondContact O-N 2.86Å; D267-N271 PolarHBondContact O-ND2 3.34Å
268	K	81.8	Confident	77.2	Confident	52 Å²	52	54.7 Å²	54.7	23%	0.226	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-23.1	178.3	-71.5	-176.4	163.3	-174.4	0	113	C270 N271 P272 D296 N297 T299 I301	K268-C270 PolarHBondContact O-N 3.06Å; K268-N271 CarbonylContact O-C 3.57Å; K268-N271 PolarHBondContact O-N 2.84Å; K268-P272 WeakPolarHBondContact O-CA 3.35Å; K268-P272 VanDerWaalsContact O-N 3.17Å; K268-D296 WeakPolarHBondContact CE-OD1 3.46Å; K268-D296 IonicContact NZ-OD1 3.53Å; K268-D296 PolarHBondContact NZ-OD1 3.31Å; K268-N297 WeakPolarHBondContact CD-O 3.45Å; K268-N297 WeakPolarHBondContact CE-O 3.21Å; K268-N297 PolarHBondContact NZ-O 2.97Å; K268-T299 VanDerWaalsContact CB-O 3.31Å; K268-T299 WeakPolarHBondContact CB-O 3.26Å; K268-T299 PolarHBondContact N-O 2.79Å; K268-I301 HydrophobicContact CG-CG1 4.35Å
269	S	75.1	Confident	77.4	Confident	95 Å²	95	51.4 Å²	51.4	66%	0.664	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-33.5	175.7	72.1	0	0	0	0	111.5	D267	D267-S269 VanDerWaalsContact C-N 3.29Å; D267-S269 VanDerWaalsContact OD1-CB 3.22Å; D267-S269 WeakPolarHBondContact OD1-CB 3.4Å; D267-S269 PolarHBondContact OD1-N 2.97Å; D267-S269 PolarHBondContact OD1-OG 2.77Å; D267-S269 PolarHBondContact OD2-OG 3.47Å; D267-S269 VanDerWaalsContact OD2-OG 3.07Å
270	C	67.9	Low	77.9	Confident	70 Å²	70	50 Å²	50	47%	0.473	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-22.3	173.7	-56.7	0	0	0	0	113.3	Y251 D267 K268	Y251-C270 HydrophobicContact CD2-CB 3.24Å; Y251-C270 VanDerWaalsContact CD2-SG 3.56Å; Y251-C270 HydrophobicContact CE2-CB 3.63Å; Y251-C270 HydrophobicContact CG-CB 3.81Å; D267-C270 PolarHBondContact O-N 2.96Å; K268-C270 PolarHBondContact O-N 3.06Å
271	N	68.4	Low	77.9	Confident	15 Å²	15	46.3 Å²	46.3	8%	0.08	26%	0.264	C	S	.	.			trans	-135.7	73.3	-176.4	-57.4	-92.3	0	0	0	111.5	Y251 D267 K268 D273 L274 R330	Y251-N271 WeakPolarHBondContact CD1-ND2 3.46Å; Y251-N271 VanDerWaalsContact CE1-ND2 3.26Å; Y251-N271 WeakPolarHBondContact CE1-ND2 3.33Å; Y251-N271 VanDerWaalsContact CG-ND2 3.32Å; D267-N271 PolarHBondContact O-N 2.86Å; D267-N271 PolarHBondContact O-ND2 3.34Å; K268-N271 CarbonylContact O-C 3.57Å; K268-N271 PolarHBondContact O-N 2.84Å; N271-D273 PolarHBondContact O-N 2.6Å; N271-L274 HydrophobicContact CB-CB 3.92Å; N271-L274 WeakPolarHBondContact O-CB 3.5Å; N271-L274 PolarHBondContact O-N 3.14Å; N271-R330 PolarHBondContact OD1-NH1 2.75Å
272	P	69.2	Low	77.5	Confident	117 Å²	117	46.5 Å²	46.5	76%	0.76	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-17.9	-174.7	26.9	-35.2	0	0	0	113.7	K268	K268-P272 WeakPolarHBondContact O-CA 3.35Å; K268-P272 VanDerWaalsContact O-N 3.17Å
273	D	71	Confident	76.7	Confident	63 Å²	63	49.5 Å²	49.5	34%	0.337	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-5.6	178.7	65.4	-27.6	0	0	0	113.7	N271 M278 R330 Y332 N342	N271-D273 PolarHBondContact O-N 2.6Å; D273-M278 WeakPolarHBondContact O-CE 3.4Å; D273-R330 IonicContact OD1-CZ 3.33Å; D273-R330 IonicContact OD1-NH2 3.54Å; D273-R330 PolarHBondContact OD1-NH2 2.88Å; D273-R330 IonicContact OD2-NH2 3.48Å; D273-R330 PolarHBondContact OD2-NH2 2.7Å; D273-Y332 WeakPolarHBondContact OD2-CE1 3.22Å; D273-N342 PolarHBondContact OD2-ND2 3.12Å
274	L	71.8	Confident	75.6	Confident	10 Å²	10	56.2 Å²	56.2	5%	0.052	31%	0.314	C	S	.	.			trans	-76.1	135.8	-175.2	-171.7	73.2	0	0	0	112.1	Y266 N271 M278 I279 I301 R330	Y266-L274 HydrophobicContact CD1-CD2 3.96Å; Y266-L274 HydrophobicContact CD2-CD2 4.47Å; Y266-L274 HydrophobicContact CG-CD2 3.71Å; N271-L274 HydrophobicContact CB-CB 3.92Å; N271-L274 WeakPolarHBondContact O-CB 3.5Å; N271-L274 PolarHBondContact O-N 3.14Å; L274-M278 HydrophobicContact CD1-CB 4.2Å; L274-M278 HydrophobicContact CD1-SD 4.39Å; L274-I279 HydrophobicContact CD1-CD1 3.76Å; L274-I279 HydrophobicContact CD1-CG1 4.34Å; L274-I279 HydrophobicContact CD2-CD1 4.5Å; L274-I301 HydrophobicContact CB-CD1 4.25Å; L274-I301 HydrophobicContact CD2-CB 4.16Å; L274-I301 HydrophobicContact CD2-CD1 3.75Å; L274-I301 HydrophobicContact CD2-CG1 4.1Å; L274-I301 HydrophobicContact CG-CD1 3.66Å; L274-R330 HydrophobicContact CD1-CG 3.92Å; L274-R330 VanDerWaalsContact CD1-CZ 3.46Å
275	N	81	Confident	74.8	Confident	61 Å²	61	61.9 Å²	61.9	33%	0.326	35%	0.348	S	S	.	.			trans	-132.5	164.7	169.8	65.8	51.2	0	0	0	111.5	S277 M278	N275-S277 VanDerWaalsContact C-N 3.29Å; N275-S277 PolarHBondContact O-N 3.15Å; N275-S277 WeakPolarHBondContact OD1-CB 3.01Å; N275-S277 PolarHBondContact OD1-N 2.85Å; N275-S277 VanDerWaalsContact OD1-N 3.15Å; N275-M278 WeakPolarHBondContact ND2-CE 3.23Å; N275-M278 WeakPolarHBondContact O-CB 3.23Å; N275-M278 PolarHBondContact O-N 3.28Å; N275-M278 VanDerWaalsContact O-N 3.13Å; N275-M278 VanDerWaalsContact OD1-CG 3.31Å; N275-M278 WeakPolarHBondContact OD1-CG 3.24Å; N275-M278 PolarHBondContact OD1-N 3.11Å; N275-M278 VanDerWaalsContact OD1-N 3.13Å
276	S	81.8	Confident	74.2	Confident	43 Å²	43	62.7 Å²	62.7	30%	0.301	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-56.6	-37.9	-178.3	55.4	0	0	0	0	114.2	M278 I279 D296	S276-M278 PolarHBondContact O-N 3.3Å; S276-I279 PolarHBondContact O-N 2.8Å; S276-D296 PolarHBondContact N-OD2 2.78Å
277	S	79.8	Confident	73.6	Confident	92 Å²	92	65.3 Å²	65.3	64%	0.643	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-65.9	-18.5	-179.7	-55.4	0	0	0	0	114.1	N275	N275-S277 VanDerWaalsContact C-N 3.29Å; N275-S277 PolarHBondContact O-N 3.15Å; N275-S277 WeakPolarHBondContact OD1-CB 3.01Å; N275-S277 PolarHBondContact OD1-N 2.85Å; N275-S277 VanDerWaalsContact OD1-N 3.15Å
278	M	75.8	Confident	73.4	Confident	34 Å²	34	71 Å²	71	17%	0.167	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-80.3	-16.9	178.3	-70.3	169.8	-178.9	0	0	113	D273 L274 N275 S276 R330 T331	D273-M278 WeakPolarHBondContact O-CE 3.4Å; L274-M278 HydrophobicContact CD1-CB 4.2Å; L274-M278 HydrophobicContact CD1-SD 4.39Å; N275-M278 WeakPolarHBondContact ND2-CE 3.23Å; N275-M278 WeakPolarHBondContact O-CB 3.23Å; N275-M278 PolarHBondContact O-N 3.28Å; N275-M278 VanDerWaalsContact O-N 3.13Å; N275-M278 VanDerWaalsContact OD1-CG 3.31Å; N275-M278 WeakPolarHBondContact OD1-CG 3.24Å; N275-M278 PolarHBondContact OD1-N 3.11Å; N275-M278 VanDerWaalsContact OD1-N 3.13Å; S276-M278 PolarHBondContact O-N 3.3Å; M278-R330 HydrophobicContact CB-CG 4.45Å; M278-R330 CarbonylContact O-C 3.52Å; M278-R330 VanDerWaalsContact O-CA 3.28Å; M278-R330 WeakPolarHBondContact O-CA 3.44Å; M278-T331 WeakPolarHBondContact CB-O 3.33Å; M278-T331 WeakPolarHBondContact CG-O 3.26Å; M278-T331 PolarHBondContact O-N 3.04Å; M278-T331 PolarHBondContact O-OG1 3.44Å
279	I	79.5	Confident	73	Confident	3 Å²	3	76.5 Å²	76.5	2%	0.015	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	116.7	-177.4	-56.5	-57.8	0	0	0	110.4	Y266 L274 S276 V294 A303 L328 R330	Y266-I279 HydrophobicContact CD1-CD1 4.4Å; Y266-I279 HydrophobicContact CD2-CD1 4.19Å; Y266-I279 HydrophobicContact CD2-CG1 4.46Å; Y266-I279 HydrophobicContact CE1-CD1 3.95Å; Y266-I279 HydrophobicContact CE2-CD1 3.71Å; Y266-I279 HydrophobicContact CE2-CG1 4.12Å; Y266-I279 HydrophobicContact CE2-CG2 4.22Å; L274-I279 HydrophobicContact CD1-CD1 3.76Å; L274-I279 HydrophobicContact CD1-CG1 4.34Å; L274-I279 HydrophobicContact CD2-CD1 4.5Å; S276-I279 PolarHBondContact O-N 2.8Å; I279-V294 HydrophobicContact CB-CG1 4.3Å; I279-V294 HydrophobicContact CB-CG2 4.37Å; I279-V294 HydrophobicContact CG2-CG2 4.37Å; I279-A303 HydrophobicContact CG2-CB 3.99Å; I279-L328 HydrophobicContact CG2-CD2 4.2Å; I279-R330 HydrophobicContact CD1-CB 4.12Å; I279-R330 HydrophobicContact CD1-CG 4.09Å
280	R	81.9	Confident	73.3	Confident	135 Å²	135	72.6 Å²	72.6	51%	0.509	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	156.3	-177.3	-62.6	-175.1	127.3	144.3	-1.1	111.8	L328 I329	R280-L328 CarbonylContact O-C 3.6Å; R280-L328 WeakPolarHBondContact O-CA 3.1Å; R280-I329 PolarHBondContact N-O 3.17Å; R280-I329 PolarHBondContact O-N 2.95Å; R280-I329 VanDerWaalsContact O-O 3.1Å
281	L	76.5	Confident	73.9	Confident	12 Å²	12	77.2 Å²	77.2	6%	0.063	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	141.7	165.3	-71.3	169.6	0	0	0	109.6	Q283 L286 Y292 I305 C310 L328	L281-Q283 PolarHBondContact O-N 3.36Å; L281-L286 HydrophobicContact CB-CD2 4.3Å; L281-L286 HydrophobicContact CD1-CD2 3.76Å; L281-Y292 HydrophobicContact CD1-CD1 3.85Å; L281-Y292 HydrophobicContact CD1-CE1 4.22Å; L281-Y292 HydrophobicContact CD1-CG 4.19Å; L281-I305 HydrophobicContact CD1-CG2 4.02Å; L281-I305 HydrophobicContact CD2-CD1 4.13Å; L281-I305 HydrophobicContact CD2-CG1 4.3Å; L281-I305 HydrophobicContact CD2-CG2 4.07Å; L281-C310 HydrophobicContact CD1-CB 4.07Å; L281-L328 HydrophobicContact CD2-CD2 4.12Å; L281-L328 HydrophobicContact CD2-CG 4.15Å
282	D	71.3	Confident	74.8	Confident	42 Å²	42	79.3 Å²	79.3	23%	0.225	42%	0.419	C	S	.	.	S	Bend	trans	-77.1	69	177.5	-172.3	13.8	0	0	0	111.6	N327 I329 K346	D282-N327 HydrophobicContact CB-CB 3.52Å; D282-N327 WeakPolarHBondContact CB-O 3.48Å; D282-N327 PolarHBondContact N-O 3.37Å; D282-I329 HydrophobicContact CB-CD1 3.48Å; D282-I329 VanDerWaalsContact CB-CD1 3.48Å; D282-I329 HydrophobicContact CB-CG1 3.72Å; D282-I329 WeakPolarHBondContact OD1-CD1 3.47Å; D282-K346 WeakPolarHBondContact OD2-CD 3.43Å; D282-K346 WeakPolarHBondContact OD2-CE 3.15Å; D282-K346 IonicContact OD2-NZ 2.61Å; D282-K346 PolarHBondContact OD2-NZ 3.21Å
283	Q	67.3	Low	75.7	Confident	64 Å²	64	78 Å²	78	30%	0.299	40%	0.403	S	S	.	.			trans	-143.4	128.1	175.2	-66	-173.3	-21.8	0	0	109.5	L281 V285 C310 G311	L281-Q283 PolarHBondContact O-N 3.36Å; Q283-V285 PolarHBondContact O-N 3.09Å; Q283-C310 PolarHBondContact NE2-O 3.25Å; Q283-C310 PolarHBondContact OE1-O 2.95Å; Q283-G311 PolarHBondContact NE2-O 3.5Å
284	D	61.4	Low	76.5	Confident	178 Å²	178	76.4 Å²	76.4	95%	0.952	40%	0.395	S	S	*	.	S	Bend	trans	-61.8	-30.6	177.2	-68.7	-40.3	0	0	0	112.2
285	V	65.8	Low	77.2	Confident	121 Å²	121	79.2 Å²	79.2	73%	0.733	41%	0.411	S	S	*	.	S	Bend	trans	-137.5	116.7	176.9	-175.4	0	0	0	0	109.1	Q283	Q283-V285 PolarHBondContact O-N 3.09Å
286	L	69.5	Low	77.6	Confident	65 Å²	65	79.9 Å²	79.9	34%	0.34	41%	0.414	S	S	.	.			trans	-76.2	135.7	171.5	-77.9	132.3	0	0	0	110.1	L281 C290 Y292	L281-L286 HydrophobicContact CB-CD2 4.3Å; L281-L286 HydrophobicContact CD1-CD2 3.76Å; L286-C290 HydrophobicContact CD2-CB 4.06Å; L286-C290 WeakPolarHBondContact CD2-SG 3.49Å; L286-Y292 HydrophobicContact CD1-CE1 4.08Å; L286-Y292 HydrophobicContact CD2-CD1 4.02Å; L286-Y292 HydrophobicContact CD2-CE1 3.9Å
287	P	70.4	Confident	77.7	Confident	55 Å²	55	81.9 Å²	81.9	36%	0.357	42%	0.421	S	S	.	.			trans	-59.1	145.4	170.1	-22.5	34.3	0	0	0	110.8	E289 C290 G309	P287-E289 PolarHBondContact O-N 3.44Å; P287-C290 WeakPolarHBondContact O-CB 3.43Å; P287-C290 PolarHBondContact O-N 3.43Å; P287-G309 WeakPolarHBondContact CB-O 3.32Å; P287-G309 VanDerWaalsContact CG-O 3.26Å; P287-G309 WeakPolarHBondContact CG-O 3.34Å
288	I	74.4	Confident	77.8	Confident	165 Å²	165	83.1 Å²	83.1	85%	0.846	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-30.5	179.9	-62.8	169.3	0	0	0	111.7	C290	I288-C290 VanDerWaalsContact C-N 3.28Å; I288-C290 PolarHBondContact O-N 3.35Å
289	E	74.3	Confident	78.3	Confident	166 Å²	166	85 Å²	85	78%	0.776	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-6.7	-179.9	-50.7	-163.4	-161.9	0	0	113.7	P287 Q291	P287-E289 PolarHBondContact O-N 3.44Å; E289-Q291 PolarHBondContact O-N 3.14Å
290	C	79.6	Confident	78.6	Confident	14 Å²	14	87.8 Å²	87.8	10%	0.095	45%	0.452	C	S	.	.			trans	-88.4	90.2	176.9	-177	0	0	0	0	111.6	L286 P287 I288 C310	L286-C290 HydrophobicContact CD2-CB 4.06Å; L286-C290 WeakPolarHBondContact CD2-SG 3.49Å; P287-C290 WeakPolarHBondContact O-CB 3.43Å; P287-C290 PolarHBondContact O-N 3.43Å; I288-C290 VanDerWaalsContact C-N 3.28Å; I288-C290 PolarHBondContact O-N 3.35Å; C290-C310 VanDerWaalsContact CA-SG 3.52Å; C290-C310 HydrophobicContact CB-CB 3.92Å; C290-C310 WeakPolarHBondContact CB-SG 3.34Å; C290-C310 WeakPolarHBondContact SG-CA 3.29Å; C290-C310 WeakPolarHBondContact SG-CB 3.4Å; C290-C310 CovalentContact SG-SG 2.04Å; C290-C310 PolarHBondContact SG-SG 2.83Å
291	Q	81.4	Confident	78.9	Confident	166 Å²	166	81.4 Å²	81.4	78%	0.776	43%	0.427	S	S	*	.			trans	-100.5	76.9	170.8	-63.8	-175.2	6.2	0	0	110.3	E289	E289-Q291 PolarHBondContact O-N 3.14Å
292	Y	86.7	Confident	79.4	Confident	60 Å²	60	82.5 Å²	82.5	24%	0.235	43%	0.433	C	S	.	.			trans	-82.7	150.2	170.2	82.2	-85.6	0	0	0	110.2	L281 L286 V294 Y304	L281-Y292 HydrophobicContact CD1-CD1 3.85Å; L281-Y292 HydrophobicContact CD1-CE1 4.22Å; L281-Y292 HydrophobicContact CD1-CG 4.19Å; L286-Y292 HydrophobicContact CD1-CE1 4.08Å; L286-Y292 HydrophobicContact CD2-CD1 4.02Å; L286-Y292 HydrophobicContact CD2-CE1 3.9Å; Y292-V294 HydrophobicContact CD2-CG2 4.04Å; Y292-V294 HydrophobicContact CE2-CG2 3.77Å; Y292-Y304 WeakPolarHBondContact CA-O 2.96Å; Y292-Y304 WeakPolarHBondContact CB-O 3Å
293	H	87.8	Confident	80.2	Confident	89 Å²	89	80.5 Å²	80.5	41%	0.412	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	152.2	174.6	73.1	91.6	0	0	0	111.2	D295 Y304	H293-D295 IonicContact CE1-OD1 3.71Å; H293-D295 PolarHBondContact CE1-OD1 2.75Å; H293-D295 IonicContact CE1-OD2 2.76Å; H293-D295 PolarHBondContact CE1-OD2 3.25Å; H293-D295 IonicContact ND1-OD1 2.68Å; H293-D295 PolarHBondContact ND1-OD1 3.16Å; H293-D295 IonicContact ND1-OD2 3.33Å; H293-Y304 AromaticContact CE1-CD2 2.98Å; H293-Y304 WeakPolarHBondContact CE1-CD2 2.92Å; H293-Y304 AromaticContact CE1-CE2 3.45Å; H293-Y304 VanDerWaalsContact CE1-CE2 3.45Å; H293-Y304 WeakPolarHBondContact CE1-CE2 3.42Å; H293-Y304 AromaticContact CE1-CG 3.49Å; H293-Y304 VanDerWaalsContact CE1-CG 3.49Å; H293-Y304 PolarHBondContact N-O 3.28Å; H293-Y304 AromaticContact ND1-CD2 3.5Å; H293-Y304 WeakPolarHBondContact ND1-CD2 3.34Å; H293-Y304 WeakPolarHBondContact NE2-CB 3.32Å; H293-Y304 AromaticContact NE2-CD2 3.53Å; H293-Y304 AromaticContact NE2-CG 3.51Å; H293-Y304 PolarHBondContact O-N 3.11Å
294	V	88	Confident	81.2	Confident	30 Å²	30	80.6 Å²	80.6	18%	0.182	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	112.5	180	-175.3	0	0	0	0	108.1	I279 Y292 I301 L302 A303	I279-V294 HydrophobicContact CB-CG1 4.3Å; I279-V294 HydrophobicContact CB-CG2 4.37Å; I279-V294 HydrophobicContact CG2-CG2 4.37Å; Y292-V294 HydrophobicContact CD2-CG2 4.04Å; Y292-V294 HydrophobicContact CE2-CG2 3.77Å; V294-I301 HydrophobicContact CG1-CG2 3.48Å; V294-I301 VanDerWaalsContact CG1-CG2 3.48Å; V294-L302 CarbonylContact C-O 3.59Å; V294-L302 WeakPolarHBondContact CA-O 3.27Å; V294-A303 HydrophobicContact CG2-CB 4.1Å
295	D	87.7	Confident	82.4	Confident	69 Å²	69	72.2 Å²	72.2	37%	0.369	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	135.8	179.3	-62.7	-13.2	0	0	0	109.7	H293 I301 L302 Y304	H293-D295 IonicContact CE1-OD1 3.71Å; H293-D295 PolarHBondContact CE1-OD1 2.75Å; H293-D295 IonicContact CE1-OD2 2.76Å; H293-D295 PolarHBondContact CE1-OD2 3.25Å; H293-D295 IonicContact ND1-OD1 2.68Å; H293-D295 PolarHBondContact ND1-OD1 3.16Å; H293-D295 IonicContact ND1-OD2 3.33Å; D295-I301 CarbonylContact O-C 3.5Å; D295-I301 WeakPolarHBondContact O-CA 3.36Å; D295-I301 WeakPolarHBondContact O-CG2 3.47Å; D295-L302 HydrophobicContact CB-CB 4.36Å; D295-L302 PolarHBondContact N-O 3.44Å; D295-L302 PolarHBondContact O-N 2.9Å; D295-Y304 HydrophobicContact CB-CE2 4.29Å; D295-Y304 WeakPolarHBondContact OD2-CE2 3.37Å
296	D	88	Confident	83.2	Confident	75 Å²	75	68.1 Å²	68.1	40%	0.401	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	103.7	-176.6	-164	-22.4	0	0	0	109.6	K268 S276	K268-D296 WeakPolarHBondContact CE-OD1 3.46Å; K268-D296 IonicContact NZ-OD1 3.53Å; K268-D296 PolarHBondContact NZ-OD1 3.31Å; S276-D296 PolarHBondContact N-OD2 2.78Å
297	N	85.3	Confident	83.5	Confident	84 Å²	84	65.5 Å²	65.5	45%	0.449	34%	0.338	S	S	.	.			trans	-101.5	171.5	179.6	-166.8	9.8	0	0	0	111.2	K268 T299 H300	K268-N297 WeakPolarHBondContact CD-O 3.45Å; K268-N297 WeakPolarHBondContact CE-O 3.21Å; K268-N297 PolarHBondContact NZ-O 2.97Å; N297-T299 VanDerWaalsContact C-N 3.28Å; N297-T299 PolarHBondContact O-N 3.16Å; N297-H300 WeakPolarHBondContact CA-O 3.19Å; N297-H300 WeakPolarHBondContact CB-O 3.32Å; N297-H300 PolarHBondContact N-O 2.96Å
298	T	82.1	Confident	83.6	Confident	119 Å²	119	68.9 Å²	68.9	73%	0.73	36%	0.357	S	S	*	.	S	Bend	trans	-59.7	-35.4	-179.8	55	0	0	0	0	113.5
299	T	85.1	Confident	83.6	Confident	72 Å²	72	62.2 Å²	62.2	44%	0.442	33%	0.329	S	S	.	.	S	Bend	trans	-106.7	-29.6	-176.9	53.8	0	0	0	0	113.9	K268 N297	K268-T299 VanDerWaalsContact CB-O 3.31Å; K268-T299 WeakPolarHBondContact CB-O 3.26Å; K268-T299 PolarHBondContact N-O 2.79Å; N297-T299 VanDerWaalsContact C-N 3.28Å; N297-T299 PolarHBondContact O-N 3.16Å
300	H	87.1	Confident	83.8	Confident	63 Å²	63	54.3 Å²	54.3	29%	0.292	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	154.6	-172.9	-61.4	81.7	0	0	0	112.4	I265 Y266 N297	I265-H300 HydrophobicContact CG2-CB 4.18Å; Y266-H300 CarbonylContact O-C 3.45Å; Y266-H300 WeakPolarHBondContact O-CA 3.17Å; Y266-H300 WeakPolarHBondContact O-CB 3.21Å; N297-H300 WeakPolarHBondContact CA-O 3.19Å; N297-H300 WeakPolarHBondContact CB-O 3.32Å; N297-H300 PolarHBondContact N-O 2.96Å
301	I	87	Confident	82.9	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	130.8	163.6	-55.1	-165.4	0	0	0	108.7	Y266 K268 L274 V294 D295	Y266-I301 PolarHBondContact N-O 3.41Å; Y266-I301 PolarHBondContact O-N 3.33Å; K268-I301 HydrophobicContact CG-CG1 4.35Å; L274-I301 HydrophobicContact CB-CD1 4.25Å; L274-I301 HydrophobicContact CD2-CB 4.16Å; L274-I301 HydrophobicContact CD2-CD1 3.75Å; L274-I301 HydrophobicContact CD2-CG1 4.1Å; L274-I301 HydrophobicContact CG-CD1 3.66Å; V294-I301 HydrophobicContact CG1-CG2 3.48Å; V294-I301 VanDerWaalsContact CG1-CG2 3.48Å; D295-I301 CarbonylContact O-C 3.5Å; D295-I301 WeakPolarHBondContact O-CA 3.36Å; D295-I301 WeakPolarHBondContact O-CG2 3.47Å
302	L	88.2	Confident	82.1	Confident	35 Å²	35	48.8 Å²	48.8	18%	0.183	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	115.8	-172.8	-67.6	145.4	0	0	0	109.3	I263 V264 I265 V294 D295 Y304	I263-L302 HydrophobicContact CG2-CD2 4.33Å; V264-L302 CarbonylContact O-C 3.59Å; V264-L302 WeakPolarHBondContact O-CA 3.27Å; I265-L302 HydrophobicContact CB-CD2 4.37Å; I265-L302 HydrophobicContact CD1-CD2 4.38Å; I265-L302 HydrophobicContact CG1-CD2 3.89Å; I265-L302 HydrophobicContact CG2-CD2 4.05Å; V294-L302 CarbonylContact C-O 3.59Å; V294-L302 WeakPolarHBondContact CA-O 3.27Å; D295-L302 HydrophobicContact CB-CB 4.36Å; D295-L302 PolarHBondContact N-O 3.44Å; D295-L302 PolarHBondContact O-N 2.9Å; L302-Y304 HydrophobicContact CB-CD2 4.47Å; L302-Y304 HydrophobicContact CB-CE2 3.75Å
