A0A087XVC5_POEFO Loading...

Cadherin-like protein 26

Cadherins are calcium-dependent cell adhesion proteins.

AlphaFold DB , UniProt , Accession A0A087XVC5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 862 aa.

						>A0A087XVC5_POEFO|A0A087XVC5
MHLGLASSAPSQVASATGTVFAERKKERSERSKMRSLFLLLLVALASLGESKEGSEHHKRAKRESLSRSKRRWVLNTIELEEEMDVEYPYKITTMHNDKTANVEHHFEISVEDDDSKLFTINKTSGEVYVHRRLDREKTPSYHITFDVWDIGVAKKIDKELSFDVDVKDINDNAPMFISQFQKSYDVKENTKVGDYLPVLMDVVDLDQEGTINSTVDVTVVKQSPAEPKIGVKKITEKQHQLISEGCFDYDKAKHYSVVISASDRGKPPLSSTVAVELNVIDTNSHRPKFKKRQYEAEAVEMQTHKDILRVAVEDKDTPNTDGWRAKYSIISGNEDEVYAITTDPVTNEGIVGVVKAKNFDITTLVKLQIGVENVEPLTVCKDGKLIEDLSSLPPKDSVSITVKMVDTNDAPLFEKYTEEVYQTEESEKGQVLYTPKVKDAESDNIRYELVEDPANWVTVDEKTGIITTIEKMDRESPHVDVDSTYRIVIAAIDDGSPPATSTCTVSVHLRDINDNTPKLLNNSAILCSNEADKVMVRAKDADLEPFSGPFGFSLADDKTLKERWKIEPEYGEEVSIRLLTKLPNGNYSVPLVIQDKQNQPSKETLSVVLCNCVKPGVCAGPKPLSTAIGIAAIGLIIAALLVFLLLLLLLTRKQKTFLMTNLNDEYKQTLMKYNEEGLGTDCKAEPNILASKTTESITDGIKLGSMQNIEASPGMVQDMGSCHRTYSVMSSNMNTWDSQQQGGMKRNSRGSTWSSNRRGTFQGNSTFKRSISSWSDGRVSSLLDRRLTVTDSNPTDSSDDHVKMYQYEGNGNSCMSLDMLSSEYQQNDLSFLDDLGPQFKTLEKIIMENKSEVLKAEKSDI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.2	Very low	32.9	Very low	179 Å²	179	116.9 Å²	116.9	88%	0.882	74%	0.739	S	S	*	*				0	138.7	0	-69	172.4	162.4	0	0	107.6
2	H	34.7	Very low	32.5	Very low	131 Å²	131	122.5 Å²	122.5	61%	0.606	75%	0.749	S	S	*	*			cis	-148.2	143.1	-11.7	-105.3	-48.7	0	0	0	110.6
3	L	40.5	Very low	32.2	Very low	147 Å²	147	123.5 Å²	123.5	77%	0.77	76%	0.755	S	S	*	*			trans	38.3	132.5	136.6	-60.4	166.5	0	0	0	120.5
4	G	34.5	Very low	32	Very low	64 Å²	64	121.4 Å²	121.4	66%	0.66	76%	0.756	S	S	*	*			cis	143.6	-178.1	-7.9	0	0	0	0	0	114.3
5	L	35.1	Very low	32	Very low	170 Å²	170	121.2 Å²	121.2	89%	0.89	76%	0.761	S	S	*	*			trans	69.1	141.7	169.2	-54.7	171.4	0	0	0	115.4
6	A	31.5	Very low	32.1	Very low	85 Å²	85	119.3 Å²	119.3	70%	0.702	76%	0.761	S	S	*	*			cis	-146.5	153.1	-4.1	0	0	0	0	0	109.5
7	S	27.3	Very low	32	Very low	110 Å²	110	121 Å²	121	77%	0.769	77%	0.769	S	S	*	*				59.9	131	98.5	-152.6	0	0	0	0	115.2
8	S	27.1	Very low	31.9	Very low	109 Å²	109	117.8 Å²	117.8	76%	0.762	76%	0.763	S	S	*	*			cis	-166.5	167.4	1.5	27.2	0	0	0	0	112.9
9	A	26.8	Very low	32	Very low	88 Å²	88	119.2 Å²	119.2	73%	0.727	77%	0.769	S	S	*	*			trans	-71.1	-164.3	170.1	0	0	0	0	0	112.5
10	P	42.6	Very low	32	Very low	111 Å²	111	119.4 Å²	119.4	72%	0.721	77%	0.768	S	S	*	*			cis	-146.5	-166.9	5.3	39.6	-16.1	0	0	0	117.8
11	S	24.9	Very low	31.8	Very low	92 Å²	92	123.2 Å²	123.2	64%	0.643	77%	0.773	S	S	*	*			trans	67.9	129.2	151.3	45.8	0	0	0	0	119.7
12	Q	27.9	Very low	31.7	Very low	184 Å²	184	119 Å²	119	86%	0.86	77%	0.767	S	S	*	*				62.9	152.1	78.6	-60.6	-173.6	-1.4	0	0	113.6
13	V	28.2	Very low	31.6	Very low	136 Å²	136	121.7 Å²	121.7	82%	0.824	78%	0.78	S	S	*	*			cis	-140.8	172.2	30.8	176.7	0	0	0	0	111.4
14	A	30.3	Very low	31.2	Very low	93 Å²	93	123.5 Å²	123.5	77%	0.769	78%	0.777	S	S	*	*			trans	-82.7	177.1	-172.8	0	0	0	0	0	117.2
15	S	30.9	Very low	31.4	Very low	119 Å²	119	130.7 Å²	130.7	83%	0.832	79%	0.79	S	S	*	*			trans	-47.4	140.7	167.8	178.6	0	0	0	0	115.5
16	A	34.5	Very low	31.5	Very low	91 Å²	91	132.5 Å²	132.5	75%	0.752	79%	0.79	S	S	*	*				175.7	151.9	114.5	0	0	0	0	0	112.8
17	T	29.4	Very low	31.9	Very low	148 Å²	148	134.3 Å²	134.3	91%	0.908	78%	0.784	S	S	*	*			trans	-137.2	129.6	165.6	56.8	0	0	0	0	110.7
18	G	31.3	Very low	32.4	Very low	64 Å²	64	140.1 Å²	140.1	66%	0.66	79%	0.789	S	S	*	*			trans	-176.2	116.8	172.1	0	0	0	0	0	116
19	T	33	Very low	33	Very low	143 Å²	143	138.4 Å²	138.4	88%	0.877	78%	0.777	S	S	*	*			trans	63	159.4	163.4	67.6	0	0	0	0	116.6
20	V	31.6	Very low	33.7	Very low	124 Å²	124	141.4 Å²	141.4	75%	0.752	78%	0.776	S	S	*	*			cis	-121.4	119.1	-7.3	178.6	0	0	0	0	106.5
21	F	29.4	Very low	33.8	Very low	199 Å²	199	147 Å²	147	87%	0.873	78%	0.783	S	S	*	*				54.2	137.7	99.9	-112.9	-96.4	0	0	0	118.2
22	A	34.2	Very low	34.6	Very low	91 Å²	91	147.3 Å²	147.3	75%	0.752	79%	0.785	S	S	*	*			trans	86.6	-18.3	154.3	0	0	0	0	0	123.5
23	E	31.8	Very low	35.3	Very low	188 Å²	188	144.9 Å²	144.9	88%	0.879	77%	0.772	S	S	*	*	S	Bend	trans	-124.8	66.2	178.7	-160.8	143.6	-116.2	0	0	116.6
24	R	33.5	Very low	36.1	Very low	185 Å²	185	145 Å²	145	70%	0.698	77%	0.765	S	S	*	*			trans	-154.6	44.6	158.1	-113	166.3	-153.8	-119.1	11	112.7	K26 E27	R24-K26 PolarHBondContact O-N 3.16Å; R24-E27 VanDerWaalsContact CD-OE2 3.32Å; R24-E27 WeakPolarHBondContact CD-OE2 3.44Å; R24-E27 IonicContact CZ-OE2 3.25Å; R24-E27 IonicContact NE-OE2 2.68Å; R24-E27 IonicContact NH1-OE1 2.68Å; R24-E27 IonicContact NH1-OE2 2.69Å; R24-E27 PolarHBondContact NH1-OE2 3.29Å; R24-E27 PolarHBondContact O-N 3.44Å
25	K	38.2	Very low	36.8	Very low	214 Å²	214	151 Å²	151	93%	0.93	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	12.4	-175	-145.2	174.5	-174.8	177.6	0	114.9
26	K	38.1	Very low	37.5	Very low	208 Å²	208	148.7 Å²	148.7	90%	0.904	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.8	-3.1	177.1	-147.9	174.3	-176.3	-178.9	0	113.9	R24	R24-K26 PolarHBondContact O-N 3.16Å
27	E	39.3	Very low	38	Very low	123 Å²	123	150 Å²	150	58%	0.575	75%	0.745	S	S	*	*	S	Bend	trans	-117.4	5.9	-175.1	-150.1	169.7	-158	0	0	113.2	R24	R24-E27 VanDerWaalsContact CD-OE2 3.32Å; R24-E27 WeakPolarHBondContact CD-OE2 3.44Å; R24-E27 IonicContact CZ-OE2 3.25Å; R24-E27 IonicContact NE-OE2 2.68Å; R24-E27 IonicContact NH1-OE1 2.68Å; R24-E27 IonicContact NH1-OE2 2.69Å; R24-E27 PolarHBondContact NH1-OE2 3.29Å; R24-E27 PolarHBondContact O-N 3.44Å
28	R	38	Very low	38.8	Very low	232 Å²	232	149.7 Å²	149.7	88%	0.875	73%	0.732	S	S	*	*	S	Bend	trans	-101.8	13.6	-177.9	-129.7	176.8	-169.8	-175.2	3.2	114.9
29	S	39.5	Very low	39.5	Very low	73 Å²	73	152.7 Å²	152.7	51%	0.51	73%	0.732	S	S	.	*	S	Bend	trans	-91.5	-26.5	-179.4	-165.3	0	0	0	0	113.8
30	E	42	Very low	40	Very low	152 Å²	152	151.2 Å²	151.2	71%	0.71	72%	0.718	S	S	*	*	S	Bend	trans	-98	-41.2	-167.9	-58.5	-153.6	124.7	0	0	114.4	S32 K33 M34	E30-S32 PolarHBondContact O-N 3Å; E30-S32 VanDerWaalsContact O-N 3.12Å; E30-K33 PolarHBondContact O-N 3.46Å; E30-M34 PolarHBondContact O-N 3.32Å
31	R	43.9	Very low	40.6	Very low	228 Å²	228	150.1 Å²	150.1	86%	0.86	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-9.5	-179.8	-70.9	-169.4	178.4	-169.4	0.4	114.8
32	S	41.6	Very low	41.4	Very low	98 Å²	98	146 Å²	146	69%	0.685	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-31.4	168.6	-164.8	0	0	0	0	112.8	E30	E30-S32 PolarHBondContact O-N 3Å; E30-S32 VanDerWaalsContact O-N 3.12Å
33	K	41.8	Very low	42	Very low	134 Å²	134	146.2 Å²	146.2	58%	0.583	69%	0.685	S	S	*	*	H	α-helix	trans	-73.6	-34.5	179.7	-67.1	178.6	179.5	177.3	0	112.3	E30 R35 S36 L37	E30-K33 PolarHBondContact O-N 3.46Å; K33-R35 VanDerWaalsContact C-N 3.32Å; K33-R35 PolarHBondContact O-N 3.11Å; K33-S36 PolarHBondContact O-N 3.44Å; K33-L37 PolarHBondContact O-N 3.2Å; K33-L37 VanDerWaalsContact O-N 3.14Å
34	M	46.3	Very low	42.5	Very low	138 Å²	138	139.5 Å²	139.5	68%	0.68	66%	0.662	S	S	*	*	H	α-helix	trans	-72.2	-15.5	-171.7	-153.5	173	-77.8	0	0	115.2	E30	E30-M34 PolarHBondContact O-N 3.32Å
35	R	44.8	Very low	42.9	Very low	219 Å²	219	137.2 Å²	137.2	83%	0.826	66%	0.663	S	S	*	*	H	α-helix	trans	-93.2	-22.6	171.9	-83.4	-172.3	170.7	-176.1	-3.1	114.6	K33	K33-R35 VanDerWaalsContact C-N 3.32Å; K33-R35 PolarHBondContact O-N 3.11Å
36	S	44.6	Very low	43.1	Very low	70 Å²	70	131.1 Å²	131.1	49%	0.49	65%	0.653	S	S	.	*	H	α-helix	trans	-77.3	-38.2	170.8	-164.8	0	0	0	0	111.3	K33 F38 L39 L40	K33-S36 PolarHBondContact O-N 3.44Å; S36-F38 VanDerWaalsContact C-N 3.34Å; S36-F38 PolarHBondContact O-N 3.5Å; S36-L39 PolarHBondContact O-N 3.07Å; S36-L40 PolarHBondContact O-N 3.46Å; S36-L40 VanDerWaalsContact O-N 3.08Å
37	L	45.3	Very low	43.3	Very low	119 Å²	119	125.2 Å²	125.2	62%	0.623	64%	0.638	S	S	*	*	H	α-helix	trans	-59.6	-39.1	176.5	-102.6	75.5	0	0	0	113.3	K33 L39 L40 L41	K33-L37 PolarHBondContact O-N 3.2Å; K33-L37 VanDerWaalsContact O-N 3.14Å; L37-L39 PolarHBondContact O-N 2.87Å; L37-L40 PolarHBondContact O-N 3.34Å; L37-L41 VanDerWaalsContact O-CB 3.24Å; L37-L41 WeakPolarHBondContact O-CB 3.46Å; L37-L41 PolarHBondContact O-N 3.06Å
38	F	46	Very low	43.2	Very low	142 Å²	142	126.6 Å²	126.6	62%	0.623	65%	0.648	S	S	*	*	H	α-helix	trans	-68	-35.3	-175.8	-130.2	-87.6	0	0	0	113.1	S36 L42	S36-F38 VanDerWaalsContact C-N 3.34Å; S36-F38 PolarHBondContact O-N 3.5Å; F38-L42 WeakPolarHBondContact O-CG 3.42Å; F38-L42 PolarHBondContact O-N 3.3Å
39	L	45.9	Very low	43	Very low	126 Å²	126	119.3 Å²	119.3	66%	0.66	65%	0.645	S	S	*	*	H	α-helix	trans	-76.8	-36.9	174.9	-87.9	149.5	0	0	0	112.3	S36 L37 V43	S36-L39 PolarHBondContact O-N 3.07Å; L37-L39 PolarHBondContact O-N 2.87Å; L39-V43 WeakPolarHBondContact O-CG2 3.42Å; L39-V43 PolarHBondContact O-N 3.07Å
40	L	45.2	Very low	42.7	Very low	112 Å²	112	124 Å²	124	59%	0.586	66%	0.659	S	S	*	*	H	α-helix	trans	-69.5	-33.3	173.3	-83	162.1	0	0	0	112.8	S36 L37 V43 A44	S36-L40 PolarHBondContact O-N 3.46Å; S36-L40 VanDerWaalsContact O-N 3.08Å; L37-L40 PolarHBondContact O-N 3.34Å; L40-V43 PolarHBondContact O-N 3.16Å; L40-A44 VanDerWaalsContact O-CB 3.23Å; L40-A44 WeakPolarHBondContact O-CB 2.97Å; L40-A44 PolarHBondContact O-N 2.79Å
41	L	43.5	Very low	42.2	Very low	101 Å²	101	121.8 Å²	121.8	53%	0.529	66%	0.661	S	S	.	*	H	α-helix	trans	-65.8	-42.2	176.1	-165	74.4	0	0	0	111.4	L37 V43 A44 L45	L37-L41 VanDerWaalsContact O-CB 3.24Å; L37-L41 WeakPolarHBondContact O-CB 3.46Å; L37-L41 PolarHBondContact O-N 3.06Å; L41-V43 VanDerWaalsContact C-N 3.31Å; L41-V43 PolarHBondContact O-N 2.82Å; L41-A44 PolarHBondContact O-N 2.76Å; L41-L45 HydrophobicContact CG-CD1 4.1Å; L41-L45 WeakPolarHBondContact O-CB 3.35Å; L41-L45 VanDerWaalsContact O-CG 3.28Å; L41-L45 WeakPolarHBondContact O-CG 3.35Å; L41-L45 PolarHBondContact O-N 2.99Å
42	L	44.9	Very low	41.7	Very low	112 Å²	112	120.7 Å²	120.7	59%	0.586	66%	0.662	S	S	*	*	H	α-helix	trans	-66.5	-29.1	176.5	-75.8	167.3	0	0	0	113.3	F38	F38-L42 WeakPolarHBondContact O-CG 3.42Å; F38-L42 PolarHBondContact O-N 3.3Å
43	V	48	Very low	41.2	Very low	96 Å²	96	125.5 Å²	125.5	58%	0.582	67%	0.674	S	S	*	*	H	α-helix	trans	-84.7	-33.7	175.5	175.6	0	0	0	0	112.2	L39 L40 L41 A46 S47	L39-V43 WeakPolarHBondContact O-CG2 3.42Å; L39-V43 PolarHBondContact O-N 3.07Å; L40-V43 PolarHBondContact O-N 3.16Å; L41-V43 VanDerWaalsContact C-N 3.31Å; L41-V43 PolarHBondContact O-N 2.82Å; V43-A46 PolarHBondContact O-N 3.49Å; V43-S47 PolarHBondContact O-OG 3.49Å
44	A	42.4	Very low	40.6	Very low	47 Å²	47	122.7 Å²	122.7	39%	0.388	68%	0.682	S	S	.	*	H	α-helix	trans	-70.4	-40.5	175.7	0	0	0	0	0	112.6	L40 L41 A46 S47 L48	L40-A44 VanDerWaalsContact O-CB 3.23Å; L40-A44 WeakPolarHBondContact O-CB 2.97Å; L40-A44 PolarHBondContact O-N 2.79Å; L41-A44 PolarHBondContact O-N 2.76Å; A44-A46 PolarHBondContact O-N 3.1Å; A44-A46 VanDerWaalsContact O-N 3.14Å; A44-S47 PolarHBondContact O-N 3.31Å; A44-S47 PolarHBondContact O-OG 2.66Å; A44-L48 PolarHBondContact O-N 2.81Å
45	L	42.1	Very low	39.8	Very low	137 Å²	137	121.1 Å²	121.1	72%	0.717	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	-17.6	174.2	-75.1	168.7	0	0	0	113.3	L41	L41-L45 HydrophobicContact CG-CD1 4.1Å; L41-L45 WeakPolarHBondContact O-CB 3.35Å; L41-L45 VanDerWaalsContact O-CG 3.28Å; L41-L45 WeakPolarHBondContact O-CG 3.35Å; L41-L45 PolarHBondContact O-N 2.99Å
46	A	41.1	Very low	39.2	Very low	87 Å²	87	117.4 Å²	117.4	72%	0.719	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-0.2	176.2	0	0	0	0	0	114.3	V43 A44	V43-A46 PolarHBondContact O-N 3.49Å; A44-A46 PolarHBondContact O-N 3.1Å; A44-A46 VanDerWaalsContact O-N 3.14Å
47	S	42.9	Very low	38.5	Very low	83 Å²	83	120.3 Å²	120.3	58%	0.58	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.3	-4.7	-169.1	49.6	0	0	0	0	116.5	V43 A44	V43-S47 PolarHBondContact O-OG 3.49Å; A44-S47 PolarHBondContact O-N 3.31Å; A44-S47 PolarHBondContact O-OG 2.66Å
48	L	36.7	Very low	38.3	Very low	152 Å²	152	122.1 Å²	122.1	80%	0.796	69%	0.687	S	S	*	*			trans	-128.3	59.4	175	-80.2	166.7	0	0	0	112	A44	A44-L48 PolarHBondContact O-N 2.81Å
49	G	35	Very low	38	Very low	79 Å²	79	125 Å²	125	81%	0.814	70%	0.7	S	S	*	*			trans	-102.5	2.4	173.2	0	0	0	0	0	115
50	E	32.6	Very low	37.9	Very low	173 Å²	173	130.2 Å²	130.2	81%	0.808	71%	0.711	S	S	*	*			trans	-138.4	145.3	175.9	-68.5	-171.7	151.1	0	0	108.5
51	S	32.2	Very low	37.6	Very low	105 Å²	105	129.9 Å²	129.9	73%	0.734	72%	0.724	S	S	*	*			cis	-158.9	149.2	-13.6	54.7	0	0	0	0	109.1
52	K	32.2	Very low	37.6	Very low	204 Å²	204	133.9 Å²	133.9	89%	0.887	74%	0.737	S	S	*	*			trans	167	98.6	142.5	-96.6	171	-179.7	178.8	0	112.5
53	E	30.8	Very low	37.5	Very low	200 Å²	200	140 Å²	140	94%	0.935	75%	0.752	S	S	*	*				-142.9	138.4	129	-117.6	175.8	179.7	0	0	107.8
54	G	29.3	Very low	37.5	Very low	74 Å²	74	143.9 Å²	143.9	76%	0.763	76%	0.764	S	S	*	*			trans	-105.4	170.7	168.8	0	0	0	0	0	109.3
55	S	31.1	Very low	37.6	Very low	105 Å²	105	146.2 Å²	146.2	73%	0.734	78%	0.778	S	S	*	*			cis	-150.7	-162.1	10.6	-171.4	0	0	0	0	109.4
56	E	31.5	Very low	37.9	Very low	141 Å²	141	148.3 Å²	148.3	66%	0.659	79%	0.789	S	S	*	*			trans	80.7	71.4	162.4	-48.5	-49.8	94.7	0	0	118.2
57	H	30.8	Very low	38.5	Very low	131 Å²	131	149.1 Å²	149.1	61%	0.606	79%	0.789	S	S	*	*				75	99.7	126.7	-67.9	-63.3	0	0	0	122.5
58	H	39.2	Very low	38.9	Very low	157 Å²	157	156.1 Å²	156.1	73%	0.727	80%	0.803	S	S	*	*				91.5	133.5	118.5	-71.7	-33.3	0	0	0	121.6
59	K	41.1	Very low	39.8	Very low	202 Å²	202	153.9 Å²	153.9	88%	0.878	80%	0.8	S	S	*	*			trans	63.7	104.7	167.4	-55.7	160.8	-173.2	171.9	0	112.8
60	R	43.3	Very low	40.8	Very low	237 Å²	237	159.7 Å²	159.7	89%	0.894	80%	0.802	S	S	*	*				-178.4	77.1	66.3	-173.8	-177.9	-166	166.8	3	111	K62	R60-K62 PolarHBondContact O-N 2.97Å; R60-K62 VanDerWaalsContact O-N 3.15Å
61	A	38.6	Very low	41.8	Very low	104 Å²	104	162.8 Å²	162.8	86%	0.86	81%	0.807	S	S	*	*			trans	-62.3	116.9	169.7	0	0	0	0	0	109.7	R63	A61-R63 PolarHBondContact O-N 2.99Å
62	K	43.1	Very low	43.3	Very low	186 Å²	186	166.2 Å²	166.2	81%	0.809	80%	0.803	S	S	*	*			trans	-64	125.5	167	-91.9	-178.2	172.6	-179.9	0	107.8	R60 E64	R60-K62 PolarHBondContact O-N 2.97Å; R60-K62 VanDerWaalsContact O-N 3.15Å; K62-E64 PolarHBondContact O-N 3.36Å
63	R	44.3	Very low	44.9	Very low	240 Å²	240	167.9 Å²	167.9	91%	0.906	81%	0.805	S	S	*	*			trans	-68.3	110	152.6	-79.2	178.8	169.3	171.4	-4.7	106.9	A61 S65	A61-R63 PolarHBondContact O-N 2.99Å; R63-S65 PolarHBondContact O-N 3.37Å
64	E	47.4	Very low	46.7	Very low	177 Å²	177	162.6 Å²	162.6	83%	0.827	79%	0.785	S	S	*	*			trans	-73.5	101	155.8	-63.3	-156.3	148.9	0	0	106.9	K62 L66	K62-E64 PolarHBondContact O-N 3.36Å; E64-L66 PolarHBondContact O-N 3.17Å
65	S	45.3	Very low	49.1	Very low	97 Å²	97	162.4 Å²	162.4	68%	0.678	77%	0.767	S	S	*	*			trans	-68.6	130	174.8	48.2	0	0	0	0	109.1	R63 S67	R63-S65 PolarHBondContact O-N 3.37Å; S65-S67 PolarHBondContact O-N 3.49Å
66	L	48.4	Very low	51.6	Low	181 Å²	181	164.3 Å²	164.3	95%	0.948	77%	0.769	S	S	*	*			trans	-61.6	84.8	167.7	-72	171.4	0	0	0	109.6	E64 R68	E64-L66 PolarHBondContact O-N 3.17Å; L66-R68 PolarHBondContact O-N 3.37Å; L66-R68 VanDerWaalsContact O-N 3.16Å
67	S	51.9	Low	54.4	Low	104 Å²	104	160.8 Å²	160.8	73%	0.727	76%	0.757	S	S	*	*			trans	-77.5	100.2	-180	-171.9	0	0	0	0	108.7	S65 S69	S65-S67 PolarHBondContact O-N 3.49Å; S67-S69 PolarHBondContact O-N 2.94Å
68	R	53.1	Low	57.3	Low	230 Å²	230	155.6 Å²	155.6	87%	0.868	73%	0.733	S	S	*	*			trans	-64.7	100.4	170.9	-173.8	-173.3	-170.2	-154.7	5.8	108.5	L66 K70	L66-R68 PolarHBondContact O-N 3.37Å; L66-R68 VanDerWaalsContact O-N 3.16Å; R68-K70 PolarHBondContact O-N 3.09Å
69	S	55.3	Low	59.9	Low	104 Å²	104	154.3 Å²	154.3	73%	0.727	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-54.6	129.8	169.4	46.9	0	0	0	0	109.4	S67 R71	S67-S69 PolarHBondContact O-N 2.94Å; S69-R71 PolarHBondContact O-N 2.9Å
70	K	55.2	Low	62.4	Low	201 Å²	201	145.3 Å²	145.3	87%	0.874	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-64.8	135.8	168.2	-78.5	-173.7	174	-176.2	0	107.7	R68 R72	R68-K70 PolarHBondContact O-N 3.09Å; K70-R72 PolarHBondContact O-N 3.47Å
71	R	54.5	Low	64.7	Low	239 Å²	239	139.7 Å²	139.7	90%	0.902	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-56.8	125.2	164.8	-64.1	178.7	-179.9	170.9	-3.1	107.5	S69	S69-R71 PolarHBondContact O-N 2.9Å
72	R	63.5	Low	67.3	Low	176 Å²	176	135 Å²	135	66%	0.664	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-75.2	129.4	166.6	-171.4	175.1	82	160	2.4	106.6	K70 V74	K70-R72 PolarHBondContact O-N 3.47Å; R72-V74 PolarHBondContact O-N 2.87Å
73	W	64.9	Low	69.5	Low	240 Å²	240	130.1 Å²	130.1	91%	0.909	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-69.5	121.9	162.3	-67.3	105.8	0	0	0	107.1
74	V	69	Low	71.7	Confident	88 Å²	88	120.3 Å²	120.3	53%	0.533	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-88.2	145.9	163.7	-171.6	0	0	0	0	106	R72	R72-V74 PolarHBondContact O-N 2.87Å
75	L	80.6	Confident	73.7	Confident	71 Å²	71	118.9 Å²	118.9	37%	0.372	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-69	152.3	172.7	-67.4	176.1	0	0	0	109.5	M95 F146 F163	L75-M95 HydrophobicContact CD1-CE 4.08Å; L75-M95 HydrophobicContact CD1-SD 3.84Å; L75-F146 HydrophobicContact CD1-CE1 3.56Å; L75-F146 HydrophobicContact CD1-CZ 4.1Å; L75-F163 HydrophobicContact CB-CB 4.07Å; L75-F163 HydrophobicContact CD1-CB 3.99Å
76	N	83.6	Confident	75.9	Confident	145 Å²	145	116.4 Å²	116.4	78%	0.775	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-68	138.2	171.7	-68	5.5	0	0	0	108.9
77	T	88.8	Confident	78	Confident	67 Å²	67	116.5 Å²	116.5	41%	0.411	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-52.7	137.6	165.3	-51.8	0	0	0	0	110.1	D164 D166	T77-D164 WeakPolarHBondContact CA-O 3.41Å; T77-D164 HydrophobicContact CG2-CB 4.1Å; T77-D166 HydrophobicContact CG2-CB 3.43Å; T77-D166 VanDerWaalsContact CG2-CB 3.43Å
78	I	91.8	Very high	79.8	Confident	22 Å²	22	114.4 Å²	114.4	11%	0.113	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	120.8	175.2	-56.3	174.9	0	0	0	107.4	L80 I92 T93 M95 F163 D164 V165 D166	I78-L80 HydrophobicContact CG2-CD2 4.32Å; I78-L80 HydrophobicContact CG2-CG 4.32Å; I78-I92 HydrophobicContact CD1-CD1 4.45Å; I78-T93 HydrophobicContact CD1-CG2 3.48Å; I78-T93 VanDerWaalsContact CD1-CG2 3.48Å; I78-M95 HydrophobicContact CD1-CE 4.5Å; I78-F163 HydrophobicContact CD1-CD2 3.5Å; I78-F163 HydrophobicContact CD1-CE2 3.57Å; I78-F163 HydrophobicContact CG1-CD2 4.2Å; I78-D164 PolarHBondContact N-O 2.76Å; I78-V165 HydrophobicContact CB-CG2 4.39Å; I78-V165 HydrophobicContact CD1-CG2 4.5Å; I78-V165 CarbonylContact O-C 3.48Å; I78-V165 WeakPolarHBondContact O-CA 3.48Å; I78-D166 PolarHBondContact O-N 2.77Å
79	E	93.4	Very high	81.7	Confident	129 Å²	129	106.8 Å²	106.8	60%	0.603	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	125.1	179	-59.9	-171.6	143.2	0	0	109.3	D166 K168	E79-D166 WeakPolarHBondContact CA-O 3.32Å; E79-K168 HydrophobicContact CB-CG 4.39Å; E79-K168 VanDerWaalsContact CD-NZ 3.31Å; E79-K168 VanDerWaalsContact CG-CE 3.44Å; E79-K168 WeakPolarHBondContact OE1-CE 3.22Å; E79-K168 IonicContact OE1-NZ 2.73Å; E79-K168 PolarHBondContact OE1-NZ 2.76Å
80	L	93.6	Very high	83.5	Confident	14 Å²	14	106.1 Å²	106.1	7%	0.073	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	136.5	175.4	-62.3	176.7	0	0	0	109.1	I78 I92 L134 V165 D166 V167 K168	I78-L80 HydrophobicContact CG2-CD2 4.32Å; I78-L80 HydrophobicContact CG2-CG 4.32Å; L80-I92 HydrophobicContact CD1-CB 4.35Å; L80-I92 HydrophobicContact CD1-CD1 4.32Å; L80-I92 HydrophobicContact CD1-CG2 3.74Å; L80-I92 HydrophobicContact CD2-CB 4.12Å; L80-I92 HydrophobicContact CD2-CG2 3.78Å; L80-I92 HydrophobicContact CG-CG2 4.42Å; L80-L134 HydrophobicContact CB-CD1 4.22Å; L80-L134 HydrophobicContact CD1-CD1 3.86Å; L80-V165 HydrophobicContact CD1-CG1 3.53Å; L80-V165 HydrophobicContact CG-CG1 4.01Å; L80-D166 PolarHBondContact N-O 2.91Å; L80-V167 CarbonylContact O-C 3.54Å; L80-V167 WeakPolarHBondContact O-CA 3.16Å; L80-K168 PolarHBondContact O-N 2.84Å
81	E	92.1	Very high	85.3	Confident	119 Å²	119	100.6 Å²	100.6	56%	0.556	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	150.3	167.7	-160.1	165.6	-149.4	0	0	109	M84 I170	E81-M84 HydrophobicContact CB-CG 3.87Å; E81-M84 HydrophobicContact CB-SD 4.26Å; E81-M84 VanDerWaalsContact O-CG 3.25Å; E81-M84 WeakPolarHBondContact O-CG 3.44Å; E81-M84 VanDerWaalsContact O-SD 3.37Å; E81-I170 HydrophobicContact CG-CG2 3.73Å
82	E	93.2	Very high	87.1	Confident	4 Å²	4	90.3 Å²	90.3	2%	0.019	43%	0.43	C	S	.	.	S	Bend	trans	-81.6	173.1	171.1	68.9	-164.5	120.3	0	0	112.5	M84 R136 V167 K168 D169 I170	E82-M84 PolarHBondContact O-N 2.87Å; E82-R136 VanDerWaalsContact CD-CB 3.46Å; E82-R136 WeakPolarHBondContact OE1-CB 3.42Å; E82-R136 WeakPolarHBondContact OE1-CD 3.45Å; E82-R136 IonicContact OE1-NE 3.83Å; E82-R136 WeakPolarHBondContact OE2-CB 3.48Å; E82-R136 PolarHBondContact OE2-N 2.61Å; E82-V167 HydrophobicContact CB-CG1 3.71Å; E82-K168 PolarHBondContact N-O 3.27Å; E82-D169 WeakPolarHBondContact OE1-CA 3.48Å; E82-I170 HydrophobicContact CG-CB 4.35Å; E82-I170 HydrophobicContact CG-CD1 3.92Å; E82-I170 HydrophobicContact CG-CG1 3.64Å; E82-I170 HydrophobicContact CG-CG2 4.11Å; E82-I170 PolarHBondContact OE1-N 3.37Å; E82-I170 VanDerWaalsContact OE1-N 3.11Å
83	E	89.3	Confident	88.5	Confident	84 Å²	84	84 Å²	84	39%	0.393	41%	0.411	S	S	.	.	S	Bend	trans	55.4	-0.8	179.2	-90.3	-86.5	95.7	0	0	116.7	D85 R133 L134 I170	E83-D85 PolarHBondContact O-N 2.89Å; E83-R133 WeakPolarHBondContact O-CD 3.4Å; E83-R133 PolarHBondContact O-NE 3.03Å; E83-R133 VanDerWaalsContact O-NE 3.07Å; E83-R133 VanDerWaalsContact OE1-CD 3.27Å; E83-R133 WeakPolarHBondContact OE1-CD 3.29Å; E83-R133 IonicContact OE1-CZ 2.7Å; E83-R133 IonicContact OE1-NE 3.43Å; E83-R133 IonicContact OE1-NH1 3.32Å; E83-R133 PolarHBondContact OE1-NH1 3.3Å; E83-R133 IonicContact OE2-NH1 2.74Å; E83-R133 PolarHBondContact OE2-NH1 3.09Å; E83-L134 PolarHBondContact N-O 2.78Å; E83-I170 HydrophobicContact CB-CD1 3.81Å; E83-I170 HydrophobicContact CG-CD1 4.09Å
84	M	90.4	Very high	89.7	Confident	35 Å²	35	75.7 Å²	75.7	17%	0.172	39%	0.387	C	S	.	.			trans	-38.2	121.7	-166.4	-76.8	177	67.1	0	0	114.4	E81 E82 V86 Y88 Y90	E81-M84 HydrophobicContact CB-CG 3.87Å; E81-M84 HydrophobicContact CB-SD 4.26Å; E81-M84 VanDerWaalsContact O-CG 3.25Å; E81-M84 WeakPolarHBondContact O-CG 3.44Å; E81-M84 VanDerWaalsContact O-SD 3.37Å; E82-M84 PolarHBondContact O-N 2.87Å; M84-V86 HydrophobicContact CB-CG1 4.4Å; M84-V86 HydrophobicContact CB-CG2 4.04Å; M84-V86 HydrophobicContact CE-CG1 3.84Å; M84-V86 HydrophobicContact CE-CG2 4.37Å; M84-V86 PolarHBondContact O-N 3.45Å; M84-Y88 PolarHBondContact O-OH 2.82Å; M84-Y88 VanDerWaalsContact O-OH 3.05Å; M84-Y90 HydrophobicContact CE-CD1 4.18Å; M84-Y90 HydrophobicContact CE-CE1 3.71Å
85	D	89.6	Confident	90.7	Very high	147 Å²	147	72.3 Å²	72.3	79%	0.786	37%	0.366	S	S	*	.			trans	-81.8	70.5	177.6	-153.7	46.2	0	0	0	111.4	E83 R133	E83-D85 PolarHBondContact O-N 2.89Å; D85-R133 IonicContact OD1-CZ 3.49Å; D85-R133 IonicContact OD1-NH2 3.47Å; D85-R133 PolarHBondContact OD1-NH2 3.45Å
86	V	91.5	Very high	91	Very high	44 Å²	44	76 Å²	76	27%	0.267	38%	0.381	S	S	.	.			trans	-122.2	155.4	179.9	-65.6	0	0	0	0	111.6	M84 Y88 Y90	M84-V86 HydrophobicContact CB-CG1 4.4Å; M84-V86 HydrophobicContact CB-CG2 4.04Å; M84-V86 HydrophobicContact CE-CG1 3.84Å; M84-V86 HydrophobicContact CE-CG2 4.37Å; M84-V86 PolarHBondContact O-N 3.45Å; V86-Y88 HydrophobicContact CG2-CD1 4.47Å; V86-Y88 HydrophobicContact CG2-CD2 4.41Å; V86-Y88 HydrophobicContact CG2-CE1 3.91Å; V86-Y88 HydrophobicContact CG2-CE2 3.85Å; V86-Y88 WeakPolarHBondContact O-CD2 3.47Å; V86-Y88 WeakPolarHBondContact O-CE2 3.45Å; V86-Y88 PolarHBondContact O-N 3.11Å; V86-Y90 HydrophobicContact CB-CD2 3.9Å; V86-Y90 HydrophobicContact CB-CE2 4.45Å; V86-Y90 HydrophobicContact CB-CG 4.29Å; V86-Y90 HydrophobicContact CG1-CD2 4.07Å; V86-Y90 HydrophobicContact CG1-CE2 4.12Å; V86-Y90 HydrophobicContact CG2-CD1 4.47Å; V86-Y90 HydrophobicContact CG2-CD2 3.94Å; V86-Y90 HydrophobicContact CG2-CG 3.8Å
87	E	91.8	Very high	91.1	Very high	183 Å²	183	69.7 Å²	69.7	86%	0.855	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-73.4	118.1	171.2	-170.7	172.7	-169.4	0	0	109.8
88	Y	90.6	Very high	90.9	Very high	61 Å²	61	72.2 Å²	72.2	24%	0.239	36%	0.358	C	S	.	.	S	Bend	trans	-89.6	141.1	178.9	-68	-83	0	0	0	111.3	M84 V86 V130 H131 R132 R133	M84-Y88 PolarHBondContact O-OH 2.82Å; M84-Y88 VanDerWaalsContact O-OH 3.05Å; V86-Y88 HydrophobicContact CG2-CD1 4.47Å; V86-Y88 HydrophobicContact CG2-CD2 4.41Å; V86-Y88 HydrophobicContact CG2-CE1 3.91Å; V86-Y88 HydrophobicContact CG2-CE2 3.85Å; V86-Y88 WeakPolarHBondContact O-CD2 3.47Å; V86-Y88 WeakPolarHBondContact O-CE2 3.45Å; V86-Y88 PolarHBondContact O-N 3.11Å; Y88-V130 HydrophobicContact CD1-CG1 4.34Å; Y88-V130 HydrophobicContact CE1-CG1 3.98Å; Y88-H131 WeakPolarHBondContact CB-O 3.39Å; Y88-R132 WeakPolarHBondContact CE1-O 3.44Å; Y88-R132 VanDerWaalsContact CZ-C 3.45Å; Y88-R133 HydrophobicContact CE2-CG 3.79Å; Y88-R133 WeakPolarHBondContact OH-CA 2.96Å
89	P	92.4	Very high	90.4	Very high	70 Å²	70	75.6 Å²	75.6	46%	0.455	37%	0.372	S	S	.	.	S	Bend	cis	-80	127.1	7.6	30.8	-34.9	0	0	0	113.9	Y129 V130	P89-Y129 HydrophobicContact CB-CD1 4.23Å; P89-V130 CarbonylContact C-O 3.55Å; P89-V130 VanDerWaalsContact CA-O 3.26Å; P89-V130 WeakPolarHBondContact CA-O 3.21Å
