A0A3P9PEB1_POERE Loading...

Neuronal growth regulator 1

AlphaFold DB , UniProt , Accession A0A3P9PEB1, Species POERE (Poecilia reticulata, Guppy), Gene n/a, Length 345 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.2	Very low	36.2	Very low	227 Å²	227	139.1 Å²	139.1	100%	1.118	78%	0.783	S	S	*	*				0	100.6	0	-100	168.8	137	0	0	106.2
2	D	38	Very low	36.8	Very low	101 Å²	101	139.4 Å²	139.4	54%	0.54	79%	0.79	S	S	.	*			cis	-155.2	112.6	13.9	-77.4	-50.1	0	0	0	108.3	I5	D2-I5 HydrophobicContact CB-CD1 4.41Å
3	I	30.7	Very low	36.6	Very low	157 Å²	157	136.5 Å²	136.5	81%	0.805	78%	0.784	S	S	*	*	S	Bend	trans	-113.9	11.1	157.3	-56.8	175.4	0	0	0	108.6	I5	I3-I5 VanDerWaalsContact C-N 3.33Å
4	M	32.7	Very low	37.4	Very low	168 Å²	168	132.5 Å²	132.5	83%	0.828	79%	0.787	S	S	*	*	S	Bend	trans	-87	5.3	178.1	-80.6	-75.7	-75.8	0	0	113.5
5	I	42.6	Very low	37.3	Very low	134 Å²	134	134.9 Å²	134.9	69%	0.687	79%	0.787	S	S	*	*	S	Bend	trans	-112.5	-9.3	-177.1	-60.9	179.8	0	0	0	113.2	D2 I3	D2-I5 HydrophobicContact CB-CD1 4.41Å; I3-I5 VanDerWaalsContact C-N 3.33Å
6	A	37.4	Very low	37.6	Very low	90 Å²	90	140.7 Å²	140.7	74%	0.744	79%	0.792	S	S	*	*	S	Bend	trans	-104.1	5.4	-178.3	0	0	0	0	0	115.5
7	V	36.3	Very low	37.7	Very low	116 Å²	116	142.4 Å²	142.4	70%	0.703	80%	0.798	S	S	*	*	S	Bend	trans	-112.7	13	-179.9	-167	0	0	0	0	112.3
8	Q	35.6	Very low	37.7	Very low	163 Å²	163	142.9 Å²	142.9	76%	0.762	81%	0.805	S	S	*	*	S	Bend	trans	-88.8	-15	177	-157.8	85	4.3	0	0	113.6
9	D	35.8	Very low	37.7	Very low	164 Å²	164	140.6 Å²	140.6	88%	0.877	81%	0.806	S	S	*	*	S	Bend	trans	-110.6	6.4	-171.9	-86.2	-13.8	0	0	0	116.5
10	A	34.4	Very low	38	Very low	89 Å²	89	141.7 Å²	141.7	74%	0.736	81%	0.807	S	S	*	*	S	Bend	trans	-106	11.2	178.3	0	0	0	0	0	114.7
11	C	32.8	Very low	38	Very low	121 Å²	121	142.4 Å²	142.4	82%	0.818	81%	0.807	S	S	*	*	S	Bend	trans	-98.3	11.3	-177.7	-131.4	0	0	0	0	114.7
12	V	42.8	Very low	37.7	Very low	143 Å²	143	141.9 Å²	141.9	87%	0.867	80%	0.799	S	S	*	*	S	Bend	trans	-131	55.2	175.9	-163.1	0	0	0	0	111.6
13	S	35	Very low	37.9	Very low	101 Å²	101	142.1 Å²	142.1	71%	0.706	81%	0.809	S	S	*	*	S	Bend	trans	-168.2	98.8	148.2	60.3	0	0	0	0	107.6	Q15	S13-Q15 PolarHBondContact O-N 3.4Å
14	G	46.6	Very low	38.3	Very low	81 Å²	81	142.6 Å²	142.6	84%	0.835	81%	0.812	S	S	*	*			trans	-57.9	114.5	177.9	0	0	0	0	0	110.5
15	Q	36.9	Very low	38.7	Very low	168 Å²	168	140.7 Å²	140.7	79%	0.785	81%	0.813	S	S	*	*			trans	-175.6	128.7	158.2	-102.6	174.7	23.1	0	0	110.4	S13	S13-Q15 PolarHBondContact O-N 3.4Å
16	W	41.3	Very low	38.5	Very low	228 Å²	228	140.3 Å²	140.3	86%	0.864	82%	0.821	S	S	*	*			trans	42	108	155.5	-53.3	95.5	0	0	0	120.8
17	L	40.2	Very low	38.7	Very low	170 Å²	170	146 Å²	146	89%	0.89	83%	0.83	S	S	*	*			trans	149.5	93.8	137	-87.3	151.9	0	0	0	110.8
18	T	37.6	Very low	38.5	Very low	151 Å²	151	148.1 Å²	148.1	93%	0.926	84%	0.836	S	S	*	*			trans	-159.1	85.9	156.6	36.8	0	0	0	0	111.2
19	A	37.7	Very low	38.9	Very low	100 Å²	100	146.4 Å²	146.4	83%	0.826	84%	0.839	S	S	*	*	S	Bend	trans	-145.6	42.8	163.9	0	0	0	0	0	111.2
20	I	42.6	Very low	39	Very low	161 Å²	161	143.5 Å²	143.5	83%	0.826	83%	0.832	S	S	*	*	S	Bend	trans	-135.7	-9.7	172.4	-63.6	-175	0	0	0	113.4
21	I	39.1	Very low	38.9	Very low	157 Å²	157	145.5 Å²	145.5	81%	0.805	84%	0.839	S	S	*	*			trans	-125.1	61.8	-175.9	-45.5	-180	0	0	0	112.2
22	F	36.1	Very low	38.9	Very low	217 Å²	217	147.8 Å²	147.8	95%	0.952	84%	0.842	S	S	*	*			trans	-131.7	38.2	164.6	-107.3	-81	0	0	0	111.5
23	S	40.8	Very low	38.5	Very low	106 Å²	106	146.8 Å²	146.8	74%	0.741	84%	0.839	S	S	*	*	S	Bend	trans	-109.1	10.4	178.5	-171.5	0	0	0	0	114.6
24	L	40.6	Very low	38.7	Very low	167 Å²	167	147.2 Å²	147.2	87%	0.874	85%	0.848	S	S	*	*	S	Bend	trans	-140.4	74.9	175.5	-87.7	114.4	0	0	0	110.9
25	C	40	Very low	38.6	Very low	127 Å²	127	146.9 Å²	146.9	86%	0.858	85%	0.845	S	S	*	*			trans	-174.2	59.3	155.6	-107.1	0	0	0	0	111.5
26	C	38.1	Very low	38.4	Very low	126 Å²	126	147.2 Å²	147.2	85%	0.851	85%	0.846	S	S	*	*			trans	-138.1	59.7	165.9	-81.1	0	0	0	0	110.3
27	F	41.6	Very low	38.1	Very low	210 Å²	210	143.4 Å²	143.4	92%	0.921	85%	0.848	S	S	*	*			trans	-132.6	73.1	165.7	-81	-77	0	0	0	109.6
28	L	32.9	Very low	38	Very low	160 Å²	160	139.8 Å²	139.8	84%	0.838	83%	0.833	S	S	*	*			trans	-139	124	155.5	-84.2	173.6	0	0	0	109	S30	L28-S30 PolarHBondContact O-N 3.28Å
29	P	43.8	Very low	38.2	Very low	127 Å²	127	138.6 Å²	138.6	83%	0.825	82%	0.821	S	S	*	*			trans	-92.1	90.2	-175.5	34.4	-29.8	0	0	0	110.5
30	S	38.5	Very low	38.6	Very low	103 Å²	103	143.8 Å²	143.8	72%	0.72	82%	0.821	S	S	*	*			trans	-168.8	83.8	166.2	45.5	0	0	0	0	111	L28	L28-S30 PolarHBondContact O-N 3.28Å
31	C	31.4	Very low	39.4	Very low	131 Å²	131	139.8 Å²	139.8	89%	0.885	81%	0.807	S	S	*	*			trans	175.1	101.2	145.7	-99.1	0	0	0	0	109.5
32	L	32.8	Very low	40.8	Very low	169 Å²	169	137.2 Å²	137.2	89%	0.885	80%	0.803	S	S	*	*			trans	-133.7	124.3	164.1	-84.5	167.5	0	0	0	108.1
33	P	35.3	Very low	43.1	Very low	123 Å²	123	130 Å²	130	80%	0.799	78%	0.777	S	S	*	*			trans	-78.5	139.4	147.5	17.9	-2.9	0	0	0	109.1
34	A	38.9	Very low	45.5	Very low	109 Å²	109	128.9 Å²	128.9	90%	0.901	76%	0.76	S	S	*	*	S	Bend	trans	-66.9	143.6	179.7	0	0	0	0	0	112.1
35	G	44.4	Very low	48.1	Very low	74 Å²	74	125.7 Å²	125.7	76%	0.763	74%	0.743	S	S	*	*	S	Bend	trans	121.6	46.7	156.8	0	0	0	0	0	118.1
36	Q	32.8	Very low	50.8	Low	176 Å²	176	120.7 Å²	120.7	82%	0.822	71%	0.709	S	S	*	*			trans	178.6	96.6	139.9	-112.7	178.2	-3.8	0	0	108.9	V38	Q36-V38 VanDerWaalsContact C-N 3.29Å; Q36-V38 HydrophobicContact CB-CG2 4.25Å; Q36-V38 HydrophobicContact CG-CG2 4.37Å; Q36-V38 PolarHBondContact O-N 2.67Å; Q36-V38 VanDerWaalsContact O-N 3.11Å
37	T	33.8	Very low	53.5	Low	148 Å²	148	118.6 Å²	118.6	91%	0.908	69%	0.692	S	S	*	*			trans	-77.7	88.2	160.1	48.9	0	0	0	0	107.1	D39	T37-D39 PolarHBondContact O-N 3.03Å
38	V	38.5	Very low	56.1	Low	94 Å²	94	109 Å²	109	57%	0.57	65%	0.651	S	S	*	*			trans	-71.6	114.5	170.8	178.6	0	0	0	0	108.2	Q36 R127	Q36-V38 VanDerWaalsContact C-N 3.29Å; Q36-V38 HydrophobicContact CB-CG2 4.25Å; Q36-V38 HydrophobicContact CG-CG2 4.37Å; Q36-V38 PolarHBondContact O-N 2.67Å; Q36-V38 VanDerWaalsContact O-N 3.11Å; V38-R127 PolarHBondContact O-NH1 2.91Å; V38-R127 VanDerWaalsContact O-NH1 3.08Å
39	D	42.3	Very low	59.1	Low	125 Å²	125	107.1 Å²	107.1	67%	0.668	63%	0.633	S	S	*	*			trans	-32.3	148.9	-175.9	-155.9	2.1	0	0	0	116.2	T37	T37-D39 PolarHBondContact O-N 3.03Å
40	Y	47	Very low	61.7	Low	210 Å²	210	105 Å²	105	82%	0.824	61%	0.612	S	S	*	*			trans	-54.4	143.5	174.8	-77.8	-101.6	0	0	0	109.6	S42	Y40-S42 PolarHBondContact O-N 3.45Å
41	S	58	Low	64.4	Low	77 Å²	77	102.3 Å²	102.3	54%	0.538	60%	0.601	S	S	.	*			trans	-47.1	93.7	178.2	53.3	0	0	0	0	112.1	V43	S41-V43 PolarHBondContact O-N 2.62Å
42	S	69.1	Low	67.5	Low	102 Å²	102	100 Å²	100	71%	0.713	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-66.6	117.5	178.1	59.3	0	0	0	0	108.3	Y40 E44	Y40-S42 PolarHBondContact O-N 3.45Å; S42-E44 PolarHBondContact O-N 3.31Å
43	V	84.8	Confident	70.5	Confident	67 Å²	67	95.3 Å²	95.3	41%	0.406	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-66.8	124	175.5	-179.1	0	0	0	0	108.6	S41 L130 N132	S41-V43 PolarHBondContact O-N 2.62Å; V43-L130 WeakPolarHBondContact CA-O 3.33Å; V43-L130 HydrophobicContact CG2-CB 4.04Å; V43-L130 HydrophobicContact CG2-CD1 4.19Å; V43-N132 HydrophobicContact CG1-CB 3.8Å
44	E	91.8	Very high	73.5	Confident	82 Å²	82	89.6 Å²	89.6	38%	0.383	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	125	177.5	-173.8	-179	166.2	0	0	110.2	S42 K129 L130 L131 N132	S42-E44 PolarHBondContact O-N 3.31Å; E44-K129 WeakPolarHBondContact OE2-CE 3.36Å; E44-K129 IonicContact OE2-NZ 2.74Å; E44-K129 PolarHBondContact OE2-NZ 2.84Å; E44-L130 PolarHBondContact N-O 2.78Å; E44-L131 HydrophobicContact CB-CG 4.4Å; E44-L131 CarbonylContact O-C 3.54Å; E44-L131 VanDerWaalsContact O-CA 3.23Å; E44-L131 WeakPolarHBondContact O-CA 3.29Å; E44-N132 PolarHBondContact O-N 2.91Å
45	N	94.5	Very high	76.2	Confident	99 Å²	99	87.1 Å²	87.1	53%	0.529	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	124.2	176	-69.5	-48.2	0	0	0	110.6	N132 I134	N45-N132 WeakPolarHBondContact CA-O 3.47Å; N45-N132 WeakPolarHBondContact OD1-CB 3.14Å; N45-N132 PolarHBondContact OD1-ND2 3Å; N45-I134 HydrophobicContact CB-CD1 4.03Å
46	V	95.8	Very high	78.6	Confident	22 Å²	22	83.6 Å²	83.6	13%	0.133	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	117.4	172.3	-178.9	0	0	0	0	107.6	L56 L131 N132 L133 I134	V46-L56 HydrophobicContact CG2-CG 4.48Å; V46-L131 HydrophobicContact CG2-CD2 3.86Å; V46-N132 PolarHBondContact N-O 3.4Å; V46-L133 HydrophobicContact CB-CD1 4.41Å; V46-L133 HydrophobicContact CG1-CD1 4.21Å; V46-L133 CarbonylContact O-C 3.52Å; V46-L133 WeakPolarHBondContact O-CA 3.24Å; V46-I134 PolarHBondContact O-N 2.81Å
47	V	95.6	Very high	81.4	Confident	82 Å²	82	81.5 Å²	81.5	50%	0.497	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.9	179.3	179.1	0	0	0	0	109.3	I134 K136	V47-I134 WeakPolarHBondContact CA-O 3.38Å; V47-I134 HydrophobicContact CG2-CB 4.32Å; V47-K136 HydrophobicContact CG1-CD 3.55Å; V47-K136 VanDerWaalsContact CG1-CE 3.43Å; V47-K136 HydrophobicContact CG1-CG 3.84Å
48	S	96.6	Very high	84	Confident	10 Å²	10	74.5 Å²	74.5	7%	0.07	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	149	174.1	-165.7	0	0	0	0	110.6	I134 V135 K136	S48-I134 PolarHBondContact N-O 2.9Å; S48-V135 WeakPolarHBondContact O-CA 3.38Å; S48-K136 PolarHBondContact O-N 2.89Å
49	R	96.3	Very high	86.3	Confident	120 Å²	120	75.3 Å²	75.3	45%	0.453	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	147.4	173.8	-59.4	178.1	176.3	163.8	1.4	109.5	G51 D52 K136 I209	R49-G51 PolarHBondContact O-N 2.54Å; R49-D52 WeakPolarHBondContact CB-OD2 3.22Å; R49-D52 WeakPolarHBondContact O-CB 3.38Å; R49-D52 PolarHBondContact O-N 2.75Å; R49-K136 CarbonylContact C-O 3.56Å; R49-K136 VanDerWaalsContact CA-O 3.27Å; R49-K136 WeakPolarHBondContact CA-O 3.43Å; R49-I209 HydrophobicContact CG-CG2 3.98Å; R49-I209 PolarHBondContact NE-O 2.77Å; R49-I209 VanDerWaalsContact NE-O 3.13Å; R49-I209 PolarHBondContact NH2-O 2.81Å
50	Q	96.7	Very high	88.1	Confident	81 Å²	81	70.4 Å²	70.4	38%	0.379	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	131.4	173.7	-172	-176.2	27	0	0	110.4	D52 V108 D109 V135 K136 V137	Q50-D52 VanDerWaalsContact C-N 3.34Å; Q50-V108 CarbonylContact C-O 3.48Å; Q50-V108 WeakPolarHBondContact CA-O 3.38Å; Q50-V108 WeakPolarHBondContact CG-O 3.41Å; Q50-D109 PolarHBondContact NE2-OD2 2.9Å; Q50-V135 HydrophobicContact CB-CG1 4.29Å; Q50-K136 PolarHBondContact N-O 3.34Å; Q50-V137 HydrophobicContact CB-CG2 4.09Å
51	G	95.4	Very high	89.4	Confident	47 Å²	47	64.9 Å²	64.9	49%	0.485	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	-18.2	-176.4	0	0	0	0	0	114.9	R49 V108	R49-G51 PolarHBondContact O-N 2.54Å; G51-V108 PolarHBondContact N-O 2.62Å
52	D	96.7	Very high	90.1	Very high	82 Å²	82	67.8 Å²	67.8	44%	0.439	36%	0.359	S	S	.	.	S	Bend	trans	-75.9	178.6	176.4	-71.9	-9.7	0	0	0	111.3	R49 Q50 K107 V108	R49-D52 WeakPolarHBondContact CB-OD2 3.22Å; R49-D52 WeakPolarHBondContact O-CB 3.38Å; R49-D52 PolarHBondContact O-N 2.75Å; Q50-D52 VanDerWaalsContact C-N 3.34Å; D52-K107 WeakPolarHBondContact O-CA 3.46Å; D52-K107 PolarHBondContact O-N 3.18Å; D52-K107 VanDerWaalsContact O-N 3.11Å; D52-V108 WeakPolarHBondContact O-CG2 3.28Å; D52-V108 PolarHBondContact O-N 2.57Å
53	T	97	Very high	89.8	Confident	72 Å²	72	67.1 Å²	67.1	44%	0.442	37%	0.368	S	S	.	.			trans	-100.7	121.5	171.3	-60.8	0	0	0	0	109.6	Q104 I105 Q106	T53-Q104 HydrophobicContact CG2-CG 3.43Å; T53-Q104 VanDerWaalsContact CG2-CG 3.43Å; T53-I105 CarbonylContact C-O 3.43Å; T53-I105 VanDerWaalsContact CA-O 3.29Å; T53-I105 WeakPolarHBondContact CA-O 3Å; T53-Q106 HydrophobicContact CG2-CG 4.19Å
54	A	97.1	Very high	88.9	Confident	2 Å²	2	65.7 Å²	65.7	2%	0.017	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	139.2	170.8	0	0	0	0	0	110.3	L56 Q104 I105 V108 L133	A54-L56 HydrophobicContact CB-CD1 4.01Å; A54-Q104 WeakPolarHBondContact O-CA 3.45Å; A54-I105 HydrophobicContact CB-CB 4.46Å; A54-I105 PolarHBondContact N-O 3.24Å; A54-I105 PolarHBondContact O-N 3.32Å; A54-V108 HydrophobicContact CB-CG2 3.56Å; A54-L133 HydrophobicContact CB-CD1 3.77Å; A54-L133 HydrophobicContact CB-CD2 4.3Å
55	L	95.9	Very high	87.5	Confident	58 Å²	58	66.5 Å²	66.5	30%	0.304	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	107.8	173	-176.5	68.3	0	0	0	109	R57 V92 Q104	L55-R57 HydrophobicContact CD2-CG 4.31Å; L55-R57 HydrophobicContact CG-CG 4.26Å; L55-V92 HydrophobicContact CD1-CB 4.21Å; L55-V92 HydrophobicContact CD1-CG2 4.14Å; L55-Q104 HydrophobicContact CD1-CB 4.21Å
56	L	95.2	Very high	86.4	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	106.9	177.5	-73.2	78	0	0	0	107.9	V46 A54 W69 S102 L103 I105 Y116 L131	V46-L56 HydrophobicContact CG2-CG 4.48Å; A54-L56 HydrophobicContact CB-CD1 4.01Å; L56-W69 HydrophobicContact CB-CH2 3.57Å; L56-W69 HydrophobicContact CB-CZ2 4.25Å; L56-W69 HydrophobicContact CB-CZ3 3.98Å; L56-W69 HydrophobicContact CD2-CH2 4.45Å; L56-W69 HydrophobicContact CD2-CZ3 4.04Å; L56-W69 WeakPolarHBondContact O-CH2 3.09Å; L56-W69 WeakPolarHBondContact O-CZ2 3.45Å; L56-S102 CarbonylContact O-C 3.55Å; L56-S102 VanDerWaalsContact O-CA 3.3Å; L56-S102 WeakPolarHBondContact O-CA 3.24Å; L56-S102 WeakPolarHBondContact O-CB 3.43Å; L56-L103 HydrophobicContact CB-CB 4.26Å; L56-L103 PolarHBondContact N-O 3.18Å; L56-L103 PolarHBondContact O-N 3.02Å; L56-I105 HydrophobicContact CD1-CD1 4.16Å; L56-I105 HydrophobicContact CD1-CG1 4.48Å; L56-Y116 HydrophobicContact CD2-CD1 3.97Å; L56-Y116 HydrophobicContact CD2-CD2 3.74Å; L56-Y116 HydrophobicContact CD2-CG 3.42Å; L56-Y116 VanDerWaalsContact CD2-CG 3.42Å; L56-L131 HydrophobicContact CB-CD2 4.06Å; L56-L131 HydrophobicContact CD2-CB 4.23Å; L56-L131 HydrophobicContact CG-CD2 4.43Å
57	R	91.6	Very high	85.9	Confident	132 Å²	132	67.1 Å²	67.1	50%	0.498	37%	0.37	S	S	.	.			trans	-81.3	128.3	-171.3	-68.8	-177.9	177.6	135.3	-0.7	112.4	L55 Y59 S102 K129	L55-R57 HydrophobicContact CD2-CG 4.31Å; L55-R57 HydrophobicContact CG-CG 4.26Å; R57-Y59 HydrophobicContact CB-CE2 4.15Å; R57-S102 WeakPolarHBondContact CA-OG 3.46Å; R57-K129 PolarHBondContact O-NZ 3.48Å
58	C	88.6	Confident	85.7	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.007	36%	0.355	C	S	.	.			trans	-143.2	141.5	170.2	-169.2	0	0	0	0	109.8	W69 Y101 S102 C118	C58-W69 HydrophobicContact CB-CH2 4.03Å; C58-W69 HydrophobicContact CB-CZ2 3.35Å; C58-Y101 WeakPolarHBondContact CB-O 3.33Å; C58-Y101 CarbonylContact O-C 3.59Å; C58-Y101 VanDerWaalsContact O-C 3.25Å; C58-Y101 WeakPolarHBondContact O-CA 3.18Å; C58-Y101 PolarHBondContact O-N 2.95Å; C58-S102 PolarHBondContact N-OG 2.85Å; C58-C118 HydrophobicContact CB-CB 3.61Å; C58-C118 WeakPolarHBondContact CB-SG 3.06Å; C58-C118 WeakPolarHBondContact SG-CB 3.32Å; C58-C118 CovalentContact SG-SG 2.03Å; C58-C118 PolarHBondContact SG-SG 3.4Å
59	Y	85.9	Confident	85.6	Confident	110 Å²	110	63.8 Å²	63.8	43%	0.431	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-125.4	129.5	-176.5	-58.5	-84.2	0	0	0	109.2	R57 H99 E100 I120	R57-Y59 HydrophobicContact CB-CE2 4.15Å; Y59-H99 CarbonylContact C-O 3.25Å; Y59-H99 VanDerWaalsContact CA-O 3.22Å; Y59-H99 WeakPolarHBondContact CA-O 3.34Å; Y59-E100 HydrophobicContact CD1-CB 4.28Å; Y59-E100 HydrophobicContact CD1-CG 4.31Å; Y59-E100 HydrophobicContact CE1-CB 4.27Å; Y59-E100 HydrophobicContact CE1-CG 4.01Å; Y59-I120 WeakPolarHBondContact O-CD1 3.35Å
60	L	81.1	Confident	85.5	Confident	23 Å²	23	59.9 Å²	59.9	12%	0.12	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-70.5	152.9	174.4	-57.9	177.2	0	0	0	110.3	H99 Y101 I120	L60-H99 PolarHBondContact N-O 3.01Å; L60-Y101 HydrophobicContact CD2-CD1 4.39Å; L60-Y101 HydrophobicContact CD2-CG 4.2Å; L60-Y101 HydrophobicContact CG-CG 4.44Å; L60-I120 HydrophobicContact CD2-CG1 4.29Å; L60-I120 HydrophobicContact CD2-CG2 4.31Å
61	L	74.8	Confident	85.4	Confident	93 Å²	93	58.2 Å²	58.2	49%	0.487	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-84.5	154.1	174.2	-61	173.9	0	0	0	110	G63 I64	L61-G63 PolarHBondContact O-N 2.86Å; L61-I64 HydrophobicContact CB-CB 4.45Å; L61-I64 HydrophobicContact CB-CD1 3.65Å; L61-I64 HydrophobicContact CB-CG1 4.37Å; L61-I64 HydrophobicContact CD1-CD1 3.81Å; L61-I64 HydrophobicContact CG-CD1 4.23Å; L61-I64 WeakPolarHBondContact O-CB 3.32Å; L61-I64 PolarHBondContact O-N 2.98Å
62	D	71.1	Confident	85	Confident	139 Å²	139	63.7 Å²	63.7	74%	0.743	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	129.2	176.8	-68.8	-37.9	0	0	0	111.2	I64 H99	D62-I64 VanDerWaalsContact C-N 3.27Å; D62-I64 PolarHBondContact O-N 2.84Å; D62-H99 IonicContact OD1-CD2 3.37Å; D62-H99 IonicContact OD1-CE1 3.79Å; D62-H99 PolarHBondContact OD1-CE1 2.85Å; D62-H99 VanDerWaalsContact OD1-CE1 3.27Å; D62-H99 IonicContact OD1-NE2 3.91Å; D62-H99 PolarHBondContact OD1-NE2 2.74Å; D62-H99 VanDerWaalsContact OD1-NE2 3.14Å
63	G	64	Low	84.6	Confident	87 Å²	87	65.1 Å²	65.1	90%	0.897	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	-2.8	-178.9	0	0	0	0	0	115.4	L61	L61-G63 PolarHBondContact O-N 2.86Å
64	I	64.9	Low	84.4	Confident	37 Å²	37	65.7 Å²	65.7	19%	0.19	36%	0.363	C	S	.	.			trans	-102.3	118.5	174.9	-65.8	167.3	0	0	0	109.5	L61 D62 I120 Q121	L61-I64 HydrophobicContact CB-CB 4.45Å; L61-I64 HydrophobicContact CB-CD1 3.65Å; L61-I64 HydrophobicContact CB-CG1 4.37Å; L61-I64 HydrophobicContact CD1-CD1 3.81Å; L61-I64 HydrophobicContact CG-CD1 4.23Å; L61-I64 WeakPolarHBondContact O-CB 3.32Å; L61-I64 PolarHBondContact O-N 2.98Å; D62-I64 VanDerWaalsContact C-N 3.27Å; D62-I64 PolarHBondContact O-N 2.84Å; I64-I120 HydrophobicContact CD1-CG2 4.44Å; I64-I120 HydrophobicContact CG2-CG2 3.77Å; I64-Q121 WeakPolarHBondContact CD1-O 3.46Å; I64-Q121 WeakPolarHBondContact CG1-O 3.36Å; I64-Q121 WeakPolarHBondContact CG2-O 3.49Å
65	S	61.9	Low	84.3	Confident	99 Å²	99	69.3 Å²	69.3	69%	0.692	38%	0.381	S	S	*	.			trans	-104.6	3	-178.2	56.7	0	0	0	0	114.5
66	K	72.8	Confident	84.3	Confident	129 Å²	129	67 Å²	67	56%	0.561	37%	0.368	S	S	*	.			trans	-133.1	114.3	-172	-61.2	-173.9	-179.2	-175.3	0	111.9	Q121	K66-Q121 PolarHBondContact O-N 3.38Å
67	G	85.3	Confident	84.3	Confident	6 Å²	6	67.6 Å²	67.6	6%	0.062	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	167.6	169.1	0	0	0	0	0	111	G79 Y101 S119	G67-G79 PolarHBondContact O-N 3.03Å; G67-Y101 PolarHBondContact O-OH 2.84Å; G67-S119 CarbonylContact C-O 3.6Å; G67-S119 VanDerWaalsContact CA-O 3.31Å; G67-S119 WeakPolarHBondContact CA-O 3.37Å
68	A	90.4	Very high	84.2	Confident	21 Å²	21	62.9 Å²	62.9	17%	0.174	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	139.5	172.5	0	0	0	0	0	110.5	L70 F77 A78 C118 S119	A68-L70 HydrophobicContact CB-CD1 4.34Å; A68-F77 CarbonylContact C-O 3.59Å; A68-F77 WeakPolarHBondContact CA-O 3.34Å; A68-F77 WeakPolarHBondContact CB-O 3.45Å; A68-A78 HydrophobicContact CB-CB 4.46Å; A68-C118 WeakPolarHBondContact O-CA 3.3Å; A68-S119 PolarHBondContact N-O 2.91Å; A68-S119 PolarHBondContact O-N 3.07Å
69	W	94.4	Very high	84.1	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	132.4	170.9	-84.2	101	0	0	0	110.2	L56 C58 I76 F77 I91 Y101 L103 T117 C118 L131	L56-W69 HydrophobicContact CB-CH2 3.57Å; L56-W69 HydrophobicContact CB-CZ2 4.25Å; L56-W69 HydrophobicContact CB-CZ3 3.98Å; L56-W69 HydrophobicContact CD2-CH2 4.45Å; L56-W69 HydrophobicContact CD2-CZ3 4.04Å; L56-W69 WeakPolarHBondContact O-CH2 3.09Å; L56-W69 WeakPolarHBondContact O-CZ2 3.45Å; C58-W69 HydrophobicContact CB-CH2 4.03Å; C58-W69 HydrophobicContact CB-CZ2 3.35Å; W69-I76 HydrophobicContact CB-CB 4.28Å; W69-I76 HydrophobicContact CB-CD1 4.48Å; W69-I76 PolarHBondContact O-N 2.78Å; W69-F77 HydrophobicContact CB-CB 4.44Å; W69-F77 PolarHBondContact N-O 3.21Å; W69-F77 PolarHBondContact O-N 2.85Å; W69-I91 VanDerWaalsContact CD1-CD1 3.48Å; W69-I91 HydrophobicContact CG-CD1 4.44Å; W69-Y101 AromaticContact CD1-CD1 3.68Å; W69-Y101 AromaticContact CD1-CE1 3.34Å; W69-Y101 HydrophobicContact CG-CE1 4.4Å; W69-Y101 AromaticContact NE1-CD1 3.56Å; W69-Y101 AromaticContact NE1-CE1 3.76Å; W69-Y101 PolarHBondContact NE1-O 3.12Å; W69-L103 HydrophobicContact CD2-CB 3.61Å; W69-L103 HydrophobicContact CD2-CD2 4.17Å; W69-L103 HydrophobicContact CD2-CG 4.44Å; W69-L103 HydrophobicContact CE3-CB 4.06Å; W69-L103 HydrophobicContact CE3-CD2 4.02Å; W69-L103 HydrophobicContact CG-CB 3.93Å; W69-L103 HydrophobicContact CG-CD2 4.4Å; W69-L103 HydrophobicContact CH2-CB 4.31Å; W69-L103 HydrophobicContact CZ2-CB 3.88Å; W69-L103 HydrophobicContact CZ3-CB 4.39Å; W69-T117 CarbonylContact C-O 3.57Å; W69-T117 WeakPolarHBondContact CA-O 3.37Å; W69-C118 HydrophobicContact CD2-CB 4.12Å; W69-C118 HydrophobicContact CE3-CB 4.08Å; W69-C118 HydrophobicContact CH2-CB 3.76Å; W69-C118 HydrophobicContact CZ2-CB 3.8Å; W69-C118 HydrophobicContact CZ3-CB 3.9Å; W69-L131 HydrophobicContact CH2-CD1 3.63Å; W69-L131 HydrophobicContact CH2-CD2 4.44Å; W69-L131 HydrophobicContact CZ3-CD1 3.78Å