303	A	87.4	Confident	80.8	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	122.1	173.6	0	0	0	0	0	110.5	I263 V264 I279 V294	I263-A303 WeakPolarHBondContact CA-O 3.24Å; V264-A303 HydrophobicContact CB-CB 4.28Å; V264-A303 PolarHBondContact N-O 2.86Å; V264-A303 PolarHBondContact O-N 3.43Å; I279-A303 HydrophobicContact CG2-CB 3.99Å; V294-A303 HydrophobicContact CG2-CB 4.1Å
304	Y	87.9	Confident	79.2	Confident	67 Å²	67	50.2 Å²	50.2	26%	0.263	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	113.3	178	-61.1	-97.3	0	0	0	109.6	I263 Y292 H293 D295 L302	I263-Y304 HydrophobicContact CD1-CD1 4.24Å; I263-Y304 HydrophobicContact CD1-CE1 4.1Å; I263-Y304 HydrophobicContact CG1-CD1 3.97Å; I263-Y304 HydrophobicContact CG1-CE1 4.25Å; I263-Y304 HydrophobicContact CG2-CD1 4.44Å; I263-Y304 HydrophobicContact CG2-CE1 4.28Å; Y292-Y304 WeakPolarHBondContact CA-O 2.96Å; Y292-Y304 WeakPolarHBondContact CB-O 3Å; H293-Y304 AromaticContact CE1-CD2 2.98Å; H293-Y304 WeakPolarHBondContact CE1-CD2 2.92Å; H293-Y304 AromaticContact CE1-CE2 3.45Å; H293-Y304 VanDerWaalsContact CE1-CE2 3.45Å; H293-Y304 WeakPolarHBondContact CE1-CE2 3.42Å; H293-Y304 AromaticContact CE1-CG 3.49Å; H293-Y304 VanDerWaalsContact CE1-CG 3.49Å; H293-Y304 PolarHBondContact N-O 3.28Å; H293-Y304 AromaticContact ND1-CD2 3.5Å; H293-Y304 WeakPolarHBondContact ND1-CD2 3.34Å; H293-Y304 WeakPolarHBondContact NE2-CB 3.32Å; H293-Y304 AromaticContact NE2-CD2 3.53Å; H293-Y304 AromaticContact NE2-CG 3.51Å; H293-Y304 PolarHBondContact O-N 3.11Å; D295-Y304 HydrophobicContact CB-CE2 4.29Å; D295-Y304 WeakPolarHBondContact OD2-CE2 3.37Å; L302-Y304 HydrophobicContact CB-CD2 4.47Å; L302-Y304 HydrophobicContact CB-CE2 3.75Å
305	I	87	Confident	77.7	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	113	-173	-56.2	147	0	0	0	108.6	T261 A262 V264 L281 L307 C310 L326 L328	T261-I305 CarbonylContact C-O 3.55Å; T261-I305 WeakPolarHBondContact CA-O 3.25Å; A262-I305 HydrophobicContact CB-CB 4.43Å; A262-I305 PolarHBondContact N-O 2.92Å; A262-I305 PolarHBondContact O-N 3.32Å; V264-I305 HydrophobicContact CG2-CD1 4Å; L281-I305 HydrophobicContact CD1-CG2 4.02Å; L281-I305 HydrophobicContact CD2-CD1 4.13Å; L281-I305 HydrophobicContact CD2-CG1 4.3Å; L281-I305 HydrophobicContact CD2-CG2 4.07Å; I305-L307 PolarHBondContact O-N 3.37Å; I305-C310 HydrophobicContact CG2-CB 4.1Å; I305-L326 HydrophobicContact CG2-CD1 3.93Å; I305-L326 HydrophobicContact CG2-CD2 4.24Å; I305-L328 HydrophobicContact CD1-CD1 3.9Å; I305-L328 HydrophobicContact CD1-CD2 3.53Å; I305-L328 HydrophobicContact CD1-CG 4.04Å
306	P	82.6	Confident	76.1	Confident	36 Å²	36	54.3 Å²	54.3	23%	0.234	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	130.8	169.6	-24.9	34.3	0	0	0	111.5	V308 C310	P306-V308 VanDerWaalsContact C-N 3.26Å; P306-V308 WeakPolarHBondContact CB-O 3.3Å; P306-V308 PolarHBondContact O-N 2.04Å; P306-C310 WeakPolarHBondContact O-CB 3.47Å
307	L	76.3	Confident	74.4	Confident	10 Å²	10	54.2 Å²	54.2	5%	0.052	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-27.7	178.2	-64.6	177.8	0	0	0	112.1	N258 T260 A262 I305 I324 L326 C351 I353	N258-L307 WeakPolarHBondContact O-CD1 3.2Å; T260-L307 WeakPolarHBondContact O-CB 3.4Å; T260-L307 WeakPolarHBondContact O-CG 3.48Å; T260-L307 PolarHBondContact O-N 2.82Å; A262-L307 HydrophobicContact CB-CD2 3.92Å; I305-L307 PolarHBondContact O-N 3.37Å; L307-I324 HydrophobicContact CB-CD1 4.13Å; L307-I324 HydrophobicContact CD1-CD1 4.48Å; L307-L326 HydrophobicContact CD2-CD1 3.82Å; L307-C351 HydrophobicContact CD2-CB 4.14Å; L307-I353 HydrophobicContact CD1-CD1 4.04Å
308	V	72.6	Confident	73	Confident	125 Å²	125	54 Å²	54	76%	0.758	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	137.6	177	-174.9	0	0	0	0	108.4	P306 C310	P306-V308 VanDerWaalsContact C-N 3.26Å; P306-V308 WeakPolarHBondContact CB-O 3.3Å; P306-V308 PolarHBondContact O-N 2.04Å; V308-C310 VanDerWaalsContact C-N 3.33Å; V308-C310 PolarHBondContact O-N 3.06Å
309	G	73.9	Confident	71.7	Confident	25 Å²	25	53.3 Å²	53.3	26%	0.258	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	90	-28.2	178.3	0	0	0	0	0	115	P287 G311	P287-G309 WeakPolarHBondContact CB-O 3.32Å; P287-G309 VanDerWaalsContact CG-O 3.26Å; P287-G309 WeakPolarHBondContact CG-O 3.34Å; G309-G311 VanDerWaalsContact C-N 3.31Å; G309-G311 PolarHBondContact O-N 3.33Å
310	C	77.4	Confident	70.3	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.007	32%	0.317	C	S	.	.	S	Bend	trans	-87.9	20.2	-179.9	-67.5	0	0	0	0	115.9	L281 Q283 C290 I305 P306 V308 G312	L281-C310 HydrophobicContact CD1-CB 4.07Å; Q283-C310 PolarHBondContact NE2-O 3.25Å; Q283-C310 PolarHBondContact OE1-O 2.95Å; C290-C310 VanDerWaalsContact CA-SG 3.52Å; C290-C310 HydrophobicContact CB-CB 3.92Å; C290-C310 WeakPolarHBondContact CB-SG 3.34Å; C290-C310 WeakPolarHBondContact SG-CA 3.29Å; C290-C310 WeakPolarHBondContact SG-CB 3.4Å; C290-C310 CovalentContact SG-SG 2.04Å; C290-C310 PolarHBondContact SG-SG 2.83Å; I305-C310 HydrophobicContact CG2-CB 4.1Å; P306-C310 WeakPolarHBondContact O-CB 3.47Å; V308-C310 VanDerWaalsContact C-N 3.33Å; V308-C310 PolarHBondContact O-N 3.06Å; C310-G312 VanDerWaalsContact C-N 3.32Å; C310-G312 PolarHBondContact O-N 3.04Å
311	G	62	Low	69	Low	41 Å²	41	49.7 Å²	49.7	42%	0.423	31%	0.31	S	S	.	.			trans	62.4	30.2	172.6	0	0	0	0	0	115.5	Q283 G309 S313	Q283-G311 PolarHBondContact NE2-O 3.5Å; G309-G311 VanDerWaalsContact C-N 3.31Å; G309-G311 PolarHBondContact O-N 3.33Å; G311-S313 PolarHBondContact O-N 2.88Å
312	G	63.3	Low	68	Low	23 Å²	23	52.1 Å²	52.1	24%	0.237	32%	0.323	C	S	.	.			trans	-58.1	133.3	169.4	0	0	0	0	0	111.1	C310 K325	C310-G312 VanDerWaalsContact C-N 3.32Å; C310-G312 PolarHBondContact O-N 3.04Å; G312-K325 CarbonylContact C-O 3.45Å; G312-K325 VanDerWaalsContact CA-O 3.3Å; G312-K325 WeakPolarHBondContact CA-O 3.1Å
313	S	59.2	Low	67	Low	52 Å²	52	50.8 Å²	50.8	36%	0.364	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	123.3	179.1	58.7	0	0	0	0	110.7	G311 T315 K325	G311-S313 PolarHBondContact O-N 2.88Å; S313-T315 VanDerWaalsContact C-N 3.29Å; S313-T315 PolarHBondContact O-N 2.9Å; S313-T315 WeakPolarHBondContact OG-CG2 3.31Å; S313-K325 PolarHBondContact N-O 3.47Å; S313-K325 PolarHBondContact O-N 2.83Å
314	L	55.4	Low	66.1	Low	126 Å²	126	51.7 Å²	51.7	66%	0.66	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	81.6	169.5	-69.7	165.9	0	0	0	108.2	I322 I324	L314-I322 HydrophobicContact CD2-CG2 3.42Å; L314-I322 VanDerWaalsContact CD2-CG2 3.42Å; L314-I324 HydrophobicContact CD2-CG1 4.01Å
315	T	55.4	Low	65.4	Low	60 Å²	60	51.6 Å²	51.6	37%	0.368	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-36	-172.7	53.6	0	0	0	0	113.6	S313 K325	S313-T315 VanDerWaalsContact C-N 3.29Å; S313-T315 PolarHBondContact O-N 2.9Å; S313-T315 WeakPolarHBondContact OG-CG2 3.31Å; T315-K325 HydrophobicContact CG2-CD 3.8Å; T315-K325 HydrophobicContact CG2-CG 4.41Å; T315-K325 WeakPolarHBondContact OG1-CD 3.09Å; T315-K325 WeakPolarHBondContact OG1-CE 3.17Å; T315-K325 PolarHBondContact OG1-NZ 2.96Å
316	L	54.8	Low	64.6	Low	125 Å²	125	51.8 Å²	51.8	65%	0.654	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.9	108.4	175.4	-75.5	101.7	0	0	0	109.2	A323	L316-A323 VanDerWaalsContact O-CB 3.22Å; L316-A323 WeakPolarHBondContact O-CB 3.3Å; L316-A323 PolarHBondContact O-N 3.28Å
317	S	52.7	Low	64.1	Low	74 Å²	74	52.3 Å²	52.3	52%	0.517	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	115.1	161.2	63.7	0	0	0	0	107.8
318	N	54.9	Low	63.8	Low	79 Å²	79	52 Å²	52	42%	0.422	32%	0.322	S	S	.	.			trans	-83.2	-179	163.8	63.6	4.8	0	0	0	109.2	T320 S321	N318-T320 VanDerWaalsContact CG-OG1 3.32Å; N318-T320 PolarHBondContact ND2-OG1 2.95Å; N318-T320 VanDerWaalsContact ND2-OG1 3.09Å; N318-T320 PolarHBondContact O-N 3.15Å; N318-T320 PolarHBondContact OD1-N 2.95Å; N318-T320 PolarHBondContact OD1-OG1 2.84Å; N318-S321 PolarHBondContact N-O 3.49Å; N318-S321 VanDerWaalsContact N-O 3.15Å; N318-S321 PolarHBondContact ND2-OG 3.38Å; N318-S321 VanDerWaalsContact OD1-CA 3.29Å; N318-S321 WeakPolarHBondContact OD1-CA 3.05Å; N318-S321 PolarHBondContact OD1-N 3.45Å; N318-S321 PolarHBondContact OD1-O 3.15Å; N318-S321 PolarHBondContact OD1-OG 3.49Å
319	S	55.1	Low	63.8	Low	105 Å²	105	46.7 Å²	46.7	73%	0.734	29%	0.29	S	S	*	.	S	Bend	trans	-63.7	-23.2	175.2	51.8	0	0	0	0	112.8
320	T	56.3	Low	63.5	Low	37 Å²	37	45.7 Å²	45.7	23%	0.227	28%	0.278	C	S	.	.	S	Bend	trans	-105.8	-17.8	-169.2	55.1	0	0	0	0	114.8	N318 P354 R355	N318-T320 VanDerWaalsContact CG-OG1 3.32Å; N318-T320 PolarHBondContact ND2-OG1 2.95Å; N318-T320 VanDerWaalsContact ND2-OG1 3.09Å; N318-T320 PolarHBondContact O-N 3.15Å; N318-T320 PolarHBondContact OD1-N 2.95Å; N318-T320 PolarHBondContact OD1-OG1 2.84Å; T320-P354 CarbonylContact O-C 3.48Å; T320-P354 WeakPolarHBondContact O-CA 3.23Å; T320-R355 PolarHBondContact O-N 3.34Å
321	S	59.7	Low	63	Low	21 Å²	21	46.9 Å²	46.9	15%	0.147	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	143.9	-173.8	60.3	0	0	0	0	112.6	N318 I353	N318-S321 PolarHBondContact N-O 3.49Å; N318-S321 VanDerWaalsContact N-O 3.15Å; N318-S321 PolarHBondContact ND2-OG 3.38Å; N318-S321 VanDerWaalsContact OD1-CA 3.29Å; N318-S321 WeakPolarHBondContact OD1-CA 3.05Å; N318-S321 PolarHBondContact OD1-N 3.45Å; N318-S321 PolarHBondContact OD1-O 3.15Å; N318-S321 PolarHBondContact OD1-OG 3.49Å; S321-I353 CarbonylContact C-O 3.52Å; S321-I353 WeakPolarHBondContact CA-O 3.48Å
322	I	65.5	Low	63.1	Low	51 Å²	51	45.9 Å²	45.9	26%	0.262	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	117.4	171	-59.7	171.8	0	0	0	106.7	L314 I324 C351 I353 R355	L314-I322 HydrophobicContact CD2-CG2 3.42Å; L314-I322 VanDerWaalsContact CD2-CG2 3.42Å; I322-I324 HydrophobicContact CG2-CG1 4.02Å; I322-C351 VanDerWaalsContact O-O 3.1Å; I322-I353 HydrophobicContact CB-CB 4.37Å; I322-I353 PolarHBondContact N-O 3.48Å; I322-I353 PolarHBondContact O-N 3.15Å; I322-R355 HydrophobicContact CD1-CG 4.11Å; I322-R355 HydrophobicContact CG1-CG 3.67Å
323	A	67.4	Low	62.8	Low	8 Å²	8	50.8 Å²	50.8	7%	0.066	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	109.7	172.8	0	0	0	0	0	110.1	L316 T350 C351 L352	L316-A323 VanDerWaalsContact O-CB 3.22Å; L316-A323 WeakPolarHBondContact O-CB 3.3Å; L316-A323 PolarHBondContact O-N 3.28Å; A323-T350 HydrophobicContact CB-CG2 3.95Å; A323-C351 WeakPolarHBondContact CA-O 3.39Å; A323-L352 HydrophobicContact CB-CD2 3.72Å
324	I	69.4	Low	62.6	Low	18 Å²	18	48.7 Å²	48.7	9%	0.092	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	116.2	172.1	-56.4	-179.7	0	0	0	107.7	L307 L314 I322 L326 T350 C351 I353	L307-I324 HydrophobicContact CB-CD1 4.13Å; L307-I324 HydrophobicContact CD1-CD1 4.48Å; L314-I324 HydrophobicContact CD2-CG1 4.01Å; I322-I324 HydrophobicContact CG2-CG1 4.02Å; I324-L326 HydrophobicContact CG2-CG 4.49Å; I324-T350 CarbonylContact O-C 3.6Å; I324-T350 WeakPolarHBondContact O-CA 3.46Å; I324-C351 HydrophobicContact CB-CB 4.49Å; I324-C351 PolarHBondContact N-O 3.27Å; I324-C351 PolarHBondContact O-N 2.71Å; I324-I353 HydrophobicContact CD1-CD1 3.67Å; I324-I353 HydrophobicContact CG1-CD1 4.45Å
325	K	71.9	Confident	62.7	Low	66 Å²	66	45.5 Å²	45.5	29%	0.287	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	122.9	175.9	-69.6	-172.2	-176.9	155.7	0	110.9	G312 S313 T315 T348 V349 T350	G312-K325 CarbonylContact C-O 3.45Å; G312-K325 VanDerWaalsContact CA-O 3.3Å; G312-K325 WeakPolarHBondContact CA-O 3.1Å; S313-K325 PolarHBondContact N-O 3.47Å; S313-K325 PolarHBondContact O-N 2.83Å; T315-K325 HydrophobicContact CG2-CD 3.8Å; T315-K325 HydrophobicContact CG2-CG 4.41Å; T315-K325 WeakPolarHBondContact OG1-CD 3.09Å; T315-K325 WeakPolarHBondContact OG1-CE 3.17Å; T315-K325 PolarHBondContact OG1-NZ 2.96Å; K325-T348 HydrophobicContact CB-CG2 4.32Å; K325-T348 HydrophobicContact CD-CG2 4.22Å; K325-T348 HydrophobicContact CG-CG2 4.35Å; K325-V349 CarbonylContact C-O 3.55Å; K325-V349 WeakPolarHBondContact CA-O 3.23Å; K325-T350 HydrophobicContact CG-CG2 4.12Å
326	L	70.3	Confident	63	Low	5 Å²	5	47.5 Å²	47.5	3%	0.026	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	128	172.9	-67.7	165	0	0	0	108.5	A262 I305 L307 I324 T348 V349	A262-L326 HydrophobicContact CB-CD1 3.84Å; I305-L326 HydrophobicContact CG2-CD1 3.93Å; I305-L326 HydrophobicContact CG2-CD2 4.24Å; L307-L326 HydrophobicContact CD2-CD1 3.82Å; I324-L326 HydrophobicContact CG2-CG 4.49Å; L326-T348 CarbonylContact O-C 3.56Å; L326-T348 WeakPolarHBondContact O-CA 3.41Å; L326-V349 HydrophobicContact CB-CB 4.37Å; L326-V349 PolarHBondContact N-O 2.97Å; L326-V349 PolarHBondContact O-N 3.16Å
327	N	73.6	Confident	63.5	Low	47 Å²	47	46.8 Å²	46.8	25%	0.251	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	120.5	176.2	-70.9	-34.9	0	0	0	108.4	D282 K346 F347 T348	D282-N327 HydrophobicContact CB-CB 3.52Å; D282-N327 WeakPolarHBondContact CB-O 3.48Å; D282-N327 PolarHBondContact N-O 3.37Å; N327-K346 VanDerWaalsContact CG-CE 3.49Å; N327-F347 WeakPolarHBondContact CA-O 3.24Å; N327-T348 WeakPolarHBondContact OD1-CB 3.42Å; N327-T348 WeakPolarHBondContact OD1-CG2 3.17Å; N327-T348 PolarHBondContact OD1-OG1 3.16Å
328	L	70.3	Confident	63.7	Low	2 Å²	2	43.6 Å²	43.6	1%	0.01	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	136.3	175	-77.7	132.7	0	0	0	109	V264 I279 R280 L281 I305 K346 F347 V349	V264-L328 HydrophobicContact CG2-CD1 3.57Å; V264-L328 HydrophobicContact CG2-CD2 4.5Å; I279-L328 HydrophobicContact CG2-CD2 4.2Å; R280-L328 CarbonylContact O-C 3.6Å; R280-L328 WeakPolarHBondContact O-CA 3.1Å; L281-L328 HydrophobicContact CD2-CD2 4.12Å; L281-L328 HydrophobicContact CD2-CG 4.15Å; I305-L328 HydrophobicContact CD1-CD1 3.9Å; I305-L328 HydrophobicContact CD1-CD2 3.53Å; I305-L328 HydrophobicContact CD1-CG 4.04Å; L328-K346 CarbonylContact O-C 3.24Å; L328-K346 WeakPolarHBondContact O-CA 3.47Å; L328-F347 HydrophobicContact CB-CB 4.3Å; L328-F347 PolarHBondContact N-O 3.42Å; L328-F347 PolarHBondContact O-N 2.94Å; L328-V349 HydrophobicContact CD1-CB 4.27Å; L328-V349 HydrophobicContact CD1-CG2 3.43Å; L328-V349 VanDerWaalsContact CD1-CG2 3.43Å
329	I	71	Confident	63.5	Low	15 Å²	15	42.6 Å²	42.6	8%	0.077	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	123.6	170.7	-67.1	169.7	0	0	0	108.1	R280 D282 T331 M345 K346 I483	R280-I329 PolarHBondContact N-O 3.17Å; R280-I329 PolarHBondContact O-N 2.95Å; R280-I329 VanDerWaalsContact O-O 3.1Å; D282-I329 HydrophobicContact CB-CD1 3.48Å; D282-I329 VanDerWaalsContact CB-CD1 3.48Å; D282-I329 HydrophobicContact CB-CG1 3.72Å; D282-I329 WeakPolarHBondContact OD1-CD1 3.47Å; I329-T331 HydrophobicContact CG2-CG2 3.5Å; I329-T331 VanDerWaalsContact CG2-CG2 3.5Å; I329-M345 WeakPolarHBondContact CA-O 3.31Å; I329-K346 HydrophobicContact CG1-CB 4.43Å; I329-K346 HydrophobicContact CG1-CG 4.39Å; I329-I483 HydrophobicContact CD1-CD1 3.59Å; I329-I483 HydrophobicContact CD1-CG1 4.27Å
330	R	67.6	Low	63.4	Low	3 Å²	3	37.8 Å²	37.8	1%	0.011	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	117.8	156	-178.6	-176.1	175.5	-176.1	5.5	107.5	N271 D273 L274 M278 I279 Y332 P344 M345	N271-R330 PolarHBondContact OD1-NH1 2.75Å; D273-R330 IonicContact OD1-CZ 3.33Å; D273-R330 IonicContact OD1-NH2 3.54Å; D273-R330 PolarHBondContact OD1-NH2 2.88Å; D273-R330 IonicContact OD2-NH2 3.48Å; D273-R330 PolarHBondContact OD2-NH2 2.7Å; L274-R330 HydrophobicContact CD1-CG 3.92Å; L274-R330 VanDerWaalsContact CD1-CZ 3.46Å; M278-R330 HydrophobicContact CB-CG 4.45Å; M278-R330 CarbonylContact O-C 3.52Å; M278-R330 VanDerWaalsContact O-CA 3.28Å; M278-R330 WeakPolarHBondContact O-CA 3.44Å; I279-R330 HydrophobicContact CD1-CB 4.12Å; I279-R330 HydrophobicContact CD1-CG 4.09Å; R330-Y332 HydrophobicContact CB-CE2 4.41Å; R330-Y332 WeakPolarHBondContact CD-OH 3.27Å; R330-Y332 HydrophobicContact CG-CD2 4.43Å; R330-Y332 HydrophobicContact CG-CE2 3.69Å; R330-Y332 PolarHBondContact NE-OH 3.18Å; R330-Y332 PolarHBondContact NH1-OH 3.15Å; R330-P344 CarbonylContact O-C 3.42Å; R330-P344 WeakPolarHBondContact O-CA 3.34Å; R330-P344 VanDerWaalsContact O-CB 3.24Å; R330-P344 WeakPolarHBondContact O-CB 3.48Å; R330-M345 HydrophobicContact CB-CB 4.48Å; R330-M345 PolarHBondContact N-O 3.27Å; R330-M345 PolarHBondContact O-N 2.85Å
331	T	67.7	Low	63.4	Low	26 Å²	26	40.4 Å²	40.4	16%	0.16	24%	0.239	C	C	.	.			trans	-99.6	145.3	175.6	56.2	0	0	0	0	111.4	M278 I329	M278-T331 WeakPolarHBondContact CB-O 3.33Å; M278-T331 WeakPolarHBondContact CG-O 3.26Å; M278-T331 PolarHBondContact O-N 3.04Å; M278-T331 PolarHBondContact O-OG1 3.44Å; I329-T331 HydrophobicContact CG2-CG2 3.5Å; I329-T331 VanDerWaalsContact CG2-CG2 3.5Å
332	Y	63.1	Low	63.3	Low	20 Å²	20	42.9 Å²	42.9	8%	0.078	25%	0.251	C	S	.	.			trans	-117.4	155	173.8	-62.2	-107.2	0	0	0	109.7	D273 R330 N342 L343 P344 V481	D273-Y332 WeakPolarHBondContact OD2-CE1 3.22Å; R330-Y332 HydrophobicContact CB-CE2 4.41Å; R330-Y332 WeakPolarHBondContact CD-OH 3.27Å; R330-Y332 HydrophobicContact CG-CD2 4.43Å; R330-Y332 HydrophobicContact CG-CE2 3.69Å; R330-Y332 PolarHBondContact NE-OH 3.18Å; R330-Y332 PolarHBondContact NH1-OH 3.15Å; Y332-N342 HydrophobicContact CD1-CB 3.85Å; Y332-N342 HydrophobicContact CE1-CB 3.43Å; Y332-N342 VanDerWaalsContact CE1-CB 3.43Å; Y332-L343 WeakPolarHBondContact CD2-O 3.39Å; Y332-L343 WeakPolarHBondContact CE2-O 3.29Å; Y332-L343 VanDerWaalsContact CZ-O 3.3Å; Y332-L343 PolarHBondContact OH-O 3.3Å; Y332-P344 HydrophobicContact CD2-CB 4.46Å; Y332-P344 HydrophobicContact CD2-CG 4.25Å; Y332-V481 WeakPolarHBondContact O-CG2 3.42Å; Y332-V481 PolarHBondContact O-N 2.91Å
333	L	58.7	Low	62.9	Low	126 Å²	126	41.6 Å²	41.6	66%	0.66	24%	0.244	S	C	*	.	B	Isolated β-bridge	trans	-93.3	135.5	166.8	-64.1	174.9	0	0	0	108.8	P335	L333-P335 WeakPolarHBondContact O-CD 3.48Å
334	T	53.6	Low	62.4	Low	8 Å²	8	41.8 Å²	41.8	5%	0.049	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-61.2	122.2	178.5	-55.1	0	0	0	0	110	I340 N475 G478 S479	T334-I340 HydrophobicContact CG2-CD1 3.96Å; T334-I340 HydrophobicContact CG2-CG1 3.88Å; T334-N475 HydrophobicContact CG2-CB 4.37Å; T334-G478 PolarHBondContact O-N 2.04Å; T334-S479 PolarHBondContact N-O 3.01Å; T334-S479 PolarHBondContact OG1-O 2.81Å