90	Y	93.3	Very high	89.7	Confident	90 Å²	90	70.2 Å²	70.2	35%	0.353	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	134.7	-177.6	178.2	-104.5	0	0	0	111.1	M84 V86 I92 Y129 V130	M84-Y90 HydrophobicContact CE-CD1 4.18Å; M84-Y90 HydrophobicContact CE-CE1 3.71Å; V86-Y90 HydrophobicContact CB-CD2 3.9Å; V86-Y90 HydrophobicContact CB-CE2 4.45Å; V86-Y90 HydrophobicContact CB-CG 4.29Å; V86-Y90 HydrophobicContact CG1-CD2 4.07Å; V86-Y90 HydrophobicContact CG1-CE2 4.12Å; V86-Y90 HydrophobicContact CG2-CD1 4.47Å; V86-Y90 HydrophobicContact CG2-CD2 3.94Å; V86-Y90 HydrophobicContact CG2-CG 3.8Å; Y90-I92 HydrophobicContact CD1-CG2 3.95Å; Y90-I92 HydrophobicContact CE1-CG2 4.33Å; Y90-Y129 CarbonylContact O-C 3.57Å; Y90-Y129 WeakPolarHBondContact O-CA 3.43Å; Y90-V130 HydrophobicContact CD1-CG1 4.24Å; Y90-V130 PolarHBondContact N-O 2.9Å; Y90-V130 PolarHBondContact O-N 3.07Å
91	K	93.9	Very high	88.9	Confident	84 Å²	84	72.8 Å²	72.8	37%	0.365	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	116.3	-177.4	-177	-177.9	169.2	177.5	0	110.9	T93 T94 E127 Y129	K91-T93 WeakPolarHBondContact CE-O 3.34Å; K91-T94 WeakPolarHBondContact CE-OG1 3.29Å; K91-T94 PolarHBondContact NZ-OG1 2.96Å; K91-E127 HydrophobicContact CD-CB 4.42Å; K91-E127 HydrophobicContact CD-CG 4.4Å; K91-E127 WeakPolarHBondContact CE-OE1 3.46Å; K91-E127 IonicContact NZ-OE1 2.62Å; K91-E127 PolarHBondContact NZ-OE1 2.8Å; K91-Y129 HydrophobicContact CB-CD1 3.9Å; K91-Y129 HydrophobicContact CB-CE1 3.67Å; K91-Y129 HydrophobicContact CG-CE1 4.21Å
92	I	92.6	Very high	88	Confident	23 Å²	23	75.4 Å²	75.4	12%	0.118	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-31.9	-176.3	67.2	168.5	0	0	0	113.3	I78 L80 Y90 F119 V128 V130 V165	I78-I92 HydrophobicContact CD1-CD1 4.45Å; L80-I92 HydrophobicContact CD1-CB 4.35Å; L80-I92 HydrophobicContact CD1-CD1 4.32Å; L80-I92 HydrophobicContact CD1-CG2 3.74Å; L80-I92 HydrophobicContact CD2-CB 4.12Å; L80-I92 HydrophobicContact CD2-CG2 3.78Å; L80-I92 HydrophobicContact CG-CG2 4.42Å; Y90-I92 HydrophobicContact CD1-CG2 3.95Å; Y90-I92 HydrophobicContact CE1-CG2 4.33Å; I92-F119 HydrophobicContact CD1-CD1 3.91Å; I92-F119 HydrophobicContact CD1-CE1 3.93Å; I92-V128 HydrophobicContact CD1-CB 4.49Å; I92-V128 HydrophobicContact CD1-CG1 3.85Å; I92-V128 HydrophobicContact CG1-CB 3.98Å; I92-V128 HydrophobicContact CG1-CG1 3.84Å; I92-V128 WeakPolarHBondContact CG1-O 3.22Å; I92-V128 PolarHBondContact N-O 3.07Å; I92-V130 HydrophobicContact CG2-CB 4.11Å; I92-V130 HydrophobicContact CG2-CG1 3.65Å; I92-V165 HydrophobicContact CD1-CG2 4.27Å
93	T	91.6	Very high	87.4	Confident	43 Å²	43	77.5 Å²	77.5	26%	0.264	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163	-173.5	178.1	-166.2	0	0	0	0	112.8	I78 K91 M95 V128	I78-T93 HydrophobicContact CD1-CG2 3.48Å; I78-T93 VanDerWaalsContact CD1-CG2 3.48Å; K91-T93 WeakPolarHBondContact CE-O 3.34Å; T93-M95 HydrophobicContact CG2-CE 3.83Å; T93-V128 HydrophobicContact CG2-CB 3.76Å; T93-V128 HydrophobicContact CG2-CG2 3.73Å; T93-V128 PolarHBondContact N-O 2.95Å; T93-V128 PolarHBondContact O-N 2.74Å
94	T	91.3	Very high	87.1	Confident	66 Å²	66	80.4 Å²	80.4	41%	0.405	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	115.3	167.3	-54.1	0	0	0	0	109.6	K91 S125 E127	K91-T94 WeakPolarHBondContact CE-OG1 3.29Å; K91-T94 PolarHBondContact NZ-OG1 2.96Å; T94-S125 WeakPolarHBondContact CG2-O 3.38Å; T94-E127 HydrophobicContact CG2-CG 3.97Å
95	M	89.1	Confident	87	Confident	17 Å²	17	80.3 Å²	80.3	8%	0.084	42%	0.415	C	S	.	.			trans	-79.5	143.7	174.3	-69.4	-68.2	154.9	0	0	110.4	L75 I78 T93 I121 G126 V128 F146 F163	L75-M95 HydrophobicContact CD1-CE 4.08Å; L75-M95 HydrophobicContact CD1-SD 3.84Å; I78-M95 HydrophobicContact CD1-CE 4.5Å; T93-M95 HydrophobicContact CG2-CE 3.83Å; M95-I121 HydrophobicContact CB-CD1 3.99Å; M95-I121 HydrophobicContact CG-CD1 4.21Å; M95-G126 PolarHBondContact N-O 2.96Å; M95-V128 HydrophobicContact CG-CG2 3.95Å; M95-F146 HydrophobicContact CB-CE2 4.47Å; M95-F146 HydrophobicContact SD-CD1 4.3Å; M95-F146 HydrophobicContact SD-CE1 3.92Å; M95-F146 HydrophobicContact SD-CE2 4.46Å; M95-F146 HydrophobicContact SD-CZ 4Å; M95-F163 HydrophobicContact CE-CB 4.25Å; M95-F163 HydrophobicContact CE-CD1 3.36Å; M95-F163 HydrophobicContact CE-CD2 3.99Å; M95-F163 HydrophobicContact CE-CE1 3.55Å; M95-F163 HydrophobicContact CE-CE2 4.15Å; M95-F163 HydrophobicContact CE-CG 3.59Å; M95-F163 HydrophobicContact CE-CZ 3.94Å; M95-F163 HydrophobicContact CG-CE1 4.46Å; M95-F163 HydrophobicContact SD-CD1 4.21Å; M95-F163 HydrophobicContact SD-CE1 4.35Å
96	H	86.4	Confident	86.9	Confident	150 Å²	150	75.3 Å²	75.3	69%	0.694	39%	0.386	S	S	*	.			trans	-140.1	147.3	179.5	-176.6	67.8	0	0	0	110.6
97	N	86.3	Confident	86.8	Confident	11 Å²	11	73.4 Å²	73.4	6%	0.059	37%	0.374	C	S	.	.			trans	-135.9	126.9	178.8	-178	-44.9	0	0	0	108.3	K99 T100 F107 V148	N97-K99 PolarHBondContact O-N 3.49Å; N97-K99 WeakPolarHBondContact OD1-CB 3.08Å; N97-K99 PolarHBondContact OD1-N 2.65Å; N97-T100 HydrophobicContact CB-CG2 4.03Å; N97-T100 PolarHBondContact O-N 3.1Å; N97-T100 PolarHBondContact O-OG1 2.9Å; N97-F107 HydrophobicContact CB-CE1 4.46Å; N97-V148 HydrophobicContact CB-CG2 4.03Å
98	D	84.1	Confident	86.7	Confident	121 Å²	121	68.1 Å²	68.1	65%	0.647	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-70.6	-18.1	-172.1	65.6	-27.4	0	0	0	113.8
99	K	81.8	Confident	86.7	Confident	93 Å²	93	66.6 Å²	66.6	40%	0.404	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-86	-3.1	-179.2	-65.1	150.9	-170.7	161.3	0	114	N97 A101 I157 D158	N97-K99 PolarHBondContact O-N 3.49Å; N97-K99 WeakPolarHBondContact OD1-CB 3.08Å; N97-K99 PolarHBondContact OD1-N 2.65Å; K99-A101 VanDerWaalsContact C-N 3.26Å; K99-A101 PolarHBondContact O-N 2.76Å; K99-I157 HydrophobicContact CB-CG2 3.66Å; K99-D158 HydrophobicContact CD-CB 4.2Å; K99-D158 IonicContact NZ-OD1 3.8Å; K99-D158 PolarHBondContact NZ-OD1 3.05Å; K99-D158 IonicContact NZ-OD2 2.78Å; K99-D158 PolarHBondContact NZ-OD2 3.35Å
100	T	79.9	Confident	86.4	Confident	16 Å²	16	66.3 Å²	66.3	10%	0.098	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-79.3	-9.8	177.8	64.4	0	0	0	0	113.5	N97 N102 V103 H105 V148	N97-T100 HydrophobicContact CB-CG2 4.03Å; N97-T100 PolarHBondContact O-N 3.1Å; N97-T100 PolarHBondContact O-OG1 2.9Å; T100-N102 PolarHBondContact O-N 3.25Å; T100-V103 PolarHBondContact O-N 2.92Å; T100-H105 HydrophobicContact CG2-CB 4.35Å; T100-V148 HydrophobicContact CG2-CG1 3.79Å
101	A	74.8	Confident	86.1	Confident	68 Å²	68	63.3 Å²	63.3	56%	0.562	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	111.9	179.4	0	0	0	0	0	111.7	K99	K99-A101 VanDerWaalsContact C-N 3.26Å; K99-A101 PolarHBondContact O-N 2.76Å
102	N	74.8	Confident	85.3	Confident	174 Å²	174	65.4 Å²	65.4	93%	0.93	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	19.4	-175.7	-38.4	-82.5	0	0	0	115.8	T100	T100-N102 PolarHBondContact O-N 3.25Å
103	V	79.6	Confident	83.9	Confident	48 Å²	48	72.7 Å²	72.7	29%	0.291	39%	0.387	S	S	.	.	S	Bend	trans	-116	132.2	172.4	-179.9	0	0	0	0	109.7	T100 H105 D150 I157	T100-V103 PolarHBondContact O-N 2.92Å; V103-H105 PolarHBondContact O-N 3.39Å; V103-H105 PolarHBondContact O-ND1 2.91Å; V103-D150 HydrophobicContact CG1-CB 4.3Å; V103-I157 HydrophobicContact CG1-CD1 3.91Å
104	E	83.8	Confident	82.7	Confident	145 Å²	145	72.4 Å²	72.4	68%	0.678	38%	0.383	S	S	*	.			trans	-74	112.8	169.2	-163.9	-176.4	175.4	0	0	108.5	I151	E104-I151 HydrophobicContact CG-CB 4.38Å; E104-I151 HydrophobicContact CG-CD1 4.2Å; E104-I151 PolarHBondContact O-N 2.8Å
105	H	87.1	Confident	81.1	Confident	33 Å²	33	77.6 Å²	77.6	15%	0.153	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	160.1	-165.9	63.5	-77.8	0	0	0	111.4	T100 V103 F107 V148 W149 I151 I157	T100-H105 HydrophobicContact CG2-CB 4.35Å; V103-H105 PolarHBondContact O-N 3.39Å; V103-H105 PolarHBondContact O-ND1 2.91Å; H105-F107 AromaticContact CD2-CE2 3.69Å; H105-F107 AromaticContact NE2-CE2 3.53Å; H105-V148 HydrophobicContact CB-CG1 4.24Å; H105-W149 CarbonylContact C-O 3.57Å; H105-W149 WeakPolarHBondContact CA-O 3.47Å; H105-W149 WeakPolarHBondContact CB-O 3.42Å; H105-I151 WeakPolarHBondContact O-CD1 3.29Å; H105-I157 HydrophobicContact CB-CD1 3.71Å
106	H	89	Confident	79.8	Confident	41 Å²	41	79.5 Å²	79.5	19%	0.19	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	144.2	159.7	67.2	-81.6	0	0	0	113.4	K123 V148 W149 I151	H106-K123 CarbonylContact C-O 3.44Å; H106-K123 WeakPolarHBondContact CA-O 3.29Å; H106-K123 HydrophobicContact CB-CB 3.99Å; H106-K123 HydrophobicContact CB-CD 4.28Å; H106-K123 HydrophobicContact CB-CG 4.45Å; H106-V148 WeakPolarHBondContact O-CA 3.49Å; H106-W149 VanDerWaalsContact CE1-CB 3.49Å; H106-W149 WeakPolarHBondContact CE1-CB 3.38Å; H106-W149 PolarHBondContact N-O 3.06Å; H106-W149 AromaticContact NE2-CD1 3.8Å; H106-W149 PolarHBondContact O-N 2.76Å; H106-I151 HydrophobicContact CB-CD1 4.16Å; H106-I151 HydrophobicContact CB-CG1 4.47Å; H106-I151 WeakPolarHBondContact ND1-CG1 3.43Å
107	F	89.3	Confident	79.5	Confident	4 Å²	4	80.1 Å²	80.1	2%	0.018	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	145.9	165.4	-66.5	-87.1	0	0	0	111	N97 H105 I121 K123 D147 V148	N97-F107 HydrophobicContact CB-CE1 4.46Å; H105-F107 AromaticContact CD2-CE2 3.69Å; H105-F107 AromaticContact NE2-CE2 3.53Å; F107-I121 HydrophobicContact CB-CD1 3.67Å; F107-I121 HydrophobicContact CB-CG1 3.86Å; F107-I121 HydrophobicContact CB-CG2 3.93Å; F107-I121 HydrophobicContact CD1-CD1 4.06Å; F107-I121 HydrophobicContact CG-CD1 4.04Å; F107-I121 HydrophobicContact CG-CG1 4.5Å; F107-K123 PolarHBondContact N-O 2.64Å; F107-D147 WeakPolarHBondContact CA-O 3.38Å; F107-V148 HydrophobicContact CD1-CG1 4.24Å; F107-V148 HydrophobicContact CD1-CG2 3.71Å; F107-V148 HydrophobicContact CE1-CG1 4.17Å; F107-V148 HydrophobicContact CE1-CG2 3.65Å; F107-V148 HydrophobicContact CZ-CG1 4.45Å
108	E	88.9	Confident	79.6	Confident	72 Å²	72	80.2 Å²	80.2	34%	0.336	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	146.9	173.2	-174.2	160.4	-112.8	0	0	108.6	F146 D147 W149	E108-F146 WeakPolarHBondContact O-CA 3.46Å; E108-D147 PolarHBondContact N-O 3.32Å; E108-D147 PolarHBondContact O-N 3.05Å; E108-W149 PolarHBondContact OE2-NE1 3.48Å
109	I	90.6	Very high	79.9	Confident	29 Å²	29	74.9 Å²	74.9	15%	0.149	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	146.6	172	59.1	171.5	0	0	0	110.2	F119 I121 I144 T145 F146	I109-F119 HydrophobicContact CD1-CB 3.95Å; I109-I121 HydrophobicContact CB-CG2 4.38Å; I109-I121 HydrophobicContact CD1-CB 4.42Å; I109-I121 HydrophobicContact CG1-CB 4.28Å; I109-I121 HydrophobicContact CG1-CG2 4.12Å; I109-I121 HydrophobicContact CG2-CB 3.85Å; I109-I121 HydrophobicContact CG2-CD1 4.06Å; I109-I121 HydrophobicContact CG2-CG2 3.86Å; I109-I144 HydrophobicContact CB-CG2 3.96Å; I109-I144 HydrophobicContact CD1-CG2 4.23Å; I109-I144 HydrophobicContact CG2-CG2 4.09Å; I109-T145 VanDerWaalsContact CA-O 3.27Å; I109-T145 WeakPolarHBondContact CA-O 3.37Å; I109-T145 WeakPolarHBondContact CB-O 3.48Å; I109-F146 HydrophobicContact CG2-CB 3.7Å
110	S	86.9	Confident	80.4	Confident	64 Å²	64	72.8 Å²	72.8	45%	0.448	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.5	165.4	-59.4	0	0	0	0	107.9	T145	S110-T145 PolarHBondContact N-O 3.41Å; S110-T145 PolarHBondContact O-N 3Å
111	V	85.6	Confident	81	Confident	27 Å²	27	72.9 Å²	72.9	16%	0.164	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	133.4	176.5	-178.6	0	0	0	0	107.7	D114 F119 Y142 I144	V111-D114 HydrophobicContact CB-CB 3.91Å; V111-D114 HydrophobicContact CG1-CB 3.67Å; V111-F119 HydrophobicContact CG1-CD2 4.44Å; V111-F119 HydrophobicContact CG2-CB 4.16Å; V111-F119 HydrophobicContact CG2-CD2 4.21Å; V111-Y142 HydrophobicContact CG1-CD1 4.31Å; V111-I144 HydrophobicContact CG1-CG1 4.25Å; V111-I144 HydrophobicContact CG2-CB 4.49Å; V111-I144 HydrophobicContact CG2-CD1 4.09Å; V111-I144 HydrophobicContact CG2-CG1 3.89Å; V111-I144 HydrophobicContact CG2-CG2 4.13Å
112	E	77.6	Confident	81.8	Confident	129 Å²	129	72.8 Å²	72.8	60%	0.603	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	130.1	176.8	-158	157.9	-165.6	0	0	109.4	D114 H143	E112-D114 VanDerWaalsContact C-N 3.32Å; E112-D114 PolarHBondContact O-N 3.02Å; E112-H143 HydrophobicContact CB-CB 4.36Å; E112-H143 PolarHBondContact N-O 3.4Å; E112-H143 VanDerWaalsContact N-O 3.09Å; E112-H143 IonicContact OE2-CD2 2.61Å
113	D	64.6	Low	82.5	Confident	176 Å²	176	69.9 Å²	69.9	94%	0.941	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	18.7	-177.3	-67.2	-22.2	0	0	0	118.8
114	D	64.4	Low	82.8	Confident	36 Å²	36	72.7 Å²	72.7	19%	0.193	38%	0.377	C	S	.	.			trans	-105.2	95.6	173	179.8	39.4	0	0	0	114.9	V111 E112 S116 K117 L118	V111-D114 HydrophobicContact CB-CB 3.91Å; V111-D114 HydrophobicContact CG1-CB 3.67Å; E112-D114 VanDerWaalsContact C-N 3.32Å; E112-D114 PolarHBondContact O-N 3.02Å; D114-S116 PolarHBondContact O-N 2.99Å; D114-S116 WeakPolarHBondContact OD1-CA 3.24Å; D114-S116 WeakPolarHBondContact OD1-CB 3.39Å; D114-S116 PolarHBondContact OD1-N 3.13Å; D114-S116 PolarHBondContact OD1-OG 2.82Å; D114-K117 PolarHBondContact OD2-N 3.14Å; D114-L118 WeakPolarHBondContact OD2-CB 3.44Å; D114-L118 PolarHBondContact OD2-N 2.86Å
115	D	58.8	Low	83	Confident	175 Å²	175	68 Å²	68	94%	0.936	36%	0.36	S	S	*	.	S	Bend	trans	-72.3	-11.1	166.8	-98.8	-27.1	0	0	0	113.6
116	S	62.3	Low	83.1	Confident	58 Å²	58	66.4 Å²	66.4	41%	0.406	35%	0.353	S	S	.	.	S	Bend	trans	-95.3	-9.7	-162.3	83.8	0	0	0	0	115.8	D114	D114-S116 PolarHBondContact O-N 2.99Å; D114-S116 WeakPolarHBondContact OD1-CA 3.24Å; D114-S116 WeakPolarHBondContact OD1-CB 3.39Å; D114-S116 PolarHBondContact OD1-N 3.13Å; D114-S116 PolarHBondContact OD1-OG 2.82Å
117	K	79.3	Confident	83.3	Confident	162 Å²	162	66.7 Å²	66.7	70%	0.704	35%	0.354	S	S	*	.			trans	61.4	44.6	-172.5	-52.4	179	-177.7	177.5	0	112.4	D114 F119	D114-K117 PolarHBondContact OD2-N 3.14Å; K117-F119 PolarHBondContact O-N 2.88Å
118	L	88.6	Confident	83.4	Confident	14 Å²	14	66.5 Å²	66.5	7%	0.073	35%	0.353	C	S	.	.			trans	-62.9	-35.4	177.7	-177.4	56.4	0	0	0	111.5	D114 V130 H131 R132 L134 Y142	D114-L118 WeakPolarHBondContact OD2-CB 3.44Å; D114-L118 PolarHBondContact OD2-N 2.86Å; L118-V130 HydrophobicContact CD1-CG2 4.1Å; L118-V130 HydrophobicContact CG-CG2 4.32Å; L118-V130 CarbonylContact O-C 3.58Å; L118-V130 WeakPolarHBondContact O-CA 3.33Å; L118-H131 PolarHBondContact O-N 2.85Å; L118-R132 HydrophobicContact CD1-CB 3.94Å; L118-L134 HydrophobicContact CD1-CD2 4.08Å; L118-L134 HydrophobicContact CD2-CD2 3.72Å; L118-L134 HydrophobicContact CG-CD2 4.12Å; L118-Y142 HydrophobicContact CD2-CE1 3.73Å; L118-Y142 HydrophobicContact CD2-CE2 4.28Å; L118-Y142 VanDerWaalsContact CD2-OH 3.3Å; L118-Y142 WeakPolarHBondContact CD2-OH 3.31Å
119	F	91.1	Very high	83.6	Confident	8 Å²	8	65.6 Å²	65.6	4%	0.035	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	147	174.8	-58.2	-85	0	0	0	111.9	I92 I109 V111 K117 Y129 V130 L134 Y142 I144 V165	I92-F119 HydrophobicContact CD1-CD1 3.91Å; I92-F119 HydrophobicContact CD1-CE1 3.93Å; I109-F119 HydrophobicContact CD1-CB 3.95Å; V111-F119 HydrophobicContact CG1-CD2 4.44Å; V111-F119 HydrophobicContact CG2-CB 4.16Å; V111-F119 HydrophobicContact CG2-CD2 4.21Å; K117-F119 PolarHBondContact O-N 2.88Å; F119-Y129 CarbonylContact C-O 3.57Å; F119-Y129 VanDerWaalsContact CA-O 3.29Å; F119-Y129 WeakPolarHBondContact CA-O 3.36Å; F119-V130 HydrophobicContact CD1-CB 3.96Å; F119-V130 HydrophobicContact CD1-CG2 4.12Å; F119-V130 HydrophobicContact CE1-CB 3.84Å; F119-V130 HydrophobicContact CE1-CG2 3.74Å; F119-V130 HydrophobicContact CZ-CG2 4.24Å; F119-L134 HydrophobicContact CZ-CD2 4.27Å; F119-Y142 AromaticContact CE2-CD1 3.82Å; F119-Y142 HydrophobicContact CE2-CD1 3.82Å; F119-Y142 AromaticContact CE2-CD2 3.7Å; F119-Y142 HydrophobicContact CE2-CD2 3.7Å; F119-Y142 HydrophobicContact CE2-CE1 4.16Å; F119-Y142 HydrophobicContact CE2-CE2 4.05Å; F119-Y142 AromaticContact CE2-CG 3.57Å; F119-Y142 HydrophobicContact CE2-CG 3.57Å; F119-Y142 AromaticContact CZ-CD2 3.72Å; F119-Y142 HydrophobicContact CZ-CD2 3.72Å; F119-Y142 HydrophobicContact CZ-CE2 4.05Å; F119-Y142 HydrophobicContact CZ-CG 4.05Å; F119-I144 HydrophobicContact CB-CD1 4.1Å; F119-I144 HydrophobicContact CD1-CD1 4.03Å; F119-I144 HydrophobicContact CD2-CD1 3.81Å; F119-I144 HydrophobicContact CE1-CD1 4.43Å; F119-I144 HydrophobicContact CE2-CD1 4.24Å; F119-I144 HydrophobicContact CG-CD1 3.7Å; F119-V165 HydrophobicContact CE1-CG1 4.41Å; F119-V165 HydrophobicContact CE1-CG2 4.49Å; F119-V165 HydrophobicContact CZ-CG1 4.34Å
120	T	91.6	Very high	83.7	Confident	50 Å²	50	64.4 Å²	64.4	31%	0.307	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	145.4	169.3	63.3	0	0	0	0	111.8	V128 Y129 H131	T120-V128 WeakPolarHBondContact O-CA 3.39Å; T120-Y129 PolarHBondContact N-O 2.68Å; T120-Y129 PolarHBondContact O-N 2.83Å; T120-H131 VanDerWaalsContact CG2-NE2 3.28Å; T120-H131 WeakPolarHBondContact CG2-NE2 3.28Å; T120-H131 PolarHBondContact OG1-NE2 3.48Å
121	I	92.1	Very high	83.9	Confident	18 Å²	18	64.7 Å²	64.7	9%	0.092	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	139.1	167.2	-163.6	157.1	0	0	0	111.3	M95 F107 I109 K123 E127 V128	M95-I121 HydrophobicContact CB-CD1 3.99Å; M95-I121 HydrophobicContact CG-CD1 4.21Å; F107-I121 HydrophobicContact CB-CD1 3.67Å; F107-I121 HydrophobicContact CB-CG1 3.86Å; F107-I121 HydrophobicContact CB-CG2 3.93Å; F107-I121 HydrophobicContact CD1-CD1 4.06Å; F107-I121 HydrophobicContact CG-CD1 4.04Å; F107-I121 HydrophobicContact CG-CG1 4.5Å; I109-I121 HydrophobicContact CB-CG2 4.38Å; I109-I121 HydrophobicContact CD1-CB 4.42Å; I109-I121 HydrophobicContact CG1-CB 4.28Å; I109-I121 HydrophobicContact CG1-CG2 4.12Å; I109-I121 HydrophobicContact CG2-CB 3.85Å; I109-I121 HydrophobicContact CG2-CD1 4.06Å; I109-I121 HydrophobicContact CG2-CG2 3.86Å; I121-K123 PolarHBondContact O-N 2.92Å; I121-E127 CarbonylContact C-O 3.5Å; I121-E127 WeakPolarHBondContact CA-O 3.39Å; I121-V128 HydrophobicContact CB-CG2 4.44Å; I121-V128 HydrophobicContact CD1-CG2 3.91Å; I121-V128 HydrophobicContact CG1-CG2 4.04Å
122	N	92.4	Very high	84.1	Confident	66 Å²	66	70.8 Å²	70.8	35%	0.353	36%	0.355	S	S	.	.			trans	-70.1	118.8	167.6	-179.3	-36.2	0	0	0	108.9	T124 S125 G126 E127 Y129	N122-T124 PolarHBondContact O-N 3.35Å; N122-T124 VanDerWaalsContact O-N 3.07Å; N122-T124 PolarHBondContact OD1-N 3.18Å; N122-S125 VanDerWaalsContact CB-OG 3.24Å; N122-S125 WeakPolarHBondContact CB-OG 2.99Å; N122-S125 PolarHBondContact ND2-OG 3.21Å; N122-S125 VanDerWaalsContact ND2-OG 3.11Å; N122-S125 PolarHBondContact OD1-N 3Å; N122-S125 PolarHBondContact OD1-OG 3.24Å; N122-G126 PolarHBondContact O-N 2.5Å; N122-E127 HydrophobicContact CB-CB 4.17Å; N122-E127 PolarHBondContact N-O 3.03Å; N122-Y129 HydrophobicContact CB-CE2 4.36Å
123	K	89.6	Confident	84.8	Confident	113 Å²	113	69.7 Å²	69.7	49%	0.491	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-30.2	-174.2	-69.5	-155.3	171.5	-151.5	0	114.3	H106 F107 I121	H106-K123 CarbonylContact C-O 3.44Å; H106-K123 WeakPolarHBondContact CA-O 3.29Å; H106-K123 HydrophobicContact CB-CB 3.99Å; H106-K123 HydrophobicContact CB-CD 4.28Å; H106-K123 HydrophobicContact CB-CG 4.45Å; F107-K123 PolarHBondContact N-O 2.64Å; I121-K123 PolarHBondContact O-N 2.92Å
124	T	86.1	Confident	86.1	Confident	107 Å²	107	61.7 Å²	61.7	66%	0.656	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	-31.5	-174.5	-51.3	0	0	0	0	113.7	N122	N122-T124 PolarHBondContact O-N 3.35Å; N122-T124 VanDerWaalsContact O-N 3.07Å; N122-T124 PolarHBondContact OD1-N 3.18Å
125	S	87.8	Confident	87.4	Confident	45 Å²	45	63.2 Å²	63.2	32%	0.315	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-13.1	179.7	64.1	0	0	0	0	114.5	T94 N122 E127	T94-S125 WeakPolarHBondContact CG2-O 3.38Å; N122-S125 VanDerWaalsContact CB-OG 3.24Å; N122-S125 WeakPolarHBondContact CB-OG 2.99Å; N122-S125 PolarHBondContact ND2-OG 3.21Å; N122-S125 VanDerWaalsContact ND2-OG 3.11Å; N122-S125 PolarHBondContact OD1-N 3Å; N122-S125 PolarHBondContact OD1-OG 3.24Å; S125-E127 VanDerWaalsContact CB-OE2 3.27Å; S125-E127 WeakPolarHBondContact CB-OE2 3.49Å; S125-E127 PolarHBondContact O-N 2.95Å; S125-E127 VanDerWaalsContact OG-CD 3.3Å; S125-E127 VanDerWaalsContact OG-CG 3.25Å; S125-E127 WeakPolarHBondContact OG-CG 3.47Å; S125-E127 PolarHBondContact OG-OE2 2.56Å
126	G	88.1	Confident	89.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.27	C	S	.	.			trans	72.1	5.2	-175.8	0	0	0	0	0	114.2	M95 N122 V128	M95-G126 PolarHBondContact N-O 2.96Å; N122-G126 PolarHBondContact O-N 2.5Å; G126-V128 PolarHBondContact O-N 2.78Å
127	E	93.2	Very high	90.6	Very high	47 Å²	47	56 Å²	56	22%	0.22	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	125.7	179.8	-64.5	173.5	114.7	0	0	110.9	K91 T94 I121 N122 S125 Y129	K91-E127 HydrophobicContact CD-CB 4.42Å; K91-E127 HydrophobicContact CD-CG 4.4Å; K91-E127 WeakPolarHBondContact CE-OE1 3.46Å; K91-E127 IonicContact NZ-OE1 2.62Å; K91-E127 PolarHBondContact NZ-OE1 2.8Å; T94-E127 HydrophobicContact CG2-CG 3.97Å; I121-E127 CarbonylContact C-O 3.5Å; I121-E127 WeakPolarHBondContact CA-O 3.39Å; N122-E127 HydrophobicContact CB-CB 4.17Å; N122-E127 PolarHBondContact N-O 3.03Å; S125-E127 VanDerWaalsContact CB-OE2 3.27Å; S125-E127 WeakPolarHBondContact CB-OE2 3.49Å; S125-E127 PolarHBondContact O-N 2.95Å; S125-E127 VanDerWaalsContact OG-CD 3.3Å; S125-E127 VanDerWaalsContact OG-CG 3.25Å; S125-E127 WeakPolarHBondContact OG-CG 3.47Å; S125-E127 PolarHBondContact OG-OE2 2.56Å; E127-Y129 HydrophobicContact CB-CD2 4.41Å; E127-Y129 HydrophobicContact CB-CE2 3.56Å; E127-Y129 WeakPolarHBondContact O-CD2 3.09Å
128	V	92.5	Very high	91.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	134.8	179.9	-172.4	0	0	0	0	109.3	I92 T93 M95 T120 I121 G126 F163	I92-V128 HydrophobicContact CD1-CB 4.49Å; I92-V128 HydrophobicContact CD1-CG1 3.85Å; I92-V128 HydrophobicContact CG1-CB 3.98Å; I92-V128 HydrophobicContact CG1-CG1 3.84Å; I92-V128 WeakPolarHBondContact CG1-O 3.22Å; I92-V128 PolarHBondContact N-O 3.07Å; T93-V128 HydrophobicContact CG2-CB 3.76Å; T93-V128 HydrophobicContact CG2-CG2 3.73Å; T93-V128 PolarHBondContact N-O 2.95Å; T93-V128 PolarHBondContact O-N 2.74Å; M95-V128 HydrophobicContact CG-CG2 3.95Å; T120-V128 WeakPolarHBondContact O-CA 3.39Å; I121-V128 HydrophobicContact CB-CG2 4.44Å; I121-V128 HydrophobicContact CD1-CG2 3.91Å; I121-V128 HydrophobicContact CG1-CG2 4.04Å; G126-V128 PolarHBondContact O-N 2.78Å; V128-F163 HydrophobicContact CG1-CZ 4.4Å; V128-F163 HydrophobicContact CG2-CZ 4.44Å
129	Y	92.6	Very high	91.2	Very high	54 Å²	54	57.2 Å²	57.2	21%	0.212	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	146.7	-178.4	-63	-99.7	0	0	0	111.4	P89 Y90 K91 F119 T120 N122 E127	P89-Y129 HydrophobicContact CB-CD1 4.23Å; Y90-Y129 CarbonylContact O-C 3.57Å; Y90-Y129 WeakPolarHBondContact O-CA 3.43Å; K91-Y129 HydrophobicContact CB-CD1 3.9Å; K91-Y129 HydrophobicContact CB-CE1 3.67Å; K91-Y129 HydrophobicContact CG-CE1 4.21Å; F119-Y129 CarbonylContact C-O 3.57Å; F119-Y129 VanDerWaalsContact CA-O 3.29Å; F119-Y129 WeakPolarHBondContact CA-O 3.36Å; T120-Y129 PolarHBondContact N-O 2.68Å; T120-Y129 PolarHBondContact O-N 2.83Å; N122-Y129 HydrophobicContact CB-CE2 4.36Å; E127-Y129 HydrophobicContact CB-CD2 4.41Å; E127-Y129 HydrophobicContact CB-CE2 3.56Å; E127-Y129 WeakPolarHBondContact O-CD2 3.09Å
130	V	93.2	Very high	91.2	Very high	4 Å²	4	60.3 Å²	60.3	2%	0.024	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	142	165.1	64.6	0	0	0	0	109.4	Y88 P89 Y90 I92 L118 F119 L134	Y88-V130 HydrophobicContact CD1-CG1 4.34Å; Y88-V130 HydrophobicContact CE1-CG1 3.98Å; P89-V130 CarbonylContact C-O 3.55Å; P89-V130 VanDerWaalsContact CA-O 3.26Å; P89-V130 WeakPolarHBondContact CA-O 3.21Å; Y90-V130 HydrophobicContact CD1-CG1 4.24Å; Y90-V130 PolarHBondContact N-O 2.9Å; Y90-V130 PolarHBondContact O-N 3.07Å; I92-V130 HydrophobicContact CG2-CB 4.11Å; I92-V130 HydrophobicContact CG2-CG1 3.65Å; L118-V130 HydrophobicContact CD1-CG2 4.1Å; L118-V130 HydrophobicContact CG-CG2 4.32Å; L118-V130 CarbonylContact O-C 3.58Å; L118-V130 WeakPolarHBondContact O-CA 3.33Å; F119-V130 HydrophobicContact CD1-CB 3.96Å; F119-V130 HydrophobicContact CD1-CG2 4.12Å; F119-V130 HydrophobicContact CE1-CB 3.84Å; F119-V130 HydrophobicContact CE1-CG2 3.74Å; F119-V130 HydrophobicContact CZ-CG2 4.24Å; V130-L134 HydrophobicContact CG2-CD2 3.94Å; V130-L134 HydrophobicContact CG2-CG 4.4Å
131	H	90.9	Very high	91.2	Very high	69 Å²	69	61 Å²	61	32%	0.319	30%	0.301	S	S	.	.			trans	-103.5	-11.9	-170	-78	-92.3	0	0	0	115.6	Y88 L118 T120	Y88-H131 WeakPolarHBondContact CB-O 3.39Å; L118-H131 PolarHBondContact O-N 2.85Å; T120-H131 VanDerWaalsContact CG2-NE2 3.28Å; T120-H131 WeakPolarHBondContact CG2-NE2 3.28Å; T120-H131 PolarHBondContact OG1-NE2 3.48Å
132	R	90.1	Very high	91.2	Very high	155 Å²	155	61.6 Å²	61.6	59%	0.585	30%	0.302	S	S	*	.	S	Bend	trans	-149	166.8	-177	-59.1	-175.4	-173.9	160.3	8.3	110.3	Y88 L118	Y88-R132 WeakPolarHBondContact CE1-O 3.44Å; Y88-R132 VanDerWaalsContact CZ-C 3.45Å; L118-R132 HydrophobicContact CD1-CB 3.94Å
133	R	91.3	Very high	91.1	Very high	107 Å²	107	61.5 Å²	61.5	40%	0.404	30%	0.299	S	S	.	.			trans	-54.7	142.2	164.6	-68.6	-175	175.2	-164	-5.5	110.5	E83 D85 Y88	E83-R133 WeakPolarHBondContact O-CD 3.4Å; E83-R133 PolarHBondContact O-NE 3.03Å; E83-R133 VanDerWaalsContact O-NE 3.07Å; E83-R133 VanDerWaalsContact OE1-CD 3.27Å; E83-R133 WeakPolarHBondContact OE1-CD 3.29Å; E83-R133 IonicContact OE1-CZ 2.7Å; E83-R133 IonicContact OE1-NE 3.43Å; E83-R133 IonicContact OE1-NH1 3.32Å; E83-R133 PolarHBondContact OE1-NH1 3.3Å; E83-R133 IonicContact OE2-NH1 2.74Å; E83-R133 PolarHBondContact OE2-NH1 3.09Å; D85-R133 IonicContact OD1-CZ 3.49Å; D85-R133 IonicContact OD1-NH2 3.47Å; D85-R133 PolarHBondContact OD1-NH2 3.45Å; Y88-R133 HydrophobicContact CE2-CG 3.79Å; Y88-R133 WeakPolarHBondContact OH-CA 2.96Å