70	L	94.4	Very high	84.1	Confident	38 Å²	38	65.8 Å²	65.8	20%	0.199	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	139.9	176.1	-55.9	88.8	0	0	0	109.9	A68 S74 I75 Y116 T117	A68-L70 HydrophobicContact CB-CD1 4.34Å; L70-S74 CarbonylContact C-O 3.56Å; L70-S74 WeakPolarHBondContact CA-O 3.36Å; L70-I75 HydrophobicContact CD2-CG1 4.25Å; L70-I75 HydrophobicContact CG-CG1 4.43Å; L70-Y116 CarbonylContact O-C 3.57Å; L70-Y116 VanDerWaalsContact O-CA 3.29Å; L70-Y116 WeakPolarHBondContact O-CA 3.31Å; L70-T117 HydrophobicContact CD1-CG2 4.45Å; L70-T117 PolarHBondContact N-O 3.38Å; L70-T117 PolarHBondContact O-N 2.84Å
71	N	94.4	Very high	84.5	Confident	46 Å²	46	70.1 Å²	70.1	25%	0.246	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	111.7	162.1	179.9	-4.7	0	0	0	106.7	S73 S74 I76 Y116	N71-S73 PolarHBondContact O-N 2.88Å; N71-S74 PolarHBondContact N-O 2.81Å; N71-S74 PolarHBondContact O-N 2.81Å; N71-I76 HydrophobicContact CB-CD1 3.8Å; N71-I76 HydrophobicContact CB-CG1 4.05Å; N71-Y116 HydrophobicContact CB-CD1 4.14Å; N71-Y116 HydrophobicContact CB-CE1 3.83Å
72	R	88.3	Confident	85.5	Confident	162 Å²	162	70 Å²	70	61%	0.611	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	-104	-170.2	-57.7	165.9	-173	-98.9	-2.4	110.4	D113 Q115	R72-D113 PolarHBondContact NH2-O 3.09Å; R72-D113 VanDerWaalsContact NH2-O 3.14Å; R72-Q115 PolarHBondContact N-O 2.95Å
73	S	88.1	Confident	86.7	Confident	113 Å²	113	71.4 Å²	71.4	79%	0.79	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.3	-3.4	178.3	-52.7	0	0	0	0	113.9	N71	N71-S73 PolarHBondContact O-N 2.88Å
74	S	93.4	Very high	88.2	Confident	84 Å²	84	68.8 Å²	68.8	59%	0.587	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	129.2	-177.8	-62.3	0	0	0	0	111	L70 N71	L70-S74 CarbonylContact C-O 3.56Å; L70-S74 WeakPolarHBondContact CA-O 3.36Å; N71-S74 PolarHBondContact N-O 2.81Å; N71-S74 PolarHBondContact O-N 2.81Å
75	I	94.4	Very high	89.7	Confident	77 Å²	77	74.1 Å²	74.1	40%	0.395	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	129.2	177.7	-57.6	170	0	0	0	109.3	L70 A78 W83	L70-I75 HydrophobicContact CD2-CG1 4.25Å; L70-I75 HydrophobicContact CG-CG1 4.43Å; I75-A78 HydrophobicContact CG2-CB 4.35Å; I75-W83 HydrophobicContact CB-CB 4.32Å; I75-W83 HydrophobicContact CB-CG 4.39Å; I75-W83 HydrophobicContact CG2-CB 4.01Å; I75-W83 HydrophobicContact CG2-CD2 4.44Å; I75-W83 HydrophobicContact CG2-CG 3.84Å; I75-W83 WeakPolarHBondContact O-CB 3.39Å
76	I	96.3	Very high	91.3	Very high	9 Å²	9	71.2 Å²	71.2	5%	0.046	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-50.6	175.2	-46.5	175.4	0	0	0	109.6	W69 N71 W83 S84 V89 L103 Y116	W69-I76 HydrophobicContact CB-CB 4.28Å; W69-I76 HydrophobicContact CB-CD1 4.48Å; W69-I76 PolarHBondContact O-N 2.78Å; N71-I76 HydrophobicContact CB-CD1 3.8Å; N71-I76 HydrophobicContact CB-CG1 4.05Å; I76-W83 PolarHBondContact O-N 2.61Å; I76-S84 PolarHBondContact O-N 2.9Å; I76-S84 VanDerWaalsContact O-N 3.11Å; I76-V89 HydrophobicContact CG2-CB 4.17Å; I76-V89 HydrophobicContact CG2-CG2 3.67Å; I76-L103 HydrophobicContact CD1-CD2 3.6Å; I76-L103 HydrophobicContact CG2-CD1 4.14Å; I76-Y116 HydrophobicContact CD1-CD1 3.82Å; I76-Y116 HydrophobicContact CD1-CE1 3.82Å
77	F	93.7	Very high	92.5	Very high	13 Å²	13	70.6 Å²	70.6	6%	0.057	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	146.9	177.8	-75.4	-90.7	0	0	0	110.2	A68 W69 D81 K82 V89 I91 Y101 L103	A68-F77 CarbonylContact C-O 3.59Å; A68-F77 WeakPolarHBondContact CA-O 3.34Å; A68-F77 WeakPolarHBondContact CB-O 3.45Å; W69-F77 HydrophobicContact CB-CB 4.44Å; W69-F77 PolarHBondContact N-O 3.21Å; W69-F77 PolarHBondContact O-N 2.85Å; F77-D81 WeakPolarHBondContact CA-O 3.43Å; F77-K82 HydrophobicContact CD1-CB 3.91Å; F77-K82 HydrophobicContact CD1-CG 4.25Å; F77-K82 HydrophobicContact CE1-CB 3.46Å; F77-K82 VanDerWaalsContact CE1-CB 3.46Å; F77-K82 HydrophobicContact CE1-CD 3.99Å; F77-K82 HydrophobicContact CE1-CG 3.64Å; F77-K82 HydrophobicContact CE2-CG 4.28Å; F77-K82 HydrophobicContact CZ-CB 4.02Å; F77-K82 HydrophobicContact CZ-CD 3.68Å; F77-K82 HydrophobicContact CZ-CG 3.64Å; F77-V89 HydrophobicContact CE2-CB 4.28Å; F77-V89 HydrophobicContact CE2-CG2 3.93Å; F77-I91 HydrophobicContact CB-CD1 4.06Å; F77-I91 HydrophobicContact CB-CG1 4.17Å; F77-I91 HydrophobicContact CD1-CD1 4.37Å; F77-I91 HydrophobicContact CD1-CG1 3.65Å; F77-I91 HydrophobicContact CD2-CD1 3.79Å; F77-I91 HydrophobicContact CD2-CG1 3.86Å; F77-I91 HydrophobicContact CE1-CG1 3.9Å; F77-I91 HydrophobicContact CE2-CD1 4.31Å; F77-I91 HydrophobicContact CE2-CG1 4.12Å; F77-I91 HydrophobicContact CG-CD1 3.83Å; F77-I91 HydrophobicContact CG-CG1 3.63Å; F77-I91 HydrophobicContact CZ-CG1 4.14Å; F77-Y101 WeakPolarHBondContact CB-OH 3.46Å; F77-L103 HydrophobicContact CD2-CD1 3.91Å; F77-L103 HydrophobicContact CE2-CD1 3.95Å
78	A	90.6	Very high	93.1	Very high	34 Å²	34	72.8 Å²	72.8	28%	0.281	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	105.1	168.9	0	0	0	0	0	108.4	A68 I75 D80 D81	A68-A78 HydrophobicContact CB-CB 4.46Å; I75-A78 HydrophobicContact CG2-CB 4.35Å; A78-D80 PolarHBondContact O-N 3.22Å; A78-D81 PolarHBondContact N-O 2.91Å; A78-D81 WeakPolarHBondContact O-CB 3.43Å; A78-D81 PolarHBondContact O-N 3Å
79	G	86.4	Confident	93.4	Very high	14 Å²	14	72.3 Å²	72.3	14%	0.144	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	-129.1	-164.2	0	0	0	0	0	110.2	G67 D81 Y101	G67-G79 PolarHBondContact O-N 3.03Å; G79-D81 VanDerWaalsContact C-N 3.35Å; G79-Y101 PolarHBondContact N-OH 2.86Å; G79-Y101 WeakPolarHBondContact O-CE2 3.33Å; G79-Y101 PolarHBondContact O-OH 2.94Å
80	D	85.8	Confident	93.4	Very high	158 Å²	158	74 Å²	74	85%	0.845	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-9.7	177.6	-58.9	-39.6	0	0	0	112.9	A78 K82	A78-D80 PolarHBondContact O-N 3.22Å; D80-K82 PolarHBondContact O-N 3.4Å
81	D	90.3	Very high	93.3	Very high	114 Å²	114	74.3 Å²	74.3	61%	0.61	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	120.4	-177.6	-63	-39	0	0	0	110.8	F77 A78 G79	F77-D81 WeakPolarHBondContact CA-O 3.43Å; A78-D81 PolarHBondContact N-O 2.91Å; A78-D81 WeakPolarHBondContact O-CB 3.43Å; A78-D81 PolarHBondContact O-N 3Å; G79-D81 VanDerWaalsContact C-N 3.35Å
82	K	94.5	Very high	93	Very high	91 Å²	91	73.9 Å²	73.9	40%	0.396	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	117.4	174.9	-173.2	172.8	174.2	166.6	0	110.6	F77 D80 S84 D86 V89	F77-K82 HydrophobicContact CD1-CB 3.91Å; F77-K82 HydrophobicContact CD1-CG 4.25Å; F77-K82 HydrophobicContact CE1-CB 3.46Å; F77-K82 VanDerWaalsContact CE1-CB 3.46Å; F77-K82 HydrophobicContact CE1-CD 3.99Å; F77-K82 HydrophobicContact CE1-CG 3.64Å; F77-K82 HydrophobicContact CE2-CG 4.28Å; F77-K82 HydrophobicContact CZ-CB 4.02Å; F77-K82 HydrophobicContact CZ-CD 3.68Å; F77-K82 HydrophobicContact CZ-CG 3.64Å; D80-K82 PolarHBondContact O-N 3.4Å; K82-S84 WeakPolarHBondContact CE-O 3.3Å; K82-S84 WeakPolarHBondContact CG-O 3.38Å; K82-D86 VanDerWaalsContact CE-O 3.26Å; K82-D86 WeakPolarHBondContact CE-O 3.5Å; K82-D86 PolarHBondContact NZ-O 2.97Å; K82-V89 PolarHBondContact NZ-O 3.47Å
83	W	96.4	Very high	92.3	Very high	167 Å²	167	70.2 Å²	70.2	63%	0.633	40%	0.401	S	S	*	.			trans	-96	-29	177.1	-74.5	72.8	0	0	0	112.8	I75 I76	I75-W83 HydrophobicContact CB-CB 4.32Å; I75-W83 HydrophobicContact CB-CG 4.39Å; I75-W83 HydrophobicContact CG2-CB 4.01Å; I75-W83 HydrophobicContact CG2-CD2 4.44Å; I75-W83 HydrophobicContact CG2-CG 3.84Å; I75-W83 WeakPolarHBondContact O-CB 3.39Å; I76-W83 PolarHBondContact O-N 2.61Å
84	S	95.9	Very high	91.3	Very high	33 Å²	33	67.7 Å²	67.7	23%	0.231	38%	0.384	C	S	.	.			trans	-72.6	136	175.7	-179.8	0	0	0	0	111.6	I76 K82 D86	I76-S84 PolarHBondContact O-N 2.9Å; I76-S84 VanDerWaalsContact O-N 3.11Å; K82-S84 WeakPolarHBondContact CE-O 3.3Å; K82-S84 WeakPolarHBondContact CG-O 3.38Å; S84-D86 VanDerWaalsContact C-N 3.26Å; S84-D86 WeakPolarHBondContact OG-CB 3.29Å; S84-D86 PolarHBondContact OG-N 3.19Å; S84-D86 VanDerWaalsContact OG-N 3.14Å
85	V	95.9	Very high	89.6	Confident	148 Å²	148	71.4 Å²	71.4	90%	0.897	40%	0.402	S	S	*	.			trans	-79.3	-8.7	171.5	-62.5	0	0	0	0	113.1	P87	V85-P87 WeakPolarHBondContact O-CD 3.3Å
86	D	96.7	Very high	87.9	Confident	39 Å²	39	71.7 Å²	71.7	21%	0.209	43%	0.425	C	S	.	.			trans	-67.4	117.9	-178.8	-169.9	-23.3	0	0	0	110.1	K82 S84 R88 V89	K82-D86 VanDerWaalsContact CE-O 3.26Å; K82-D86 WeakPolarHBondContact CE-O 3.5Å; K82-D86 PolarHBondContact NZ-O 2.97Å; S84-D86 VanDerWaalsContact C-N 3.26Å; S84-D86 WeakPolarHBondContact OG-CB 3.29Å; S84-D86 PolarHBondContact OG-N 3.19Å; S84-D86 VanDerWaalsContact OG-N 3.14Å; D86-R88 PolarHBondContact O-N 2.97Å; D86-R88 WeakPolarHBondContact OD1-CB 3.19Å; D86-R88 VanDerWaalsContact OD1-CG 3.26Å; D86-R88 WeakPolarHBondContact OD1-CG 3.42Å; D86-R88 PolarHBondContact OD1-N 3.11Å; D86-R88 IonicContact OD1-NE 2.86Å; D86-R88 PolarHBondContact OD1-NE 2.85Å; D86-R88 IonicContact OD2-CZ 2.91Å; D86-R88 IonicContact OD2-NE 3.8Å; D86-R88 PolarHBondContact OD2-NE 3.03Å; D86-R88 VanDerWaalsContact OD2-NE 3.15Å; D86-R88 IonicContact OD2-NH2 3.73Å; D86-R88 PolarHBondContact OD2-NH2 3.16Å; D86-V89 HydrophobicContact CB-CG1 4.41Å; D86-V89 HydrophobicContact CB-CG2 4.35Å; D86-V89 WeakPolarHBondContact O-CG2 3.31Å
87	P	96.9	Very high	86.6	Confident	116 Å²	116	74 Å²	74	75%	0.753	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-17.6	179.9	28.9	-35.7	0	0	0	113.1	V85 V89	V85-P87 WeakPolarHBondContact O-CD 3.3Å; P87-V89 VanDerWaalsContact C-N 3.31Å; P87-V89 PolarHBondContact O-N 3.08Å
88	R	97.6	Very high	85.3	Confident	52 Å²	52	82.6 Å²	82.6	20%	0.196	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-17.6	-176.4	-59.5	178.6	-56.5	138.8	5.2	113.9	D86 Q106 K107 D112	D86-R88 PolarHBondContact O-N 2.97Å; D86-R88 WeakPolarHBondContact OD1-CB 3.19Å; D86-R88 VanDerWaalsContact OD1-CG 3.26Å; D86-R88 WeakPolarHBondContact OD1-CG 3.42Å; D86-R88 PolarHBondContact OD1-N 3.11Å; D86-R88 IonicContact OD1-NE 2.86Å; D86-R88 PolarHBondContact OD1-NE 2.85Å; D86-R88 IonicContact OD2-CZ 2.91Å; D86-R88 IonicContact OD2-NE 3.8Å; D86-R88 PolarHBondContact OD2-NE 3.03Å; D86-R88 VanDerWaalsContact OD2-NE 3.15Å; D86-R88 IonicContact OD2-NH2 3.73Å; D86-R88 PolarHBondContact OD2-NH2 3.16Å; R88-Q106 WeakPolarHBondContact CB-O 3.36Å; R88-Q106 WeakPolarHBondContact CD-O 3.36Å; R88-Q106 PolarHBondContact O-N 3.15Å; R88-K107 PolarHBondContact NH1-O 2.86Å; R88-D112 IonicContact CZ-OD1 2.69Å; R88-D112 IonicContact CZ-OD2 3.14Å; R88-D112 IonicContact NH1-OD1 3.88Å; R88-D112 IonicContact NH1-OD2 3.27Å; R88-D112 PolarHBondContact NH1-OD2 2.69Å; R88-D112 IonicContact NH2-OD1 3.19Å; R88-D112 PolarHBondContact NH2-OD1 3.23Å; R88-D112 IonicContact NH2-OD2 3.65Å; R88-D112 PolarHBondContact NH2-OD2 2.69Å
89	V	96.9	Very high	84.7	Confident	11 Å²	11	84 Å²	84	7%	0.067	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	133.7	-176.2	-54.5	0	0	0	0	112.3	I76 F77 K82 D86 P87 L103 Q104 I105	I76-V89 HydrophobicContact CG2-CB 4.17Å; I76-V89 HydrophobicContact CG2-CG2 3.67Å; F77-V89 HydrophobicContact CE2-CB 4.28Å; F77-V89 HydrophobicContact CE2-CG2 3.93Å; K82-V89 PolarHBondContact NZ-O 3.47Å; D86-V89 HydrophobicContact CB-CG1 4.41Å; D86-V89 HydrophobicContact CB-CG2 4.35Å; D86-V89 WeakPolarHBondContact O-CG2 3.31Å; P87-V89 VanDerWaalsContact C-N 3.31Å; P87-V89 PolarHBondContact O-N 3.08Å; V89-L103 HydrophobicContact CB-CD1 4.32Å; V89-Q104 VanDerWaalsContact CA-O 3.31Å; V89-Q104 WeakPolarHBondContact CA-O 3.41Å; V89-I105 HydrophobicContact CG1-CG1 4.15Å; V89-I105 HydrophobicContact CG1-CG2 4.27Å
90	S	95.2	Very high	84.7	Confident	35 Å²	35	84 Å²	84	25%	0.245	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	155.6	178.8	47.6	0	0	0	0	110.7	Q104	S90-Q104 PolarHBondContact N-O 3.43Å; S90-Q104 PolarHBondContact O-N 3.37Å; S90-Q104 PolarHBondContact OG-OE1 2.81Å
91	I	91.9	Very high	84.8	Confident	45 Å²	45	77.1 Å²	77.1	23%	0.231	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	136.6	165.9	-62.9	-62.5	0	0	0	108.4	W69 F77 Y101 S102 L103	W69-I91 VanDerWaalsContact CD1-CD1 3.48Å; W69-I91 HydrophobicContact CG-CD1 4.44Å; F77-I91 HydrophobicContact CB-CD1 4.06Å; F77-I91 HydrophobicContact CB-CG1 4.17Å; F77-I91 HydrophobicContact CD1-CD1 4.37Å; F77-I91 HydrophobicContact CD1-CG1 3.65Å; F77-I91 HydrophobicContact CD2-CD1 3.79Å; F77-I91 HydrophobicContact CD2-CG1 3.86Å; F77-I91 HydrophobicContact CE1-CG1 3.9Å; F77-I91 HydrophobicContact CE2-CD1 4.31Å; F77-I91 HydrophobicContact CE2-CG1 4.12Å; F77-I91 HydrophobicContact CG-CD1 3.83Å; F77-I91 HydrophobicContact CG-CG1 3.63Å; F77-I91 HydrophobicContact CZ-CG1 4.14Å; I91-Y101 HydrophobicContact CD1-CE1 4.42Å; I91-Y101 HydrophobicContact CD1-CE2 4.13Å; I91-Y101 HydrophobicContact CG1-CE2 4.13Å; I91-Y101 HydrophobicContact CG2-CD2 3.85Å; I91-Y101 HydrophobicContact CG2-CE2 4.02Å; I91-S102 WeakPolarHBondContact CA-O 3.39Å; I91-L103 HydrophobicContact CD1-CD1 4.3Å
92	V	87.4	Confident	84.9	Confident	36 Å²	36	71.7 Å²	71.7	22%	0.218	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	125.1	173.5	176	0	0	0	0	108.7	L55 S102 Q104	L55-V92 HydrophobicContact CD1-CB 4.21Å; L55-V92 HydrophobicContact CD1-CG2 4.14Å; V92-S102 PolarHBondContact N-O 2.04Å; V92-S102 PolarHBondContact O-N 2.87Å; V92-Q104 HydrophobicContact CG2-CB 3.51Å; V92-Q104 HydrophobicContact CG2-CG 4.2Å
93	S	75.1	Confident	84.9	Confident	85 Å²	85	67.3 Å²	67.3	59%	0.594	39%	0.386	S	S	*	.			trans	-116.9	110.8	168.8	59	0	0	0	0	108.6
94	S	66.2	Low	85	Confident	61 Å²	61	61.8 Å²	61.8	43%	0.427	37%	0.367	S	S	.	.			trans	-58.3	139.9	176	-72.4	0	0	0	0	111.9	G96 D97 E100	S94-G96 PolarHBondContact O-N 2.88Å; S94-D97 PolarHBondContact O-N 2.76Å; S94-E100 WeakPolarHBondContact CA-OE2 3.29Å; S94-E100 WeakPolarHBondContact CB-OE2 3.31Å; S94-E100 PolarHBondContact N-OE2 3.48Å; S94-E100 PolarHBondContact OG-OE2 3.19Å
95	V	58	Low	85.1	Confident	161 Å²	161	60.3 Å²	60.3	98%	0.976	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	103.4	176.2	-177.8	0	0	0	0	109
96	G	58.8	Low	85.1	Confident	84 Å²	84	57.4 Å²	57.4	87%	0.866	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	111	-11.9	179.9	0	0	0	0	0	115.4	S94	S94-G96 PolarHBondContact O-N 2.88Å
97	D	67.9	Low	85.2	Confident	56 Å²	56	62.9 Å²	62.9	30%	0.299	36%	0.355	S	S	.	.			trans	-109.3	100.1	174.2	-169.5	-3.5	0	0	0	110.6	S94 H99 E100	S94-D97 PolarHBondContact O-N 2.76Å; D97-H99 PolarHBondContact O-N 3.49Å; D97-H99 WeakPolarHBondContact OD1-CB 3.44Å; D97-H99 PolarHBondContact OD1-N 2.9Å; D97-H99 IonicContact OD1-ND1 3.08Å; D97-E100 HydrophobicContact CB-CB 4.49Å
98	K	66.7	Low	85.2	Confident	195 Å²	195	57.5 Å²	57.5	85%	0.848	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-8.1	177.6	-67.6	-175.6	178.6	-179.4	0	113.2
99	H	78.2	Confident	85.2	Confident	64 Å²	64	57.3 Å²	57.3	30%	0.296	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-6.1	-177.2	-57.9	100.7	0	0	0	112.4	Y59 L60 D62 D97 Y101	Y59-H99 CarbonylContact C-O 3.25Å; Y59-H99 VanDerWaalsContact CA-O 3.22Å; Y59-H99 WeakPolarHBondContact CA-O 3.34Å; L60-H99 PolarHBondContact N-O 3.01Å; D62-H99 IonicContact OD1-CD2 3.37Å; D62-H99 IonicContact OD1-CE1 3.79Å; D62-H99 PolarHBondContact OD1-CE1 2.85Å; D62-H99 VanDerWaalsContact OD1-CE1 3.27Å; D62-H99 IonicContact OD1-NE2 3.91Å; D62-H99 PolarHBondContact OD1-NE2 2.74Å; D62-H99 VanDerWaalsContact OD1-NE2 3.14Å; D97-H99 PolarHBondContact O-N 3.49Å; D97-H99 WeakPolarHBondContact OD1-CB 3.44Å; D97-H99 PolarHBondContact OD1-N 2.9Å; D97-H99 IonicContact OD1-ND1 3.08Å; H99-Y101 PolarHBondContact O-N 3.41Å
100	E	85.9	Confident	85.2	Confident	14 Å²	14	59.6 Å²	59.6	7%	0.065	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-75.6	121.9	176.8	-167.4	178.7	-158.8	0	0	111.7	Y59 S94 D97 S102	Y59-E100 HydrophobicContact CD1-CB 4.28Å; Y59-E100 HydrophobicContact CD1-CG 4.31Å; Y59-E100 HydrophobicContact CE1-CB 4.27Å; Y59-E100 HydrophobicContact CE1-CG 4.01Å; S94-E100 WeakPolarHBondContact CA-OE2 3.29Å; S94-E100 WeakPolarHBondContact CB-OE2 3.31Å; S94-E100 PolarHBondContact N-OE2 3.48Å; S94-E100 PolarHBondContact OG-OE2 3.19Å; D97-E100 HydrophobicContact CB-CB 4.49Å; E100-S102 VanDerWaalsContact CG-OG 3.23Å; E100-S102 WeakPolarHBondContact CG-OG 3.19Å; E100-S102 WeakPolarHBondContact OE1-CB 3.36Å; E100-S102 PolarHBondContact OE1-OG 2.66Å
101	Y	89	Confident	85.2	Confident	12 Å²	12	63.1 Å²	63.1	5%	0.047	36%	0.356	C	S	.	.			trans	-128.5	53.9	174.6	-167.8	-111.1	0	0	0	109.2	C58 L60 G67 W69 F77 G79 I91 H99	C58-Y101 WeakPolarHBondContact CB-O 3.33Å; C58-Y101 CarbonylContact O-C 3.59Å; C58-Y101 VanDerWaalsContact O-C 3.25Å; C58-Y101 WeakPolarHBondContact O-CA 3.18Å; C58-Y101 PolarHBondContact O-N 2.95Å; L60-Y101 HydrophobicContact CD2-CD1 4.39Å; L60-Y101 HydrophobicContact CD2-CG 4.2Å; L60-Y101 HydrophobicContact CG-CG 4.44Å; G67-Y101 PolarHBondContact O-OH 2.84Å; W69-Y101 AromaticContact CD1-CD1 3.68Å; W69-Y101 AromaticContact CD1-CE1 3.34Å; W69-Y101 HydrophobicContact CG-CE1 4.4Å; W69-Y101 AromaticContact NE1-CD1 3.56Å; W69-Y101 AromaticContact NE1-CE1 3.76Å; W69-Y101 PolarHBondContact NE1-O 3.12Å; F77-Y101 WeakPolarHBondContact CB-OH 3.46Å; G79-Y101 PolarHBondContact N-OH 2.86Å; G79-Y101 WeakPolarHBondContact O-CE2 3.33Å; G79-Y101 PolarHBondContact O-OH 2.94Å; I91-Y101 HydrophobicContact CD1-CE1 4.42Å; I91-Y101 HydrophobicContact CD1-CE2 4.13Å; I91-Y101 HydrophobicContact CG1-CE2 4.13Å; I91-Y101 HydrophobicContact CG2-CD2 3.85Å; I91-Y101 HydrophobicContact CG2-CE2 4.02Å; H99-Y101 PolarHBondContact O-N 3.41Å
102	S	92.4	Very high	85.5	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	137.6	-176.4	-65.2	0	0	0	0	111.1	L56 R57 C58 I91 V92 E100	L56-S102 CarbonylContact O-C 3.55Å; L56-S102 VanDerWaalsContact O-CA 3.3Å; L56-S102 WeakPolarHBondContact O-CA 3.24Å; L56-S102 WeakPolarHBondContact O-CB 3.43Å; R57-S102 WeakPolarHBondContact CA-OG 3.46Å; C58-S102 PolarHBondContact N-OG 2.85Å; I91-S102 WeakPolarHBondContact CA-O 3.39Å; V92-S102 PolarHBondContact N-O 2.04Å; V92-S102 PolarHBondContact O-N 2.87Å; E100-S102 VanDerWaalsContact CG-OG 3.23Å; E100-S102 WeakPolarHBondContact CG-OG 3.19Å; E100-S102 WeakPolarHBondContact OE1-CB 3.36Å; E100-S102 PolarHBondContact OE1-OG 2.66Å
103	L	95.1	Very high	85.9	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	124.7	173.4	177.3	72.4	0	0	0	109.9	L56 W69 I76 F77 V89 I91 I105 Y116	L56-L103 HydrophobicContact CB-CB 4.26Å; L56-L103 PolarHBondContact N-O 3.18Å; L56-L103 PolarHBondContact O-N 3.02Å; W69-L103 HydrophobicContact CD2-CB 3.61Å; W69-L103 HydrophobicContact CD2-CD2 4.17Å; W69-L103 HydrophobicContact CD2-CG 4.44Å; W69-L103 HydrophobicContact CE3-CB 4.06Å; W69-L103 HydrophobicContact CE3-CD2 4.02Å; W69-L103 HydrophobicContact CG-CB 3.93Å; W69-L103 HydrophobicContact CG-CD2 4.4Å; W69-L103 HydrophobicContact CH2-CB 4.31Å; W69-L103 HydrophobicContact CZ2-CB 3.88Å; W69-L103 HydrophobicContact CZ3-CB 4.39Å; I76-L103 HydrophobicContact CD1-CD2 3.6Å; I76-L103 HydrophobicContact CG2-CD1 4.14Å; F77-L103 HydrophobicContact CD2-CD1 3.91Å; F77-L103 HydrophobicContact CE2-CD1 3.95Å; V89-L103 HydrophobicContact CB-CD1 4.32Å; I91-L103 HydrophobicContact CD1-CD1 4.3Å; L103-I105 HydrophobicContact CD2-CD1 4.19Å; L103-I105 HydrophobicContact CD2-CG1 4.26Å; L103-I105 HydrophobicContact CG-CG1 4.21Å; L103-Y116 HydrophobicContact CD2-CD1 3.82Å; L103-Y116 HydrophobicContact CD2-CE1 4.1Å
104	Q	96.6	Very high	86.9	Confident	51 Å²	51	57.9 Å²	57.9	24%	0.238	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	134	172.1	178.8	179.5	60.1	0	0	110.1	T53 A54 L55 V89 S90 V92 Q106	T53-Q104 HydrophobicContact CG2-CG 3.43Å; T53-Q104 VanDerWaalsContact CG2-CG 3.43Å; A54-Q104 WeakPolarHBondContact O-CA 3.45Å; L55-Q104 HydrophobicContact CD1-CB 4.21Å; V89-Q104 VanDerWaalsContact CA-O 3.31Å; V89-Q104 WeakPolarHBondContact CA-O 3.41Å; S90-Q104 PolarHBondContact N-O 3.43Å; S90-Q104 PolarHBondContact O-N 3.37Å; S90-Q104 PolarHBondContact OG-OE1 2.81Å; V92-Q104 HydrophobicContact CG2-CB 3.51Å; V92-Q104 HydrophobicContact CG2-CG 4.2Å; Q104-Q106 HydrophobicContact CG-CG 4.42Å
105	I	97.9	Very high	88.3	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	109.6	175.2	-49.4	179.3	0	0	0	107.3	T53 A54 L56 V89 L103 V108 Y116 L133	T53-I105 CarbonylContact C-O 3.43Å; T53-I105 VanDerWaalsContact CA-O 3.29Å; T53-I105 WeakPolarHBondContact CA-O 3Å; A54-I105 HydrophobicContact CB-CB 4.46Å; A54-I105 PolarHBondContact N-O 3.24Å; A54-I105 PolarHBondContact O-N 3.32Å; L56-I105 HydrophobicContact CD1-CD1 4.16Å; L56-I105 HydrophobicContact CD1-CG1 4.48Å; V89-I105 HydrophobicContact CG1-CG1 4.15Å; V89-I105 HydrophobicContact CG1-CG2 4.27Å; L103-I105 HydrophobicContact CD2-CD1 4.19Å; L103-I105 HydrophobicContact CD2-CG1 4.26Å; L103-I105 HydrophobicContact CG-CG1 4.21Å; I105-V108 HydrophobicContact CB-CG2 4.36Å; I105-V108 HydrophobicContact CG2-CG2 4.28Å; I105-V108 WeakPolarHBondContact O-CG2 3.32Å; I105-Y116 HydrophobicContact CD1-CE1 3.71Å; I105-L133 HydrophobicContact CD1-CD2 4.03Å