335	P	58.6	Low	62.1	Low	59 Å²	59	42.6 Å²	42.6	38%	0.383	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-62.4	159.9	178.6	23.8	-32	0	0	0	111.6	L333 N337 G338 I339	L333-P335 WeakPolarHBondContact O-CD 3.48Å; P335-N337 WeakPolarHBondContact CG-OD1 3.4Å; P335-N337 PolarHBondContact O-N 2.79Å; P335-N337 VanDerWaalsContact O-N 3.07Å; P335-G338 PolarHBondContact O-N 2.76Å; P335-I339 WeakPolarHBondContact CG-O 3.23Å
336	A	61.8	Low	61.8	Low	102 Å²	102	44 Å²	44	84%	0.843	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.7	-173.2	0	0	0	0	0	114.5	G338	A336-G338 VanDerWaalsContact C-N 3.26Å; A336-G338 PolarHBondContact O-N 2.75Å
337	N	63.8	Low	61.7	Low	111 Å²	111	45.1 Å²	45.1	59%	0.594	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-6.6	175.7	67.2	-1.4	0	0	0	113.6	P335 I339	P335-N337 WeakPolarHBondContact CG-OD1 3.4Å; P335-N337 PolarHBondContact O-N 2.79Å; P335-N337 VanDerWaalsContact O-N 3.07Å; N337-I339 PolarHBondContact O-N 3.35Å; N337-I339 PolarHBondContact OD1-N 3.1Å; N337-I339 PolarHBondContact OD1-O 3.23Å
338	G	57	Low	61.4	Low	6 Å²	6	46.2 Å²	46.2	6%	0.062	27%	0.268	C	S	.	.	S	Bend	trans	73.5	-0.3	-177.3	0	0	0	0	0	115.2	P335 A336	P335-G338 PolarHBondContact O-N 2.76Å; A336-G338 VanDerWaalsContact C-N 3.26Å; A336-G338 PolarHBondContact O-N 2.75Å
339	I	51.3	Low	61.3	Low	58 Å²	58	46.5 Å²	46.5	30%	0.297	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	109.6	-176.6	-57.1	175.2	0	0	0	108.7	P335 N337	P335-I339 WeakPolarHBondContact CG-O 3.23Å; N337-I339 PolarHBondContact O-N 3.35Å; N337-I339 PolarHBondContact OD1-N 3.1Å; N337-I339 PolarHBondContact OD1-O 3.23Å
340	I	54	Low	61.3	Low	5 Å²	5	48 Å²	48	3%	0.026	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	110.2	-179.9	-59.5	153.6	0	0	0	108.5	T334 N342 Y473 N475 V481	T334-I340 HydrophobicContact CG2-CD1 3.96Å; T334-I340 HydrophobicContact CG2-CG1 3.88Å; I340-N342 WeakPolarHBondContact CG2-O 3.15Å; I340-Y473 HydrophobicContact CG2-CD2 4.4Å; I340-N475 HydrophobicContact CD1-CB 3.59Å; I340-V481 HydrophobicContact CD1-CB 4.33Å; I340-V481 HydrophobicContact CD1-CG1 3.91Å; I340-V481 HydrophobicContact CD1-CG2 3.61Å; I340-V481 HydrophobicContact CG1-CG2 4Å; I340-V481 HydrophobicContact CG2-CG1 4.17Å; I340-V481 HydrophobicContact CG2-CG2 4.12Å
341	S	56	Low	61.6	Low	92 Å²	92	48 Å²	48	64%	0.643	28%	0.28	S	S	*	.			trans	-94.7	-27.3	169.6	56.8	0	0	0	0	112.7
342	N	57.4	Low	61.7	Low	73 Å²	73	52.2 Å²	52.2	39%	0.39	30%	0.301	S	S	.	.	S	Bend	trans	-100.8	120.1	-177.7	-58.6	0.1	0	0	0	109.3	D273 Y332 I340	D273-N342 PolarHBondContact OD2-ND2 3.12Å; Y332-N342 HydrophobicContact CD1-CB 3.85Å; Y332-N342 HydrophobicContact CE1-CB 3.43Å; Y332-N342 VanDerWaalsContact CE1-CB 3.43Å; I340-N342 WeakPolarHBondContact CG2-O 3.15Å
343	L	56.2	Low	61.9	Low	24 Å²	24	53.4 Å²	53.4	13%	0.126	31%	0.308	C	S	.	.			trans	-82	137.2	-173.2	-94.7	130.8	0	0	0	113.3	F250 Y332 M345 P404 Y473	F250-L343 HydrophobicContact CE1-CD1 4.33Å; Y332-L343 WeakPolarHBondContact CD2-O 3.39Å; Y332-L343 WeakPolarHBondContact CE2-O 3.29Å; Y332-L343 VanDerWaalsContact CZ-O 3.3Å; Y332-L343 PolarHBondContact OH-O 3.3Å; L343-M345 HydrophobicContact CB-CG 4.41Å; L343-M345 WeakPolarHBondContact O-CG 3.46Å; L343-M345 PolarHBondContact O-N 3.32Å; L343-P404 HydrophobicContact CD1-CB 3.51Å; L343-P404 HydrophobicContact CD1-CG 3.63Å; L343-P404 HydrophobicContact CD2-CB 4.38Å; L343-P404 HydrophobicContact CD2-CG 3.54Å; L343-P404 HydrophobicContact CG-CB 3.87Å; L343-P404 HydrophobicContact CG-CG 3.56Å; L343-Y473 HydrophobicContact CD2-CE2 3.49Å; L343-Y473 VanDerWaalsContact CD2-CE2 3.49Å; L343-Y473 WeakPolarHBondContact CD2-OH 3.16Å; L343-Y473 HydrophobicContact CG-CE2 3.87Å
344	P	57.6	Low	61.9	Low	11 Å²	11	51.9 Å²	51.9	7%	0.071	31%	0.306	C	S	.	.			trans	-55.9	115.8	155.5	-20.2	32.3	0	0	0	109.7	R330 Y332 V481	R330-P344 CarbonylContact O-C 3.42Å; R330-P344 WeakPolarHBondContact O-CA 3.34Å; R330-P344 VanDerWaalsContact O-CB 3.24Å; R330-P344 WeakPolarHBondContact O-CB 3.48Å; Y332-P344 HydrophobicContact CD2-CB 4.46Å; Y332-P344 HydrophobicContact CD2-CG 4.25Å; P344-V481 HydrophobicContact CG-CB 3.44Å; P344-V481 VanDerWaalsContact CG-CB 3.44Å; P344-V481 HydrophobicContact CG-CG1 3.39Å
345	M	63.3	Low	62.3	Low	35 Å²	35	58.6 Å²	58.6	17%	0.172	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	123.8	-178.3	-66.4	-174.3	76.9	0	0	108.8	F250 I329 R330 L343 F347	F250-M345 HydrophobicContact CD1-CE 4.16Å; I329-M345 WeakPolarHBondContact CA-O 3.31Å; R330-M345 HydrophobicContact CB-CB 4.48Å; R330-M345 PolarHBondContact N-O 3.27Å; R330-M345 PolarHBondContact O-N 2.85Å; L343-M345 HydrophobicContact CB-CG 4.41Å; L343-M345 WeakPolarHBondContact O-CG 3.46Å; L343-M345 PolarHBondContact O-N 3.32Å; M345-F347 HydrophobicContact CB-CD2 4.25Å; M345-F347 HydrophobicContact CB-CE1 4.3Å; M345-F347 HydrophobicContact CB-CE2 3.49Å; M345-F347 VanDerWaalsContact CB-CE2 3.49Å; M345-F347 HydrophobicContact CB-CZ 3.53Å; M345-F347 HydrophobicContact CE-CE1 3.58Å; M345-F347 HydrophobicContact CE-CZ 3.47Å; M345-F347 VanDerWaalsContact CE-CZ 3.47Å; M345-F347 HydrophobicContact CG-CZ 4.19Å; M345-F347 HydrophobicContact SD-CE1 4.37Å; M345-F347 HydrophobicContact SD-CE2 4.4Å; M345-F347 HydrophobicContact SD-CZ 3.63Å
346	K	64.1	Low	61.9	Low	97 Å²	97	59.3 Å²	59.3	42%	0.422	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	114	168	-176.6	171.4	168.6	166.6	0	109.8	D282 N327 L328 I329	D282-K346 WeakPolarHBondContact OD2-CD 3.43Å; D282-K346 WeakPolarHBondContact OD2-CE 3.15Å; D282-K346 IonicContact OD2-NZ 2.61Å; D282-K346 PolarHBondContact OD2-NZ 3.21Å; N327-K346 VanDerWaalsContact CG-CE 3.49Å; L328-K346 CarbonylContact O-C 3.24Å; L328-K346 WeakPolarHBondContact O-CA 3.47Å; I329-K346 HydrophobicContact CG1-CB 4.43Å; I329-K346 HydrophobicContact CG1-CG 4.39Å
347	F	69.6	Low	60.7	Low	27 Å²	27	64.2 Å²	64.2	12%	0.118	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	118.6	172.1	-56.3	-77.4	0	0	0	109.3	P253 Y266 N327 L328 M345 V349	P253-F347 HydrophobicContact CG-CD1 3.96Å; P253-F347 HydrophobicContact CG-CD2 4.11Å; P253-F347 HydrophobicContact CG-CE1 3.82Å; P253-F347 HydrophobicContact CG-CE2 3.96Å; P253-F347 HydrophobicContact CG-CG 4.1Å; P253-F347 HydrophobicContact CG-CZ 3.79Å; Y266-F347 HydrophobicContact CE1-CD2 4.45Å; Y266-F347 AromaticContact CE1-CE2 3.88Å; Y266-F347 HydrophobicContact CE1-CE2 3.88Å; Y266-F347 HydrophobicContact CE1-CZ 4.5Å; N327-F347 WeakPolarHBondContact CA-O 3.24Å; L328-F347 HydrophobicContact CB-CB 4.3Å; L328-F347 PolarHBondContact N-O 3.42Å; L328-F347 PolarHBondContact O-N 2.94Å; M345-F347 HydrophobicContact CB-CD2 4.25Å; M345-F347 HydrophobicContact CB-CE1 4.3Å; M345-F347 HydrophobicContact CB-CE2 3.49Å; M345-F347 VanDerWaalsContact CB-CE2 3.49Å; M345-F347 HydrophobicContact CB-CZ 3.53Å; M345-F347 HydrophobicContact CE-CE1 3.58Å; M345-F347 HydrophobicContact CE-CZ 3.47Å; M345-F347 VanDerWaalsContact CE-CZ 3.47Å; M345-F347 HydrophobicContact CG-CZ 4.19Å; M345-F347 HydrophobicContact SD-CE1 4.37Å; M345-F347 HydrophobicContact SD-CE2 4.4Å; M345-F347 HydrophobicContact SD-CZ 3.63Å; F347-V349 PolarHBondContact O-N 3.24Å
348	T	66.1	Low	59.3	Low	70 Å²	70	66 Å²	66	43%	0.429	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	104.8	165.3	-57.7	0	0	0	0	109	K325 L326 N327	K325-T348 HydrophobicContact CB-CG2 4.32Å; K325-T348 HydrophobicContact CD-CG2 4.22Å; K325-T348 HydrophobicContact CG-CG2 4.35Å; L326-T348 CarbonylContact O-C 3.56Å; L326-T348 WeakPolarHBondContact O-CA 3.41Å; N327-T348 WeakPolarHBondContact OD1-CB 3.42Å; N327-T348 WeakPolarHBondContact OD1-CG2 3.17Å; N327-T348 PolarHBondContact OD1-OG1 3.16Å
349	V	69.3	Low	58	Low	8 Å²	8	71.4 Å²	71.4	5%	0.048	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	122.5	169.3	175.6	0	0	0	0	108	F255 V264 K325 L326 L328 F347	F255-V349 HydrophobicContact CD2-CG1 4.02Å; V264-V349 HydrophobicContact CG2-CG2 4.35Å; K325-V349 CarbonylContact C-O 3.55Å; K325-V349 WeakPolarHBondContact CA-O 3.23Å; L326-V349 HydrophobicContact CB-CB 4.37Å; L326-V349 PolarHBondContact N-O 2.97Å; L326-V349 PolarHBondContact O-N 3.16Å; L328-V349 HydrophobicContact CD1-CB 4.27Å; L328-V349 HydrophobicContact CD1-CG2 3.43Å; L328-V349 VanDerWaalsContact CD1-CG2 3.43Å; F347-V349 PolarHBondContact O-N 3.24Å
350	T	71.5	Confident	56.7	Low	48 Å²	48	76.9 Å²	76.9	29%	0.294	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	106.2	171.9	-54.9	0	0	0	0	108.4	A323 I324 K325 L352	A323-T350 HydrophobicContact CB-CG2 3.95Å; I324-T350 CarbonylContact O-C 3.6Å; I324-T350 WeakPolarHBondContact O-CA 3.46Å; K325-T350 HydrophobicContact CG-CG2 4.12Å; T350-L352 HydrophobicContact CG2-CD2 4.11Å; T350-L352 HydrophobicContact CG2-CG 4.49Å
351	C	72.8	Confident	55.3	Low	1 Å²	1	81.5 Å²	81.5	1%	0.007	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	117.2	171.1	-66.4	0	0	0	0	109.2	C257 L307 I322 A323 I324	C257-C351 HydrophobicContact CB-CB 3.64Å; C257-C351 WeakPolarHBondContact CB-SG 3.38Å; C257-C351 WeakPolarHBondContact SG-CA 3.14Å; C257-C351 WeakPolarHBondContact SG-CB 3.25Å; C257-C351 CovalentContact SG-SG 2.04Å; C257-C351 PolarHBondContact SG-SG 2.99Å; L307-C351 HydrophobicContact CD2-CB 4.14Å; I322-C351 VanDerWaalsContact O-O 3.1Å; A323-C351 WeakPolarHBondContact CA-O 3.39Å; I324-C351 HydrophobicContact CB-CB 4.49Å; I324-C351 PolarHBondContact N-O 3.27Å; I324-C351 PolarHBondContact O-N 2.71Å
352	L	70	Confident	54	Low	115 Å²	115	86.5 Å²	86.5	60%	0.602	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94	99.9	173.1	-63.4	175	0	0	0	108.5	A323 T350 P354	A323-L352 HydrophobicContact CB-CD2 3.72Å; T350-L352 HydrophobicContact CG2-CD2 4.11Å; T350-L352 HydrophobicContact CG2-CG 4.49Å; L352-P354 WeakPolarHBondContact O-CD 3.35Å
353	I	66.4	Low	52.4	Low	45 Å²	45	89.3 Å²	89.3	23%	0.231	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	114.1	174.1	-53	175.9	0	0	0	107.7	L307 S321 I322 I324 R355	L307-I353 HydrophobicContact CD1-CD1 4.04Å; S321-I353 CarbonylContact C-O 3.52Å; S321-I353 WeakPolarHBondContact CA-O 3.48Å; I322-I353 HydrophobicContact CB-CB 4.37Å; I322-I353 PolarHBondContact N-O 3.48Å; I322-I353 PolarHBondContact O-N 3.15Å; I324-I353 HydrophobicContact CD1-CD1 3.67Å; I324-I353 HydrophobicContact CG1-CD1 4.45Å; I353-R355 PolarHBondContact O-N 3.23Å
354	P	58.7	Low	50.9	Low	94 Å²	94	95 Å²	95	61%	0.61	50%	0.495	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.4	129.4	176.9	26	-32.6	0	0	0	110.9	T320 L352	T320-P354 CarbonylContact O-C 3.48Å; T320-P354 WeakPolarHBondContact O-CA 3.23Å; L352-P354 WeakPolarHBondContact O-CD 3.35Å
355	R	62.4	Low	49.3	Very low	150 Å²	150	98.6 Å²	98.6	57%	0.566	53%	0.526	S	S	*	.	S	Bend	trans	-80.7	-27.8	172.5	-65.3	-175.7	72.8	160.4	2.6	112.3	T320 I322 I353	T320-R355 PolarHBondContact O-N 3.34Å; I322-R355 HydrophobicContact CD1-CG 4.11Å; I322-R355 HydrophobicContact CG1-CG 3.67Å; I353-R355 PolarHBondContact O-N 3.23Å
356	S	50.6	Low	47.6	Very low	73 Å²	73	102.4 Å²	102.4	51%	0.51	56%	0.556	S	S	.	*	S	Bend	trans	-158	156.2	168.7	83.9	0	0	0	0	109.2	Q358	S356-Q358 PolarHBondContact O-N 3.22Å
357	K	37	Very low	45.7	Very low	206 Å²	206	103.6 Å²	103.6	90%	0.896	57%	0.573	S	S	*	*	S	Bend	trans	-67.5	102.1	172.8	-105	-179.3	172.3	178.8	0	108.7
358	Q	33.3	Very low	43.6	Very low	148 Å²	148	110.1 Å²	110.1	69%	0.692	61%	0.609	S	S	*	*			trans	153.3	135	136.2	-85.5	-168.5	-13.9	0	0	116.1	S356	S356-Q358 PolarHBondContact O-N 3.22Å
359	I	30.3	Very low	41.6	Very low	119 Å²	119	113 Å²	113	61%	0.61	62%	0.621	S	S	*	*			trans	74	109.4	140	-57.5	163.6	0	0	0	122.3
360	Q	25.2	Very low	39.5	Very low	173 Å²	173	118.3 Å²	118.3	81%	0.808	65%	0.653	S	S	*	*			trans	53.1	133.3	133.3	-63	-173.8	16.7	0	0	126.3
361	S	23	Very low	37.4	Very low	102 Å²	102	122.3 Å²	122.3	71%	0.713	68%	0.678	S	S	*	*			trans	68.2	118.8	140.8	-53.2	0	0	0	0	122.6
362	E	29	Very low	35.1	Very low	197 Å²	197	129.3 Å²	129.3	92%	0.921	72%	0.715	S	S	*	*				173.7	157.8	96.3	-103.4	-178.9	-177.2	0	0	112.6
363	V	24	Very low	33.2	Very low	132 Å²	132	132 Å²	132	80%	0.8	73%	0.729	S	S	*	*			trans	-113	140	-171.4	171.8	0	0	0	0	110.1
364	V	25.7	Very low	31.2	Very low	145 Å²	145	137.3 Å²	137.3	88%	0.879	76%	0.757	S	S	*	*			trans	-145.1	134.7	158	-178.3	0	0	0	0	110.6
365	A	23.7	Very low	29.8	Very low	86 Å²	86	142.5 Å²	142.5	71%	0.711	77%	0.766	S	S	*	*			trans	-130.5	147.8	173.1	0	0	0	0	0	110
366	S	27.8	Very low	28	Very low	114 Å²	114	142.8 Å²	142.8	80%	0.797	77%	0.774	S	S	*	*			trans	-173	127.8	148.1	62.5	0	0	0	0	111.7
367	P	24.1	Very low	26.9	Very low	123 Å²	123	142.2 Å²	142.2	80%	0.799	77%	0.77	S	S	*	*			trans	-110.2	153.1	164.8	33.9	-23	0	0	0	113.1
368	N	24.7	Very low	26.5	Very low	163 Å²	163	142.2 Å²	142.2	87%	0.872	77%	0.773	S	S	*	*			trans	-110.6	140.2	173.9	-88	-14.3	0	0	0	110.1
369	I	24.2	Very low	26.7	Very low	132 Å²	132	138.7 Å²	138.7	68%	0.677	77%	0.765	S	S	*	*			trans	-137.2	136.7	168.4	-61.3	178.6	0	0	0	108.8	P399	I369-P399 HydrophobicContact CD1-CG 4.45Å
370	T	24.4	Very low	27.6	Very low	118 Å²	118	137.5 Å²	137.5	72%	0.724	76%	0.759	S	S	*	*			trans	-135.6	131.3	174.5	-28.9	0	0	0	0	109.2
371	T	27.3	Very low	29.1	Very low	133 Å²	133	132.6 Å²	132.6	82%	0.816	74%	0.738	S	S	*	*				147.7	146	122.8	53.8	0	0	0	0	113.9
372	N	26	Very low	31	Very low	148 Å²	148	128.8 Å²	128.8	79%	0.791	71%	0.711	S	S	*	*			trans	-87.9	151.3	-169.3	-54.8	-54.7	0	0	0	112.8
373	L	28.6	Very low	33.1	Very low	171 Å²	171	121.6 Å²	121.6	90%	0.895	68%	0.681	S	S	*	*			trans	-139.6	124.4	148.7	-77.4	173.5	0	0	0	110.5
374	L	25.5	Very low	35.8	Very low	156 Å²	156	116.1 Å²	116.1	82%	0.817	65%	0.647	S	S	*	*			trans	-82.1	138.8	168.4	-78.8	104.4	0	0	0	109.6
375	Y	29.3	Very low	38.4	Very low	204 Å²	204	113 Å²	113	80%	0.8	62%	0.622	S	S	*	*			trans	-124.8	127.2	163.9	-171.3	-101.7	0	0	0	108.6
376	Q	23.5	Very low	41.1	Very low	156 Å²	156	109.3 Å²	109.3	73%	0.729	59%	0.59	S	S	*	*			trans	-124.5	131	172.7	-87.2	-177.5	-22.6	0	0	108.3
377	S	27.4	Very low	43.6	Very low	61 Å²	61	105 Å²	105	43%	0.427	56%	0.556	S	S	.	*			trans	-120.1	132.9	161.2	65.9	0	0	0	0	108.8	S379 L381	S377-S379 PolarHBondContact O-N 3.03Å; S377-S379 VanDerWaalsContact O-N 3.14Å; S377-L381 WeakPolarHBondContact O-CD2 3.17Å
378	E	29.3	Very low	46.2	Very low	205 Å²	205	102.2 Å²	102.2	96%	0.958	54%	0.54	S	S	*	.	S	Bend	trans	-81.3	87.1	178.1	-74.7	-173.4	152.1	0	0	111
379	S	38.1	Very low	48.7	Very low	74 Å²	74	95.8 Å²	95.8	52%	0.517	51%	0.505	S	S	.	.	S	Bend	trans	-163.8	150.1	148.4	62.9	0	0	0	0	105.5	S377 L381	S377-S379 PolarHBondContact O-N 3.03Å; S377-S379 VanDerWaalsContact O-N 3.14Å; S379-L381 WeakPolarHBondContact O-CA 3.21Å; S379-L381 PolarHBondContact O-N 2.81Å
380	I	48.7	Very low	51.4	Low	94 Å²	94	90.2 Å²	90.2	48%	0.482	48%	0.477	S	S	.	.	S	Bend	trans	-6.6	92.6	-173.9	-59.8	169.9	0	0	0	111.8	S382 L414 V495 I555	I380-S382 PolarHBondContact O-N 2.83Å; I380-S382 VanDerWaalsContact O-N 3.1Å; I380-L414 HydrophobicContact CG2-CD2 4.15Å; I380-V495 HydrophobicContact CG2-CG2 4.44Å; I380-I555 HydrophobicContact CB-CD1 4.08Å; I380-I555 HydrophobicContact CD1-CD1 4.05Å; I380-I555 HydrophobicContact CG2-CD1 4.32Å
381	L	57.3	Low	54	Low	70 Å²	70	86 Å²	86	37%	0.366	45%	0.448	S	S	.	.			trans	-58.4	122.2	-169.9	-75.8	168	0	0	0	107.7	S377 S379 V415	S377-L381 WeakPolarHBondContact O-CD2 3.17Å; S379-L381 WeakPolarHBondContact O-CA 3.21Å; S379-L381 PolarHBondContact O-N 2.81Å; L381-V415 HydrophobicContact CB-CB 3.58Å; L381-V415 HydrophobicContact CB-CG1 4.11Å; L381-V415 HydrophobicContact CB-CG2 3.8Å; L381-V415 HydrophobicContact CD1-CG1 4.39Å; L381-V415 WeakPolarHBondContact O-CA 3Å; L381-V415 WeakPolarHBondContact O-CB 3.01Å; L381-V415 WeakPolarHBondContact O-CG2 3.37Å; L381-V415 PolarHBondContact O-N 3.46Å
382	S	63	Low	56.7	Low	23 Å²	23	80.5 Å²	80.5	16%	0.161	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	146.8	172.1	48.1	0	0	0	0	107.9	I380 S413 V557	I380-S382 PolarHBondContact O-N 2.83Å; I380-S382 VanDerWaalsContact O-N 3.1Å; S382-S413 CarbonylContact C-O 3.44Å; S382-S413 VanDerWaalsContact CA-O 3.23Å; S382-S413 WeakPolarHBondContact CA-O 3.25Å; S382-V557 WeakPolarHBondContact OG-CG2 3.35Å
383	T	73.6	Confident	59.1	Low	46 Å²	46	76.3 Å²	76.3	28%	0.282	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134	-174.6	55.8	0	0	0	0	109.2	V412 S413 V415	T383-V412 CarbonylContact O-C 3.48Å; T383-V412 VanDerWaalsContact O-CA 3.32Å; T383-V412 WeakPolarHBondContact O-CA 3.49Å; T383-S413 PolarHBondContact N-O 3.29Å; T383-S413 PolarHBondContact O-N 3.44Å; T383-S413 PolarHBondContact OG1-O 3.42Å; T383-V415 HydrophobicContact CG2-CG2 3.61Å
384	L	80.3	Confident	61.4	Low	16 Å²	16	72.1 Å²	72.1	8%	0.084	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	112.7	167.3	-168.5	170.7	0	0	0	107.4	L386 A410 L411 V412 L489 V557	L384-L386 HydrophobicContact CD2-CD2 4.06Å; L384-A410 HydrophobicContact CD2-CB 4.37Å; L384-L411 WeakPolarHBondContact CA-O 3.49Å; L384-V412 HydrophobicContact CG-CG2 4.26Å; L384-L489 HydrophobicContact CD1-CB 3.9Å; L384-L489 HydrophobicContact CD2-CD1 4.17Å; L384-V557 HydrophobicContact CB-CG1 3.77Å
385	K	79.9	Confident	63.8	Low	81 Å²	81	69 Å²	69	35%	0.352	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	152.2	-179.6	-69.1	179.4	172.3	-165.2	0	110.5	Y387 A410 L411	K385-Y387 HydrophobicContact CB-CE2 3.63Å; K385-A410 WeakPolarHBondContact O-CA 3.46Å; K385-L411 PolarHBondContact N-O 3.15Å; K385-L411 PolarHBondContact O-N 3.18Å
386	L	80.1	Confident	65.9	Low	8 Å²	8	61.4 Å²	61.4	4%	0.042	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	147.2	179.3	-57	-176.7	0	0	0	111.6	L384 Q395 L396 I400 V408 Y409 A410 L489 I562	L384-L386 HydrophobicContact CD2-CD2 4.06Å; L386-Q395 WeakPolarHBondContact O-CA 3.48Å; L386-Q395 WeakPolarHBondContact O-CG 3.43Å; L386-L396 HydrophobicContact CB-CB 4.34Å; L386-L396 HydrophobicContact CB-CD1 4.09Å; L386-L396 PolarHBondContact O-N 2.75Å; L386-I400 HydrophobicContact CB-CD1 4.04Å; L386-I400 HydrophobicContact CD1-CD1 3.81Å; L386-I400 HydrophobicContact CG-CD1 4.3Å; L386-V408 HydrophobicContact CD1-CG1 4.23Å; L386-V408 HydrophobicContact CD2-CG1 4.03Å; L386-Y409 CarbonylContact C-O 3.54Å; L386-Y409 WeakPolarHBondContact CA-O 3.47Å; L386-A410 HydrophobicContact CD2-CB 3.67Å; L386-L489 HydrophobicContact CD2-CD1 3.83Å; L386-I562 HydrophobicContact CD1-CD1 3.46Å; L386-I562 VanDerWaalsContact CD1-CD1 3.46Å; L386-I562 HydrophobicContact CD1-CG1 3.57Å; L386-I562 HydrophobicContact CD1-CG2 4.32Å