134	L	91.6	Very high	91.1	Very high	8 Å²	8	56.1 Å²	56.1	4%	0.042	28%	0.276	C	S	.	.			trans	-93.4	150	170.7	-56.2	-179.4	0	0	0	108	L80 E83 L118 F119 V130 Y142 V167	L80-L134 HydrophobicContact CB-CD1 4.22Å; L80-L134 HydrophobicContact CD1-CD1 3.86Å; E83-L134 PolarHBondContact N-O 2.78Å; L118-L134 HydrophobicContact CD1-CD2 4.08Å; L118-L134 HydrophobicContact CD2-CD2 3.72Å; L118-L134 HydrophobicContact CG-CD2 4.12Å; F119-L134 HydrophobicContact CZ-CD2 4.27Å; V130-L134 HydrophobicContact CG2-CD2 3.94Å; V130-L134 HydrophobicContact CG2-CG 4.4Å; L134-Y142 HydrophobicContact CD2-CE2 4Å; L134-V167 HydrophobicContact CB-CG1 4.18Å; L134-V167 HydrophobicContact CD1-CG1 4.49Å; L134-V167 HydrophobicContact CD1-CG2 3.95Å
135	D	92.1	Very high	91.2	Very high	67 Å²	67	52.3 Å²	52.3	36%	0.358	25%	0.253	S	S	.	.			trans	-135	122.6	171.2	109.7	53.1	0	0	0	106.1	K138 T139	D135-K138 VanDerWaalsContact CG-CB 3.44Å; D135-K138 WeakPolarHBondContact OD1-CB 3.4Å; D135-K138 PolarHBondContact OD1-N 3.3Å; D135-K138 WeakPolarHBondContact OD2-CB 3.4Å; D135-K138 WeakPolarHBondContact OD2-CD 3.5Å; D135-T139 PolarHBondContact O-N 3.11Å; D135-T139 VanDerWaalsContact O-N 3.15Å
136	R	93.8	Very high	91.3	Very high	21 Å²	21	50.6 Å²	50.6	8%	0.079	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-29.9	-162.4	-179.5	-148.3	68.2	114.5	16.8	111.7	E82 K138 T139 P140 V167 D169 L206 Q208	E82-R136 VanDerWaalsContact CD-CB 3.46Å; E82-R136 WeakPolarHBondContact OE1-CB 3.42Å; E82-R136 WeakPolarHBondContact OE1-CD 3.45Å; E82-R136 IonicContact OE1-NE 3.83Å; E82-R136 WeakPolarHBondContact OE2-CB 3.48Å; E82-R136 PolarHBondContact OE2-N 2.61Å; R136-K138 PolarHBondContact O-N 3.49Å; R136-T139 CarbonylContact O-C 3.58Å; R136-T139 VanDerWaalsContact O-C 3.31Å; R136-T139 PolarHBondContact O-N 3.3Å; R136-P140 HydrophobicContact CG-CB 4Å; R136-P140 WeakPolarHBondContact O-CD 3.25Å; R136-P140 VanDerWaalsContact O-N 3.15Å; R136-V167 HydrophobicContact CB-CB 4.24Å; R136-V167 HydrophobicContact CB-CG1 3.81Å; R136-V167 HydrophobicContact CG-CB 4.08Å; R136-V167 HydrophobicContact CG-CG1 4.12Å; R136-D169 IonicContact CZ-OD1 3.88Å; R136-D169 IonicContact NE-OD1 2.72Å; R136-D169 PolarHBondContact NE-OD1 2.85Å; R136-D169 IonicContact NH1-OD1 3.42Å; R136-D169 PolarHBondContact NH1-OD1 2.85Å; R136-D169 IonicContact NH2-OD1 3.67Å; R136-L206 PolarHBondContact NH2-O 2.88Å; R136-Q208 VanDerWaalsContact NH1-N 3.12Å
137	E	93.8	Very high	91.3	Very high	62 Å²	62	51.2 Å²	51.2	29%	0.29	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-34.2	173.6	-67	58.4	-108.9	0	0	110	L206	E137-L206 HydrophobicContact CG-CB 3.86Å
138	K	90.4	Very high	91.1	Very high	159 Å²	159	49.2 Å²	49.2	69%	0.691	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-39.3	172.7	-176.1	-175.3	174.2	-170.1	0	113.6	D135 R136	D135-K138 VanDerWaalsContact CG-CB 3.44Å; D135-K138 WeakPolarHBondContact OD1-CB 3.4Å; D135-K138 PolarHBondContact OD1-N 3.3Å; D135-K138 WeakPolarHBondContact OD2-CB 3.4Å; D135-K138 WeakPolarHBondContact OD2-CD 3.5Å; R136-K138 PolarHBondContact O-N 3.49Å
139	T	90.3	Very high	90.9	Very high	41 Å²	41	52.4 Å²	52.4	25%	0.252	25%	0.246	S	C	.	.			trans	-152.7	98.1	179.5	-50	0	0	0	0	112.2	D135 R136 S141 Y142	D135-T139 PolarHBondContact O-N 3.11Å; D135-T139 VanDerWaalsContact O-N 3.15Å; R136-T139 CarbonylContact O-C 3.58Å; R136-T139 VanDerWaalsContact O-C 3.31Å; R136-T139 PolarHBondContact O-N 3.3Å; T139-S141 PolarHBondContact O-N 3.03Å; T139-Y142 WeakPolarHBondContact CB-OH 3.25Å; T139-Y142 HydrophobicContact CG2-CD1 3.94Å; T139-Y142 HydrophobicContact CG2-CE1 3.44Å; T139-Y142 VanDerWaalsContact CG2-CE1 3.44Å; T139-Y142 HydrophobicContact CG2-CE2 4.08Å; T139-Y142 HydrophobicContact CG2-CG 4.45Å
140	P	91.8	Very high	90.6	Very high	73 Å²	73	51.6 Å²	51.6	47%	0.474	25%	0.245	S	C	.	.	S	Bend	trans	-77.9	-19.9	-172.6	30.1	-36.3	0	0	0	113.9	R136 V167	R136-P140 HydrophobicContact CG-CB 4Å; R136-P140 WeakPolarHBondContact O-CD 3.25Å; R136-P140 VanDerWaalsContact O-N 3.15Å; P140-V167 WeakPolarHBondContact O-CB 3.43Å; P140-V167 PolarHBondContact O-N 2.82Å
141	S	92.1	Very high	90.1	Very high	66 Å²	66	55.2 Å²	55.2	46%	0.462	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	154.8	174.4	58.4	0	0	0	0	112.7	T139 V165	T139-S141 PolarHBondContact O-N 3.03Å; S141-V165 CarbonylContact C-O 3.54Å; S141-V165 WeakPolarHBondContact CA-O 3.49Å; S141-V165 VanDerWaalsContact CB-O 3.29Å; S141-V165 WeakPolarHBondContact CB-O 3.19Å
142	Y	90.9	Very high	89.5	Confident	29 Å²	29	55.2 Å²	55.2	11%	0.114	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	126.3	179.4	-59.9	-88.9	0	0	0	110.5	V111 L118 F119 L134 T139 V165 V167	V111-Y142 HydrophobicContact CG1-CD1 4.31Å; L118-Y142 HydrophobicContact CD2-CE1 3.73Å; L118-Y142 HydrophobicContact CD2-CE2 4.28Å; L118-Y142 VanDerWaalsContact CD2-OH 3.3Å; L118-Y142 WeakPolarHBondContact CD2-OH 3.31Å; F119-Y142 AromaticContact CE2-CD1 3.82Å; F119-Y142 HydrophobicContact CE2-CD1 3.82Å; F119-Y142 AromaticContact CE2-CD2 3.7Å; F119-Y142 HydrophobicContact CE2-CD2 3.7Å; F119-Y142 HydrophobicContact CE2-CE1 4.16Å; F119-Y142 HydrophobicContact CE2-CE2 4.05Å; F119-Y142 AromaticContact CE2-CG 3.57Å; F119-Y142 HydrophobicContact CE2-CG 3.57Å; F119-Y142 AromaticContact CZ-CD2 3.72Å; F119-Y142 HydrophobicContact CZ-CD2 3.72Å; F119-Y142 HydrophobicContact CZ-CE2 4.05Å; F119-Y142 HydrophobicContact CZ-CG 4.05Å; L134-Y142 HydrophobicContact CD2-CE2 4Å; T139-Y142 WeakPolarHBondContact CB-OH 3.25Å; T139-Y142 HydrophobicContact CG2-CD1 3.94Å; T139-Y142 HydrophobicContact CG2-CE1 3.44Å; T139-Y142 VanDerWaalsContact CG2-CE1 3.44Å; T139-Y142 HydrophobicContact CG2-CE2 4.08Å; T139-Y142 HydrophobicContact CG2-CG 4.45Å; Y142-V165 PolarHBondContact N-O 2.87Å; Y142-V165 PolarHBondContact O-N 2.74Å; Y142-V167 HydrophobicContact CD2-CG2 4.34Å; Y142-V167 HydrophobicContact CE2-CG2 4.05Å
143	H	90.3	Very high	89.2	Confident	65 Å²	65	52.8 Å²	52.8	30%	0.301	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	119.6	168.8	-160.5	62.9	0	0	0	109.6	E112 S162 D164	E112-H143 HydrophobicContact CB-CB 4.36Å; E112-H143 PolarHBondContact N-O 3.4Å; E112-H143 VanDerWaalsContact N-O 3.09Å; E112-H143 IonicContact OE2-CD2 2.61Å; H143-S162 PolarHBondContact CE1-OG 3.11Å; H143-S162 VanDerWaalsContact NE2-CB 3.3Å; H143-S162 WeakPolarHBondContact NE2-CB 3.4Å; H143-S162 PolarHBondContact NE2-OG 3.12Å; H143-D164 IonicContact CE1-OD1 2.83Å; H143-D164 PolarHBondContact CE1-OD1 3.02Å; H143-D164 IonicContact CG-OD1 3.98Å; H143-D164 IonicContact ND1-OD1 2.72Å; H143-D164 PolarHBondContact ND1-OD1 2.55Å
144	I	89.8	Confident	88.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	115.2	-178	-54.8	-173.8	0	0	0	109.2	I109 V111 F119 S162 F163 V165	I109-I144 HydrophobicContact CB-CG2 3.96Å; I109-I144 HydrophobicContact CD1-CG2 4.23Å; I109-I144 HydrophobicContact CG2-CG2 4.09Å; V111-I144 HydrophobicContact CG1-CG1 4.25Å; V111-I144 HydrophobicContact CG2-CB 4.49Å; V111-I144 HydrophobicContact CG2-CD1 4.09Å; V111-I144 HydrophobicContact CG2-CG1 3.89Å; V111-I144 HydrophobicContact CG2-CG2 4.13Å; F119-I144 HydrophobicContact CB-CD1 4.1Å; F119-I144 HydrophobicContact CD1-CD1 4.03Å; F119-I144 HydrophobicContact CD2-CD1 3.81Å; F119-I144 HydrophobicContact CE1-CD1 4.43Å; F119-I144 HydrophobicContact CE2-CD1 4.24Å; F119-I144 HydrophobicContact CG-CD1 3.7Å; I144-S162 CarbonylContact O-C 3.54Å; I144-S162 WeakPolarHBondContact O-CA 3.34Å; I144-S162 VanDerWaalsContact O-CB 3.23Å; I144-S162 WeakPolarHBondContact O-CB 3.41Å; I144-F163 HydrophobicContact CB-CD1 4.35Å; I144-F163 HydrophobicContact CB-CD2 4.42Å; I144-F163 HydrophobicContact CB-CE1 3.87Å; I144-F163 HydrophobicContact CB-CE2 3.95Å; I144-F163 HydrophobicContact CB-CZ 3.65Å; I144-F163 HydrophobicContact CD1-CE2 3.9Å; I144-F163 HydrophobicContact CD1-CZ 3.99Å; I144-F163 HydrophobicContact CG1-CE2 4.32Å; I144-F163 HydrophobicContact CG1-CZ 4.35Å; I144-F163 HydrophobicContact CG2-CD1 4.47Å; I144-F163 HydrophobicContact CG2-CE1 3.6Å; I144-F163 HydrophobicContact CG2-CE2 4.27Å; I144-F163 HydrophobicContact CG2-CZ 3.48Å; I144-F163 VanDerWaalsContact CG2-CZ 3.48Å; I144-F163 PolarHBondContact N-O 3.15Å; I144-F163 PolarHBondContact O-N 3.32Å; I144-V165 HydrophobicContact CD1-CG2 3.73Å; I144-V165 HydrophobicContact CG1-CG2 4.42Å
145	T	89.4	Confident	88.3	Confident	27 Å²	27	58 Å²	58	17%	0.166	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	147	167.7	92.4	0	0	0	0	109.9	I109 S110 E160 L161	I109-T145 VanDerWaalsContact CA-O 3.27Å; I109-T145 WeakPolarHBondContact CA-O 3.37Å; I109-T145 WeakPolarHBondContact CB-O 3.48Å; S110-T145 PolarHBondContact N-O 3.41Å; S110-T145 PolarHBondContact O-N 3Å; T145-E160 WeakPolarHBondContact CB-OE1 3.48Å; T145-E160 PolarHBondContact OG1-OE1 3.12Å; T145-L161 CarbonylContact C-O 3.36Å; T145-L161 WeakPolarHBondContact CA-O 3.34Å
146	F	88.4	Confident	88	Confident	9 Å²	9	58.1 Å²	58.1	4%	0.039	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	142.7	175.8	79.1	-84.5	0	0	0	112	L75 M95 E108 I109 L161 F163	L75-F146 HydrophobicContact CD1-CE1 3.56Å; L75-F146 HydrophobicContact CD1-CZ 4.1Å; M95-F146 HydrophobicContact CB-CE2 4.47Å; M95-F146 HydrophobicContact SD-CD1 4.3Å; M95-F146 HydrophobicContact SD-CE1 3.92Å; M95-F146 HydrophobicContact SD-CE2 4.46Å; M95-F146 HydrophobicContact SD-CZ 4Å; E108-F146 WeakPolarHBondContact O-CA 3.46Å; I109-F146 HydrophobicContact CG2-CB 3.7Å; F146-L161 HydrophobicContact CD1-CB 3.97Å; F146-L161 WeakPolarHBondContact CD1-O 3.43Å; F146-L161 HydrophobicContact CE1-CB 3.35Å; F146-L161 HydrophobicContact CE1-CD1 4.27Å; F146-L161 HydrophobicContact CE1-CG 4.45Å; F146-L161 HydrophobicContact CZ-CB 3.68Å; F146-L161 HydrophobicContact CZ-CD1 3.78Å; F146-L161 HydrophobicContact CZ-CG 4.36Å; F146-L161 PolarHBondContact N-O 2.82Å; F146-L161 PolarHBondContact O-N 2.95Å; F146-F163 AromaticContact CD1-CD1 3.97Å; F146-F163 HydrophobicContact CD1-CD1 3.97Å; F146-F163 HydrophobicContact CD1-CE1 4.22Å; F146-F163 HydrophobicContact CE1-CD1 4.43Å
147	D	88.9	Confident	87.6	Confident	12 Å²	12	59.1 Å²	59.1	6%	0.064	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	157.9	179	-81.1	-53.3	0	0	0	110.9	F107 E108 K156	F107-D147 WeakPolarHBondContact CA-O 3.38Å; E108-D147 PolarHBondContact N-O 3.32Å; E108-D147 PolarHBondContact O-N 3.05Å; D147-K156 VanDerWaalsContact OD1-CD 3.25Å; D147-K156 WeakPolarHBondContact OD1-CD 3.36Å; D147-K156 WeakPolarHBondContact OD1-CE 3.33Å; D147-K156 IonicContact OD1-NZ 2.77Å; D147-K156 PolarHBondContact OD1-NZ 2.8Å; D147-K156 WeakPolarHBondContact OD2-CE 3.47Å; D147-K156 IonicContact OD2-NZ 2.85Å; D147-K156 PolarHBondContact OD2-NZ 2.96Å
148	V	89.4	Confident	87.1	Confident	6 Å²	6	58.6 Å²	58.6	4%	0.036	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	118.1	172.1	-159.6	0	0	0	0	108.2	N97 T100 H105 H106 F107 K156 I157	N97-V148 HydrophobicContact CB-CG2 4.03Å; T100-V148 HydrophobicContact CG2-CG1 3.79Å; H105-V148 HydrophobicContact CB-CG1 4.24Å; H106-V148 WeakPolarHBondContact O-CA 3.49Å; F107-V148 HydrophobicContact CD1-CG1 4.24Å; F107-V148 HydrophobicContact CD1-CG2 3.71Å; F107-V148 HydrophobicContact CE1-CG1 4.17Å; F107-V148 HydrophobicContact CE1-CG2 3.65Å; F107-V148 HydrophobicContact CZ-CG1 4.45Å; V148-K156 CarbonylContact O-C 3.58Å; V148-K156 WeakPolarHBondContact O-CA 3.08Å; V148-I157 HydrophobicContact CG1-CD1 4.15Å; V148-I157 PolarHBondContact O-N 3.33Å
149	W	87.5	Confident	86.8	Confident	67 Å²	67	59.4 Å²	59.4	25%	0.254	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	137	-176	-69.6	96.8	0	0	0	111.4	H105 H106 E108 K156	H105-W149 CarbonylContact C-O 3.57Å; H105-W149 WeakPolarHBondContact CA-O 3.47Å; H105-W149 WeakPolarHBondContact CB-O 3.42Å; H106-W149 VanDerWaalsContact CE1-CB 3.49Å; H106-W149 WeakPolarHBondContact CE1-CB 3.38Å; H106-W149 PolarHBondContact N-O 3.06Å; H106-W149 AromaticContact NE2-CD1 3.8Å; H106-W149 PolarHBondContact O-N 2.76Å; E108-W149 PolarHBondContact OE2-NE1 3.48Å; W149-K156 HydrophobicContact CD2-CG 4.16Å; W149-K156 HydrophobicContact CE3-CG 4.23Å; W149-K156 VanDerWaalsContact CE3-N 3.34Å; W149-K156 HydrophobicContact CH2-CG 3.99Å; W149-K156 HydrophobicContact CZ2-CG 3.94Å; W149-K156 HydrophobicContact CZ3-CG 4.15Å
150	D	86.9	Confident	86.5	Confident	36 Å²	36	61.8 Å²	61.8	19%	0.193	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	122.5	165.6	-174.7	-44.7	0	0	0	108.8	V103 G152 V153 A154 K155 I157	V103-D150 HydrophobicContact CG1-CB 4.3Å; D150-G152 WeakPolarHBondContact OD1-CA 3.32Å; D150-G152 PolarHBondContact OD1-N 3.41Å; D150-V153 PolarHBondContact OD1-N 3.16Å; D150-A154 VanDerWaalsContact O-CA 3.27Å; D150-A154 WeakPolarHBondContact O-CA 3.48Å; D150-A154 PolarHBondContact O-N 3.12Å; D150-K155 PolarHBondContact N-O 3.07Å; D150-I157 HydrophobicContact CB-CD1 4.2Å; D150-I157 HydrophobicContact CB-CG1 3.88Å
151	I	81.9	Confident	86.3	Confident	81 Å²	81	61 Å²	61	42%	0.415	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-33.3	-178.4	-68.5	177.2	0	0	0	111.3	E104 H105 H106	E104-I151 HydrophobicContact CG-CB 4.38Å; E104-I151 HydrophobicContact CG-CD1 4.2Å; E104-I151 PolarHBondContact O-N 2.8Å; H105-I151 WeakPolarHBondContact O-CD1 3.29Å; H106-I151 HydrophobicContact CB-CD1 4.16Å; H106-I151 HydrophobicContact CB-CG1 4.47Å; H106-I151 WeakPolarHBondContact ND1-CG1 3.43Å
152	G	79.7	Confident	86.1	Confident	68 Å²	68	59.4 Å²	59.4	70%	0.701	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-26.2	-178.8	0	0	0	0	0	114	D150	D150-G152 WeakPolarHBondContact OD1-CA 3.32Å; D150-G152 PolarHBondContact OD1-N 3.41Å
153	V	81.9	Confident	86	Confident	104 Å²	104	58.1 Å²	58.1	63%	0.63	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.7	0.5	-175.9	-155.6	0	0	0	0	113.4	D150 K155	D150-V153 PolarHBondContact OD1-N 3.16Å; V153-K155 PolarHBondContact O-N 3.5Å
154	A	79.8	Confident	86	Confident	80 Å²	80	57.9 Å²	57.9	66%	0.661	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	48.5	176.8	0	0	0	0	0	113.8	D150	D150-A154 VanDerWaalsContact O-CA 3.27Å; D150-A154 WeakPolarHBondContact O-CA 3.48Å; D150-A154 PolarHBondContact O-N 3.12Å
155	K	85.3	Confident	86.2	Confident	145 Å²	145	57.9 Å²	57.9	63%	0.63	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.4	141.4	-174.7	-171.5	-177.6	174.7	-174.2	0	112.3	D150 V153 I157	D150-K155 PolarHBondContact N-O 3.07Å; V153-K155 PolarHBondContact O-N 3.5Å; K155-I157 PolarHBondContact O-N 3Å
156	K	85.5	Confident	86.3	Confident	70 Å²	70	59 Å²	59	30%	0.304	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.7	122.3	169	-64.1	-170.8	175.6	-152.1	0	110.2	D147 V148 W149 E160	D147-K156 VanDerWaalsContact OD1-CD 3.25Å; D147-K156 WeakPolarHBondContact OD1-CD 3.36Å; D147-K156 WeakPolarHBondContact OD1-CE 3.33Å; D147-K156 IonicContact OD1-NZ 2.77Å; D147-K156 PolarHBondContact OD1-NZ 2.8Å; D147-K156 WeakPolarHBondContact OD2-CE 3.47Å; D147-K156 IonicContact OD2-NZ 2.85Å; D147-K156 PolarHBondContact OD2-NZ 2.96Å; V148-K156 CarbonylContact O-C 3.58Å; V148-K156 WeakPolarHBondContact O-CA 3.08Å; W149-K156 HydrophobicContact CD2-CG 4.16Å; W149-K156 HydrophobicContact CE3-CG 4.23Å; W149-K156 VanDerWaalsContact CE3-N 3.34Å; W149-K156 HydrophobicContact CH2-CG 3.99Å; W149-K156 HydrophobicContact CZ2-CG 3.94Å; W149-K156 HydrophobicContact CZ3-CG 4.15Å; K156-E160 IonicContact NZ-OE2 3.22Å; K156-E160 PolarHBondContact NZ-OE2 3.41Å
157	I	84.8	Confident	86.6	Confident	41 Å²	41	58.9 Å²	58.9	21%	0.21	32%	0.32	C	S	.	.	S	Bend	trans	-72	-34.7	-178.2	-67.6	176.4	0	0	0	111.1	K99 V103 H105 V148 D150 K155	K99-I157 HydrophobicContact CB-CG2 3.66Å; V103-I157 HydrophobicContact CG1-CD1 3.91Å; H105-I157 HydrophobicContact CB-CD1 3.71Å; V148-I157 HydrophobicContact CG1-CD1 4.15Å; V148-I157 PolarHBondContact O-N 3.33Å; D150-I157 HydrophobicContact CB-CD1 4.2Å; D150-I157 HydrophobicContact CB-CG1 3.88Å; K155-I157 PolarHBondContact O-N 3Å
158	D	85.1	Confident	86.9	Confident	52 Å²	52	61.5 Å²	61.5	28%	0.278	33%	0.331	S	S	.	.	S	Bend	trans	-135.8	-176.1	179.4	-154.9	5.3	0	0	0	111.2	K99	K99-D158 HydrophobicContact CD-CB 4.2Å; K99-D158 IonicContact NZ-OD1 3.8Å; K99-D158 PolarHBondContact NZ-OD1 3.05Å; K99-D158 IonicContact NZ-OD2 2.78Å; K99-D158 PolarHBondContact NZ-OD2 3.35Å
159	K	82.8	Confident	87.1	Confident	175 Å²	175	62.5 Å²	62.5	76%	0.761	34%	0.336	S	S	*	.			trans	-69.6	142.6	166.7	-60.8	-173.3	178.2	-169.3	0	110.6
160	E	85.3	Confident	87.4	Confident	91 Å²	91	61.2 Å²	61.2	43%	0.425	33%	0.334	S	S	.	.			trans	-53.4	137.7	166.8	-169.2	168.6	167.3	0	0	110.8	T145 K156	T145-E160 WeakPolarHBondContact CB-OE1 3.48Å; T145-E160 PolarHBondContact OG1-OE1 3.12Å; K156-E160 IonicContact NZ-OE2 3.22Å; K156-E160 PolarHBondContact NZ-OE2 3.41Å
161	L	86.9	Confident	87.7	Confident	58 Å²	58	60.5 Å²	60.5	30%	0.304	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	159.8	178.7	-72	174.4	0	0	0	108.3	T145 F146	T145-L161 CarbonylContact C-O 3.36Å; T145-L161 WeakPolarHBondContact CA-O 3.34Å; F146-L161 HydrophobicContact CD1-CB 3.97Å; F146-L161 WeakPolarHBondContact CD1-O 3.43Å; F146-L161 HydrophobicContact CE1-CB 3.35Å; F146-L161 HydrophobicContact CE1-CD1 4.27Å; F146-L161 HydrophobicContact CE1-CG 4.45Å; F146-L161 HydrophobicContact CZ-CB 3.68Å; F146-L161 HydrophobicContact CZ-CD1 3.78Å; F146-L161 HydrophobicContact CZ-CG 4.36Å; F146-L161 PolarHBondContact N-O 2.82Å; F146-L161 PolarHBondContact O-N 2.95Å
162	S	88.3	Confident	88.2	Confident	32 Å²	32	60.2 Å²	60.2	22%	0.224	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	158.4	174.7	53.1	0	0	0	0	112	H143 I144	H143-S162 PolarHBondContact CE1-OG 3.11Å; H143-S162 VanDerWaalsContact NE2-CB 3.3Å; H143-S162 WeakPolarHBondContact NE2-CB 3.4Å; H143-S162 PolarHBondContact NE2-OG 3.12Å; I144-S162 CarbonylContact O-C 3.54Å; I144-S162 WeakPolarHBondContact O-CA 3.34Å; I144-S162 VanDerWaalsContact O-CB 3.23Å; I144-S162 WeakPolarHBondContact O-CB 3.41Å
163	F	88.7	Confident	88.9	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.009	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	150.5	173.1	62.7	-82.8	0	0	0	108.9	L75 I78 M95 V128 I144 F146 V165	L75-F163 HydrophobicContact CB-CB 4.07Å; L75-F163 HydrophobicContact CD1-CB 3.99Å; I78-F163 HydrophobicContact CD1-CD2 3.5Å; I78-F163 HydrophobicContact CD1-CE2 3.57Å; I78-F163 HydrophobicContact CG1-CD2 4.2Å; M95-F163 HydrophobicContact CE-CB 4.25Å; M95-F163 HydrophobicContact CE-CD1 3.36Å; M95-F163 HydrophobicContact CE-CD2 3.99Å; M95-F163 HydrophobicContact CE-CE1 3.55Å; M95-F163 HydrophobicContact CE-CE2 4.15Å; M95-F163 HydrophobicContact CE-CG 3.59Å; M95-F163 HydrophobicContact CE-CZ 3.94Å; M95-F163 HydrophobicContact CG-CE1 4.46Å; M95-F163 HydrophobicContact SD-CD1 4.21Å; M95-F163 HydrophobicContact SD-CE1 4.35Å; V128-F163 HydrophobicContact CG1-CZ 4.4Å; V128-F163 HydrophobicContact CG2-CZ 4.44Å; I144-F163 HydrophobicContact CB-CD1 4.35Å; I144-F163 HydrophobicContact CB-CD2 4.42Å; I144-F163 HydrophobicContact CB-CE1 3.87Å; I144-F163 HydrophobicContact CB-CE2 3.95Å; I144-F163 HydrophobicContact CB-CZ 3.65Å; I144-F163 HydrophobicContact CD1-CE2 3.9Å; I144-F163 HydrophobicContact CD1-CZ 3.99Å; I144-F163 HydrophobicContact CG1-CE2 4.32Å; I144-F163 HydrophobicContact CG1-CZ 4.35Å; I144-F163 HydrophobicContact CG2-CD1 4.47Å; I144-F163 HydrophobicContact CG2-CE1 3.6Å; I144-F163 HydrophobicContact CG2-CE2 4.27Å; I144-F163 HydrophobicContact CG2-CZ 3.48Å; I144-F163 VanDerWaalsContact CG2-CZ 3.48Å; I144-F163 PolarHBondContact N-O 3.15Å; I144-F163 PolarHBondContact O-N 3.32Å; F146-F163 AromaticContact CD1-CD1 3.97Å; F146-F163 HydrophobicContact CD1-CD1 3.97Å; F146-F163 HydrophobicContact CD1-CE1 4.22Å; F146-F163 HydrophobicContact CE1-CD1 4.43Å; F163-V165 HydrophobicContact CD2-CG2 4.1Å; F163-V165 HydrophobicContact CE2-CG2 3.81Å
164	D	90.7	Very high	89.5	Confident	59 Å²	59	55.8 Å²	55.8	32%	0.316	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	138.7	178.1	-50.5	-59.5	0	0	0	109.1	T77 I78 H143	T77-D164 WeakPolarHBondContact CA-O 3.41Å; T77-D164 HydrophobicContact CG2-CB 4.1Å; I78-D164 PolarHBondContact N-O 2.76Å; H143-D164 IonicContact CE1-OD1 2.83Å; H143-D164 PolarHBondContact CE1-OD1 3.02Å; H143-D164 IonicContact CG-OD1 3.98Å; H143-D164 IonicContact ND1-OD1 2.72Å; H143-D164 PolarHBondContact ND1-OD1 2.55Å
165	V	91.9	Very high	90.3	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	119.4	165.7	-176.1	0	0	0	0	107.1	I78 L80 I92 F119 S141 Y142 I144 F163	I78-V165 HydrophobicContact CB-CG2 4.39Å; I78-V165 HydrophobicContact CD1-CG2 4.5Å; I78-V165 CarbonylContact O-C 3.48Å; I78-V165 WeakPolarHBondContact O-CA 3.48Å; L80-V165 HydrophobicContact CD1-CG1 3.53Å; L80-V165 HydrophobicContact CG-CG1 4.01Å; I92-V165 HydrophobicContact CD1-CG2 4.27Å; F119-V165 HydrophobicContact CE1-CG1 4.41Å; F119-V165 HydrophobicContact CE1-CG2 4.49Å; F119-V165 HydrophobicContact CZ-CG1 4.34Å; S141-V165 CarbonylContact C-O 3.54Å; S141-V165 WeakPolarHBondContact CA-O 3.49Å; S141-V165 VanDerWaalsContact CB-O 3.29Å; S141-V165 WeakPolarHBondContact CB-O 3.19Å; Y142-V165 PolarHBondContact N-O 2.87Å; Y142-V165 PolarHBondContact O-N 2.74Å; I144-V165 HydrophobicContact CD1-CG2 3.73Å; I144-V165 HydrophobicContact CG1-CG2 4.42Å; F163-V165 HydrophobicContact CD2-CG2 4.1Å; F163-V165 HydrophobicContact CE2-CG2 3.81Å
166	D	93	Very high	90.6	Very high	52 Å²	52	49.1 Å²	49.1	28%	0.278	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	124.4	-176.2	-174.3	65.5	0	0	0	109.1	T77 I78 E79 L80 K168	T77-D166 HydrophobicContact CG2-CB 3.43Å; T77-D166 VanDerWaalsContact CG2-CB 3.43Å; I78-D166 PolarHBondContact O-N 2.77Å; E79-D166 WeakPolarHBondContact CA-O 3.32Å; L80-D166 PolarHBondContact N-O 2.91Å; D166-K168 WeakPolarHBondContact OD2-CE 3.36Å; D166-K168 IonicContact OD2-NZ 3.38Å; D166-K168 PolarHBondContact OD2-NZ 3.42Å
167	V	94.3	Very high	91	Very high	6 Å²	6	47.3 Å²	47.3	4%	0.036	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	127.5	-173	-170.9	0	0	0	0	109.5	L80 E82 L134 R136 P140 Y142	L80-V167 CarbonylContact O-C 3.54Å; L80-V167 WeakPolarHBondContact O-CA 3.16Å; E82-V167 HydrophobicContact CB-CG1 3.71Å; L134-V167 HydrophobicContact CB-CG1 4.18Å; L134-V167 HydrophobicContact CD1-CG1 4.49Å; L134-V167 HydrophobicContact CD1-CG2 3.95Å; R136-V167 HydrophobicContact CB-CB 4.24Å; R136-V167 HydrophobicContact CB-CG1 3.81Å; R136-V167 HydrophobicContact CG-CB 4.08Å; R136-V167 HydrophobicContact CG-CG1 4.12Å; P140-V167 WeakPolarHBondContact O-CB 3.43Å; P140-V167 PolarHBondContact O-N 2.82Å; Y142-V167 HydrophobicContact CD2-CG2 4.34Å; Y142-V167 HydrophobicContact CE2-CG2 4.05Å
168	K	94.1	Very high	91.3	Very high	67 Å²	67	49.9 Å²	49.9	29%	0.291	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	126.1	-174.6	-59.3	-54.1	-173.1	-171.9	0	111.8	E79 L80 E82 D166 I170	E79-K168 HydrophobicContact CB-CG 4.39Å; E79-K168 VanDerWaalsContact CD-NZ 3.31Å; E79-K168 VanDerWaalsContact CG-CE 3.44Å; E79-K168 WeakPolarHBondContact OE1-CE 3.22Å; E79-K168 IonicContact OE1-NZ 2.73Å; E79-K168 PolarHBondContact OE1-NZ 2.76Å; L80-K168 PolarHBondContact O-N 2.84Å; E82-K168 PolarHBondContact N-O 3.27Å; D166-K168 WeakPolarHBondContact OD2-CE 3.36Å; D166-K168 IonicContact OD2-NZ 3.38Å; D166-K168 PolarHBondContact OD2-NZ 3.42Å; K168-I170 PolarHBondContact O-N 2.69Å
169	D	94.1	Very high	91.2	Very high	27 Å²	27	48.3 Å²	48.3	14%	0.144	25%	0.249	C	C	.	.			trans	-44	116.9	171.1	-161	58.6	0	0	0	112.9	E82 R136 Q208 T211 N213	E82-D169 WeakPolarHBondContact OE1-CA 3.48Å; R136-D169 IonicContact CZ-OD1 3.88Å; R136-D169 IonicContact NE-OD1 2.72Å; R136-D169 PolarHBondContact NE-OD1 2.85Å; R136-D169 IonicContact NH1-OD1 3.42Å; R136-D169 PolarHBondContact NH1-OD1 2.85Å; R136-D169 IonicContact NH2-OD1 3.67Å; D169-Q208 HydrophobicContact CB-CB 3.95Å; D169-Q208 WeakPolarHBondContact OD1-CA 3.35Å; D169-Q208 VanDerWaalsContact OD1-CB 3.23Å; D169-Q208 WeakPolarHBondContact OD1-CB 3.4Å; D169-Q208 PolarHBondContact OD1-N 3.02Å; D169-Q208 VanDerWaalsContact OD2-CB 3.26Å; D169-Q208 WeakPolarHBondContact OD2-CB 3.4Å; D169-Q208 PolarHBondContact OD2-N 2.86Å; D169-T211 PolarHBondContact OD2-OG1 3.05Å; D169-N213 PolarHBondContact OD2-ND2 2.73Å
170	I	93.4	Very high	91	Very high	40 Å²	40	49 Å²	49	21%	0.205	26%	0.256	C	S	.	.			trans	-96.2	-167.8	155.7	68.4	176.4	0	0	0	109.8	E81 E82 E83 K168 D172 N213	E81-I170 HydrophobicContact CG-CG2 3.73Å; E82-I170 HydrophobicContact CG-CB 4.35Å; E82-I170 HydrophobicContact CG-CD1 3.92Å; E82-I170 HydrophobicContact CG-CG1 3.64Å; E82-I170 HydrophobicContact CG-CG2 4.11Å; E82-I170 PolarHBondContact OE1-N 3.37Å; E82-I170 VanDerWaalsContact OE1-N 3.11Å; E83-I170 HydrophobicContact CB-CD1 3.81Å; E83-I170 HydrophobicContact CG-CD1 4.09Å; K168-I170 PolarHBondContact O-N 2.69Å; I170-D172 HydrophobicContact CD1-CB 4Å; I170-D172 HydrophobicContact CG1-CB 4.16Å; I170-N213 VanDerWaalsContact C-ND2 3.3Å; I170-N213 PolarHBondContact O-ND2 2.74Å