106	Q	97.9	Very high	90.1	Very high	88 Å²	88	51.3 Å²	51.3	41%	0.411	27%	0.274	S	S	.	.	S	Bend	trans	-82.2	151.1	177.9	-61.9	-177.5	2.5	0	0	111.2	T53 R88 Q104 V108	T53-Q106 HydrophobicContact CG2-CG 4.19Å; R88-Q106 WeakPolarHBondContact CB-O 3.36Å; R88-Q106 WeakPolarHBondContact CD-O 3.36Å; R88-Q106 PolarHBondContact O-N 3.15Å; Q104-Q106 HydrophobicContact CG-CG 4.42Å; Q106-V108 VanDerWaalsContact C-N 3.35Å; Q106-V108 PolarHBondContact O-N 2.79Å
107	K	97.3	Very high	91.8	Very high	154 Å²	154	48.3 Å²	48.3	67%	0.67	24%	0.239	S	C	*	.	S	Bend	trans	48.7	57.3	177.7	-60.6	-179.2	-179.2	178.5	0	111.3	D52 R88 D109	D52-K107 WeakPolarHBondContact O-CA 3.46Å; D52-K107 PolarHBondContact O-N 3.18Å; D52-K107 VanDerWaalsContact O-N 3.11Å; R88-K107 PolarHBondContact NH1-O 2.86Å; K107-D109 PolarHBondContact O-N 2.78Å
108	V	97.6	Very high	92.9	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.012	23%	0.225	C	C	.	.			trans	-55.2	134.2	-178.1	174.7	0	0	0	0	109.8	Q50 G51 D52 A54 I105 Q106 D112 L133 V135	Q50-V108 CarbonylContact C-O 3.48Å; Q50-V108 WeakPolarHBondContact CA-O 3.38Å; Q50-V108 WeakPolarHBondContact CG-O 3.41Å; G51-V108 PolarHBondContact N-O 2.62Å; D52-V108 WeakPolarHBondContact O-CG2 3.28Å; D52-V108 PolarHBondContact O-N 2.57Å; A54-V108 HydrophobicContact CB-CG2 3.56Å; I105-V108 HydrophobicContact CB-CG2 4.36Å; I105-V108 HydrophobicContact CG2-CG2 4.28Å; I105-V108 WeakPolarHBondContact O-CG2 3.32Å; Q106-V108 VanDerWaalsContact C-N 3.35Å; Q106-V108 PolarHBondContact O-N 2.79Å; V108-D112 WeakPolarHBondContact CA-OD2 3.41Å; V108-D112 HydrophobicContact CG1-CB 4.29Å; V108-L133 HydrophobicContact CG1-CD2 4.44Å; V108-V135 HydrophobicContact CG1-CB 4.27Å; V108-V135 HydrophobicContact CG1-CG1 3.82Å; V108-V135 HydrophobicContact CG1-CG2 3.45Å; V108-V135 VanDerWaalsContact CG1-CG2 3.45Å
109	D	97.3	Very high	93.9	Very high	49 Å²	49	38.4 Å²	38.4	26%	0.262	20%	0.199	S	C	.	.			trans	-113.6	160.6	176.3	-175.3	-106.6	0	0	0	110.9	Q50 K107 T111 D112 V135	Q50-D109 PolarHBondContact NE2-OD2 2.9Å; K107-D109 PolarHBondContact O-N 2.78Å; D109-T111 PolarHBondContact O-N 2.95Å; D109-T111 VanDerWaalsContact O-N 3.09Å; D109-T111 WeakPolarHBondContact OD1-CB 3.38Å; D109-T111 WeakPolarHBondContact OD1-CG2 3.47Å; D109-T111 PolarHBondContact OD1-N 2.79Å; D109-T111 PolarHBondContact OD1-OG1 2.78Å; D109-D112 PolarHBondContact N-OD2 3.03Å; D109-D112 WeakPolarHBondContact O-CB 3.31Å; D109-D112 PolarHBondContact O-N 2.81Å; D109-V135 WeakPolarHBondContact O-CG2 3.39Å
110	V	96.2	Very high	94.2	Very high	59 Å²	59	36.5 Å²	36.5	36%	0.358	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-57.4	-24.8	177.2	-65	0	0	0	0	113.3	D112 D113 V135 V137	V110-D112 VanDerWaalsContact C-N 3.3Å; V110-D113 WeakPolarHBondContact O-CB 2.96Å; V110-D113 PolarHBondContact O-N 3.12Å; V110-V135 HydrophobicContact CG1-CG1 4.46Å; V110-V137 HydrophobicContact CG1-CG2 3.46Å; V110-V137 VanDerWaalsContact CG1-CG2 3.46Å
111	T	96.3	Very high	93.6	Very high	108 Å²	108	42.1 Å²	42.1	66%	0.663	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-73.2	-17.5	176.1	53.6	0	0	0	0	114.1	D109 D113	D109-T111 PolarHBondContact O-N 2.95Å; D109-T111 VanDerWaalsContact O-N 3.09Å; D109-T111 WeakPolarHBondContact OD1-CB 3.38Å; D109-T111 WeakPolarHBondContact OD1-CG2 3.47Å; D109-T111 PolarHBondContact OD1-N 2.79Å; D109-T111 PolarHBondContact OD1-OG1 2.78Å; T111-D113 PolarHBondContact O-N 3.03Å
112	D	97	Very high	92.6	Very high	12 Å²	12	43.7 Å²	43.7	6%	0.064	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-78.3	-6	174.9	-59.1	-43.4	0	0	0	112.1	R88 V108 D109 V110 G114 Y116 L133 V135	R88-D112 IonicContact CZ-OD1 2.69Å; R88-D112 IonicContact CZ-OD2 3.14Å; R88-D112 IonicContact NH1-OD1 3.88Å; R88-D112 IonicContact NH1-OD2 3.27Å; R88-D112 PolarHBondContact NH1-OD2 2.69Å; R88-D112 IonicContact NH2-OD1 3.19Å; R88-D112 PolarHBondContact NH2-OD1 3.23Å; R88-D112 IonicContact NH2-OD2 3.65Å; R88-D112 PolarHBondContact NH2-OD2 2.69Å; V108-D112 WeakPolarHBondContact CA-OD2 3.41Å; V108-D112 HydrophobicContact CG1-CB 4.29Å; D109-D112 PolarHBondContact N-OD2 3.03Å; D109-D112 WeakPolarHBondContact O-CB 3.31Å; D109-D112 PolarHBondContact O-N 2.81Å; V110-D112 VanDerWaalsContact C-N 3.3Å; D112-G114 PolarHBondContact O-N 3.46Å; D112-Y116 VanDerWaalsContact O-CE2 3.3Å; D112-Y116 WeakPolarHBondContact O-CE2 3.41Å; D112-Y116 PolarHBondContact O-OH 2.91Å; D112-L133 HydrophobicContact CB-CD2 4.03Å; D112-V135 HydrophobicContact CB-CG2 4.49Å
113	D	97.1	Very high	91.2	Very high	40 Å²	40	52.6 Å²	52.6	21%	0.214	27%	0.271	C	S	.	.			trans	-64.6	131.7	-179.7	-164.2	-66	0	0	0	112.2	R72 V110 T111 L133 V135 K165	R72-D113 PolarHBondContact NH2-O 3.09Å; R72-D113 VanDerWaalsContact NH2-O 3.14Å; V110-D113 WeakPolarHBondContact O-CB 2.96Å; V110-D113 PolarHBondContact O-N 3.12Å; T111-D113 PolarHBondContact O-N 3.03Å; D113-L133 WeakPolarHBondContact CA-O 3.31Å; D113-V135 HydrophobicContact CB-CB 4.34Å; D113-V135 HydrophobicContact CB-CG2 4.06Å; D113-V135 PolarHBondContact OD2-N 2.9Å; D113-K165 IonicContact OD2-NZ 3.91Å; D113-K165 PolarHBondContact OD2-NZ 2.99Å
114	G	95.3	Very high	89.6	Confident	5 Å²	5	62.9 Å²	62.9	5%	0.052	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	138.8	-162.3	172.8	0	0	0	0	0	114	D112 Y116 N132 L133	D112-G114 PolarHBondContact O-N 3.46Å; G114-Y116 WeakPolarHBondContact O-CD2 3.37Å; G114-N132 VanDerWaalsContact C-OD1 3.28Å; G114-N132 PolarHBondContact O-OD1 2.92Å; G114-L133 PolarHBondContact N-O 2.81Å; G114-L133 PolarHBondContact O-N 3.45Å
115	Q	95.7	Very high	87.8	Confident	80 Å²	80	66.4 Å²	66.4	37%	0.374	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	128.8	-171.3	-171.5	177.6	71.7	0	0	112.5	R72 L131	R72-Q115 PolarHBondContact N-O 2.95Å; Q115-L131 CarbonylContact C-O 3.54Å; Q115-L131 WeakPolarHBondContact CA-O 3.2Å
116	Y	96.1	Very high	86.2	Confident	4 Å²	4	70.1 Å²	70.1	2%	0.016	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	144.3	170.6	-69.1	-101.8	0	0	0	109.5	L56 L70 N71 I76 L103 I105 D112 G114 L131 L133	L56-Y116 HydrophobicContact CD2-CD1 3.97Å; L56-Y116 HydrophobicContact CD2-CD2 3.74Å; L56-Y116 HydrophobicContact CD2-CG 3.42Å; L56-Y116 VanDerWaalsContact CD2-CG 3.42Å; L70-Y116 CarbonylContact O-C 3.57Å; L70-Y116 VanDerWaalsContact O-CA 3.29Å; L70-Y116 WeakPolarHBondContact O-CA 3.31Å; N71-Y116 HydrophobicContact CB-CD1 4.14Å; N71-Y116 HydrophobicContact CB-CE1 3.83Å; I76-Y116 HydrophobicContact CD1-CD1 3.82Å; I76-Y116 HydrophobicContact CD1-CE1 3.82Å; L103-Y116 HydrophobicContact CD2-CD1 3.82Å; L103-Y116 HydrophobicContact CD2-CE1 4.1Å; I105-Y116 HydrophobicContact CD1-CE1 3.71Å; D112-Y116 VanDerWaalsContact O-CE2 3.3Å; D112-Y116 WeakPolarHBondContact O-CE2 3.41Å; D112-Y116 PolarHBondContact O-OH 2.91Å; G114-Y116 WeakPolarHBondContact O-CD2 3.37Å; Y116-L131 PolarHBondContact N-O 2.9Å; Y116-L131 PolarHBondContact O-N 2.83Å; Y116-L131 VanDerWaalsContact O-O 3.06Å; Y116-L133 HydrophobicContact CD2-CB 3.87Å; Y116-L133 HydrophobicContact CE2-CB 3.67Å; Y116-L133 HydrophobicContact CE2-CD2 3.89Å; Y116-L133 HydrophobicContact CE2-CG 4.42Å
117	T	93.9	Very high	84.8	Confident	20 Å²	20	73.7 Å²	73.7	12%	0.123	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	124.6	-179.3	-58.3	0	0	0	0	109.7	W69 L70 P128 L130	W69-T117 CarbonylContact C-O 3.57Å; W69-T117 WeakPolarHBondContact CA-O 3.37Å; L70-T117 HydrophobicContact CD1-CG2 4.45Å; L70-T117 PolarHBondContact N-O 3.38Å; L70-T117 PolarHBondContact O-N 2.84Å; T117-P128 HydrophobicContact CG2-CB 3.5Å; T117-L130 HydrophobicContact CG2-CD2 4.04Å; T117-L130 WeakPolarHBondContact OG1-CD2 3.41Å
118	C	91.5	Very high	84.2	Confident	0 Å²	0	69 Å²	69	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	112.3	163.2	-177.5	0	0	0	0	108.7	C58 A68 W69 P128 K129	C58-C118 HydrophobicContact CB-CB 3.61Å; C58-C118 WeakPolarHBondContact CB-SG 3.06Å; C58-C118 WeakPolarHBondContact SG-CB 3.32Å; C58-C118 CovalentContact SG-SG 2.03Å; C58-C118 PolarHBondContact SG-SG 3.4Å; A68-C118 WeakPolarHBondContact O-CA 3.3Å; W69-C118 HydrophobicContact CD2-CB 4.12Å; W69-C118 HydrophobicContact CE3-CB 4.08Å; W69-C118 HydrophobicContact CH2-CB 3.76Å; W69-C118 HydrophobicContact CZ2-CB 3.8Å; W69-C118 HydrophobicContact CZ3-CB 3.9Å; C118-P128 WeakPolarHBondContact O-CA 3.17Å; C118-K129 HydrophobicContact CB-CB 4.26Å; C118-K129 PolarHBondContact N-O 2.91Å; C118-K129 PolarHBondContact O-N 2.76Å
119	S	88.4	Confident	83.7	Confident	43 Å²	43	72.1 Å²	72.1	30%	0.301	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	117.1	177.7	-176.1	0	0	0	0	109.6	G67 A68	G67-S119 CarbonylContact C-O 3.6Å; G67-S119 VanDerWaalsContact CA-O 3.31Å; G67-S119 WeakPolarHBondContact CA-O 3.37Å; A68-S119 PolarHBondContact N-O 2.91Å; A68-S119 PolarHBondContact O-N 3.07Å
120	I	84	Confident	83.4	Confident	25 Å²	25	71.3 Å²	71.3	13%	0.128	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	130.9	178.5	-57.9	169.4	0	0	0	108.5	Y59 L60 I64 S122	Y59-I120 WeakPolarHBondContact O-CD1 3.35Å; L60-I120 HydrophobicContact CD2-CG1 4.29Å; L60-I120 HydrophobicContact CD2-CG2 4.31Å; I64-I120 HydrophobicContact CD1-CG2 4.44Å; I64-I120 HydrophobicContact CG2-CG2 3.77Å; I120-S122 PolarHBondContact O-N 3.2Å
121	Q	72.8	Confident	83.4	Confident	132 Å²	132	68.5 Å²	68.5	62%	0.617	34%	0.341	S	S	*	.			trans	-70.8	118.4	177.3	-173.7	172.3	22.5	0	0	110	I64 K66	I64-Q121 WeakPolarHBondContact CD1-O 3.46Å; I64-Q121 WeakPolarHBondContact CG1-O 3.36Å; I64-Q121 WeakPolarHBondContact CG2-O 3.49Å; K66-Q121 PolarHBondContact O-N 3.38Å
122	S	68	Low	83.4	Confident	45 Å²	45	65.4 Å²	65.4	32%	0.315	32%	0.32	S	S	.	.			trans	-131.4	140.9	177.3	-176.9	0	0	0	0	111.2	I120 R124	I120-S122 PolarHBondContact O-N 3.2Å; S122-R124 VanDerWaalsContact C-N 3.25Å; S122-R124 PolarHBondContact O-N 3.45Å
123	E	64.3	Low	83.4	Confident	186 Å²	186	64.8 Å²	64.8	87%	0.869	32%	0.317	S	S	*	.	S	Bend	trans	-66.1	-19.4	-173.7	-66.1	-173.5	162.2	0	0	114.6
124	R	60.5	Low	83.4	Confident	217 Å²	217	65.1 Å²	65.1	82%	0.819	32%	0.319	S	S	*	.	S	Bend	trans	-123.8	-12.1	-171.2	-62	-171	-148.3	-154.2	5.3	116.6	S122	S122-R124 VanDerWaalsContact C-N 3.25Å; S122-R124 PolarHBondContact O-N 3.45Å
125	N	59.6	Low	83.5	Confident	125 Å²	125	64.9 Å²	64.9	67%	0.668	32%	0.316	S	S	*	.			trans	171.5	107.2	167.1	-90.7	-33.1	0	0	0	108.7	R127	N125-R127 PolarHBondContact O-N 3.29Å; N125-R127 VanDerWaalsContact O-N 3.1Å
126	P	63.1	Low	83.6	Confident	78 Å²	78	64.1 Å²	64.1	51%	0.506	31%	0.311	S	S	.	.			trans	-67.1	112.6	173.4	26.1	-30.4	0	0	0	109.2	P128	P126-P128 WeakPolarHBondContact O-CD 3.41Å
127	R	69.8	Low	83.6	Confident	164 Å²	164	65.2 Å²	65.2	62%	0.619	32%	0.318	S	S	*	.			trans	-98.4	109.3	169.2	-70.4	-168.5	-179.7	-159.8	1.7	108.3	V38 N125	V38-R127 PolarHBondContact O-NH1 2.91Å; V38-R127 VanDerWaalsContact O-NH1 3.08Å; N125-R127 PolarHBondContact O-N 3.29Å; N125-R127 VanDerWaalsContact O-N 3.1Å
128	P	83.3	Confident	83.8	Confident	54 Å²	54	66.5 Å²	66.5	35%	0.351	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-65.7	137.8	177	24.9	-31.1	0	0	0	110.4	T117 C118 P126	T117-P128 HydrophobicContact CG2-CB 3.5Å; C118-P128 WeakPolarHBondContact O-CA 3.17Å; P126-P128 WeakPolarHBondContact O-CD 3.41Å
129	K	87.9	Confident	84.1	Confident	68 Å²	68	67 Å²	67	30%	0.296	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	118.2	166.3	-172.6	-178.7	-180	-171.9	0	108	E44 R57 C118 L131	E44-K129 WeakPolarHBondContact OE2-CE 3.36Å; E44-K129 IonicContact OE2-NZ 2.74Å; E44-K129 PolarHBondContact OE2-NZ 2.84Å; R57-K129 PolarHBondContact O-NZ 3.48Å; C118-K129 HydrophobicContact CB-CB 4.26Å; C118-K129 PolarHBondContact N-O 2.91Å; C118-K129 PolarHBondContact O-N 2.76Å; K129-L131 HydrophobicContact CB-CD1 4.45Å; K129-L131 HydrophobicContact CD-CD1 4.12Å; K129-L131 HydrophobicContact CG-CD1 3.91Å
130	L	91.4	Very high	84.5	Confident	32 Å²	32	71.6 Å²	71.6	17%	0.168	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	125.2	178	-61.2	176.2	0	0	0	109.3	V43 E44 T117	V43-L130 WeakPolarHBondContact CA-O 3.33Å; V43-L130 HydrophobicContact CG2-CB 4.04Å; V43-L130 HydrophobicContact CG2-CD1 4.19Å; E44-L130 PolarHBondContact N-O 2.78Å; T117-L130 HydrophobicContact CG2-CD2 4.04Å; T117-L130 WeakPolarHBondContact OG1-CD2 3.41Å
131	L	94.9	Very high	85.2	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	144.5	173.8	-59.7	92.9	0	0	0	109.1	E44 V46 L56 W69 Q115 Y116 K129	E44-L131 HydrophobicContact CB-CG 4.4Å; E44-L131 CarbonylContact O-C 3.54Å; E44-L131 VanDerWaalsContact O-CA 3.23Å; E44-L131 WeakPolarHBondContact O-CA 3.29Å; V46-L131 HydrophobicContact CG2-CD2 3.86Å; L56-L131 HydrophobicContact CB-CD2 4.06Å; L56-L131 HydrophobicContact CD2-CB 4.23Å; L56-L131 HydrophobicContact CG-CD2 4.43Å; W69-L131 HydrophobicContact CH2-CD1 3.63Å; W69-L131 HydrophobicContact CH2-CD2 4.44Å; W69-L131 HydrophobicContact CZ3-CD1 3.78Å; Q115-L131 CarbonylContact C-O 3.54Å; Q115-L131 WeakPolarHBondContact CA-O 3.2Å; Y116-L131 PolarHBondContact N-O 2.9Å; Y116-L131 PolarHBondContact O-N 2.83Å; Y116-L131 VanDerWaalsContact O-O 3.06Å; K129-L131 HydrophobicContact CB-CD1 4.45Å; K129-L131 HydrophobicContact CD-CD1 4.12Å; K129-L131 HydrophobicContact CG-CD1 3.91Å
132	N	96	Very high	86.4	Confident	43 Å²	43	71 Å²	71	23%	0.23	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	109.9	174.9	-173.6	47.1	0	0	0	108.7	V43 E44 N45 V46 G114 I134	V43-N132 HydrophobicContact CG1-CB 3.8Å; E44-N132 PolarHBondContact O-N 2.91Å; N45-N132 WeakPolarHBondContact CA-O 3.47Å; N45-N132 WeakPolarHBondContact OD1-CB 3.14Å; N45-N132 PolarHBondContact OD1-ND2 3Å; V46-N132 PolarHBondContact N-O 3.4Å; G114-N132 VanDerWaalsContact C-OD1 3.28Å; G114-N132 PolarHBondContact O-OD1 2.92Å; N132-I134 PolarHBondContact O-N 2.86Å
133	L	97.3	Very high	87.8	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	114	175.9	178.8	59.1	0	0	0	108.6	V46 A54 I105 V108 D112 D113 G114 Y116 V135	V46-L133 HydrophobicContact CB-CD1 4.41Å; V46-L133 HydrophobicContact CG1-CD1 4.21Å; V46-L133 CarbonylContact O-C 3.52Å; V46-L133 WeakPolarHBondContact O-CA 3.24Å; A54-L133 HydrophobicContact CB-CD1 3.77Å; A54-L133 HydrophobicContact CB-CD2 4.3Å; I105-L133 HydrophobicContact CD1-CD2 4.03Å; V108-L133 HydrophobicContact CG1-CD2 4.44Å; D112-L133 HydrophobicContact CB-CD2 4.03Å; D113-L133 WeakPolarHBondContact CA-O 3.31Å; G114-L133 PolarHBondContact N-O 2.81Å; G114-L133 PolarHBondContact O-N 3.45Å; Y116-L133 HydrophobicContact CD2-CB 3.87Å; Y116-L133 HydrophobicContact CE2-CB 3.67Å; Y116-L133 HydrophobicContact CE2-CD2 3.89Å; Y116-L133 HydrophobicContact CE2-CG 4.42Å; L133-V135 HydrophobicContact CD2-CG2 4.37Å; L133-V135 HydrophobicContact CG-CG2 4.07Å
134	I	96.9	Very high	89.3	Confident	47 Å²	47	65.5 Å²	65.5	24%	0.241	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	109.5	176.7	-58.3	173.9	0	0	0	107.8	N45 V46 V47 S48 N132 K136	N45-I134 HydrophobicContact CB-CD1 4.03Å; V46-I134 PolarHBondContact O-N 2.81Å; V47-I134 WeakPolarHBondContact CA-O 3.38Å; V47-I134 HydrophobicContact CG2-CB 4.32Å; S48-I134 PolarHBondContact N-O 2.9Å; N132-I134 PolarHBondContact O-N 2.86Å; I134-K136 HydrophobicContact CG2-CG 4.18Å
135	V	97.8	Very high	91.1	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	121.5	179.3	-174.3	0	0	0	0	109.2	S48 Q50 V108 D109 V110 D112 D113 L133 K165	S48-V135 WeakPolarHBondContact O-CA 3.38Å; Q50-V135 HydrophobicContact CB-CG1 4.29Å; V108-V135 HydrophobicContact CG1-CB 4.27Å; V108-V135 HydrophobicContact CG1-CG1 3.82Å; V108-V135 HydrophobicContact CG1-CG2 3.45Å; V108-V135 VanDerWaalsContact CG1-CG2 3.45Å; D109-V135 WeakPolarHBondContact O-CG2 3.39Å; V110-V135 HydrophobicContact CG1-CG1 4.46Å; D112-V135 HydrophobicContact CB-CG2 4.49Å; D113-V135 HydrophobicContact CB-CB 4.34Å; D113-V135 HydrophobicContact CB-CG2 4.06Å; D113-V135 PolarHBondContact OD2-N 2.9Å; L133-V135 HydrophobicContact CD2-CG2 4.37Å; L133-V135 HydrophobicContact CG-CG2 4.07Å; V135-K165 VanDerWaalsContact O-CD 3.23Å; V135-K165 WeakPolarHBondContact O-CD 3.43Å; V135-K165 WeakPolarHBondContact O-CE 3.44Å; V135-K165 PolarHBondContact O-NZ 3.3Å
136	K	97.5	Very high	92.9	Very high	63 Å²	63	54.8 Å²	54.8	27%	0.274	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	141.9	-180	-58.6	-164.4	-179	-177.1	0	110.9	V47 S48 R49 Q50 I134 K165 I209	V47-K136 HydrophobicContact CG1-CD 3.55Å; V47-K136 VanDerWaalsContact CG1-CE 3.43Å; V47-K136 HydrophobicContact CG1-CG 3.84Å; S48-K136 PolarHBondContact O-N 2.89Å; R49-K136 CarbonylContact C-O 3.56Å; R49-K136 VanDerWaalsContact CA-O 3.27Å; R49-K136 WeakPolarHBondContact CA-O 3.43Å; Q50-K136 PolarHBondContact N-O 3.34Å; I134-K136 HydrophobicContact CG2-CG 4.18Å; K136-K165 CarbonylContact C-O 3.55Å; K136-K165 VanDerWaalsContact CA-O 3.24Å; K136-K165 WeakPolarHBondContact CA-O 3.19Å; K136-K165 WeakPolarHBondContact CB-O 3.21Å; K136-I209 HydrophobicContact CB-CD1 4.05Å; K136-I209 HydrophobicContact CB-CG1 4.08Å; K136-I209 HydrophobicContact CB-CG2 4.03Å; K136-I209 HydrophobicContact CD-CD1 3.33Å; K136-I209 HydrophobicContact CD-CG1 4.26Å; K136-I209 HydrophobicContact CG-CD1 4.27Å
137	V	97.6	Very high	94.6	Very high	27 Å²	27	55.9 Å²	55.9	16%	0.164	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	124.2	-176.9	-176.1	0	0	0	0	108.3	Q50 V110 K165 N207	Q50-V137 HydrophobicContact CB-CG2 4.09Å; V110-V137 HydrophobicContact CG1-CG2 3.46Å; V110-V137 VanDerWaalsContact CG1-CG2 3.46Å; V137-K165 HydrophobicContact CB-CB 3.86Å; V137-K165 HydrophobicContact CG2-CB 3.87Å; V137-K165 PolarHBondContact N-O 3.43Å; V137-K165 PolarHBondContact O-N 3.47Å; V137-N207 PolarHBondContact O-ND2 2.64Å
138	P	96.8	Very high	95.9	Very high	47 Å²	47	50.2 Å²	50.2	31%	0.305	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	156.8	173.3	-27.1	36.3	0	0	0	113.1	I209 A210	P138-I209 HydrophobicContact CG-CG2 4.3Å; P138-A210 HydrophobicContact CB-CB 3.95Å; P138-A210 HydrophobicContact CG-CB 4.27Å
139	P	97.6	Very high	96.6	Very high	11 Å²	11	51.7 Å²	51.7	7%	0.071	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	145	-179.8	32.8	-28.5	0	0	0	110	T163 P168 A205 N207	P139-T163 CarbonylContact C-O 3.57Å; P139-T163 VanDerWaalsContact CA-O 3.27Å; P139-T163 WeakPolarHBondContact CA-O 3.29Å; P139-P168 HydrophobicContact CB-CB 3.92Å; P139-A205 HydrophobicContact CB-CB 4.1Å; P139-A205 WeakPolarHBondContact CB-O 3.33Å; P139-A205 VanDerWaalsContact CG-O 3.27Å; P139-A205 WeakPolarHBondContact CG-O 3.47Å; P139-N207 WeakPolarHBondContact CD-OD1 3.42Å
140	K	97.9	Very high	97.1	Very high	140 Å²	140	49.9 Å²	49.9	61%	0.609	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.2	118.1	176.1	-173.3	175.2	-178.2	178.7	0	111.8	Y142 A162 T163 D213	K140-Y142 PolarHBondContact O-N 2.89Å; K140-A162 CarbonylContact O-C 3.52Å; K140-A162 WeakPolarHBondContact O-CA 3.31Å; K140-A162 WeakPolarHBondContact O-CB 3.46Å; K140-T163 PolarHBondContact N-O 2.72Å; K140-T163 PolarHBondContact O-N 2.69Å; K140-D213 WeakPolarHBondContact CA-OD2 3.49Å
141	I	98.4	Very high	97.4	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.01	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	113.4	175.2	-60.8	168.4	0	0	0	108.7	I144 A162 C203 A205 D213 K215	I141-I144 HydrophobicContact CG2-CB 4.39Å; I141-A162 HydrophobicContact CG1-CB 4.02Å; I141-C203 HydrophobicContact CD1-CB 4.44Å; I141-A205 HydrophobicContact CD1-CB 4.24Å; I141-A205 HydrophobicContact CG1-CB 3.76Å; I141-D213 VanDerWaalsContact CD1-O 3.32Å; I141-D213 WeakPolarHBondContact CD1-O 3.44Å; I141-D213 HydrophobicContact CG1-CB 4.37Å; I141-D213 PolarHBondContact N-OD2 2.78Å; I141-K215 HydrophobicContact CB-CD 4.13Å; I141-K215 HydrophobicContact CB-CG 4.29Å; I141-K215 HydrophobicContact CD1-CB 4.22Å; I141-K215 HydrophobicContact CD1-CG 4.15Å; I141-K215 HydrophobicContact CG2-CD 3.76Å; I141-K215 HydrophobicContact CG2-CG 4.21Å; I141-K215 WeakPolarHBondContact O-CE 3.47Å; I141-K215 PolarHBondContact O-NZ 2.84Å
142	Y	97.4	Very high	97.6	Very high	142 Å²	142	55.2 Å²	55.2	56%	0.557	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.1	-25.3	-179.9	66.5	-92	0	0	0	113.1	K140 T161 T163	K140-Y142 PolarHBondContact O-N 2.89Å; Y142-T161 WeakPolarHBondContact CE2-OG1 3.36Å; Y142-T161 PolarHBondContact N-O 2.89Å; Y142-T161 VanDerWaalsContact N-O 3.16Å; Y142-T161 PolarHBondContact OH-OG1 3.06Å; Y142-T163 HydrophobicContact CD1-CG2 3.69Å; Y142-T163 HydrophobicContact CE1-CG2 3.65Å
143	D	97.2	Very high	97.7	Very high	81 Å²	81	55.5 Å²	55.5	43%	0.433	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	139.3	176.9	-171	28	0	0	0	111.2	T161	D143-T161 WeakPolarHBondContact CB-OG1 3.43Å; D143-T161 PolarHBondContact N-O 3.37Å; D143-T161 PolarHBondContact O-N 2.85Å