387	Y	79.3	Confident	68	Low	23 Å²	23	62.1 Å²	62.1	9%	0.09	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	154.6	-176	-62.3	-97.8	0	0	0	110.3	K385 F392 V394 Q395 Y409 L411	K385-Y387 HydrophobicContact CB-CE2 3.63Å; Y387-F392 HydrophobicContact CD1-CB 3.83Å; Y387-F392 VanDerWaalsContact CD1-O 3.24Å; Y387-F392 WeakPolarHBondContact CD1-O 3.49Å; Y387-F392 HydrophobicContact CD2-CB 3.8Å; Y387-F392 AromaticContact CD2-CD1 3.66Å; Y387-F392 HydrophobicContact CD2-CD1 3.66Å; Y387-F392 HydrophobicContact CD2-CG 4.21Å; Y387-F392 VanDerWaalsContact CE1-C 3.47Å; Y387-F392 HydrophobicContact CE1-CB 3.99Å; Y387-F392 WeakPolarHBondContact CE1-O 3.41Å; Y387-F392 HydrophobicContact CE2-CB 3.94Å; Y387-F392 HydrophobicContact CE2-CD1 4.29Å; Y387-F392 VanDerWaalsContact CG-CA 3.48Å; Y387-F392 HydrophobicContact CG-CB 3.75Å; Y387-F392 HydrophobicContact CG-CD1 4.02Å; Y387-F392 HydrophobicContact CG-CG 4.4Å; Y387-V394 WeakPolarHBondContact CA-O 3.11Å; Y387-V394 WeakPolarHBondContact CB-O 3.17Å; Y387-V394 VanDerWaalsContact CD1-C 3.5Å; Y387-V394 WeakPolarHBondContact CD1-O 3.3Å; Y387-Q395 VanDerWaalsContact CD1-CA 3.42Å; Y387-Q395 HydrophobicContact CD1-CB 3.95Å; Y387-Q395 HydrophobicContact CD1-CG 4.42Å; Y387-Q395 HydrophobicContact CE1-CB 3.63Å; Y387-Q395 HydrophobicContact CE1-CG 4Å; Y387-Y409 PolarHBondContact N-O 3.39Å; Y387-Y409 PolarHBondContact O-N 2.78Å; Y387-L411 HydrophobicContact CD2-CB 4.05Å; Y387-L411 HydrophobicContact CE2-CB 3.64Å; Y387-L411 HydrophobicContact CE2-CD2 4.1Å
388	S	78.7	Confident	69.4	Low	65 Å²	65	65 Å²	65	46%	0.455	34%	0.338	S	S	.	.	S	Bend	trans	-84.9	-11	175.6	57.3	0	0	0	0	113.4	V394	S388-V394 PolarHBondContact N-O 2.8Å; S388-V394 VanDerWaalsContact N-O 3.09Å; S388-V394 WeakPolarHBondContact OG-CB 3.23Å; S388-V394 WeakPolarHBondContact OG-CG1 3.06Å
389	D	79.1	Confident	70.7	Confident	27 Å²	27	58 Å²	58	14%	0.144	31%	0.311	C	S	.	.	S	Bend	trans	-131.8	156	-173	70.8	103.6	0	0	0	112.9	F391 F392 T393 V394 Y409	D389-F391 PolarHBondContact O-N 2.02Å; D389-F391 WeakPolarHBondContact OD1-CA 3.35Å; D389-F391 WeakPolarHBondContact OD1-CB 3.43Å; D389-F391 PolarHBondContact OD1-N 3.09Å; D389-F392 PolarHBondContact O-N 2.96Å; D389-F392 VanDerWaalsContact O-N 3.17Å; D389-F392 PolarHBondContact OD1-N 3.09Å; D389-F392 VanDerWaalsContact OD1-N 3.13Å; D389-T393 PolarHBondContact OD1-N 3.47Å; D389-T393 VanDerWaalsContact OD1-N 3.07Å; D389-T393 PolarHBondContact OD1-OG1 3.23Å; D389-T393 PolarHBondContact OD2-N 3.36Å; D389-T393 PolarHBondContact OD2-OG1 3.23Å; D389-T393 VanDerWaalsContact OD2-OG1 3.05Å; D389-V394 PolarHBondContact OD2-N 3Å; D389-Y409 WeakPolarHBondContact O-CB 3.45Å
390	Q	79.4	Confident	72	Confident	16 Å²	16	55 Å²	55	8%	0.075	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-12.8	-178.6	70	-165.8	23.1	0	0	115.4	Q182 Y185 F392 Y409 I458	Q182-Q390 PolarHBondContact O-NE2 2.82Å; Y185-Q390 HydrophobicContact CD1-CG 4.04Å; Y185-Q390 HydrophobicContact CE1-CG 4.23Å; Y185-Q390 VanDerWaalsContact CE1-NE2 3.27Å; Y185-Q390 HydrophobicContact CG-CG 4.49Å; Q390-F392 WeakPolarHBondContact O-CE2 3.02Å; Q390-Y409 VanDerWaalsContact CA-CE1 3.45Å; Q390-Y409 HydrophobicContact CB-CD1 3.91Å; Q390-Y409 HydrophobicContact CB-CE1 3.42Å; Q390-Y409 VanDerWaalsContact CB-CE1 3.42Å; Q390-I458 HydrophobicContact CB-CD1 4.46Å
391	F	80.2	Confident	72.6	Confident	30 Å²	30	54.2 Å²	54.2	13%	0.132	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	0.1	177.1	-53.8	-69.3	0	0	0	112.9	L164 L181 Q182 A184 D389 T393	L164-F391 HydrophobicContact CD2-CD1 4.2Å; L181-F391 WeakPolarHBondContact O-CZ 3.16Å; Q182-F391 VanDerWaalsContact C-CE2 3.48Å; Q182-F391 HydrophobicContact CG-CE2 4.24Å; Q182-F391 WeakPolarHBondContact O-CE2 3.49Å; Q182-F391 WeakPolarHBondContact O-CZ 3.02Å; A184-F391 WeakPolarHBondContact O-CE1 3.38Å; D389-F391 PolarHBondContact O-N 2.02Å; D389-F391 WeakPolarHBondContact OD1-CA 3.35Å; D389-F391 WeakPolarHBondContact OD1-CB 3.43Å; D389-F391 PolarHBondContact OD1-N 3.09Å; F391-T393 VanDerWaalsContact C-N 3.29Å; F391-T393 HydrophobicContact CB-CG2 3.84Å; F391-T393 PolarHBondContact O-N 3.01Å
392	F	82.7	Confident	73	Confident	17 Å²	17	51.6 Å²	51.6	8%	0.075	28%	0.275	C	S	.	.	S	Bend	trans	57.3	42.4	-178.4	-42.7	-76.8	0	0	0	112.2	Y387 D389 Q390 L411 I458	Y387-F392 HydrophobicContact CD1-CB 3.83Å; Y387-F392 VanDerWaalsContact CD1-O 3.24Å; Y387-F392 WeakPolarHBondContact CD1-O 3.49Å; Y387-F392 HydrophobicContact CD2-CB 3.8Å; Y387-F392 AromaticContact CD2-CD1 3.66Å; Y387-F392 HydrophobicContact CD2-CD1 3.66Å; Y387-F392 HydrophobicContact CD2-CG 4.21Å; Y387-F392 VanDerWaalsContact CE1-C 3.47Å; Y387-F392 HydrophobicContact CE1-CB 3.99Å; Y387-F392 WeakPolarHBondContact CE1-O 3.41Å; Y387-F392 HydrophobicContact CE2-CB 3.94Å; Y387-F392 HydrophobicContact CE2-CD1 4.29Å; Y387-F392 VanDerWaalsContact CG-CA 3.48Å; Y387-F392 HydrophobicContact CG-CB 3.75Å; Y387-F392 HydrophobicContact CG-CD1 4.02Å; Y387-F392 HydrophobicContact CG-CG 4.4Å; D389-F392 PolarHBondContact O-N 2.96Å; D389-F392 VanDerWaalsContact O-N 3.17Å; D389-F392 PolarHBondContact OD1-N 3.09Å; D389-F392 VanDerWaalsContact OD1-N 3.13Å; Q390-F392 WeakPolarHBondContact O-CE2 3.02Å; F392-L411 HydrophobicContact CB-CB 4.45Å; F392-L411 HydrophobicContact CB-CD2 3.82Å; F392-L411 HydrophobicContact CD1-CB 3.62Å; F392-L411 HydrophobicContact CD1-CD1 4.1Å; F392-L411 HydrophobicContact CD1-CD2 4.43Å; F392-L411 HydrophobicContact CD1-CG 4.25Å; F392-L411 HydrophobicContact CD2-CD1 3.72Å; F392-L411 HydrophobicContact CD2-CD2 4.32Å; F392-L411 HydrophobicContact CD2-CG 4.44Å; F392-L411 HydrophobicContact CE1-CB 3.98Å; F392-L411 HydrophobicContact CE1-CD1 4.14Å; F392-L411 HydrophobicContact CE2-CD1 3.79Å; F392-L411 HydrophobicContact CG-CB 3.99Å; F392-L411 HydrophobicContact CG-CD1 3.89Å; F392-L411 HydrophobicContact CG-CD2 3.93Å; F392-L411 HydrophobicContact CG-CG 4.14Å; F392-L411 HydrophobicContact CZ-CD1 4.02Å; F392-I458 HydrophobicContact CE2-CB 4.49Å; F392-I458 HydrophobicContact CE2-CG2 4.19Å; F392-I458 HydrophobicContact CZ-CB 4.34Å; F392-I458 HydrophobicContact CZ-CD1 4.22Å; F392-I458 HydrophobicContact CZ-CG2 4.49Å
393	T	77	Confident	73.1	Confident	60 Å²	60	52.8 Å²	52.8	37%	0.368	28%	0.282	S	S	.	.			trans	-93.1	-41.6	-178.5	54.9	0	0	0	0	112.5	Y116 D389 F391	Y116-T393 HydrophobicContact CE1-CG2 4.02Å; D389-T393 PolarHBondContact OD1-N 3.47Å; D389-T393 VanDerWaalsContact OD1-N 3.07Å; D389-T393 PolarHBondContact OD1-OG1 3.23Å; D389-T393 PolarHBondContact OD2-N 3.36Å; D389-T393 PolarHBondContact OD2-OG1 3.23Å; D389-T393 VanDerWaalsContact OD2-OG1 3.05Å; F391-T393 VanDerWaalsContact C-N 3.29Å; F391-T393 HydrophobicContact CB-CG2 3.84Å; F391-T393 PolarHBondContact O-N 3.01Å
394	V	77.7	Confident	72.7	Confident	83 Å²	83	50.8 Å²	50.8	50%	0.503	27%	0.27	S	S	.	.	S	Bend	trans	-102.8	95.3	-179.4	-178.7	0	0	0	0	108.8	Y387 S388 D389 L396	Y387-V394 WeakPolarHBondContact CA-O 3.11Å; Y387-V394 WeakPolarHBondContact CB-O 3.17Å; Y387-V394 VanDerWaalsContact CD1-C 3.5Å; Y387-V394 WeakPolarHBondContact CD1-O 3.3Å; S388-V394 PolarHBondContact N-O 2.8Å; S388-V394 VanDerWaalsContact N-O 3.09Å; S388-V394 WeakPolarHBondContact OG-CB 3.23Å; S388-V394 WeakPolarHBondContact OG-CG1 3.06Å; D389-V394 PolarHBondContact OD2-N 3Å; V394-L396 PolarHBondContact O-N 3.18Å
395	Q	75.9	Confident	72	Confident	91 Å²	91	51.9 Å²	51.9	43%	0.425	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-67.3	128.2	176.2	-164.9	-169.8	-50.9	0	0	109.6	L386 Y387 Q397	L386-Q395 WeakPolarHBondContact O-CA 3.48Å; L386-Q395 WeakPolarHBondContact O-CG 3.43Å; Y387-Q395 VanDerWaalsContact CD1-CA 3.42Å; Y387-Q395 HydrophobicContact CD1-CB 3.95Å; Y387-Q395 HydrophobicContact CD1-CG 4.42Å; Y387-Q395 HydrophobicContact CE1-CB 3.63Å; Y387-Q395 HydrophobicContact CE1-CG 4Å; Q395-Q397 PolarHBondContact O-N 2.7Å
396	L	72.5	Confident	71.7	Confident	43 Å²	43	51.3 Å²	51.3	23%	0.225	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-69	127.5	173.3	-65.4	175.4	0	0	0	109.3	L386 V394 I400 I402	L386-L396 HydrophobicContact CB-CB 4.34Å; L386-L396 HydrophobicContact CB-CD1 4.09Å; L386-L396 PolarHBondContact O-N 2.75Å; V394-L396 PolarHBondContact O-N 3.18Å; L396-I400 HydrophobicContact CB-CD1 3.76Å; L396-I400 HydrophobicContact CB-CG1 3.87Å; L396-I400 HydrophobicContact CB-CG2 4.11Å; L396-I400 HydrophobicContact CD1-CG2 3.9Å; L396-I402 HydrophobicContact CD1-CD1 3.72Å; L396-I402 HydrophobicContact CD1-CG1 4.41Å
397	Q	67.5	Low	71.5	Confident	171 Å²	171	55.7 Å²	55.7	80%	0.799	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-88.6	142.5	178.9	-64	-161.2	-4.5	0	0	111.1	Q395 P399 I400	Q395-Q397 PolarHBondContact O-N 2.7Å; Q397-P399 CarbonylContact O-C 3.54Å; Q397-I400 VanDerWaalsContact O-CG1 3.28Å; Q397-I400 WeakPolarHBondContact O-CG1 3.32Å
398	Q	58.1	Low	71.4	Confident	122 Å²	122	54.7 Å²	54.7	57%	0.57	30%	0.301	S	S	*	.	S	Bend	trans	-78	147.2	178.3	-72.6	179.6	9.2	0	0	112	I400	Q398-I400 HydrophobicContact CG-CD1 4.18Å; Q398-I400 HydrophobicContact CG-CG1 4.07Å
399	P	56.7	Low	71.7	Confident	59 Å²	59	53 Å²	53	38%	0.383	29%	0.285	S	S	.	.	S	Bend	cis	-70.5	129.4	-6.6	28.4	-32.1	0	0	0	111.3	I369 Q397 T401 M563	I369-P399 HydrophobicContact CD1-CG 4.45Å; Q397-P399 CarbonylContact O-C 3.54Å; P399-T401 PolarHBondContact O-N 2.75Å; P399-M563 HydrophobicContact CB-CE 3.52Å; P399-M563 HydrophobicContact CG-CE 4.07Å
400	I	64.9	Low	72	Confident	10 Å²	10	51.8 Å²	51.8	5%	0.051	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	119	-178.1	-62.4	171.1	0	0	0	106.7	L386 L396 Q397 Q398 I402 I562 M563	L386-I400 HydrophobicContact CB-CD1 4.04Å; L386-I400 HydrophobicContact CD1-CD1 3.81Å; L386-I400 HydrophobicContact CG-CD1 4.3Å; L396-I400 HydrophobicContact CB-CD1 3.76Å; L396-I400 HydrophobicContact CB-CG1 3.87Å; L396-I400 HydrophobicContact CB-CG2 4.11Å; L396-I400 HydrophobicContact CD1-CG2 3.9Å; Q397-I400 VanDerWaalsContact O-CG1 3.28Å; Q397-I400 WeakPolarHBondContact O-CG1 3.32Å; Q398-I400 HydrophobicContact CG-CD1 4.18Å; Q398-I400 HydrophobicContact CG-CG1 4.07Å; I400-I402 HydrophobicContact CG2-CD1 3.6Å; I400-I402 HydrophobicContact CG2-CG1 3.62Å; I400-I562 HydrophobicContact CB-CG2 4.44Å; I400-I562 HydrophobicContact CG2-CG2 4.18Å; I400-M563 CarbonylContact O-C 3.56Å; I400-M563 WeakPolarHBondContact O-CA 3.46Å; I400-M563 PolarHBondContact O-N 3.04Å
401	T	60.8	Low	72.3	Confident	78 Å²	78	51.3 Å²	51.3	48%	0.479	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	115.4	173	-66.4	0	0	0	0	109.7	P399 M563 V565	P399-T401 PolarHBondContact O-N 2.75Å; T401-M563 WeakPolarHBondContact CA-O 3.28Å; T401-V565 HydrophobicContact CG2-CB 3.44Å; T401-V565 VanDerWaalsContact CG2-CB 3.44Å; T401-V565 HydrophobicContact CG2-CG1 4.45Å; T401-V565 HydrophobicContact CG2-CG2 3.34Å
402	I	65.5	Low	72.5	Confident	15 Å²	15	49.9 Å²	49.9	8%	0.077	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	125.8	179.3	-53.3	172.6	0	0	0	109.7	L396 I400 D406 V408 A471 M563 T564	L396-I402 HydrophobicContact CD1-CD1 3.72Å; L396-I402 HydrophobicContact CD1-CG1 4.41Å; I400-I402 HydrophobicContact CG2-CD1 3.6Å; I400-I402 HydrophobicContact CG2-CG1 3.62Å; I402-D406 HydrophobicContact CG2-CB 3.89Å; I402-V408 HydrophobicContact CD1-CB 4.32Å; I402-V408 HydrophobicContact CD1-CG1 3.87Å; I402-V408 HydrophobicContact CD1-CG2 3.55Å; I402-V408 HydrophobicContact CG2-CG2 4.01Å; I402-A471 HydrophobicContact CB-CB 4.32Å; I402-A471 HydrophobicContact CG2-CB 3.82Å; I402-M563 PolarHBondContact N-O 3.42Å; I402-T564 WeakPolarHBondContact O-CA 3.44Å
403	P	64.4	Low	72.4	Confident	47 Å²	47	49.6 Å²	49.6	31%	0.305	27%	0.269	S	S	.	.			trans	-60.5	132.6	169.8	-19.4	31.1	0	0	0	110.9	F250 D406	F250-P403 HydrophobicContact CZ-CB 3.75Å; P403-D406 WeakPolarHBondContact CD-OD2 3.19Å; P403-D406 WeakPolarHBondContact CG-OD2 3.43Å; P403-D406 VanDerWaalsContact O-CB 3.3Å; P403-D406 WeakPolarHBondContact O-CB 3.39Å; P403-D406 PolarHBondContact O-N 3.09Å
404	P	65.4	Low	72.2	Confident	5 Å²	5	47.3 Å²	47.3	3%	0.032	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	147.1	170.1	-19.6	26.5	0	0	0	112.6	L343 D406 A471 Y473	L343-P404 HydrophobicContact CD1-CB 3.51Å; L343-P404 HydrophobicContact CD1-CG 3.63Å; L343-P404 HydrophobicContact CD2-CB 4.38Å; L343-P404 HydrophobicContact CD2-CG 3.54Å; L343-P404 HydrophobicContact CG-CB 3.87Å; L343-P404 HydrophobicContact CG-CG 3.56Å; P404-D406 VanDerWaalsContact C-N 3.26Å; P404-D406 PolarHBondContact O-N 3.16Å; P404-A471 CarbonylContact C-O 3.53Å; P404-A471 VanDerWaalsContact CA-O 3.23Å; P404-A471 WeakPolarHBondContact CA-O 3.23Å; P404-A471 WeakPolarHBondContact CB-O 3.02Å; P404-Y473 HydrophobicContact CB-CE2 4.28Å; P404-Y473 HydrophobicContact CG-CD2 3.8Å; P404-Y473 HydrophobicContact CG-CE1 4.18Å; P404-Y473 HydrophobicContact CG-CE2 3.18Å; P404-Y473 HydrophobicContact CG-CG 4.49Å; P404-Y473 WeakPolarHBondContact CG-OH 3.15Å
405	G	67.2	Low	71.9	Confident	38 Å²	38	45.7 Å²	45.7	39%	0.392	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.4	-34.5	-168.8	0	0	0	0	0	113.1	N470 A471	G405-N470 WeakPolarHBondContact O-CB 3.32Å; G405-N470 VanDerWaalsContact O-CG 3.31Å; G405-N470 PolarHBondContact O-ND2 2.03Å; G405-A471 PolarHBondContact N-O 3.32Å
406	D	73.5	Confident	71.6	Confident	70 Å²	70	48.2 Å²	48.2	37%	0.374	26%	0.262	S	S	.	.	S	Bend	trans	-66.3	142.7	177.4	-71	-6.7	0	0	0	111.2	I402 P403 P404 N470 A471	I402-D406 HydrophobicContact CG2-CB 3.89Å; P403-D406 WeakPolarHBondContact CD-OD2 3.19Å; P403-D406 WeakPolarHBondContact CG-OD2 3.43Å; P403-D406 VanDerWaalsContact O-CB 3.3Å; P403-D406 WeakPolarHBondContact O-CB 3.39Å; P403-D406 PolarHBondContact O-N 3.09Å; P404-D406 VanDerWaalsContact C-N 3.26Å; P404-D406 PolarHBondContact O-N 3.16Å; D406-N470 CarbonylContact O-C 3.58Å; D406-N470 WeakPolarHBondContact O-CA 3.27Å; D406-A471 PolarHBondContact O-N 2.93Å
407	K	75.2	Confident	71.5	Confident	99 Å²	99	48.6 Å²	48.6	43%	0.43	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	128.5	179.3	-74.9	-170.5	178	-171.2	0	111.1	Y409 N470	K407-Y409 HydrophobicContact CB-CE2 4.15Å; K407-N470 WeakPolarHBondContact CG-OD1 3.43Å
408	V	77.9	Confident	71.5	Confident	3 Å²	3	47.2 Å²	47.2	2%	0.018	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	133.7	173.6	-170.2	0	0	0	0	109.2	L386 I402 T468 F469 A471	L386-V408 HydrophobicContact CD1-CG1 4.23Å; L386-V408 HydrophobicContact CD2-CG1 4.03Å; I402-V408 HydrophobicContact CD1-CB 4.32Å; I402-V408 HydrophobicContact CD1-CG1 3.87Å; I402-V408 HydrophobicContact CD1-CG2 3.55Å; I402-V408 HydrophobicContact CG2-CG2 4.01Å; V408-T468 WeakPolarHBondContact O-CA 3.28Å; V408-F469 HydrophobicContact CB-CD1 4.28Å; V408-F469 HydrophobicContact CB-CD2 4.5Å; V408-F469 HydrophobicContact CB-CE1 3.82Å; V408-F469 HydrophobicContact CB-CE2 4.06Å; V408-F469 HydrophobicContact CB-CZ 3.68Å; V408-F469 HydrophobicContact CG1-CE1 3.88Å; V408-F469 HydrophobicContact CG1-CZ 3.73Å; V408-F469 HydrophobicContact CG2-CE2 4.13Å; V408-F469 HydrophobicContact CG2-CZ 4.15Å; V408-F469 PolarHBondContact N-O 2.79Å; V408-F469 PolarHBondContact O-N 2.86Å; V408-A471 HydrophobicContact CG2-CB 3.86Å
409	Y	83.6	Confident	71.9	Confident	30 Å²	30	48.4 Å²	48.4	12%	0.118	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	110.5	177.3	-60.1	-93.4	0	0	0	109.1	L386 Y387 D389 Q390 K407 I458 T468	L386-Y409 CarbonylContact C-O 3.54Å; L386-Y409 WeakPolarHBondContact CA-O 3.47Å; Y387-Y409 PolarHBondContact N-O 3.39Å; Y387-Y409 PolarHBondContact O-N 2.78Å; D389-Y409 WeakPolarHBondContact O-CB 3.45Å; Q390-Y409 VanDerWaalsContact CA-CE1 3.45Å; Q390-Y409 HydrophobicContact CB-CD1 3.91Å; Q390-Y409 HydrophobicContact CB-CE1 3.42Å; Q390-Y409 VanDerWaalsContact CB-CE1 3.42Å; K407-Y409 HydrophobicContact CB-CE2 4.15Å; Y409-I458 HydrophobicContact CD1-CD1 4.48Å; Y409-T468 HydrophobicContact CD1-CG2 3.41Å; Y409-T468 VanDerWaalsContact CD1-CG2 3.41Å; Y409-T468 HydrophobicContact CE1-CG2 3.5Å; Y409-T468 HydrophobicContact CG-CG2 4.43Å
410	A	86.6	Confident	72.5	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	132.9	176.8	0	0	0	0	0	110	L384 K385 L386 G466 F467 F469 L489	L384-A410 HydrophobicContact CD2-CB 4.37Å; K385-A410 WeakPolarHBondContact O-CA 3.46Å; L386-A410 HydrophobicContact CD2-CB 3.67Å; A410-G466 CarbonylContact O-C 3.47Å; A410-G466 WeakPolarHBondContact O-CA 3.08Å; A410-F467 HydrophobicContact CB-CD1 4.17Å; A410-F467 HydrophobicContact CB-CD2 4.26Å; A410-F467 HydrophobicContact CB-CE1 3.71Å; A410-F467 HydrophobicContact CB-CE2 3.79Å; A410-F467 HydrophobicContact CB-CG 4.44Å; A410-F467 HydrophobicContact CB-CZ 3.51Å; A410-F467 PolarHBondContact N-O 2.83Å; A410-F467 PolarHBondContact O-N 2.02Å; A410-F469 HydrophobicContact CB-CE1 4.25Å; A410-L489 HydrophobicContact CB-CD1 4.38Å
411	L	85	Confident	72.9	Confident	6 Å²	6	49.5 Å²	49.5	3%	0.031	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	124.1	175.1	-170.8	65.1	0	0	0	110.2	L384 K385 Y387 F392 Q464	L384-L411 WeakPolarHBondContact CA-O 3.49Å; K385-L411 PolarHBondContact N-O 3.15Å; K385-L411 PolarHBondContact O-N 3.18Å; Y387-L411 HydrophobicContact CD2-CB 4.05Å; Y387-L411 HydrophobicContact CE2-CB 3.64Å; Y387-L411 HydrophobicContact CE2-CD2 4.1Å; F392-L411 HydrophobicContact CB-CB 4.45Å; F392-L411 HydrophobicContact CB-CD2 3.82Å; F392-L411 HydrophobicContact CD1-CB 3.62Å; F392-L411 HydrophobicContact CD1-CD1 4.1Å; F392-L411 HydrophobicContact CD1-CD2 4.43Å; F392-L411 HydrophobicContact CD1-CG 4.25Å; F392-L411 HydrophobicContact CD2-CD1 3.72Å; F392-L411 HydrophobicContact CD2-CD2 4.32Å; F392-L411 HydrophobicContact CD2-CG 4.44Å; F392-L411 HydrophobicContact CE1-CB 3.98Å; F392-L411 HydrophobicContact CE1-CD1 4.14Å; F392-L411 HydrophobicContact CE2-CD1 3.79Å; F392-L411 HydrophobicContact CG-CB 3.99Å; F392-L411 HydrophobicContact CG-CD1 3.89Å; F392-L411 HydrophobicContact CG-CD2 3.93Å; F392-L411 HydrophobicContact CG-CG 4.14Å; F392-L411 HydrophobicContact CZ-CD1 4.02Å; L411-Q464 HydrophobicContact CD1-CB 4.09Å
412	V	84.1	Confident	73.3	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	120.3	170.4	-167.4	0	0	0	0	108.8	T383 L384 L423 L425 Q464 V465 F467 I493 V557	T383-V412 CarbonylContact O-C 3.48Å; T383-V412 VanDerWaalsContact O-CA 3.32Å; T383-V412 WeakPolarHBondContact O-CA 3.49Å; L384-V412 HydrophobicContact CG-CG2 4.26Å; V412-L423 HydrophobicContact CG1-CD1 4.15Å; V412-L425 HydrophobicContact CB-CD1 4.47Å; V412-L425 HydrophobicContact CG2-CD1 3.98Å; V412-Q464 VanDerWaalsContact O-CA 3.3Å; V412-Q464 WeakPolarHBondContact O-CA 3.38Å; V412-V465 PolarHBondContact N-O 2.92Å; V412-V465 PolarHBondContact O-N 3.28Å; V412-F467 HydrophobicContact CG2-CE1 4.05Å; V412-I493 HydrophobicContact CG1-CG2 3.78Å; V412-V557 HydrophobicContact CG1-CG1 4.45Å; V412-V557 HydrophobicContact CG1-CG2 4.21Å