171	N	94.4	Very high	90.8	Very high	21 Å²	21	47.5 Å²	47.5	11%	0.112	25%	0.247	C	C	.	.	S	Bend	trans	-124.9	71.2	177.4	-164.9	120.2	0	0	0	109.9	D207 N213 D264 G266 L270	N171-D207 WeakPolarHBondContact CA-OD2 3.11Å; N171-N213 HydrophobicContact CB-CB 4.16Å; N171-N213 WeakPolarHBondContact OD1-CA 3.15Å; N171-N213 WeakPolarHBondContact OD1-CB 3.13Å; N171-N213 VanDerWaalsContact OD1-CG 3.29Å; N171-N213 PolarHBondContact OD1-OD1 2.93Å; N171-D264 PolarHBondContact ND2-OD2 2.93Å; N171-G266 WeakPolarHBondContact OD1-CA 3.44Å; N171-L270 WeakPolarHBondContact O-CD1 3.35Å
172	D	93	Very high	90.6	Very high	75 Å²	75	50.6 Å²	50.6	40%	0.401	26%	0.26	S	S	.	.			trans	-108	-19.6	-179.8	71.8	-50.5	0	0	0	113.3	I170 L270	I170-D172 HydrophobicContact CD1-CB 4Å; I170-D172 HydrophobicContact CG1-CB 4.16Å; D172-L270 WeakPolarHBondContact O-CD1 3.39Å
173	N	93.5	Very high	90.1	Very high	34 Å²	34	57.4 Å²	57.4	18%	0.182	29%	0.286	C	S	.	.	S	Bend	trans	-80.4	149.3	169.6	-59.2	-87.1	0	0	0	111	D205 L206 D207 L270	N173-D205 WeakPolarHBondContact CB-OD1 3.49Å; N173-L206 HydrophobicContact CB-CB 4.15Å; N173-D207 VanDerWaalsContact CB-OD1 3.24Å; N173-D207 WeakPolarHBondContact CB-OD1 3.45Å; N173-D207 PolarHBondContact N-OD1 3.02Å; N173-D207 PolarHBondContact ND2-OD1 3.12Å; N173-L270 VanDerWaalsContact O-CD1 3.29Å; N173-L270 WeakPolarHBondContact O-CD1 3.1Å
174	A	94.8	Very high	90.2	Very high	44 Å²	44	59.2 Å²	59.2	36%	0.364	30%	0.299	S	S	.	.			trans	-112.3	140.5	176.4	0	0	0	0	0	109.7	M176 L270	A174-M176 PolarHBondContact O-N 2.72Å; A174-L270 HydrophobicContact CB-CB 3.83Å
175	P	95.6	Very high	90.4	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.287	C	S	.	.			trans	-55.7	123.2	-177.2	-22.8	25.3	0	0	0	111.8	V203 D205 V216 A262 D264 S272	P175-V203 HydrophobicContact CB-CG1 4.23Å; P175-D205 VanDerWaalsContact CA-OD2 3.25Å; P175-D205 WeakPolarHBondContact CA-OD2 3.36Å; P175-D205 WeakPolarHBondContact CD-OD2 3.41Å; P175-D205 WeakPolarHBondContact CG-OD2 3.25Å; P175-D205 VanDerWaalsContact N-OD2 3.1Å; P175-V216 HydrophobicContact CB-CB 4.47Å; P175-V216 HydrophobicContact CB-CG1 3.74Å; P175-V216 HydrophobicContact CB-CG2 3.83Å; P175-V216 HydrophobicContact CG-CG1 4Å; P175-V216 HydrophobicContact CG-CG2 3.99Å; P175-A262 HydrophobicContact CB-CB 3.86Å; P175-D264 HydrophobicContact CG-CB 4Å; P175-S272 VanDerWaalsContact O-CB 3.23Å; P175-S272 WeakPolarHBondContact O-CB 3.36Å; P175-S272 PolarHBondContact O-OG 3.01Å
176	M	93.4	Very high	90.6	Very high	86 Å²	86	62 Å²	62	42%	0.424	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	136.6	-176.5	69.5	176.5	-65.6	0	0	112.6	A174 I178 V203 V204	A174-M176 PolarHBondContact O-N 2.72Å; M176-I178 HydrophobicContact CE-CD1 4.42Å; M176-I178 HydrophobicContact CE-CG1 3.99Å; M176-I178 HydrophobicContact CG-CD1 4.32Å; M176-I178 HydrophobicContact CG-CG1 4Å; M176-I178 HydrophobicContact SD-CD1 4.35Å; M176-I178 HydrophobicContact SD-CG1 4.34Å; M176-V203 WeakPolarHBondContact O-CA 3.27Å; M176-V204 WeakPolarHBondContact CG-O 3.17Å; M176-V204 PolarHBondContact N-O 2.75Å; M176-V204 PolarHBondContact O-N 3.19Å
177	F	93.5	Very high	90.7	Very high	31 Å²	31	59.7 Å²	59.7	14%	0.136	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	119.7	168.7	-61	-95.3	0	0	0	109.3	F181 M201 V203 V218 I260 A262 S272 V274	F177-F181 HydrophobicContact CB-CE2 3.76Å; F177-F181 HydrophobicContact CB-CZ 4.05Å; F177-F181 HydrophobicContact CD1-CE2 4.47Å; F177-F181 AromaticContact CD1-CZ 3.92Å; F177-F181 HydrophobicContact CD1-CZ 3.92Å; F177-F181 HydrophobicContact CG-CE2 4.35Å; F177-F181 HydrophobicContact CG-CZ 4.24Å; F177-M201 HydrophobicContact CD1-CB 4.44Å; F177-M201 HydrophobicContact CD1-SD 4.47Å; F177-M201 HydrophobicContact CE1-SD 4.03Å; F177-V203 HydrophobicContact CD1-CG2 3.57Å; F177-V203 HydrophobicContact CE1-CG2 3.71Å; F177-V203 HydrophobicContact CG-CG2 4.37Å; F177-V218 HydrophobicContact CE1-CG1 4.36Å; F177-I260 HydrophobicContact CE1-CG2 4.11Å; F177-I260 HydrophobicContact CZ-CG2 4.02Å; F177-A262 HydrophobicContact CE1-CB 4.39Å; F177-A262 HydrophobicContact CE2-CB 3.74Å; F177-A262 HydrophobicContact CZ-CB 3.63Å; F177-S272 WeakPolarHBondContact CD2-OG 3.18Å; F177-S272 WeakPolarHBondContact CE2-OG 3.36Å; F177-V274 HydrophobicContact CD1-CG1 4Å; F177-V274 HydrophobicContact CD2-CB 4.3Å; F177-V274 HydrophobicContact CD2-CG1 4.11Å; F177-V274 HydrophobicContact CE1-CG1 3.85Å; F177-V274 HydrophobicContact CE2-CB 4.4Å; F177-V274 HydrophobicContact CE2-CG1 3.97Å; F177-V274 HydrophobicContact CG-CG1 4.14Å; F177-V274 HydrophobicContact CZ-CG1 3.84Å
178	I	89.9	Confident	90.7	Very high	95 Å²	95	64.3 Å²	64.3	49%	0.487	32%	0.32	S	S	.	.			trans	-96.7	-20.8	-178	-59.7	-169	0	0	0	112.1	M176 D202 V204	M176-I178 HydrophobicContact CE-CD1 4.42Å; M176-I178 HydrophobicContact CE-CG1 3.99Å; M176-I178 HydrophobicContact CG-CD1 4.32Å; M176-I178 HydrophobicContact CG-CG1 4Å; M176-I178 HydrophobicContact SD-CD1 4.35Å; M176-I178 HydrophobicContact SD-CG1 4.34Å; I178-D202 PolarHBondContact N-O 2.74Å; I178-V204 HydrophobicContact CD1-CB 3.72Å; I178-V204 HydrophobicContact CD1-CG1 4.33Å; I178-V204 HydrophobicContact CD1-CG2 3.64Å; I178-V204 HydrophobicContact CG1-CB 4.36Å; I178-V204 HydrophobicContact CG1-CG2 4.28Å
179	S	83.2	Confident	90.6	Very high	20 Å²	20	61.5 Å²	61.5	14%	0.14	31%	0.308	C	S	.	.	S	Bend	trans	-60.9	142.8	179.6	-51.3	0	0	0	0	113.3	F181 M201 D202	S179-F181 WeakPolarHBondContact O-CD2 3.22Å; S179-F181 WeakPolarHBondContact O-CE2 3.42Å; S179-F181 PolarHBondContact O-N 3.24Å; S179-F181 VanDerWaalsContact O-N 3.17Å; S179-M201 WeakPolarHBondContact OG-CA 3.13Å; S179-D202 WeakPolarHBondContact OG-CB 3.2Å; S179-D202 PolarHBondContact OG-N 2.87Å; S179-D202 PolarHBondContact OG-OD2 2.98Å
180	Q	79	Confident	90.4	Very high	190 Å²	190	61.9 Å²	61.9	89%	0.888	31%	0.31	S	S	*	.			trans	-79.2	98.3	172.1	-65.6	-177.4	1	0	0	110
181	F	80.9	Confident	90.3	Very high	58 Å²	58	61.1 Å²	61.1	25%	0.254	31%	0.307	S	S	.	.			trans	-68.6	131.4	177.8	-65.2	-84.8	0	0	0	111.8	F177 S179 Y185 V199 M201 V274 V276	F177-F181 HydrophobicContact CB-CE2 3.76Å; F177-F181 HydrophobicContact CB-CZ 4.05Å; F177-F181 HydrophobicContact CD1-CE2 4.47Å; F177-F181 AromaticContact CD1-CZ 3.92Å; F177-F181 HydrophobicContact CD1-CZ 3.92Å; F177-F181 HydrophobicContact CG-CE2 4.35Å; F177-F181 HydrophobicContact CG-CZ 4.24Å; S179-F181 WeakPolarHBondContact O-CD2 3.22Å; S179-F181 WeakPolarHBondContact O-CE2 3.42Å; S179-F181 PolarHBondContact O-N 3.24Å; S179-F181 VanDerWaalsContact O-N 3.17Å; F181-Y185 WeakPolarHBondContact CA-OH 3.42Å; F181-V199 HydrophobicContact CE1-CG1 4.31Å; F181-M201 HydrophobicContact CE1-CG 3.99Å; F181-M201 HydrophobicContact CZ-CG 4.19Å; F181-V274 HydrophobicContact CD1-CG2 4.3Å; F181-V274 HydrophobicContact CD2-CG2 3.83Å; F181-V274 HydrophobicContact CE1-CG1 4.22Å; F181-V274 HydrophobicContact CE1-CG2 4.27Å; F181-V274 HydrophobicContact CE2-CB 4.45Å; F181-V274 HydrophobicContact CE2-CG1 4.37Å; F181-V274 HydrophobicContact CE2-CG2 3.82Å; F181-V274 HydrophobicContact CG-CG2 4.09Å; F181-V274 HydrophobicContact CZ-CB 4.45Å; F181-V274 HydrophobicContact CZ-CG1 3.89Å; F181-V274 HydrophobicContact CZ-CG2 4.04Å; F181-V276 HydrophobicContact CD1-CG1 3.59Å; F181-V276 HydrophobicContact CE1-CG1 4.06Å; F181-V276 HydrophobicContact CG-CG1 4.44Å
182	Q	82.2	Confident	90.1	Very high	124 Å²	124	64.6 Å²	64.6	58%	0.579	32%	0.321	S	S	*	.			trans	-73	153.2	165.6	-60.6	-174.7	-3.4	0	0	109.4	S184 Y185	Q182-S184 VanDerWaalsContact C-N 3.27Å; Q182-S184 PolarHBondContact O-N 2.78Å; Q182-Y185 HydrophobicContact CB-CD2 4.27Å; Q182-Y185 HydrophobicContact CB-CE1 4.13Å; Q182-Y185 HydrophobicContact CB-CE2 3.82Å; Q182-Y185 HydrophobicContact CG-CE1 4.12Å; Q182-Y185 PolarHBondContact N-OH 2.84Å; Q182-Y185 WeakPolarHBondContact O-CE2 3.49Å
183	K	78.1	Confident	90	Very high	175 Å²	175	64.5 Å²	64.5	76%	0.761	32%	0.323	S	S	*	.	S	Bend	trans	-58.9	-42.7	178.3	-173	-169.4	170	-163.1	0	111.4
184	S	91.4	Very high	89.8	Confident	39 Å²	39	64.8 Å²	64.8	27%	0.273	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	145	178.8	61.5	0	0	0	0	110.2	Q182 E277 N279	Q182-S184 VanDerWaalsContact C-N 3.27Å; Q182-S184 PolarHBondContact O-N 2.78Å; S184-E277 CarbonylContact C-O 3.52Å; S184-E277 VanDerWaalsContact CA-O 3.25Å; S184-E277 WeakPolarHBondContact CA-O 3.26Å; S184-N279 WeakPolarHBondContact CB-ND2 3.4Å; S184-N279 PolarHBondContact OG-ND2 3.4Å; S184-N279 VanDerWaalsContact OG-ND2 3.12Å
185	Y	95.4	Very high	89.8	Confident	20 Å²	20	66.1 Å²	66.1	8%	0.078	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	138	178.8	-66.2	-103.7	0	0	0	111.5	F181 Q182 P198 V199 V276 E277 L278 N279	F181-Y185 WeakPolarHBondContact CA-OH 3.42Å; Q182-Y185 HydrophobicContact CB-CD2 4.27Å; Q182-Y185 HydrophobicContact CB-CE1 4.13Å; Q182-Y185 HydrophobicContact CB-CE2 3.82Å; Q182-Y185 HydrophobicContact CG-CE1 4.12Å; Q182-Y185 PolarHBondContact N-OH 2.84Å; Q182-Y185 WeakPolarHBondContact O-CE2 3.49Å; Y185-P198 HydrophobicContact CD1-CB 4.18Å; Y185-P198 HydrophobicContact CD1-CG 4.27Å; Y185-V199 HydrophobicContact CD1-CG2 3.98Å; Y185-V199 HydrophobicContact CD2-CG2 3.72Å; Y185-V199 HydrophobicContact CE1-CG2 4.22Å; Y185-V199 HydrophobicContact CE2-CG2 3.99Å; Y185-V199 HydrophobicContact CG-CG2 3.71Å; Y185-V276 HydrophobicContact CE2-CG1 4.42Å; Y185-E277 PolarHBondContact N-O 2.81Å; Y185-L278 CarbonylContact O-C 3.46Å; Y185-L278 VanDerWaalsContact O-CA 3.29Å; Y185-L278 WeakPolarHBondContact O-CA 3.49Å; Y185-N279 PolarHBondContact O-N 3.28Å
186	D	95.8	Very high	89.7	Confident	99 Å²	99	71.3 Å²	71.3	53%	0.529	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	126.2	-177.2	-66.4	-12.6	0	0	0	111.7	N279 I281	D186-N279 WeakPolarHBondContact OD1-CB 3.31Å; D186-N279 PolarHBondContact OD1-ND2 2.99Å; D186-I281 HydrophobicContact CB-CD1 4Å; D186-I281 HydrophobicContact CB-CG1 3.78Å
187	V	95.3	Very high	89.8	Confident	3 Å²	3	67.3 Å²	67.3	2%	0.018	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	119.8	-177.4	178.5	0	0	0	0	109.5	L197 P198 F248 L278 N279 V280 I281	V187-L197 HydrophobicContact CG1-CD2 3.79Å; V187-L197 HydrophobicContact CG2-CD2 4.32Å; V187-P198 HydrophobicContact CG2-CG 4.11Å; V187-F248 HydrophobicContact CG1-CD2 3.96Å; V187-F248 HydrophobicContact CG1-CE2 3.6Å; V187-F248 HydrophobicContact CG1-CZ 4.04Å; V187-L278 HydrophobicContact CG2-CB 4.23Å; V187-L278 HydrophobicContact CG2-CD1 4.36Å; V187-L278 HydrophobicContact CG2-CD2 4.25Å; V187-N279 PolarHBondContact N-O 3.39Å; V187-V280 CarbonylContact O-C 3.55Å; V187-V280 WeakPolarHBondContact O-CA 3.38Å; V187-I281 PolarHBondContact O-N 3.32Å
188	K	93.4	Very high	89.8	Confident	103 Å²	103	68.9 Å²	68.9	45%	0.448	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	139.7	174.5	-70	-166.2	168.8	-153.8	0	111.1	N190 T191 I281 T283 E376	K188-N190 WeakPolarHBondContact CB-OD1 3.44Å; K188-N190 WeakPolarHBondContact CD-OD1 3.29Å; K188-N190 PolarHBondContact O-N 2.71Å; K188-T191 VanDerWaalsContact O-CB 3.28Å; K188-T191 WeakPolarHBondContact O-CB 3.36Å; K188-T191 PolarHBondContact O-N 2.92Å; K188-T191 PolarHBondContact O-OG1 3.19Å; K188-I281 HydrophobicContact CG-CB 4.47Å; K188-T283 HydrophobicContact CB-CG2 4.1Å; K188-T283 HydrophobicContact CD-CG2 4.15Å; K188-T283 HydrophobicContact CG-CG2 4.26Å; K188-E376 IonicContact NZ-OE1 3.67Å
189	E	93.3	Very high	90	Very high	8 Å²	8	64.4 Å²	64.4	4%	0.037	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-30.2	177.7	67.4	179.1	168.6	0	0	113.8	T191 F248 Y250 V280 I281 T283 S285	E189-T191 PolarHBondContact O-N 3.2Å; E189-T191 VanDerWaalsContact O-N 3.14Å; E189-F248 HydrophobicContact CB-CB 4.15Å; E189-Y250 VanDerWaalsContact OE2-CB 3.24Å; E189-Y250 WeakPolarHBondContact OE2-CB 3.39Å; E189-Y250 PolarHBondContact OE2-N 2.88Å; E189-V280 HydrophobicContact CB-CG1 3.78Å; E189-I281 PolarHBondContact N-O 3.02Å; E189-T283 HydrophobicContact CG-CG2 4.17Å; E189-T283 WeakPolarHBondContact CG-OG1 3.41Å; E189-T283 PolarHBondContact OE1-N 2.69Å; E189-T283 PolarHBondContact OE1-OG1 2.67Å; E189-S285 WeakPolarHBondContact OE1-CB 3.08Å
190	N	89.9	Confident	90.5	Very high	35 Å²	35	66.7 Å²	66.7	19%	0.187	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	16.9	175.8	69.8	7.7	0	0	0	114.9	K188 T379 L386	K188-N190 WeakPolarHBondContact CB-OD1 3.44Å; K188-N190 WeakPolarHBondContact CD-OD1 3.29Å; K188-N190 PolarHBondContact O-N 2.71Å; N190-T379 HydrophobicContact CB-CG2 4.29Å; N190-T379 VanDerWaalsContact CB-OG1 3.26Å; N190-T379 WeakPolarHBondContact CB-OG1 3.35Å; N190-L386 HydrophobicContact CB-CD1 4.44Å; N190-L386 HydrophobicContact CB-CD2 4.23Å; N190-L386 VanDerWaalsContact O-CD2 3.28Å; N190-L386 WeakPolarHBondContact O-CD2 3.14Å
191	T	91.3	Very high	91.1	Very high	24 Å²	24	57.6 Å²	57.6	15%	0.147	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-63.3	132	167.7	-62.3	0	0	0	0	109.7	K188 E189 D195 L197	K188-T191 VanDerWaalsContact O-CB 3.28Å; K188-T191 WeakPolarHBondContact O-CB 3.36Å; K188-T191 PolarHBondContact O-N 2.92Å; K188-T191 PolarHBondContact O-OG1 3.19Å; E189-T191 PolarHBondContact O-N 3.2Å; E189-T191 VanDerWaalsContact O-N 3.14Å; T191-D195 HydrophobicContact CG2-CB 3.87Å; T191-L197 HydrophobicContact CG2-CD2 4.1Å
192	K	90.2	Very high	91.7	Very high	93 Å²	93	57.3 Å²	57.3	40%	0.404	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-82.7	157.9	-171.8	-46.4	-166.8	-178.1	-146.7	0	112	G194 D195 L386 E388	K192-G194 PolarHBondContact O-N 3.32Å; K192-D195 WeakPolarHBondContact CB-OD2 3.26Å; K192-D195 WeakPolarHBondContact CG-OD2 3.41Å; K192-D195 PolarHBondContact N-OD2 3.14Å; K192-D195 WeakPolarHBondContact O-CB 3.2Å; K192-D195 PolarHBondContact O-N 2.96Å; K192-L386 HydrophobicContact CG-CD2 4.27Å; K192-E388 WeakPolarHBondContact CE-OE1 3.34Å; K192-E388 IonicContact NZ-OE1 3.5Å; K192-E388 PolarHBondContact NZ-OE1 2.81Å; K192-E388 IonicContact NZ-OE2 2.86Å; K192-E388 PolarHBondContact NZ-OE2 3.4Å
193	V	90.3	Very high	92.3	Very high	74 Å²	74	51.5 Å²	51.5	45%	0.448	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	119.9	178.3	-174.5	0	0	0	0	109.6	E245	V193-E245 WeakPolarHBondContact CG1-O 3.43Å
194	G	90.2	Very high	93	Very high	40 Å²	40	44.3 Å²	44.3	41%	0.412	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.1	-6.3	-174.1	0	0	0	0	0	115.1	K192 S244	K192-G194 PolarHBondContact O-N 3.32Å; G194-S244 PolarHBondContact N-O 2.86Å
195	D	92.8	Very high	93.2	Very high	71 Å²	71	43 Å²	43	38%	0.38	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-71.5	155.6	175.4	-75.9	-15.1	0	0	0	112	T191 K192 I243 S244	T191-D195 HydrophobicContact CG2-CB 3.87Å; K192-D195 WeakPolarHBondContact CB-OD2 3.26Å; K192-D195 WeakPolarHBondContact CG-OD2 3.41Å; K192-D195 PolarHBondContact N-OD2 3.14Å; K192-D195 WeakPolarHBondContact O-CB 3.2Å; K192-D195 PolarHBondContact O-N 2.96Å; D195-I243 VanDerWaalsContact O-CA 3.32Å; D195-I243 WeakPolarHBondContact O-CA 3.47Å; D195-S244 PolarHBondContact O-N 3.28Å; D195-S244 VanDerWaalsContact O-N 3.1Å
196	Y	94.8	Very high	93.1	Very high	109 Å²	109	46.5 Å²	46.5	43%	0.427	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	133.7	176.9	-60.6	-71.8	0	0	0	112	K233 I235 Q241 I243	Y196-K233 HydrophobicContact CE1-CB 4.42Å; Y196-K233 HydrophobicContact CE1-CD 3.75Å; Y196-K233 HydrophobicContact CE1-CG 4.31Å; Y196-K233 WeakPolarHBondContact OH-CE 3.38Å; Y196-K233 PolarHBondContact OH-NZ 3.04Å; Y196-I235 HydrophobicContact CD1-CD1 4.36Å; Y196-I235 HydrophobicContact CE1-CD1 3.56Å; Y196-Q241 HydrophobicContact CD1-CB 4.16Å; Y196-Q241 HydrophobicContact CD1-CG 4.1Å; Y196-I243 HydrophobicContact CD1-CG2 3.61Å; Y196-I243 HydrophobicContact CE1-CG2 4.02Å; Y196-I243 HydrophobicContact CG-CG2 4.47Å
197	L	95.1	Very high	93	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	158.3	171.2	-58.7	-176.3	0	0	0	110.2	V187 T191 V199 I230 Q241 L242 F248 L278	V187-L197 HydrophobicContact CG1-CD2 3.79Å; V187-L197 HydrophobicContact CG2-CD2 4.32Å; T191-L197 HydrophobicContact CG2-CD2 4.1Å; L197-V199 PolarHBondContact O-N 3.35Å; L197-I230 HydrophobicContact CD1-CG1 4.38Å; L197-I230 HydrophobicContact CD1-CG2 3.8Å; L197-Q241 PolarHBondContact O-NE2 2.83Å; L197-L242 HydrophobicContact CB-CB 4Å; L197-L242 HydrophobicContact CD1-CB 4.05Å; L197-L242 HydrophobicContact CG-CB 4.39Å; L197-L242 PolarHBondContact N-O 2.82Å; L197-F248 HydrophobicContact CD1-CZ 4.24Å; L197-F248 HydrophobicContact CD2-CE2 4.02Å; L197-F248 HydrophobicContact CD2-CZ 4.24Å; L197-L278 HydrophobicContact CD1-CD1 4.07Å
198	P	93.6	Very high	92.9	Very high	65 Å²	65	46 Å²	46	42%	0.422	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	0.6	-177.5	29	-39.3	0	0	0	115.3	Y185 V187 L200	Y185-P198 HydrophobicContact CD1-CB 4.18Å; Y185-P198 HydrophobicContact CD1-CG 4.27Å; V187-P198 HydrophobicContact CG2-CG 4.11Å; P198-L200 PolarHBondContact O-N 2.88Å
199	V	93.6	Very high	92.8	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	90.8	177.5	-173.2	0	0	0	0	109.9	F181 Y185 L197 M201 Q241 L242 V276 L278	F181-V199 HydrophobicContact CE1-CG1 4.31Å; Y185-V199 HydrophobicContact CD1-CG2 3.98Å; Y185-V199 HydrophobicContact CD2-CG2 3.72Å; Y185-V199 HydrophobicContact CE1-CG2 4.22Å; Y185-V199 HydrophobicContact CE2-CG2 3.99Å; Y185-V199 HydrophobicContact CG-CG2 3.71Å; L197-V199 PolarHBondContact O-N 3.35Å; V199-M201 HydrophobicContact CG1-CG 4.08Å; V199-M201 HydrophobicContact CG1-SD 4.45Å; V199-Q241 WeakPolarHBondContact O-CG 3.24Å; V199-L242 HydrophobicContact CB-CB 4.37Å; V199-L242 HydrophobicContact CB-CD1 3.73Å; V199-L242 HydrophobicContact CB-CG 3.92Å; V199-L242 HydrophobicContact CG1-CD1 3.93Å; V199-L242 HydrophobicContact CG1-CG 4.11Å; V199-L242 HydrophobicContact CG2-CD1 4.02Å; V199-L242 PolarHBondContact O-N 2.89Å; V199-L242 VanDerWaalsContact O-N 3.15Å; V199-V276 HydrophobicContact CG1-CG1 4.32Å; V199-L278 HydrophobicContact CG2-CD2 3.74Å
200	L	93.2	Very high	92.5	Very high	68 Å²	68	51.3 Å²	51.3	36%	0.356	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	142.2	165.1	-175.1	66.6	0	0	0	109.7	P198 Q241	P198-L200 PolarHBondContact O-N 2.88Å; L200-Q241 HydrophobicContact CD1-CB 4.1Å; L200-Q241 HydrophobicContact CD1-CG 4.36Å
201	M	93.2	Very high	92.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	120.4	-174.7	-57.4	179	-70.1	0	0	110.5	F177 S179 F181 V199 V203 V218 V232 Q239 H240 L242 I260	F177-M201 HydrophobicContact CD1-CB 4.44Å; F177-M201 HydrophobicContact CD1-SD 4.47Å; F177-M201 HydrophobicContact CE1-SD 4.03Å; S179-M201 WeakPolarHBondContact OG-CA 3.13Å; F181-M201 HydrophobicContact CE1-CG 3.99Å; F181-M201 HydrophobicContact CZ-CG 4.19Å; V199-M201 HydrophobicContact CG1-CG 4.08Å; V199-M201 HydrophobicContact CG1-SD 4.45Å; M201-V203 HydrophobicContact CB-CG2 4.33Å; M201-V218 HydrophobicContact CE-CG1 4.16Å; M201-V232 HydrophobicContact CE-CG1 3.87Å; M201-Q239 CarbonylContact O-C 3.58Å; M201-Q239 WeakPolarHBondContact O-CA 3.41Å; M201-H240 WeakPolarHBondContact CA-O 3.46Å; M201-H240 HydrophobicContact CB-CB 4.43Å; M201-H240 WeakPolarHBondContact CB-O 3.29Å; M201-H240 HydrophobicContact CE-CB 4.1Å; M201-H240 PolarHBondContact N-O 3.06Å; M201-H240 PolarHBondContact O-N 3.04Å; M201-L242 HydrophobicContact CE-CD2 3.7Å; M201-L242 HydrophobicContact CE-CG 4.23Å; M201-L242 HydrophobicContact SD-CD2 4.47Å; M201-I260 HydrophobicContact CE-CG2 4.23Å; M201-I260 HydrophobicContact SD-CB 4.49Å; M201-I260 HydrophobicContact SD-CD1 3.93Å; M201-I260 HydrophobicContact SD-CG1 4.42Å; M201-I260 HydrophobicContact SD-CG2 3.93Å
202	D	93.9	Very high	92.6	Very high	51 Å²	51	54.7 Å²	54.7	27%	0.273	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	111	171.1	-48.4	-72.2	0	0	0	106.6	I178 S179 Q239	I178-D202 PolarHBondContact N-O 2.74Å; S179-D202 WeakPolarHBondContact OG-CB 3.2Å; S179-D202 PolarHBondContact OG-N 2.87Å; S179-D202 PolarHBondContact OG-OD2 2.98Å; D202-Q239 WeakPolarHBondContact OD1-CG 3.34Å; D202-Q239 PolarHBondContact OD1-NE2 2.76Å
203	V	94.1	Very high	92.7	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.012	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	130.8	-178.8	-169.5	0	0	0	0	108.1	P175 M176 F177 M201 V216 V218 K238 A262	P175-V203 HydrophobicContact CB-CG1 4.23Å; M176-V203 WeakPolarHBondContact O-CA 3.27Å; F177-V203 HydrophobicContact CD1-CG2 3.57Å; F177-V203 HydrophobicContact CE1-CG2 3.71Å; F177-V203 HydrophobicContact CG-CG2 4.37Å; M201-V203 HydrophobicContact CB-CG2 4.33Å; V203-V216 HydrophobicContact CG1-CG1 3.95Å; V203-V218 HydrophobicContact CB-CG2 4.42Å; V203-V218 HydrophobicContact CG1-CG2 4.46Å; V203-V218 HydrophobicContact CG2-CG2 4.05Å; V203-K238 PolarHBondContact N-O 3.25Å; V203-K238 WeakPolarHBondContact O-CA 3.34Å; V203-K238 WeakPolarHBondContact O-CB 3.48Å; V203-A262 HydrophobicContact CG1-CB 3.72Å
204	V	93.2	Very high	92.8	Very high	25 Å²	25	48.7 Å²	48.7	15%	0.152	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	137.2	-174.3	-179.8	0	0	0	0	108.4	M176 I178 K238	M176-V204 WeakPolarHBondContact CG-O 3.17Å; M176-V204 PolarHBondContact N-O 2.75Å; M176-V204 PolarHBondContact O-N 3.19Å; I178-V204 HydrophobicContact CD1-CB 3.72Å; I178-V204 HydrophobicContact CD1-CG1 4.33Å; I178-V204 HydrophobicContact CD1-CG2 3.64Å; I178-V204 HydrophobicContact CG1-CB 4.36Å; I178-V204 HydrophobicContact CG1-CG2 4.28Å; V204-K238 HydrophobicContact CG2-CB 4.49Å; V204-K238 HydrophobicContact CG2-CD 4Å; V204-K238 HydrophobicContact CG2-CG 4.37Å
205	D	95.1	Very high	92.9	Very high	12 Å²	12	48.6 Å²	48.6	6%	0.064	27%	0.27	C	S	.	.			trans	-102	156.9	160.9	-139.3	-58.6	0	0	0	110.2	N173 P175 D207 V216	N173-D205 WeakPolarHBondContact CB-OD1 3.49Å; P175-D205 VanDerWaalsContact CA-OD2 3.25Å; P175-D205 WeakPolarHBondContact CA-OD2 3.36Å; P175-D205 WeakPolarHBondContact CD-OD2 3.41Å; P175-D205 WeakPolarHBondContact CG-OD2 3.25Å; P175-D205 VanDerWaalsContact N-OD2 3.1Å; D205-D207 PolarHBondContact OD1-N 2.94Å; D205-V216 HydrophobicContact CB-CG2 4.3Å
206	L	93.2	Very high	92.9	Very high	92 Å²	92	45.8 Å²	45.8	48%	0.482	26%	0.255	S	S	.	.	S	Bend	trans	-97	-20.4	176	-58	-178.1	0	0	0	111.9	R136 E137 N173	R136-L206 PolarHBondContact NH2-O 2.88Å; E137-L206 HydrophobicContact CG-CB 3.86Å; N173-L206 HydrophobicContact CB-CB 4.15Å
207	D	94.4	Very high	92.8	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.011	25%	0.253	C	S	.	.	S	Bend	trans	-57.2	169	170.6	-66	-5.4	0	0	0	112.1	N171 N173 D205 E209 N213 S214	N171-D207 WeakPolarHBondContact CA-OD2 3.11Å; N173-D207 VanDerWaalsContact CB-OD1 3.24Å; N173-D207 WeakPolarHBondContact CB-OD1 3.45Å; N173-D207 PolarHBondContact N-OD1 3.02Å; N173-D207 PolarHBondContact ND2-OD1 3.12Å; D205-D207 PolarHBondContact OD1-N 2.94Å; D207-E209 PolarHBondContact O-N 3.16Å; D207-E209 VanDerWaalsContact O-N 3.13Å; D207-N213 HydrophobicContact CB-CB 3.67Å; D207-N213 WeakPolarHBondContact OD2-CB 3.35Å; D207-S214 WeakPolarHBondContact O-CB 3.45Å
208	Q	93	Very high	92.8	Very high	91 Å²	91	44.5 Å²	44.5	43%	0.425	26%	0.257	S	S	.	.			trans	-60.3	117.5	-164.7	-167.4	163.8	35.2	0	0	113.3	R136 D169 G210 T211 S214	R136-Q208 VanDerWaalsContact NH1-N 3.12Å; D169-Q208 HydrophobicContact CB-CB 3.95Å; D169-Q208 WeakPolarHBondContact OD1-CA 3.35Å; D169-Q208 VanDerWaalsContact OD1-CB 3.23Å; D169-Q208 WeakPolarHBondContact OD1-CB 3.4Å; D169-Q208 PolarHBondContact OD1-N 3.02Å; D169-Q208 VanDerWaalsContact OD2-CB 3.26Å; D169-Q208 WeakPolarHBondContact OD2-CB 3.4Å; D169-Q208 PolarHBondContact OD2-N 2.86Å; Q208-G210 PolarHBondContact O-N 3.44Å; Q208-T211 HydrophobicContact CB-CG2 3.59Å; Q208-T211 HydrophobicContact CG-CG2 3.89Å; Q208-T211 PolarHBondContact O-N 3.14Å; Q208-T211 PolarHBondContact O-OG1 2.78Å; Q208-T211 VanDerWaalsContact OE1-CG2 3.3Å; Q208-S214 VanDerWaalsContact C-OG 3.32Å; Q208-S214 WeakPolarHBondContact O-CB 3.45Å; Q208-S214 PolarHBondContact O-OG 3.13Å
209	E	90.8	Very high	92.9	Very high	145 Å²	145	45 Å²	45	68%	0.678	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	112.1	176.1	-67.1	-158.6	152.3	0	0	111.4	D207 S214 K238	D207-E209 PolarHBondContact O-N 3.16Å; D207-E209 VanDerWaalsContact O-N 3.13Å; E209-S214 WeakPolarHBondContact CA-OG 3.44Å; E209-K238 WeakPolarHBondContact OE1-CE 3.46Å; E209-K238 IonicContact OE1-NZ 3.32Å; E209-K238 PolarHBondContact OE1-NZ 2.67Å
210	G	87.3	Confident	93.1	Very high	76 Å²	76	46.9 Å²	46.9	78%	0.784	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.6	-0	-179.8	0	0	0	0	0	116.4	Q208 S214	Q208-G210 PolarHBondContact O-N 3.44Å; G210-S214 PolarHBondContact N-OG 3.01Å; G210-S214 VanDerWaalsContact N-OG 3.1Å
211	T	90.9	Very high	93.2	Very high	38 Å²	38	47.6 Å²	47.6	23%	0.233	28%	0.277	C	S	.	.	S	Bend	trans	-83	174.7	163.5	65.9	0	0	0	0	111.4	D169 Q208 N213 T215	D169-T211 PolarHBondContact OD2-OG1 3.05Å; Q208-T211 HydrophobicContact CB-CG2 3.59Å; Q208-T211 HydrophobicContact CG-CG2 3.89Å; Q208-T211 PolarHBondContact O-N 3.14Å; Q208-T211 PolarHBondContact O-OG1 2.78Å; Q208-T211 VanDerWaalsContact OE1-CG2 3.3Å; T211-N213 PolarHBondContact O-N 3.27Å; T211-N213 PolarHBondContact OG1-N 2.7Å; T211-T215 PolarHBondContact O-N 3.2Å; T211-T215 PolarHBondContact O-OG1 2.87Å
212	I	92.4	Very high	93.3	Very high	92 Å²	92	54.4 Å²	54.4	47%	0.472	31%	0.306	S	S	.	.	S	Bend	trans	-67.6	-20.3	173.1	64.9	-178.5	0	0	0	112.2	T215 R265	I212-T215 PolarHBondContact O-N 2.63Å; I212-R265 HydrophobicContact CB-CB 4.37Å; I212-R265 CarbonylContact O-C 3.58Å; I212-R265 WeakPolarHBondContact O-CA 3.49Å; I212-R265 WeakPolarHBondContact O-CB 3.34Å; I212-R265 PolarHBondContact O-N 3.44Å