144	I	97.5	Very high	97.7	Very high	34 Å²	34	57.4 Å²	57.4	17%	0.174	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	145.1	178.6	-171.7	169.8	0	0	0	109	I141 S146 I159 C160 W172 C203 K215	I141-I144 HydrophobicContact CG2-CB 4.39Å; I144-S146 PolarHBondContact O-N 3.15Å; I144-I159 CarbonylContact C-O 3.38Å; I144-I159 VanDerWaalsContact CA-O 3.31Å; I144-I159 WeakPolarHBondContact CA-O 3.5Å; I144-C160 HydrophobicContact CG1-CB 4.35Å; I144-W172 HydrophobicContact CD1-CH2 4.2Å; I144-W172 HydrophobicContact CG1-CH2 4.22Å; I144-C203 HydrophobicContact CD1-CB 4Å; I144-K215 HydrophobicContact CD1-CB 3.62Å; I144-K215 HydrophobicContact CG2-CB 4.42Å; I144-K215 HydrophobicContact CG2-CD 3.93Å
145	S	97.4	Very high	97.7	Very high	26 Å²	26	61 Å²	61	18%	0.182	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-51.3	139.4	172.1	-66.2	0	0	0	0	112.5	L158 I159 V217	S145-L158 WeakPolarHBondContact OG-CA 3.02Å; S145-I159 PolarHBondContact N-O 2.87Å; S145-I159 WeakPolarHBondContact OG-CG2 3.29Å; S145-I159 PolarHBondContact OG-N 2.89Å; S145-V217 VanDerWaalsContact O-CG2 3.3Å; S145-V217 WeakPolarHBondContact O-CG2 3.36Å
146	S	97.6	Very high	97.7	Very high	92 Å²	92	61.3 Å²	61.3	64%	0.643	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-71.2	164.4	168	60.8	0	0	0	0	111.6	I144 I148 V217	I144-S146 PolarHBondContact O-N 3.15Å; S146-I148 WeakPolarHBondContact O-CG2 3.39Å; S146-I148 PolarHBondContact O-N 2.83Å; S146-V217 VanDerWaalsContact O-CG2 3.27Å; S146-V217 WeakPolarHBondContact O-CG2 3.31Å
147	D	98.2	Very high	97.6	Very high	101 Å²	101	61.6 Å²	61.6	54%	0.54	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-52.9	136.5	171.8	-69.7	-4.3	0	0	0	111.4	K218	D147-K218 WeakPolarHBondContact CA-O 3.38Å; D147-K218 HydrophobicContact CB-CB 4.27Å; D147-K218 WeakPolarHBondContact OD1-CB 3.32Å; D147-K218 PolarHBondContact OD1-N 2.72Å
148	I	97.8	Very high	97.6	Very high	44 Å²	44	60.3 Å²	60.3	23%	0.226	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	151.4	-178	61.1	169	0	0	0	111.6	S146 V150 V156 L158 K218 V219 T220	S146-I148 WeakPolarHBondContact O-CG2 3.39Å; S146-I148 PolarHBondContact O-N 2.83Å; I148-V150 HydrophobicContact CD1-CG1 4.29Å; I148-V156 HydrophobicContact CD1-CB 4.46Å; I148-V156 HydrophobicContact CD1-CG1 3.48Å; I148-V156 VanDerWaalsContact CD1-CG1 3.48Å; I148-V156 HydrophobicContact CD1-CG2 4.19Å; I148-L158 HydrophobicContact CD1-CD2 3.81Å; I148-L158 HydrophobicContact CG1-CD2 4.38Å; I148-K218 PolarHBondContact N-O 2.97Å; I148-V219 HydrophobicContact CD1-CG1 4.23Å; I148-V219 HydrophobicContact CD1-CG2 4.17Å; I148-V219 HydrophobicContact CG1-CB 4.36Å; I148-V219 HydrophobicContact CG1-CG1 4.17Å; I148-V219 HydrophobicContact CG1-CG2 3.99Å; I148-T220 PolarHBondContact O-N 3.14Å
149	T	98.3	Very high	97.6	Very high	86 Å²	86	60 Å²	60	53%	0.528	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	120.8	170.5	-61.2	0	0	0	0	109	T220 N222	T149-T220 CarbonylContact C-O 3.54Å; T149-T220 VanDerWaalsContact CA-O 3.29Å; T149-T220 WeakPolarHBondContact CA-O 3.44Å; T149-T220 HydrophobicContact CG2-CG2 4.1Å; T149-N222 WeakPolarHBondContact CG2-ND2 3.39Å; T149-N222 WeakPolarHBondContact CG2-OD1 3.36Å
150	V	98.2	Very high	97.6	Very high	29 Å²	29	59.5 Å²	59.5	18%	0.176	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	165.7	-177.9	-63.6	0	0	0	0	110.5	I148 V156 I193 T220 V221 N222	I148-V150 HydrophobicContact CD1-CG1 4.29Å; V150-V156 HydrophobicContact CB-CG2 4.48Å; V150-V156 HydrophobicContact CG1-CG2 4.18Å; V150-V156 HydrophobicContact CG2-CG2 3.78Å; V150-I193 HydrophobicContact CG2-CG2 3.9Å; V150-T220 PolarHBondContact N-O 3.49Å; V150-V221 HydrophobicContact CG2-CG2 4.48Å; V150-V221 CarbonylContact O-C 3.5Å; V150-V221 WeakPolarHBondContact O-CA 3.24Å; V150-N222 PolarHBondContact O-N 3.41Å
151	N	98.3	Very high	97.5	Very high	75 Å²	75	53.4 Å²	53.4	40%	0.401	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	150.4	173	-64.1	-20	0	0	0	110.2	G153 S154 N222	N151-G153 PolarHBondContact O-N 3.19Å; N151-S154 WeakPolarHBondContact O-CB 3.44Å; N151-S154 PolarHBondContact O-N 3.02Å; N151-S154 VanDerWaalsContact O-N 3.08Å; N151-S154 PolarHBondContact O-OG 3.42Å; N151-N222 WeakPolarHBondContact OD1-CB 3.4Å; N151-N222 PolarHBondContact OD1-ND2 2.86Å
152	E	98.1	Very high	97.5	Very high	69 Å²	69	53.5 Å²	53.5	32%	0.322	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	136.7	173.5	-172.1	166.4	-125	0	0	111.3	S154 R195 V221 N222 F223	E152-S154 VanDerWaalsContact C-N 3.33Å; E152-R195 WeakPolarHBondContact OE1-CB 3.45Å; E152-R195 WeakPolarHBondContact OE1-CG 3.42Å; E152-R195 IonicContact OE1-CZ 3.82Å; E152-R195 PolarHBondContact OE1-N 2.86Å; E152-R195 VanDerWaalsContact OE1-N 3.07Å; E152-R195 IonicContact OE1-NE 2.78Å; E152-R195 PolarHBondContact OE1-NE 3.33Å; E152-R195 IonicContact OE1-NH2 3.27Å; E152-R195 IonicContact OE2-CZ 3.2Å; E152-R195 IonicContact OE2-NE 2.74Å; E152-R195 PolarHBondContact OE2-NE 3.27Å; E152-R195 IonicContact OE2-NH2 2.84Å; E152-R195 PolarHBondContact OE2-NH2 3.43Å; E152-V221 HydrophobicContact CB-CG1 3.84Å; E152-V221 HydrophobicContact CG-CG1 4.45Å; E152-N222 PolarHBondContact N-O 2.9Å; E152-F223 HydrophobicContact CB-CB 4.24Å
153	G	97.7	Very high	97.5	Very high	49 Å²	49	50.1 Å²	50.1	51%	0.505	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	-3.4	-174.4	0	0	0	0	0	115.3	N151 G192 I193	N151-G153 PolarHBondContact O-N 3.19Å; G153-G192 WeakPolarHBondContact O-CA 3.32Å; G153-I193 PolarHBondContact N-O 2.63Å
154	S	98.2	Very high	97.5	Very high	41 Å²	41	47 Å²	47	29%	0.287	29%	0.289	S	S	.	.			trans	-72.7	157.2	175.3	-54.6	0	0	0	0	112	N151 E152 G192 I193	N151-S154 WeakPolarHBondContact O-CB 3.44Å; N151-S154 PolarHBondContact O-N 3.02Å; N151-S154 VanDerWaalsContact O-N 3.08Å; N151-S154 PolarHBondContact O-OG 3.42Å; E152-S154 VanDerWaalsContact C-N 3.33Å; S154-G192 PolarHBondContact O-N 2.79Å; S154-I193 WeakPolarHBondContact O-CG2 3.49Å; S154-I193 PolarHBondContact O-N 3.16Å
155	N	97.4	Very high	97.5	Very high	121 Å²	121	48.9 Å²	48.9	65%	0.647	30%	0.296	S	S	*	.			trans	-89.1	135.4	168.8	-64.7	-12.9	0	0	0	109.7	I190 T191 G192	N155-I190 CarbonylContact C-O 3.53Å; N155-I190 WeakPolarHBondContact CA-O 3.37Å; N155-T191 VanDerWaalsContact OD1-CA 3.3Å; N155-T191 WeakPolarHBondContact OD1-CA 3.4Å; N155-G192 PolarHBondContact OD1-N 3.21Å
156	V	96.3	Very high	97.4	Very high	7 Å²	7	51 Å²	51	4%	0.042	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	136.4	-179.3	172	0	0	0	0	108.9	I148 V150 L158 N189 I190 I193	I148-V156 HydrophobicContact CD1-CB 4.46Å; I148-V156 HydrophobicContact CD1-CG1 3.48Å; I148-V156 VanDerWaalsContact CD1-CG1 3.48Å; I148-V156 HydrophobicContact CD1-CG2 4.19Å; V150-V156 HydrophobicContact CB-CG2 4.48Å; V150-V156 HydrophobicContact CG1-CG2 4.18Å; V150-V156 HydrophobicContact CG2-CG2 3.78Å; V156-L158 HydrophobicContact CG1-CD2 4.01Å; V156-L158 HydrophobicContact CG1-CG 4.02Å; V156-N189 CarbonylContact O-C 3.55Å; V156-N189 WeakPolarHBondContact O-CA 3.47Å; V156-I190 HydrophobicContact CB-CB 4.33Å; V156-I190 PolarHBondContact N-O 2.87Å; V156-I190 PolarHBondContact O-N 2.83Å; V156-I193 HydrophobicContact CG2-CB 4.41Å; V156-I193 HydrophobicContact CG2-CD1 3.93Å; V156-I193 HydrophobicContact CG2-CG2 4.15Å
157	S	95.9	Very high	97.3	Very high	69 Å²	69	53.2 Å²	53.2	48%	0.483	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	116.4	170.6	174.3	0	0	0	0	108.1	L188 N189	S157-L188 WeakPolarHBondContact CA-O 3.29Å; S157-N189 WeakPolarHBondContact CB-OD1 3.43Å; S157-N189 PolarHBondContact OG-OD1 2.86Å
158	L	96.9	Very high	97.3	Very high	0 Å²	0	49 Å²	49	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	146.2	171.5	-53.5	175	0	0	0	109	S145 I148 V156 W172 Y187 L188 Y201 V217 V219	S145-L158 WeakPolarHBondContact OG-CA 3.02Å; I148-L158 HydrophobicContact CD1-CD2 3.81Å; I148-L158 HydrophobicContact CG1-CD2 4.38Å; V156-L158 HydrophobicContact CG1-CD2 4.01Å; V156-L158 HydrophobicContact CG1-CG 4.02Å; L158-W172 HydrophobicContact CB-CH2 3.86Å; L158-W172 HydrophobicContact CB-CZ2 4.04Å; L158-W172 HydrophobicContact CB-CZ3 4.45Å; L158-W172 HydrophobicContact CD1-CH2 4.48Å; L158-W172 HydrophobicContact CD1-CZ3 4.29Å; L158-Y187 CarbonylContact O-C 3.58Å; L158-Y187 VanDerWaalsContact O-CA 3.29Å; L158-Y187 WeakPolarHBondContact O-CA 3.42Å; L158-L188 HydrophobicContact CB-CB 4.3Å; L158-L188 HydrophobicContact CD1-CD2 4.28Å; L158-L188 PolarHBondContact N-O 2.86Å; L158-L188 PolarHBondContact O-N 2.74Å; L158-Y201 HydrophobicContact CD1-CD1 4.45Å; L158-Y201 HydrophobicContact CD1-CD2 4.49Å; L158-Y201 HydrophobicContact CD1-CG 4.08Å; L158-V217 HydrophobicContact CD1-CG1 3.79Å; L158-V217 HydrophobicContact CD2-CG1 4.44Å; L158-V217 HydrophobicContact CD2-CG2 4.45Å; L158-V219 HydrophobicContact CD1-CG2 3.99Å; L158-V219 HydrophobicContact CD2-CG2 4.28Å
159	I	96.9	Very high	97.2	Very high	42 Å²	42	49.9 Å²	49.9	22%	0.215	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	143.2	176.3	-171.5	172.7	0	0	0	109.9	I144 S145 T161 E186 Y187	I144-I159 CarbonylContact C-O 3.38Å; I144-I159 VanDerWaalsContact CA-O 3.31Å; I144-I159 WeakPolarHBondContact CA-O 3.5Å; S145-I159 PolarHBondContact N-O 2.87Å; S145-I159 WeakPolarHBondContact OG-CG2 3.29Å; S145-I159 PolarHBondContact OG-N 2.89Å; I159-T161 HydrophobicContact CD1-CG2 4.2Å; I159-T161 HydrophobicContact CG1-CG2 4.16Å; I159-E186 CarbonylContact C-O 3.53Å; I159-E186 WeakPolarHBondContact CA-O 3.44Å; I159-Y187 HydrophobicContact CB-CD1 4.26Å; I159-Y187 HydrophobicContact CB-CE1 4.14Å; I159-Y187 HydrophobicContact CD1-CE1 3.67Å; I159-Y187 WeakPolarHBondContact CD1-OH 3.42Å; I159-Y187 HydrophobicContact CG1-CD1 4.28Å; I159-Y187 HydrophobicContact CG1-CE1 3.9Å
160	C	97.6	Very high	97.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	122.4	170	180	0	0	0	0	109.5	I144 I170 W172 E186 C203	I144-C160 HydrophobicContact CG1-CB 4.35Å; C160-I170 HydrophobicContact CB-CG2 4.33Å; C160-W172 HydrophobicContact CB-CH2 3.83Å; C160-W172 HydrophobicContact CB-CZ2 3.27Å; C160-E186 PolarHBondContact N-O 3.07Å; C160-E186 WeakPolarHBondContact O-CA 3.3Å; C160-C203 HydrophobicContact CB-CB 3.58Å; C160-C203 WeakPolarHBondContact CB-SG 3.43Å; C160-C203 WeakPolarHBondContact SG-CB 3.25Å; C160-C203 CovalentContact SG-SG 2.02Å; C160-C203 PolarHBondContact SG-SG 2.98Å
161	T	97.3	Very high	96.9	Very high	11 Å²	11	46.8 Å²	46.8	7%	0.067	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	139.2	179.1	58.4	0	0	0	0	110.3	Y142 D143 I159 E186	Y142-T161 WeakPolarHBondContact CE2-OG1 3.36Å; Y142-T161 PolarHBondContact N-O 2.89Å; Y142-T161 VanDerWaalsContact N-O 3.16Å; Y142-T161 PolarHBondContact OH-OG1 3.06Å; D143-T161 WeakPolarHBondContact CB-OG1 3.43Å; D143-T161 PolarHBondContact N-O 3.37Å; D143-T161 PolarHBondContact O-N 2.85Å; I159-T161 HydrophobicContact CD1-CG2 4.2Å; I159-T161 HydrophobicContact CG1-CG2 4.16Å; T161-E186 HydrophobicContact CG2-CG 4.49Å
162	A	97.9	Very high	96.8	Very high	5 Å²	5	43.4 Å²	43.4	4%	0.041	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	153.3	-178.7	0	0	0	0	0	111.1	K140 I141 P168 I170 A205	K140-A162 CarbonylContact O-C 3.52Å; K140-A162 WeakPolarHBondContact O-CA 3.31Å; K140-A162 WeakPolarHBondContact O-CB 3.46Å; I141-A162 HydrophobicContact CG1-CB 4.02Å; A162-P168 HydrophobicContact CB-CB 4.5Å; A162-P168 HydrophobicContact CB-CG 3.74Å; A162-I170 HydrophobicContact CB-CD1 3.73Å; A162-A205 HydrophobicContact CB-CB 3.44Å; A162-A205 VanDerWaalsContact CB-CB 3.44Å
163	T	97.1	Very high	96.6	Very high	70 Å²	70	43.3 Å²	43.3	43%	0.429	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	157.4	168.8	52.7	0	0	0	0	110.2	P139 K140 Y142	P139-T163 CarbonylContact C-O 3.57Å; P139-T163 VanDerWaalsContact CA-O 3.27Å; P139-T163 WeakPolarHBondContact CA-O 3.29Å; K140-T163 PolarHBondContact N-O 2.72Å; K140-T163 PolarHBondContact O-N 2.69Å; Y142-T163 HydrophobicContact CD1-CG2 3.69Å; Y142-T163 HydrophobicContact CE1-CG2 3.65Å
164	G	96.8	Very high	96.3	Very high	15 Å²	15	41.2 Å²	41.2	16%	0.155	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.7	164.6	175.5	0	0	0	0	0	110.8	P166	G164-P166 CarbonylContact C-O 3.54Å; G164-P166 CarbonylContact O-C 3.52Å
165	K	96.8	Very high	96	Very high	74 Å²	74	42.5 Å²	42.5	32%	0.322	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	107.8	173.4	-174.9	177.3	169.1	-162.9	0	109.4	D113 V135 K136 V137 N207	D113-K165 IonicContact OD2-NZ 3.91Å; D113-K165 PolarHBondContact OD2-NZ 2.99Å; V135-K165 VanDerWaalsContact O-CD 3.23Å; V135-K165 WeakPolarHBondContact O-CD 3.43Å; V135-K165 WeakPolarHBondContact O-CE 3.44Å; V135-K165 PolarHBondContact O-NZ 3.3Å; K136-K165 CarbonylContact C-O 3.55Å; K136-K165 VanDerWaalsContact CA-O 3.24Å; K136-K165 WeakPolarHBondContact CA-O 3.19Å; K136-K165 WeakPolarHBondContact CB-O 3.21Å; V137-K165 HydrophobicContact CB-CB 3.86Å; V137-K165 HydrophobicContact CG2-CB 3.87Å; V137-K165 PolarHBondContact N-O 3.43Å; V137-K165 PolarHBondContact O-N 3.47Å; K165-N207 PolarHBondContact N-ND2 3.17Å
166	P	96.4	Very high	95.4	Very high	70 Å²	70	38.7 Å²	38.7	46%	0.455	23%	0.225	S	C	.	.	S	Bend	cis	-63.1	163.3	2.9	-21.3	34.7	0	0	0	114.1	G164 N207	G164-P166 CarbonylContact C-O 3.54Å; G164-P166 CarbonylContact O-C 3.52Å; P166-N207 VanDerWaalsContact O-CB 3.3Å; P166-N207 WeakPolarHBondContact O-CB 3.41Å; P166-N207 PolarHBondContact O-ND2 3.04Å
167	E	96.1	Very high	94.4	Very high	140 Å²	140	45.2 Å²	45.2	65%	0.654	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-53.8	128.3	177.5	-167.2	64.7	-163.4	0	0	110.1
168	P	96.6	Very high	93.4	Very high	13 Å²	13	48.9 Å²	48.9	8%	0.084	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-77	139.6	-173.6	30.4	-34.5	0	0	0	112.9	P139 A162 A205 L206 N207	P139-P168 HydrophobicContact CB-CB 3.92Å; A162-P168 HydrophobicContact CB-CB 4.5Å; A162-P168 HydrophobicContact CB-CG 3.74Å; P168-A205 HydrophobicContact CB-CB 4.25Å; P168-L206 CarbonylContact C-O 3.6Å; P168-L206 VanDerWaalsContact CA-O 3.3Å; P168-L206 WeakPolarHBondContact CA-O 3.48Å; P168-N207 HydrophobicContact CB-CB 4.21Å
169	A	95.8	Very high	92	Very high	62 Å²	62	51 Å²	51	51%	0.512	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	129.7	166.7	0	0	0	0	0	110	A205 L206	A169-A205 WeakPolarHBondContact O-CA 3.41Å; A169-L206 PolarHBondContact N-O 2.66Å; A169-L206 PolarHBondContact O-N 2.97Å
170	I	96.6	Very high	91	Very high	12 Å²	12	56 Å²	56	6%	0.062	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	135.3	175	-56.6	-57.7	0	0	0	109.9	C160 A162 S184 S185 E186 S204 A205	C160-I170 HydrophobicContact CB-CG2 4.33Å; A162-I170 HydrophobicContact CB-CD1 3.73Å; I170-S184 CarbonylContact O-C 3.46Å; I170-S184 WeakPolarHBondContact O-CA 3.45Å; I170-S184 WeakPolarHBondContact O-CB 3.33Å; I170-S185 WeakPolarHBondContact CG2-O 3.31Å; I170-E186 HydrophobicContact CG1-CG 4.29Å; I170-S204 CarbonylContact C-O 3.57Å; I170-S204 WeakPolarHBondContact CA-O 3.37Å; I170-A205 HydrophobicContact CD1-CB 3.73Å
171	A	94.9	Very high	90.1	Very high	38 Å²	38	65 Å²	65	31%	0.314	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	138.3	174.4	0	0	0	0	0	111	C203 S204	A171-C203 CarbonylContact O-C 3.51Å; A171-C203 WeakPolarHBondContact O-CA 3.27Å; A171-S204 PolarHBondContact N-O 3.01Å; A171-S204 PolarHBondContact O-N 3.24Å
172	W	95.6	Very high	89.3	Confident	4 Å²	4	66.9 Å²	66.9	2%	0.015	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	144.6	178.4	-75	98.7	0	0	0	112.3	I144 L158 C160 Y182 S185 E186 L188 E202 C203 V217	I144-W172 HydrophobicContact CD1-CH2 4.2Å; I144-W172 HydrophobicContact CG1-CH2 4.22Å; L158-W172 HydrophobicContact CB-CH2 3.86Å; L158-W172 HydrophobicContact CB-CZ2 4.04Å; L158-W172 HydrophobicContact CB-CZ3 4.45Å; L158-W172 HydrophobicContact CD1-CH2 4.48Å; L158-W172 HydrophobicContact CD1-CZ3 4.29Å; C160-W172 HydrophobicContact CB-CH2 3.83Å; C160-W172 HydrophobicContact CB-CZ2 3.27Å; W172-Y182 PolarHBondContact O-N 3.1Å; W172-S185 VanDerWaalsContact CD1-O 3.3Å; W172-S185 PolarHBondContact NE1-O 3.28Å; W172-E186 PolarHBondContact NE1-O 2.81Å; W172-L188 HydrophobicContact CB-CB 4.46Å; W172-L188 HydrophobicContact CB-CD2 4.03Å; W172-L188 HydrophobicContact CD2-CB 3.95Å; W172-L188 HydrophobicContact CD2-CD2 4.18Å; W172-L188 HydrophobicContact CE3-CD2 4.26Å; W172-L188 HydrophobicContact CG-CB 3.86Å; W172-L188 HydrophobicContact CG-CD2 4.13Å; W172-L188 HydrophobicContact CG-CG 4.48Å; W172-E202 CarbonylContact C-O 3.58Å; W172-E202 WeakPolarHBondContact CA-O 3.42Å; W172-C203 HydrophobicContact CD2-CB 4.17Å; W172-C203 HydrophobicContact CE3-CB 3.92Å; W172-C203 HydrophobicContact CH2-CB 3.87Å; W172-C203 HydrophobicContact CZ2-CB 4.11Å; W172-C203 HydrophobicContact CZ3-CB 3.76Å; W172-V217 HydrophobicContact CH2-CG1 4.21Å; W172-V217 HydrophobicContact CZ3-CG1 3.88Å
173	R	93.2	Very high	88.3	Confident	67 Å²	67	73.4 Å²	73.4	25%	0.253	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	131.4	178	-176.7	178.9	68.1	87.6	-4.4	110.7	Y201 E202	R173-Y201 CarbonylContact O-C 3.56Å; R173-Y201 WeakPolarHBondContact O-CA 3.48Å; R173-E202 HydrophobicContact CB-CB 4.49Å; R173-E202 IonicContact CZ-OE1 2.76Å; R173-E202 PolarHBondContact N-O 3.44Å; R173-E202 IonicContact NE-OE1 3.49Å; R173-E202 PolarHBondContact NE-OE1 3.28Å; R173-E202 IonicContact NH2-OE1 3.36Å; R173-E202 PolarHBondContact NH2-OE1 3.13Å; R173-E202 IonicContact NH2-OE2 3.15Å; R173-E202 PolarHBondContact NH2-OE2 3Å; R173-E202 PolarHBondContact O-N 2.88Å
174	H	93	Very high	87.5	Confident	5 Å²	5	74.7 Å²	74.7	2%	0.023	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	122.1	167.4	178.5	-146.1	0	0	0	109	T176 R180 Y182 Q197 A198 D200 Y201	H174-T176 WeakPolarHBondContact CE1-CG2 3.12Å; H174-T176 VanDerWaalsContact ND1-CG2 3.3Å; H174-T176 WeakPolarHBondContact ND1-CG2 3.39Å; H174-T176 PolarHBondContact O-N 2.89Å; H174-R180 PolarHBondContact N-O 2.66Å; H174-Y182 HydrophobicContact CB-CE2 3.58Å; H174-Q197 PolarHBondContact NE2-O 2.94Å; H174-A198 PolarHBondContact NE2-O 3.33Å; H174-D200 PolarHBondContact CD2-O 3.47Å; H174-Y201 HydrophobicContact CB-CD1 4.06Å; H174-Y201 HydrophobicContact CB-CE1 3.78Å; H174-Y201 AromaticContact CD2-CE2 3.6Å; H174-Y201 AromaticContact CD2-CZ 3.6Å; H174-Y201 AromaticContact CG-CZ 3.94Å; H174-Y201 AromaticContact NE2-CE2 3.99Å
175	I	90.9	Very high	87.2	Confident	67 Å²	67	76.4 Å²	76.4	34%	0.344	42%	0.415	S	S	.	.			trans	-77.6	76.4	-178.2	-50	-176.7	0	0	0	108.8	D200 E202 T216	I175-D200 HydrophobicContact CB-CB 4.27Å; I175-D200 WeakPolarHBondContact CB-O 2.95Å; I175-D200 HydrophobicContact CD1-CB 3.94Å; I175-D200 HydrophobicContact CG1-CB 4.31Å; I175-D200 WeakPolarHBondContact CG1-O 3.03Å; I175-D200 PolarHBondContact N-O 2.99Å; I175-E202 HydrophobicContact CD1-CB 4.07Å; I175-E202 HydrophobicContact CG1-CB 4.09Å; I175-T216 HydrophobicContact CD1-CG2 3.86Å
176	T	84.3	Confident	87.1	Confident	41 Å²	41	76.8 Å²	76.8	25%	0.252	42%	0.419	S	S	.	.	S	Bend	trans	-118.1	163.8	169.8	48.5	0	0	0	0	110.3	H174 L178 A179	H174-T176 WeakPolarHBondContact CE1-CG2 3.12Å; H174-T176 VanDerWaalsContact ND1-CG2 3.3Å; H174-T176 WeakPolarHBondContact ND1-CG2 3.39Å; H174-T176 PolarHBondContact O-N 2.89Å; T176-L178 PolarHBondContact O-N 2.96Å; T176-L178 VanDerWaalsContact O-N 3.07Å; T176-A179 WeakPolarHBondContact O-CA 3.3Å; T176-A179 PolarHBondContact O-N 2.84Å
177	P	76.1	Confident	87	Confident	144 Å²	144	78.7 Å²	78.7	94%	0.935	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-27.2	175.3	-27.8	35.8	0	0	0	114.1
178	L	74.1	Confident	87	Confident	146 Å²	146	72.4 Å²	72.4	76%	0.764	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-5	177.4	-66.8	170	0	0	0	113.6	T176 R180	T176-L178 PolarHBondContact O-N 2.96Å; T176-L178 VanDerWaalsContact O-N 3.07Å; L178-R180 PolarHBondContact O-N 2.81Å
179	A	67.2	Low	86.9	Confident	45 Å²	45	77.1 Å²	77.1	37%	0.372	41%	0.413	S	S	.	.			trans	38.8	69.6	178.6	0	0	0	0	0	113.4	T176 K181	T176-A179 WeakPolarHBondContact O-CA 3.3Å; T176-A179 PolarHBondContact O-N 2.84Å; A179-K181 PolarHBondContact O-N 3.33Å
180	R	75.9	Confident	86.8	Confident	148 Å²	148	74.6 Å²	74.6	56%	0.558	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	119.7	176.1	-68.8	-172.7	-176.6	-170.8	3.5	109.9	H174 L178 Y182	H174-R180 PolarHBondContact N-O 2.66Å; L178-R180 PolarHBondContact O-N 2.81Å; R180-Y182 HydrophobicContact CB-CE2 4.32Å
181	K	79.5	Confident	86.8	Confident	187 Å²	187	79.3 Å²	79.3	81%	0.813	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	139.1	169.6	-64.3	-174.9	179.8	-176.3	0	109.1	A179	A179-K181 PolarHBondContact O-N 3.33Å