413	S	80.5	Confident	74.1	Confident	11 Å²	11	45.8 Å²	45.8	8%	0.077	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	137.8	-175.1	-61.3	0	0	0	0	111.9	S382 T383 Q464	S382-S413 CarbonylContact C-O 3.44Å; S382-S413 VanDerWaalsContact CA-O 3.23Å; S382-S413 WeakPolarHBondContact CA-O 3.25Å; T383-S413 PolarHBondContact N-O 3.29Å; T383-S413 PolarHBondContact O-N 3.44Å; T383-S413 PolarHBondContact OG1-O 3.42Å; S413-Q464 WeakPolarHBondContact OG-CG 3.29Å; S413-Q464 PolarHBondContact OG-NE2 2.83Å
414	L	73.3	Confident	74.8	Confident	13 Å²	13	43.8 Å²	43.8	7%	0.068	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	138.2	165.2	-61.9	176.7	0	0	0	110.5	I380 P417 L423 T463 I493 V495	I380-L414 HydrophobicContact CG2-CD2 4.15Å; L414-P417 HydrophobicContact CB-CB 3.81Å; L414-P417 HydrophobicContact CB-CG 4.08Å; L414-P417 HydrophobicContact CD1-CB 3.91Å; L414-L423 HydrophobicContact CD1-CB 4.14Å; L414-L423 HydrophobicContact CD2-CD1 3.81Å; L414-L423 HydrophobicContact CG-CB 4.19Å; L414-L423 HydrophobicContact CG-CD1 3.73Å; L414-T463 HydrophobicContact CD1-CG2 4.39Å; L414-T463 PolarHBondContact N-O 3.5Å; L414-T463 VanDerWaalsContact N-O 3.13Å; L414-I493 HydrophobicContact CD2-CD1 3.94Å; L414-V495 HydrophobicContact CD1-CG1 4.23Å; L414-V495 HydrophobicContact CD1-CG2 3.95Å; L414-V495 HydrophobicContact CD2-CG2 3.58Å; L414-V495 HydrophobicContact CG-CG2 4.41Å
415	V	72.2	Confident	75.7	Confident	49 Å²	49	43.5 Å²	43.5	30%	0.297	23%	0.232	S	C	.	.	S	Bend	trans	-93.7	126.3	170.7	-176.7	0	0	0	0	107.5	L381 T383	L381-V415 HydrophobicContact CB-CB 3.58Å; L381-V415 HydrophobicContact CB-CG1 4.11Å; L381-V415 HydrophobicContact CB-CG2 3.8Å; L381-V415 HydrophobicContact CD1-CG1 4.39Å; L381-V415 WeakPolarHBondContact O-CA 3Å; L381-V415 WeakPolarHBondContact O-CB 3.01Å; L381-V415 WeakPolarHBondContact O-CG2 3.37Å; L381-V415 PolarHBondContact O-N 3.46Å; T383-V415 HydrophobicContact CG2-CG2 3.61Å
416	N	68.7	Low	76.4	Confident	144 Å²	144	42.2 Å²	42.2	77%	0.77	22%	0.216	S	C	*	.	S	Bend	trans	51.3	49.7	-176.5	-58.2	-28.7	0	0	0	114.7
417	P	71.1	Confident	76.9	Confident	50 Å²	50	40.4 Å²	40.4	33%	0.325	21%	0.206	S	C	.	.			trans	-63.7	148.7	175.8	28.4	-33.7	0	0	0	111.3	L414 T463	L414-P417 HydrophobicContact CB-CB 3.81Å; L414-P417 HydrophobicContact CB-CG 4.08Å; L414-P417 HydrophobicContact CD1-CB 3.91Å; P417-T463 HydrophobicContact CB-CG2 3.57Å; P417-T463 HydrophobicContact CG-CG2 3.6Å
418	Q	67.5	Low	77.4	Confident	142 Å²	142	35.8 Å²	35.8	66%	0.664	19%	0.186	S	C	*	.			trans	-67.5	151	166.6	-61.3	-65.8	-42.8	0	0	109	T420 S421	Q418-T420 PolarHBondContact O-N 2.9Å; Q418-S421 WeakPolarHBondContact O-CB 3.49Å; Q418-S421 PolarHBondContact O-N 3.11Å; Q418-S421 PolarHBondContact O-OG 2.98Å
419	K	65.9	Low	77.9	Confident	148 Å²	148	36.3 Å²	36.3	64%	0.643	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-22.5	179.2	-70.9	-172.4	177.6	-174.7	0	113.5	L498	K419-L498 WeakPolarHBondContact O-CD1 3.35Å
420	T	69.6	Low	77.8	Confident	73 Å²	73	34.9 Å²	34.9	45%	0.448	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	15.5	177.1	69.3	0	0	0	0	113.4	Q418 D497 L498	Q418-T420 PolarHBondContact O-N 2.9Å; T420-D497 WeakPolarHBondContact CB-OD2 3.07Å; T420-D497 CarbonylContact O-C 3.46Å; T420-D497 VanDerWaalsContact O-CA 3.25Å; T420-D497 WeakPolarHBondContact O-CA 3.2Å; T420-D497 PolarHBondContact OG1-OD2 2.97Å; T420-D497 VanDerWaalsContact OG1-OD2 3.04Å; T420-L498 PolarHBondContact O-N 2.85Å
421	S	72.5	Confident	77.4	Confident	19 Å²	19	34.9 Å²	34.9	13%	0.133	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	141.1	178.8	-61.2	0	0	0	0	112.1	Q418 T463 C496	Q418-S421 WeakPolarHBondContact O-CB 3.49Å; Q418-S421 PolarHBondContact O-N 3.11Å; Q418-S421 PolarHBondContact O-OG 2.98Å; S421-T463 WeakPolarHBondContact O-CG2 3.43Å; S421-C496 CarbonylContact C-O 3.34Å; S421-C496 WeakPolarHBondContact CA-O 3.48Å
422	K	70.1	Confident	76.9	Confident	9 Å²	9	36 Å²	36	4%	0.039	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	144.8	160.9	59.4	-179.3	172.9	-179.3	0	112.1	D160 I424 A462 C496 D497 L498 E500 C505	D160-K422 IonicContact OD1-NZ 2.57Å; K422-I424 HydrophobicContact CD-CD1 4.42Å; K422-A462 CarbonylContact C-O 3.56Å; K422-A462 WeakPolarHBondContact CA-O 3.4Å; K422-C496 HydrophobicContact CG-CB 3.93Å; K422-C496 PolarHBondContact N-O 3.39Å; K422-C496 PolarHBondContact O-N 3.24Å; K422-D497 WeakPolarHBondContact CE-O 3.47Å; K422-L498 HydrophobicContact CB-CD2 4.01Å; K422-E500 WeakPolarHBondContact CE-O 3.46Å; K422-E500 PolarHBondContact NZ-O 2.8Å; K422-C505 WeakPolarHBondContact CE-O 3.41Å; K422-C505 PolarHBondContact NZ-O 3.24Å
423	L	81.1	Confident	76.3	Confident	5 Å²	5	38.9 Å²	38.9	3%	0.026	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.6	176	179.4	148.9	0	0	0	109.7	V412 L414 A462 V465 I493	V412-L423 HydrophobicContact CG1-CD1 4.15Å; L414-L423 HydrophobicContact CD1-CB 4.14Å; L414-L423 HydrophobicContact CD2-CD1 3.81Å; L414-L423 HydrophobicContact CG-CB 4.19Å; L414-L423 HydrophobicContact CG-CD1 3.73Å; L423-A462 PolarHBondContact N-O 3.21Å; L423-V465 HydrophobicContact CD2-CB 3.71Å; L423-V465 HydrophobicContact CD2-CG2 3.51Å; L423-I493 HydrophobicContact CD1-CD1 3.68Å; L423-I493 HydrophobicContact CD1-CG2 4.42Å; L423-I493 HydrophobicContact CD2-CG2 4.41Å; L423-I493 HydrophobicContact CG-CB 4.41Å; L423-I493 HydrophobicContact CG-CD1 4.33Å; L423-I493 HydrophobicContact CG-CG2 4.5Å
424	I	80.4	Confident	75.8	Confident	5 Å²	5	42.8 Å²	42.8	3%	0.026	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	125.8	172.8	-52.7	-60	0	0	0	108.2	K422 E426 R448 I493 R494 Q507	K422-I424 HydrophobicContact CD-CD1 4.42Å; I424-E426 HydrophobicContact CG2-CG 4.26Å; I424-R448 HydrophobicContact CG2-CG 4.07Å; I424-I493 CarbonylContact O-C 3.39Å; I424-I493 VanDerWaalsContact O-CA 3.23Å; I424-I493 WeakPolarHBondContact O-CA 3.04Å; I424-I493 WeakPolarHBondContact O-CB 3.23Å; I424-R494 HydrophobicContact CB-CB 4.27Å; I424-R494 PolarHBondContact N-O 3.08Å; I424-R494 PolarHBondContact O-N 3.17Å; I424-Q507 HydrophobicContact CD1-CB 4.32Å
425	L	84.7	Confident	75.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	107.1	177	-169.3	61.1	0	0	0	109	V412 C428 I445 R448 V465 F467 C491 I493 Q507	V412-L425 HydrophobicContact CB-CD1 4.47Å; V412-L425 HydrophobicContact CG2-CD1 3.98Å; L425-C428 VanDerWaalsContact CD1-SG 3.5Å; L425-I445 HydrophobicContact CD2-CD1 3.33Å; L425-I445 HydrophobicContact CG-CD1 3.92Å; L425-R448 WeakPolarHBondContact O-CG 3.4Å; L425-V465 HydrophobicContact CB-CB 4.29Å; L425-V465 HydrophobicContact CB-CG1 3.97Å; L425-V465 HydrophobicContact CD2-CB 4.47Å; L425-V465 HydrophobicContact CD2-CG1 3.84Å; L425-F467 HydrophobicContact CD2-CD1 3.59Å; L425-F467 HydrophobicContact CD2-CE1 4.13Å; L425-F467 HydrophobicContact CD2-CG 4.43Å; L425-C491 HydrophobicContact CD1-CB 3.98Å; L425-I493 HydrophobicContact CD1-CG2 3.73Å; L425-Q507 PolarHBondContact O-NE2 3.3Å; L425-Q507 PolarHBondContact O-OE1 2.87Å
426	E	80.7	Confident	76.2	Confident	11 Å²	11	47.3 Å²	47.3	5%	0.051	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-55.6	-171.2	-71.2	177.4	137.5	0	0	112.5	I424 N447 R448 D492 R494 H554	I424-E426 HydrophobicContact CG2-CG 4.26Å; E426-N447 CarbonylContact O-C 3.54Å; E426-N447 PolarHBondContact O-N 2.94Å; E426-N447 VanDerWaalsContact O-N 3.15Å; E426-R448 HydrophobicContact CG-CG 4.28Å; E426-R448 PolarHBondContact O-N 2.88Å; E426-D492 HydrophobicContact CB-CB 4.48Å; E426-D492 PolarHBondContact N-O 2.62Å; E426-R494 HydrophobicContact CG-CB 4.42Å; E426-R494 IonicContact OE1-CZ 3.91Å; E426-R494 IonicContact OE1-NE 3.84Å; E426-R494 PolarHBondContact OE1-NE 3.29Å; E426-R494 IonicContact OE1-NH2 3.78Å; E426-R494 PolarHBondContact OE1-NH2 2.86Å; E426-H554 IonicContact OE1-CE1 2.67Å; E426-H554 IonicContact OE2-CE1 2.76Å; E426-H554 PolarHBondContact OE2-CE1 3.04Å; E426-H554 IonicContact OE2-CG 2.79Å; E426-H554 IonicContact OE2-ND1 3.16Å; E426-H554 PolarHBondContact OE2-ND1 3.44Å
427	N	84.6	Confident	76.9	Confident	32 Å²	32	45.9 Å²	45.9	17%	0.171	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	144.5	179.3	-58.6	-64.8	0	0	0	109.2	W429 I445 V446 N447 C491 D492	N427-W429 HydrophobicContact CB-CE3 4.25Å; N427-W429 HydrophobicContact CB-CZ3 4.01Å; N427-I445 CarbonylContact C-O 3.59Å; N427-I445 VanDerWaalsContact CA-O 3.25Å; N427-I445 WeakPolarHBondContact CA-O 3.29Å; N427-V446 WeakPolarHBondContact OD1-CA 3.19Å; N427-N447 PolarHBondContact OD1-N 2.74Å; N427-C491 CarbonylContact O-C 3.56Å; N427-C491 WeakPolarHBondContact O-CA 3.36Å; N427-D492 HydrophobicContact CB-CB 4.18Å; N427-D492 PolarHBondContact N-O 3.29Å; N427-D492 PolarHBondContact O-N 3.49Å
428	C	86.5	Confident	77.2	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.007	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	140.7	167.4	-68.3	0	0	0	0	109	L425 L444 I445 F467 H490 C491	L425-C428 VanDerWaalsContact CD1-SG 3.5Å; C428-L444 HydrophobicContact CB-CB 4.14Å; C428-L444 WeakPolarHBondContact O-CA 3.31Å; C428-L444 WeakPolarHBondContact O-CB 3.32Å; C428-L444 PolarHBondContact O-N 2.81Å; C428-I445 HydrophobicContact CB-CB 3.98Å; C428-I445 HydrophobicContact CB-CD1 4.31Å; C428-I445 HydrophobicContact CB-CG1 4.24Å; C428-I445 PolarHBondContact N-O 3.24Å; C428-I445 PolarHBondContact O-N 3.33Å; C428-F467 HydrophobicContact CB-CZ 4.25Å; C428-H490 CarbonylContact C-O 3.46Å; C428-H490 WeakPolarHBondContact CA-O 3.36Å; C428-C491 HydrophobicContact CB-CB 4.21Å; C428-C491 WeakPolarHBondContact CB-SG 3.2Å; C428-C491 WeakPolarHBondContact SG-CB 3.35Å; C428-C491 CovalentContact SG-SG 2.05Å; C428-C491 PolarHBondContact SG-SG 3.39Å
429	W	87.4	Confident	77.8	Confident	14 Å²	14	43.2 Å²	43.2	5%	0.053	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	158.7	175.2	63	99.6	0	0	0	110.1	N427 R436 R442 H490 D492	N427-W429 HydrophobicContact CB-CE3 4.25Å; N427-W429 HydrophobicContact CB-CZ3 4.01Å; W429-R436 VanDerWaalsContact CH2-NH2 3.27Å; W429-R436 HydrophobicContact CZ2-CB 4.13Å; W429-R436 PolarHBondContact NE1-O 3.5Å; W429-R442 CarbonylContact C-O 3.57Å; W429-R442 VanDerWaalsContact CA-O 3.24Å; W429-R442 WeakPolarHBondContact CA-O 3.33Å; W429-R442 WeakPolarHBondContact CB-O 3.38Å; W429-H490 AromaticContact CD1-CD2 3.96Å; W429-H490 HydrophobicContact CD2-CB 3.91Å; W429-H490 VanDerWaalsContact CE2-CB 3.42Å; W429-H490 HydrophobicContact CE3-CB 4.45Å; W429-H490 HydrophobicContact CG-CB 4.38Å; W429-H490 HydrophobicContact CH2-CB 4.08Å; W429-H490 HydrophobicContact CZ2-CB 3.54Å; W429-H490 PolarHBondContact N-O 3.26Å; W429-H490 AromaticContact NE1-CD2 3.66Å; W429-H490 AromaticContact NE1-CG 3.85Å; W429-H490 PolarHBondContact O-N 2.87Å; W429-D492 VanDerWaalsContact CH2-OD1 3.31Å; W429-D492 WeakPolarHBondContact CH2-OD1 3.41Å
430	A	82.4	Confident	78.3	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	149.2	173.2	0	0	0	0	0	111.1	R441 R442 L444 F472 L474 L487 F488 L489	A430-R441 VanDerWaalsContact O-CA 3.26Å; A430-R441 WeakPolarHBondContact O-CA 3.42Å; A430-R442 PolarHBondContact N-O 2.67Å; A430-R442 PolarHBondContact O-N 3.46Å; A430-L444 HydrophobicContact CB-CD1 4.49Å; A430-F472 HydrophobicContact CB-CE2 3.85Å; A430-F472 HydrophobicContact CB-CZ 3.51Å; A430-L474 VanDerWaalsContact C-CD1 3.46Å; A430-L474 HydrophobicContact CB-CD1 4.14Å; A430-L474 WeakPolarHBondContact O-CD1 3.19Å; A430-L487 HydrophobicContact CB-CD1 3.65Å; A430-L487 HydrophobicContact CB-CD2 4.36Å; A430-L487 HydrophobicContact CB-CG 4.01Å; A430-F488 CarbonylContact C-O 3.47Å; A430-F488 WeakPolarHBondContact CA-O 3.17Å; A430-L489 HydrophobicContact CB-CD2 3.86Å
431	T	78.1	Confident	78.9	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	162.3	176.5	60.4	0	0	0	0	110.3	T433 S438 R441 F488 H490	T431-T433 PolarHBondContact OG1-O 3.1Å; T431-S438 VanDerWaalsContact CB-OG 3.32Å; T431-S438 WeakPolarHBondContact CB-OG 3.42Å; T431-R441 HydrophobicContact CG2-CB 4.26Å; T431-F488 PolarHBondContact N-O 3.19Å; T431-F488 PolarHBondContact O-N 2.79Å; T431-H490 PolarHBondContact OG1-CD2 2.88Å; T431-H490 PolarHBondContact OG1-NE2 2.98Å
432	A	73.8	Confident	79.4	Confident	30 Å²	30	42.6 Å²	42.6	25%	0.248	23%	0.226	C	C	.	.	S	Bend	trans	-81.9	-12.1	176.1	0	0	0	0	0	113.7	L474	A432-L474 HydrophobicContact CB-CB 4.14Å
433	T	70.9	Confident	80.1	Confident	61 Å²	61	45.4 Å²	45.4	37%	0.374	24%	0.241	S	C	.	.	S	Bend	trans	-133.8	159.5	-176.3	74.5	0	0	0	0	110.7	T431 N435 S438	T431-T433 PolarHBondContact OG1-O 3.1Å; T433-N435 PolarHBondContact O-N 3.09Å; T433-N435 PolarHBondContact OG1-N 3.06Å; T433-S438 VanDerWaalsContact OG1-CB 3.27Å; T433-S438 WeakPolarHBondContact OG1-CB 3.34Å; T433-S438 PolarHBondContact OG1-OG 3.2Å
434	P	71.1	Confident	80.3	Confident	92 Å²	92	45.2 Å²	45.2	60%	0.597	24%	0.24	S	C	*	.	S	Bend	trans	-59	-14.5	176.9	-19.1	27.9	0	0	0	114.4	R436 F488 H490	P434-R436 PolarHBondContact O-N 2.93Å; P434-F488 HydrophobicContact CB-CD1 4.18Å; P434-F488 HydrophobicContact CB-CE1 4.08Å; P434-F488 HydrophobicContact CB-CZ 4.45Å; P434-F488 HydrophobicContact CG-CD1 4.14Å; P434-F488 HydrophobicContact CG-CE1 3.58Å; P434-F488 HydrophobicContact CG-CE2 4.09Å; P434-F488 HydrophobicContact CG-CZ 3.55Å; P434-H490 PolarHBondContact O-CE1 3.45Å
435	N	75.1	Confident	80.4	Confident	91 Å²	91	45 Å²	45	49%	0.487	24%	0.239	S	C	.	.			trans	-75.8	111.8	177.5	-179.3	-4	0	0	0	110.8	T433 N437 S438	T433-N435 PolarHBondContact O-N 3.09Å; T433-N435 PolarHBondContact OG1-N 3.06Å; N435-N437 PolarHBondContact O-N 3.25Å; N435-N437 PolarHBondContact OD1-N 2.93Å; N435-S438 VanDerWaalsContact O-CB 3.27Å; N435-S438 WeakPolarHBondContact O-CB 2.99Å; N435-S438 PolarHBondContact O-N 2.87Å; N435-S438 PolarHBondContact O-OG 3.01Å
436	R	79	Confident	80.5	Confident	67 Å²	67	46.7 Å²	46.7	25%	0.253	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-24.1	178.4	74.1	-176.5	-66.1	-83.6	11.5	115.3	W429 P434 H490 D492 H556	W429-R436 VanDerWaalsContact CH2-NH2 3.27Å; W429-R436 HydrophobicContact CZ2-CB 4.13Å; W429-R436 PolarHBondContact NE1-O 3.5Å; P434-R436 PolarHBondContact O-N 2.93Å; R436-H490 HydrophobicContact CB-CB 4.47Å; R436-D492 IonicContact NH2-OD1 3.77Å; R436-D492 PolarHBondContact NH2-OD1 3.18Å; R436-H556 PolarHBondContact NH2-CE1 2.89Å; R436-H556 VanDerWaalsContact NH2-CE1 3.25Å; R436-H556 PolarHBondContact NH2-ND1 3.19Å
437	N	82.2	Confident	80.6	Confident	113 Å²	113	51.1 Å²	51.1	60%	0.604	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	4.2	179.8	-62.8	-27.3	0	0	0	112.9	N435	N435-N437 PolarHBondContact O-N 3.25Å; N435-N437 PolarHBondContact OD1-N 2.93Å
438	S	77.8	Confident	80.6	Confident	16 Å²	16	50.7 Å²	50.7	11%	0.112	27%	0.269	C	S	.	.			trans	-69.7	151.4	179.2	62.4	0	0	0	0	112.3	T431 T433 N435	T431-S438 VanDerWaalsContact CB-OG 3.32Å; T431-S438 WeakPolarHBondContact CB-OG 3.42Å; T433-S438 VanDerWaalsContact OG1-CB 3.27Å; T433-S438 WeakPolarHBondContact OG1-CB 3.34Å; T433-S438 PolarHBondContact OG1-OG 3.2Å; N435-S438 VanDerWaalsContact O-CB 3.27Å; N435-S438 WeakPolarHBondContact O-CB 2.99Å; N435-S438 PolarHBondContact O-N 2.87Å; N435-S438 PolarHBondContact O-OG 3.01Å
439	T	79	Confident	80.5	Confident	121 Å²	121	51 Å²	51	74%	0.742	27%	0.271	S	S	*	.	S	Bend	trans	-117.4	150.1	171.4	53.6	0	0	0	0	109.2
440	P	78	Confident	80.4	Confident	33 Å²	33	51.7 Å²	51.7	21%	0.214	28%	0.28	C	S	.	.	S	Bend	cis	-69.9	151.2	-2.3	31.3	-36	0	0	0	112.4	L474	P440-L474 HydrophobicContact CB-CD2 4.43Å; P440-L474 HydrophobicContact CG-CB 4.13Å; P440-L474 HydrophobicContact CG-CD2 4.49Å
441	R	81.3	Confident	80.6	Confident	143 Å²	143	53.1 Å²	53.1	54%	0.54	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	142.4	175.2	70	178.9	-177.2	176.3	0.8	110	A430 T431	A430-R441 VanDerWaalsContact O-CA 3.26Å; A430-R441 WeakPolarHBondContact O-CA 3.42Å; T431-R441 HydrophobicContact CG2-CB 4.26Å
442	R	82.2	Confident	80.8	Confident	51 Å²	51	55 Å²	55	19%	0.192	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	120.8	171.6	178.7	169.8	-179.8	-175.1	2.2	109.4	W429 A430 F472 L474	W429-R442 CarbonylContact C-O 3.57Å; W429-R442 VanDerWaalsContact CA-O 3.24Å; W429-R442 WeakPolarHBondContact CA-O 3.33Å; W429-R442 WeakPolarHBondContact CB-O 3.38Å; A430-R442 PolarHBondContact N-O 2.67Å; A430-R442 PolarHBondContact O-N 3.46Å; R442-F472 HydrophobicContact CB-CE2 3.78Å; R442-F472 HydrophobicContact CB-CZ 3.94Å; R442-F472 HydrophobicContact CG-CE2 4.21Å; R442-F472 HydrophobicContact CG-CZ 4.04Å; R442-F472 VanDerWaalsContact NH1-CD1 3.3Å; R442-L474 HydrophobicContact CB-CD2 3.97Å
443	N	85.1	Confident	80.8	Confident	68 Å²	68	60.2 Å²	60.2	36%	0.364	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	132.9	174.3	-62.2	-25.2	0	0	0	109.4	V446 A451	N443-V446 HydrophobicContact CB-CG2 3.63Å; N443-A451 WeakPolarHBondContact O-CB 3.33Å
444	L	85.1	Confident	81.2	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	-47.9	178.2	-60.5	-180	0	0	0	110.1	C428 A430 A451 Y452 L455 F467 F469 F472 L489	C428-L444 HydrophobicContact CB-CB 4.14Å; C428-L444 WeakPolarHBondContact O-CA 3.31Å; C428-L444 WeakPolarHBondContact O-CB 3.32Å; C428-L444 PolarHBondContact O-N 2.81Å; A430-L444 HydrophobicContact CB-CD1 4.49Å; L444-A451 WeakPolarHBondContact O-CB 3.43Å; L444-A451 PolarHBondContact O-N 2.75Å; L444-Y452 HydrophobicContact CD2-CE1 3.98Å; L444-Y452 VanDerWaalsContact CD2-OH 3.29Å; L444-Y452 WeakPolarHBondContact CD2-OH 3.41Å; L444-L455 HydrophobicContact CB-CD1 3.71Å; L444-L455 HydrophobicContact CD2-CD1 4.23Å; L444-L455 VanDerWaalsContact O-CD1 3.29Å; L444-L455 WeakPolarHBondContact O-CD1 3.04Å; L444-F467 HydrophobicContact CD1-CE2 3.97Å; L444-F469 HydrophobicContact CD1-CD1 4.46Å; L444-F469 HydrophobicContact CD1-CG 4.47Å; L444-F469 HydrophobicContact CD2-CB 4.37Å; L444-F472 HydrophobicContact CD2-CE1 3.79Å; L444-F472 HydrophobicContact CD2-CZ 3.96Å; L444-L489 HydrophobicContact CD1-CD2 3.58Å