213	N	92.5	Very high	93.3	Very high	19 Å²	19	53.8 Å²	53.8	10%	0.102	30%	0.302	C	S	.	.	S	Bend	trans	-72.9	-53.1	-176.9	-55.4	0.5	0	0	0	109.1	D169 I170 N171 D207 T211 T215 D264	D169-N213 PolarHBondContact OD2-ND2 2.73Å; I170-N213 VanDerWaalsContact C-ND2 3.3Å; I170-N213 PolarHBondContact O-ND2 2.74Å; N171-N213 HydrophobicContact CB-CB 4.16Å; N171-N213 WeakPolarHBondContact OD1-CA 3.15Å; N171-N213 WeakPolarHBondContact OD1-CB 3.13Å; N171-N213 VanDerWaalsContact OD1-CG 3.29Å; N171-N213 PolarHBondContact OD1-OD1 2.93Å; D207-N213 HydrophobicContact CB-CB 3.67Å; D207-N213 WeakPolarHBondContact OD2-CB 3.35Å; T211-N213 PolarHBondContact O-N 3.27Å; T211-N213 PolarHBondContact OG1-N 2.7Å; N213-T215 PolarHBondContact O-N 2.92Å; N213-T215 VanDerWaalsContact O-N 3.08Å; N213-D264 WeakPolarHBondContact O-CB 3.29Å
214	S	91.1	Very high	93.4	Very high	23 Å²	23	57.1 Å²	57.1	16%	0.161	33%	0.326	C	S	.	.	S	Bend	trans	-72.6	0.6	171.7	70.3	0	0	0	0	116.1	D207 Q208 E209 G210 V216	D207-S214 WeakPolarHBondContact O-CB 3.45Å; Q208-S214 VanDerWaalsContact C-OG 3.32Å; Q208-S214 WeakPolarHBondContact O-CB 3.45Å; Q208-S214 PolarHBondContact O-OG 3.13Å; E209-S214 WeakPolarHBondContact CA-OG 3.44Å; G210-S214 PolarHBondContact N-OG 3.01Å; G210-S214 VanDerWaalsContact N-OG 3.1Å; S214-V216 PolarHBondContact O-N 3.18Å
215	T	92.3	Very high	93.4	Very high	37 Å²	37	58.3 Å²	58.3	23%	0.227	33%	0.334	C	S	.	.			trans	-84.7	93.4	-178.8	-63.5	0	0	0	0	111.1	T211 I212 N213 D264 R265	T211-T215 PolarHBondContact O-N 3.2Å; T211-T215 PolarHBondContact O-OG1 2.87Å; I212-T215 PolarHBondContact O-N 2.63Å; N213-T215 PolarHBondContact O-N 2.92Å; N213-T215 VanDerWaalsContact O-N 3.08Å; T215-D264 CarbonylContact O-C 3.56Å; T215-R265 HydrophobicContact CG2-CG 4.48Å; T215-R265 WeakPolarHBondContact O-CG 3.48Å; T215-R265 PolarHBondContact O-N 2.7Å
216	V	93.5	Very high	93.3	Very high	12 Å²	12	61.3 Å²	61.3	7%	0.073	36%	0.36	C	S	.	.			trans	-84.9	133.7	-177.2	-166.2	0	0	0	0	113.4	P175 V203 D205 S214 V218 A262 S263	P175-V216 HydrophobicContact CB-CB 4.47Å; P175-V216 HydrophobicContact CB-CG1 3.74Å; P175-V216 HydrophobicContact CB-CG2 3.83Å; P175-V216 HydrophobicContact CG-CG1 4Å; P175-V216 HydrophobicContact CG-CG2 3.99Å; V203-V216 HydrophobicContact CG1-CG1 3.95Å; D205-V216 HydrophobicContact CB-CG2 4.3Å; S214-V216 PolarHBondContact O-N 3.18Å; V216-V218 HydrophobicContact CG1-CG2 3.99Å; V216-A262 HydrophobicContact CG1-CB 3.83Å; V216-S263 CarbonylContact C-O 3.56Å; V216-S263 WeakPolarHBondContact CA-O 3.43Å; V216-S263 WeakPolarHBondContact CG1-O 3.48Å
217	D	93	Very high	93.2	Very high	70 Å²	70	64.4 Å²	64.4	37%	0.374	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	130.1	161.1	-79	-47.3	0	0	0	110.5	S263 R265	D217-S263 PolarHBondContact N-O 2.89Å; D217-S263 PolarHBondContact O-N 2.77Å; D217-R265 IonicContact OD1-CZ 3.68Å; D217-R265 IonicContact OD1-NE 2.82Å; D217-R265 IonicContact OD1-NH2 2.72Å; D217-R265 PolarHBondContact OD1-NH2 3.03Å; D217-R265 IonicContact OD2-CZ 2.67Å; D217-R265 IonicContact OD2-NE 3.75Å; D217-R265 PolarHBondContact OD2-NE 3.36Å; D217-R265 IonicContact OD2-NH2 3.65Å; D217-R265 PolarHBondContact OD2-NH2 3.28Å
218	V	95.4	Very high	93.1	Very high	15 Å²	15	65 Å²	65	9%	0.091	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	125.8	-178.8	-173.1	0	0	0	0	110.6	F177 M201 V203 V216 V232 I260 S261 A262	F177-V218 HydrophobicContact CE1-CG1 4.36Å; M201-V218 HydrophobicContact CE-CG1 4.16Å; V203-V218 HydrophobicContact CB-CG2 4.42Å; V203-V218 HydrophobicContact CG1-CG2 4.46Å; V203-V218 HydrophobicContact CG2-CG2 4.05Å; V216-V218 HydrophobicContact CG1-CG2 3.99Å; V218-V232 HydrophobicContact CB-CG1 4.25Å; V218-V232 HydrophobicContact CG1-CG1 4.05Å; V218-I260 HydrophobicContact CG1-CG2 3.61Å; V218-S261 WeakPolarHBondContact CA-O 3.46Å; V218-A262 HydrophobicContact CG2-CB 4.27Å
219	T	95.4	Very high	93.1	Very high	74 Å²	74	67 Å²	67	45%	0.454	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	153.8	-173.4	59.9	0	0	0	0	113	I260 S261	T219-I260 CarbonylContact O-C 3.56Å; T219-I260 WeakPolarHBondContact O-CA 3.26Å; T219-I260 WeakPolarHBondContact O-CG2 3.45Å; T219-S261 PolarHBondContact N-O 2.84Å; T219-S261 PolarHBondContact O-N 3.4Å
220	V	96.3	Very high	93.3	Very high	40 Å²	40	60.4 Å²	60.4	24%	0.242	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	115.8	167.3	173.3	0	0	0	0	108.7	Q223 I230 V232 L242 V258 I260	V220-Q223 HydrophobicContact CG1-CB 4.43Å; V220-I230 WeakPolarHBondContact CG2-O 3.43Å; V220-V232 HydrophobicContact CG2-CG2 3.92Å; V220-L242 HydrophobicContact CG2-CD2 4.26Å; V220-V258 HydrophobicContact CB-CG1 4.4Å; V220-V258 HydrophobicContact CG1-CG1 3.66Å; V220-V258 HydrophobicContact CG2-CG1 3.79Å; V220-I260 HydrophobicContact CG2-CG1 4.14Å
221	V	95.3	Very high	93.6	Very high	84 Å²	84	57.1 Å²	57.1	51%	0.509	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	-20.4	-177.1	-68.5	0	0	0	0	113.4	V259 S261	V221-V259 HydrophobicContact CG2-CB 4.21Å; V221-V259 HydrophobicContact CG2-CG1 3.95Å; V221-V259 WeakPolarHBondContact CG2-O 3.39Å; V221-V259 PolarHBondContact N-O 2.93Å; V221-S261 VanDerWaalsContact CG1-CB 3.48Å
222	K	95.4	Very high	93.8	Very high	142 Å²	142	57 Å²	57	62%	0.617	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-153.3	140	175.2	-173.6	-177.7	177.3	-173.7	0	110.5	V259	K222-V259 HydrophobicContact CB-CB 4.04Å; K222-V259 HydrophobicContact CB-CG2 4.12Å; K222-V259 HydrophobicContact CD-CG2 4.46Å; K222-V259 PolarHBondContact N-O 2.85Å; K222-V259 PolarHBondContact O-N 3.3Å
223	Q	95.1	Very high	94	Very high	38 Å²	38	56.7 Å²	56.7	18%	0.178	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	147	175.7	-155.6	-168.8	-70.9	0	0	109.9	V220 P225 P228 I230 S257 V258	V220-Q223 HydrophobicContact CG1-CB 4.43Å; Q223-P225 CarbonylContact C-O 3.58Å; Q223-P225 WeakPolarHBondContact CG-O 3.26Å; Q223-P225 PolarHBondContact NE2-O 3.02Å; Q223-P228 PolarHBondContact NE2-O 3.44Å; Q223-I230 HydrophobicContact CG-CD1 4.33Å; Q223-S257 CarbonylContact C-O 3.57Å; Q223-S257 WeakPolarHBondContact CA-O 3.37Å; Q223-V258 HydrophobicContact CG-CG2 4.31Å
224	S	95.1	Very high	94	Very high	73 Å²	73	59.7 Å²	59.7	51%	0.51	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	120.3	170.5	-179.9	0	0	0	0	110.7	Y256 S257	S224-Y256 WeakPolarHBondContact O-CA 3.42Å; S224-S257 PolarHBondContact N-O 2.83Å; S224-S257 PolarHBondContact O-N 2.88Å
225	P	94.9	Very high	94.1	Very high	50 Å²	50	62 Å²	62	33%	0.325	34%	0.335	S	S	.	.	S	Bend	cis	-60.3	170	-5.1	-26.7	37.9	0	0	0	114.9	Q223 A253 H255 Y256	Q223-P225 CarbonylContact C-O 3.58Å; Q223-P225 WeakPolarHBondContact CG-O 3.26Å; Q223-P225 PolarHBondContact NE2-O 3.02Å; P225-A253 HydrophobicContact CG-CB 3.88Å; P225-H255 VanDerWaalsContact CD-O 3.3Å; P225-H255 WeakPolarHBondContact CD-O 3.11Å; P225-Y256 HydrophobicContact CB-CD1 4.48Å; P225-Y256 HydrophobicContact CB-CE1 3.97Å; P225-Y256 HydrophobicContact CG-CE1 4.21Å
226	A	92.5	Very high	94	Very high	74 Å²	74	63.3 Å²	63.3	61%	0.612	34%	0.343	S	S	*	.			trans	-88.8	-14.6	-172.3	0	0	0	0	0	115.2
227	E	90.4	Very high	93.6	Very high	157 Å²	157	69.4 Å²	69.4	73%	0.734	37%	0.371	S	S	*	.	S	Bend	trans	-134.3	143.3	176.8	-67.5	-173.1	169.6	0	0	109.7	Y256	E227-Y256 WeakPolarHBondContact O-CE1 3.41Å; E227-Y256 PolarHBondContact O-OH 3.29Å; E227-Y256 VanDerWaalsContact O-OH 3.05Å
228	P	92.4	Very high	93.3	Very high	15 Å²	15	70 Å²	70	10%	0.097	37%	0.37	C	S	.	.	S	Bend	cis	-65.1	159.2	-6.2	32.5	-37.5	0	0	0	111	Q223 C247 F248 Y256	Q223-P228 PolarHBondContact NE2-O 3.44Å; P228-C247 WeakPolarHBondContact CB-O 3.39Å; P228-C247 WeakPolarHBondContact CG-O 3.35Å; P228-F248 HydrophobicContact CG-CD1 3.61Å; P228-F248 HydrophobicContact CG-CD2 4.44Å; P228-F248 HydrophobicContact CG-CE1 3.83Å; P228-F248 HydrophobicContact CG-CG 3.94Å; P228-F248 HydrophobicContact CG-CZ 4.33Å; P228-Y256 VanDerWaalsContact CD-OH 3.29Å; P228-Y256 WeakPolarHBondContact CD-OH 3.34Å
229	K	92.7	Very high	93.2	Very high	132 Å²	132	72.5 Å²	72.5	57%	0.574	38%	0.381	S	S	*	.			trans	-74	143.7	173.5	-71.1	-178.4	179.6	-177.2	0	110.5	E245	K229-E245 HydrophobicContact CB-CB 3.97Å; K229-E245 HydrophobicContact CB-CG 4.35Å; K229-E245 VanDerWaalsContact CB-OE2 3.28Å; K229-E245 WeakPolarHBondContact CB-OE2 3.29Å; K229-E245 WeakPolarHBondContact O-CB 3.43Å; K229-E245 PolarHBondContact O-N 3.03Å
230	I	95.3	Very high	93.1	Very high	7 Å²	7	69.2 Å²	69.2	4%	0.036	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	118.7	174.5	-61.4	165.4	0	0	0	107.8	L197 V220 Q223 L242 F248 Y256 V258 L278	L197-I230 HydrophobicContact CD1-CG1 4.38Å; L197-I230 HydrophobicContact CD1-CG2 3.8Å; V220-I230 WeakPolarHBondContact CG2-O 3.43Å; Q223-I230 HydrophobicContact CG-CD1 4.33Å; I230-L242 HydrophobicContact CG2-CB 4.12Å; I230-L242 HydrophobicContact CG2-CD1 4.14Å; I230-L242 HydrophobicContact CG2-CD2 4.42Å; I230-L242 HydrophobicContact CG2-CG 4.47Å; I230-F248 HydrophobicContact CD1-CE1 4.29Å; I230-F248 HydrophobicContact CD1-CZ 4.41Å; I230-F248 HydrophobicContact CG1-CZ 4.35Å; I230-Y256 HydrophobicContact CD1-CD1 4.5Å; I230-V258 HydrophobicContact CD1-CG2 3.61Å; I230-L278 HydrophobicContact CD1-CD1 3.63Å
231	G	94.5	Very high	93.1	Very high	7 Å²	7	69.3 Å²	69.3	7%	0.072	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	173.9	178.3	0	0	0	0	0	112.1	L242 I243	G231-L242 WeakPolarHBondContact O-CA 3.37Å; G231-I243 PolarHBondContact N-O 3.43Å; G231-I243 PolarHBondContact O-N 2.81Å
232	V	95.6	Very high	93.1	Very high	36 Å²	36	65.3 Å²	65.3	22%	0.218	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	138.3	169.6	-168.7	0	0	0	0	108.6	M201 V218 V220 H240 L242	M201-V232 HydrophobicContact CE-CG1 3.87Å; V218-V232 HydrophobicContact CB-CG1 4.25Å; V218-V232 HydrophobicContact CG1-CG1 4.05Å; V220-V232 HydrophobicContact CG2-CG2 3.92Å; V232-H240 HydrophobicContact CG1-CB 4.08Å; V232-L242 HydrophobicContact CG2-CD2 3.94Å
233	K	95	Very high	93.1	Very high	86 Å²	86	59.9 Å²	59.9	37%	0.374	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	123.8	174.9	-172.4	165.7	169.4	-161.6	0	110.3	Y196 Q241 I243	Y196-K233 HydrophobicContact CE1-CB 4.42Å; Y196-K233 HydrophobicContact CE1-CD 3.75Å; Y196-K233 HydrophobicContact CE1-CG 4.31Å; Y196-K233 WeakPolarHBondContact OH-CE 3.38Å; Y196-K233 PolarHBondContact OH-NZ 3.04Å; K233-Q241 PolarHBondContact N-O 3.03Å; K233-Q241 PolarHBondContact O-N 2.9Å; K233-I243 HydrophobicContact CB-CD1 4.21Å; K233-I243 HydrophobicContact CB-CG1 4.35Å; K233-I243 HydrophobicContact CB-CG2 3.75Å; K233-I243 HydrophobicContact CD-CG2 4.13Å
234	K	93.9	Very high	93.1	Very high	82 Å²	82	58 Å²	58	36%	0.357	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	130.1	173.6	-169.6	162.3	-177.8	169.7	0	109.6	T236 E237 H240	K234-T236 WeakPolarHBondContact CE-O 3.42Å; K234-T236 WeakPolarHBondContact CG-O 3.36Å; K234-E237 VanDerWaalsContact CE-CA 3.48Å; K234-E237 WeakPolarHBondContact CE-OE1 3.18Å; K234-E237 WeakPolarHBondContact CE-OE2 3.41Å; K234-E237 IonicContact NZ-OE1 2.74Å; K234-E237 IonicContact NZ-OE2 3.85Å; K234-E237 PolarHBondContact NZ-OE2 2.8Å; K234-H240 WeakPolarHBondContact CD-NE2 3.2Å; K234-H240 WeakPolarHBondContact CG-NE2 3.32Å
235	I	92.6	Very high	92.9	Very high	71 Å²	71	59.6 Å²	59.6	36%	0.364	30%	0.302	S	S	.	.	S	Bend	trans	-106.6	-44.5	-178.4	-49.8	-59.5	0	0	0	109.9	Y196 Q239 Q241	Y196-I235 HydrophobicContact CD1-CD1 4.36Å; Y196-I235 HydrophobicContact CE1-CD1 3.56Å; I235-Q239 WeakPolarHBondContact CA-O 3.07Å; I235-Q239 HydrophobicContact CB-CB 4.33Å; I235-Q239 WeakPolarHBondContact CB-O 3.25Å; I235-Q239 PolarHBondContact N-O 2.85Å; I235-Q241 HydrophobicContact CD1-CB 4.12Å; I235-Q241 HydrophobicContact CG1-CB 4.03Å
236	T	89.4	Confident	92.7	Very high	65 Å²	65	57.4 Å²	57.4	40%	0.399	29%	0.289	S	S	.	.	S	Bend	trans	-138.8	-176.3	170.7	70.8	0	0	0	0	108.8	K234 K238 Q239	K234-T236 WeakPolarHBondContact CE-O 3.42Å; K234-T236 WeakPolarHBondContact CG-O 3.36Å; T236-K238 VanDerWaalsContact C-N 3.25Å; T236-K238 PolarHBondContact O-N 2.93Å; T236-K238 PolarHBondContact OG1-N 3.32Å; T236-Q239 PolarHBondContact N-O 3.01Å; T236-Q239 VanDerWaalsContact OG1-CB 3.32Å; T236-Q239 WeakPolarHBondContact OG1-CB 3.39Å; T236-Q239 WeakPolarHBondContact OG1-CG 3.48Å; T236-Q239 PolarHBondContact OG1-N 3.01Å
237	E	84.8	Confident	92.6	Very high	140 Å²	140	54.1 Å²	54.1	65%	0.654	26%	0.261	S	S	*	.	S	Bend	trans	-59.6	-36.1	176.7	-70.6	-50.5	116.3	0	0	113.6	K234	K234-E237 VanDerWaalsContact CE-CA 3.48Å; K234-E237 WeakPolarHBondContact CE-OE1 3.18Å; K234-E237 WeakPolarHBondContact CE-OE2 3.41Å; K234-E237 IonicContact NZ-OE1 2.74Å; K234-E237 IonicContact NZ-OE2 3.85Å; K234-E237 PolarHBondContact NZ-OE2 2.8Å
238	K	87.4	Confident	92.7	Very high	82 Å²	82	46.7 Å²	46.7	36%	0.357	23%	0.226	S	C	.	.	S	Bend	trans	-99.5	-27.1	-179.9	-64.3	-179.6	175.3	-166	0	112.9	V203 V204 E209 T236 H240	V203-K238 PolarHBondContact N-O 3.25Å; V203-K238 WeakPolarHBondContact O-CA 3.34Å; V203-K238 WeakPolarHBondContact O-CB 3.48Å; V204-K238 HydrophobicContact CG2-CB 4.49Å; V204-K238 HydrophobicContact CG2-CD 4Å; V204-K238 HydrophobicContact CG2-CG 4.37Å; E209-K238 WeakPolarHBondContact OE1-CE 3.46Å; E209-K238 IonicContact OE1-NZ 3.32Å; E209-K238 PolarHBondContact OE1-NZ 2.67Å; T236-K238 VanDerWaalsContact C-N 3.25Å; T236-K238 PolarHBondContact O-N 2.93Å; T236-K238 PolarHBondContact OG1-N 3.32Å; K238-H240 PolarHBondContact O-ND1 3.16Å
239	Q	92.9	Very high	92.7	Very high	67 Å²	67	47.3 Å²	47.3	31%	0.313	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	129.1	-173.9	-57.5	-166.7	-64.8	0	0	113.4	M201 D202 I235 T236	M201-Q239 CarbonylContact O-C 3.58Å; M201-Q239 WeakPolarHBondContact O-CA 3.41Å; D202-Q239 WeakPolarHBondContact OD1-CG 3.34Å; D202-Q239 PolarHBondContact OD1-NE2 2.76Å; I235-Q239 WeakPolarHBondContact CA-O 3.07Å; I235-Q239 HydrophobicContact CB-CB 4.33Å; I235-Q239 WeakPolarHBondContact CB-O 3.25Å; I235-Q239 PolarHBondContact N-O 2.85Å; T236-Q239 PolarHBondContact N-O 3.01Å; T236-Q239 VanDerWaalsContact OG1-CB 3.32Å; T236-Q239 WeakPolarHBondContact OG1-CB 3.39Å; T236-Q239 WeakPolarHBondContact OG1-CG 3.48Å; T236-Q239 PolarHBondContact OG1-N 3.01Å
240	H	94.5	Very high	92.7	Very high	6 Å²	6	43 Å²	43	3%	0.028	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	145.1	-178.5	-62.6	81.2	0	0	0	109.3	M201 V232 K234 K238	M201-H240 WeakPolarHBondContact CA-O 3.46Å; M201-H240 HydrophobicContact CB-CB 4.43Å; M201-H240 WeakPolarHBondContact CB-O 3.29Å; M201-H240 HydrophobicContact CE-CB 4.1Å; M201-H240 PolarHBondContact N-O 3.06Å; M201-H240 PolarHBondContact O-N 3.04Å; V232-H240 HydrophobicContact CG1-CB 4.08Å; K234-H240 WeakPolarHBondContact CD-NE2 3.2Å; K234-H240 WeakPolarHBondContact CG-NE2 3.32Å; K238-H240 PolarHBondContact O-ND1 3.16Å
241	Q	95.1	Very high	92.5	Very high	42 Å²	42	47 Å²	47	20%	0.196	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	142	179.3	-165.7	165.6	8.1	0	0	110.5	Y196 L197 V199 L200 K233 I235	Y196-Q241 HydrophobicContact CD1-CB 4.16Å; Y196-Q241 HydrophobicContact CD1-CG 4.1Å; L197-Q241 PolarHBondContact O-NE2 2.83Å; V199-Q241 WeakPolarHBondContact O-CG 3.24Å; L200-Q241 HydrophobicContact CD1-CB 4.1Å; L200-Q241 HydrophobicContact CD1-CG 4.36Å; K233-Q241 PolarHBondContact N-O 3.03Å; K233-Q241 PolarHBondContact O-N 2.9Å; I235-Q241 HydrophobicContact CD1-CB 4.12Å; I235-Q241 HydrophobicContact CG1-CB 4.03Å
242	L	95.6	Very high	92.3	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	145.8	172.7	-60.4	-173.1	0	0	0	110.6	L197 V199 M201 V220 I230 G231 V232 I260 V276	L197-L242 HydrophobicContact CB-CB 4Å; L197-L242 HydrophobicContact CD1-CB 4.05Å; L197-L242 HydrophobicContact CG-CB 4.39Å; L197-L242 PolarHBondContact N-O 2.82Å; V199-L242 HydrophobicContact CB-CB 4.37Å; V199-L242 HydrophobicContact CB-CD1 3.73Å; V199-L242 HydrophobicContact CB-CG 3.92Å; V199-L242 HydrophobicContact CG1-CD1 3.93Å; V199-L242 HydrophobicContact CG1-CG 4.11Å; V199-L242 HydrophobicContact CG2-CD1 4.02Å; V199-L242 PolarHBondContact O-N 2.89Å; V199-L242 VanDerWaalsContact O-N 3.15Å; M201-L242 HydrophobicContact CE-CD2 3.7Å; M201-L242 HydrophobicContact CE-CG 4.23Å; M201-L242 HydrophobicContact SD-CD2 4.47Å; V220-L242 HydrophobicContact CG2-CD2 4.26Å; I230-L242 HydrophobicContact CG2-CB 4.12Å; I230-L242 HydrophobicContact CG2-CD1 4.14Å; I230-L242 HydrophobicContact CG2-CD2 4.42Å; I230-L242 HydrophobicContact CG2-CG 4.47Å; G231-L242 WeakPolarHBondContact O-CA 3.37Å; V232-L242 HydrophobicContact CG2-CD2 3.94Å; L242-I260 HydrophobicContact CD1-CD1 4.11Å; L242-I260 HydrophobicContact CD2-CD1 4.12Å; L242-I260 HydrophobicContact CD2-CG1 4.09Å; L242-V276 HydrophobicContact CD1-CG2 4.28Å
243	I	95.4	Very high	92.2	Very high	27 Å²	27	53.2 Å²	53.2	14%	0.138	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	151.1	176.8	54.9	163	0	0	0	110.7	D195 Y196 G231 K233	D195-I243 VanDerWaalsContact O-CA 3.32Å; D195-I243 WeakPolarHBondContact O-CA 3.47Å; Y196-I243 HydrophobicContact CD1-CG2 3.61Å; Y196-I243 HydrophobicContact CE1-CG2 4.02Å; Y196-I243 HydrophobicContact CG-CG2 4.47Å; G231-I243 PolarHBondContact N-O 3.43Å; G231-I243 PolarHBondContact O-N 2.81Å; K233-I243 HydrophobicContact CB-CD1 4.21Å; K233-I243 HydrophobicContact CB-CG1 4.35Å; K233-I243 HydrophobicContact CB-CG2 3.75Å; K233-I243 HydrophobicContact CD-CG2 4.13Å
244	S	94.3	Very high	92.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	123.6	174.5	-151	0	0	0	0	111.6	G194 D195 G246 F248	G194-S244 PolarHBondContact N-O 2.86Å; D195-S244 PolarHBondContact O-N 3.28Å; D195-S244 VanDerWaalsContact O-N 3.1Å; S244-G246 PolarHBondContact OG-O 2.86Å; S244-F248 WeakPolarHBondContact OG-CE2 3.45Å
245	E	92.1	Very high	92.3	Very high	106 Å²	106	55.5 Å²	55.5	50%	0.495	27%	0.267	S	S	.	.	S	Bend	trans	-91.4	0.2	174.2	-53.7	-171.4	157	0	0	112.9	V193 K229	V193-E245 WeakPolarHBondContact CG1-O 3.43Å; K229-E245 HydrophobicContact CB-CB 3.97Å; K229-E245 HydrophobicContact CB-CG 4.35Å; K229-E245 VanDerWaalsContact CB-OE2 3.28Å; K229-E245 WeakPolarHBondContact CB-OE2 3.29Å; K229-E245 WeakPolarHBondContact O-CB 3.43Å; K229-E245 PolarHBondContact O-N 3.03Å
246	G	90.3	Very high	92.5	Very high	4 Å²	4	52.4 Å²	52.4	4%	0.041	25%	0.25	C	S	.	.	S	Bend	trans	-154.9	176.4	172.2	0	0	0	0	0	111.8	S244 G384	S244-G246 PolarHBondContact OG-O 2.86Å; G246-G384 CarbonylContact C-O 3.31Å; G246-G384 VanDerWaalsContact CA-O 3.26Å; G246-G384 WeakPolarHBondContact CA-O 3.16Å
247	C	90.7	Very high	92.7	Very high	4 Å²	4	51.9 Å²	51.9	3%	0.027	25%	0.249	C	C	.	.			trans	-76.3	146.3	168	52.3	0	0	0	0	111.4	P228 C381 G384 K385 L386	P228-C247 WeakPolarHBondContact CB-O 3.39Å; P228-C247 WeakPolarHBondContact CG-O 3.35Å; C247-C381 HydrophobicContact CB-CB 3.7Å; C247-C381 WeakPolarHBondContact CB-SG 3.21Å; C247-C381 PolarHBondContact O-SG 2.69Å; C247-C381 VanDerWaalsContact O-SG 3.39Å; C247-C381 WeakPolarHBondContact SG-CA 3.3Å; C247-C381 WeakPolarHBondContact SG-CB 3.47Å; C247-C381 CovalentContact SG-SG 2.03Å; C247-C381 PolarHBondContact SG-SG 2.88Å; C247-G384 PolarHBondContact N-O 3.17Å; C247-K385 PolarHBondContact SG-N 2.81Å; C247-K385 VanDerWaalsContact SG-N 3.37Å; C247-K385 PolarHBondContact SG-O 3.09Å; C247-K385 VanDerWaalsContact SG-O 3.34Å; C247-L386 HydrophobicContact CB-CB 4.23Å; C247-L386 HydrophobicContact CB-CD1 4.24Å
248	F	92.7	Very high	93.3	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	22%	0.218	C	C	.	.			trans	-83.8	170.8	168.1	-60.4	-93.2	0	0	0	110	V187 E189 L197 P228 I230 S244 Y256 V280 C381	V187-F248 HydrophobicContact CG1-CD2 3.96Å; V187-F248 HydrophobicContact CG1-CE2 3.6Å; V187-F248 HydrophobicContact CG1-CZ 4.04Å; E189-F248 HydrophobicContact CB-CB 4.15Å; L197-F248 HydrophobicContact CD1-CZ 4.24Å; L197-F248 HydrophobicContact CD2-CE2 4.02Å; L197-F248 HydrophobicContact CD2-CZ 4.24Å; P228-F248 HydrophobicContact CG-CD1 3.61Å; P228-F248 HydrophobicContact CG-CD2 4.44Å; P228-F248 HydrophobicContact CG-CE1 3.83Å; P228-F248 HydrophobicContact CG-CG 3.94Å; P228-F248 HydrophobicContact CG-CZ 4.33Å; I230-F248 HydrophobicContact CD1-CE1 4.29Å; I230-F248 HydrophobicContact CD1-CZ 4.41Å; I230-F248 HydrophobicContact CG1-CZ 4.35Å; S244-F248 WeakPolarHBondContact OG-CE2 3.45Å; F248-Y256 HydrophobicContact CD1-CD2 4.21Å; F248-Y256 AromaticContact CD1-CE2 3.78Å; F248-Y256 HydrophobicContact CD1-CE2 3.78Å; F248-Y256 AromaticContact CD1-CZ 3.99Å; F248-Y256 HydrophobicContact CE1-CD2 4.26Å; F248-Y256 HydrophobicContact CE1-CE2 4.25Å; F248-V280 HydrophobicContact CB-CG1 4.31Å; F248-V280 HydrophobicContact CB-CG2 4.43Å; F248-V280 HydrophobicContact CD1-CG2 4.12Å; F248-C381 VanDerWaalsContact O-CB 3.26Å; F248-C381 WeakPolarHBondContact O-CB 3.16Å; F248-C381 PolarHBondContact O-SG 3.04Å; F248-C381 VanDerWaalsContact O-SG 3.35Å
249	D	91.8	Very high	93.6	Very high	28 Å²	28	42.9 Å²	42.9	15%	0.15	21%	0.211	C	C	.	.			trans	-150.8	110.1	-178.4	-179.8	-50.4	0	0	0	108	D251 K252 A253	D249-D251 VanDerWaalsContact C-N 3.33Å; D249-D251 PolarHBondContact OD1-N 2.71Å; D249-D251 VanDerWaalsContact OD1-N 3.12Å; D249-K252 HydrophobicContact CB-CB 4.13Å; D249-K252 HydrophobicContact CB-CD 4.16Å; D249-K252 HydrophobicContact CB-CG 4.21Å; D249-K252 PolarHBondContact O-N 3.29Å; D249-K252 WeakPolarHBondContact OD1-CB 3.31Å; D249-K252 WeakPolarHBondContact OD1-CG 3.48Å; D249-K252 PolarHBondContact OD1-N 2.77Å; D249-K252 IonicContact OD2-NZ 2.76Å; D249-K252 PolarHBondContact OD2-NZ 2.8Å; D249-A253 PolarHBondContact O-N 2.84Å
250	Y	93	Very high	93.7	Very high	43 Å²	43	39.7 Å²	39.7	17%	0.169	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-29.8	-175	-179.5	-102.9	0	0	0	112.9	E189 K254 V280 D282	E189-Y250 VanDerWaalsContact OE2-CB 3.24Å; E189-Y250 WeakPolarHBondContact OE2-CB 3.39Å; E189-Y250 PolarHBondContact OE2-N 2.88Å; Y250-K254 HydrophobicContact CD1-CD 4.44Å; Y250-K254 HydrophobicContact CD2-CB 4.29Å; Y250-K254 HydrophobicContact CD2-CD 4.18Å; Y250-K254 HydrophobicContact CD2-CG 3.77Å; Y250-K254 HydrophobicContact CE1-CD 3.96Å; Y250-K254 HydrophobicContact CE2-CB 4.08Å; Y250-K254 HydrophobicContact CE2-CD 3.62Å; Y250-K254 HydrophobicContact CE2-CG 3.65Å; Y250-K254 HydrophobicContact CG-CG 4.24Å; Y250-K254 VanDerWaalsContact CZ-CD 3.5Å; Y250-K254 WeakPolarHBondContact O-CE 3.4Å; Y250-K254 WeakPolarHBondContact O-CG 3.48Å; Y250-K254 PolarHBondContact OH-NZ 3.03Å; Y250-V280 HydrophobicContact CD2-CB 4.18Å; Y250-V280 HydrophobicContact CD2-CG1 4.08Å; Y250-V280 VanDerWaalsContact CD2-O 3.23Å; Y250-V280 WeakPolarHBondContact CD2-O 3.14Å; Y250-V280 VanDerWaalsContact CE2-O 3.24Å; Y250-V280 WeakPolarHBondContact CE2-O 3.5Å; Y250-D282 HydrophobicContact CD1-CB 3.53Å; Y250-D282 WeakPolarHBondContact CD1-OD1 3.3Å; Y250-D282 WeakPolarHBondContact CD1-OD2 3.42Å; Y250-D282 HydrophobicContact CD2-CB 3.95Å; Y250-D282 HydrophobicContact CE1-CB 3.54Å; Y250-D282 WeakPolarHBondContact CE1-OD2 3.49Å; Y250-D282 HydrophobicContact CE2-CB 4Å; Y250-D282 HydrophobicContact CG-CB 3.72Å
251	D	91.3	Very high	93.8	Very high	91 Å²	91	40.2 Å²	40.2	49%	0.487	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-33.2	178.6	-133.7	22	0	0	0	110.8	D249 H286 K316	D249-D251 VanDerWaalsContact C-N 3.33Å; D249-D251 PolarHBondContact OD1-N 2.71Å; D249-D251 VanDerWaalsContact OD1-N 3.12Å; D251-H286 IonicContact OD2-CE1 3.6Å; D251-H286 IonicContact OD2-NE2 3.97Å; D251-K316 IonicContact OD2-NZ 2.66Å; D251-K316 PolarHBondContact OD2-NZ 2.92Å
252	K	90.9	Very high	93.8	Very high	159 Å²	159	38.2 Å²	38.2	69%	0.691	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-46.2	172.3	-70	-175.1	-172	89.7	0	113.4	D249	D249-K252 HydrophobicContact CB-CB 4.13Å; D249-K252 HydrophobicContact CB-CD 4.16Å; D249-K252 HydrophobicContact CB-CG 4.21Å; D249-K252 PolarHBondContact O-N 3.29Å; D249-K252 WeakPolarHBondContact OD1-CB 3.31Å; D249-K252 WeakPolarHBondContact OD1-CG 3.48Å; D249-K252 PolarHBondContact OD1-N 2.77Å; D249-K252 IonicContact OD2-NZ 2.76Å; D249-K252 PolarHBondContact OD2-NZ 2.8Å
253	A	93.4	Very high	93.8	Very high	13 Å²	13	40 Å²	40	11%	0.107	20%	0.204	C	C	.	.			trans	-156.2	108.1	-166.2	0	0	0	0	0	113.6	P225 D249 Y256 V280	P225-A253 HydrophobicContact CG-CB 3.88Å; D249-A253 PolarHBondContact O-N 2.84Å; A253-Y256 HydrophobicContact CB-CE2 3.78Å; A253-Y256 VanDerWaalsContact CB-OH 3.29Å; A253-Y256 WeakPolarHBondContact CB-OH 3.43Å; A253-V280 WeakPolarHBondContact O-CG2 3.45Å
254	K	94.9	Very high	93.8	Very high	88 Å²	88	39 Å²	39	38%	0.383	20%	0.199	S	C	.	.	S	Bend	trans	-86.4	-14.3	-175.9	-57.8	-170.6	173.6	-158.9	0	115.1	Y250 V280	Y250-K254 HydrophobicContact CD1-CD 4.44Å; Y250-K254 HydrophobicContact CD2-CB 4.29Å; Y250-K254 HydrophobicContact CD2-CD 4.18Å; Y250-K254 HydrophobicContact CD2-CG 3.77Å; Y250-K254 HydrophobicContact CE1-CD 3.96Å; Y250-K254 HydrophobicContact CE2-CB 4.08Å; Y250-K254 HydrophobicContact CE2-CD 3.62Å; Y250-K254 HydrophobicContact CE2-CG 3.65Å; Y250-K254 HydrophobicContact CG-CG 4.24Å; Y250-K254 VanDerWaalsContact CZ-CD 3.5Å; Y250-K254 WeakPolarHBondContact O-CE 3.4Å; Y250-K254 WeakPolarHBondContact O-CG 3.48Å; Y250-K254 PolarHBondContact OH-NZ 3.03Å; K254-V280 PolarHBondContact O-N 2.87Å
255	H	95.5	Very high	93.8	Very high	129 Å²	129	45 Å²	45	60%	0.597	22%	0.221	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-145.1	141.7	-177.9	-53.7	85	0	0	0	110.5	P225 L278 N279	P225-H255 VanDerWaalsContact CD-O 3.3Å; P225-H255 WeakPolarHBondContact CD-O 3.11Å; H255-L278 CarbonylContact C-O 3.57Å; H255-L278 VanDerWaalsContact CA-O 3.28Å; H255-L278 WeakPolarHBondContact CA-O 3.46Å; H255-N279 PolarHBondContact CD2-OD1 2.66Å