182	Y	81.5	Confident	86.9	Confident	52 Å²	52	79.1 Å²	79.1	20%	0.204	42%	0.422	C	S	.	.			trans	-109	171.5	173.4	-67.5	-93.4	0	0	0	110.3	W172 H174 R180 L188 Y201	W172-Y182 PolarHBondContact O-N 3.1Å; H174-Y182 HydrophobicContact CB-CE2 3.58Å; R180-Y182 HydrophobicContact CB-CE2 4.32Å; Y182-L188 HydrophobicContact CD1-CD1 3.5Å; Y182-L188 VanDerWaalsContact CD1-CD1 3.5Å; Y182-L188 HydrophobicContact CD2-CD1 4.39Å; Y182-L188 HydrophobicContact CD2-CD2 4.36Å; Y182-L188 HydrophobicContact CE1-CD1 4.22Å; Y182-L188 HydrophobicContact CG-CD1 3.58Å; Y182-L188 HydrophobicContact CG-CD2 4.33Å; Y182-Y201 HydrophobicContact CE2-CD1 4.42Å; Y182-Y201 AromaticContact CE2-CE1 3.93Å; Y182-Y201 HydrophobicContact CE2-CE1 3.93Å
183	D	75.6	Confident	86.9	Confident	142 Å²	142	78.9 Å²	78.9	76%	0.759	42%	0.421	S	S	*	.			trans	-57.7	147	-179.9	-67.9	-24.9	0	0	0	112.4	S185	D183-S185 PolarHBondContact O-N 2.97Å; D183-S185 VanDerWaalsContact O-N 3.1Å
184	S	79.8	Confident	87.1	Confident	97 Å²	97	78.4 Å²	78.4	68%	0.678	43%	0.425	S	S	*	.	S	Bend	trans	-79.2	88.2	179.8	-62	0	0	0	0	110.9	I170	I170-S184 CarbonylContact O-C 3.46Å; I170-S184 WeakPolarHBondContact O-CA 3.45Å; I170-S184 WeakPolarHBondContact O-CB 3.33Å
185	S	91.4	Very high	87.2	Confident	50 Å²	50	81.7 Å²	81.7	35%	0.35	44%	0.437	S	S	.	.	S	Bend	trans	-149.8	157.2	176.2	120	0	0	0	0	110.4	I170 W172 D183 Y187	I170-S185 WeakPolarHBondContact CG2-O 3.31Å; W172-S185 VanDerWaalsContact CD1-O 3.3Å; W172-S185 PolarHBondContact NE1-O 3.28Å; D183-S185 PolarHBondContact O-N 2.97Å; D183-S185 VanDerWaalsContact O-N 3.1Å; S185-Y187 PolarHBondContact O-N 2.87Å; S185-Y187 PolarHBondContact OG-N 3.03Å; S185-Y187 PolarHBondContact OG-O 3.42Å
186	E	94.2	Very high	87.3	Confident	83 Å²	83	84.9 Å²	84.9	39%	0.388	46%	0.455	S	S	.	.	S	Bend	trans	-57.4	-31.5	173.4	-65.1	-177.8	161.7	0	0	111.9	I159 C160 T161 I170 W172	I159-E186 CarbonylContact C-O 3.53Å; I159-E186 WeakPolarHBondContact CA-O 3.44Å; C160-E186 PolarHBondContact N-O 3.07Å; C160-E186 WeakPolarHBondContact O-CA 3.3Å; T161-E186 HydrophobicContact CG2-CG 4.49Å; I170-E186 HydrophobicContact CG1-CG 4.29Å; W172-E186 PolarHBondContact NE1-O 2.81Å
187	Y	94.8	Very high	87.7	Confident	110 Å²	110	84.7 Å²	84.7	43%	0.431	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	135.5	-179	-62.4	-92	0	0	0	111.5	L158 I159 S185	L158-Y187 CarbonylContact O-C 3.58Å; L158-Y187 VanDerWaalsContact O-CA 3.29Å; L158-Y187 WeakPolarHBondContact O-CA 3.42Å; I159-Y187 HydrophobicContact CB-CD1 4.26Å; I159-Y187 HydrophobicContact CB-CE1 4.14Å; I159-Y187 HydrophobicContact CD1-CE1 3.67Å; I159-Y187 WeakPolarHBondContact CD1-OH 3.42Å; I159-Y187 HydrophobicContact CG1-CD1 4.28Å; I159-Y187 HydrophobicContact CG1-CE1 3.9Å; S185-Y187 PolarHBondContact O-N 2.87Å; S185-Y187 PolarHBondContact OG-N 3.03Å; S185-Y187 PolarHBondContact OG-O 3.42Å
188	L	95.3	Very high	88.6	Confident	8 Å²	8	79.4 Å²	79.4	4%	0.042	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	109.9	165.7	176.2	59.7	0	0	0	109.6	S157 L158 W172 Y182 I190 Y201	S157-L188 WeakPolarHBondContact CA-O 3.29Å; L158-L188 HydrophobicContact CB-CB 4.3Å; L158-L188 HydrophobicContact CD1-CD2 4.28Å; L158-L188 PolarHBondContact N-O 2.86Å; L158-L188 PolarHBondContact O-N 2.74Å; W172-L188 HydrophobicContact CB-CB 4.46Å; W172-L188 HydrophobicContact CB-CD2 4.03Å; W172-L188 HydrophobicContact CD2-CB 3.95Å; W172-L188 HydrophobicContact CD2-CD2 4.18Å; W172-L188 HydrophobicContact CE3-CD2 4.26Å; W172-L188 HydrophobicContact CG-CB 3.86Å; W172-L188 HydrophobicContact CG-CD2 4.13Å; W172-L188 HydrophobicContact CG-CG 4.48Å; Y182-L188 HydrophobicContact CD1-CD1 3.5Å; Y182-L188 VanDerWaalsContact CD1-CD1 3.5Å; Y182-L188 HydrophobicContact CD2-CD1 4.39Å; Y182-L188 HydrophobicContact CD2-CD2 4.36Å; Y182-L188 HydrophobicContact CE1-CD1 4.22Å; Y182-L188 HydrophobicContact CG-CD1 3.58Å; Y182-L188 HydrophobicContact CG-CD2 4.33Å; L188-I190 HydrophobicContact CD1-CG1 4.42Å; L188-I190 HydrophobicContact CD2-CD1 4.27Å; L188-I190 HydrophobicContact CG-CD1 4.39Å; L188-I190 HydrophobicContact CG-CG1 4.19Å; L188-Y201 HydrophobicContact CD2-CD1 3.46Å; L188-Y201 VanDerWaalsContact CD2-CD1 3.46Å; L188-Y201 HydrophobicContact CD2-CE1 3.81Å; L188-Y201 HydrophobicContact CD2-CG 4.46Å
189	N	95	Very high	89.6	Confident	111 Å²	111	73.7 Å²	73.7	59%	0.594	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	121.3	178.2	-66.5	-43.2	0	0	0	110.6	V156 S157	V156-N189 CarbonylContact O-C 3.55Å; V156-N189 WeakPolarHBondContact O-CA 3.47Å; S157-N189 WeakPolarHBondContact CB-OD1 3.43Å; S157-N189 PolarHBondContact OG-OD1 2.86Å
190	I	94.5	Very high	91	Very high	9 Å²	9	74.2 Å²	74.2	5%	0.046	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	117.7	175.6	-54.9	171.3	0	0	0	107.2	N155 V156 L188 I193 Y201	N155-I190 CarbonylContact C-O 3.53Å; N155-I190 WeakPolarHBondContact CA-O 3.37Å; V156-I190 HydrophobicContact CB-CB 4.33Å; V156-I190 PolarHBondContact N-O 2.87Å; V156-I190 PolarHBondContact O-N 2.83Å; L188-I190 HydrophobicContact CD1-CG1 4.42Å; L188-I190 HydrophobicContact CD2-CD1 4.27Å; L188-I190 HydrophobicContact CG-CD1 4.39Å; L188-I190 HydrophobicContact CG-CG1 4.19Å; I190-I193 HydrophobicContact CD1-CD1 4.46Å; I190-I193 HydrophobicContact CG2-CB 4Å; I190-I193 HydrophobicContact CG2-CD1 4.37Å; I190-I193 HydrophobicContact CG2-CG1 3.97Å; I190-Y201 HydrophobicContact CD1-CE1 3.62Å; I190-Y201 WeakPolarHBondContact CD1-OH 3.17Å
191	T	96.1	Very high	92	Very high	111 Å²	111	67.1 Å²	67.1	68%	0.681	37%	0.366	S	S	*	.	S	Bend	trans	-96.3	139.5	176.5	54.6	0	0	0	0	110	N155 I193	N155-T191 VanDerWaalsContact OD1-CA 3.3Å; N155-T191 WeakPolarHBondContact OD1-CA 3.4Å; T191-I193 PolarHBondContact O-N 2.02Å
192	G	96.8	Very high	92.8	Very high	34 Å²	34	59.9 Å²	59.9	35%	0.351	34%	0.335	S	S	.	.	S	Bend	trans	57.5	49	177.2	0	0	0	0	0	113.9	G153 S154 N155 T194	G153-G192 WeakPolarHBondContact O-CA 3.32Å; S154-G192 PolarHBondContact O-N 2.79Å; N155-G192 PolarHBondContact OD1-N 3.21Å; G192-T194 PolarHBondContact O-N 3.46Å
193	I	96.5	Very high	93.5	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	33%	0.326	C	S	.	.			trans	-57.2	131.6	-171.6	-164.8	171.1	0	0	0	112.4	V150 G153 S154 V156 I190 T191 Q197 V219 V221	V150-I193 HydrophobicContact CG2-CG2 3.9Å; G153-I193 PolarHBondContact N-O 2.63Å; S154-I193 WeakPolarHBondContact O-CG2 3.49Å; S154-I193 PolarHBondContact O-N 3.16Å; V156-I193 HydrophobicContact CG2-CB 4.41Å; V156-I193 HydrophobicContact CG2-CD1 3.93Å; V156-I193 HydrophobicContact CG2-CG2 4.15Å; I190-I193 HydrophobicContact CD1-CD1 4.46Å; I190-I193 HydrophobicContact CG2-CB 4Å; I190-I193 HydrophobicContact CG2-CD1 4.37Å; I190-I193 HydrophobicContact CG2-CG1 3.97Å; T191-I193 PolarHBondContact O-N 2.02Å; I193-Q197 HydrophobicContact CD1-CB 4.39Å; I193-Q197 HydrophobicContact CG1-CB 3.82Å; I193-V219 HydrophobicContact CD1-CG1 3.65Å; I193-V221 HydrophobicContact CD1-CG2 3.85Å; I193-V221 HydrophobicContact CG1-CG2 4.05Å; I193-V221 HydrophobicContact CG2-CG2 4.25Å
194	T	96.5	Very high	94.5	Very high	57 Å²	57	51.9 Å²	51.9	35%	0.35	30%	0.298	S	S	.	.			trans	-97.5	161.7	177.4	72.4	0	0	0	0	112	G192 D196 Q197	G192-T194 PolarHBondContact O-N 3.46Å; T194-D196 PolarHBondContact O-N 2.83Å; T194-Q197 WeakPolarHBondContact O-CB 3.46Å; T194-Q197 PolarHBondContact O-N 2.95Å; T194-Q197 PolarHBondContact OG1-OE1 2.84Å
195	R	95	Very high	95.4	Very high	73 Å²	73	47.3 Å²	47.3	28%	0.275	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-58.5	-27.3	175.7	67.7	-171.8	70.1	177.2	-0.9	114.6	E152 Q197 A198 F223 D226	E152-R195 WeakPolarHBondContact OE1-CB 3.45Å; E152-R195 WeakPolarHBondContact OE1-CG 3.42Å; E152-R195 IonicContact OE1-CZ 3.82Å; E152-R195 PolarHBondContact OE1-N 2.86Å; E152-R195 VanDerWaalsContact OE1-N 3.07Å; E152-R195 IonicContact OE1-NE 2.78Å; E152-R195 PolarHBondContact OE1-NE 3.33Å; E152-R195 IonicContact OE1-NH2 3.27Å; E152-R195 IonicContact OE2-CZ 3.2Å; E152-R195 IonicContact OE2-NE 2.74Å; E152-R195 PolarHBondContact OE2-NE 3.27Å; E152-R195 IonicContact OE2-NH2 2.84Å; E152-R195 PolarHBondContact OE2-NH2 3.43Å; R195-Q197 PolarHBondContact O-N 2.86Å; R195-A198 VanDerWaalsContact O-CB 3.29Å; R195-A198 WeakPolarHBondContact O-CB 3.36Å; R195-A198 PolarHBondContact O-N 2.82Å; R195-F223 HydrophobicContact CB-CD1 3.68Å; R195-F223 HydrophobicContact CB-CE1 3.77Å; R195-F223 HydrophobicContact CB-CG 4.28Å; R195-F223 HydrophobicContact CB-CZ 4.43Å; R195-D226 IonicContact NH1-OD2 2.64Å
196	D	93.2	Very high	95.6	Very high	135 Å²	135	48.2 Å²	48.2	72%	0.722	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-74.4	-16.9	177	-61.1	-43.5	0	0	0	113	T194 A198	T194-D196 PolarHBondContact O-N 2.83Å; D196-A198 VanDerWaalsContact C-N 3.35Å
197	Q	93.6	Very high	95.6	Very high	37 Å²	37	44.8 Å²	44.8	17%	0.173	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-90.9	1.6	174.8	-65.1	176.3	-62.4	0	0	112.3	H174 I193 T194 R195 Y201	H174-Q197 PolarHBondContact NE2-O 2.94Å; I193-Q197 HydrophobicContact CD1-CB 4.39Å; I193-Q197 HydrophobicContact CG1-CB 3.82Å; T194-Q197 WeakPolarHBondContact O-CB 3.46Å; T194-Q197 PolarHBondContact O-N 2.95Å; T194-Q197 PolarHBondContact OG1-OE1 2.84Å; R195-Q197 PolarHBondContact O-N 2.86Å; Q197-Y201 VanDerWaalsContact O-CE2 3.31Å; Q197-Y201 WeakPolarHBondContact O-CE2 3.18Å; Q197-Y201 PolarHBondContact O-OH 2.78Å
198	A	95.2	Very high	95.6	Very high	33 Å²	33	46.2 Å²	46.2	27%	0.273	27%	0.266	S	S	.	.			trans	-66.2	161.2	170.6	0	0	0	0	0	111.4	H174 R195 D196 V219 V221	H174-A198 PolarHBondContact NE2-O 3.33Å; R195-A198 VanDerWaalsContact O-CB 3.29Å; R195-A198 WeakPolarHBondContact O-CB 3.36Å; R195-A198 PolarHBondContact O-N 2.82Å; D196-A198 VanDerWaalsContact C-N 3.35Å; A198-V219 WeakPolarHBondContact CA-O 3.23Å; A198-V221 HydrophobicContact CB-CB 4.13Å; A198-V221 HydrophobicContact CB-CG2 3.85Å
199	G	95.3	Very high	95.5	Very high	26 Å²	26	46.4 Å²	46.4	27%	0.268	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	118.4	-157.6	176.3	0	0	0	0	0	112.9	V219	G199-V219 PolarHBondContact N-O 2.99Å; G199-V219 PolarHBondContact O-N 3.43Å
200	D	96.1	Very high	95.4	Very high	55 Å²	55	42.7 Å²	42.7	29%	0.294	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	132.5	-172	-62	-33.3	0	0	0	111	H174 I175 K218	H174-D200 PolarHBondContact CD2-O 3.47Å; I175-D200 HydrophobicContact CB-CB 4.27Å; I175-D200 WeakPolarHBondContact CB-O 2.95Å; I175-D200 HydrophobicContact CD1-CB 3.94Å; I175-D200 HydrophobicContact CG1-CB 4.31Å; I175-D200 WeakPolarHBondContact CG1-O 3.03Å; I175-D200 PolarHBondContact N-O 2.99Å; D200-K218 WeakPolarHBondContact OD1-CB 3.3Å; D200-K218 WeakPolarHBondContact OD1-CG 3.17Å; D200-K218 IonicContact OD1-NZ 2.72Å; D200-K218 PolarHBondContact OD1-NZ 2.88Å; D200-K218 IonicContact OD2-NZ 3.56Å; D200-K218 PolarHBondContact OD2-NZ 3.27Å
201	Y	96	Very high	95.5	Very high	0 Å²	0	47 Å²	47	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	128.7	173.5	-72.5	-102.7	0	0	0	108.6	L158 R173 H174 Y182 L188 I190 Q197 T216 V217 V219	L158-Y201 HydrophobicContact CD1-CD1 4.45Å; L158-Y201 HydrophobicContact CD1-CD2 4.49Å; L158-Y201 HydrophobicContact CD1-CG 4.08Å; R173-Y201 CarbonylContact O-C 3.56Å; R173-Y201 WeakPolarHBondContact O-CA 3.48Å; H174-Y201 HydrophobicContact CB-CD1 4.06Å; H174-Y201 HydrophobicContact CB-CE1 3.78Å; H174-Y201 AromaticContact CD2-CE2 3.6Å; H174-Y201 AromaticContact CD2-CZ 3.6Å; H174-Y201 AromaticContact CG-CZ 3.94Å; H174-Y201 AromaticContact NE2-CE2 3.99Å; Y182-Y201 HydrophobicContact CE2-CD1 4.42Å; Y182-Y201 AromaticContact CE2-CE1 3.93Å; Y182-Y201 HydrophobicContact CE2-CE1 3.93Å; L188-Y201 HydrophobicContact CD2-CD1 3.46Å; L188-Y201 VanDerWaalsContact CD2-CD1 3.46Å; L188-Y201 HydrophobicContact CD2-CE1 3.81Å; L188-Y201 HydrophobicContact CD2-CG 4.46Å; I190-Y201 HydrophobicContact CD1-CE1 3.62Å; I190-Y201 WeakPolarHBondContact CD1-OH 3.17Å; Q197-Y201 VanDerWaalsContact O-CE2 3.31Å; Q197-Y201 WeakPolarHBondContact O-CE2 3.18Å; Q197-Y201 PolarHBondContact O-OH 2.78Å; Y201-T216 CarbonylContact O-C 3.53Å; Y201-T216 VanDerWaalsContact O-CA 3.25Å; Y201-T216 WeakPolarHBondContact O-CA 3.39Å; Y201-V217 PolarHBondContact N-O 3.05Å; Y201-V217 PolarHBondContact O-N 2.87Å; Y201-V219 HydrophobicContact CD2-CB 4.06Å; Y201-V219 HydrophobicContact CD2-CG2 3.58Å; Y201-V219 HydrophobicContact CE2-CB 3.89Å; Y201-V219 HydrophobicContact CE2-CG2 3.79Å; Y201-V219 HydrophobicContact CG-CG2 4.49Å
202	E	96.2	Very high	95.5	Very high	35 Å²	35	44.6 Å²	44.6	16%	0.164	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.1	178.2	-176	-179.6	70.7	0	0	109.7	W172 R173 I175 K215 T216	W172-E202 CarbonylContact C-O 3.58Å; W172-E202 WeakPolarHBondContact CA-O 3.42Å; R173-E202 HydrophobicContact CB-CB 4.49Å; R173-E202 IonicContact CZ-OE1 2.76Å; R173-E202 PolarHBondContact N-O 3.44Å; R173-E202 IonicContact NE-OE1 3.49Å; R173-E202 PolarHBondContact NE-OE1 3.28Å; R173-E202 IonicContact NH2-OE1 3.36Å; R173-E202 PolarHBondContact NH2-OE1 3.13Å; R173-E202 IonicContact NH2-OE2 3.15Å; R173-E202 PolarHBondContact NH2-OE2 3Å; R173-E202 PolarHBondContact O-N 2.88Å; I175-E202 HydrophobicContact CD1-CB 4.07Å; I175-E202 HydrophobicContact CG1-CB 4.09Å; E202-K215 CarbonylContact C-O 3.56Å; E202-K215 WeakPolarHBondContact CA-O 3.45Å; E202-T216 HydrophobicContact CB-CG2 4.21Å; E202-T216 HydrophobicContact CG-CG2 4.33Å
203	C	97	Very high	95.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	134.6	162.6	174.8	0	0	0	0	109.3	I141 I144 C160 A171 W172 T214 K215	I141-C203 HydrophobicContact CD1-CB 4.44Å; I144-C203 HydrophobicContact CD1-CB 4Å; C160-C203 HydrophobicContact CB-CB 3.58Å; C160-C203 WeakPolarHBondContact CB-SG 3.43Å; C160-C203 WeakPolarHBondContact SG-CB 3.25Å; C160-C203 CovalentContact SG-SG 2.02Å; C160-C203 PolarHBondContact SG-SG 2.98Å; A171-C203 CarbonylContact O-C 3.51Å; A171-C203 WeakPolarHBondContact O-CA 3.27Å; W172-C203 HydrophobicContact CD2-CB 4.17Å; W172-C203 HydrophobicContact CE3-CB 3.92Å; W172-C203 HydrophobicContact CH2-CB 3.87Å; W172-C203 HydrophobicContact CZ2-CB 4.11Å; W172-C203 HydrophobicContact CZ3-CB 3.76Å; C203-T214 VanDerWaalsContact O-CA 3.24Å; C203-T214 WeakPolarHBondContact O-CA 3.45Å; C203-K215 PolarHBondContact N-O 3.09Å; C203-K215 PolarHBondContact O-N 2.74Å
204	S	96.5	Very high	95.6	Very high	26 Å²	26	48.6 Å²	48.6	18%	0.182	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	128.8	173.2	-60	0	0	0	0	110.4	I170 A171 D213 T214	I170-S204 CarbonylContact C-O 3.57Å; I170-S204 WeakPolarHBondContact CA-O 3.37Å; A171-S204 PolarHBondContact N-O 3.01Å; A171-S204 PolarHBondContact O-N 3.24Å; S204-D213 WeakPolarHBondContact CA-O 3.48Å; S204-T214 WeakPolarHBondContact OG-CG2 3.24Å
205	A	97.8	Very high	95.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	121.1	174.2	0	0	0	0	0	110.3	P139 I141 A162 P168 A169 I170 P212 D213	P139-A205 HydrophobicContact CB-CB 4.1Å; P139-A205 WeakPolarHBondContact CB-O 3.33Å; P139-A205 VanDerWaalsContact CG-O 3.27Å; P139-A205 WeakPolarHBondContact CG-O 3.47Å; I141-A205 HydrophobicContact CD1-CB 4.24Å; I141-A205 HydrophobicContact CG1-CB 3.76Å; A162-A205 HydrophobicContact CB-CB 3.44Å; A162-A205 VanDerWaalsContact CB-CB 3.44Å; P168-A205 HydrophobicContact CB-CB 4.25Å; A169-A205 WeakPolarHBondContact O-CA 3.41Å; I170-A205 HydrophobicContact CD1-CB 3.73Å; A205-P212 WeakPolarHBondContact O-CA 3.3Å; A205-P212 WeakPolarHBondContact O-CB 3.27Å; A205-D213 PolarHBondContact N-O 2.95Å; A205-D213 PolarHBondContact O-N 2.76Å; A205-D213 VanDerWaalsContact O-N 3.13Å
206	L	95.6	Very high	95.7	Very high	70 Å²	70	50.1 Å²	50.1	37%	0.366	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	134.9	-174.9	172.9	68.7	0	0	0	111.3	P168 A169 P212	P168-L206 CarbonylContact C-O 3.6Å; P168-L206 VanDerWaalsContact CA-O 3.3Å; P168-L206 WeakPolarHBondContact CA-O 3.48Å; A169-L206 PolarHBondContact N-O 2.66Å; A169-L206 PolarHBondContact O-N 2.97Å; L206-P212 HydrophobicContact CB-CG 4.45Å; L206-P212 HydrophobicContact CD1-CG 3.97Å
207	N	95.7	Very high	95.9	Very high	10 Å²	10	43.7 Å²	43.7	5%	0.053	26%	0.261	C	S	.	.			trans	-139.3	21.8	170.2	71.1	-5.6	0	0	0	113.9	V137 P139 K165 P166 P168 I209	V137-N207 PolarHBondContact O-ND2 2.64Å; P139-N207 WeakPolarHBondContact CD-OD1 3.42Å; K165-N207 PolarHBondContact N-ND2 3.17Å; P166-N207 VanDerWaalsContact O-CB 3.3Å; P166-N207 WeakPolarHBondContact O-CB 3.41Å; P166-N207 PolarHBondContact O-ND2 3.04Å; P168-N207 HydrophobicContact CB-CB 4.21Å; N207-I209 WeakPolarHBondContact O-CD1 3.32Å; N207-I209 VanDerWaalsContact O-CG1 3.32Å; N207-I209 WeakPolarHBondContact O-CG1 3.48Å; N207-I209 PolarHBondContact O-N 2.97Å; N207-I209 WeakPolarHBondContact OD1-CB 3.18Å; N207-I209 WeakPolarHBondContact OD1-CG1 3.27Å; N207-I209 PolarHBondContact OD1-N 3.5Å
208	D	94.4	Very high	96.1	Very high	140 Å²	140	46 Å²	46	75%	0.749	27%	0.27	S	S	*	.	S	Bend	trans	58.1	10.2	-179.9	-55.7	-40.5	0	0	0	115.8
209	I	93.8	Very high	96.2	Very high	13 Å²	13	44.4 Å²	44.4	7%	0.067	26%	0.258	C	S	.	.	S	Bend	trans	-89.5	-38.5	-179.9	-53.8	-40.9	0	0	0	111.2	R49 K136 P138 N207	R49-I209 HydrophobicContact CG-CG2 3.98Å; R49-I209 PolarHBondContact NE-O 2.77Å; R49-I209 VanDerWaalsContact NE-O 3.13Å; R49-I209 PolarHBondContact NH2-O 2.81Å; K136-I209 HydrophobicContact CB-CD1 4.05Å; K136-I209 HydrophobicContact CB-CG1 4.08Å; K136-I209 HydrophobicContact CB-CG2 4.03Å; K136-I209 HydrophobicContact CD-CD1 3.33Å; K136-I209 HydrophobicContact CD-CG1 4.26Å; K136-I209 HydrophobicContact CG-CD1 4.27Å; P138-I209 HydrophobicContact CG-CG2 4.3Å; N207-I209 WeakPolarHBondContact O-CD1 3.32Å; N207-I209 VanDerWaalsContact O-CG1 3.32Å; N207-I209 WeakPolarHBondContact O-CG1 3.48Å; N207-I209 PolarHBondContact O-N 2.97Å; N207-I209 WeakPolarHBondContact OD1-CB 3.18Å; N207-I209 WeakPolarHBondContact OD1-CG1 3.27Å; N207-I209 PolarHBondContact OD1-N 3.5Å
210	A	92.5	Very high	96.3	Very high	33 Å²	33	45.3 Å²	45.3	27%	0.273	26%	0.258	S	S	.	.	S	Bend	trans	-143.4	-174.6	177.2	0	0	0	0	0	109.6	P138	P138-A210 HydrophobicContact CB-CB 3.95Å; P138-A210 HydrophobicContact CG-CB 4.27Å
211	S	95	Very high	96.4	Very high	98 Å²	98	42.8 Å²	42.8	69%	0.685	25%	0.245	S	C	*	.	S	Bend	trans	-54.6	144.6	165.9	50.4	0	0	0	0	110.3
212	P	96.2	Very high	96.5	Very high	61 Å²	61	43.2 Å²	43.2	40%	0.396	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-55.1	143	173.8	-21.4	30.1	0	0	0	111.5	A205 L206 T214	A205-P212 WeakPolarHBondContact O-CA 3.3Å; A205-P212 WeakPolarHBondContact O-CB 3.27Å; L206-P212 HydrophobicContact CB-CG 4.45Å; L206-P212 HydrophobicContact CD1-CG 3.97Å; P212-T214 HydrophobicContact CB-CG2 4.33Å
213	D	98.1	Very high	96.6	Very high	50 Å²	50	42.6 Å²	42.6	27%	0.267	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	136.1	163.8	-169.2	24.8	0	0	0	108.2	K140 I141 S204 A205	K140-D213 WeakPolarHBondContact CA-OD2 3.49Å; I141-D213 VanDerWaalsContact CD1-O 3.32Å; I141-D213 WeakPolarHBondContact CD1-O 3.44Å; I141-D213 HydrophobicContact CG1-CB 4.37Å; I141-D213 PolarHBondContact N-OD2 2.78Å; S204-D213 WeakPolarHBondContact CA-O 3.48Å; A205-D213 PolarHBondContact N-O 2.95Å; A205-D213 PolarHBondContact O-N 2.76Å; A205-D213 VanDerWaalsContact O-N 3.13Å
214	T	97.3	Very high	96.7	Very high	68 Å²	68	45.1 Å²	45.1	42%	0.417	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	141	-175.5	67.2	0	0	0	0	111.6	C203 S204 P212	C203-T214 VanDerWaalsContact O-CA 3.24Å; C203-T214 WeakPolarHBondContact O-CA 3.45Å; S204-T214 WeakPolarHBondContact OG-CG2 3.24Å; P212-T214 HydrophobicContact CB-CG2 4.33Å
215	K	97.6	Very high	96.8	Very high	79 Å²	79	44.3 Å²	44.3	34%	0.343	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	152.5	173.8	-69.6	-165	-172.9	179.5	0	110.7	I141 I144 E202 C203	I141-K215 HydrophobicContact CB-CD 4.13Å; I141-K215 HydrophobicContact CB-CG 4.29Å; I141-K215 HydrophobicContact CD1-CB 4.22Å; I141-K215 HydrophobicContact CD1-CG 4.15Å; I141-K215 HydrophobicContact CG2-CD 3.76Å; I141-K215 HydrophobicContact CG2-CG 4.21Å; I141-K215 WeakPolarHBondContact O-CE 3.47Å; I141-K215 PolarHBondContact O-NZ 2.84Å; I144-K215 HydrophobicContact CD1-CB 3.62Å; I144-K215 HydrophobicContact CG2-CB 4.42Å; I144-K215 HydrophobicContact CG2-CD 3.93Å; E202-K215 CarbonylContact C-O 3.56Å; E202-K215 WeakPolarHBondContact CA-O 3.45Å; C203-K215 PolarHBondContact N-O 3.09Å; C203-K215 PolarHBondContact O-N 2.74Å
216	T	96.9	Very high	96.8	Very high	83 Å²	83	48.1 Å²	48.1	51%	0.509	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	149.3	-178	54.4	0	0	0	0	111.9	I175 Y201 E202	I175-T216 HydrophobicContact CD1-CG2 3.86Å; Y201-T216 CarbonylContact O-C 3.53Å; Y201-T216 VanDerWaalsContact O-CA 3.25Å; Y201-T216 WeakPolarHBondContact O-CA 3.39Å; E202-T216 HydrophobicContact CB-CG2 4.21Å; E202-T216 HydrophobicContact CG-CG2 4.33Å