445	I	82.8	Confident	81.9	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	131.5	175.4	-61.8	174.4	0	0	0	107.3	L425 N427 C428 C449 L455 V457 F467	L425-I445 HydrophobicContact CD2-CD1 3.33Å; L425-I445 HydrophobicContact CG-CD1 3.92Å; N427-I445 CarbonylContact C-O 3.59Å; N427-I445 VanDerWaalsContact CA-O 3.25Å; N427-I445 WeakPolarHBondContact CA-O 3.29Å; C428-I445 HydrophobicContact CB-CB 3.98Å; C428-I445 HydrophobicContact CB-CD1 4.31Å; C428-I445 HydrophobicContact CB-CG1 4.24Å; C428-I445 PolarHBondContact N-O 3.24Å; C428-I445 PolarHBondContact O-N 3.33Å; I445-C449 CarbonylContact C-O 3.55Å; I445-C449 VanDerWaalsContact CA-O 3.23Å; I445-C449 WeakPolarHBondContact CA-O 3.43Å; I445-C449 WeakPolarHBondContact CG2-O 3.44Å; I445-L455 HydrophobicContact CD1-CD2 4.48Å; I445-L455 HydrophobicContact CG1-CD2 3.88Å; I445-V457 HydrophobicContact CD1-CG2 4.05Å; I445-F467 HydrophobicContact CD1-CB 3.94Å; I445-F467 HydrophobicContact CD1-CD1 4.05Å; I445-F467 HydrophobicContact CD1-CD2 4.41Å; I445-F467 HydrophobicContact CD1-CG 3.88Å
446	V	86.8	Confident	82.4	Confident	36 Å²	36	54.3 Å²	54.3	22%	0.218	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	125.3	177.5	-178.1	0	0	0	0	108	N427 N443 R448 C449 A451	N427-V446 WeakPolarHBondContact OD1-CA 3.19Å; N443-V446 HydrophobicContact CB-CG2 3.63Å; V446-R448 PolarHBondContact O-N 2.88Å; V446-C449 PolarHBondContact N-O 3.11Å; V446-C449 WeakPolarHBondContact O-CB 3.19Å; V446-C449 PolarHBondContact O-N 2.65Å; V446-A451 HydrophobicContact CG2-CB 4.5Å
447	N	84.3	Confident	82.8	Confident	103 Å²	103	51.1 Å²	51.1	55%	0.551	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	42.2	178.7	-63.2	-33.4	0	0	0	113.4	E426 N427 C449	E426-N447 CarbonylContact O-C 3.54Å; E426-N447 PolarHBondContact O-N 2.94Å; E426-N447 VanDerWaalsContact O-N 3.15Å; N427-N447 PolarHBondContact OD1-N 2.74Å; N447-C449 PolarHBondContact O-N 3.03Å
448	R	82.8	Confident	83	Confident	23 Å²	23	45.8 Å²	45.8	9%	0.087	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	1.3	-178.6	-54.5	155.9	-79.3	172.9	-10.7	115.5	Y189 I424 L425 E426 V446 E503 Q506 Q507 Y508	Y189-R448 VanDerWaalsContact CE2-O 3.27Å; Y189-R448 WeakPolarHBondContact CE2-O 3Å; Y189-R448 PolarHBondContact OH-O 2.82Å; I424-R448 HydrophobicContact CG2-CG 4.07Å; L425-R448 WeakPolarHBondContact O-CG 3.4Å; E426-R448 HydrophobicContact CG-CG 4.28Å; E426-R448 PolarHBondContact O-N 2.88Å; V446-R448 PolarHBondContact O-N 2.88Å; R448-E503 PolarHBondContact NH1-O 3.1Å; R448-Q506 WeakPolarHBondContact CD-O 3.34Å; R448-Q506 PolarHBondContact NH1-O 2.8Å; R448-Q507 PolarHBondContact O-NE2 3.3Å; R448-Y508 WeakPolarHBondContact CB-O 3.18Å
449	C	84.7	Confident	83.3	Confident	8 Å²	8	45.8 Å²	45.8	5%	0.054	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	148.3	178.1	-56	0	0	0	0	112	I445 V446 N447 C509	I445-C449 CarbonylContact C-O 3.55Å; I445-C449 VanDerWaalsContact CA-O 3.23Å; I445-C449 WeakPolarHBondContact CA-O 3.43Å; I445-C449 WeakPolarHBondContact CG2-O 3.44Å; V446-C449 PolarHBondContact N-O 3.11Å; V446-C449 WeakPolarHBondContact O-CB 3.19Å; V446-C449 PolarHBondContact O-N 2.65Å; N447-C449 PolarHBondContact O-N 3.03Å; C449-C509 HydrophobicContact CB-CB 3.92Å; C449-C509 WeakPolarHBondContact CB-SG 3Å; C449-C509 WeakPolarHBondContact SG-CA 3.28Å; C449-C509 WeakPolarHBondContact SG-CB 3.44Å; C449-C509 CovalentContact SG-SG 2.03Å; C449-C509 PolarHBondContact SG-SG 3Å
450	A	85.4	Confident	83.6	Confident	28 Å²	28	40.6 Å²	40.6	23%	0.231	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	133.1	165.8	0	0	0	0	0	110.6	Y452 L455	A450-Y452 VanDerWaalsContact C-N 3.32Å; A450-Y452 PolarHBondContact O-N 2.04Å; A450-L455 HydrophobicContact CB-CB 4.31Å; A450-L455 HydrophobicContact CB-CD2 3.45Å; A450-L455 VanDerWaalsContact CB-CD2 3.45Å; A450-L455 HydrophobicContact CB-CG 4.47Å; A450-L455 WeakPolarHBondContact CB-O 3.02Å
451	A	86.5	Confident	83.9	Confident	30 Å²	30	40.6 Å²	40.6	25%	0.248	21%	0.208	C	C	.	.	S	Bend	trans	-77.1	-15.4	-178.8	0	0	0	0	0	113.8	N443 L444 V446	N443-A451 WeakPolarHBondContact O-CB 3.33Å; L444-A451 WeakPolarHBondContact O-CB 3.43Å; L444-A451 PolarHBondContact O-N 2.75Å; V446-A451 HydrophobicContact CG2-CB 4.5Å
452	Y	82.1	Confident	83.8	Confident	41 Å²	41	35.9 Å²	35.9	16%	0.161	20%	0.2	C	C	.	.	S	Bend	trans	-159.8	159.3	179.6	51.5	-91.2	0	0	0	111.5	L444 A450 N454 L455 F469	L444-Y452 HydrophobicContact CD2-CE1 3.98Å; L444-Y452 VanDerWaalsContact CD2-OH 3.29Å; L444-Y452 WeakPolarHBondContact CD2-OH 3.41Å; A450-Y452 VanDerWaalsContact C-N 3.32Å; A450-Y452 PolarHBondContact O-N 2.04Å; Y452-N454 HydrophobicContact CD2-CB 4.35Å; Y452-N454 PolarHBondContact O-N 2.88Å; Y452-L455 HydrophobicContact CD2-CB 3.99Å; Y452-L455 HydrophobicContact CE1-CB 4.47Å; Y452-L455 HydrophobicContact CE1-CD1 4.23Å; Y452-L455 HydrophobicContact CE2-CB 3.7Å; Y452-L455 PolarHBondContact O-N 3.47Å; Y452-L455 VanDerWaalsContact O-N 3.09Å; Y452-F469 WeakPolarHBondContact OH-CB 3.48Å
453	E	74.2	Confident	83.8	Confident	139 Å²	139	34.9 Å²	34.9	65%	0.65	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-38.2	-167.9	-63.5	-175	162.9	0	0	114.8	L455 F515	E453-L455 PolarHBondContact O-N 3.45Å; E453-F515 HydrophobicContact CB-CE1 4.39Å; E453-F515 HydrophobicContact CG-CD1 4.23Å; E453-F515 HydrophobicContact CG-CE1 3.31Å; E453-F515 HydrophobicContact CG-CE2 4.35Å; E453-F515 HydrophobicContact CG-CZ 3.38Å
454	N	79.7	Confident	83.8	Confident	102 Å²	102	34.6 Å²	34.6	55%	0.545	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-2.8	-178	-73.2	-14.6	0	0	0	114.1	Y452	Y452-N454 HydrophobicContact CD2-CB 4.35Å; Y452-N454 PolarHBondContact O-N 2.88Å
455	L	85.8	Confident	83.9	Confident	6 Å²	6	34.9 Å²	34.9	3%	0.031	20%	0.198	C	C	.	.			trans	-92.5	119.2	174.8	-176	139.4	0	0	0	110.2	L444 I445 A450 Y452 E453 V457 F467 T468 F469	L444-L455 HydrophobicContact CB-CD1 3.71Å; L444-L455 HydrophobicContact CD2-CD1 4.23Å; L444-L455 VanDerWaalsContact O-CD1 3.29Å; L444-L455 WeakPolarHBondContact O-CD1 3.04Å; I445-L455 HydrophobicContact CD1-CD2 4.48Å; I445-L455 HydrophobicContact CG1-CD2 3.88Å; A450-L455 HydrophobicContact CB-CB 4.31Å; A450-L455 HydrophobicContact CB-CD2 3.45Å; A450-L455 VanDerWaalsContact CB-CD2 3.45Å; A450-L455 HydrophobicContact CB-CG 4.47Å; A450-L455 WeakPolarHBondContact CB-O 3.02Å; Y452-L455 HydrophobicContact CD2-CB 3.99Å; Y452-L455 HydrophobicContact CE1-CB 4.47Å; Y452-L455 HydrophobicContact CE1-CD1 4.23Å; Y452-L455 HydrophobicContact CE2-CB 3.7Å; Y452-L455 PolarHBondContact O-N 3.47Å; Y452-L455 VanDerWaalsContact O-N 3.09Å; E453-L455 PolarHBondContact O-N 3.45Å; L455-V457 HydrophobicContact CD2-CG2 4.1Å; L455-F467 HydrophobicContact CD1-CD2 4.47Å; L455-T468 VanDerWaalsContact CA-O 3.3Å; L455-T468 WeakPolarHBondContact CA-O 3.03Å; L455-T468 WeakPolarHBondContact CG-O 3.47Å; L455-F469 HydrophobicContact CD1-CB 4.18Å
456	T	84.7	Confident	84.1	Confident	12 Å²	12	34.9 Å²	34.9	7%	0.074	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	139.7	177.9	68.5	0	0	0	0	110.2	L190 F467 T468	L190-T456 HydrophobicContact CD1-CG2 4.44Å; L190-T456 HydrophobicContact CD2-CG2 4.25Å; T456-F467 CarbonylContact O-C 3.52Å; T456-F467 WeakPolarHBondContact O-CA 2.97Å; T456-T468 PolarHBondContact N-OG1 3.09Å; T456-T468 VanDerWaalsContact N-OG1 3.11Å; T456-T468 PolarHBondContact O-N 3.15Å; T456-T468 VanDerWaalsContact OG1-CG2 3.23Å; T456-T468 WeakPolarHBondContact OG1-CG2 3.39Å; T456-T468 PolarHBondContact OG1-OG1 3.14Å
457	V	88	Confident	84.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.5	173.3	-177.3	0	0	0	0	108.1	L188 Y189 I445 L455 V465 F467	L188-V457 HydrophobicContact CB-CB 4.29Å; L188-V457 HydrophobicContact CD1-CB 4.34Å; L188-V457 HydrophobicContact CD1-CG1 4.04Å; L188-V457 PolarHBondContact N-O 2.87Å; L188-V457 VanDerWaalsContact N-O 3.15Å; Y189-V457 HydrophobicContact CD2-CG2 4.42Å; Y189-V457 HydrophobicContact CE2-CB 4.38Å; Y189-V457 HydrophobicContact CE2-CG2 4.21Å; I445-V457 HydrophobicContact CD1-CG2 4.05Å; L455-V457 HydrophobicContact CD2-CG2 4.1Å; V457-V465 HydrophobicContact CG1-CG1 3.7Å; V457-F467 HydrophobicContact CG2-CB 4.45Å
458	I	86.2	Confident	84.3	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	103.6	-174	-55.5	174.1	0	0	0	108.3	Y185 P186 Q390 F392 Y409 S460 G466 T468	Y185-I458 HydrophobicContact CD2-CD1 4Å; Y185-I458 HydrophobicContact CD2-CG1 4.11Å; Y185-I458 HydrophobicContact CD2-CG2 4.3Å; Y185-I458 HydrophobicContact CE2-CD1 4.06Å; Y185-I458 HydrophobicContact CE2-CG1 4.29Å; P186-I458 HydrophobicContact CG-CG2 4.39Å; Q390-I458 HydrophobicContact CB-CD1 4.46Å; F392-I458 HydrophobicContact CE2-CB 4.49Å; F392-I458 HydrophobicContact CE2-CG2 4.19Å; F392-I458 HydrophobicContact CZ-CB 4.34Å; F392-I458 HydrophobicContact CZ-CD1 4.22Å; F392-I458 HydrophobicContact CZ-CG2 4.49Å; Y409-I458 HydrophobicContact CD1-CD1 4.48Å; I458-S460 PolarHBondContact O-N 3.27Å; I458-G466 PolarHBondContact N-O 3.42Å; I458-G466 PolarHBondContact O-N 3.36Å; I458-T468 HydrophobicContact CD1-CG2 3.67Å; I458-T468 HydrophobicContact CG1-CG2 4.43Å
459	P	84.8	Confident	84.4	Confident	16 Å²	16	27.3 Å²	27.3	10%	0.104	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	98.6	170.9	28.3	-31.5	0	0	0	109.4	P186 L188 I235	P186-P459 HydrophobicContact CB-CG 3.96Å; P186-P459 HydrophobicContact CG-CG 3.87Å; P186-P459 WeakPolarHBondContact CG-O 3.49Å; L188-P459 HydrophobicContact CD1-CG 4.22Å; L188-P459 HydrophobicContact CG-CG 4.35Å; I235-P459 HydrophobicContact CD1-CG 4.26Å
460	S	84.8	Confident	84.1	Confident	12 Å²	12	29.3 Å²	29.3	8%	0.084	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	-45.7	-178.3	177.9	0	0	0	0	111.1	L164 I458 Q464	L164-S460 WeakPolarHBondContact CD1-OG 3.46Å; L164-S460 PolarHBondContact N-O 3.21Å; I458-S460 PolarHBondContact O-N 3.27Å; S460-Q464 WeakPolarHBondContact CB-O 3.28Å; S460-Q464 PolarHBondContact N-O 2.75Å; S460-Q464 VanDerWaalsContact N-O 3.08Å
461	S	84	Confident	83.5	Confident	33 Å²	33	28.2 Å²	28.2	23%	0.231	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	175.6	174.6	64	0	0	0	0	110	T463 Q464	S461-T463 PolarHBondContact O-N 3.37Å; S461-T463 VanDerWaalsContact O-N 3.08Å; S461-Q464 PolarHBondContact N-O 3.38Å; S461-Q464 CarbonylContact O-C 3.51Å; S461-Q464 PolarHBondContact O-N 2.82Å; S461-Q464 VanDerWaalsContact O-N 3.16Å; S461-Q464 VanDerWaalsContact OG-CB 3.31Å; S461-Q464 WeakPolarHBondContact OG-CB 3.45Å; S461-Q464 WeakPolarHBondContact OG-CG 3.39Å; S461-Q464 PolarHBondContact OG-N 3.14Å; S461-Q464 PolarHBondContact OG-OE1 2.84Å
462	A	80.9	Confident	82.8	Confident	45 Å²	45	27 Å²	27	37%	0.372	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-29.8	176.6	0	0	0	0	0	113.5	K422 L423 L498	K422-A462 CarbonylContact C-O 3.56Å; K422-A462 WeakPolarHBondContact CA-O 3.4Å; L423-A462 PolarHBondContact N-O 3.21Å; A462-L498 HydrophobicContact CB-CD2 3.84Å
463	T	81.7	Confident	82.2	Confident	30 Å²	30	25.1 Å²	25.1	18%	0.184	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	5.2	-176.1	57.7	0	0	0	0	113.4	L414 P417 S421 S461	L414-T463 HydrophobicContact CD1-CG2 4.39Å; L414-T463 PolarHBondContact N-O 3.5Å; L414-T463 VanDerWaalsContact N-O 3.13Å; P417-T463 HydrophobicContact CB-CG2 3.57Å; P417-T463 HydrophobicContact CG-CG2 3.6Å; S421-T463 WeakPolarHBondContact O-CG2 3.43Å; S461-T463 PolarHBondContact O-N 3.37Å; S461-T463 VanDerWaalsContact O-N 3.08Å
464	Q	85.1	Confident	81.8	Confident	61 Å²	61	18.9 Å²	18.9	29%	0.285	11%	0.112	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	120.3	-177.5	-55.7	179.2	-34.8	0	0	110.9	L411 V412 S413 S460 S461	L411-Q464 HydrophobicContact CD1-CB 4.09Å; V412-Q464 VanDerWaalsContact O-CA 3.3Å; V412-Q464 WeakPolarHBondContact O-CA 3.38Å; S413-Q464 WeakPolarHBondContact OG-CG 3.29Å; S413-Q464 PolarHBondContact OG-NE2 2.83Å; S460-Q464 WeakPolarHBondContact CB-O 3.28Å; S460-Q464 PolarHBondContact N-O 2.75Å; S460-Q464 VanDerWaalsContact N-O 3.08Å; S461-Q464 PolarHBondContact N-O 3.38Å; S461-Q464 CarbonylContact O-C 3.51Å; S461-Q464 PolarHBondContact O-N 2.82Å; S461-Q464 VanDerWaalsContact O-N 3.16Å; S461-Q464 VanDerWaalsContact OG-CB 3.31Å; S461-Q464 WeakPolarHBondContact OG-CB 3.45Å; S461-Q464 WeakPolarHBondContact OG-CG 3.39Å; S461-Q464 PolarHBondContact OG-N 3.14Å; S461-Q464 PolarHBondContact OG-OE1 2.84Å
465	V	86.4	Confident	81.1	Confident	7 Å²	7	15.5 Å²	15.5	4%	0.042	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124	174.7	-179.5	0	0	0	0	107.8	V412 L423 L425 V457	V412-V465 PolarHBondContact N-O 2.92Å; V412-V465 PolarHBondContact O-N 3.28Å; L423-V465 HydrophobicContact CD2-CB 3.71Å; L423-V465 HydrophobicContact CD2-CG2 3.51Å; L425-V465 HydrophobicContact CB-CB 4.29Å; L425-V465 HydrophobicContact CB-CG1 3.97Å; L425-V465 HydrophobicContact CD2-CB 4.47Å; L425-V465 HydrophobicContact CD2-CG1 3.84Å; V457-V465 HydrophobicContact CG1-CG1 3.7Å
466	G	87.2	Confident	80.3	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	162.4	173.2	0	0	0	0	0	112.1	A410 I458	A410-G466 CarbonylContact O-C 3.47Å; A410-G466 WeakPolarHBondContact O-CA 3.08Å; I458-G466 PolarHBondContact N-O 3.42Å; I458-G466 PolarHBondContact O-N 3.36Å
467	F	89.5	Confident	79.3	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	155	171.9	62.2	-85.7	0	0	0	110.9	A410 V412 L425 C428 L444 I445 L455 T456 V457 F469	A410-F467 HydrophobicContact CB-CD1 4.17Å; A410-F467 HydrophobicContact CB-CD2 4.26Å; A410-F467 HydrophobicContact CB-CE1 3.71Å; A410-F467 HydrophobicContact CB-CE2 3.79Å; A410-F467 HydrophobicContact CB-CG 4.44Å; A410-F467 HydrophobicContact CB-CZ 3.51Å; A410-F467 PolarHBondContact N-O 2.83Å; A410-F467 PolarHBondContact O-N 2.02Å; V412-F467 HydrophobicContact CG2-CE1 4.05Å; L425-F467 HydrophobicContact CD2-CD1 3.59Å; L425-F467 HydrophobicContact CD2-CE1 4.13Å; L425-F467 HydrophobicContact CD2-CG 4.43Å; C428-F467 HydrophobicContact CB-CZ 4.25Å; L444-F467 HydrophobicContact CD1-CE2 3.97Å; I445-F467 HydrophobicContact CD1-CB 3.94Å; I445-F467 HydrophobicContact CD1-CD1 4.05Å; I445-F467 HydrophobicContact CD1-CD2 4.41Å; I445-F467 HydrophobicContact CD1-CG 3.88Å; L455-F467 HydrophobicContact CD1-CD2 4.47Å; T456-F467 CarbonylContact O-C 3.52Å; T456-F467 WeakPolarHBondContact O-CA 2.97Å; V457-F467 HydrophobicContact CG2-CB 4.45Å; F467-F469 HydrophobicContact CD2-CD1 4.05Å; F467-F469 AromaticContact CE2-CD1 3.81Å; F467-F469 HydrophobicContact CE2-CD1 3.81Å; F467-F469 HydrophobicContact CE2-CE1 4.06Å
468	T	86.2	Confident	77.8	Confident	3 Å²	3	24.3 Å²	24.3	2%	0.018	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	140.9	-176.9	72.9	0	0	0	0	110.9	V408 Y409 L455 T456 I458	V408-T468 WeakPolarHBondContact O-CA 3.28Å; Y409-T468 HydrophobicContact CD1-CG2 3.41Å; Y409-T468 VanDerWaalsContact CD1-CG2 3.41Å; Y409-T468 HydrophobicContact CE1-CG2 3.5Å; Y409-T468 HydrophobicContact CG-CG2 4.43Å; L455-T468 VanDerWaalsContact CA-O 3.3Å; L455-T468 WeakPolarHBondContact CA-O 3.03Å; L455-T468 WeakPolarHBondContact CG-O 3.47Å; T456-T468 PolarHBondContact N-OG1 3.09Å; T456-T468 VanDerWaalsContact N-OG1 3.11Å; T456-T468 PolarHBondContact O-N 3.15Å; T456-T468 VanDerWaalsContact OG1-CG2 3.23Å; T456-T468 WeakPolarHBondContact OG1-CG2 3.39Å; T456-T468 PolarHBondContact OG1-OG1 3.14Å; I458-T468 HydrophobicContact CD1-CG2 3.67Å; I458-T468 HydrophobicContact CG1-CG2 4.43Å
469	F	83.6	Confident	76.9	Confident	1 Å²	1	26.6 Å²	26.6	0%	0.004	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	152.8	171.2	63.7	-79.6	0	0	0	109.9	V408 A410 L444 Y452 L455 F467 F472 L487 L489	V408-F469 HydrophobicContact CB-CD1 4.28Å; V408-F469 HydrophobicContact CB-CD2 4.5Å; V408-F469 HydrophobicContact CB-CE1 3.82Å; V408-F469 HydrophobicContact CB-CE2 4.06Å; V408-F469 HydrophobicContact CB-CZ 3.68Å; V408-F469 HydrophobicContact CG1-CE1 3.88Å; V408-F469 HydrophobicContact CG1-CZ 3.73Å; V408-F469 HydrophobicContact CG2-CE2 4.13Å; V408-F469 HydrophobicContact CG2-CZ 4.15Å; V408-F469 PolarHBondContact N-O 2.79Å; V408-F469 PolarHBondContact O-N 2.86Å; A410-F469 HydrophobicContact CB-CE1 4.25Å; L444-F469 HydrophobicContact CD1-CD1 4.46Å; L444-F469 HydrophobicContact CD1-CG 4.47Å; L444-F469 HydrophobicContact CD2-CB 4.37Å; Y452-F469 WeakPolarHBondContact OH-CB 3.48Å; L455-F469 HydrophobicContact CD1-CB 4.18Å; F467-F469 HydrophobicContact CD2-CD1 4.05Å; F467-F469 AromaticContact CE2-CD1 3.81Å; F467-F469 HydrophobicContact CE2-CD1 3.81Å; F467-F469 HydrophobicContact CE2-CE1 4.06Å; F469-F472 HydrophobicContact CD2-CD1 4.33Å; F469-F472 AromaticContact CD2-CE1 3.86Å; F469-F472 HydrophobicContact CD2-CE1 3.86Å; F469-F472 HydrophobicContact CE2-CE1 4.32Å; F469-L487 HydrophobicContact CE2-CD2 4.06Å; F469-L489 HydrophobicContact CE1-CD1 3.79Å; F469-L489 HydrophobicContact CE1-CD2 4.29Å; F469-L489 HydrophobicContact CE2-CD2 4.42Å; F469-L489 HydrophobicContact CZ-CD1 3.71Å; F469-L489 HydrophobicContact CZ-CD2 3.93Å; F469-L489 HydrophobicContact CZ-CG 4.35Å
470	N	78.4	Confident	75.6	Confident	49 Å²	49	30.1 Å²	30.1	26%	0.262	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	134.7	170.9	-65.3	12.3	0	0	0	108.1	G405 D406 K407 F472	G405-N470 WeakPolarHBondContact O-CB 3.32Å; G405-N470 VanDerWaalsContact O-CG 3.31Å; G405-N470 PolarHBondContact O-ND2 2.03Å; D406-N470 CarbonylContact O-C 3.58Å; D406-N470 WeakPolarHBondContact O-CA 3.27Å; K407-N470 WeakPolarHBondContact CG-OD1 3.43Å; N470-F472 VanDerWaalsContact O-CD1 3.23Å; N470-F472 WeakPolarHBondContact O-CD1 3.46Å
471	A	74.2	Confident	74.3	Confident	6 Å²	6	29.8 Å²	29.8	5%	0.05	20%	0.2	C	C	.	.			trans	-56.6	143.2	174.4	0	0	0	0	0	110.6	I402 P404 G405 D406 V408 T564	I402-A471 HydrophobicContact CB-CB 4.32Å; I402-A471 HydrophobicContact CG2-CB 3.82Å; P404-A471 CarbonylContact C-O 3.53Å; P404-A471 VanDerWaalsContact CA-O 3.23Å; P404-A471 WeakPolarHBondContact CA-O 3.23Å; P404-A471 WeakPolarHBondContact CB-O 3.02Å; G405-A471 PolarHBondContact N-O 3.32Å; D406-A471 PolarHBondContact O-N 2.93Å; V408-A471 HydrophobicContact CG2-CB 3.86Å; A471-T564 HydrophobicContact CB-CG2 4.17Å
472	F	71.8	Confident	73.1	Confident	4 Å²	4	30.4 Å²	30.4	2%	0.018	20%	0.204	C	C	.	.			trans	-151.4	167	-178.8	58.6	-95	0	0	0	110.5	A430 R442 L444 F469 N470 L474 L487	A430-F472 HydrophobicContact CB-CE2 3.85Å; A430-F472 HydrophobicContact CB-CZ 3.51Å; R442-F472 HydrophobicContact CB-CE2 3.78Å; R442-F472 HydrophobicContact CB-CZ 3.94Å; R442-F472 HydrophobicContact CG-CE2 4.21Å; R442-F472 HydrophobicContact CG-CZ 4.04Å; R442-F472 VanDerWaalsContact NH1-CD1 3.3Å; L444-F472 HydrophobicContact CD2-CE1 3.79Å; L444-F472 HydrophobicContact CD2-CZ 3.96Å; F469-F472 HydrophobicContact CD2-CD1 4.33Å; F469-F472 AromaticContact CD2-CE1 3.86Å; F469-F472 HydrophobicContact CD2-CE1 3.86Å; F469-F472 HydrophobicContact CE2-CE1 4.32Å; N470-F472 VanDerWaalsContact O-CD1 3.23Å; N470-F472 WeakPolarHBondContact O-CD1 3.46Å; F472-L474 HydrophobicContact CD2-CD2 4.43Å; F472-L474 HydrophobicContact CD2-CG 4.14Å; F472-L474 HydrophobicContact CE2-CD1 4.05Å; F472-L474 HydrophobicContact CE2-CD2 4.17Å; F472-L474 HydrophobicContact CE2-CG 3.84Å; F472-L487 HydrophobicContact CD2-CD1 4.19Å; F472-L487 HydrophobicContact CE2-CD1 3.72Å; F472-L487 HydrophobicContact CE2-CD2 4.48Å; F472-L487 HydrophobicContact CZ-CD1 4.25Å; F472-L487 HydrophobicContact CZ-CD2 4.35Å