256	Y	95.6	Very high	93.7	Very high	6 Å²	6	40.2 Å²	40.2	2%	0.024	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	133.1	174.3	-70.3	-106.6	0	0	0	110	S224 P225 E227 P228 I230 F248 A253 E277 L278 V280	S224-Y256 WeakPolarHBondContact O-CA 3.42Å; P225-Y256 HydrophobicContact CB-CD1 4.48Å; P225-Y256 HydrophobicContact CB-CE1 3.97Å; P225-Y256 HydrophobicContact CG-CE1 4.21Å; E227-Y256 WeakPolarHBondContact O-CE1 3.41Å; E227-Y256 PolarHBondContact O-OH 3.29Å; E227-Y256 VanDerWaalsContact O-OH 3.05Å; P228-Y256 VanDerWaalsContact CD-OH 3.29Å; P228-Y256 WeakPolarHBondContact CD-OH 3.34Å; I230-Y256 HydrophobicContact CD1-CD1 4.5Å; F248-Y256 HydrophobicContact CD1-CD2 4.21Å; F248-Y256 AromaticContact CD1-CE2 3.78Å; F248-Y256 HydrophobicContact CD1-CE2 3.78Å; F248-Y256 AromaticContact CD1-CZ 3.99Å; F248-Y256 HydrophobicContact CE1-CD2 4.26Å; F248-Y256 HydrophobicContact CE1-CE2 4.25Å; A253-Y256 HydrophobicContact CB-CE2 3.78Å; A253-Y256 VanDerWaalsContact CB-OH 3.29Å; A253-Y256 WeakPolarHBondContact CB-OH 3.43Å; Y256-E277 CarbonylContact O-C 3.5Å; Y256-E277 WeakPolarHBondContact O-CA 3.26Å; Y256-L278 PolarHBondContact N-O 3.44Å; Y256-L278 PolarHBondContact O-N 2.85Å; Y256-V280 HydrophobicContact CD2-CG2 3.81Å; Y256-V280 HydrophobicContact CE2-CG2 3.63Å
257	S	95.6	Very high	93.7	Very high	54 Å²	54	48.5 Å²	48.5	38%	0.378	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	123	167.3	-176.4	0	0	0	0	108.7	Q223 S224	Q223-S257 CarbonylContact C-O 3.57Å; Q223-S257 WeakPolarHBondContact CA-O 3.37Å; S224-S257 PolarHBondContact N-O 2.83Å; S224-S257 PolarHBondContact O-N 2.88Å
258	V	95.4	Very high	93.7	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	123.5	-175.9	-164.8	0	0	0	0	108.5	V220 Q223 I230 I260 A275 V276 L278	V220-V258 HydrophobicContact CB-CG1 4.4Å; V220-V258 HydrophobicContact CG1-CG1 3.66Å; V220-V258 HydrophobicContact CG2-CG1 3.79Å; Q223-V258 HydrophobicContact CG-CG2 4.31Å; I230-V258 HydrophobicContact CD1-CG2 3.61Å; V258-I260 HydrophobicContact CG1-CG1 4.28Å; V258-A275 CarbonylContact O-C 3.5Å; V258-A275 WeakPolarHBondContact O-CA 3.37Å; V258-V276 HydrophobicContact CB-CG2 3.92Å; V258-V276 HydrophobicContact CG2-CG2 4.47Å; V258-V276 PolarHBondContact N-O 3.27Å; V258-V276 PolarHBondContact O-N 3.45Å; V258-L278 HydrophobicContact CG2-CD1 4.06Å; V258-L278 HydrophobicContact CG2-CG 4.25Å
259	V	95.3	Very high	93.7	Very high	33 Å²	33	56.7 Å²	56.7	20%	0.2	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	121.2	173.5	-170.1	0	0	0	0	108.6	V221 K222 V274 A275	V221-V259 HydrophobicContact CG2-CB 4.21Å; V221-V259 HydrophobicContact CG2-CG1 3.95Å; V221-V259 WeakPolarHBondContact CG2-O 3.39Å; V221-V259 PolarHBondContact N-O 2.93Å; K222-V259 HydrophobicContact CB-CB 4.04Å; K222-V259 HydrophobicContact CB-CG2 4.12Å; K222-V259 HydrophobicContact CD-CG2 4.46Å; K222-V259 PolarHBondContact N-O 2.85Å; K222-V259 PolarHBondContact O-N 3.3Å; V259-V274 WeakPolarHBondContact CA-O 3.37Å; V259-A275 HydrophobicContact CG2-CB 4.26Å
260	I	95.2	Very high	93.9	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	140.7	-178.4	-56.9	130.5	0	0	0	107.7	F177 M201 V218 T219 V220 L242 V258 T273 V274 V276	F177-I260 HydrophobicContact CE1-CG2 4.11Å; F177-I260 HydrophobicContact CZ-CG2 4.02Å; M201-I260 HydrophobicContact CE-CG2 4.23Å; M201-I260 HydrophobicContact SD-CB 4.49Å; M201-I260 HydrophobicContact SD-CD1 3.93Å; M201-I260 HydrophobicContact SD-CG1 4.42Å; M201-I260 HydrophobicContact SD-CG2 3.93Å; V218-I260 HydrophobicContact CG1-CG2 3.61Å; T219-I260 CarbonylContact O-C 3.56Å; T219-I260 WeakPolarHBondContact O-CA 3.26Å; T219-I260 WeakPolarHBondContact O-CG2 3.45Å; V220-I260 HydrophobicContact CG2-CG1 4.14Å; L242-I260 HydrophobicContact CD1-CD1 4.11Å; L242-I260 HydrophobicContact CD2-CD1 4.12Å; L242-I260 HydrophobicContact CD2-CG1 4.09Å; V258-I260 HydrophobicContact CG1-CG1 4.28Å; I260-T273 CarbonylContact O-C 3.49Å; I260-T273 WeakPolarHBondContact O-CA 3.22Å; I260-T273 WeakPolarHBondContact O-CB 3.45Å; I260-V274 HydrophobicContact CB-CG1 4.09Å; I260-V274 HydrophobicContact CD1-CG1 4.29Å; I260-V274 PolarHBondContact N-O 2.83Å; I260-V274 PolarHBondContact O-N 3.49Å; I260-V276 HydrophobicContact CD1-CG1 4.38Å; I260-V276 HydrophobicContact CD1-CG2 3.82Å
261	S	95.4	Very high	94	Very high	16 Å²	16	59.1 Å²	59.1	11%	0.112	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	136	173.6	-156.8	0	0	0	0	109.7	V218 T219 V221 S272 T273	V218-S261 WeakPolarHBondContact CA-O 3.46Å; T219-S261 PolarHBondContact N-O 2.84Å; T219-S261 PolarHBondContact O-N 3.4Å; V221-S261 VanDerWaalsContact CG1-CB 3.48Å; S261-S272 VanDerWaalsContact CA-O 3.32Å; S261-S272 WeakPolarHBondContact CA-O 3.21Å; S261-S272 PolarHBondContact OG-O 2.82Å; S261-T273 WeakPolarHBondContact OG-CG2 3.27Å
262	A	96.3	Very high	94.2	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	135.7	160.6	0	0	0	0	0	107.9	P175 F177 V203 V216 V218 S271 S272	P175-A262 HydrophobicContact CB-CB 3.86Å; F177-A262 HydrophobicContact CE1-CB 4.39Å; F177-A262 HydrophobicContact CE2-CB 3.74Å; F177-A262 HydrophobicContact CZ-CB 3.63Å; V203-A262 HydrophobicContact CG1-CB 3.72Å; V216-A262 HydrophobicContact CG1-CB 3.83Å; V218-A262 HydrophobicContact CG2-CB 4.27Å; A262-S271 CarbonylContact O-C 3.56Å; A262-S271 WeakPolarHBondContact O-CA 3.14Å; A262-S271 WeakPolarHBondContact O-CB 3.02Å; A262-S272 PolarHBondContact N-O 2.85Å; A262-S272 PolarHBondContact O-N 2.64Å
263	S	95.8	Very high	94.4	Very high	39 Å²	39	53.1 Å²	53.1	27%	0.273	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	139.5	176.6	-175.8	0	0	0	0	109.1	V216 D217 L270	V216-S263 CarbonylContact C-O 3.56Å; V216-S263 WeakPolarHBondContact CA-O 3.43Å; V216-S263 WeakPolarHBondContact CG1-O 3.48Å; D217-S263 PolarHBondContact N-O 2.89Å; D217-S263 PolarHBondContact O-N 2.77Å; S263-L270 WeakPolarHBondContact CA-O 3.26Å
264	D	95.3	Very high	94.4	Very high	6 Å²	6	53.9 Å²	53.9	3%	0.032	29%	0.294	C	S	.	.			trans	-73	-174	169.6	63.9	40.2	0	0	0	111.4	N171 P175 N213 T215 G266 P269 L270	N171-D264 PolarHBondContact ND2-OD2 2.93Å; P175-D264 HydrophobicContact CG-CB 4Å; N213-D264 WeakPolarHBondContact O-CB 3.29Å; T215-D264 CarbonylContact O-C 3.56Å; D264-G266 WeakPolarHBondContact OD1-CA 3.33Å; D264-G266 PolarHBondContact OD1-N 2.96Å; D264-P269 WeakPolarHBondContact OD1-CA 3.23Å; D264-P269 WeakPolarHBondContact OD1-CB 3.31Å; D264-L270 VanDerWaalsContact CG-N 3.27Å; D264-L270 PolarHBondContact N-O 2.63Å; D264-L270 PolarHBondContact OD1-N 2.63Å; D264-L270 VanDerWaalsContact OD1-N 3.16Å; D264-L270 VanDerWaalsContact OD2-CA 3.31Å; D264-L270 WeakPolarHBondContact OD2-CA 3.3Å; D264-L270 VanDerWaalsContact OD2-CB 3.24Å; D264-L270 WeakPolarHBondContact OD2-CB 3.49Å; D264-L270 PolarHBondContact OD2-N 2.62Å
265	R	93.1	Very high	94.3	Very high	124 Å²	124	52.8 Å²	52.8	47%	0.468	30%	0.302	S	S	.	.	S	Bend	trans	-115.5	28.6	166.3	-64.6	178.9	179.3	165	3	112.4	I212 T215 D217	I212-R265 HydrophobicContact CB-CB 4.37Å; I212-R265 CarbonylContact O-C 3.58Å; I212-R265 WeakPolarHBondContact O-CA 3.49Å; I212-R265 WeakPolarHBondContact O-CB 3.34Å; I212-R265 PolarHBondContact O-N 3.44Å; T215-R265 HydrophobicContact CG2-CG 4.48Å; T215-R265 WeakPolarHBondContact O-CG 3.48Å; T215-R265 PolarHBondContact O-N 2.7Å; D217-R265 IonicContact OD1-CZ 3.68Å; D217-R265 IonicContact OD1-NE 2.82Å; D217-R265 IonicContact OD1-NH2 2.72Å; D217-R265 PolarHBondContact OD1-NH2 3.03Å; D217-R265 IonicContact OD2-CZ 2.67Å; D217-R265 IonicContact OD2-NE 3.75Å; D217-R265 PolarHBondContact OD2-NE 3.36Å; D217-R265 IonicContact OD2-NH2 3.65Å; D217-R265 PolarHBondContact OD2-NH2 3.28Å
266	G	91.1	Very high	94.2	Very high	6 Å²	6	46.8 Å²	46.8	6%	0.062	27%	0.274	C	S	.	.			trans	-68.4	-178.5	178.3	0	0	0	0	0	115.6	N171 D264	N171-G266 WeakPolarHBondContact OD1-CA 3.44Å; D264-G266 WeakPolarHBondContact OD1-CA 3.33Å; D264-G266 PolarHBondContact OD1-N 2.96Å
267	K	88.6	Confident	94.2	Very high	179 Å²	179	50.8 Å²	50.8	78%	0.778	29%	0.293	S	S	*	.	S	Bend	trans	-145.9	101.3	178.3	-67.6	-176.5	-174.7	164.6	0	111.5
268	P	91.8	Very high	94.2	Very high	96 Å²	96	48.2 Å²	48.2	62%	0.623	28%	0.275	S	S	*	.	S	Bend	cis	-65.5	152.3	-4.5	31.3	-36.4	0	0	0	111.4
269	P	93.5	Very high	94.3	Very high	80 Å²	80	49.7 Å²	49.7	52%	0.519	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-76.5	135.2	176	31	-34.2	0	0	0	111.6	D264	D264-P269 WeakPolarHBondContact OD1-CA 3.23Å; D264-P269 WeakPolarHBondContact OD1-CB 3.31Å
270	L	95.4	Very high	94.3	Very high	51 Å²	51	48.4 Å²	48.4	27%	0.267	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-103.9	156.4	176.9	-54.6	178.3	0	0	0	110.3	N171 D172 N173 A174 S263 D264	N171-L270 WeakPolarHBondContact O-CD1 3.35Å; D172-L270 WeakPolarHBondContact O-CD1 3.39Å; N173-L270 VanDerWaalsContact O-CD1 3.29Å; N173-L270 WeakPolarHBondContact O-CD1 3.1Å; A174-L270 HydrophobicContact CB-CB 3.83Å; S263-L270 WeakPolarHBondContact CA-O 3.26Å; D264-L270 VanDerWaalsContact CG-N 3.27Å; D264-L270 PolarHBondContact N-O 2.63Å; D264-L270 PolarHBondContact OD1-N 2.63Å; D264-L270 VanDerWaalsContact OD1-N 3.16Å; D264-L270 VanDerWaalsContact OD2-CA 3.31Å; D264-L270 WeakPolarHBondContact OD2-CA 3.3Å; D264-L270 VanDerWaalsContact OD2-CB 3.24Å; D264-L270 WeakPolarHBondContact OD2-CB 3.49Å; D264-L270 PolarHBondContact OD2-N 2.62Å
271	S	95.5	Very high	94.3	Very high	72 Å²	72	51.7 Å²	51.7	50%	0.503	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	151.7	-173.6	52	0	0	0	0	112.9	A262	A262-S271 CarbonylContact O-C 3.56Å; A262-S271 WeakPolarHBondContact O-CA 3.14Å; A262-S271 WeakPolarHBondContact O-CB 3.02Å
272	S	95.4	Very high	94.2	Very high	32 Å²	32	51.8 Å²	51.8	22%	0.224	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	161.3	169.9	78.6	0	0	0	0	110.8	P175 F177 S261 A262	P175-S272 VanDerWaalsContact O-CB 3.23Å; P175-S272 WeakPolarHBondContact O-CB 3.36Å; P175-S272 PolarHBondContact O-OG 3.01Å; F177-S272 WeakPolarHBondContact CD2-OG 3.18Å; F177-S272 WeakPolarHBondContact CE2-OG 3.36Å; S261-S272 VanDerWaalsContact CA-O 3.32Å; S261-S272 WeakPolarHBondContact CA-O 3.21Å; S261-S272 PolarHBondContact OG-O 2.82Å; A262-S272 PolarHBondContact N-O 2.85Å; A262-S272 PolarHBondContact O-N 2.64Å
273	T	94.8	Very high	94.1	Very high	92 Å²	92	51.9 Å²	51.9	56%	0.564	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.9	148.4	179	52.9	0	0	0	0	112.1	I260 S261	I260-T273 CarbonylContact O-C 3.49Å; I260-T273 WeakPolarHBondContact O-CA 3.22Å; I260-T273 WeakPolarHBondContact O-CB 3.45Å; S261-T273 WeakPolarHBondContact OG-CG2 3.27Å
274	V	93.1	Very high	94.1	Very high	28 Å²	28	50.1 Å²	50.1	17%	0.17	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	145.2	173.7	64.9	0	0	0	0	109.8	F177 F181 V259 I260	F177-V274 HydrophobicContact CD1-CG1 4Å; F177-V274 HydrophobicContact CD2-CB 4.3Å; F177-V274 HydrophobicContact CD2-CG1 4.11Å; F177-V274 HydrophobicContact CE1-CG1 3.85Å; F177-V274 HydrophobicContact CE2-CB 4.4Å; F177-V274 HydrophobicContact CE2-CG1 3.97Å; F177-V274 HydrophobicContact CG-CG1 4.14Å; F177-V274 HydrophobicContact CZ-CG1 3.84Å; F181-V274 HydrophobicContact CD1-CG2 4.3Å; F181-V274 HydrophobicContact CD2-CG2 3.83Å; F181-V274 HydrophobicContact CE1-CG1 4.22Å; F181-V274 HydrophobicContact CE1-CG2 4.27Å; F181-V274 HydrophobicContact CE2-CB 4.45Å; F181-V274 HydrophobicContact CE2-CG1 4.37Å; F181-V274 HydrophobicContact CE2-CG2 3.82Å; F181-V274 HydrophobicContact CG-CG2 4.09Å; F181-V274 HydrophobicContact CZ-CB 4.45Å; F181-V274 HydrophobicContact CZ-CG1 3.89Å; F181-V274 HydrophobicContact CZ-CG2 4.04Å; V259-V274 WeakPolarHBondContact CA-O 3.37Å; I260-V274 HydrophobicContact CB-CG1 4.09Å; I260-V274 HydrophobicContact CD1-CG1 4.29Å; I260-V274 PolarHBondContact N-O 2.83Å; I260-V274 PolarHBondContact O-N 3.49Å
275	A	92.9	Very high	93.9	Very high	66 Å²	66	50.9 Å²	50.9	55%	0.545	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	132.9	174.5	0	0	0	0	0	110.1	V258 V259	V258-A275 CarbonylContact O-C 3.5Å; V258-A275 WeakPolarHBondContact O-CA 3.37Å; V259-A275 HydrophobicContact CG2-CB 4.26Å
276	V	93.5	Very high	93.9	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.018	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	144.3	175.1	-60.7	0	0	0	0	110.5	F181 Y185 V199 L242 V258 I260	F181-V276 HydrophobicContact CD1-CG1 3.59Å; F181-V276 HydrophobicContact CE1-CG1 4.06Å; F181-V276 HydrophobicContact CG-CG1 4.44Å; Y185-V276 HydrophobicContact CE2-CG1 4.42Å; V199-V276 HydrophobicContact CG1-CG1 4.32Å; L242-V276 HydrophobicContact CD1-CG2 4.28Å; V258-V276 HydrophobicContact CB-CG2 3.92Å; V258-V276 HydrophobicContact CG2-CG2 4.47Å; V258-V276 PolarHBondContact N-O 3.27Å; V258-V276 PolarHBondContact O-N 3.45Å; I260-V276 HydrophobicContact CD1-CG1 4.38Å; I260-V276 HydrophobicContact CD1-CG2 3.82Å
277	E	95.6	Very high	94	Very high	90 Å²	90	48 Å²	48	42%	0.421	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	134.3	170.7	-56.7	-176.4	147.1	0	0	109	S184 Y185 Y256	S184-E277 CarbonylContact C-O 3.52Å; S184-E277 VanDerWaalsContact CA-O 3.25Å; S184-E277 WeakPolarHBondContact CA-O 3.26Å; Y185-E277 PolarHBondContact N-O 2.81Å; Y256-E277 CarbonylContact O-C 3.5Å; Y256-E277 WeakPolarHBondContact O-CA 3.26Å
278	L	95.9	Very high	94.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	125.6	169.7	-50.7	178.9	0	0	0	108.9	Y185 V187 L197 V199 I230 H255 Y256 V258	Y185-L278 CarbonylContact O-C 3.46Å; Y185-L278 VanDerWaalsContact O-CA 3.29Å; Y185-L278 WeakPolarHBondContact O-CA 3.49Å; V187-L278 HydrophobicContact CG2-CB 4.23Å; V187-L278 HydrophobicContact CG2-CD1 4.36Å; V187-L278 HydrophobicContact CG2-CD2 4.25Å; L197-L278 HydrophobicContact CD1-CD1 4.07Å; V199-L278 HydrophobicContact CG2-CD2 3.74Å; I230-L278 HydrophobicContact CD1-CD1 3.63Å; H255-L278 CarbonylContact C-O 3.57Å; H255-L278 VanDerWaalsContact CA-O 3.28Å; H255-L278 WeakPolarHBondContact CA-O 3.46Å; Y256-L278 PolarHBondContact N-O 3.44Å; Y256-L278 PolarHBondContact O-N 2.85Å; V258-L278 HydrophobicContact CG2-CD1 4.06Å; V258-L278 HydrophobicContact CG2-CG 4.25Å
279	N	96.3	Very high	94.6	Very high	31 Å²	31	40.3 Å²	40.3	17%	0.166	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	125.7	171	-51.5	-37.6	0	0	0	107.8	S184 Y185 D186 V187 H255	S184-N279 WeakPolarHBondContact CB-ND2 3.4Å; S184-N279 PolarHBondContact OG-ND2 3.4Å; S184-N279 VanDerWaalsContact OG-ND2 3.12Å; Y185-N279 PolarHBondContact O-N 3.28Å; D186-N279 WeakPolarHBondContact OD1-CB 3.31Å; D186-N279 PolarHBondContact OD1-ND2 2.99Å; V187-N279 PolarHBondContact N-O 3.39Å; H255-N279 PolarHBondContact CD2-OD1 2.66Å
280	V	95.6	Very high	94.7	Very high	5 Å²	5	36.9 Å²	36.9	3%	0.03	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	124	171.2	-176.7	0	0	0	0	108.4	V187 E189 F248 Y250 A253 K254 Y256	V187-V280 CarbonylContact O-C 3.55Å; V187-V280 WeakPolarHBondContact O-CA 3.38Å; E189-V280 HydrophobicContact CB-CG1 3.78Å; F248-V280 HydrophobicContact CB-CG1 4.31Å; F248-V280 HydrophobicContact CB-CG2 4.43Å; F248-V280 HydrophobicContact CD1-CG2 4.12Å; Y250-V280 HydrophobicContact CD2-CB 4.18Å; Y250-V280 HydrophobicContact CD2-CG1 4.08Å; Y250-V280 VanDerWaalsContact CD2-O 3.23Å; Y250-V280 WeakPolarHBondContact CD2-O 3.14Å; Y250-V280 VanDerWaalsContact CE2-O 3.24Å; Y250-V280 WeakPolarHBondContact CE2-O 3.5Å; A253-V280 WeakPolarHBondContact O-CG2 3.45Å; K254-V280 PolarHBondContact O-N 2.87Å; Y256-V280 HydrophobicContact CD2-CG2 3.81Å; Y256-V280 HydrophobicContact CE2-CG2 3.63Å
281	I	95.1	Very high	94.7	Very high	69 Å²	69	40.1 Å²	40.1	35%	0.354	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	121.7	171.4	-56.2	-56.3	0	0	0	108.2	D186 V187 K188 E189	D186-I281 HydrophobicContact CB-CD1 4Å; D186-I281 HydrophobicContact CB-CG1 3.78Å; V187-I281 PolarHBondContact O-N 3.32Å; K188-I281 HydrophobicContact CG-CB 4.47Å; E189-I281 PolarHBondContact N-O 3.02Å
282	D	94.8	Very high	94.7	Very high	19 Å²	19	42.9 Å²	42.9	10%	0.102	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-59.2	142	174.2	-154.8	11.2	0	0	0	111.4	Y250 T318	Y250-D282 HydrophobicContact CD1-CB 3.53Å; Y250-D282 WeakPolarHBondContact CD1-OD1 3.3Å; Y250-D282 WeakPolarHBondContact CD1-OD2 3.42Å; Y250-D282 HydrophobicContact CD2-CB 3.95Å; Y250-D282 HydrophobicContact CE1-CB 3.54Å; Y250-D282 WeakPolarHBondContact CE1-OD2 3.49Å; Y250-D282 HydrophobicContact CE2-CB 4Å; Y250-D282 HydrophobicContact CG-CB 3.72Å; D282-T318 WeakPolarHBondContact OD2-CA 3.17Å; D282-T318 WeakPolarHBondContact OD2-CB 3.47Å; D282-T318 PolarHBondContact OD2-N 3.46Å; D282-T318 PolarHBondContact OD2-OG1 2.76Å
283	T	93.8	Very high	94.5	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.012	24%	0.239	C	C	.	.			trans	-135.8	-165.4	177	63.7	0	0	0	0	109.4	K188 E189 S285	K188-T283 HydrophobicContact CB-CG2 4.1Å; K188-T283 HydrophobicContact CD-CG2 4.15Å; K188-T283 HydrophobicContact CG-CG2 4.26Å; E189-T283 HydrophobicContact CG-CG2 4.17Å; E189-T283 WeakPolarHBondContact CG-OG1 3.41Å; E189-T283 PolarHBondContact OE1-N 2.69Å; E189-T283 PolarHBondContact OE1-OG1 2.67Å; T283-S285 PolarHBondContact O-N 2.83Å; T283-S285 VanDerWaalsContact O-N 3.07Å
284	N	94.8	Very high	94.3	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	25%	0.245	C	C	.	.	S	Bend	trans	-71.3	99.4	168.4	-171.7	-23.6	0	0	0	111.2	H286 D317 N374 E376 L378 T379	N284-H286 PolarHBondContact OD1-O 2.99Å; N284-D317 WeakPolarHBondContact CA-OD2 3.43Å; N284-N374 WeakPolarHBondContact ND2-CB 3.16Å; N284-N374 PolarHBondContact ND2-OD1 2.65Å; N284-E376 HydrophobicContact CB-CB 4.2Å; N284-E376 HydrophobicContact CB-CG 4.37Å; N284-E376 PolarHBondContact N-OE2 2.91Å; N284-E376 PolarHBondContact ND2-O 3.25Å; N284-L378 WeakPolarHBondContact ND2-CA 3.19Å; N284-L378 PolarHBondContact ND2-N 2.88Å; N284-L378 WeakPolarHBondContact OD1-CA 3.21Å; N284-L378 WeakPolarHBondContact OD1-CD1 3.49Å; N284-T379 PolarHBondContact O-N 2.95Å; N284-T379 VanDerWaalsContact O-O 3.06Å; N284-T379 PolarHBondContact O-OG1 2.87Å
285	S	92.4	Very high	94.4	Very high	23 Å²	23	50.4 Å²	50.4	16%	0.161	24%	0.239	C	C	.	.			trans	-115.9	-13.5	170.4	71.1	0	0	0	0	113.4	E189 T283 D317 L378	E189-S285 WeakPolarHBondContact OE1-CB 3.08Å; T283-S285 PolarHBondContact O-N 2.83Å; T283-S285 VanDerWaalsContact O-N 3.07Å; S285-D317 PolarHBondContact N-OD2 2.87Å; S285-D317 PolarHBondContact OG-OD1 2.84Å; S285-D317 VanDerWaalsContact OG-OD1 3.11Å; S285-L378 WeakPolarHBondContact O-CD1 3.26Å
286	H	92.6	Very high	94.6	Very high	40 Å²	40	54.7 Å²	54.7	19%	0.185	25%	0.248	C	C	.	.	S	Bend	trans	-120.9	164.7	177.4	-67.7	93	0	0	0	113.2	D251 N284 D315 K316 D317	D251-H286 IonicContact OD2-CE1 3.6Å; D251-H286 IonicContact OD2-NE2 3.97Å; N284-H286 PolarHBondContact OD1-O 2.99Å; H286-D315 WeakPolarHBondContact CB-OD1 3.02Å; H286-K316 HydrophobicContact CB-CB 4.18Å; H286-K316 WeakPolarHBondContact CD2-CD 3.26Å; H286-K316 VanDerWaalsContact NE2-CD 3.31Å; H286-K316 WeakPolarHBondContact NE2-CD 3.5Å; H286-K316 PolarHBondContact NE2-NZ 2.83Å; H286-D317 WeakPolarHBondContact CB-OD1 3Å; H286-D317 IonicContact CE1-OD1 3.33Å; H286-D317 IonicContact CG-OD1 3.26Å; H286-D317 PolarHBondContact N-OD1 2.81Å; H286-D317 PolarHBondContact N-OD2 2.75Å; H286-D317 IonicContact ND1-OD1 3.58Å; H286-D317 PolarHBondContact ND1-OD1 2.98Å
287	R	92.9	Very high	94.6	Very high	28 Å²	28	55 Å²	55	11%	0.106	25%	0.251	C	S	.	.			trans	-109.9	143.3	174.6	-72.3	-146.2	-169.8	-72.3	2.7	111	L378 P394 P395	R287-L378 HydrophobicContact CG-CD2 3.81Å; R287-P394 VanDerWaalsContact CZ-O 3.31Å; R287-P394 PolarHBondContact NE-O 3.21Å; R287-P394 PolarHBondContact NH2-O 2.79Å; R287-P395 WeakPolarHBondContact CD-O 3.23Å; R287-P395 PolarHBondContact NE-O 2.76Å
288	P	96.4	Very high	94.6	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	26%	0.258	C	S	.	.			trans	-74.2	133.1	177.9	26	-25.3	0	0	0	107.8	V313 E314 D315 V372 N374	P288-V313 HydrophobicContact CB-CB 4.18Å; P288-V313 HydrophobicContact CB-CG2 4.03Å; P288-E314 WeakPolarHBondContact CA-O 3.45Å; P288-D315 WeakPolarHBondContact CA-OD2 3.36Å; P288-D315 HydrophobicContact CB-CB 4.2Å; P288-D315 WeakPolarHBondContact CB-OD2 3.27Å; P288-D315 WeakPolarHBondContact CD-OD2 3.39Å; P288-V372 HydrophobicContact CB-CG1 4.29Å; P288-V372 HydrophobicContact CB-CG2 4.21Å; P288-V372 HydrophobicContact CG-CB 4.44Å; P288-V372 HydrophobicContact CG-CG1 4.02Å; P288-V372 HydrophobicContact CG-CG2 3.79Å; P288-V372 WeakPolarHBondContact O-CG1 3.05Å; P288-N374 WeakPolarHBondContact CD-ND2 3.31Å; P288-N374 VanDerWaalsContact CD-OD1 3.29Å; P288-N374 WeakPolarHBondContact CD-OD1 3.21Å
289	K	95.6	Very high	94.4	Very high	114 Å²	114	56.8 Å²	56.8	50%	0.496	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136.1	-175.6	-70.5	162.3	-168.7	167.5	0	110.1	K291 V313 E314 D397	K289-K291 PolarHBondContact O-N 3.39Å; K289-V313 CarbonylContact O-C 3.56Å; K289-V313 WeakPolarHBondContact O-CA 3.39Å; K289-V313 WeakPolarHBondContact O-CB 3.37Å; K289-E314 PolarHBondContact N-O 2.78Å; K289-E314 PolarHBondContact O-N 2.85Å; K289-D397 VanDerWaalsContact CA-OD2 3.26Å; K289-D397 WeakPolarHBondContact CA-OD2 3.38Å
290	F	96.8	Very high	94.1	Very high	8 Å²	8	57.5 Å²	57.5	4%	0.035	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	131.3	179.3	-69.1	-82.2	0	0	0	111.2	K292 Y295 V311 V313 Y328 I370 V372 D397 V399	F290-K292 VanDerWaalsContact CB-O 3.31Å; F290-K292 WeakPolarHBondContact CB-O 3.36Å; F290-K292 PolarHBondContact O-N 2.85Å; F290-Y295 HydrophobicContact CB-CE2 4.46Å; F290-Y295 HydrophobicContact CD1-CE2 4.23Å; F290-V311 HydrophobicContact CD1-CB 4.36Å; F290-V311 HydrophobicContact CE1-CB 4.23Å; F290-V311 HydrophobicContact CE1-CG2 4.08Å; F290-V313 HydrophobicContact CD1-CG1 3.81Å; F290-V313 HydrophobicContact CE1-CG1 4.05Å; F290-V313 HydrophobicContact CG-CG1 4.24Å; F290-Y328 HydrophobicContact CE1-CD1 4.18Å; F290-Y328 AromaticContact CE1-CE1 3.77Å; F290-Y328 HydrophobicContact CE1-CE1 3.77Å; F290-Y328 HydrophobicContact CZ-CD1 4.23Å; F290-Y328 HydrophobicContact CZ-CE1 4.16Å; F290-I370 HydrophobicContact CE1-CD1 3.6Å; F290-I370 HydrophobicContact CE1-CG1 4.3Å; F290-I370 HydrophobicContact CZ-CD1 3.66Å; F290-I370 HydrophobicContact CZ-CG1 3.93Å; F290-V372 HydrophobicContact CD2-CG1 4.07Å; F290-V372 HydrophobicContact CE2-CB 3.99Å; F290-V372 HydrophobicContact CE2-CG1 3.48Å; F290-V372 VanDerWaalsContact CE2-CG1 3.48Å; F290-V372 HydrophobicContact CZ-CB 3.77Å; F290-V372 HydrophobicContact CZ-CG1 3.75Å; F290-D397 HydrophobicContact CD2-CB 4.29Å; F290-D397 PolarHBondContact N-OD2 3.35Å; F290-V399 HydrophobicContact CB-CB 4.47Å; F290-V399 HydrophobicContact CD1-CB 4.44Å; F290-V399 HydrophobicContact CD1-CG1 3.69Å; F290-V399 HydrophobicContact CD2-CB 3.88Å; F290-V399 HydrophobicContact CD2-CG1 3.82Å; F290-V399 HydrophobicContact CE1-CG1 3.67Å; F290-V399 HydrophobicContact CE2-CB 4.18Å; F290-V399 HydrophobicContact CE2-CG1 3.8Å; F290-V399 HydrophobicContact CG-CB 4.02Å; F290-V399 HydrophobicContact CG-CG1 3.76Å; F290-V399 HydrophobicContact CZ-CG1 3.73Å
291	K	95.6	Very high	93.8	Very high	119 Å²	119	57.7 Å²	57.7	52%	0.517	27%	0.266	S	S	.	.	S	Bend	trans	-63.3	-22.8	177.7	-68.7	-170.8	-173.6	-178.3	0	113	K289 A312 V313 E314	K289-K291 PolarHBondContact O-N 3.39Å; K291-A312 HydrophobicContact CD-CB 3.8Å; K291-A312 HydrophobicContact CG-CB 4.29Å; K291-A312 PolarHBondContact N-O 2.96Å; K291-V313 VanDerWaalsContact CE-O 3.26Å; K291-V313 WeakPolarHBondContact CE-O 3.18Å; K291-E314 HydrophobicContact CD-CG 4.05Å; K291-E314 WeakPolarHBondContact CD-OE1 3.26Å; K291-E314 WeakPolarHBondContact CE-OE1 3.35Å; K291-E314 HydrophobicContact CG-CG 3.73Å; K291-E314 IonicContact NZ-OE1 3.92Å
292	K	94.6	Very high	93.4	Very high	131 Å²	131	59.6 Å²	59.6	57%	0.57	28%	0.275	S	S	*	.	S	Bend	trans	-128.1	153.2	174.7	-54.3	-179.6	-175.5	173.3	0	110.1	F290 Y295	F290-K292 VanDerWaalsContact CB-O 3.31Å; F290-K292 WeakPolarHBondContact CB-O 3.36Å; F290-K292 PolarHBondContact O-N 2.85Å; K292-Y295 HydrophobicContact CB-CE1 4.01Å; K292-Y295 HydrophobicContact CB-CE2 3.95Å; K292-Y295 HydrophobicContact CD-CD1 4.12Å; K292-Y295 HydrophobicContact CD-CE1 3.82Å; K292-Y295 HydrophobicContact CG-CE1 4.13Å; K292-Y295 PolarHBondContact N-OH 2.85Å; K292-Y295 WeakPolarHBondContact O-CE2 3.14Å
293	R	92.2	Very high	93.1	Very high	149 Å²	149	63.1 Å²	63.1	56%	0.562	29%	0.29	S	S	*	.	S	Bend	trans	-95.6	-5.7	-179.4	-69.6	-74.5	152.7	-159.2	-10.7	114.5	D397 V399	R293-D397 IonicContact CZ-OD1 2.7Å; R293-D397 IonicContact CZ-OD2 3.57Å; R293-D397 IonicContact NH1-OD1 3.69Å; R293-D397 PolarHBondContact NH1-OD1 2.89Å; R293-D397 IonicContact NH1-OD2 2.84Å; R293-D397 PolarHBondContact NH1-OD2 3.11Å; R293-D397 IonicContact NH2-OD1 3.44Å; R293-D397 PolarHBondContact NH2-OD1 2.9Å; R293-D397 IonicContact NH2-OD2 3.19Å; R293-D397 PolarHBondContact NH2-OD2 2.68Å; R293-V399 VanDerWaalsContact O-CG2 3.3Å; R293-V399 WeakPolarHBondContact O-CG2 3.4Å
294	Q	91.1	Very high	93	Very high	149 Å²	149	67.3 Å²	67.3	70%	0.696	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.2	149.2	171	-67.8	-178.4	-26.2	0	0	107.7