217	V	97.1	Very high	96.9	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	134.9	173.4	57.5	0	0	0	0	109.5	S145 S146 L158 W172 Y201	S145-V217 VanDerWaalsContact O-CG2 3.3Å; S145-V217 WeakPolarHBondContact O-CG2 3.36Å; S146-V217 VanDerWaalsContact O-CG2 3.27Å; S146-V217 WeakPolarHBondContact O-CG2 3.31Å; L158-V217 HydrophobicContact CD1-CG1 3.79Å; L158-V217 HydrophobicContact CD2-CG1 4.44Å; L158-V217 HydrophobicContact CD2-CG2 4.45Å; W172-V217 HydrophobicContact CH2-CG1 4.21Å; W172-V217 HydrophobicContact CZ3-CG1 3.88Å; Y201-V217 PolarHBondContact N-O 3.05Å; Y201-V217 PolarHBondContact O-N 2.87Å
218	K	97.7	Very high	96.9	Very high	84 Å²	84	51.1 Å²	51.1	37%	0.365	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	125.6	179.2	-172.8	177.6	-59	-59.1	0	110.9	D147 I148 D200	D147-K218 WeakPolarHBondContact CA-O 3.38Å; D147-K218 HydrophobicContact CB-CB 4.27Å; D147-K218 WeakPolarHBondContact OD1-CB 3.32Å; D147-K218 PolarHBondContact OD1-N 2.72Å; I148-K218 PolarHBondContact N-O 2.97Å; D200-K218 WeakPolarHBondContact OD1-CB 3.3Å; D200-K218 WeakPolarHBondContact OD1-CG 3.17Å; D200-K218 IonicContact OD1-NZ 2.72Å; D200-K218 PolarHBondContact OD1-NZ 2.88Å; D200-K218 IonicContact OD2-NZ 3.56Å; D200-K218 PolarHBondContact OD2-NZ 3.27Å
219	V	97.6	Very high	96.9	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	112.9	172.1	-177.8	0	0	0	0	109.2	I148 L158 I193 A198 G199 Y201 V221	I148-V219 HydrophobicContact CD1-CG1 4.23Å; I148-V219 HydrophobicContact CD1-CG2 4.17Å; I148-V219 HydrophobicContact CG1-CB 4.36Å; I148-V219 HydrophobicContact CG1-CG1 4.17Å; I148-V219 HydrophobicContact CG1-CG2 3.99Å; L158-V219 HydrophobicContact CD1-CG2 3.99Å; L158-V219 HydrophobicContact CD2-CG2 4.28Å; I193-V219 HydrophobicContact CD1-CG1 3.65Å; A198-V219 WeakPolarHBondContact CA-O 3.23Å; G199-V219 PolarHBondContact N-O 2.99Å; G199-V219 PolarHBondContact O-N 3.43Å; Y201-V219 HydrophobicContact CD2-CB 4.06Å; Y201-V219 HydrophobicContact CD2-CG2 3.58Å; Y201-V219 HydrophobicContact CE2-CB 3.89Å; Y201-V219 HydrophobicContact CE2-CG2 3.79Å; Y201-V219 HydrophobicContact CG-CG2 4.49Å; V219-V221 HydrophobicContact CG1-CG2 4.43Å
220	T	97.9	Very high	97.1	Very high	45 Å²	45	47.8 Å²	47.8	28%	0.276	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	127.8	174.5	-57.8	0	0	0	0	110	I148 T149 V150 V250	I148-T220 PolarHBondContact O-N 3.14Å; T149-T220 CarbonylContact C-O 3.54Å; T149-T220 VanDerWaalsContact CA-O 3.29Å; T149-T220 WeakPolarHBondContact CA-O 3.44Å; T149-T220 HydrophobicContact CG2-CG2 4.1Å; V150-T220 PolarHBondContact N-O 3.49Å; T220-V250 HydrophobicContact CG2-CG1 3.85Å
221	V	98.3	Very high	97.2	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.012	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	117	178.2	-176.6	0	0	0	0	109	V150 E152 I193 A198 V219 F223 V250	V150-V221 HydrophobicContact CG2-CG2 4.48Å; V150-V221 CarbonylContact O-C 3.5Å; V150-V221 WeakPolarHBondContact O-CA 3.24Å; E152-V221 HydrophobicContact CB-CG1 3.84Å; E152-V221 HydrophobicContact CG-CG1 4.45Å; I193-V221 HydrophobicContact CD1-CG2 3.85Å; I193-V221 HydrophobicContact CG1-CG2 4.05Å; I193-V221 HydrophobicContact CG2-CG2 4.25Å; A198-V221 HydrophobicContact CB-CB 4.13Å; A198-V221 HydrophobicContact CB-CG2 3.85Å; V219-V221 HydrophobicContact CG1-CG2 4.43Å; V221-F223 WeakPolarHBondContact O-CD1 3.21Å; V221-V250 WeakPolarHBondContact O-CB 3.38Å
222	N	98.5	Very high	97.2	Very high	9 Å²	9	47.8 Å²	47.8	5%	0.048	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	135.4	172.6	-58.1	-46.9	0	0	0	110.1	T149 V150 N151 E152 V250 K301 L302	T149-N222 WeakPolarHBondContact CG2-ND2 3.39Å; T149-N222 WeakPolarHBondContact CG2-OD1 3.36Å; V150-N222 PolarHBondContact O-N 3.41Å; N151-N222 WeakPolarHBondContact OD1-CB 3.4Å; N151-N222 PolarHBondContact OD1-ND2 2.86Å; E152-N222 PolarHBondContact N-O 2.9Å; N222-V250 CarbonylContact C-O 3.59Å; N222-V250 WeakPolarHBondContact CA-O 3.35Å; N222-V250 WeakPolarHBondContact CB-O 3.46Å; N222-K301 PolarHBondContact ND2-NZ 3.41Å; N222-L302 VanDerWaalsContact C-CD1 3.48Å; N222-L302 HydrophobicContact CB-CD1 3.52Å
223	F	98.3	Very high	96.9	Very high	21 Å²	21	50.9 Å²	50.9	9%	0.092	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	151.3	175.7	56.2	-87.9	0	0	0	110.9	E152 R195 V221 A248 A249 V250 N300	E152-F223 HydrophobicContact CB-CB 4.24Å; R195-F223 HydrophobicContact CB-CD1 3.68Å; R195-F223 HydrophobicContact CB-CE1 3.77Å; R195-F223 HydrophobicContact CB-CG 4.28Å; R195-F223 HydrophobicContact CB-CZ 4.43Å; V221-F223 WeakPolarHBondContact O-CD1 3.21Å; F223-A248 HydrophobicContact CE2-CB 4.05Å; F223-A248 HydrophobicContact CZ-CB 4.44Å; F223-A249 VanDerWaalsContact CE2-CA 3.47Å; F223-V250 HydrophobicContact CD1-CB 4.06Å; F223-V250 HydrophobicContact CD1-CG2 4.23Å; F223-V250 HydrophobicContact CE1-CB 3.81Å; F223-V250 HydrophobicContact CE1-CG2 3.47Å; F223-V250 VanDerWaalsContact CE1-CG2 3.47Å; F223-V250 HydrophobicContact CZ-CB 4.44Å; F223-V250 HydrophobicContact CZ-CG2 3.89Å; F223-V250 PolarHBondContact N-O 3.4Å; F223-V250 PolarHBondContact O-N 2.94Å; F223-V250 VanDerWaalsContact O-O 3.09Å; F223-N300 PolarHBondContact O-ND2 2.88Å
224	P	98.2	Very high	96.4	Very high	53 Å²	53	50.4 Å²	50.4	34%	0.344	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	161.8	178.1	29.7	-36.3	0	0	0	111.3	L302	P224-L302 HydrophobicContact CB-CB 4.14Å
225	P	98.2	Very high	96.1	Very high	10 Å²	10	48.1 Å²	48.1	7%	0.065	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	140.3	-178.1	-19.4	34.2	0	0	0	111.8	A248 A249 P253 A298 N300 G303 A305	P225-A248 CarbonylContact C-O 3.53Å; P225-A248 WeakPolarHBondContact CA-O 3.27Å; P225-A249 HydrophobicContact CB-CB 3.98Å; P225-A249 HydrophobicContact CG-CB 4.05Å; P225-P253 HydrophobicContact CB-CB 4.36Å; P225-P253 HydrophobicContact CG-CB 4.25Å; P225-A298 HydrophobicContact CB-CB 3.71Å; P225-A298 HydrophobicContact CG-CB 4.43Å; P225-N300 WeakPolarHBondContact CD-OD1 3.5Å; P225-N300 HydrophobicContact CG-CB 4.1Å; P225-G303 WeakPolarHBondContact CD-O 3.49Å; P225-A305 HydrophobicContact CB-CB 4.33Å; P225-A305 WeakPolarHBondContact O-CB 3.43Å
226	D	97.4	Very high	95.9	Very high	80 Å²	80	45 Å²	45	43%	0.428	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	110.6	175.7	-179.8	22	0	0	0	109.6	R195 H228 A247 A248	R195-D226 IonicContact NH1-OD2 2.64Å; D226-H228 PolarHBondContact O-N 2.68Å; D226-H228 PolarHBondContact O-ND1 3.03Å; D226-A247 CarbonylContact O-C 3.46Å; D226-A247 VanDerWaalsContact O-CA 3.24Å; D226-A247 WeakPolarHBondContact O-CA 3.45Å; D226-A248 PolarHBondContact N-O 2.87Å; D226-A248 PolarHBondContact O-N 3.43Å
227	I	97.9	Very high	95.8	Very high	27 Å²	27	45.9 Å²	45.9	14%	0.138	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	105.3	-178.4	-60.6	172.5	0	0	0	108.4	E246 A247 A298 A305 A307	I227-E246 WeakPolarHBondContact CA-O 3.37Å; I227-A247 HydrophobicContact CG1-CB 3.88Å; I227-A298 HydrophobicContact CD1-CB 4.12Å; I227-A298 HydrophobicContact CG1-CB 4.05Å; I227-A305 HydrophobicContact CD1-CB 4.16Å; I227-A305 WeakPolarHBondContact CD1-O 3.46Å; I227-A305 HydrophobicContact CG1-CB 4.04Å; I227-A307 HydrophobicContact CB-CB 4.28Å; I227-A307 HydrophobicContact CD1-CB 4.12Å; I227-A307 HydrophobicContact CG2-CB 3.71Å
228	H	95.6	Very high	95.7	Very high	115 Å²	115	48.1 Å²	48.1	53%	0.532	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-15.3	-179.6	55	-83	0	0	0	112.7	D226 E246	D226-H228 PolarHBondContact O-N 2.68Å; D226-H228 PolarHBondContact O-ND1 3.03Å; H228-E246 PolarHBondContact N-O 3.13Å
229	E	95.9	Very high	95.6	Very high	52 Å²	52	52.7 Å²	52.7	24%	0.243	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	127.4	176.2	-175.9	165.3	151.9	0	0	112.2	K231 C245 E246	E229-K231 HydrophobicContact CG-CD 4.04Å; E229-K231 HydrophobicContact CG-CG 3.98Å; E229-K231 WeakPolarHBondContact OE1-CD 3.4Å; E229-K231 WeakPolarHBondContact OE1-CE 3.43Å; E229-K231 IonicContact OE1-NZ 3Å; E229-K231 PolarHBondContact OE1-NZ 3.29Å; E229-K231 IonicContact OE2-NZ 2.78Å; E229-K231 PolarHBondContact OE2-NZ 2.78Å; E229-C245 CarbonylContact O-C 3.47Å; E229-C245 WeakPolarHBondContact O-CA 3.35Å; E229-E246 HydrophobicContact CB-CB 4.07Å; E229-E246 HydrophobicContact CB-CG 4.25Å; E229-E246 PolarHBondContact N-O 2.96Å; E229-E246 PolarHBondContact O-N 3.28Å
230	M	96.6	Very high	95.5	Very high	31 Å²	31	56.1 Å²	56.1	15%	0.153	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	113.5	170.7	-178.4	67	172.6	0	0	109	R244 C245 W257 C296 A307 V309	M230-R244 WeakPolarHBondContact CA-O 3.3Å; M230-C245 HydrophobicContact SD-CB 3.73Å; M230-W257 HydrophobicContact CE-CE3 4.24Å; M230-W257 HydrophobicContact CE-CH2 3.57Å; M230-W257 HydrophobicContact CE-CZ3 3.23Å; M230-W257 HydrophobicContact SD-CH2 3.82Å; M230-W257 HydrophobicContact SD-CZ3 4.12Å; M230-C296 HydrophobicContact CE-CB 3.83Å; M230-C296 HydrophobicContact SD-CB 3.71Å; M230-A307 HydrophobicContact CB-CB 3.88Å; M230-A307 HydrophobicContact CG-CB 4.1Å; M230-V309 HydrophobicContact CE-CB 4.23Å; M230-V309 HydrophobicContact CE-CG1 3.51Å; M230-V309 HydrophobicContact CG-CB 3.89Å; M230-V309 HydrophobicContact CG-CG1 4.01Å; M230-V309 HydrophobicContact SD-CG1 4.39Å
231	K	95.2	Very high	95.4	Very high	103 Å²	103	54 Å²	54	45%	0.448	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	142.4	-173.5	-65.5	-177.6	-172.8	149.6	0	112.2	E229 L243 R244	E229-K231 HydrophobicContact CG-CD 4.04Å; E229-K231 HydrophobicContact CG-CG 3.98Å; E229-K231 WeakPolarHBondContact OE1-CD 3.4Å; E229-K231 WeakPolarHBondContact OE1-CE 3.43Å; E229-K231 IonicContact OE1-NZ 3Å; E229-K231 PolarHBondContact OE1-NZ 3.29Å; E229-K231 IonicContact OE2-NZ 2.78Å; E229-K231 PolarHBondContact OE2-NZ 2.78Å; K231-L243 WeakPolarHBondContact O-CA 3.47Å; K231-R244 PolarHBondContact N-O 3.19Å; K231-R244 PolarHBondContact O-N 2.74Å
232	S	94.4	Very high	95.3	Very high	28 Å²	28	57.2 Å²	57.2	20%	0.196	31%	0.308	C	S	.	.			trans	-130.4	164.7	167.1	65.3	0	0	0	0	108.9	V309 P310	S232-V309 VanDerWaalsContact OG-CG2 3.31Å; S232-V309 WeakPolarHBondContact OG-CG2 3.11Å; S232-P310 PolarHBondContact OG-O 3.36Å
233	H	89.6	Confident	95.2	Very high	126 Å²	126	56.8 Å²	56.8	58%	0.583	31%	0.306	S	S	*	.			trans	-123.5	153	171.7	-64	82.7	0	0	0	109.4	V235 L311	H233-V235 WeakPolarHBondContact O-CG2 3.48Å; H233-V235 PolarHBondContact O-N 2.79Å; H233-L311 WeakPolarHBondContact O-CD1 3.47Å
234	G	87.3	Confident	95.2	Very high	41 Å²	41	61.4 Å²	61.4	42%	0.423	32%	0.323	S	S	.	.			trans	-66.1	125.1	172.8	0	0	0	0	0	110.6	I312	G234-I312 VanDerWaalsContact CA-O 3.28Å; G234-I312 WeakPolarHBondContact CA-O 3.23Å
235	V	92.6	Very high	95.2	Very high	19 Å²	19	58.9 Å²	58.9	12%	0.115	31%	0.306	C	S	.	.			trans	-133.5	128.3	-172.5	175.4	0	0	0	0	109.4	H233 R239 A241 M286 Y291 I312	H233-V235 WeakPolarHBondContact O-CG2 3.48Å; H233-V235 PolarHBondContact O-N 2.79Å; V235-R239 HydrophobicContact CG1-CB 3.69Å; V235-A241 HydrophobicContact CB-CB 4.07Å; V235-A241 HydrophobicContact CG1-CB 4.12Å; V235-A241 HydrophobicContact CG2-CB 3.93Å; V235-M286 HydrophobicContact CG1-CG 3.9Å; V235-Y291 VanDerWaalsContact O-CE1 3.32Å; V235-Y291 WeakPolarHBondContact O-CE1 3.48Å; V235-Y291 PolarHBondContact O-OH 2.69Å; V235-I312 PolarHBondContact N-O 2.78Å
236	G	93.1	Very high	95.2	Very high	15 Å²	15	59.7 Å²	59.7	16%	0.155	31%	0.309	C	S	.	.			trans	-73.9	164.7	-180	0	0	0	0	0	113.1	R239 P314	G236-R239 WeakPolarHBondContact O-CB 3.45Å; G236-R239 PolarHBondContact O-N 2.72Å; G236-P314 VanDerWaalsContact N-CG 3.27Å
237	L	95.3	Very high	95.2	Very high	101 Å²	101	55.9 Å²	55.9	53%	0.529	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	149	177.1	-63	174.6	0	0	0	112.2	R239 M286 E288 Y291	L237-R239 PolarHBondContact O-N 3.44Å; L237-M286 CarbonylContact C-O 3.59Å; L237-M286 WeakPolarHBondContact CA-O 3.35Å; L237-E288 HydrophobicContact CD2-CG 4.23Å; L237-Y291 HydrophobicContact CD2-CE2 3.89Å
238	G	93.7	Very high	95.1	Very high	47 Å²	47	56.2 Å²	56.2	49%	0.485	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	-10.5	-178.5	0	0	0	0	0	115.2	M286	G238-M286 PolarHBondContact N-O 2.84Å
239	R	95.4	Very high	95.2	Very high	180 Å²	180	51.2 Å²	51.2	68%	0.679	28%	0.275	S	S	*	.	S	Bend	trans	-88.4	175.8	-180	-59	-165.7	178.1	-160.4	-0.5	112.2	V235 G236 L237 N285 M286	V235-R239 HydrophobicContact CG1-CB 3.69Å; G236-R239 WeakPolarHBondContact O-CB 3.45Å; G236-R239 PolarHBondContact O-N 2.72Å; L237-R239 PolarHBondContact O-N 3.44Å; R239-N285 PolarHBondContact O-N 2.9Å; R239-M286 VanDerWaalsContact O-CG 3.31Å; R239-M286 WeakPolarHBondContact O-CG 3.48Å; R239-M286 PolarHBondContact O-N 2.87Å
240	T	95.8	Very high	95.3	Very high	73 Å²	73	50.9 Å²	50.9	45%	0.448	28%	0.276	S	S	.	.			trans	-99.5	126.9	175.1	-61.2	0	0	0	0	110.4	T282 V283 T284	T240-T282 HydrophobicContact CG2-CG2 3.48Å; T240-T282 VanDerWaalsContact CG2-CG2 3.48Å; T240-V283 CarbonylContact C-O 3.56Å; T240-V283 WeakPolarHBondContact CA-O 3.18Å; T240-T284 HydrophobicContact CG2-CG2 4Å
241	A	96	Very high	95.3	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	148.1	172.8	0	0	0	0	0	112.1	V235 T282 V283 M286 L311	V235-A241 HydrophobicContact CB-CB 4.07Å; V235-A241 HydrophobicContact CG1-CB 4.12Å; V235-A241 HydrophobicContact CG2-CB 3.93Å; A241-T282 WeakPolarHBondContact O-CA 3.09Å; A241-V283 HydrophobicContact CB-CB 4.36Å; A241-V283 PolarHBondContact N-O 2.78Å; A241-V283 PolarHBondContact O-N 2.87Å; A241-M286 HydrophobicContact CB-CG 4.04Å; A241-M286 HydrophobicContact CB-SD 3.79Å; A241-L311 HydrophobicContact CB-CD1 3.87Å; A241-L311 HydrophobicContact CB-CD2 3.81Å; A241-L311 HydrophobicContact CB-CG 4.46Å
242	L	96	Very high	95.4	Very high	71 Å²	71	50.7 Å²	50.7	37%	0.372	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	125.6	177	-64.8	175.5	0	0	0	109.3	V280 L281 T282	L242-V280 HydrophobicContact CD2-CG1 4.24Å; L242-L281 WeakPolarHBondContact CA-O 3.46Å; L242-T282 HydrophobicContact CD2-CG2 3.8Å; L242-T282 VanDerWaalsContact CD2-OG1 3.29Å; L242-T282 WeakPolarHBondContact CD2-OG1 3.26Å
243	L	97.4	Very high	95.5	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	135.7	170.9	-58.7	83.9	0	0	0	108.3	K231 W257 V280 L281 V283 Y294 V309 L311	K231-L243 WeakPolarHBondContact O-CA 3.47Å; L243-W257 HydrophobicContact CB-CH2 3.63Å; L243-W257 HydrophobicContact CB-CZ3 3.7Å; L243-W257 HydrophobicContact CD2-CZ3 4.06Å; L243-V280 CarbonylContact O-C 3.49Å; L243-V280 WeakPolarHBondContact O-CA 3.29Å; L243-L281 HydrophobicContact CB-CB 4.3Å; L243-L281 HydrophobicContact CD1-CD2 4.16Å; L243-L281 HydrophobicContact CD1-CG 4.36Å; L243-L281 PolarHBondContact N-O 2.87Å; L243-L281 PolarHBondContact O-N 3.15Å; L243-V283 HydrophobicContact CD1-CG2 4.33Å; L243-Y294 VanDerWaalsContact CD2-CB 3.4Å; L243-Y294 HydrophobicContact CD2-CD1 4.23Å; L243-Y294 HydrophobicContact CD2-CD2 3.84Å; L243-Y294 HydrophobicContact CD2-CG 3.56Å; L243-V309 HydrophobicContact CD2-CG1 3.89Å; L243-L311 HydrophobicContact CD1-CD2 4.31Å
244	R	97.4	Very high	95.9	Very high	117 Å²	117	48.1 Å²	48.1	44%	0.442	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	135.5	-177.7	-62.6	-174.7	179.7	163.6	0.7	109.6	M230 K231 V280	M230-R244 WeakPolarHBondContact CA-O 3.3Å; K231-R244 PolarHBondContact N-O 3.19Å; K231-R244 PolarHBondContact O-N 2.74Å; R244-V280 HydrophobicContact CG-CG1 4.39Å; R244-V280 HydrophobicContact CG-CG2 4.21Å
245	C	97.9	Very high	96.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	126.6	178	-179.7	0	0	0	0	108.7	E229 M230 W257 R278 S279 C296	E229-C245 CarbonylContact O-C 3.47Å; E229-C245 WeakPolarHBondContact O-CA 3.35Å; M230-C245 HydrophobicContact SD-CB 3.73Å; C245-W257 HydrophobicContact CB-CH2 3.85Å; C245-W257 HydrophobicContact CB-CZ2 3.6Å; C245-R278 CarbonylContact O-C 3.56Å; C245-R278 WeakPolarHBondContact O-CA 3.29Å; C245-S279 PolarHBondContact N-O 3.35Å; C245-S279 PolarHBondContact O-N 3.19Å; C245-C296 HydrophobicContact CB-CB 3.57Å; C245-C296 WeakPolarHBondContact CB-SG 3.49Å; C245-C296 WeakPolarHBondContact SG-CB 3.22Å; C245-C296 CovalentContact SG-SG 2.04Å; C245-C296 PolarHBondContact SG-SG 2.78Å
246	E	98	Very high	96.6	Very high	27 Å²	27	47.9 Å²	47.9	13%	0.126	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	128.5	177.4	-48.9	-166.5	-176.4	0	0	110.3	I227 H228 E229 S277 R278	I227-E246 WeakPolarHBondContact CA-O 3.37Å; H228-E246 PolarHBondContact N-O 3.13Å; E229-E246 HydrophobicContact CB-CB 4.07Å; E229-E246 HydrophobicContact CB-CG 4.25Å; E229-E246 PolarHBondContact N-O 2.96Å; E229-E246 PolarHBondContact O-N 3.28Å; E246-S277 CarbonylContact C-O 3.09Å; E246-S277 VanDerWaalsContact CA-O 3.31Å; E246-S277 WeakPolarHBondContact CA-O 3.4Å; E246-R278 HydrophobicContact CG-CB 4.34Å; E246-R278 HydrophobicContact CG-CG 4.15Å; E246-R278 IonicContact OE1-CZ 2.74Å; E246-R278 IonicContact OE1-NE 3.45Å; E246-R278 PolarHBondContact OE1-NE 3.33Å; E246-R278 IonicContact OE1-NH2 3.29Å; E246-R278 PolarHBondContact OE1-NH2 2.79Å; E246-R278 IonicContact OE2-NE 3.73Å; E246-R278 IonicContact OE2-NH2 3.7Å; E246-R278 PolarHBondContact OE2-NH2 2.76Å
247	A	97.8	Very high	96.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	129.1	-177.6	0	0	0	0	0	110.6	D226 I227 P253 F255 S277 A298	D226-A247 CarbonylContact O-C 3.46Å; D226-A247 VanDerWaalsContact O-CA 3.24Å; D226-A247 WeakPolarHBondContact O-CA 3.45Å; I227-A247 HydrophobicContact CG1-CB 3.88Å; A247-P253 HydrophobicContact CB-CG 4.23Å; A247-F255 HydrophobicContact CB-CE1 3.8Å; A247-F255 HydrophobicContact CB-CZ 3.74Å; A247-S277 PolarHBondContact N-O 2.85Å; A247-S277 WeakPolarHBondContact O-CA 3.22Å; A247-S277 WeakPolarHBondContact O-CB 3.42Å; A247-A298 HydrophobicContact CB-CB 3.62Å
248	A	97.1	Very high	97	Very high	34 Å²	34	45.1 Å²	45.1	28%	0.281	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	128.9	168.9	0	0	0	0	0	108.6	F223 P225 D226	F223-A248 HydrophobicContact CE2-CB 4.05Å; F223-A248 HydrophobicContact CZ-CB 4.44Å; P225-A248 CarbonylContact C-O 3.53Å; P225-A248 WeakPolarHBondContact CA-O 3.27Å; D226-A248 PolarHBondContact N-O 2.87Å; D226-A248 PolarHBondContact O-N 3.43Å
249	A	97.3	Very high	97.1	Very high	11 Å²	11	46.2 Å²	46.2	9%	0.091	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	147.5	173.4	0	0	0	0	0	110.8	F223 P225 P251 P253	F223-A249 VanDerWaalsContact CE2-CA 3.47Å; P225-A249 HydrophobicContact CB-CB 3.98Å; P225-A249 HydrophobicContact CG-CB 4.05Å; A249-P251 CarbonylContact C-O 3.55Å; A249-P251 CarbonylContact O-C 3.47Å; A249-P253 HydrophobicContact CB-CB 4Å; A249-P253 HydrophobicContact CB-CG 3.95Å
250	V	97.7	Very high	96.8	Very high	45 Å²	45	40.3 Å²	40.3	27%	0.273	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	120.7	168.4	178	0	0	0	0	108.6	T220 V221 N222 F223 N300	T220-V250 HydrophobicContact CG2-CG1 3.85Å; V221-V250 WeakPolarHBondContact O-CB 3.38Å; N222-V250 CarbonylContact C-O 3.59Å; N222-V250 WeakPolarHBondContact CA-O 3.35Å; N222-V250 WeakPolarHBondContact CB-O 3.46Å; F223-V250 HydrophobicContact CD1-CB 4.06Å; F223-V250 HydrophobicContact CD1-CG2 4.23Å; F223-V250 HydrophobicContact CE1-CB 3.81Å; F223-V250 HydrophobicContact CE1-CG2 3.47Å; F223-V250 VanDerWaalsContact CE1-CG2 3.47Å; F223-V250 HydrophobicContact CZ-CB 4.44Å; F223-V250 HydrophobicContact CZ-CG2 3.89Å; F223-V250 PolarHBondContact N-O 3.4Å; F223-V250 PolarHBondContact O-N 2.94Å; F223-V250 VanDerWaalsContact O-O 3.09Å; V250-N300 PolarHBondContact O-ND2 2.87Å
251	P	97.2	Very high	96.6	Very high	52 Å²	52	46.2 Å²	46.2	34%	0.338	26%	0.255	S	S	.	.	S	Bend	cis	-61.6	162.3	-6.2	-21.5	34.1	0	0	0	113	A249 N300 K301	A249-P251 CarbonylContact C-O 3.55Å; A249-P251 CarbonylContact O-C 3.47Å; P251-N300 WeakPolarHBondContact O-CB 3.41Å; P251-N300 PolarHBondContact O-ND2 2.97Å; P251-N300 VanDerWaalsContact O-ND2 3.15Å; P251-K301 HydrophobicContact CG-CD 4Å; P251-K301 HydrophobicContact CG-CG 4.35Å
252	S	95.8	Very high	96.5	Very high	77 Å²	77	54.1 Å²	54.1	54%	0.538	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-50.7	138.7	-179.1	-59.2	0	0	0	0	112
253	P	97.5	Very high	96.6	Very high	12 Å²	12	56.7 Å²	56.7	8%	0.078	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-79.9	153.6	-174.9	32.3	-31.1	0	0	0	111.7	P225 A247 A249 F255 A298 I299	P225-P253 HydrophobicContact CB-CB 4.36Å; P225-P253 HydrophobicContact CG-CB 4.25Å; A247-P253 HydrophobicContact CB-CG 4.23Å; A249-P253 HydrophobicContact CB-CB 4Å; A249-P253 HydrophobicContact CB-CG 3.95Å; P253-F255 HydrophobicContact CB-CE2 4.47Å; P253-F255 HydrophobicContact CG-CE2 3.79Å; P253-F255 HydrophobicContact CG-CZ 3.87Å; P253-A298 HydrophobicContact CB-CB 4.16Å; P253-I299 CarbonylContact C-O 3.57Å; P253-I299 VanDerWaalsContact CA-O 3.31Å; P253-I299 WeakPolarHBondContact CA-O 3.5Å
254	T	97.1	Very high	96.5	Very high	89 Å²	89	57.8 Å²	57.8	55%	0.546	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	152.7	159.7	56.3	0	0	0	0	109.2	A298 I299	T254-A298 CarbonylContact O-C 3.57Å; T254-A298 WeakPolarHBondContact O-CA 3.3Å; T254-I299 PolarHBondContact N-O 3.18Å; T254-I299 PolarHBondContact O-N 2.68Å; T254-I299 PolarHBondContact OG1-O 2.76Å