473	Y	68.2	Low	71.9	Confident	2 Å²	2	31.5 Å²	31.5	1%	0.008	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	153.5	172.6	-58.3	-66.1	0	0	0	112.4	I340 L343 P404 V481 S485 T564 V565	I340-Y473 HydrophobicContact CG2-CD2 4.4Å; L343-Y473 HydrophobicContact CD2-CE2 3.49Å; L343-Y473 VanDerWaalsContact CD2-CE2 3.49Å; L343-Y473 WeakPolarHBondContact CD2-OH 3.16Å; L343-Y473 HydrophobicContact CG-CE2 3.87Å; P404-Y473 HydrophobicContact CB-CE2 4.28Å; P404-Y473 HydrophobicContact CG-CD2 3.8Å; P404-Y473 HydrophobicContact CG-CE1 4.18Å; P404-Y473 HydrophobicContact CG-CE2 3.18Å; P404-Y473 HydrophobicContact CG-CG 4.49Å; P404-Y473 WeakPolarHBondContact CG-OH 3.15Å; Y473-V481 HydrophobicContact CD2-CG1 4.45Å; Y473-S485 WeakPolarHBondContact CD1-OG 3.2Å; Y473-T564 WeakPolarHBondContact CD1-OG1 3.22Å; Y473-T564 WeakPolarHBondContact CE1-O 3.46Å; Y473-T564 WeakPolarHBondContact CE1-OG1 3.49Å; Y473-V565 PolarHBondContact OH-N 2.95Å; Y473-V565 PolarHBondContact OH-OXT 3.37Å
474	L	66.6	Low	70.8	Confident	7 Å²	7	35 Å²	35	4%	0.037	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	118.8	171.4	-75.4	175	0	0	0	108.3	A430 A432 P440 R442 F472 L487	A430-L474 VanDerWaalsContact C-CD1 3.46Å; A430-L474 HydrophobicContact CB-CD1 4.14Å; A430-L474 WeakPolarHBondContact O-CD1 3.19Å; A432-L474 HydrophobicContact CB-CB 4.14Å; P440-L474 HydrophobicContact CB-CD2 4.43Å; P440-L474 HydrophobicContact CG-CB 4.13Å; P440-L474 HydrophobicContact CG-CD2 4.49Å; R442-L474 HydrophobicContact CB-CD2 3.97Å; F472-L474 HydrophobicContact CD2-CD2 4.43Å; F472-L474 HydrophobicContact CD2-CG 4.14Å; F472-L474 HydrophobicContact CE2-CD1 4.05Å; F472-L474 HydrophobicContact CE2-CD2 4.17Å; F472-L474 HydrophobicContact CE2-CG 3.84Å; L474-L487 HydrophobicContact CD1-CD1 3.97Å; L474-L487 HydrophobicContact CG-CD1 4.28Å
475	N	65.9	Low	69.8	Low	31 Å²	31	32.7 Å²	32.7	17%	0.166	21%	0.211	C	C	.	.			trans	-142.2	159.8	176.4	-161	14.5	0	0	0	111.1	T334 I340 V480 P482	T334-N475 HydrophobicContact CG2-CB 4.37Å; I340-N475 HydrophobicContact CD1-CB 3.59Å; N475-V480 PolarHBondContact ND2-O 2.67Å; N475-P482 WeakPolarHBondContact ND2-CD 3.09Å
476	T	69.2	Low	68.9	Low	86 Å²	86	35.1 Å²	35.1	53%	0.528	22%	0.223	S	C	.	.			trans	-67.2	133.7	178.6	-49.4	0	0	0	0	110.4	G478 S479	T476-G478 PolarHBondContact O-N 3.45Å; T476-S479 VanDerWaalsContact O-CB 3.24Å; T476-S479 WeakPolarHBondContact O-CB 2.94Å; T476-S479 PolarHBondContact O-N 2.88Å; T476-S479 PolarHBondContact O-OG 2.88Å
477	A	62.3	Low	68.1	Low	57 Å²	57	35.1 Å²	35.1	47%	0.471	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	136.3	178.4	0	0	0	0	0	111.6	S479	A477-S479 PolarHBondContact O-N 3.34Å
478	G	58	Low	67.5	Low	61 Å²	61	35.9 Å²	35.9	63%	0.629	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.3	-5.7	-177	0	0	0	0	0	115.7	T334 T476	T334-G478 PolarHBondContact O-N 2.04Å; T476-G478 PolarHBondContact O-N 3.45Å
479	S	66	Low	67.4	Low	47 Å²	47	35.7 Å²	35.7	33%	0.329	23%	0.226	S	C	.	.	S	Bend	trans	-83.7	149.7	174.2	-58.2	0	0	0	0	111.6	T334 T476 A477 V481	T334-S479 PolarHBondContact N-O 3.01Å; T334-S479 PolarHBondContact OG1-O 2.81Å; T476-S479 VanDerWaalsContact O-CB 3.24Å; T476-S479 WeakPolarHBondContact O-CB 2.94Å; T476-S479 PolarHBondContact O-N 2.88Å; T476-S479 PolarHBondContact O-OG 2.88Å; A477-S479 PolarHBondContact O-N 3.34Å; S479-V481 PolarHBondContact O-N 3.33Å
480	V	57.9	Low	67.3	Low	91 Å²	91	35.8 Å²	35.8	55%	0.552	23%	0.226	S	C	*	.	B	Isolated β-bridge	trans	-62.2	131.3	171.3	-178.9	0	0	0	0	108.4	N475 P482	N475-V480 PolarHBondContact ND2-O 2.67Å; V480-P482 WeakPolarHBondContact O-CD 3.23Å
481	V	57.3	Low	67.5	Low	4 Å²	4	33.5 Å²	33.5	2%	0.024	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-68.5	123	178.2	-177.5	0	0	0	0	109.3	Y332 I340 P344 Y473 S479	Y332-V481 WeakPolarHBondContact O-CG2 3.42Å; Y332-V481 PolarHBondContact O-N 2.91Å; I340-V481 HydrophobicContact CD1-CB 4.33Å; I340-V481 HydrophobicContact CD1-CG1 3.91Å; I340-V481 HydrophobicContact CD1-CG2 3.61Å; I340-V481 HydrophobicContact CG1-CG2 4Å; I340-V481 HydrophobicContact CG2-CG1 4.17Å; I340-V481 HydrophobicContact CG2-CG2 4.12Å; P344-V481 HydrophobicContact CG-CB 3.44Å; P344-V481 VanDerWaalsContact CG-CB 3.44Å; P344-V481 HydrophobicContact CG-CG1 3.39Å; Y473-V481 HydrophobicContact CD2-CG1 4.45Å; S479-V481 PolarHBondContact O-N 3.33Å
482	P	59.7	Low	67.9	Low	46 Å²	46	33.9 Å²	33.9	30%	0.299	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-72.2	153.9	-179.7	31.1	-36.1	0	0	0	111.7	N475 V480 N484	N475-P482 WeakPolarHBondContact ND2-CD 3.09Å; V480-P482 WeakPolarHBondContact O-CD 3.23Å; P482-N484 VanDerWaalsContact C-N 3.28Å; P482-N484 WeakPolarHBondContact CB-O 3.37Å; P482-N484 WeakPolarHBondContact CG-O 3.15Å; P482-N484 PolarHBondContact O-N 2.89Å
483	I	55.2	Low	68.2	Low	68 Å²	68	33.7 Å²	33.7	35%	0.349	22%	0.215	S	C	.	.	S	Bend	trans	-66.4	-33	178.5	-56.7	169.6	0	0	0	111	I329	I329-I483 HydrophobicContact CD1-CD1 3.59Å; I329-I483 HydrophobicContact CD1-CG1 4.27Å
484	N	57.7	Low	68.5	Low	105 Å²	105	36 Å²	36	56%	0.561	22%	0.223	S	C	*	.	S	Bend	trans	-123	138.2	173.8	53.1	1.8	0	0	0	109.1	P482	P482-N484 VanDerWaalsContact C-N 3.28Å; P482-N484 WeakPolarHBondContact CB-O 3.37Å; P482-N484 WeakPolarHBondContact CG-O 3.15Å; P482-N484 PolarHBondContact O-N 2.89Å
485	S	63.8	Low	68.8	Low	11 Å²	11	37.8 Å²	37.8	8%	0.077	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	146.7	169.5	130.5	0	0	0	0	109.6	Y473 T564	Y473-S485 WeakPolarHBondContact CD1-OG 3.2Å; S485-T564 PolarHBondContact N-O 3.45Å; S485-T564 PolarHBondContact O-N 3.3Å; S485-T564 PolarHBondContact O-OG1 3.39Å; S485-T564 VanDerWaalsContact O-OG1 3.07Å
486	N	68.2	Low	69.3	Low	58 Å²	58	36.6 Å²	36.6	31%	0.31	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	141.4	173.4	-62.5	-34.5	0	0	0	108.8	F488 Q561 I562	N486-F488 HydrophobicContact CB-CD2 4.36Å; N486-F488 HydrophobicContact CB-CE2 3.58Å; N486-F488 HydrophobicContact CB-CZ 4.2Å; N486-Q561 HydrophobicContact CB-CG 4.33Å; N486-Q561 VanDerWaalsContact CG-NE2 3.25Å; N486-Q561 PolarHBondContact ND2-NE2 2.83Å; N486-Q561 PolarHBondContact OD1-NE2 3.33Å; N486-I562 CarbonylContact C-O 3.58Å; N486-I562 WeakPolarHBondContact CA-O 3.27Å
487	L	70	Confident	69.5	Low	1 Å²	1	35.6 Å²	35.6	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.7	171	-165.5	74.4	0	0	0	108.3	A430 F469 F472 L474 I562	A430-L487 HydrophobicContact CB-CD1 3.65Å; A430-L487 HydrophobicContact CB-CD2 4.36Å; A430-L487 HydrophobicContact CB-CG 4.01Å; F469-L487 HydrophobicContact CE2-CD2 4.06Å; F472-L487 HydrophobicContact CD2-CD1 4.19Å; F472-L487 HydrophobicContact CE2-CD1 3.72Å; F472-L487 HydrophobicContact CE2-CD2 4.48Å; F472-L487 HydrophobicContact CZ-CD1 4.25Å; F472-L487 HydrophobicContact CZ-CD2 4.35Å; L474-L487 HydrophobicContact CD1-CD1 3.97Å; L474-L487 HydrophobicContact CG-CD1 4.28Å; L487-I562 HydrophobicContact CB-CB 4.24Å; L487-I562 PolarHBondContact N-O 3.1Å; L487-I562 VanDerWaalsContact O-CB 3.25Å; L487-I562 WeakPolarHBondContact O-CB 3.46Å; L487-I562 WeakPolarHBondContact O-CG1 3.37Å; L487-I562 PolarHBondContact O-N 3.28Å
488	F	77.6	Confident	69.9	Low	15 Å²	15	35.8 Å²	35.8	7%	0.066	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	130.1	174.6	-62.6	-93.9	0	0	0	108.3	A430 T431 P434 N486 Q561	A430-F488 CarbonylContact C-O 3.47Å; A430-F488 WeakPolarHBondContact CA-O 3.17Å; T431-F488 PolarHBondContact N-O 3.19Å; T431-F488 PolarHBondContact O-N 2.79Å; P434-F488 HydrophobicContact CB-CD1 4.18Å; P434-F488 HydrophobicContact CB-CE1 4.08Å; P434-F488 HydrophobicContact CB-CZ 4.45Å; P434-F488 HydrophobicContact CG-CD1 4.14Å; P434-F488 HydrophobicContact CG-CE1 3.58Å; P434-F488 HydrophobicContact CG-CE2 4.09Å; P434-F488 HydrophobicContact CG-CZ 3.55Å; N486-F488 HydrophobicContact CB-CD2 4.36Å; N486-F488 HydrophobicContact CB-CE2 3.58Å; N486-F488 HydrophobicContact CB-CZ 4.2Å; F488-Q561 HydrophobicContact CE1-CB 3.68Å; F488-Q561 HydrophobicContact CE1-CG 4.09Å; F488-Q561 HydrophobicContact CZ-CB 3.93Å; F488-Q561 HydrophobicContact CZ-CG 3.8Å
489	L	82.9	Confident	70.6	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	136	177.1	-61.4	172.4	0	0	0	109.6	L384 L386 A410 A430 L444 F469 D558 S559 I562	L384-L489 HydrophobicContact CD1-CB 3.9Å; L384-L489 HydrophobicContact CD2-CD1 4.17Å; L386-L489 HydrophobicContact CD2-CD1 3.83Å; A410-L489 HydrophobicContact CB-CD1 4.38Å; A430-L489 HydrophobicContact CB-CD2 3.86Å; L444-L489 HydrophobicContact CD1-CD2 3.58Å; F469-L489 HydrophobicContact CE1-CD1 3.79Å; F469-L489 HydrophobicContact CE1-CD2 4.29Å; F469-L489 HydrophobicContact CE2-CD2 4.42Å; F469-L489 HydrophobicContact CZ-CD1 3.71Å; F469-L489 HydrophobicContact CZ-CD2 3.93Å; F469-L489 HydrophobicContact CZ-CG 4.35Å; L489-D558 WeakPolarHBondContact O-CA 2.99Å; L489-S559 PolarHBondContact N-OG 3.43Å; L489-S559 PolarHBondContact O-N 2.9Å; L489-I562 HydrophobicContact CD1-CD1 3.75Å; L489-I562 HydrophobicContact CG-CD1 3.76Å
490	H	83	Confident	70.9	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.009	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	136.3	177.5	-54.7	-74.8	0	0	0	107.8	C428 W429 T431 P434 R436 V557 D558	C428-H490 CarbonylContact C-O 3.46Å; C428-H490 WeakPolarHBondContact CA-O 3.36Å; W429-H490 AromaticContact CD1-CD2 3.96Å; W429-H490 HydrophobicContact CD2-CB 3.91Å; W429-H490 VanDerWaalsContact CE2-CB 3.42Å; W429-H490 HydrophobicContact CE3-CB 4.45Å; W429-H490 HydrophobicContact CG-CB 4.38Å; W429-H490 HydrophobicContact CH2-CB 4.08Å; W429-H490 HydrophobicContact CZ2-CB 3.54Å; W429-H490 PolarHBondContact N-O 3.26Å; W429-H490 AromaticContact NE1-CD2 3.66Å; W429-H490 AromaticContact NE1-CG 3.85Å; W429-H490 PolarHBondContact O-N 2.87Å; T431-H490 PolarHBondContact OG1-CD2 2.88Å; T431-H490 PolarHBondContact OG1-NE2 2.98Å; P434-H490 PolarHBondContact O-CE1 3.45Å; R436-H490 HydrophobicContact CB-CB 4.47Å; H490-V557 CarbonylContact C-O 3.56Å; H490-D558 IonicContact CE1-OD1 3.15Å; H490-D558 IonicContact CG-OD1 3.27Å; H490-D558 IonicContact ND1-OD1 2.62Å; H490-D558 PolarHBondContact ND1-OD1 3.37Å
491	C	83.1	Confident	71.4	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.007	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	144.1	174.8	-67.8	0	0	0	0	111.5	L425 N427 C428 H556 V557	L425-C491 HydrophobicContact CD1-CB 3.98Å; N427-C491 CarbonylContact O-C 3.56Å; N427-C491 WeakPolarHBondContact O-CA 3.36Å; C428-C491 HydrophobicContact CB-CB 4.21Å; C428-C491 WeakPolarHBondContact CB-SG 3.2Å; C428-C491 WeakPolarHBondContact SG-CB 3.35Å; C428-C491 CovalentContact SG-SG 2.05Å; C428-C491 PolarHBondContact SG-SG 3.39Å; C491-H556 WeakPolarHBondContact O-CA 3.44Å; C491-V557 PolarHBondContact N-O 2.07Å; C491-V557 PolarHBondContact O-N 3.25Å
492	D	81.5	Confident	72.2	Confident	15 Å²	15	45.4 Å²	45.4	8%	0.08	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	124.1	165.8	-61.8	-24	0	0	0	108	E426 N427 W429 R436 H554 H556	E426-D492 HydrophobicContact CB-CB 4.48Å; E426-D492 PolarHBondContact N-O 2.62Å; N427-D492 HydrophobicContact CB-CB 4.18Å; N427-D492 PolarHBondContact N-O 3.29Å; N427-D492 PolarHBondContact O-N 3.49Å; W429-D492 VanDerWaalsContact CH2-OD1 3.31Å; W429-D492 WeakPolarHBondContact CH2-OD1 3.41Å; R436-D492 IonicContact NH2-OD1 3.77Å; R436-D492 PolarHBondContact NH2-OD1 3.18Å; D492-H554 HydrophobicContact CB-CB 4.19Å; D492-H556 IonicContact OD1-CE1 3.86Å; D492-H556 PolarHBondContact OD1-CE1 3.09Å; D492-H556 IonicContact OD1-CG 3.14Å; D492-H556 IonicContact OD1-ND1 2.6Å; D492-H556 PolarHBondContact OD1-ND1 3.48Å
493	I	78.4	Confident	72.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	156.5	173.1	70.8	173.6	0	0	0	111.3	V412 L414 L423 I424 L425 I555 V557	V412-I493 HydrophobicContact CG1-CG2 3.78Å; L414-I493 HydrophobicContact CD2-CD1 3.94Å; L423-I493 HydrophobicContact CD1-CD1 3.68Å; L423-I493 HydrophobicContact CD1-CG2 4.42Å; L423-I493 HydrophobicContact CD2-CG2 4.41Å; L423-I493 HydrophobicContact CG-CB 4.41Å; L423-I493 HydrophobicContact CG-CD1 4.33Å; L423-I493 HydrophobicContact CG-CG2 4.5Å; I424-I493 CarbonylContact O-C 3.39Å; I424-I493 VanDerWaalsContact O-CA 3.23Å; I424-I493 WeakPolarHBondContact O-CA 3.04Å; I424-I493 WeakPolarHBondContact O-CB 3.23Å; L425-I493 HydrophobicContact CD1-CG2 3.73Å; I493-I555 HydrophobicContact CD1-CB 4.27Å; I493-I555 HydrophobicContact CD1-CG2 4.18Å; I493-I555 HydrophobicContact CG1-CB 3.65Å; I493-I555 HydrophobicContact CG1-CG2 4.03Å; I493-I555 WeakPolarHBondContact CG1-O 3.37Å; I493-I555 PolarHBondContact N-O 3.44Å; I493-I555 PolarHBondContact O-N 3.14Å; I493-V557 HydrophobicContact CD1-CG2 3.79Å; I493-V557 HydrophobicContact CG1-CG2 3.93Å; I493-V557 HydrophobicContact CG2-CG2 4.07Å
494	R	73.9	Confident	73.7	Confident	50 Å²	50	48.9 Å²	48.9	19%	0.189	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	137.3	168.5	-175	179.7	-58.8	-135.3	-0.7	109.6	I424 E426 N504	I424-R494 HydrophobicContact CB-CB 4.27Å; I424-R494 PolarHBondContact N-O 3.08Å; I424-R494 PolarHBondContact O-N 3.17Å; E426-R494 HydrophobicContact CG-CB 4.42Å; E426-R494 IonicContact OE1-CZ 3.91Å; E426-R494 IonicContact OE1-NE 3.84Å; E426-R494 PolarHBondContact OE1-NE 3.29Å; E426-R494 IonicContact OE1-NH2 3.78Å; E426-R494 PolarHBondContact OE1-NH2 2.86Å; R494-N504 VanDerWaalsContact NH1-CB 3.35Å
495	V	74.3	Confident	74.7	Confident	45 Å²	45	44 Å²	44	27%	0.273	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	122.6	172.2	179.5	0	0	0	0	107.9	I380 L414 I555	I380-V495 HydrophobicContact CG2-CG2 4.44Å; L414-V495 HydrophobicContact CD1-CG1 4.23Å; L414-V495 HydrophobicContact CD1-CG2 3.95Å; L414-V495 HydrophobicContact CD2-CG2 3.58Å; L414-V495 HydrophobicContact CG-CG2 4.41Å; V495-I555 HydrophobicContact CB-CD1 4.39Å; V495-I555 HydrophobicContact CG2-CD1 3.65Å
496	C	75.2	Confident	75.3	Confident	5 Å²	5	43.9 Å²	43.9	3%	0.034	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	163.5	178.4	-63.4	0	0	0	0	110.5	S421 K422 C505	S421-C496 CarbonylContact C-O 3.34Å; S421-C496 WeakPolarHBondContact CA-O 3.48Å; K422-C496 HydrophobicContact CG-CB 3.93Å; K422-C496 PolarHBondContact N-O 3.39Å; K422-C496 PolarHBondContact O-N 3.24Å; C496-C505 HydrophobicContact CB-CB 3.56Å; C496-C505 WeakPolarHBondContact CB-SG 3.31Å; C496-C505 WeakPolarHBondContact SG-CA 3.36Å; C496-C505 WeakPolarHBondContact SG-CB 3.09Å; C496-C505 CovalentContact SG-SG 2.04Å; C496-C505 PolarHBondContact SG-SG 3.34Å
497	D	74	Confident	75.9	Confident	65 Å²	65	42.1 Å²	42.1	35%	0.348	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	145	164.6	-171.1	-86.6	0	0	0	110	T420 K422 R499 E500	T420-D497 WeakPolarHBondContact CB-OD2 3.07Å; T420-D497 CarbonylContact O-C 3.46Å; T420-D497 VanDerWaalsContact O-CA 3.25Å; T420-D497 WeakPolarHBondContact O-CA 3.2Å; T420-D497 PolarHBondContact OG1-OD2 2.97Å; T420-D497 VanDerWaalsContact OG1-OD2 3.04Å; K422-D497 WeakPolarHBondContact CE-O 3.47Å; D497-R499 PolarHBondContact O-N 3.24Å; D497-R499 VanDerWaalsContact O-N 3.11Å; D497-R499 WeakPolarHBondContact OD1-CB 3.24Å; D497-R499 PolarHBondContact OD1-N 3.22Å; D497-E500 HydrophobicContact CB-CB 4.33Å; D497-E500 WeakPolarHBondContact O-CB 3.41Å; D497-E500 PolarHBondContact O-N 3.45Å
498	L	70.7	Confident	76.2	Confident	62 Å²	62	42.7 Å²	42.7	33%	0.325	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-33.4	178.4	-83.4	179.4	0	0	0	112	K419 T420 K422 A462	K419-L498 WeakPolarHBondContact O-CD1 3.35Å; T420-L498 PolarHBondContact O-N 2.85Å; K422-L498 HydrophobicContact CB-CD2 4.01Å; A462-L498 HydrophobicContact CB-CD2 3.84Å
499	R	71.2	Confident	76.1	Confident	163 Å²	163	42.7 Å²	42.7	62%	0.615	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90	-5.5	-177.5	-59.3	-178	176.3	-170.5	-0.8	113.3	D497 I501	D497-R499 PolarHBondContact O-N 3.24Å; D497-R499 VanDerWaalsContact O-N 3.11Å; D497-R499 WeakPolarHBondContact OD1-CB 3.24Å; D497-R499 PolarHBondContact OD1-N 3.22Å; R499-I501 PolarHBondContact O-N 2.95Å
500	E	72.9	Confident	75.3	Confident	71 Å²	71	48.8 Å²	48.8	33%	0.332	24%	0.235	S	C	.	.			trans	-75.1	119.2	179.8	-165.8	172.6	176.5	0	0	110.5	K422 D497 N502 C505	K422-E500 WeakPolarHBondContact CE-O 3.46Å; K422-E500 PolarHBondContact NZ-O 2.8Å; D497-E500 HydrophobicContact CB-CB 4.33Å; D497-E500 WeakPolarHBondContact O-CB 3.41Å; D497-E500 PolarHBondContact O-N 3.45Å; E500-N502 HydrophobicContact CG-CB 4.27Å; E500-N502 PolarHBondContact OE1-ND2 3.08Å; E500-C505 HydrophobicContact CB-CB 4.1Å; E500-C505 HydrophobicContact CG-CB 3.9Å; E500-C505 PolarHBondContact OE2-SG 3.07Å; E500-C505 VanDerWaalsContact OE2-SG 3.39Å
501	I	69.4	Low	74.1	Confident	77 Å²	77	51.3 Å²	51.3	40%	0.395	25%	0.253	S	S	.	.			trans	-108.3	12.3	-176.1	58.6	167.1	0	0	0	113.1	R499	R499-I501 PolarHBondContact O-N 2.95Å
502	N	74.3	Confident	72.2	Confident	93 Å²	93	55.5 Å²	55.5	50%	0.497	28%	0.282	S	S	.	.	S	Bend	trans	-61.6	151.3	176.7	-67.6	-20.4	0	0	0	109.9	E500 N504 C505	E500-N502 HydrophobicContact CG-CB 4.27Å; E500-N502 PolarHBondContact OE1-ND2 3.08Å; N502-N504 PolarHBondContact O-N 3.25Å; N502-N504 VanDerWaalsContact O-N 3.08Å; N502-C505 WeakPolarHBondContact O-CA 3.29Å; N502-C505 PolarHBondContact O-N 2.87Å
503	E	72.5	Confident	69.9	Low	114 Å²	114	61.2 Å²	61.2	53%	0.533	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-50.4	-42.1	-179.1	-66.2	-170.2	164.9	0	0	111.6	R448 C505 Q506 Y508	R448-E503 PolarHBondContact NH1-O 3.1Å; E503-C505 PolarHBondContact O-N 3.48Å; E503-Q506 PolarHBondContact O-N 2.82Å; E503-Y508 WeakPolarHBondContact CG-OH 3.13Å; E503-Y508 WeakPolarHBondContact O-CE1 3.36Å
504	N	73	Confident	67.9	Low	73 Å²	73	65.5 Å²	65.5	39%	0.39	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-68.4	-17.3	179.7	-61	-35.7	0	0	0	114.8	R494 N502	R494-N504 VanDerWaalsContact NH1-CB 3.35Å; N502-N504 PolarHBondContact O-N 3.25Å; N502-N504 VanDerWaalsContact O-N 3.08Å