295	Y	95.3	Very high	92.9	Very high	12 Å²	12	70.5 Å²	70.5	5%	0.047	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	150.8	170	-61.6	-100.9	0	0	0	109.7	F290 K292 L309 V311 A312 V399 S400 I401 T402	F290-Y295 HydrophobicContact CB-CE2 4.46Å; F290-Y295 HydrophobicContact CD1-CE2 4.23Å; K292-Y295 HydrophobicContact CB-CE1 4.01Å; K292-Y295 HydrophobicContact CB-CE2 3.95Å; K292-Y295 HydrophobicContact CD-CD1 4.12Å; K292-Y295 HydrophobicContact CD-CE1 3.82Å; K292-Y295 HydrophobicContact CG-CE1 4.13Å; K292-Y295 PolarHBondContact N-OH 2.85Å; K292-Y295 WeakPolarHBondContact O-CE2 3.14Å; Y295-L309 HydrophobicContact CD1-CD1 4.22Å; Y295-L309 HydrophobicContact CG-CD2 4.37Å; Y295-V311 HydrophobicContact CD1-CG1 3.8Å; Y295-V311 HydrophobicContact CD2-CG1 3.87Å; Y295-V311 HydrophobicContact CE1-CB 4.16Å; Y295-V311 HydrophobicContact CE1-CG1 3.84Å; Y295-V311 HydrophobicContact CE2-CB 4.25Å; Y295-V311 HydrophobicContact CE2-CG1 3.94Å; Y295-V311 HydrophobicContact CG-CG1 3.81Å; Y295-A312 PolarHBondContact OH-O 2.85Å; Y295-V399 HydrophobicContact CD2-CG1 4.13Å; Y295-V399 HydrophobicContact CD2-CG2 3.88Å; Y295-V399 HydrophobicContact CE2-CG1 4.04Å; Y295-V399 HydrophobicContact CE2-CG2 3.95Å; Y295-S400 PolarHBondContact N-O 3.09Å; Y295-I401 WeakPolarHBondContact O-CA 3.19Å; Y295-T402 PolarHBondContact O-N 2.8Å
296	E	95.7	Very high	92.8	Very high	156 Å²	156	78.9 Å²	78.9	73%	0.729	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.9	142.5	176.6	-64.8	179.2	166.7	0	0	108.2	T402	E296-T402 WeakPolarHBondContact CA-O 3.35Å
297	A	95	Very high	92.8	Very high	9 Å²	9	80.4 Å²	80.4	7%	0.074	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	150.4	178	0	0	0	0	0	109.5	I308 L309 T402 V403 K404	A297-I308 HydrophobicContact CB-CD1 4.35Å; A297-L309 HydrophobicContact CB-CB 3.95Å; A297-L309 HydrophobicContact CB-CD2 4.21Å; A297-T402 PolarHBondContact N-O 3.23Å; A297-V403 HydrophobicContact CB-CG2 4.44Å; A297-V403 WeakPolarHBondContact O-CA 3.34Å; A297-K404 PolarHBondContact O-N 3.37Å
298	E	94.1	Very high	93	Very high	123 Å²	123	80.5 Å²	80.5	58%	0.575	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.4	137.2	167.8	-57	-164.3	132.6	0	0	108.4	K404 V406	E298-K404 WeakPolarHBondContact CA-O 3.16Å; E298-K404 HydrophobicContact CG-CB 4.4Å; E298-K404 HydrophobicContact CG-CD 4.43Å; E298-K404 WeakPolarHBondContact OE1-CD 3.41Å; E298-K404 IonicContact OE1-NZ 2.65Å; E298-K404 PolarHBondContact OE1-NZ 2.82Å; E298-V406 HydrophobicContact CB-CG2 4.35Å
299	A	92.8	Very high	93	Very high	5 Å²	5	81.8 Å²	81.8	4%	0.041	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	140.8	174	0	0	0	0	0	108.2	I308 V354 V403 K404 M405 V406	A299-I308 HydrophobicContact CB-CD1 4.16Å; A299-I308 HydrophobicContact CB-CG2 4.28Å; A299-V354 HydrophobicContact CB-CG2 4.09Å; A299-V403 HydrophobicContact CB-CG1 4.05Å; A299-K404 PolarHBondContact N-O 2.92Å; A299-M405 HydrophobicContact CB-CE 4.27Å; A299-M405 HydrophobicContact CB-SD 3.84Å; A299-M405 CarbonylContact O-C 3.57Å; A299-M405 WeakPolarHBondContact O-CA 3.33Å; A299-V406 PolarHBondContact O-N 3.41Å
300	V	90	Very high	93	Very high	45 Å²	45	80.7 Å²	80.7	27%	0.273	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	137.5	173	-170	0	0	0	0	108.3	Q303 T408	V300-Q303 VanDerWaalsContact CG1-NE2 3.33Å; V300-T408 VanDerWaalsContact CG1-OG1 3.25Å; V300-T408 WeakPolarHBondContact CG1-OG1 3.4Å
301	E	88.2	Confident	93	Very high	9 Å²	9	80.3 Å²	80.3	4%	0.042	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	169.3	176.1	75.7	172.8	138.5	0	0	113.2	Q303 N359 F360 V406 D407 T408	E301-Q303 WeakPolarHBondContact O-CG 3.32Å; E301-Q303 PolarHBondContact O-N 3.21Å; E301-N359 VanDerWaalsContact OE2-CA 3.3Å; E301-N359 WeakPolarHBondContact OE2-CA 3.42Å; E301-F360 HydrophobicContact CB-CD2 4.19Å; E301-F360 PolarHBondContact OE2-N 3.23Å; E301-V406 PolarHBondContact N-O 2.95Å; E301-V406 VanDerWaalsContact N-O 3.11Å; E301-D407 WeakPolarHBondContact OE1-CA 3.36Å; E301-D407 WeakPolarHBondContact OE1-CB 3.44Å; E301-T408 PolarHBondContact OE1-N 2.71Å
302	M	86.3	Confident	93	Very high	109 Å²	109	75.4 Å²	75.4	54%	0.537	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	4.6	177.9	-69.1	-65.2	-90.3	0	0	116.8	A357 K358 N359	M302-A357 WeakPolarHBondContact O-CB 3.33Å; M302-A357 HydrophobicContact SD-CB 4.46Å; M302-K358 PolarHBondContact N-O 2.89Å; M302-K358 VanDerWaalsContact N-O 3.16Å; M302-N359 HydrophobicContact CG-CB 4.47Å; M302-N359 WeakPolarHBondContact CG-OD1 3.47Å; M302-N359 HydrophobicContact SD-CB 4.18Å; M302-N359 PolarHBondContact SD-OD1 3.22Å; M302-N359 VanDerWaalsContact SD-OD1 3.36Å
303	Q	88.7	Confident	93.1	Very high	93 Å²	93	69.9 Å²	69.9	44%	0.435	33%	0.333	S	S	.	.			trans	-119.7	140.5	-177.8	-65.1	174.9	42.8	0	0	110.5	V300 E301 H305	V300-Q303 VanDerWaalsContact CG1-NE2 3.33Å; E301-Q303 WeakPolarHBondContact O-CG 3.32Å; E301-Q303 PolarHBondContact O-N 3.21Å; Q303-H305 PolarHBondContact OE1-CE1 2.85Å
304	T	92	Very high	93.3	Very high	91 Å²	91	68.6 Å²	68.6	56%	0.558	33%	0.333	S	S	*	.			trans	-96.5	130.9	174.3	54	0	0	0	0	110.6	V354 V355	T304-V354 CarbonylContact C-O 3.51Å; T304-V354 WeakPolarHBondContact CA-O 3.32Å; T304-V354 WeakPolarHBondContact CB-O 3.48Å; T304-V355 WeakPolarHBondContact CG2-O 3.42Å
305	H	91.9	Very high	93.5	Very high	68 Å²	68	62.6 Å²	62.6	32%	0.315	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	117.4	-173.2	-79.3	95.2	0	0	0	109.3	Q303 D307 I308 G353 V354	Q303-H305 PolarHBondContact OE1-CE1 2.85Å; H305-D307 VanDerWaalsContact C-N 3.32Å; H305-D307 PolarHBondContact O-N 2.66Å; H305-I308 HydrophobicContact CB-CG2 3.45Å; H305-I308 VanDerWaalsContact CB-CG2 3.45Å; H305-G353 CarbonylContact O-C 3.56Å; H305-G353 WeakPolarHBondContact O-CA 3.26Å; H305-V354 PolarHBondContact N-O 2.6Å; H305-V354 PolarHBondContact O-N 3.09Å
306	K	90.6	Very high	93.5	Very high	198 Å²	198	68.2 Å²	68.2	86%	0.861	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	-23	-174.4	-66.6	-174.8	178.8	-178.9	0	114.5	I351	K306-I351 VanDerWaalsContact O-CG2 3.27Å; K306-I351 WeakPolarHBondContact O-CG2 3.24Å
307	D	94.3	Very high	93.4	Very high	72 Å²	72	60.9 Å²	60.9	39%	0.385	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	96.6	-176	-166.6	-17.1	0	0	0	107.2	H305 R310 I351	H305-D307 VanDerWaalsContact C-N 3.32Å; H305-D307 PolarHBondContact O-N 2.66Å; D307-R310 IonicContact OD1-NE 2.63Å; D307-R310 IonicContact OD2-CZ 2.67Å; D307-R310 VanDerWaalsContact OD2-CZ 3.26Å; D307-R310 IonicContact OD2-NE 2.64Å; D307-R310 PolarHBondContact OD2-NE 3.44Å; D307-R310 IonicContact OD2-NH2 2.71Å; D307-R310 PolarHBondContact OD2-NH2 2.88Å; D307-I351 HydrophobicContact CB-CG2 3.75Å
308	I	95.6	Very high	93.4	Very high	31 Å²	31	62.7 Å²	62.7	16%	0.159	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	-19.4	172.2	63.2	162.2	0	0	0	111.9	A297 A299 H305 Y339 V352 V354 V403	A297-I308 HydrophobicContact CB-CD1 4.35Å; A299-I308 HydrophobicContact CB-CD1 4.16Å; A299-I308 HydrophobicContact CB-CG2 4.28Å; H305-I308 HydrophobicContact CB-CG2 3.45Å; H305-I308 VanDerWaalsContact CB-CG2 3.45Å; I308-Y339 HydrophobicContact CD1-CE1 4.49Å; I308-V352 HydrophobicContact CD1-CG1 4.2Å; I308-V352 HydrophobicContact CG1-CB 4.33Å; I308-V352 HydrophobicContact CG1-CG1 4.12Å; I308-V352 WeakPolarHBondContact CG1-O 3.34Å; I308-V352 PolarHBondContact N-O 2.03Å; I308-V354 HydrophobicContact CD1-CG2 4.21Å; I308-V354 HydrophobicContact CG2-CG2 4.44Å; I308-V403 HydrophobicContact CD1-CG1 4Å; I308-V403 HydrophobicContact CD1-CG2 4.29Å
309	L	96.3	Very high	93.4	Very high	26 Å²	26	60.5 Å²	60.5	14%	0.136	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	135.9	-177.6	173.7	66.7	0	0	0	110.6	Y295 A297 V311 V352 I401	Y295-L309 HydrophobicContact CD1-CD1 4.22Å; Y295-L309 HydrophobicContact CG-CD2 4.37Å; A297-L309 HydrophobicContact CB-CB 3.95Å; A297-L309 HydrophobicContact CB-CD2 4.21Å; L309-V311 HydrophobicContact CD2-CG1 3.9Å; L309-V311 HydrophobicContact CG-CG1 4.06Å; L309-V352 HydrophobicContact CB-CB 4.32Å; L309-V352 PolarHBondContact O-N 2.92Å; L309-I401 HydrophobicContact CD2-CD1 3.97Å; L309-I401 HydrophobicContact CD2-CG1 4.36Å; L309-I401 HydrophobicContact CD2-CG2 3.48Å; L309-I401 VanDerWaalsContact CD2-CG2 3.48Å
310	R	96.4	Very high	93.3	Very high	92 Å²	92	64.9 Å²	64.9	35%	0.347	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	124.3	168.9	-67.6	178.9	170.2	-108.7	-11.2	111.3	D307 D344 E349 G350 I351	D307-R310 IonicContact OD1-NE 2.63Å; D307-R310 IonicContact OD2-CZ 2.67Å; D307-R310 VanDerWaalsContact OD2-CZ 3.26Å; D307-R310 IonicContact OD2-NE 2.64Å; D307-R310 PolarHBondContact OD2-NE 3.44Å; D307-R310 IonicContact OD2-NH2 2.71Å; D307-R310 PolarHBondContact OD2-NH2 2.88Å; R310-D344 IonicContact CZ-OD2 3.03Å; R310-D344 IonicContact NH1-OD2 2.63Å; R310-D344 PolarHBondContact NH1-OD2 2.84Å; R310-D344 IonicContact NH2-OD2 3.17Å; R310-E349 IonicContact NH1-OE2 2.73Å; R310-E349 PolarHBondContact NH1-OE2 3.4Å; R310-G350 CarbonylContact C-O 3.55Å; R310-G350 WeakPolarHBondContact CA-O 3.44Å; R310-I351 HydrophobicContact CG-CG1 4.49Å
311	V	96.8	Very high	93.5	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	100.3	176.6	-65.2	0	0	0	0	110.6	F290 Y295 L309 Y328 I341 G350 I370 I401	F290-V311 HydrophobicContact CD1-CB 4.36Å; F290-V311 HydrophobicContact CE1-CB 4.23Å; F290-V311 HydrophobicContact CE1-CG2 4.08Å; Y295-V311 HydrophobicContact CD1-CG1 3.8Å; Y295-V311 HydrophobicContact CD2-CG1 3.87Å; Y295-V311 HydrophobicContact CE1-CB 4.16Å; Y295-V311 HydrophobicContact CE1-CG1 3.84Å; Y295-V311 HydrophobicContact CE2-CB 4.25Å; Y295-V311 HydrophobicContact CE2-CG1 3.94Å; Y295-V311 HydrophobicContact CG-CG1 3.81Å; L309-V311 HydrophobicContact CD2-CG1 3.9Å; L309-V311 HydrophobicContact CG-CG1 4.06Å; V311-Y328 HydrophobicContact CG2-CD1 4.36Å; V311-Y328 HydrophobicContact CG2-CE1 4.05Å; V311-Y328 PolarHBondContact O-OH 3.2Å; V311-I341 HydrophobicContact CG2-CD1 4.02Å; V311-G350 WeakPolarHBondContact CG2-O 3.41Å; V311-G350 PolarHBondContact N-O 2.72Å; V311-G350 PolarHBondContact O-N 3.07Å; V311-I370 HydrophobicContact CB-CD1 4.49Å; V311-I370 HydrophobicContact CG1-CD1 4.46Å; V311-I370 HydrophobicContact CG2-CD1 3.75Å; V311-I401 HydrophobicContact CG1-CD1 3.95Å
312	A	95.8	Very high	93.8	Very high	16 Å²	16	68.9 Å²	68.9	13%	0.132	35%	0.348	C	S	.	.			trans	-78.6	140.8	178.4	0	0	0	0	0	112.8	K291 Y295 E349	K291-A312 HydrophobicContact CD-CB 3.8Å; K291-A312 HydrophobicContact CG-CB 4.29Å; K291-A312 PolarHBondContact N-O 2.96Å; Y295-A312 PolarHBondContact OH-O 2.85Å; A312-E349 HydrophobicContact CB-CG 3.98Å
313	V	97	Very high	94.1	Very high	15 Å²	15	63.7 Å²	63.7	9%	0.091	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	166.6	172.9	-63.3	0	0	0	0	111.8	P288 K289 F290 K291 A326 Y328 V372	P288-V313 HydrophobicContact CB-CB 4.18Å; P288-V313 HydrophobicContact CB-CG2 4.03Å; K289-V313 CarbonylContact O-C 3.56Å; K289-V313 WeakPolarHBondContact O-CA 3.39Å; K289-V313 WeakPolarHBondContact O-CB 3.37Å; F290-V313 HydrophobicContact CD1-CG1 3.81Å; F290-V313 HydrophobicContact CE1-CG1 4.05Å; F290-V313 HydrophobicContact CG-CG1 4.24Å; K291-V313 VanDerWaalsContact CE-O 3.26Å; K291-V313 WeakPolarHBondContact CE-O 3.18Å; V313-A326 HydrophobicContact CG2-CB 3.93Å; V313-Y328 HydrophobicContact CG1-CE1 3.89Å; V313-Y328 WeakPolarHBondContact CG1-OH 3.17Å; V313-Y328 VanDerWaalsContact CG2-OH 3.3Å; V313-Y328 WeakPolarHBondContact CG2-OH 3.32Å; V313-V372 HydrophobicContact CG1-CG1 4.18Å; V313-V372 HydrophobicContact CG1-CG2 4.31Å
314	E	95.4	Very high	94.4	Very high	121 Å²	121	61.4 Å²	61.4	57%	0.565	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.3	127.1	168.1	-69.5	175.5	178.4	0	0	108.8	P288 K289 K291	P288-E314 WeakPolarHBondContact CA-O 3.45Å; K289-E314 PolarHBondContact N-O 2.78Å; K289-E314 PolarHBondContact O-N 2.85Å; K291-E314 HydrophobicContact CD-CG 4.05Å; K291-E314 WeakPolarHBondContact CD-OE1 3.26Å; K291-E314 WeakPolarHBondContact CE-OE1 3.35Å; K291-E314 HydrophobicContact CG-CG 3.73Å; K291-E314 IonicContact NZ-OE1 3.92Å
315	D	95.6	Very high	94.6	Very high	23 Å²	23	60.8 Å²	60.8	12%	0.123	30%	0.297	C	S	.	.			trans	-126.5	153.7	165.8	-146.7	-35	0	0	0	108.9	H286 P288 N374	H286-D315 WeakPolarHBondContact CB-OD1 3.02Å; P288-D315 WeakPolarHBondContact CA-OD2 3.36Å; P288-D315 HydrophobicContact CB-CB 4.2Å; P288-D315 WeakPolarHBondContact CB-OD2 3.27Å; P288-D315 WeakPolarHBondContact CD-OD2 3.39Å; D315-N374 PolarHBondContact OD2-ND2 3.38Å
316	K	94.4	Very high	94.8	Very high	130 Å²	130	57.7 Å²	57.7	57%	0.565	28%	0.283	S	S	*	.			trans	-94.4	-28.1	-176.1	-77.6	170.5	125.3	-141.1	0	113.1	D251 H286	D251-K316 IonicContact OD2-NZ 2.66Å; D251-K316 PolarHBondContact OD2-NZ 2.92Å; H286-K316 HydrophobicContact CB-CB 4.18Å; H286-K316 WeakPolarHBondContact CD2-CD 3.26Å; H286-K316 VanDerWaalsContact NE2-CD 3.31Å; H286-K316 WeakPolarHBondContact NE2-CD 3.5Å; H286-K316 PolarHBondContact NE2-NZ 2.83Å
317	D	95.2	Very high	95.1	Very high	3 Å²	3	52.9 Å²	52.9	2%	0.016	26%	0.262	C	S	.	.	S	Bend	trans	-63.4	159.4	-176.2	-60.2	-12.4	0	0	0	110.4	N284 S285 H286 P319	N284-D317 WeakPolarHBondContact CA-OD2 3.43Å; S285-D317 PolarHBondContact N-OD2 2.87Å; S285-D317 PolarHBondContact OG-OD1 2.84Å; S285-D317 VanDerWaalsContact OG-OD1 3.11Å; H286-D317 WeakPolarHBondContact CB-OD1 3Å; H286-D317 IonicContact CE1-OD1 3.33Å; H286-D317 IonicContact CG-OD1 3.26Å; H286-D317 PolarHBondContact N-OD1 2.81Å; H286-D317 PolarHBondContact N-OD2 2.75Å; H286-D317 IonicContact ND1-OD1 3.58Å; H286-D317 PolarHBondContact ND1-OD1 2.98Å; D317-P319 WeakPolarHBondContact O-CD 3.47Å
318	T	94.4	Very high	95.3	Very high	47 Å²	47	50.4 Å²	50.4	29%	0.288	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-58.4	122.4	-165.1	-72.2	0	0	0	0	112.1	D282 T321 W324	D282-T318 WeakPolarHBondContact OD2-CA 3.17Å; D282-T318 WeakPolarHBondContact OD2-CB 3.47Å; D282-T318 PolarHBondContact OD2-N 3.46Å; D282-T318 PolarHBondContact OD2-OG1 2.76Å; T318-T321 HydrophobicContact CG2-CG2 4.06Å; T318-T321 WeakPolarHBondContact O-CB 3.4Å; T318-T321 VanDerWaalsContact O-CG2 3.22Å; T318-T321 WeakPolarHBondContact O-CG2 3.31Å; T318-T321 PolarHBondContact O-N 3.33Å; T318-T321 PolarHBondContact O-OG1 2.83Å; T318-W324 VanDerWaalsContact O-CB 3.29Å; T318-W324 WeakPolarHBondContact O-CB 3.38Å
319	P	93.9	Very high	95.3	Very high	77 Å²	77	51.2 Å²	51.2	50%	0.5	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	143.8	-174.2	-31.1	36.6	0	0	0	115.3	D317 T321 W324	D317-P319 WeakPolarHBondContact O-CD 3.47Å; P319-T321 VanDerWaalsContact C-N 3.27Å; P319-T321 PolarHBondContact O-N 2.82Å; P319-W324 HydrophobicContact CB-CD2 4.21Å; P319-W324 HydrophobicContact CB-CZ2 4.21Å
320	N	91.4	Very high	95.3	Very high	97 Å²	97	52.4 Å²	52.4	52%	0.519	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	-3.9	-177.1	-47.7	-84.7	0	0	0	116.8	R325	N320-R325 PolarHBondContact O-NE 2.98Å; N320-R325 PolarHBondContact O-NH2 2.87Å
321	T	93.5	Very high	95.2	Very high	47 Å²	47	52.4 Å²	52.4	29%	0.288	27%	0.268	S	S	.	.	S	Bend	trans	-71.8	163.4	169.9	63.4	0	0	0	0	112.1	T318 P319 G323 W324 R325	T318-T321 HydrophobicContact CG2-CG2 4.06Å; T318-T321 WeakPolarHBondContact O-CB 3.4Å; T318-T321 VanDerWaalsContact O-CG2 3.22Å; T318-T321 WeakPolarHBondContact O-CG2 3.31Å; T318-T321 PolarHBondContact O-N 3.33Å; T318-T321 PolarHBondContact O-OG1 2.83Å; P319-T321 VanDerWaalsContact C-N 3.27Å; P319-T321 PolarHBondContact O-N 2.82Å; T321-G323 PolarHBondContact O-N 3.49Å; T321-W324 PolarHBondContact O-N 2.78Å; T321-W324 PolarHBondContact OG1-N 3.19Å; T321-R325 WeakPolarHBondContact O-CB 3.49Å; T321-R325 WeakPolarHBondContact O-CG 3.5Å; T321-R325 PolarHBondContact O-N 2.79Å
322	D	94.2	Very high	95.1	Very high	91 Å²	91	54.6 Å²	54.6	49%	0.487	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-21	173	-67.7	-29.9	0	0	0	113	R325 V375 E376	D322-R325 VanDerWaalsContact OD1-CD 3.32Å; D322-R325 WeakPolarHBondContact OD1-CD 3.39Å; D322-R325 IonicContact OD1-NE 2.83Å; D322-V375 HydrophobicContact CB-CB 4.13Å; D322-V375 HydrophobicContact CB-CG1 4.18Å; D322-V375 PolarHBondContact O-N 2.93Å; D322-E376 HydrophobicContact CB-CB 4.19Å; D322-E376 PolarHBondContact O-N 2.89Å
323	G	93	Very high	95	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-45.7	165.4	0	0	0	0	0	111.9	T321 N374	T321-G323 PolarHBondContact O-N 3.49Å; G323-N374 VanDerWaalsContact O-CB 3.31Å; G323-N374 WeakPolarHBondContact O-CB 3.39Å; G323-N374 VanDerWaalsContact O-CG 3.27Å; G323-N374 PolarHBondContact O-ND2 3.05Å
324	W	95.4	Very high	94.9	Very high	44 Å²	44	55.5 Å²	55.5	17%	0.167	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-25.4	179	179.6	87.7	0	0	0	115	T318 P319 T321 A326 N348	T318-W324 VanDerWaalsContact O-CB 3.29Å; T318-W324 WeakPolarHBondContact O-CB 3.38Å; P319-W324 HydrophobicContact CB-CD2 4.21Å; P319-W324 HydrophobicContact CB-CZ2 4.21Å; T321-W324 PolarHBondContact O-N 2.78Å; T321-W324 PolarHBondContact OG1-N 3.19Å; W324-A326 PolarHBondContact O-N 3.43Å; W324-N348 HydrophobicContact CE3-CB 4.36Å; W324-N348 HydrophobicContact CH2-CB 3.49Å; W324-N348 VanDerWaalsContact CH2-CB 3.49Å; W324-N348 HydrophobicContact CZ2-CB 4.06Å; W324-N348 HydrophobicContact CZ3-CB 3.65Å; W324-N348 PolarHBondContact O-ND2 2.96Å
325	R	95.9	Very high	94.8	Very high	79 Å²	79	56.7 Å²	56.7	30%	0.298	30%	0.295	S	S	.	.			trans	-65.1	117.6	-177.3	-81.5	166.2	-171.2	-76.9	-6.9	111.4	N320 T321 D322 N374 V375	N320-R325 PolarHBondContact O-NE 2.98Å; N320-R325 PolarHBondContact O-NH2 2.87Å; T321-R325 WeakPolarHBondContact O-CB 3.49Å; T321-R325 WeakPolarHBondContact O-CG 3.5Å; T321-R325 PolarHBondContact O-N 2.79Å; D322-R325 VanDerWaalsContact OD1-CD 3.32Å; D322-R325 WeakPolarHBondContact OD1-CD 3.39Å; D322-R325 IonicContact OD1-NE 2.83Å; R325-N374 CarbonylContact O-C 3.59Å; R325-N374 WeakPolarHBondContact O-CA 3.37Å; R325-V375 HydrophobicContact CB-CB 4.41Å; R325-V375 HydrophobicContact CB-CG2 3.81Å; R325-V375 PolarHBondContact O-N 3.47Å
326	A	96.9	Very high	94.5	Very high	2 Å²	2	59.6 Å²	59.6	2%	0.017	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	142.8	177	0	0	0	0	0	111.3	V313 W324 Y328 T343 N348 V372 E373	V313-A326 HydrophobicContact CG2-CB 3.93Å; W324-A326 PolarHBondContact O-N 3.43Å; A326-Y328 HydrophobicContact CB-CE2 3.73Å; A326-T343 WeakPolarHBondContact O-CB 3.35Å; A326-T343 VanDerWaalsContact O-CG2 3.23Å; A326-T343 WeakPolarHBondContact O-CG2 3.43Å; A326-T343 PolarHBondContact O-OG1 2.82Å; A326-N348 WeakPolarHBondContact CB-OD1 3.32Å; A326-N348 PolarHBondContact N-OD1 2.96Å; A326-V372 HydrophobicContact CB-CG2 3.93Å; A326-E373 CarbonylContact C-O 3.6Å; A326-E373 WeakPolarHBondContact CA-O 3.46Å
327	K	96.6	Very high	94.4	Very high	98 Å²	98	60.3 Å²	60.3	43%	0.426	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	109.1	177.5	177.1	-174.3	169.2	-152	0	107.3	E373 V375	K327-E373 HydrophobicContact CB-CG 4.13Å; K327-E373 HydrophobicContact CD-CG 4.1Å; K327-E373 WeakPolarHBondContact CD-OE1 3.47Å; K327-E373 VanDerWaalsContact CE-OE1 3.3Å; K327-E373 WeakPolarHBondContact CE-OE1 3.39Å; K327-E373 HydrophobicContact CG-CG 4.29Å; K327-E373 PolarHBondContact N-O 3.02Å; K327-E373 IonicContact NZ-OE1 3.12Å; K327-E373 PolarHBondContact NZ-OE1 2.73Å; K327-E373 PolarHBondContact O-N 2.91Å; K327-V375 HydrophobicContact CB-CG2 4.44Å
328	Y	96.9	Very high	94.3	Very high	20 Å²	20	60.4 Å²	60.4	8%	0.078	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	155.9	-176.5	-62.1	-86.8	0	0	0	112.1	F290 V311 V313 A326 I341 T343 N348 G350 V372	F290-Y328 HydrophobicContact CE1-CD1 4.18Å; F290-Y328 AromaticContact CE1-CE1 3.77Å; F290-Y328 HydrophobicContact CE1-CE1 3.77Å; F290-Y328 HydrophobicContact CZ-CD1 4.23Å; F290-Y328 HydrophobicContact CZ-CE1 4.16Å; V311-Y328 HydrophobicContact CG2-CD1 4.36Å; V311-Y328 HydrophobicContact CG2-CE1 4.05Å; V311-Y328 PolarHBondContact O-OH 3.2Å; V313-Y328 HydrophobicContact CG1-CE1 3.89Å; V313-Y328 WeakPolarHBondContact CG1-OH 3.17Å; V313-Y328 VanDerWaalsContact CG2-OH 3.3Å; V313-Y328 WeakPolarHBondContact CG2-OH 3.32Å; A326-Y328 HydrophobicContact CB-CE2 3.73Å; Y328-I341 HydrophobicContact CD1-CD1 3.98Å; Y328-I341 HydrophobicContact CG-CD1 3.91Å; Y328-I341 HydrophobicContact CG-CG1 4.18Å; Y328-T343 WeakPolarHBondContact CD2-OG1 3.23Å; Y328-T343 HydrophobicContact CE2-CG2 4.16Å; Y328-N348 PolarHBondContact OH-O 2.7Å; Y328-G350 PolarHBondContact OH-N 3.2Å; Y328-V372 HydrophobicContact CD1-CB 3.94Å; Y328-V372 HydrophobicContact CD1-CG2 3.76Å; Y328-V372 HydrophobicContact CE1-CB 3.99Å; Y328-V372 HydrophobicContact CE1-CG2 3.61Å; Y328-V372 HydrophobicContact CG-CG2 4.33Å
329	S	95.7	Very high	94.4	Very high	48 Å²	48	58.7 Å²	58.7	34%	0.336	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	147.9	176.9	55.9	0	0	0	0	110	I370 G371	S329-I370 CarbonylContact O-C 3.56Å; S329-I370 VanDerWaalsContact O-CA 3.24Å; S329-I370 WeakPolarHBondContact O-CA 3.42Å; S329-I370 WeakPolarHBondContact O-CB 3.23Å; S329-G371 PolarHBondContact N-O 3.49Å; S329-G371 PolarHBondContact O-N 3.42Å; S329-G371 PolarHBondContact OG-O 3.25Å
330	I	96.3	Very high	94.5	Very high	50 Å²	50	56.5 Å²	56.5	26%	0.256	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	127.9	169	-53.1	174.5	0	0	0	107.2	N334 I341 I370	I330-N334 HydrophobicContact CD1-CB 4.34Å; I330-N334 WeakPolarHBondContact CD1-ND2 3.27Å; I330-N334 HydrophobicContact CG2-CB 3.79Å; I330-I341 HydrophobicContact CD1-CG2 4.39Å; I330-I341 HydrophobicContact CG1-CB 4.45Å; I330-I341 HydrophobicContact CG1-CG2 3.81Å; I330-I370 HydrophobicContact CG1-CG2 4.16Å
331	I	95.6	Very high	94.8	Very high	93 Å²	93	53 Å²	53	48%	0.477	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-39.9	-176.8	-61.9	174.2	0	0	0	110.5	Q369	I331-Q369 HydrophobicContact CB-CB 4.27Å; I331-Q369 HydrophobicContact CB-CG 4.26Å; I331-Q369 HydrophobicContact CD1-CG 4.28Å; I331-Q369 PolarHBondContact N-O 3.32Å
332	S	95.1	Very high	94.9	Very high	46 Å²	46	54.8 Å²	54.8	32%	0.322	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	164.3	-178.8	58.7	0	0	0	0	112	Q369	S332-Q369 PolarHBondContact N-O 2.74Å; S332-Q369 PolarHBondContact O-N 3.17Å; S332-Q369 WeakPolarHBondContact OG-CB 3.46Å
333	G	92.2	Very high	95	Very high	18 Å²	18	52.7 Å²	52.7	19%	0.186	28%	0.276	C	S	.	.	S	Bend	trans	89.8	9.3	179	0	0	0	0	0	114.9	E335 L368	G333-E335 WeakPolarHBondContact CA-OE1 3.49Å; G333-E335 VanDerWaalsContact CA-OE2 3.26Å; G333-E335 WeakPolarHBondContact CA-OE2 3.46Å; G333-E335 PolarHBondContact N-OE1 2.95Å; G333-L368 WeakPolarHBondContact O-CD2 3.44Å
334	N	94.8	Very high	95.1	Very high	31 Å²	31	53.7 Å²	53.7	17%	0.166	28%	0.282	C	S	.	.			trans	-130.6	39.2	-177.9	-171.3	38	0	0	0	111.8	I330 D336 E337 V338 Y339 L368	I330-N334 HydrophobicContact CD1-CB 4.34Å; I330-N334 WeakPolarHBondContact CD1-ND2 3.27Å; I330-N334 HydrophobicContact CG2-CB 3.79Å; N334-D336 PolarHBondContact O-N 3.22Å; N334-E337 PolarHBondContact O-N 2.82Å; N334-V338 PolarHBondContact OD1-N 2.9Å; N334-Y339 PolarHBondContact ND2-O 2.74Å; N334-Y339 WeakPolarHBondContact OD1-CD2 3.39Å; N334-Y339 PolarHBondContact OD1-N 2.89Å; N334-L368 HydrophobicContact CB-CD2 4.29Å
335	E	93	Very high	94.9	Very high	147 Å²	147	56 Å²	56	69%	0.687	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-23.4	-174	-65	66.9	-145.6	0	0	112.6	G333	G333-E335 WeakPolarHBondContact CA-OE1 3.49Å; G333-E335 VanDerWaalsContact CA-OE2 3.26Å; G333-E335 WeakPolarHBondContact CA-OE2 3.46Å; G333-E335 PolarHBondContact N-OE1 2.95Å
336	D	90.4	Very high	94.6	Very high	83 Å²	83	57.9 Å²	57.9	44%	0.444	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	0.3	176.5	-72.8	-40.6	0	0	0	114.3	N334 V338 K356 K358	N334-D336 PolarHBondContact O-N 3.22Å; D336-V338 VanDerWaalsContact C-N 3.27Å; D336-V338 HydrophobicContact CB-CG2 3.79Å; D336-V338 PolarHBondContact O-N 3.35Å; D336-K356 PolarHBondContact O-NZ 2.97Å; D336-K358 IonicContact OD2-NZ 2.73Å; D336-K358 PolarHBondContact OD2-NZ 2.82Å
337	E	92.9	Very high	94.5	Very high	146 Å²	146	61 Å²	61	68%	0.682	34%	0.341	S	S	*	.			trans	54.8	37.2	-172.7	-56.5	-175.1	157.3	0	0	114	N334	N334-E337 PolarHBondContact O-N 2.82Å
338	V	93.3	Very high	94.4	Very high	5 Å²	5	56.8 Å²	56.8	3%	0.03	32%	0.323	C	S	.	.			trans	-72.6	-37.6	177.5	168.8	0	0	0	0	111.7	N334 D336 V354 V355 K356 K358 M405	N334-V338 PolarHBondContact OD1-N 2.9Å; D336-V338 VanDerWaalsContact C-N 3.27Å; D336-V338 HydrophobicContact CB-CG2 3.79Å; D336-V338 PolarHBondContact O-N 3.35Å; V338-V354 HydrophobicContact CG1-CG1 4.13Å; V338-V355 WeakPolarHBondContact O-CG2 3Å; V338-V355 PolarHBondContact O-N 3.44Å; V338-K356 PolarHBondContact O-N 3.38Å; V338-K358 HydrophobicContact CG2-CB 4.09Å; V338-K358 HydrophobicContact CG2-CD 3.85Å; V338-M405 HydrophobicContact CG1-CE 4.05Å
339	Y	95.4	Very high	94.4	Very high	10 Å²	10	58.1 Å²	58.1	4%	0.039	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	151.3	-173.5	-55.1	-85.1	0	0	0	112.2	I308 N334 G353 V354 V366 L368 V403 M405	I308-Y339 HydrophobicContact CD1-CE1 4.49Å; N334-Y339 PolarHBondContact ND2-O 2.74Å; N334-Y339 WeakPolarHBondContact OD1-CD2 3.39Å; N334-Y339 PolarHBondContact OD1-N 2.89Å; Y339-G353 CarbonylContact C-O 3.45Å; Y339-G353 VanDerWaalsContact CA-O 3.32Å; Y339-G353 WeakPolarHBondContact CA-O 3.43Å; Y339-V354 HydrophobicContact CD1-CG2 4.1Å; Y339-V354 HydrophobicContact CE1-CG2 3.96Å; Y339-V366 HydrophobicContact CE2-CG1 3.89Å; Y339-L368 HydrophobicContact CD1-CD1 4.05Å; Y339-L368 HydrophobicContact CD2-CD1 4.11Å; Y339-L368 HydrophobicContact CD2-CD2 3.68Å; Y339-L368 HydrophobicContact CD2-CG 4.48Å; Y339-L368 HydrophobicContact CE1-CD1 4.45Å; Y339-L368 HydrophobicContact CE2-CD2 3.94Å; Y339-L368 HydrophobicContact CG-CD1 3.85Å; Y339-L368 HydrophobicContact CG-CD2 4.26Å; Y339-V403 HydrophobicContact CE1-CB 4.26Å; Y339-V403 HydrophobicContact CE1-CG1 4.01Å; Y339-V403 HydrophobicContact CE1-CG2 4.09Å; Y339-M405 HydrophobicContact CE1-CE 3.81Å; Y339-M405 VanDerWaalsContact OH-CE 3.26Å; Y339-M405 WeakPolarHBondContact OH-CE 3.49Å