255	F	97.7	Very high	96.4	Very high	15 Å²	15	58 Å²	58	7%	0.066	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	140.7	-175.2	-71.2	-89.8	0	0	0	112.3	A247 P253 S277 S279 V297 A298	A247-F255 HydrophobicContact CB-CE1 3.8Å; A247-F255 HydrophobicContact CB-CZ 3.74Å; P253-F255 HydrophobicContact CB-CE2 4.47Å; P253-F255 HydrophobicContact CG-CE2 3.79Å; P253-F255 HydrophobicContact CG-CZ 3.87Å; F255-S277 WeakPolarHBondContact CZ-O 3.35Å; F255-S279 VanDerWaalsContact CG-CB 3.42Å; F255-V297 CarbonylContact C-O 3.57Å; F255-V297 WeakPolarHBondContact CA-O 3.48Å; F255-A298 HydrophobicContact CD1-CB 4.06Å; F255-A298 HydrophobicContact CE1-CB 3.81Å; F255-A298 HydrophobicContact CZ-CB 4.46Å
256	E	97.3	Very high	96.2	Very high	40 Å²	40	65.4 Å²	65.4	19%	0.187	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	150.4	170.8	-52.5	-163.1	132.8	0	0	110.4	Y258 R263 C296 V297 I299	E256-Y258 HydrophobicContact CB-CD2 4.43Å; E256-Y258 HydrophobicContact CB-CE2 3.67Å; E256-Y258 PolarHBondContact OE2-OH 2.81Å; E256-R263 IonicContact OE1-CZ 2.72Å; E256-R263 VanDerWaalsContact OE1-CZ 3.27Å; E256-R263 IonicContact OE1-NE 3.33Å; E256-R263 PolarHBondContact OE1-NE 2.93Å; E256-R263 IonicContact OE1-NH2 2.66Å; E256-R263 PolarHBondContact OE1-NH2 2.99Å; E256-R263 IonicContact OE2-NE 2.69Å; E256-C296 CarbonylContact O-C 3.59Å; E256-V297 HydrophobicContact CB-CB 4.36Å; E256-V297 PolarHBondContact N-O 3.22Å; E256-V297 PolarHBondContact O-N 2.77Å; E256-I299 HydrophobicContact CG-CD1 4.13Å
257	W	98.1	Very high	95.9	Very high	1 Å²	1	65.8 Å²	65.8	0%	0.004	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	143.5	177.7	-74.3	88	0	0	0	110.3	M230 L243 C245 I264 I272 S279 L281 T295 C296	M230-W257 HydrophobicContact CE-CE3 4.24Å; M230-W257 HydrophobicContact CE-CH2 3.57Å; M230-W257 HydrophobicContact CE-CZ3 3.23Å; M230-W257 HydrophobicContact SD-CH2 3.82Å; M230-W257 HydrophobicContact SD-CZ3 4.12Å; L243-W257 HydrophobicContact CB-CH2 3.63Å; L243-W257 HydrophobicContact CB-CZ3 3.7Å; L243-W257 HydrophobicContact CD2-CZ3 4.06Å; C245-W257 HydrophobicContact CB-CH2 3.85Å; C245-W257 HydrophobicContact CB-CZ2 3.6Å; W257-I264 HydrophobicContact CB-CB 4.14Å; W257-I264 HydrophobicContact CB-CD1 4.19Å; W257-I264 WeakPolarHBondContact O-CB 3.34Å; W257-I264 PolarHBondContact O-N 2.87Å; W257-I272 HydrophobicContact CB-CD1 4.42Å; W257-S279 PolarHBondContact NE1-OG 2.83Å; W257-L281 HydrophobicContact CB-CD2 4.28Å; W257-L281 HydrophobicContact CD2-CB 3.62Å; W257-L281 HydrophobicContact CD2-CD2 3.85Å; W257-L281 HydrophobicContact CD2-CG 4.28Å; W257-L281 HydrophobicContact CE3-CB 3.9Å; W257-L281 HydrophobicContact CE3-CD2 3.54Å; W257-L281 HydrophobicContact CE3-CG 4.35Å; W257-L281 HydrophobicContact CG-CB 4.08Å; W257-L281 HydrophobicContact CG-CD2 4.16Å; W257-L281 HydrophobicContact CG-CG 4.49Å; W257-L281 HydrophobicContact CH2-CB 4.15Å; W257-L281 HydrophobicContact CZ2-CB 3.9Å; W257-L281 HydrophobicContact CZ3-CB 4.12Å; W257-L281 HydrophobicContact CZ3-CD2 4.11Å; W257-T295 CarbonylContact C-O 3.59Å; W257-T295 WeakPolarHBondContact CA-O 3.02Å; W257-C296 HydrophobicContact CD2-CB 4.4Å; W257-C296 HydrophobicContact CE3-CB 4.25Å; W257-C296 HydrophobicContact CH2-CB 4.08Å; W257-C296 HydrophobicContact CZ2-CB 4.21Å; W257-C296 HydrophobicContact CZ3-CB 4.13Å
258	Y	98.2	Very high	95.4	Very high	56 Å²	56	74.6 Å²	74.6	22%	0.22	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	149.8	-178.9	-67.6	-102	0	0	0	110.3	E256 K262 R263 Y294 T295 V297	E256-Y258 HydrophobicContact CB-CD2 4.43Å; E256-Y258 HydrophobicContact CB-CE2 3.67Å; E256-Y258 PolarHBondContact OE2-OH 2.81Å; Y258-K262 WeakPolarHBondContact CA-O 3.36Å; Y258-R263 HydrophobicContact CD1-CB 3.99Å; Y258-R263 HydrophobicContact CE1-CB 3.54Å; Y258-R263 HydrophobicContact CE1-CG 4.01Å; Y258-R263 HydrophobicContact CE2-CG 4.43Å; Y258-Y294 CarbonylContact O-C 3.55Å; Y258-Y294 VanDerWaalsContact O-CA 3.3Å; Y258-Y294 WeakPolarHBondContact O-CA 3.31Å; Y258-T295 PolarHBondContact N-O 2.88Å; Y258-T295 PolarHBondContact O-N 2.91Å; Y258-V297 HydrophobicContact CD2-CG2 3.76Å; Y258-V297 HydrophobicContact CE2-CB 4.36Å; Y258-V297 HydrophobicContact CE2-CG2 3.76Å
259	K	95.6	Very high	95.1	Very high	70 Å²	70	74.3 Å²	74.3	30%	0.304	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	110.8	165.3	-174.8	176.6	-163	-96.7	0	107.6	E261 K262 I264 D289 R290 Y291 Y294	K259-E261 PolarHBondContact O-N 3.06Å; K259-K262 PolarHBondContact N-O 2.9Å; K259-K262 PolarHBondContact O-N 2.87Å; K259-I264 HydrophobicContact CB-CD1 4.08Å; K259-I264 HydrophobicContact CB-CG1 4.37Å; K259-D289 PolarHBondContact NZ-O 3.02Å; K259-R290 WeakPolarHBondContact CE-O 3.41Å; K259-Y291 WeakPolarHBondContact CE-O 3.39Å; K259-Y291 PolarHBondContact NZ-O 2.84Å; K259-Y294 HydrophobicContact CB-CD1 4.35Å; K259-Y294 HydrophobicContact CB-CE1 4.22Å; K259-Y294 HydrophobicContact CD-CE1 4.12Å; K259-Y294 HydrophobicContact CD-CE2 4.34Å; K259-Y294 HydrophobicContact CG-CE1 4.37Å
260	G	89.7	Confident	95	Very high	56 Å²	56	75.2 Å²	75.2	58%	0.577	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	-129.1	-161.3	0	0	0	0	0	110.3
261	E	91.1	Very high	95	Very high	197 Å²	197	75.9 Å²	75.9	92%	0.921	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-8.2	179.4	-59.7	-172.4	160.9	0	0	113.7	K259	K259-E261 PolarHBondContact O-N 3.06Å
262	K	94.9	Very high	95	Very high	167 Å²	167	74.1 Å²	74.1	73%	0.726	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	122.3	-173.8	-167.2	176	-179	178.6	0	111.1	Y258 K259 I264	Y258-K262 WeakPolarHBondContact CA-O 3.36Å; K259-K262 PolarHBondContact N-O 2.9Å; K259-K262 PolarHBondContact O-N 2.87Å; K262-I264 PolarHBondContact O-N 3.04Å
263	R	96.9	Very high	94.9	Very high	125 Å²	125	76.5 Å²	76.5	47%	0.472	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	129.7	171.7	-168.6	174.9	-178	-114.7	7	110.3	E256 Y258	E256-R263 IonicContact OE1-CZ 2.72Å; E256-R263 VanDerWaalsContact OE1-CZ 3.27Å; E256-R263 IonicContact OE1-NE 3.33Å; E256-R263 PolarHBondContact OE1-NE 2.93Å; E256-R263 IonicContact OE1-NH2 2.66Å; E256-R263 PolarHBondContact OE1-NH2 2.99Å; E256-R263 IonicContact OE2-NE 2.69Å; Y258-R263 HydrophobicContact CD1-CB 3.99Å; Y258-R263 HydrophobicContact CE1-CB 3.54Å; Y258-R263 HydrophobicContact CE1-CG 4.01Å; Y258-R263 HydrophobicContact CE2-CG 4.43Å
264	I	96.6	Very high	94.8	Very high	23 Å²	23	79.6 Å²	79.6	12%	0.118	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-85.1	131.7	176.5	-60.6	176.5	0	0	0	108.5	W257 K259 K262 I270 I272 L281 Y294	W257-I264 HydrophobicContact CB-CB 4.14Å; W257-I264 HydrophobicContact CB-CD1 4.19Å; W257-I264 WeakPolarHBondContact O-CB 3.34Å; W257-I264 PolarHBondContact O-N 2.87Å; K259-I264 HydrophobicContact CB-CD1 4.08Å; K259-I264 HydrophobicContact CB-CG1 4.37Å; K262-I264 PolarHBondContact O-N 3.04Å; I264-I270 HydrophobicContact CG2-CG2 3.57Å; I264-I272 HydrophobicContact CG2-CD1 4.39Å; I264-L281 HydrophobicContact CD1-CD2 3.92Å; I264-L281 HydrophobicContact CG2-CD1 4.13Å; I264-Y294 HydrophobicContact CD1-CD1 3.55Å; I264-Y294 HydrophobicContact CD1-CE1 3.58Å
265	I	94.2	Very high	94.5	Very high	121 Å²	121	80.3 Å²	80.3	62%	0.621	40%	0.403	S	S	*	.			trans	-121	148.3	179	-52.8	174.3	0	0	0	107.6
266	R	93.8	Very high	94.1	Very high	156 Å²	156	83.5 Å²	83.5	59%	0.589	43%	0.427	S	S	*	.	S	Bend	trans	-57.6	143.2	176	-68.1	-177.8	177.5	159.8	-2.4	111.1	D271 I272	R266-D271 IonicContact NE-OD1 2.98Å; R266-I272 HydrophobicContact CG-CB 4.3Å; R266-I272 HydrophobicContact CG-CG1 4.45Å; R266-I272 VanDerWaalsContact CZ-O 3.25Å; R266-I272 PolarHBondContact NE-O 2.9Å; R266-I272 PolarHBondContact NH2-O 3.31Å
267	G	91.4	Very high	93.9	Very high	35 Å²	35	84.1 Å²	84.1	36%	0.361	44%	0.436	S	S	.	.	B	Isolated β-bridge	trans	126.3	167.4	-179.6	0	0	0	0	0	113.2	G269 I270	G267-G269 VanDerWaalsContact C-N 3.3Å; G267-G269 PolarHBondContact O-N 3.14Å; G267-I270 PolarHBondContact N-O 3.11Å; G267-I270 VanDerWaalsContact O-CB 3.29Å; G267-I270 WeakPolarHBondContact O-CB 3.43Å; G267-I270 PolarHBondContact O-N 3.38Å
268	H	89.1	Confident	93.9	Very high	184 Å²	184	89.3 Å²	89.3	85%	0.852	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	43.8	177	-57.1	-76	0	0	0	115	R290	H268-R290 PolarHBondContact O-NH2 2.75Å
269	G	89.8	Confident	93.8	Very high	29 Å²	29	86.7 Å²	86.7	30%	0.299	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	15.2	-177.9	0	0	0	0	0	114.5	G267 T284	G267-G269 VanDerWaalsContact C-N 3.3Å; G267-G269 PolarHBondContact O-N 3.14Å; G269-T284 WeakPolarHBondContact CA-OG1 3.26Å; G269-T284 PolarHBondContact O-N 3.33Å; G269-T284 PolarHBondContact O-OG1 2.8Å; G269-T284 VanDerWaalsContact O-OG1 3.12Å
270	I	95.9	Very high	93.9	Very high	30 Å²	30	84.7 Å²	84.7	15%	0.154	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	127.9	170.8	-56.1	-66.8	0	0	0	109.9	I264 G267 I272 L281 T282 V283	I264-I270 HydrophobicContact CG2-CG2 3.57Å; G267-I270 PolarHBondContact N-O 3.11Å; G267-I270 VanDerWaalsContact O-CB 3.29Å; G267-I270 WeakPolarHBondContact O-CB 3.43Å; G267-I270 PolarHBondContact O-N 3.38Å; I270-I272 HydrophobicContact CG2-CG1 4.43Å; I270-L281 HydrophobicContact CG2-CD1 3.6Å; I270-T282 WeakPolarHBondContact CA-O 3.44Å; I270-V283 HydrophobicContact CD1-CB 4.04Å; I270-V283 HydrophobicContact CD1-CG1 3.74Å; I270-V283 HydrophobicContact CD1-CG2 3.71Å
271	D	96.7	Very high	94.3	Very high	58 Å²	58	82 Å²	82	31%	0.31	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	146.5	168.1	-176.3	33.8	0	0	0	110.6	R266 K273 T282	R266-D271 IonicContact NE-OD1 2.98Å; D271-K273 WeakPolarHBondContact OD2-CE 3.37Å; D271-T282 PolarHBondContact N-O 2.85Å; D271-T282 PolarHBondContact O-N 2.92Å
272	I	96.8	Very high	94.6	Very high	16 Å²	16	73.8 Å²	73.8	8%	0.082	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	118.4	179.8	-60.9	171.6	0	0	0	107.5	W257 I264 R266 I270 V280 L281	W257-I272 HydrophobicContact CB-CD1 4.42Å; I264-I272 HydrophobicContact CG2-CD1 4.39Å; R266-I272 HydrophobicContact CG-CB 4.3Å; R266-I272 HydrophobicContact CG-CG1 4.45Å; R266-I272 VanDerWaalsContact CZ-O 3.25Å; R266-I272 PolarHBondContact NE-O 2.9Å; R266-I272 PolarHBondContact NH2-O 3.31Å; I270-I272 HydrophobicContact CG2-CG1 4.43Å; I272-V280 WeakPolarHBondContact CA-O 3.39Å; I272-L281 HydrophobicContact CD1-CD1 4.35Å; I272-L281 HydrophobicContact CG1-CD1 3.73Å
273	K	95.3	Very high	94.7	Very high	126 Å²	126	65.8 Å²	65.8	55%	0.548	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	118.8	177	-64.7	-173.3	-177.8	-177.4	0	110	D271 S279 V280	D271-K273 WeakPolarHBondContact OD2-CE 3.37Å; K273-S279 CarbonylContact O-C 3.52Å; K273-S279 WeakPolarHBondContact O-CA 3.46Å; K273-V280 PolarHBondContact N-O 2.89Å; K273-V280 PolarHBondContact O-N 3.11Å
274	N	93.8	Very high	94.7	Very high	78 Å²	78	62.3 Å²	62.3	42%	0.417	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	128.9	177.6	-62.7	-22.2	0	0	0	109	S279	N274-S279 VanDerWaalsContact OD1-CB 3.31Å; N274-S279 WeakPolarHBondContact OD1-CB 3.35Å; N274-S279 PolarHBondContact OD1-OG 2.99Å
275	V	90.8	Very high	94.6	Very high	104 Å²	104	66.1 Å²	66.1	63%	0.63	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.9	102.2	179.8	-176.5	0	0	0	0	108.5	S277 R278	V275-S277 PolarHBondContact O-N 2.86Å; V275-R278 PolarHBondContact N-O 2.75Å; V275-R278 PolarHBondContact O-N 3.24Å
276	S	89.4	Confident	94.6	Very high	82 Å²	82	60.5 Å²	60.5	57%	0.573	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	-102.5	179.4	-173.6	0	0	0	0	112.7
277	S	94.7	Very high	94.6	Very high	53 Å²	53	55.4 Å²	55.4	37%	0.371	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	2.4	-179.6	54.4	0	0	0	0	114.9	E246 A247 F255 V275	E246-S277 CarbonylContact C-O 3.09Å; E246-S277 VanDerWaalsContact CA-O 3.31Å; E246-S277 WeakPolarHBondContact CA-O 3.4Å; A247-S277 PolarHBondContact N-O 2.85Å; A247-S277 WeakPolarHBondContact O-CA 3.22Å; A247-S277 WeakPolarHBondContact O-CB 3.42Å; F255-S277 WeakPolarHBondContact CZ-O 3.35Å; V275-S277 PolarHBondContact O-N 2.86Å
278	R	96.4	Very high	94.7	Very high	110 Å²	110	61.1 Å²	61.1	42%	0.415	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	138.7	-175	179.4	-177.8	-71.5	158.2	2.1	112	C245 E246 V275 V280	C245-R278 CarbonylContact O-C 3.56Å; C245-R278 WeakPolarHBondContact O-CA 3.29Å; E246-R278 HydrophobicContact CG-CB 4.34Å; E246-R278 HydrophobicContact CG-CG 4.15Å; E246-R278 IonicContact OE1-CZ 2.74Å; E246-R278 IonicContact OE1-NE 3.45Å; E246-R278 PolarHBondContact OE1-NE 3.33Å; E246-R278 IonicContact OE1-NH2 3.29Å; E246-R278 PolarHBondContact OE1-NH2 2.79Å; E246-R278 IonicContact OE2-NE 3.73Å; E246-R278 IonicContact OE2-NH2 3.7Å; E246-R278 PolarHBondContact OE2-NH2 2.76Å; V275-R278 PolarHBondContact N-O 2.75Å; V275-R278 PolarHBondContact O-N 3.24Å; R278-V280 HydrophobicContact CG-CG2 4.19Å
279	S	97.8	Very high	94.9	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	137.5	166.8	-171.7	0	0	0	0	111.3	C245 F255 W257 K273 N274	C245-S279 PolarHBondContact N-O 3.35Å; C245-S279 PolarHBondContact O-N 3.19Å; F255-S279 VanDerWaalsContact CG-CB 3.42Å; W257-S279 PolarHBondContact NE1-OG 2.83Å; K273-S279 CarbonylContact O-C 3.52Å; K273-S279 WeakPolarHBondContact O-CA 3.46Å; N274-S279 VanDerWaalsContact OD1-CB 3.31Å; N274-S279 WeakPolarHBondContact OD1-CB 3.35Å; N274-S279 PolarHBondContact OD1-OG 2.99Å
280	V	97.6	Very high	95.1	Very high	28 Å²	28	59 Å²	59	17%	0.17	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	116.9	177.5	-174.8	0	0	0	0	109.4	L242 L243 R244 I272 K273 R278	L242-V280 HydrophobicContact CD2-CG1 4.24Å; L243-V280 CarbonylContact O-C 3.49Å; L243-V280 WeakPolarHBondContact O-CA 3.29Å; R244-V280 HydrophobicContact CG-CG1 4.39Å; R244-V280 HydrophobicContact CG-CG2 4.21Å; I272-V280 WeakPolarHBondContact CA-O 3.39Å; K273-V280 PolarHBondContact N-O 2.89Å; K273-V280 PolarHBondContact O-N 3.11Å; R278-V280 HydrophobicContact CG-CG2 4.19Å
281	L	97.7	Very high	95	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	123.8	170.4	172.4	67.9	0	0	0	109.1	L242 L243 W257 I264 I270 I272 V283 Y294	L242-L281 WeakPolarHBondContact CA-O 3.46Å; L243-L281 HydrophobicContact CB-CB 4.3Å; L243-L281 HydrophobicContact CD1-CD2 4.16Å; L243-L281 HydrophobicContact CD1-CG 4.36Å; L243-L281 PolarHBondContact N-O 2.87Å; L243-L281 PolarHBondContact O-N 3.15Å; W257-L281 HydrophobicContact CB-CD2 4.28Å; W257-L281 HydrophobicContact CD2-CB 3.62Å; W257-L281 HydrophobicContact CD2-CD2 3.85Å; W257-L281 HydrophobicContact CD2-CG 4.28Å; W257-L281 HydrophobicContact CE3-CB 3.9Å; W257-L281 HydrophobicContact CE3-CD2 3.54Å; W257-L281 HydrophobicContact CE3-CG 4.35Å; W257-L281 HydrophobicContact CG-CB 4.08Å; W257-L281 HydrophobicContact CG-CD2 4.16Å; W257-L281 HydrophobicContact CG-CG 4.49Å; W257-L281 HydrophobicContact CH2-CB 4.15Å; W257-L281 HydrophobicContact CZ2-CB 3.9Å; W257-L281 HydrophobicContact CZ3-CB 4.12Å; W257-L281 HydrophobicContact CZ3-CD2 4.11Å; I264-L281 HydrophobicContact CD1-CD2 3.92Å; I264-L281 HydrophobicContact CG2-CD1 4.13Å; I270-L281 HydrophobicContact CG2-CD1 3.6Å; I272-L281 HydrophobicContact CD1-CD1 4.35Å; I272-L281 HydrophobicContact CG1-CD1 3.73Å; L281-V283 HydrophobicContact CD1-CG2 4.44Å; L281-V283 HydrophobicContact CD2-CG2 4.27Å; L281-V283 HydrophobicContact CG-CG2 4.05Å; L281-Y294 HydrophobicContact CD2-CD1 3.55Å; L281-Y294 HydrophobicContact CD2-CE1 3.89Å; L281-Y294 HydrophobicContact CD2-CG 4.48Å
282	T	97.4	Very high	94.9	Very high	24 Å²	24	58 Å²	58	15%	0.147	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.3	175.6	-54.1	0	0	0	0	109.1	T240 A241 L242 I270 D271 T284	T240-T282 HydrophobicContact CG2-CG2 3.48Å; T240-T282 VanDerWaalsContact CG2-CG2 3.48Å; A241-T282 WeakPolarHBondContact O-CA 3.09Å; L242-T282 HydrophobicContact CD2-CG2 3.8Å; L242-T282 VanDerWaalsContact CD2-OG1 3.29Å; L242-T282 WeakPolarHBondContact CD2-OG1 3.26Å; I270-T282 WeakPolarHBondContact CA-O 3.44Å; D271-T282 PolarHBondContact N-O 2.85Å; D271-T282 PolarHBondContact O-N 2.92Å; T282-T284 HydrophobicContact CG2-CG2 4.31Å
283	V	96.8	Very high	94.9	Very high	0 Å²	0	62 Å²	62	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	105.6	177.4	-175.7	0	0	0	0	108	T240 A241 L243 I270 L281 M286 R290 Y294	T240-V283 CarbonylContact C-O 3.56Å; T240-V283 WeakPolarHBondContact CA-O 3.18Å; A241-V283 HydrophobicContact CB-CB 4.36Å; A241-V283 PolarHBondContact N-O 2.78Å; A241-V283 PolarHBondContact O-N 2.87Å; L243-V283 HydrophobicContact CD1-CG2 4.33Å; I270-V283 HydrophobicContact CD1-CB 4.04Å; I270-V283 HydrophobicContact CD1-CG1 3.74Å; I270-V283 HydrophobicContact CD1-CG2 3.71Å; L281-V283 HydrophobicContact CD1-CG2 4.44Å; L281-V283 HydrophobicContact CD2-CG2 4.27Å; L281-V283 HydrophobicContact CG-CG2 4.05Å; V283-M286 HydrophobicContact CB-SD 4.23Å; V283-M286 HydrophobicContact CG1-SD 3.76Å; V283-R290 HydrophobicContact CG1-CB 4.49Å; V283-R290 HydrophobicContact CG1-CG 4.49Å; V283-Y294 HydrophobicContact CG2-CE1 4.48Å
284	T	95.9	Very high	95	Very high	52 Å²	52	56.2 Å²	56.2	32%	0.319	31%	0.307	S	S	.	.			trans	-84.3	160.2	177.2	68.4	0	0	0	0	111.2	T240 G269 T282 R290	T240-T284 HydrophobicContact CG2-CG2 4Å; G269-T284 WeakPolarHBondContact CA-OG1 3.26Å; G269-T284 PolarHBondContact O-N 3.33Å; G269-T284 PolarHBondContact O-OG1 2.8Å; G269-T284 VanDerWaalsContact O-OG1 3.12Å; T282-T284 HydrophobicContact CG2-CG2 4.31Å; T284-R290 PolarHBondContact O-NH1 3.08Å
285	N	94.6	Very high	95.2	Very high	103 Å²	103	53.8 Å²	53.8	55%	0.551	30%	0.295	S	S	*	.	S	Bend	trans	48.4	66.7	177.7	-167.1	24.3	0	0	0	112.7	R239 T287	R239-N285 PolarHBondContact O-N 2.9Å; N285-T287 PolarHBondContact O-N 2.94Å
286	M	94.8	Very high	95.6	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.01	27%	0.265	C	S	.	.			trans	-57.8	129.7	-179.1	-78.9	-60.8	-64.1	0	0	112.4	V235 L237 G238 R239 A241 V283 R290 Y291 L311	V235-M286 HydrophobicContact CG1-CG 3.9Å; L237-M286 CarbonylContact C-O 3.59Å; L237-M286 WeakPolarHBondContact CA-O 3.35Å; G238-M286 PolarHBondContact N-O 2.84Å; R239-M286 VanDerWaalsContact O-CG 3.31Å; R239-M286 WeakPolarHBondContact O-CG 3.48Å; R239-M286 PolarHBondContact O-N 2.87Å; A241-M286 HydrophobicContact CB-CG 4.04Å; A241-M286 HydrophobicContact CB-SD 3.79Å; V283-M286 HydrophobicContact CB-SD 4.23Å; V283-M286 HydrophobicContact CG1-SD 3.76Å; M286-R290 HydrophobicContact CE-CB 3.97Å; M286-R290 HydrophobicContact SD-CB 4.04Å; M286-Y291 HydrophobicContact CE-CD1 3.51Å; M286-Y291 HydrophobicContact CE-CE1 3.4Å; M286-Y291 HydrophobicContact CE-CG 4.18Å; M286-L311 HydrophobicContact CE-CD2 3.44Å; M286-L311 VanDerWaalsContact CE-CD2 3.44Å; M286-L311 HydrophobicContact CE-CG 4.06Å; M286-L311 HydrophobicContact SD-CD2 3.79Å
287	T	94.7	Very high	96	Very high	49 Å²	49	45.8 Å²	45.8	30%	0.301	24%	0.243	S	C	.	.			trans	-124.9	165.6	175.1	51.4	0	0	0	0	109.5	N285 D289 R290	N285-T287 PolarHBondContact O-N 2.94Å; T287-D289 VanDerWaalsContact C-N 3.28Å; T287-D289 WeakPolarHBondContact CB-OD1 3.4Å; T287-D289 PolarHBondContact O-N 2.79Å; T287-D289 PolarHBondContact OG1-OD1 2.78Å; T287-R290 WeakPolarHBondContact O-CB 3.23Å; T287-R290 PolarHBondContact O-N 3.45Å; T287-R290 WeakPolarHBondContact OG1-CD 3.33Å; T287-R290 VanDerWaalsContact OG1-CG 3.3Å; T287-R290 WeakPolarHBondContact OG1-CG 3.37Å
288	E	93.1	Very high	96.2	Very high	156 Å²	156	43.3 Å²	43.3	73%	0.729	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-58.8	-39.5	-177.1	-68.3	-172.5	167.2	0	0	112.8	L237 R290 Y291	L237-E288 HydrophobicContact CD2-CG 4.23Å; E288-R290 PolarHBondContact O-N 3.22Å; E288-Y291 PolarHBondContact O-N 2.85Å
289	D	92.9	Very high	96.3	Very high	116 Å²	116	39.2 Å²	39.2	62%	0.62	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-68.7	-13.7	177.5	68.8	-66.1	0	0	0	113.4	K259 T287	K259-D289 PolarHBondContact NZ-O 3.02Å; T287-D289 VanDerWaalsContact C-N 3.28Å; T287-D289 WeakPolarHBondContact CB-OD1 3.4Å; T287-D289 PolarHBondContact O-N 2.79Å; T287-D289 PolarHBondContact OG1-OD1 2.78Å
290	R	93.5	Very high	96.3	Very high	53 Å²	53	40.1 Å²	40.1	20%	0.2	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-88	-12.9	176.3	-70.1	178.1	178.6	-127.9	-7.7	112.9	K259 H268 V283 T284 M286 T287 E288 Y294	K259-R290 WeakPolarHBondContact CE-O 3.41Å; H268-R290 PolarHBondContact O-NH2 2.75Å; V283-R290 HydrophobicContact CG1-CB 4.49Å; V283-R290 HydrophobicContact CG1-CG 4.49Å; T284-R290 PolarHBondContact O-NH1 3.08Å; M286-R290 HydrophobicContact CE-CB 3.97Å; M286-R290 HydrophobicContact SD-CB 4.04Å; T287-R290 WeakPolarHBondContact O-CB 3.23Å; T287-R290 PolarHBondContact O-N 3.45Å; T287-R290 WeakPolarHBondContact OG1-CD 3.33Å; T287-R290 VanDerWaalsContact OG1-CG 3.3Å; T287-R290 WeakPolarHBondContact OG1-CG 3.37Å; E288-R290 PolarHBondContact O-N 3.22Å; R290-Y294 WeakPolarHBondContact O-CE2 3.01Å; R290-Y294 PolarHBondContact O-OH 3.5Å