505	C	78.3	Confident	66.1	Low	3 Å²	3	67.1 Å²	67.1	2%	0.02	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-104.7	19.9	-177.4	-73	0	0	0	0	112.7	K422 C496 E500 N502 E503	K422-C505 WeakPolarHBondContact CE-O 3.41Å; K422-C505 PolarHBondContact NZ-O 3.24Å; C496-C505 HydrophobicContact CB-CB 3.56Å; C496-C505 WeakPolarHBondContact CB-SG 3.31Å; C496-C505 WeakPolarHBondContact SG-CA 3.36Å; C496-C505 WeakPolarHBondContact SG-CB 3.09Å; C496-C505 CovalentContact SG-SG 2.04Å; C496-C505 PolarHBondContact SG-SG 3.34Å; E500-C505 HydrophobicContact CB-CB 4.1Å; E500-C505 HydrophobicContact CG-CB 3.9Å; E500-C505 PolarHBondContact OE2-SG 3.07Å; E500-C505 VanDerWaalsContact OE2-SG 3.39Å; N502-C505 WeakPolarHBondContact O-CA 3.29Å; N502-C505 PolarHBondContact O-N 2.87Å; E503-C505 PolarHBondContact O-N 3.48Å
506	Q	77.6	Confident	63.9	Low	8 Å²	8	70.2 Å²	70.2	4%	0.037	36%	0.363	C	S	.	.	S	Bend	trans	-125.3	132.4	175	-66	-178.1	-39.2	0	0	109.9	G228 M233 R448 E503 Y508	G228-Q506 VanDerWaalsContact C-NE2 3.26Å; G228-Q506 PolarHBondContact O-NE2 3.49Å; G228-Q506 PolarHBondContact O-OE1 2.91Å; M233-Q506 HydrophobicContact CE-CB 3.97Å; M233-Q506 HydrophobicContact CE-CG 4.25Å; M233-Q506 HydrophobicContact SD-CB 4.1Å; M233-Q506 HydrophobicContact SD-CG 4.38Å; R448-Q506 WeakPolarHBondContact CD-O 3.34Å; R448-Q506 PolarHBondContact NH1-O 2.8Å; E503-Q506 PolarHBondContact O-N 2.82Å; Q506-Y508 HydrophobicContact CB-CD1 3.52Å; Q506-Y508 HydrophobicContact CB-CE1 3.8Å; Q506-Y508 WeakPolarHBondContact O-CD1 3.45Å; Q506-Y508 PolarHBondContact O-N 2.87Å; Q506-Y508 VanDerWaalsContact O-N 3.15Å
507	Q	80.3	Confident	61.5	Low	21 Å²	21	74.9 Å²	74.9	10%	0.098	39%	0.391	C	S	.	.			trans	-83.4	85.2	176.6	-169.3	71	45.9	0	0	108.9	L188 I424 L425 R448	L188-Q507 HydrophobicContact CD1-CG 4.02Å; I424-Q507 HydrophobicContact CD1-CB 4.32Å; L425-Q507 PolarHBondContact O-NE2 3.3Å; L425-Q507 PolarHBondContact O-OE1 2.87Å; R448-Q507 PolarHBondContact O-NE2 3.3Å
508	Y	76.9	Confident	59.3	Low	13 Å²	13	80 Å²	80	5%	0.051	42%	0.417	C	S	.	.			trans	-146.2	161.4	178.3	78.5	-79.9	0	0	0	111.9	Y189 M233 R448 E503 Q506 Q510	Y189-Y508 VanDerWaalsContact OH-C 3.24Å; Y189-Y508 WeakPolarHBondContact OH-CA 3.39Å; Y189-Y508 PolarHBondContact OH-N 3.46Å; M233-Y508 HydrophobicContact CG-CG 4.03Å; M233-Y508 HydrophobicContact SD-CD1 4.44Å; R448-Y508 WeakPolarHBondContact CB-O 3.18Å; E503-Y508 WeakPolarHBondContact CG-OH 3.13Å; E503-Y508 WeakPolarHBondContact O-CE1 3.36Å; Q506-Y508 HydrophobicContact CB-CD1 3.52Å; Q506-Y508 HydrophobicContact CB-CE1 3.8Å; Q506-Y508 WeakPolarHBondContact O-CD1 3.45Å; Q506-Y508 PolarHBondContact O-N 2.87Å; Q506-Y508 VanDerWaalsContact O-N 3.15Å; Y508-Q510 HydrophobicContact CD2-CG 4.18Å; Y508-Q510 HydrophobicContact CE2-CB 4.44Å; Y508-Q510 HydrophobicContact CE2-CG 3.32Å; Y508-Q510 PolarHBondContact OH-NE2 3.32Å
509	C	75.4	Confident	57.3	Low	15 Å²	15	81.1 Å²	81.1	10%	0.101	43%	0.431	C	S	.	.			trans	-107.7	120.9	176.3	-171.6	0	0	0	0	110.1	Y189 C449 S511	Y189-C509 HydrophobicContact CD1-CB 3.89Å; Y189-C509 HydrophobicContact CE1-CB 3.66Å; C449-C509 HydrophobicContact CB-CB 3.92Å; C449-C509 WeakPolarHBondContact CB-SG 3Å; C449-C509 WeakPolarHBondContact SG-CA 3.28Å; C449-C509 WeakPolarHBondContact SG-CB 3.44Å; C449-C509 CovalentContact SG-SG 2.03Å; C449-C509 PolarHBondContact SG-SG 3Å; C509-S511 PolarHBondContact SG-O 3.41Å
510	Q	65.3	Low	55.2	Low	128 Å²	128	78.8 Å²	78.8	60%	0.598	44%	0.437	S	S	*	.	S	Bend	trans	-74.6	-26.6	176.7	-84.8	178.4	-31.1	0	0	112.9	Y508	Y508-Q510 HydrophobicContact CD2-CG 4.18Å; Y508-Q510 HydrophobicContact CE2-CB 4.44Å; Y508-Q510 HydrophobicContact CE2-CG 3.32Å; Y508-Q510 PolarHBondContact OH-NE2 3.32Å
511	S	56.9	Low	53	Low	56 Å²	56	83.6 Å²	83.6	39%	0.392	46%	0.464	S	S	.	.			trans	-125.4	103	-175.2	56.6	0	0	0	0	110.6	C509 I513	C509-S511 PolarHBondContact SG-O 3.41Å; S511-I513 PolarHBondContact O-N 2.89Å
512	S	43.3	Very low	50.9	Low	88 Å²	88	85.9 Å²	85.9	62%	0.615	48%	0.481	S	S	*	.	S	Bend	trans	-67.2	11.1	171.9	-39.3	0	0	0	0	113.8
513	I	34.9	Very low	48.6	Very low	135 Å²	135	87.3 Å²	87.3	69%	0.692	49%	0.494	S	S	*	.			trans	-137.5	81.7	-174.2	-45.9	175.3	0	0	0	109	S511	S511-I513 PolarHBondContact O-N 2.89Å
514	I	34.8	Very low	46.5	Very low	90 Å²	90	88.5 Å²	88.5	46%	0.462	50%	0.502	S	S	.	.			trans	-118.7	49.9	147.2	-44.4	176.8	0	0	0	107.2	P516	I514-P516 WeakPolarHBondContact O-CD 3.37Å
515	F	36.5	Very low	44.2	Very low	85 Å²	85	92 Å²	92	37%	0.373	52%	0.521	S	S	.	.			trans	-98	104	154.4	-55.9	-66.6	0	0	0	104.5	E453 T517	E453-F515 HydrophobicContact CB-CE1 4.39Å; E453-F515 HydrophobicContact CG-CD1 4.23Å; E453-F515 HydrophobicContact CG-CE1 3.31Å; E453-F515 HydrophobicContact CG-CE2 4.35Å; E453-F515 HydrophobicContact CG-CZ 3.38Å; F515-T517 HydrophobicContact CB-CG2 4.45Å; F515-T517 PolarHBondContact O-N 2.97Å
516	P	27.5	Very low	41.8	Very low	110 Å²	110	97.6 Å²	97.6	71%	0.714	56%	0.555	S	S	*	*			trans	-65.7	82.8	157.3	28.1	-28.5	0	0	0	105.5	I514 L518	I514-P516 WeakPolarHBondContact O-CD 3.37Å; P516-L518 PolarHBondContact O-N 3.1Å
517	T	26.7	Very low	39.1	Very low	102 Å²	102	104.2 Å²	104.2	63%	0.626	60%	0.597	S	S	*	*			trans	-54.3	114.5	152.7	53.1	0	0	0	0	103.8	F515 S519	F515-T517 HydrophobicContact CB-CG2 4.45Å; F515-T517 PolarHBondContact O-N 2.97Å; T517-S519 PolarHBondContact O-N 2.91Å; T517-S519 PolarHBondContact OG1-OG 3.37Å
518	L	27.9	Very low	36.7	Very low	172 Å²	172	108.3 Å²	108.3	90%	0.901	63%	0.628	S	S	*	*			trans	-62.1	77.7	163.4	-83.3	96.6	0	0	0	106.9	P516	P516-L518 PolarHBondContact O-N 3.1Å
519	S	26.9	Very low	34.1	Very low	87 Å²	87	115 Å²	115	61%	0.608	67%	0.67	S	S	*	*			trans	-76.6	125.3	166.6	-49.6	0	0	0	0	105.8	T517	T517-S519 PolarHBondContact O-N 2.91Å; T517-S519 PolarHBondContact OG1-OG 3.37Å
520	P	28.6	Very low	31.8	Very low	114 Å²	114	117.8 Å²	117.8	74%	0.74	70%	0.701	S	S	*	*			trans	-63.3	145.9	-170.2	-15.6	28	0	0	0	111	T522	P520-T522 PolarHBondContact O-N 3Å
521	L	25.8	Very low	29.8	Very low	172 Å²	172	118.1 Å²	118.1	90%	0.901	71%	0.712	S	S	*	*			trans	-39.5	100.2	174.2	-68.4	101.1	0	0	0	112.2	T523	L521-T523 PolarHBondContact O-N 2.9Å
522	T	26.2	Very low	28.4	Very low	124 Å²	124	123.7 Å²	123.7	76%	0.761	73%	0.731	S	S	*	*			trans	-87.6	98.5	154.3	51.1	0	0	0	0	107.1	P520 I524	P520-T522 PolarHBondContact O-N 3Å; T522-I524 PolarHBondContact O-N 3.11Å; T522-I524 VanDerWaalsContact O-N 3.09Å
523	T	24.9	Very low	27.6	Very low	124 Å²	124	124.2 Å²	124.2	76%	0.761	73%	0.733	S	S	*	*			trans	-37.6	105.3	164.1	1.9	0	0	0	0	111	L521	L521-T523 PolarHBondContact O-N 2.9Å
524	I	29.8	Very low	27.1	Very low	138 Å²	138	124.4 Å²	124.4	71%	0.708	74%	0.74	S	S	*	*			trans	-107.7	98.1	159.5	-61.5	178.5	0	0	0	106.6	T522 T526	T522-I524 PolarHBondContact O-N 3.11Å; T522-I524 VanDerWaalsContact O-N 3.09Å; I524-T526 HydrophobicContact CG2-CG2 4.12Å; I524-T526 PolarHBondContact O-N 3.49Å; I524-T526 VanDerWaalsContact O-N 3.14Å
525	N	23.2	Very low	26.6	Very low	148 Å²	148	129.7 Å²	129.7	79%	0.791	76%	0.76	S	S	*	*			trans	-61.5	103.2	161.9	-79.1	-20.3	0	0	0	108.5
526	T	27.7	Very low	25.9	Very low	119 Å²	119	137 Å²	137	73%	0.73	79%	0.785	S	S	*	*			trans	-134.1	94.3	154.9	49.2	0	0	0	0	109.2	I524 S528	I524-T526 HydrophobicContact CG2-CG2 4.12Å; I524-T526 PolarHBondContact O-N 3.49Å; I524-T526 VanDerWaalsContact O-N 3.14Å; T526-S528 PolarHBondContact O-N 3.48Å
527	T	21.5	Very low	25.9	Very low	148 Å²	148	142.9 Å²	142.9	91%	0.908	79%	0.794	S	S	*	*			trans	-55.2	108.6	153.9	45.7	0	0	0	0	109.3
528	S	29.3	Very low	25.7	Very low	107 Å²	107	149.2 Å²	149.2	75%	0.748	81%	0.807	S	S	*	*			trans	-150	104.9	153.4	115	0	0	0	0	109.1	T526 G530	T526-S528 PolarHBondContact O-N 3.48Å; S528-G530 PolarHBondContact O-N 3.41Å
529	T	23.2	Very low	25.5	Very low	152 Å²	152	152.4 Å²	152.4	93%	0.933	81%	0.807	S	S	*	*			trans	-49.1	120	161.6	45.7	0	0	0	0	111
530	G	27.7	Very low	25.5	Very low	74 Å²	74	156.4 Å²	156.4	76%	0.763	82%	0.821	S	S	*	*			trans	-156.3	59.7	178.1	0	0	0	0	0	112	S528 Q532	S528-G530 PolarHBondContact O-N 3.41Å; G530-Q532 PolarHBondContact O-N 3.24Å
531	V	22.6	Very low	25.2	Very low	135 Å²	135	157.8 Å²	157.8	82%	0.818	82%	0.822	S	S	*	*			trans	-73.1	115.4	168.2	174.9	0	0	0	0	108.6
532	Q	27.1	Very low	25.2	Very low	173 Å²	173	155.8 Å²	155.8	81%	0.808	81%	0.812	S	S	*	*			trans	-153.7	151.7	156.6	-82.6	-44.9	-32.1	0	0	110.2	G530	G530-Q532 PolarHBondContact O-N 3.24Å
533	P	27	Very low	25.2	Very low	100 Å²	100	159 Å²	159	65%	0.649	82%	0.816	S	S	*	*				-109.7	155.3	-125.1	12.9	8.5	0	0	0	114.1	K535	P533-K535 PolarHBondContact O-N 3.01Å; P533-K535 VanDerWaalsContact O-N 3.1Å
534	V	24.7	Very low	25.1	Very low	138 Å²	138	161.2 Å²	161.2	84%	0.836	82%	0.821	S	S	*	*			trans	-61	103.7	175.1	-179.3	0	0	0	0	110.6	R536	V534-R536 PolarHBondContact O-N 2.87Å
535	K	24.8	Very low	25	Very low	202 Å²	202	160.5 Å²	160.5	88%	0.878	82%	0.819	S	S	*	*			trans	-73.3	107.2	168.2	-79.3	-176.6	177.6	177.6	0	109.6	P533 Y537	P533-K535 PolarHBondContact O-N 3.01Å; P533-K535 VanDerWaalsContact O-N 3.1Å; K535-Y537 PolarHBondContact O-N 3.37Å
536	R	20.5	Very low	25.6	Very low	239 Å²	239	159 Å²	159	90%	0.902	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-63.1	120.1	168.7	-74.2	175.7	169.9	169.1	-3.3	110.2	V534	V534-R536 PolarHBondContact O-N 2.87Å
537	Y	27.6	Very low	25.5	Very low	232 Å²	232	160.7 Å²	160.7	91%	0.91	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-95.2	124.7	156.4	-109.2	-90.3	0	0	0	109.3	K535	K535-Y537 PolarHBondContact O-N 3.37Å
538	R	23.6	Very low	25.8	Very low	236 Å²	236	162.6 Å²	162.6	89%	0.891	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-70	141.7	179.7	-129.9	174.5	-174.7	161	-1	109.1	D540	R538-D540 PolarHBondContact O-N 2.88Å
539	R	22	Very low	25.6	Very low	238 Å²	238	165.3 Å²	165.3	90%	0.898	82%	0.816	S	S	*	*			trans	-68.3	113.1	174.6	-68.1	173.1	175.9	149.5	-2.5	109.3
540	D	27.5	Very low	25.7	Very low	171 Å²	171	165.9 Å²	165.9	91%	0.914	81%	0.808	S	S	*	*			trans	-88	123.7	156.8	-87.1	-34.1	0	0	0	109	R538	R538-D540 PolarHBondContact O-N 2.88Å
541	L	22.7	Very low	25.7	Very low	144 Å²	144	165.3 Å²	165.3	75%	0.754	79%	0.792	S	S	*	*			trans	-82.6	145.4	178.6	-79.5	155.2	0	0	0	110
542	N	24.7	Very low	26.2	Very low	129 Å²	129	166.5 Å²	166.5	69%	0.69	79%	0.789	S	S	*	*			trans	71.2	115.3	155.9	-57.1	-21.8	0	0	0	117.1
543	F	26.6	Very low	26.5	Very low	192 Å²	192	160.1 Å²	160.1	84%	0.842	77%	0.769	S	S	*	*				-171.1	108.5	98.7	-98	-77.5	0	0	0	108.4	N545	F543-N545 PolarHBondContact O-N 3.29Å
544	I	23.6	Very low	27.4	Very low	171 Å²	171	158.9 Å²	158.9	88%	0.877	76%	0.755	S	S	*	*			trans	-65.3	114.2	169	-62.7	167.2	0	0	0	106.6
545	N	27.4	Very low	28.6	Very low	123 Å²	123	153.2 Å²	153.2	66%	0.658	72%	0.719	S	S	*	*			trans	-128.6	118	170.8	-123.6	-32.5	0	0	0	108.2	F543 K547	F543-N545 PolarHBondContact O-N 3.29Å; N545-K547 PolarHBondContact O-N 3.16Å; N545-K547 VanDerWaalsContact O-N 3.11Å
546	P	36	Very low	29.8	Very low	117 Å²	117	148 Å²	148	76%	0.76	70%	0.698	S	S	*	*			trans	-79.9	101.1	-172.3	31.5	-30.5	0	0	0	108.3
547	K	26.1	Very low	31.4	Very low	154 Å²	154	136.9 Å²	136.9	67%	0.67	66%	0.656	S	S	*	*			trans	-136.5	118.5	175.7	-81.4	-173	178	-179.6	0	110.8	N545	N545-K547 PolarHBondContact O-N 3.16Å; N545-K547 VanDerWaalsContact O-N 3.11Å
548	F	26.7	Very low	32.5	Very low	188 Å²	188	129.5 Å²	129.5	83%	0.825	63%	0.633	S	S	*	*			trans	52.7	100.8	154.4	-77.9	-91.5	0	0	0	116.3	Q550	F548-Q550 PolarHBondContact O-N 3.29Å
549	L	25	Very low	34	Very low	164 Å²	164	118.9 Å²	118.9	86%	0.859	60%	0.595	S	S	*	*			trans	-62.2	70.6	153.4	-77.1	142.6	0	0	0	109.9	S551	L549-S551 PolarHBondContact O-N 3.09Å
550	Q	26.2	Very low	35.2	Very low	164 Å²	164	109.2 Å²	109.2	77%	0.766	57%	0.569	S	S	*	*			trans	-72.9	87.2	132.4	-78.6	-176.2	-12.1	0	0	103.8	F548 H552	F548-Q550 PolarHBondContact O-N 3.29Å; Q550-H552 PolarHBondContact O-N 3.04Å
551	S	27.5	Very low	35.8	Very low	62 Å²	62	105.1 Å²	105.1	43%	0.434	54%	0.544	S	S	.	.			trans	-69	92.4	-175.4	79.6	0	0	0	0	108.6	L549 G553	L549-S551 PolarHBondContact O-N 3.09Å; S551-G553 WeakPolarHBondContact CB-O 3.47Å; S551-G553 PolarHBondContact O-N 3.25Å; S551-G553 PolarHBondContact OG-O 3.35Å
552	H	31.9	Very low	37	Very low	160 Å²	160	98.4 Å²	98.4	74%	0.741	51%	0.509	S	S	*	.			trans	-61	-2.8	135.9	-69.5	77.7	0	0	0	110.7	Q550	Q550-H552 PolarHBondContact O-N 3.04Å
553	G	34.6	Very low	37.6	Very low	39 Å²	39	94.8 Å²	94.8	40%	0.402	49%	0.489	S	S	.	.	S	Bend	trans	-73.1	121.1	170.1	0	0	0	0	0	112.2	S551	S551-G553 WeakPolarHBondContact CB-O 3.47Å; S551-G553 PolarHBondContact O-N 3.25Å; S551-G553 PolarHBondContact OG-O 3.35Å
554	H	45.4	Very low	38.4	Very low	74 Å²	74	85.7 Å²	85.7	34%	0.343	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-48.8	136.8	156.1	-57.3	-86.7	0	0	0	109.8	E426 D492	E426-H554 IonicContact OE1-CE1 2.67Å; E426-H554 IonicContact OE2-CE1 2.76Å; E426-H554 PolarHBondContact OE2-CE1 3.04Å; E426-H554 IonicContact OE2-CG 2.79Å; E426-H554 IonicContact OE2-ND1 3.16Å; E426-H554 PolarHBondContact OE2-ND1 3.44Å; D492-H554 HydrophobicContact CB-CB 4.19Å
555	I	50.8	Low	39.5	Very low	19 Å²	19	81.4 Å²	81.4	10%	0.097	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	123.2	166.9	-58.8	169.2	0	0	0	106	I380 I493 V495	I380-I555 HydrophobicContact CB-CD1 4.08Å; I380-I555 HydrophobicContact CD1-CD1 4.05Å; I380-I555 HydrophobicContact CG2-CD1 4.32Å; I493-I555 HydrophobicContact CD1-CB 4.27Å; I493-I555 HydrophobicContact CD1-CG2 4.18Å; I493-I555 HydrophobicContact CG1-CB 3.65Å; I493-I555 HydrophobicContact CG1-CG2 4.03Å; I493-I555 WeakPolarHBondContact CG1-O 3.37Å; I493-I555 PolarHBondContact N-O 3.44Å; I493-I555 PolarHBondContact O-N 3.14Å; V495-I555 HydrophobicContact CB-CD1 4.39Å; V495-I555 HydrophobicContact CG2-CD1 3.65Å
556	H	48.8	Very low	40.1	Very low	91 Å²	91	79.4 Å²	79.4	42%	0.421	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	131.9	-178.7	-58.3	-55.4	0	0	0	109.7	R436 C491 D492	R436-H556 PolarHBondContact NH2-CE1 2.89Å; R436-H556 VanDerWaalsContact NH2-CE1 3.25Å; R436-H556 PolarHBondContact NH2-ND1 3.19Å; C491-H556 WeakPolarHBondContact O-CA 3.44Å; D492-H556 IonicContact OD1-CE1 3.86Å; D492-H556 PolarHBondContact OD1-CE1 3.09Å; D492-H556 IonicContact OD1-CG 3.14Å; D492-H556 IonicContact OD1-ND1 2.6Å; D492-H556 PolarHBondContact OD1-ND1 3.48Å
557	V	55.2	Low	40.3	Very low	6 Å²	6	77.4 Å²	77.4	4%	0.036	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	120.3	-179.9	-160.2	0	0	0	0	108.6	S382 L384 V412 H490 C491 I493	S382-V557 WeakPolarHBondContact OG-CG2 3.35Å; L384-V557 HydrophobicContact CB-CG1 3.77Å; V412-V557 HydrophobicContact CG1-CG1 4.45Å; V412-V557 HydrophobicContact CG1-CG2 4.21Å; H490-V557 CarbonylContact C-O 3.56Å; C491-V557 PolarHBondContact N-O 2.07Å; C491-V557 PolarHBondContact O-N 3.25Å; I493-V557 HydrophobicContact CD1-CG2 3.79Å; I493-V557 HydrophobicContact CG1-CG2 3.93Å; I493-V557 HydrophobicContact CG2-CG2 4.07Å
558	D	50.8	Low	41.1	Very low	77 Å²	77	73.1 Å²	73.1	41%	0.412	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	141.4	179.3	-58.2	-45.8	0	0	0	109.9	L489 H490	L489-D558 WeakPolarHBondContact O-CA 2.99Å; H490-D558 IonicContact CE1-OD1 3.15Å; H490-D558 IonicContact CG-OD1 3.27Å; H490-D558 IonicContact ND1-OD1 2.62Å; H490-D558 PolarHBondContact ND1-OD1 3.37Å
559	S	54.5	Low	41.9	Very low	14 Å²	14	66.4 Å²	66.4	10%	0.098	36%	0.361	C	S	.	.			trans	-80.7	158.6	169.7	78.3	0	0	0	0	111	L489	L489-S559 PolarHBondContact N-OG 3.43Å; L489-S559 PolarHBondContact O-N 2.9Å
560	G	47.7	Very low	43	Very low	34 Å²	34	60.3 Å²	60.3	35%	0.351	33%	0.33	S	S	.	.			trans	-65.3	177.1	159.6	0	0	0	0	0	112.3	I562	G560-I562 PolarHBondContact O-N 3.48Å
561	Q	40	Very low	44.1	Very low	85 Å²	85	53.3 Å²	53.3	40%	0.397	30%	0.301	S	S	.	.			trans	-62.4	128.6	178.9	-176.1	179.2	-15.4	0	0	111.6	N486 F488	N486-Q561 HydrophobicContact CB-CG 4.33Å; N486-Q561 VanDerWaalsContact CG-NE2 3.25Å; N486-Q561 PolarHBondContact ND2-NE2 2.83Å; N486-Q561 PolarHBondContact OD1-NE2 3.33Å; F488-Q561 HydrophobicContact CE1-CB 3.68Å; F488-Q561 HydrophobicContact CE1-CG 4.09Å; F488-Q561 HydrophobicContact CZ-CB 3.93Å; F488-Q561 HydrophobicContact CZ-CG 3.8Å
562	I	47.4	Very low	45.3	Very low	4 Å²	4	52.7 Å²	52.7	2%	0.021	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	122.9	168.4	-46.9	166.1	0	0	0	106.2	L386 I400 N486 L487 L489 G560	L386-I562 HydrophobicContact CD1-CD1 3.46Å; L386-I562 VanDerWaalsContact CD1-CD1 3.46Å; L386-I562 HydrophobicContact CD1-CG1 3.57Å; L386-I562 HydrophobicContact CD1-CG2 4.32Å; I400-I562 HydrophobicContact CB-CG2 4.44Å; I400-I562 HydrophobicContact CG2-CG2 4.18Å; N486-I562 CarbonylContact C-O 3.58Å; N486-I562 WeakPolarHBondContact CA-O 3.27Å; L487-I562 HydrophobicContact CB-CB 4.24Å; L487-I562 PolarHBondContact N-O 3.1Å; L487-I562 VanDerWaalsContact O-CB 3.25Å; L487-I562 WeakPolarHBondContact O-CB 3.46Å; L487-I562 WeakPolarHBondContact O-CG1 3.37Å; L487-I562 PolarHBondContact O-N 3.28Å; L489-I562 HydrophobicContact CD1-CD1 3.75Å; L489-I562 HydrophobicContact CG-CD1 3.76Å; G560-I562 PolarHBondContact O-N 3.48Å
563	M	38.5	Very low	46.3	Very low	53 Å²	53	44.5 Å²	44.5	26%	0.261	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	122.4	168.8	-70	-155	-73.1	0	0	108	P399 I400 T401 I402	P399-M563 HydrophobicContact CB-CE 3.52Å; P399-M563 HydrophobicContact CG-CE 4.07Å; I400-M563 CarbonylContact O-C 3.56Å; I400-M563 WeakPolarHBondContact O-CA 3.46Å; I400-M563 PolarHBondContact O-N 3.04Å; T401-M563 WeakPolarHBondContact CA-O 3.28Å; I402-M563 PolarHBondContact N-O 3.42Å
564	T	43.3	Very low	47.3	Very low	1 Å²	1	44.9 Å²	44.9	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	128.8	166.1	42.4	0	0	0	0	106.7	I402 A471 Y473 S485	I402-T564 WeakPolarHBondContact O-CA 3.44Å; A471-T564 HydrophobicContact CB-CG2 4.17Å; Y473-T564 WeakPolarHBondContact CD1-OG1 3.22Å; Y473-T564 WeakPolarHBondContact CE1-O 3.46Å; Y473-T564 WeakPolarHBondContact CE1-OG1 3.49Å; S485-T564 PolarHBondContact N-O 3.45Å; S485-T564 PolarHBondContact O-N 3.3Å; S485-T564 PolarHBondContact O-OG1 3.39Å; S485-T564 VanDerWaalsContact O-OG1 3.07Å
565	V	45.1	Very low	47.5	Very low	81 Å²	81	42.3 Å²	42.3	49%	0.491	24%	0.236	S	C	.	.			trans	-125.2	0	-176.7	-177.5	0	0	0	0	109.3	T401 Y473	T401-V565 HydrophobicContact CG2-CB 3.44Å; T401-V565 VanDerWaalsContact CG2-CB 3.44Å; T401-V565 HydrophobicContact CG2-CG1 4.45Å; T401-V565 HydrophobicContact CG2-CG2 3.34Å; Y473-V565 PolarHBondContact OH-N 2.95Å; Y473-V565 PolarHBondContact OH-OXT 3.37Å

Retrieved 565 of 565 residues in 806.6 ms (Link to these results)

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