291	Y	94.9	Very high	96.3	Very high	36 Å²	36	45.6 Å²	45.6	14%	0.141	24%	0.238	C	C	.	.			trans	-70.6	162.3	168.1	-65.2	-60.4	0	0	0	111.7	V235 L237 K259 M286 E288 L311 I312 P313	V235-Y291 VanDerWaalsContact O-CE1 3.32Å; V235-Y291 WeakPolarHBondContact O-CE1 3.48Å; V235-Y291 PolarHBondContact O-OH 2.69Å; L237-Y291 HydrophobicContact CD2-CE2 3.89Å; K259-Y291 WeakPolarHBondContact CE-O 3.39Å; K259-Y291 PolarHBondContact NZ-O 2.84Å; M286-Y291 HydrophobicContact CE-CD1 3.51Å; M286-Y291 HydrophobicContact CE-CE1 3.4Å; M286-Y291 HydrophobicContact CE-CG 4.18Å; E288-Y291 PolarHBondContact O-N 2.85Å; Y291-L311 WeakPolarHBondContact CB-O 3.31Å; Y291-L311 HydrophobicContact CD1-CG 4.24Å; Y291-L311 WeakPolarHBondContact CD1-O 3.22Å; Y291-I312 WeakPolarHBondContact CE1-O 3.13Å; Y291-P313 HydrophobicContact CD1-CG 4.46Å; Y291-P313 HydrophobicContact CD2-CG 4.11Å; Y291-P313 HydrophobicContact CE1-CB 4.48Å; Y291-P313 HydrophobicContact CE1-CG 4.13Å; Y291-P313 HydrophobicContact CE2-CB 4.47Å; Y291-P313 HydrophobicContact CE2-CG 3.77Å; Y291-P313 HydrophobicContact CG-CG 4.46Å
292	G	94.6	Very high	96.3	Very high	29 Å²	29	48.7 Å²	48.7	30%	0.299	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	126.1	-169.3	178	0	0	0	0	0	113.3	Y294 L311	G292-Y294 WeakPolarHBondContact O-CD2 3.5Å; G292-L311 PolarHBondContact N-O 2.81Å; G292-L311 PolarHBondContact O-N 2.82Å
293	N	96.4	Very high	96.3	Very high	100 Å²	100	48.8 Å²	48.8	54%	0.535	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	126.7	-176.4	-74	-17.6	0	0	0	111.8	P310	N293-P310 WeakPolarHBondContact OD1-CA 3.46Å; N293-P310 WeakPolarHBondContact OD1-CB 2.92Å
294	Y	97.7	Very high	96.3	Very high	5 Å²	5	57.7 Å²	57.7	2%	0.02	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	135.1	172.8	-72.9	-98.6	0	0	0	109.2	L243 Y258 K259 I264 L281 V283 R290 G292 S308 V309 L311	L243-Y294 VanDerWaalsContact CD2-CB 3.4Å; L243-Y294 HydrophobicContact CD2-CD1 4.23Å; L243-Y294 HydrophobicContact CD2-CD2 3.84Å; L243-Y294 HydrophobicContact CD2-CG 3.56Å; Y258-Y294 CarbonylContact O-C 3.55Å; Y258-Y294 VanDerWaalsContact O-CA 3.3Å; Y258-Y294 WeakPolarHBondContact O-CA 3.31Å; K259-Y294 HydrophobicContact CB-CD1 4.35Å; K259-Y294 HydrophobicContact CB-CE1 4.22Å; K259-Y294 HydrophobicContact CD-CE1 4.12Å; K259-Y294 HydrophobicContact CD-CE2 4.34Å; K259-Y294 HydrophobicContact CG-CE1 4.37Å; I264-Y294 HydrophobicContact CD1-CD1 3.55Å; I264-Y294 HydrophobicContact CD1-CE1 3.58Å; L281-Y294 HydrophobicContact CD2-CD1 3.55Å; L281-Y294 HydrophobicContact CD2-CE1 3.89Å; L281-Y294 HydrophobicContact CD2-CG 4.48Å; V283-Y294 HydrophobicContact CG2-CE1 4.48Å; R290-Y294 WeakPolarHBondContact O-CE2 3.01Å; R290-Y294 PolarHBondContact O-OH 3.5Å; G292-Y294 WeakPolarHBondContact O-CD2 3.5Å; Y294-S308 CarbonylContact O-C 3.51Å; Y294-S308 WeakPolarHBondContact O-CA 3.44Å; Y294-V309 PolarHBondContact N-O 2.03Å; Y294-V309 PolarHBondContact O-N 3.42Å; Y294-L311 HydrophobicContact CD2-CB 3.8Å; Y294-L311 HydrophobicContact CD2-CD2 4.49Å; Y294-L311 HydrophobicContact CE2-CB 3.7Å; Y294-L311 HydrophobicContact CE2-CD2 3.79Å; Y294-L311 HydrophobicContact CE2-CG 4.42Å
295	T	98.4	Very high	96.4	Very high	27 Å²	27	56.3 Å²	56.3	17%	0.166	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	125.2	179.3	-55.2	0	0	0	0	109.5	W257 Y258 V297 N306 A307 S308	W257-T295 CarbonylContact C-O 3.59Å; W257-T295 WeakPolarHBondContact CA-O 3.02Å; Y258-T295 PolarHBondContact N-O 2.88Å; Y258-T295 PolarHBondContact O-N 2.91Å; T295-V297 HydrophobicContact CG2-CG2 4.27Å; T295-N306 HydrophobicContact CG2-CB 4.04Å; T295-A307 CarbonylContact C-O 3.55Å; T295-A307 WeakPolarHBondContact CA-O 3.22Å; T295-S308 PolarHBondContact OG1-OG 2.85Å
296	C	98.2	Very high	96.6	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	138.5	167.4	173.8	0	0	0	0	108.9	M230 C245 E256 W257 N306 A307	M230-C296 HydrophobicContact CE-CB 3.83Å; M230-C296 HydrophobicContact SD-CB 3.71Å; C245-C296 HydrophobicContact CB-CB 3.57Å; C245-C296 WeakPolarHBondContact CB-SG 3.49Å; C245-C296 WeakPolarHBondContact SG-CB 3.22Å; C245-C296 CovalentContact SG-SG 2.04Å; C245-C296 PolarHBondContact SG-SG 2.78Å; E256-C296 CarbonylContact O-C 3.59Å; W257-C296 HydrophobicContact CD2-CB 4.4Å; W257-C296 HydrophobicContact CE3-CB 4.25Å; W257-C296 HydrophobicContact CH2-CB 4.08Å; W257-C296 HydrophobicContact CZ2-CB 4.21Å; W257-C296 HydrophobicContact CZ3-CB 4.13Å; C296-N306 CarbonylContact O-C 3.45Å; C296-N306 WeakPolarHBondContact O-CA 3.02Å; C296-A307 PolarHBondContact N-O 2.73Å; C296-A307 PolarHBondContact O-N 3.33Å
297	V	98.2	Very high	96.7	Very high	19 Å²	19	58 Å²	58	12%	0.115	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	119	174.3	-174.1	0	0	0	0	108.8	F255 E256 Y258 T295 I299 A305 N306	F255-V297 CarbonylContact C-O 3.57Å; F255-V297 WeakPolarHBondContact CA-O 3.48Å; E256-V297 HydrophobicContact CB-CB 4.36Å; E256-V297 PolarHBondContact N-O 3.22Å; E256-V297 PolarHBondContact O-N 2.77Å; Y258-V297 HydrophobicContact CD2-CG2 3.76Å; Y258-V297 HydrophobicContact CE2-CB 4.36Å; Y258-V297 HydrophobicContact CE2-CG2 3.76Å; T295-V297 HydrophobicContact CG2-CG2 4.27Å; V297-I299 HydrophobicContact CG1-CD1 4.15Å; V297-I299 HydrophobicContact CG1-CG1 3.9Å; V297-A305 CarbonylContact C-O 3.59Å; V297-A305 WeakPolarHBondContact CA-O 3.49Å; V297-N306 HydrophobicContact CG2-CB 4.02Å
298	A	98.4	Very high	96.9	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	134.8	174.9	0	0	0	0	0	109.9	P225 I227 A247 P253 T254 F255 R304 A305	P225-A298 HydrophobicContact CB-CB 3.71Å; P225-A298 HydrophobicContact CG-CB 4.43Å; I227-A298 HydrophobicContact CD1-CB 4.12Å; I227-A298 HydrophobicContact CG1-CB 4.05Å; A247-A298 HydrophobicContact CB-CB 3.62Å; P253-A298 HydrophobicContact CB-CB 4.16Å; T254-A298 CarbonylContact O-C 3.57Å; T254-A298 WeakPolarHBondContact O-CA 3.3Å; F255-A298 HydrophobicContact CD1-CB 4.06Å; F255-A298 HydrophobicContact CE1-CB 3.81Å; F255-A298 HydrophobicContact CZ-CB 4.46Å; A298-R304 CarbonylContact O-C 3.59Å; A298-R304 VanDerWaalsContact O-CA 3.24Å; A298-R304 WeakPolarHBondContact O-CA 3.42Å; A298-A305 PolarHBondContact N-O 3.32Å; A298-A305 PolarHBondContact O-N 3.24Å
299	I	98	Very high	97	Very high	25 Å²	25	52.7 Å²	52.7	13%	0.128	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	128.6	-170	-52.3	175.9	0	0	0	110.4	P253 T254 E256 V297 R304	P253-I299 CarbonylContact C-O 3.57Å; P253-I299 VanDerWaalsContact CA-O 3.31Å; P253-I299 WeakPolarHBondContact CA-O 3.5Å; T254-I299 PolarHBondContact N-O 3.18Å; T254-I299 PolarHBondContact O-N 2.68Å; T254-I299 PolarHBondContact OG1-O 2.76Å; E256-I299 HydrophobicContact CG-CD1 4.13Å; V297-I299 HydrophobicContact CG1-CD1 4.15Å; V297-I299 HydrophobicContact CG1-CG1 3.9Å; I299-R304 HydrophobicContact CB-CG 4.27Å; I299-R304 HydrophobicContact CG1-CB 4.41Å; I299-R304 HydrophobicContact CG1-CG 3.88Å; I299-R304 HydrophobicContact CG2-CG 3.96Å
300	N	97.8	Very high	97.1	Very high	18 Å²	18	50 Å²	50	10%	0.096	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	-175.1	164.3	80.2	1.8	0	0	0	110.8	F223 P225 V250 P251 L302 G303	F223-N300 PolarHBondContact O-ND2 2.88Å; P225-N300 WeakPolarHBondContact CD-OD1 3.5Å; P225-N300 HydrophobicContact CG-CB 4.1Å; V250-N300 PolarHBondContact O-ND2 2.87Å; P251-N300 WeakPolarHBondContact O-CB 3.41Å; P251-N300 PolarHBondContact O-ND2 2.97Å; P251-N300 VanDerWaalsContact O-ND2 3.15Å; N300-L302 PolarHBondContact O-N 3.18Å; N300-L302 VanDerWaalsContact O-N 3.12Å; N300-L302 WeakPolarHBondContact OD1-CA 3.49Å; N300-L302 WeakPolarHBondContact OD1-CB 3.21Å; N300-L302 PolarHBondContact OD1-N 3.45Å; N300-G303 PolarHBondContact N-O 3.1Å; N300-G303 PolarHBondContact O-N 3.37Å; N300-G303 PolarHBondContact OD1-N 3.11Å
301	K	97.4	Very high	97.2	Very high	144 Å²	144	47.5 Å²	47.5	63%	0.626	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-16.1	-178.6	72.1	-179.8	-175.4	-177.4	0	114.7	N222 P251	N222-K301 PolarHBondContact ND2-NZ 3.41Å; P251-K301 HydrophobicContact CG-CD 4Å; P251-K301 HydrophobicContact CG-CG 4.35Å
302	L	97.8	Very high	97.1	Very high	64 Å²	64	48.2 Å²	48.2	34%	0.335	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-16.4	-177.2	-65.6	177.1	0	0	0	113.3	N222 P224 N300	N222-L302 VanDerWaalsContact C-CD1 3.48Å; N222-L302 HydrophobicContact CB-CD1 3.52Å; P224-L302 HydrophobicContact CB-CB 4.14Å; N300-L302 PolarHBondContact O-N 3.18Å; N300-L302 VanDerWaalsContact O-N 3.12Å; N300-L302 WeakPolarHBondContact OD1-CA 3.49Å; N300-L302 WeakPolarHBondContact OD1-CB 3.21Å; N300-L302 PolarHBondContact OD1-N 3.45Å
303	G	97.6	Very high	97	Very high	26 Å²	26	49.2 Å²	49.2	27%	0.268	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	165.3	-165.4	-179.4	0	0	0	0	0	114.6	P225 N300	P225-G303 WeakPolarHBondContact CD-O 3.49Å; N300-G303 PolarHBondContact N-O 3.1Å; N300-G303 PolarHBondContact O-N 3.37Å; N300-G303 PolarHBondContact OD1-N 3.11Å
304	R	98.2	Very high	96.6	Very high	188 Å²	188	47.4 Å²	47.4	71%	0.709	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.4	146	-178.4	-54.4	-172.1	176.2	178.9	-2.5	110.4	A298 I299	A298-R304 CarbonylContact O-C 3.59Å; A298-R304 VanDerWaalsContact O-CA 3.24Å; A298-R304 WeakPolarHBondContact O-CA 3.42Å; I299-R304 HydrophobicContact CB-CG 4.27Å; I299-R304 HydrophobicContact CG1-CB 4.41Å; I299-R304 HydrophobicContact CG1-CG 3.88Å; I299-R304 HydrophobicContact CG2-CG 3.96Å
305	A	98.3	Very high	95.5	Very high	22 Å²	22	55.3 Å²	55.3	18%	0.182	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	151.1	167.1	0	0	0	0	0	109.7	P225 I227 V297 A298	P225-A305 HydrophobicContact CB-CB 4.33Å; P225-A305 WeakPolarHBondContact O-CB 3.43Å; I227-A305 HydrophobicContact CD1-CB 4.16Å; I227-A305 WeakPolarHBondContact CD1-O 3.46Å; I227-A305 HydrophobicContact CG1-CB 4.04Å; V297-A305 CarbonylContact C-O 3.59Å; V297-A305 WeakPolarHBondContact CA-O 3.49Å; A298-A305 PolarHBondContact N-O 3.32Å; A298-A305 PolarHBondContact O-N 3.24Å
306	N	97.8	Very high	94.1	Very high	119 Å²	119	57.2 Å²	57.2	64%	0.636	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134	152.2	176.2	62.3	36	0	0	0	111.4	T295 C296 V297	T295-N306 HydrophobicContact CG2-CB 4.04Å; C296-N306 CarbonylContact O-C 3.45Å; C296-N306 WeakPolarHBondContact O-CA 3.02Å; V297-N306 HydrophobicContact CG2-CB 4.02Å
307	A	97.8	Very high	91.9	Very high	23 Å²	23	61.1 Å²	61.1	19%	0.19	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	141.4	174.3	0	0	0	0	0	109.4	I227 M230 T295 C296	I227-A307 HydrophobicContact CB-CB 4.28Å; I227-A307 HydrophobicContact CD1-CB 4.12Å; I227-A307 HydrophobicContact CG2-CB 3.71Å; M230-A307 HydrophobicContact CB-CB 3.88Å; M230-A307 HydrophobicContact CG-CB 4.1Å; T295-A307 CarbonylContact C-O 3.55Å; T295-A307 WeakPolarHBondContact CA-O 3.22Å; C296-A307 PolarHBondContact N-O 2.73Å; C296-A307 PolarHBondContact O-N 3.33Å
308	S	97.4	Very high	89.8	Confident	73 Å²	73	65 Å²	65	51%	0.51	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	144.5	-178.5	-56.9	0	0	0	0	111.3	Y294 T295	Y294-S308 CarbonylContact O-C 3.51Å; Y294-S308 WeakPolarHBondContact O-CA 3.44Å; T295-S308 PolarHBondContact OG1-OG 2.85Å
309	V	96.1	Very high	87.4	Confident	19 Å²	19	77 Å²	77	12%	0.115	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	139.5	172.8	73.8	0	0	0	0	109.9	M230 S232 L243 Y294	M230-V309 HydrophobicContact CE-CB 4.23Å; M230-V309 HydrophobicContact CE-CG1 3.51Å; M230-V309 HydrophobicContact CG-CB 3.89Å; M230-V309 HydrophobicContact CG-CG1 4.01Å; M230-V309 HydrophobicContact SD-CG1 4.39Å; S232-V309 VanDerWaalsContact OG-CG2 3.31Å; S232-V309 WeakPolarHBondContact OG-CG2 3.11Å; L243-V309 HydrophobicContact CD2-CG1 3.89Å; Y294-V309 PolarHBondContact N-O 2.03Å; Y294-V309 PolarHBondContact O-N 3.42Å
310	P	95.1	Very high	84.9	Confident	60 Å²	60	79.3 Å²	79.3	39%	0.39	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	137.6	173.7	31.3	-35.8	0	0	0	110.3	S232 N293 I312	S232-P310 PolarHBondContact OG-O 3.36Å; N293-P310 WeakPolarHBondContact OD1-CA 3.46Å; N293-P310 WeakPolarHBondContact OD1-CB 2.92Å; P310-I312 HydrophobicContact CB-CG2 3.95Å
311	L	94.8	Very high	82.1	Confident	0 Å²	0	83 Å²	83	0%	0	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	119.7	162.6	-176.1	65.9	0	0	0	107.8	H233 A241 L243 M286 Y291 G292 Y294	H233-L311 WeakPolarHBondContact O-CD1 3.47Å; A241-L311 HydrophobicContact CB-CD1 3.87Å; A241-L311 HydrophobicContact CB-CD2 3.81Å; A241-L311 HydrophobicContact CB-CG 4.46Å; L243-L311 HydrophobicContact CD1-CD2 4.31Å; M286-L311 HydrophobicContact CE-CD2 3.44Å; M286-L311 VanDerWaalsContact CE-CD2 3.44Å; M286-L311 HydrophobicContact CE-CG 4.06Å; M286-L311 HydrophobicContact SD-CD2 3.79Å; Y291-L311 WeakPolarHBondContact CB-O 3.31Å; Y291-L311 HydrophobicContact CD1-CG 4.24Å; Y291-L311 WeakPolarHBondContact CD1-O 3.22Å; G292-L311 PolarHBondContact N-O 2.81Å; G292-L311 PolarHBondContact O-N 2.82Å; Y294-L311 HydrophobicContact CD2-CB 3.8Å; Y294-L311 HydrophobicContact CD2-CD2 4.49Å; Y294-L311 HydrophobicContact CE2-CB 3.7Å; Y294-L311 HydrophobicContact CE2-CD2 3.79Å; Y294-L311 HydrophobicContact CE2-CG 4.42Å
312	I	93.8	Very high	79.2	Confident	51 Å²	51	82.9 Å²	82.9	26%	0.262	49%	0.489	S	S	.	.			trans	-128.8	160.6	-170.2	64	-175.7	0	0	0	111.6	G234 V235 Y291 P310 T316	G234-I312 VanDerWaalsContact CA-O 3.28Å; G234-I312 WeakPolarHBondContact CA-O 3.23Å; V235-I312 PolarHBondContact N-O 2.78Å; Y291-I312 WeakPolarHBondContact CE1-O 3.13Å; P310-I312 HydrophobicContact CB-CG2 3.95Å; I312-T316 WeakPolarHBondContact CB-OG1 3.36Å; I312-T316 WeakPolarHBondContact CD1-O 3.46Å; I312-T316 VanDerWaalsContact CD1-OG1 3.29Å; I312-T316 WeakPolarHBondContact CD1-OG1 3.42Å; I312-T316 VanDerWaalsContact CG1-OG1 3.31Å; I312-T316 WeakPolarHBondContact CG1-OG1 3.5Å
313	P	92.3	Very high	76.2	Confident	50 Å²	50	83.5 Å²	83.5	33%	0.325	51%	0.51	S	S	.	.			trans	-61.8	157.3	171.3	-19.9	31	0	0	0	112.2	Y291 T316	Y291-P313 HydrophobicContact CD1-CG 4.46Å; Y291-P313 HydrophobicContact CD2-CG 4.11Å; Y291-P313 HydrophobicContact CE1-CB 4.48Å; Y291-P313 HydrophobicContact CE1-CG 4.13Å; Y291-P313 HydrophobicContact CE2-CB 4.47Å; Y291-P313 HydrophobicContact CE2-CG 3.77Å; Y291-P313 HydrophobicContact CG-CG 4.46Å; P313-T316 HydrophobicContact CB-CG2 4.31Å; P313-T316 HydrophobicContact CG-CG2 4.39Å; P313-T316 PolarHBondContact O-N 2.5Å; P313-T316 PolarHBondContact O-OG1 3.39Å
314	P	87.1	Confident	73.4	Confident	62 Å²	62	87.2 Å²	87.2	40%	0.403	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	143.7	173.8	-17.1	31.1	0	0	0	110.6	G236 T316	G236-P314 VanDerWaalsContact N-CG 3.27Å; P314-T316 VanDerWaalsContact C-N 3.26Å; P314-T316 PolarHBondContact O-N 2.87Å
315	N	75.8	Confident	70.4	Confident	172 Å²	172	82.5 Å²	82.5	92%	0.92	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	14	176.2	-51.3	-27.6	0	0	0	116.5
316	T	68.3	Low	67.5	Low	66 Å²	66	90.1 Å²	90.1	41%	0.405	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-82.9	116.6	163.7	47.9	0	0	0	0	108.3	I312 P313 P314	I312-T316 WeakPolarHBondContact CB-OG1 3.36Å; I312-T316 WeakPolarHBondContact CD1-O 3.46Å; I312-T316 VanDerWaalsContact CD1-OG1 3.29Å; I312-T316 WeakPolarHBondContact CD1-OG1 3.42Å; I312-T316 VanDerWaalsContact CG1-OG1 3.31Å; I312-T316 WeakPolarHBondContact CG1-OG1 3.5Å; P313-T316 HydrophobicContact CB-CG2 4.31Å; P313-T316 HydrophobicContact CG-CG2 4.39Å; P313-T316 PolarHBondContact O-N 2.5Å; P313-T316 PolarHBondContact O-OG1 3.39Å; P314-T316 VanDerWaalsContact C-N 3.26Å; P314-T316 PolarHBondContact O-N 2.87Å
317	A	53	Low	64.7	Low	83 Å²	83	90 Å²	90	69%	0.686	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-60.1	140.8	177.2	0	0	0	0	0	109.7	Y319	A317-Y319 PolarHBondContact O-N 2.98Å; A317-Y319 VanDerWaalsContact O-N 3.16Å
318	P	53.8	Low	61.6	Low	101 Å²	101	94.2 Å²	94.2	66%	0.656	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-58	124.5	176.4	21.8	-29.7	0	0	0	109.2	G320	P318-G320 VanDerWaalsContact C-N 3.34Å; P318-G320 PolarHBondContact O-N 3.3Å
319	Y	48.2	Very low	58.8	Low	252 Å²	252	99.4 Å²	99.4	99%	0.988	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	92.7	179.3	-156.3	-92.6	0	0	0	108.2	A317	A317-Y319 PolarHBondContact O-N 2.98Å; A317-Y319 VanDerWaalsContact O-N 3.16Å
320	G	44.1	Very low	55.9	Low	72 Å²	72	102.6 Å²	102.6	74%	0.742	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	163.4	-7.5	-177.5	0	0	0	0	0	118.6	P318	P318-G320 VanDerWaalsContact C-N 3.34Å; P318-G320 PolarHBondContact O-N 3.3Å
321	S	40.3	Very low	52.8	Low	97 Å²	97	105.9 Å²	105.9	68%	0.678	67%	0.666	S	S	*	*			trans	-101.6	80.7	170.1	62.4	0	0	0	0	110.9	G323	S321-G323 PolarHBondContact O-N 3.05Å; S321-G323 VanDerWaalsContact O-N 3.11Å
322	T	36.2	Very low	49.8	Very low	141 Å²	141	118 Å²	118	87%	0.865	71%	0.712	S	S	*	*			trans	-57.1	113	155.5	44	0	0	0	0	107.4	S324	T322-S324 PolarHBondContact O-N 2.93Å; T322-S324 VanDerWaalsContact O-N 3.09Å
323	G	35.4	Very low	46.8	Very low	76 Å²	76	126.1 Å²	126.1	78%	0.784	74%	0.741	S	S	*	*			trans	-59	111.6	-177.6	0	0	0	0	0	111.7	S321 A325	S321-G323 PolarHBondContact O-N 3.05Å; S321-G323 VanDerWaalsContact O-N 3.11Å; G323-A325 PolarHBondContact O-N 2.92Å
324	S	37.8	Very low	43.9	Very low	105 Å²	105	131.1 Å²	131.1	73%	0.734	76%	0.764	S	S	*	*			trans	-75.4	109.7	147.1	175.6	0	0	0	0	106.3	T322 H326	T322-S324 PolarHBondContact O-N 2.93Å; T322-S324 VanDerWaalsContact O-N 3.09Å; S324-H326 PolarHBondContact O-N 3.27Å
325	A	36	Very low	41.1	Very low	88 Å²	88	134.3 Å²	134.3	73%	0.727	78%	0.782	S	S	*	*			trans	-58	110.1	170.7	0	0	0	0	0	108.9	G323 V327	G323-A325 PolarHBondContact O-N 2.92Å; A325-V327 PolarHBondContact O-N 3.14Å; A325-V327 VanDerWaalsContact O-N 3.15Å
326	H	36.4	Very low	39	Very low	183 Å²	183	133.6 Å²	133.6	85%	0.847	78%	0.777	S	S	*	*			trans	-66.9	108	162.8	-88.7	-70.6	0	0	0	108	S324	S324-H326 PolarHBondContact O-N 3.27Å
327	V	38.1	Very low	37.3	Very low	117 Å²	117	134.7 Å²	134.7	71%	0.709	79%	0.793	S	S	*	*			trans	-66.3	123.6	159.1	-179.9	0	0	0	0	106.8	A325 L329	A325-V327 PolarHBondContact O-N 3.14Å; A325-V327 VanDerWaalsContact O-N 3.15Å; V327-L329 PolarHBondContact O-N 3.07Å
328	P	32.7	Very low	36.2	Very low	111 Å²	111	138.4 Å²	138.4	72%	0.721	80%	0.8	S	S	*	*			trans	-72.5	119.6	177.6	27.8	-29.5	0	0	0	109.1	A330	P328-A330 VanDerWaalsContact C-N 3.34Å; P328-A330 PolarHBondContact O-N 3.27Å
329	L	38.6	Very low	35.2	Very low	182 Å²	182	139.5 Å²	139.5	95%	0.953	81%	0.81	S	S	*	*			trans	-74.2	91.2	165.8	-95.4	99.2	0	0	0	109.1	V327	V327-L329 PolarHBondContact O-N 3.07Å
330	A	36.6	Very low	34.6	Very low	85 Å²	85	131.9 Å²	131.9	70%	0.702	79%	0.794	S	S	*	*			trans	-136.5	131.4	153.6	0	0	0	0	0	108.4	P328	P328-A330 VanDerWaalsContact C-N 3.34Å; P328-A330 PolarHBondContact O-N 3.27Å
331	C	28.9	Very low	34.1	Very low	130 Å²	130	137.6 Å²	137.6	88%	0.878	80%	0.799	S	S	*	*			trans	78	95.8	-179.3	-71.7	0	0	0	0	117.9
332	R	33.2	Very low	33.8	Very low	254 Å²	254	140.6 Å²	140.6	96%	0.958	81%	0.805	S	S	*	*				-162	97.8	119.6	-104	173.3	-173.2	-137.7	1.9	110.3
333	Y	30.8	Very low	33.7	Very low	222 Å²	222	138.5 Å²	138.5	87%	0.871	80%	0.796	S	S	*	*			trans	-88.1	149.6	158.2	-96.8	-86.1	0	0	0	109
334	L	30.3	Very low	34.1	Very low	155 Å²	155	141.7 Å²	141.7	81%	0.812	80%	0.801	S	S	*	*			trans	70.8	111.9	175	-84.5	84.7	0	0	0	116.9
335	V	29.2	Very low	34.3	Very low	129 Å²	129	150.6 Å²	150.6	78%	0.782	82%	0.82	S	S	*	*				-164.1	116.4	104.5	166.5	0	0	0	0	109.1
336	L	30.7	Very low	34.2	Very low	157 Å²	157	153.7 Å²	153.7	82%	0.822	83%	0.825	S	S	*	*			trans	70.2	101.6	152.2	-61.5	166.6	0	0	0	121.4
337	A	32.7	Very low	34.1	Very low	89 Å²	89	152.2 Å²	152.2	74%	0.736	82%	0.823	S	S	*	*			trans	-61.7	130.7	136.5	0	0	0	0	0	110.2
338	L	30.7	Very low	33.9	Very low	160 Å²	160	154.1 Å²	154.1	84%	0.838	83%	0.83	S	S	*	*			trans	160.6	103.9	142.5	-88.8	162.8	0	0	0	109.3
339	S	31.5	Very low	33.9	Very low	124 Å²	124	156.6 Å²	156.6	87%	0.867	84%	0.836	S	S	*	*				-173.9	118.4	126	38.2	0	0	0	0	109.5
340	S	35.3	Very low	33.6	Very low	92 Å²	92	155.1 Å²	155.1	64%	0.643	83%	0.829	S	S	*	*			trans	-86.3	158.3	178.7	-40.2	0	0	0	0	110.4
341	F	34.4	Very low	33.4	Very low	193 Å²	193	159.7 Å²	159.7	85%	0.846	84%	0.837	S	S	*	*			trans	75.2	123.9	157.2	-70.7	-79.4	0	0	0	120.1
342	I	33.2	Very low	33.8	Very low	159 Å²	159	161.9 Å²	161.9	82%	0.815	83%	0.834	S	S	*	*				155.1	98.8	127.3	-77.6	159.9	0	0	0	106.3
343	S	34.1	Very low	33.8	Very low	97 Å²	97	154.8 Å²	154.8	68%	0.678	83%	0.825	S	S	*	*				97.4	115.2	90.4	-169.5	0	0	0	0	111.5
344	V	44	Very low	34	Very low	144 Å²	144	149.2 Å²	149.2	87%	0.873	82%	0.821	S	S	*	*			trans	-147.2	137.8	142.9	-175	0	0	0	0	108.1
345	Y	42.5	Very low	34.4	Very low	291 Å²	291	148.6 Å²	148.6	100%	1.141	82%	0.822	S	S	*	*			trans	-45.9	0	-175.5	-88.6	-102.7	0	0	0	117.7

Retrieved 345 of 345 residues in 319.9 ms (Link to these results)

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