340	A	96.1	Very high	94.4	Very high	32 Å²	32	55.9 Å²	55.9	26%	0.264	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	157.8	164.3	0	0	0	0	0	110.4	V352 G353 V355	A340-V352 WeakPolarHBondContact O-CA 3.35Å; A340-G353 PolarHBondContact N-O 2.91Å; A340-G353 PolarHBondContact O-N 3.02Å; A340-V355 HydrophobicContact CB-CB 4.49Å; A340-V355 HydrophobicContact CB-CG1 3.52Å; A340-V355 HydrophobicContact CB-CG2 4.13Å
341	I	97	Very high	94.5	Very high	24 Å²	24	54.6 Å²	54.6	12%	0.123	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	134.3	170.2	-167.5	166.1	0	0	0	109.2	V311 Y328 I330 I351 V352 I370	V311-I341 HydrophobicContact CG2-CD1 4.02Å; Y328-I341 HydrophobicContact CD1-CD1 3.98Å; Y328-I341 HydrophobicContact CG-CD1 3.91Å; Y328-I341 HydrophobicContact CG-CG1 4.18Å; I330-I341 HydrophobicContact CD1-CG2 4.39Å; I330-I341 HydrophobicContact CG1-CB 4.45Å; I330-I341 HydrophobicContact CG1-CG2 3.81Å; I341-I351 WeakPolarHBondContact CA-O 3.35Å; I341-V352 HydrophobicContact CD1-CG2 3.84Å; I341-V352 HydrophobicContact CG1-CG2 4.08Å; I341-I370 HydrophobicContact CD1-CB 4.49Å; I341-I370 HydrophobicContact CD1-CD1 3.59Å; I341-I370 HydrophobicContact CD1-CG2 4.31Å
342	T	95.5	Very high	94.5	Very high	83 Å²	83	50.3 Å²	50.3	51%	0.509	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	152.5	179.6	57.7	0	0	0	0	110.3	G350 I351	T342-G350 CarbonylContact O-C 3.58Å; T342-G350 WeakPolarHBondContact O-CA 3.28Å; T342-I351 PolarHBondContact N-O 2.88Å; T342-I351 PolarHBondContact O-N 2.8Å
343	T	96.3	Very high	94.5	Very high	47 Å²	47	48.3 Å²	48.3	29%	0.288	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	128.8	175.4	-51	0	0	0	0	110.2	A326 Y328 P345	A326-T343 WeakPolarHBondContact O-CB 3.35Å; A326-T343 VanDerWaalsContact O-CG2 3.23Å; A326-T343 WeakPolarHBondContact O-CG2 3.43Å; A326-T343 PolarHBondContact O-OG1 2.82Å; Y328-T343 WeakPolarHBondContact CD2-OG1 3.23Å; Y328-T343 HydrophobicContact CE2-CG2 4.16Å; T343-P345 WeakPolarHBondContact O-CD 3.31Å
344	D	95.5	Very high	94.7	Very high	22 Å²	22	47.7 Å²	47.7	12%	0.118	27%	0.265	C	S	.	.			trans	-65.7	117.5	165.7	-171.2	-56.4	0	0	0	109.3	R310 V346 T347 N348 E349 I351	R310-D344 IonicContact CZ-OD2 3.03Å; R310-D344 IonicContact NH1-OD2 2.63Å; R310-D344 PolarHBondContact NH1-OD2 2.84Å; R310-D344 IonicContact NH2-OD2 3.17Å; D344-V346 PolarHBondContact O-N 3.32Å; D344-V346 VanDerWaalsContact O-N 3.11Å; D344-V346 WeakPolarHBondContact OD1-CA 3.45Å; D344-V346 PolarHBondContact OD1-N 3.03Å; D344-T347 VanDerWaalsContact CB-OG1 3.27Å; D344-T347 WeakPolarHBondContact CB-OG1 3.32Å; D344-T347 PolarHBondContact OD1-N 3.49Å; D344-N348 WeakPolarHBondContact O-CA 3.48Å; D344-N348 PolarHBondContact O-N 2.97Å; D344-E349 PolarHBondContact N-O 2.78Å; D344-I351 HydrophobicContact CB-CD1 3.96Å; D344-I351 HydrophobicContact CB-CG1 4.2Å
345	P	91.4	Very high	94.6	Very high	93 Å²	93	50.3 Å²	50.3	60%	0.604	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-5.6	-172.8	30.6	-36.3	0	0	0	113.9	T343	T343-P345 WeakPolarHBondContact O-CD 3.31Å
346	V	90.3	Very high	94.6	Very high	117 Å²	117	48.2 Å²	48.2	71%	0.709	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.3	-44.9	179.2	-175.8	0	0	0	0	111.4	D344	D344-V346 PolarHBondContact O-N 3.32Å; D344-V346 VanDerWaalsContact O-N 3.11Å; D344-V346 WeakPolarHBondContact OD1-CA 3.45Å; D344-V346 PolarHBondContact OD1-N 3.03Å
347	T	93.4	Very high	94.5	Very high	68 Å²	68	46.4 Å²	46.4	42%	0.417	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-12.9	-177.7	69.9	0	0	0	0	114.3	D344 E349	D344-T347 VanDerWaalsContact CB-OG1 3.27Å; D344-T347 WeakPolarHBondContact CB-OG1 3.32Å; D344-T347 PolarHBondContact OD1-N 3.49Å; T347-E349 WeakPolarHBondContact CB-OE2 3.4Å; T347-E349 PolarHBondContact O-N 2.89Å; T347-E349 WeakPolarHBondContact OG1-CB 3.43Å; T347-E349 VanDerWaalsContact OG1-CG 3.23Å; T347-E349 WeakPolarHBondContact OG1-CG 3.3Å; T347-E349 PolarHBondContact OG1-N 3.32Å; T347-E349 PolarHBondContact OG1-OE2 2.97Å
348	N	95.3	Very high	94.1	Very high	9 Å²	9	43 Å²	43	5%	0.048	25%	0.25	C	S	.	.			trans	63.1	13.8	-174.2	-150.5	30.9	0	0	0	114.1	W324 A326 Y328 D344	W324-N348 HydrophobicContact CE3-CB 4.36Å; W324-N348 HydrophobicContact CH2-CB 3.49Å; W324-N348 VanDerWaalsContact CH2-CB 3.49Å; W324-N348 HydrophobicContact CZ2-CB 4.06Å; W324-N348 HydrophobicContact CZ3-CB 3.65Å; W324-N348 PolarHBondContact O-ND2 2.96Å; A326-N348 WeakPolarHBondContact CB-OD1 3.32Å; A326-N348 PolarHBondContact N-OD1 2.96Å; Y328-N348 PolarHBondContact OH-O 2.7Å; D344-N348 WeakPolarHBondContact O-CA 3.48Å; D344-N348 PolarHBondContact O-N 2.97Å
349	E	96.4	Very high	93.7	Very high	49 Å²	49	44.9 Å²	44.9	23%	0.229	26%	0.261	C	S	.	.			trans	-82.1	148.4	177.6	-60.9	173.7	128.3	0	0	111.3	R310 A312 D344 T347 I351	R310-E349 IonicContact NH1-OE2 2.73Å; R310-E349 PolarHBondContact NH1-OE2 3.4Å; A312-E349 HydrophobicContact CB-CG 3.98Å; D344-E349 PolarHBondContact N-O 2.78Å; T347-E349 WeakPolarHBondContact CB-OE2 3.4Å; T347-E349 PolarHBondContact O-N 2.89Å; T347-E349 WeakPolarHBondContact OG1-CB 3.43Å; T347-E349 VanDerWaalsContact OG1-CG 3.23Å; T347-E349 WeakPolarHBondContact OG1-CG 3.3Å; T347-E349 PolarHBondContact OG1-N 3.32Å; T347-E349 PolarHBondContact OG1-OE2 2.97Å; E349-I351 PolarHBondContact O-N 3.37Å
350	G	96.6	Very high	93	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	116.4	169.9	0	0	0	0	0	110	R310 V311 Y328 T342	R310-G350 CarbonylContact C-O 3.55Å; R310-G350 WeakPolarHBondContact CA-O 3.44Å; V311-G350 WeakPolarHBondContact CG2-O 3.41Å; V311-G350 PolarHBondContact N-O 2.72Å; V311-G350 PolarHBondContact O-N 3.07Å; Y328-G350 PolarHBondContact OH-N 3.2Å; T342-G350 CarbonylContact O-C 3.58Å; T342-G350 WeakPolarHBondContact O-CA 3.28Å
351	I	97.3	Very high	91.9	Very high	24 Å²	24	49.2 Å²	49.2	12%	0.123	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	114.2	171.5	-54.8	172.6	0	0	0	107.6	K306 D307 R310 I341 T342 D344 E349	K306-I351 VanDerWaalsContact O-CG2 3.27Å; K306-I351 WeakPolarHBondContact O-CG2 3.24Å; D307-I351 HydrophobicContact CB-CG2 3.75Å; R310-I351 HydrophobicContact CG-CG1 4.49Å; I341-I351 WeakPolarHBondContact CA-O 3.35Å; T342-I351 PolarHBondContact N-O 2.88Å; T342-I351 PolarHBondContact O-N 2.8Å; D344-I351 HydrophobicContact CB-CD1 3.96Å; D344-I351 HydrophobicContact CB-CG1 4.2Å; E349-I351 PolarHBondContact O-N 3.37Å
352	V	96.8	Very high	91	Very high	2 Å²	2	54 Å²	54	1%	0.012	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	135	171.3	-176.5	0	0	0	0	109	I308 L309 A340 I341 L368 I401	I308-V352 HydrophobicContact CD1-CG1 4.2Å; I308-V352 HydrophobicContact CG1-CB 4.33Å; I308-V352 HydrophobicContact CG1-CG1 4.12Å; I308-V352 WeakPolarHBondContact CG1-O 3.34Å; I308-V352 PolarHBondContact N-O 2.03Å; L309-V352 HydrophobicContact CB-CB 4.32Å; L309-V352 PolarHBondContact O-N 2.92Å; A340-V352 WeakPolarHBondContact O-CA 3.35Å; I341-V352 HydrophobicContact CD1-CG2 3.84Å; I341-V352 HydrophobicContact CG1-CG2 4.08Å; V352-L368 HydrophobicContact CG1-CD1 4.48Å; V352-I401 HydrophobicContact CG2-CD1 3.91Å
353	G	95.1	Very high	90.3	Very high	5 Å²	5	52.9 Å²	52.9	5%	0.052	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	157.3	176.6	0	0	0	0	0	113.2	H305 Y339 A340	H305-G353 CarbonylContact O-C 3.56Å; H305-G353 WeakPolarHBondContact O-CA 3.26Å; Y339-G353 CarbonylContact C-O 3.45Å; Y339-G353 VanDerWaalsContact CA-O 3.32Å; Y339-G353 WeakPolarHBondContact CA-O 3.43Å; A340-G353 PolarHBondContact N-O 2.91Å; A340-G353 PolarHBondContact O-N 3.02Å
354	V	95.6	Very high	89.9	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.024	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	112.1	169.3	-178.9	0	0	0	0	107.8	A299 T304 H305 I308 V338 Y339 M405	A299-V354 HydrophobicContact CB-CG2 4.09Å; T304-V354 CarbonylContact C-O 3.51Å; T304-V354 WeakPolarHBondContact CA-O 3.32Å; T304-V354 WeakPolarHBondContact CB-O 3.48Å; H305-V354 PolarHBondContact N-O 2.6Å; H305-V354 PolarHBondContact O-N 3.09Å; I308-V354 HydrophobicContact CD1-CG2 4.21Å; I308-V354 HydrophobicContact CG2-CG2 4.44Å; V338-V354 HydrophobicContact CG1-CG1 4.13Å; Y339-V354 HydrophobicContact CD1-CG2 4.1Å; Y339-V354 HydrophobicContact CE1-CG2 3.96Å; V354-M405 HydrophobicContact CG1-CE 4.23Å; V354-M405 HydrophobicContact CG2-CE 3.77Å
355	V	93.9	Very high	89.7	Confident	86 Å²	86	57 Å²	57	52%	0.521	32%	0.318	S	S	.	.			trans	-97.8	-20.9	-176.8	-69.7	0	0	0	0	113.4	T304 V338 A340	T304-V355 WeakPolarHBondContact CG2-O 3.42Å; V338-V355 WeakPolarHBondContact O-CG2 3Å; V338-V355 PolarHBondContact O-N 3.44Å; A340-V355 HydrophobicContact CB-CB 4.49Å; A340-V355 HydrophobicContact CB-CG1 3.52Å; A340-V355 HydrophobicContact CB-CG2 4.13Å
356	K	91.6	Very high	89.7	Confident	103 Å²	103	53.8 Å²	53.8	45%	0.448	30%	0.296	S	S	.	.	S	Bend	trans	-132	119.4	-178	167.7	-176.9	174.9	-174.3	0	108.5	D336 V338	D336-K356 PolarHBondContact O-NZ 2.97Å; V338-K356 PolarHBondContact O-N 3.38Å
357	A	87.9	Confident	89.9	Confident	46 Å²	46	55.3 Å²	55.3	38%	0.38	29%	0.294	S	S	.	.			trans	-59.7	139.9	173.7	0	0	0	0	0	110.4	M302	M302-A357 WeakPolarHBondContact O-CB 3.33Å; M302-A357 HydrophobicContact SD-CB 4.46Å
358	K	86.3	Confident	90	Very high	73 Å²	73	52.2 Å²	52.2	32%	0.317	28%	0.275	S	S	.	.			trans	-147.3	142.1	176.5	176.1	171.9	178.1	-178.7	0	108.6	M302 D336 V338 F360	M302-K358 PolarHBondContact N-O 2.89Å; M302-K358 VanDerWaalsContact N-O 3.16Å; D336-K358 IonicContact OD2-NZ 2.73Å; D336-K358 PolarHBondContact OD2-NZ 2.82Å; V338-K358 HydrophobicContact CG2-CB 4.09Å; V338-K358 HydrophobicContact CG2-CD 3.85Å; K358-F360 HydrophobicContact CB-CE2 3.9Å; K358-F360 HydrophobicContact CB-CZ 4.47Å; K358-F360 HydrophobicContact CD-CE1 4.31Å; K358-F360 HydrophobicContact CD-CE2 3.98Å; K358-F360 HydrophobicContact CD-CZ 3.72Å; K358-F360 HydrophobicContact CG-CD2 4.26Å; K358-F360 HydrophobicContact CG-CE2 3.75Å; K358-F360 HydrophobicContact CG-CZ 4.02Å
359	N	83.7	Confident	90	Very high	46 Å²	46	55 Å²	55	25%	0.246	29%	0.288	C	S	.	.			trans	-82.7	147.7	172.5	-130.2	73	0	0	0	110.8	E301 M302 D410	E301-N359 VanDerWaalsContact OE2-CA 3.3Å; E301-N359 WeakPolarHBondContact OE2-CA 3.42Å; M302-N359 HydrophobicContact CG-CB 4.47Å; M302-N359 WeakPolarHBondContact CG-OD1 3.47Å; M302-N359 HydrophobicContact SD-CB 4.18Å; M302-N359 PolarHBondContact SD-OD1 3.22Å; M302-N359 VanDerWaalsContact SD-OD1 3.36Å; N359-D410 PolarHBondContact ND2-OD2 3.06Å
360	F	81.1	Confident	90	Very high	19 Å²	19	52.8 Å²	52.8	8%	0.083	28%	0.277	C	S	.	.			trans	-144.5	88.1	178.8	-69.6	-89.5	0	0	0	109	E301 K358 I362 T364 V366 M405 D407	E301-F360 HydrophobicContact CB-CD2 4.19Å; E301-F360 PolarHBondContact OE2-N 3.23Å; K358-F360 HydrophobicContact CB-CE2 3.9Å; K358-F360 HydrophobicContact CB-CZ 4.47Å; K358-F360 HydrophobicContact CD-CE1 4.31Å; K358-F360 HydrophobicContact CD-CE2 3.98Å; K358-F360 HydrophobicContact CD-CZ 3.72Å; K358-F360 HydrophobicContact CG-CD2 4.26Å; K358-F360 HydrophobicContact CG-CE2 3.75Å; K358-F360 HydrophobicContact CG-CZ 4.02Å; F360-I362 CarbonylContact O-C 3.58Å; F360-I362 WeakPolarHBondContact O-CA 3.44Å; F360-I362 PolarHBondContact O-N 3.35Å; F360-T364 HydrophobicContact CD1-CG2 4Å; F360-T364 HydrophobicContact CE1-CG2 4.14Å; F360-V366 HydrophobicContact CE1-CG2 4.2Å; F360-V366 HydrophobicContact CZ-CG2 4.36Å; F360-M405 HydrophobicContact CD2-CB 4Å; F360-M405 HydrophobicContact CD2-CG 3.99Å; F360-M405 HydrophobicContact CD2-SD 4.38Å; F360-M405 HydrophobicContact CE1-CG 4.44Å; F360-M405 HydrophobicContact CE2-CB 4.13Å; F360-M405 HydrophobicContact CE2-CE 4.07Å; F360-M405 HydrophobicContact CE2-CG 3.62Å; F360-M405 HydrophobicContact CE2-SD 4Å; F360-M405 HydrophobicContact CG-CB 4.19Å; F360-M405 HydrophobicContact CZ-CB 4.44Å; F360-M405 HydrophobicContact CZ-CG 3.86Å; F360-D407 WeakPolarHBondContact O-CB 3.43Å
361	D	72.5	Confident	90	Very high	113 Å²	113	53 Å²	53	60%	0.604	28%	0.279	S	S	*	.	S	Bend	trans	-51	-7.5	-179.1	-13.5	-34.4	0	0	0	115.2
362	I	78.7	Confident	90	Very high	125 Å²	125	51.8 Å²	51.8	64%	0.641	27%	0.273	S	S	*	.	S	Bend	trans	-146.4	148	158.1	52.1	172.4	0	0	0	110.5	F360 T364	F360-I362 CarbonylContact O-C 3.58Å; F360-I362 WeakPolarHBondContact O-CA 3.44Å; F360-I362 PolarHBondContact O-N 3.35Å; I362-T364 WeakPolarHBondContact O-CB 3.29Å; I362-T364 PolarHBondContact O-N 2.03Å; I362-T364 PolarHBondContact O-OG1 3.21Å
363	T	80.9	Confident	89.9	Confident	59 Å²	59	53.6 Å²	53.6	36%	0.362	28%	0.281	S	S	.	.			trans	-45.6	111.3	170.5	-75.3	0	0	0	0	111.4	K404 M405 D407	T363-K404 HydrophobicContact CG2-CD 4.4Å; T363-K404 HydrophobicContact CG2-CG 4.01Å; T363-M405 CarbonylContact C-O 3.57Å; T363-M405 VanDerWaalsContact CA-O 3.26Å; T363-M405 WeakPolarHBondContact CA-O 3.05Å; T363-M405 WeakPolarHBondContact CG2-O 3.39Å; T363-D407 WeakPolarHBondContact CA-OD2 3.5Å; T363-D407 VanDerWaalsContact CB-OD2 3.25Å; T363-D407 WeakPolarHBondContact CB-OD2 3.07Å; T363-D407 PolarHBondContact N-OD2 3.41Å; T363-D407 PolarHBondContact OG1-N 3.18Å; T363-D407 VanDerWaalsContact OG1-N 3.12Å; T363-D407 PolarHBondContact OG1-OD2 2.56Å
364	T	87.2	Confident	89.9	Confident	45 Å²	45	53.7 Å²	53.7	28%	0.276	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	134.6	-165.1	-73.7	0	0	0	0	112.3	F360 I362 V366 M405	F360-T364 HydrophobicContact CD1-CG2 4Å; F360-T364 HydrophobicContact CE1-CG2 4.14Å; I362-T364 WeakPolarHBondContact O-CB 3.29Å; I362-T364 PolarHBondContact O-N 2.03Å; I362-T364 PolarHBondContact O-OG1 3.21Å; T364-V366 HydrophobicContact CG2-CG2 4.14Å; T364-V366 PolarHBondContact O-N 2.96Å; T364-M405 PolarHBondContact N-O 3.11Å; T364-M405 PolarHBondContact O-N 2.62Å
365	L	90.9	Very high	89.9	Confident	111 Å²	111	57.2 Å²	57.2	58%	0.581	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	93	176.5	-64.8	176.4	0	0	0	111.2	T402 K404	L365-T402 HydrophobicContact CB-CG2 4.3Å; L365-T402 HydrophobicContact CD2-CG2 4.06Å; L365-K404 HydrophobicContact CD2-CB 3.73Å; L365-K404 HydrophobicContact CD2-CG 3.96Å
366	V	91.7	Very high	89.8	Confident	25 Å²	25	55.2 Å²	55.2	15%	0.152	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	135.7	173.8	-175.6	0	0	0	0	109.9	Y339 F360 T364 L368 T402 V403 M405	Y339-V366 HydrophobicContact CE2-CG1 3.89Å; F360-V366 HydrophobicContact CE1-CG2 4.2Å; F360-V366 HydrophobicContact CZ-CG2 4.36Å; T364-V366 HydrophobicContact CG2-CG2 4.14Å; T364-V366 PolarHBondContact O-N 2.96Å; V366-L368 HydrophobicContact CG1-CD2 3.95Å; V366-T402 CarbonylContact O-C 3.51Å; V366-T402 WeakPolarHBondContact O-CA 3.44Å; V366-V403 PolarHBondContact N-O 2.68Å; V366-V403 PolarHBondContact O-N 2.98Å; V366-M405 HydrophobicContact CG2-CG 4.47Å
367	K	94.8	Very high	89.8	Confident	150 Å²	150	55.1 Å²	55.1	65%	0.652	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	103.4	179.2	-68.5	179	-177.9	174.6	0	110	I401	K367-I401 WeakPolarHBondContact CA-O 3.24Å
368	L	95.6	Very high	90	Very high	3 Å²	3	53.4 Å²	53.4	2%	0.016	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	136.8	173.9	-51.6	179.5	0	0	0	109.1	G333 N334 Y339 V352 V366 S400 I401 V403	G333-L368 WeakPolarHBondContact O-CD2 3.44Å; N334-L368 HydrophobicContact CB-CD2 4.29Å; Y339-L368 HydrophobicContact CD1-CD1 4.05Å; Y339-L368 HydrophobicContact CD2-CD1 4.11Å; Y339-L368 HydrophobicContact CD2-CD2 3.68Å; Y339-L368 HydrophobicContact CD2-CG 4.48Å; Y339-L368 HydrophobicContact CE1-CD1 4.45Å; Y339-L368 HydrophobicContact CE2-CD2 3.94Å; Y339-L368 HydrophobicContact CG-CD1 3.85Å; Y339-L368 HydrophobicContact CG-CD2 4.26Å; V352-L368 HydrophobicContact CG1-CD1 4.48Å; V366-L368 HydrophobicContact CG1-CD2 3.95Å; L368-S400 CarbonylContact O-C 3.55Å; L368-S400 WeakPolarHBondContact O-CA 3.48Å; L368-I401 HydrophobicContact CB-CB 4.32Å; L368-I401 PolarHBondContact N-O 3.03Å; L368-I401 PolarHBondContact O-N 2.69Å; L368-V403 HydrophobicContact CD1-CG2 3.92Å; L368-V403 HydrophobicContact CG-CG2 4.36Å
369	Q	96.2	Very high	90.2	Very high	68 Å²	68	50.7 Å²	50.7	32%	0.318	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.2	160.4	-168.7	-179.8	-6.8	0	0	108.1	I331 S332	I331-Q369 HydrophobicContact CB-CB 4.27Å; I331-Q369 HydrophobicContact CB-CG 4.26Å; I331-Q369 HydrophobicContact CD1-CG 4.28Å; I331-Q369 PolarHBondContact N-O 3.32Å; S332-Q369 PolarHBondContact N-O 2.74Å; S332-Q369 PolarHBondContact O-N 3.17Å; S332-Q369 WeakPolarHBondContact OG-CB 3.46Å
370	I	96.8	Very high	90.4	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	150.6	175.2	66.1	160	0	0	0	110.9	F290 V311 S329 I330 I341 S398 V399 I401	F290-I370 HydrophobicContact CE1-CD1 3.6Å; F290-I370 HydrophobicContact CE1-CG1 4.3Å; F290-I370 HydrophobicContact CZ-CD1 3.66Å; F290-I370 HydrophobicContact CZ-CG1 3.93Å; V311-I370 HydrophobicContact CB-CD1 4.49Å; V311-I370 HydrophobicContact CG1-CD1 4.46Å; V311-I370 HydrophobicContact CG2-CD1 3.75Å; S329-I370 CarbonylContact O-C 3.56Å; S329-I370 VanDerWaalsContact O-CA 3.24Å; S329-I370 WeakPolarHBondContact O-CA 3.42Å; S329-I370 WeakPolarHBondContact O-CB 3.23Å; I330-I370 HydrophobicContact CG1-CG2 4.16Å; I341-I370 HydrophobicContact CD1-CB 4.49Å; I341-I370 HydrophobicContact CD1-CD1 3.59Å; I341-I370 HydrophobicContact CD1-CG2 4.31Å; I370-S398 CarbonylContact O-C 3.54Å; I370-S398 WeakPolarHBondContact O-CA 3.21Å; I370-S398 WeakPolarHBondContact O-CB 3.32Å; I370-V399 HydrophobicContact CD1-CG1 3.85Å; I370-V399 HydrophobicContact CG1-CG1 3.53Å; I370-V399 PolarHBondContact N-O 2.75Å; I370-V399 PolarHBondContact O-N 2.82Å; I370-I401 HydrophobicContact CD1-CD1 3.7Å; I370-I401 HydrophobicContact CD1-CG1 4.45Å; I370-I401 HydrophobicContact CG1-CD1 4.01Å; I370-I401 HydrophobicContact CG1-CG1 4.38Å; I370-I401 HydrophobicContact CG2-CD1 4.15Å
371	G	96	Very high	90.7	Very high	4 Å²	4	50.8 Å²	50.8	4%	0.041	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	153.4	173.2	0	0	0	0	0	111.3	S329 D397	S329-G371 PolarHBondContact N-O 3.49Å; S329-G371 PolarHBondContact O-N 3.42Å; S329-G371 PolarHBondContact OG-O 3.25Å; G371-D397 WeakPolarHBondContact CA-O 3.22Å
372	V	96.7	Very high	91.2	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138.9	173.9	68.6	0	0	0	0	111.2	P288 F290 V313 A326 Y328 D397	P288-V372 HydrophobicContact CB-CG1 4.29Å; P288-V372 HydrophobicContact CB-CG2 4.21Å; P288-V372 HydrophobicContact CG-CB 4.44Å; P288-V372 HydrophobicContact CG-CG1 4.02Å; P288-V372 HydrophobicContact CG-CG2 3.79Å; P288-V372 WeakPolarHBondContact O-CG1 3.05Å; F290-V372 HydrophobicContact CD2-CG1 4.07Å; F290-V372 HydrophobicContact CE2-CB 3.99Å; F290-V372 HydrophobicContact CE2-CG1 3.48Å; F290-V372 VanDerWaalsContact CE2-CG1 3.48Å; F290-V372 HydrophobicContact CZ-CB 3.77Å; F290-V372 HydrophobicContact CZ-CG1 3.75Å; V313-V372 HydrophobicContact CG1-CG1 4.18Å; V313-V372 HydrophobicContact CG1-CG2 4.31Å; A326-V372 HydrophobicContact CB-CG2 3.93Å; Y328-V372 HydrophobicContact CD1-CB 3.94Å; Y328-V372 HydrophobicContact CD1-CG2 3.76Å; Y328-V372 HydrophobicContact CE1-CB 3.99Å; Y328-V372 HydrophobicContact CE1-CG2 3.61Å; Y328-V372 HydrophobicContact CG-CG2 4.33Å; V372-D397 HydrophobicContact CG1-CB 4.25Å; V372-D397 PolarHBondContact N-O 2.93Å
373	E	95.4	Very high	91.3	Very high	40 Å²	40	51.9 Å²	51.9	19%	0.187	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	-175.5	168.5	60.9	-178	-169	0	0	108.7	A326 K327 K396	A326-E373 CarbonylContact C-O 3.6Å; A326-E373 WeakPolarHBondContact CA-O 3.46Å; K327-E373 HydrophobicContact CB-CG 4.13Å; K327-E373 HydrophobicContact CD-CG 4.1Å; K327-E373 WeakPolarHBondContact CD-OE1 3.47Å; K327-E373 VanDerWaalsContact CE-OE1 3.3Å; K327-E373 WeakPolarHBondContact CE-OE1 3.39Å; K327-E373 HydrophobicContact CG-CG 4.29Å; K327-E373 PolarHBondContact N-O 3.02Å; K327-E373 IonicContact NZ-OE1 3.12Å; K327-E373 PolarHBondContact NZ-OE1 2.73Å; K327-E373 PolarHBondContact O-N 2.91Å; E373-K396 HydrophobicContact CB-CD 4.27Å; E373-K396 WeakPolarHBondContact OE2-CE 3.08Å; E373-K396 IonicContact OE2-NZ 3.52Å; E373-K396 PolarHBondContact OE2-NZ 2.87Å
374	N	95.6	Very high	91	Very high	6 Å²	6	50.9 Å²	50.9	3%	0.032	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	177.5	176	-44.4	79	0	0	0	110.3	N284 P288 D315 G323 R325	N284-N374 WeakPolarHBondContact ND2-CB 3.16Å; N284-N374 PolarHBondContact ND2-OD1 2.65Å; P288-N374 WeakPolarHBondContact CD-ND2 3.31Å; P288-N374 VanDerWaalsContact CD-OD1 3.29Å; P288-N374 WeakPolarHBondContact CD-OD1 3.21Å; D315-N374 PolarHBondContact OD2-ND2 3.38Å; G323-N374 VanDerWaalsContact O-CB 3.31Å; G323-N374 WeakPolarHBondContact O-CB 3.39Å; G323-N374 VanDerWaalsContact O-CG 3.27Å; G323-N374 PolarHBondContact O-ND2 3.05Å; R325-N374 CarbonylContact O-C 3.59Å; R325-N374 WeakPolarHBondContact O-CA 3.37Å
375	V	94.2	Very high	90.9	Very high	79 Å²	79	55.8 Å²	55.8	48%	0.479	30%	0.296	S	S	.	.	S	Bend	trans	-79.7	-46.3	171.8	177.3	0	0	0	0	111.1	D322 R325 K327	D322-V375 HydrophobicContact CB-CB 4.13Å; D322-V375 HydrophobicContact CB-CG1 4.18Å; D322-V375 PolarHBondContact O-N 2.93Å; R325-V375 HydrophobicContact CB-CB 4.41Å; R325-V375 HydrophobicContact CB-CG2 3.81Å; R325-V375 PolarHBondContact O-N 3.47Å; K327-V375 HydrophobicContact CB-CG2 4.44Å
376	E	92.8	Very high	90.6	Very high	44 Å²	44	52 Å²	52	21%	0.206	28%	0.276	C	S	.	.	S	Bend	trans	-77.5	143.1	170.5	-167.7	173.4	-151.7	0	0	110.1	K188 N284 D322	K188-E376 IonicContact NZ-OE1 3.67Å; N284-E376 HydrophobicContact CB-CB 4.2Å; N284-E376 HydrophobicContact CB-CG 4.37Å; N284-E376 PolarHBondContact N-OE2 2.91Å; N284-E376 PolarHBondContact ND2-O 3.25Å; D322-E376 HydrophobicContact CB-CB 4.19Å; D322-E376 PolarHBondContact O-N 2.89Å
377	P	91.3	Very high	90.3	Very high	101 Å²	101	52.8 Å²	52.8	66%	0.656	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-71.4	137.6	176.8	28.4	-35.4	0	0	0	112.6	T379	P377-T379 PolarHBondContact O-N 2.83Å
378	L	91.5	Very high	89.7	Confident	10 Å²	10	50 Å²	50	5%	0.052	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-61.1	129.9	178.1	174.6	72	0	0	0	112.5	N284 S285 R287 V380 L393	N284-L378 WeakPolarHBondContact ND2-CA 3.19Å; N284-L378 PolarHBondContact ND2-N 2.88Å; N284-L378 WeakPolarHBondContact OD1-CA 3.21Å; N284-L378 WeakPolarHBondContact OD1-CD1 3.49Å; S285-L378 WeakPolarHBondContact O-CD1 3.26Å; R287-L378 HydrophobicContact CG-CD2 3.81Å; L378-V380 HydrophobicContact CD1-CG2 3.81Å; L378-V380 HydrophobicContact CD2-CG2 3.97Å; L378-V380 HydrophobicContact CG-CG2 3.89Å; L378-L393 HydrophobicContact CB-CD1 4.49Å; L378-L393 HydrophobicContact CD2-CB 4.33Å; L378-L393 HydrophobicContact CD2-CD1 4.41Å; L378-L393 HydrophobicContact CD2-CD2 3.94Å; L378-L393 HydrophobicContact CD2-CG 4.47Å; L378-L393 HydrophobicContact CG-CD1 4.5Å; L378-L393 HydrophobicContact CG-CD2 4.13Å; L378-L393 WeakPolarHBondContact O-CD1 3.24Å
379	T	90.1	Very high	89	Confident	16 Å²	16	54.2 Å²	54.2	10%	0.098	29%	0.291	C	S	.	.			trans	-128.3	126.2	170.6	55	0	0	0	0	110	N190 N284 P377 E388	N190-T379 HydrophobicContact CB-CG2 4.29Å; N190-T379 VanDerWaalsContact CB-OG1 3.26Å; N190-T379 WeakPolarHBondContact CB-OG1 3.35Å; N284-T379 PolarHBondContact O-N 2.95Å; N284-T379 VanDerWaalsContact O-O 3.06Å; N284-T379 PolarHBondContact O-OG1 2.87Å; P377-T379 PolarHBondContact O-N 2.83Å; T379-E388 HydrophobicContact CG2-CG 4.12Å
380	V	89.2	Confident	88	Confident	39 Å²	39	57.6 Å²	57.6	24%	0.236	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	123.3	-175.1	177.9	0	0	0	0	111	L378 K382 I387 L393	L378-V380 HydrophobicContact CD1-CG2 3.81Å; L378-V380 HydrophobicContact CD2-CG2 3.97Å; L378-V380 HydrophobicContact CG-CG2 3.89Å; V380-K382 PolarHBondContact O-N 3.16Å; V380-I387 PolarHBondContact N-O 2.68Å; V380-I387 VanDerWaalsContact N-O 3.07Å; V380-I387 WeakPolarHBondContact O-CB 3.29Å; V380-I387 PolarHBondContact O-N 3.08Å; V380-L393 HydrophobicContact CB-CD2 4.12Å; V380-L393 HydrophobicContact CG2-CD2 3.73Å
381	C	87.4	Confident	87.1	Confident	27 Å²	27	62.3 Å²	62.3	18%	0.182	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	116	169.7	-177.4	0	0	0	0	110.6	C247 F248	C247-C381 HydrophobicContact CB-CB 3.7Å; C247-C381 WeakPolarHBondContact CB-SG 3.21Å; C247-C381 PolarHBondContact O-SG 2.69Å; C247-C381 VanDerWaalsContact O-SG 3.39Å; C247-C381 WeakPolarHBondContact SG-CA 3.3Å; C247-C381 WeakPolarHBondContact SG-CB 3.47Å; C247-C381 CovalentContact SG-SG 2.03Å; C247-C381 PolarHBondContact SG-SG 2.88Å; F248-C381 VanDerWaalsContact O-CB 3.26Å; F248-C381 WeakPolarHBondContact O-CB 3.16Å; F248-C381 PolarHBondContact O-SG 3.04Å; F248-C381 VanDerWaalsContact O-SG 3.35Å
382	K	83.3	Confident	86.4	Confident	118 Å²	118	65.3 Å²	65.3	51%	0.513	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	132.8	178.1	-172	-174.7	172.4	-170.8	0	111.2	V380 G384 K385 I387	V380-K382 PolarHBondContact O-N 3.16Å; K382-G384 PolarHBondContact O-N 2.87Å; K382-G384 VanDerWaalsContact O-N 3.14Å; K382-K385 PolarHBondContact N-O 2.9Å; K382-K385 PolarHBondContact O-N 3.41Å; K382-I387 HydrophobicContact CB-CD1 3.76Å; K382-I387 HydrophobicContact CB-CG1 4.43Å; K382-I387 HydrophobicContact CD-CD1 4.04Å; K382-I387 HydrophobicContact CG-CD1 4.47Å
383	D	80.3	Confident	85.8	Confident	143 Å²	143	66.1 Å²	66.1	77%	0.765	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	37.2	178.2	-49.7	-35.5	0	0	0	112.7	K385	D383-K385 VanDerWaalsContact C-N 3.29Å; D383-K385 PolarHBondContact O-N 3.23Å
384	G	74.9	Confident	85.3	Confident	39 Å²	39	67.4 Å²	67.4	40%	0.402	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	0.9	-177.6	0	0	0	0	0	115.7	G246 C247 K382	G246-G384 CarbonylContact C-O 3.31Å; G246-G384 VanDerWaalsContact CA-O 3.26Å; G246-G384 WeakPolarHBondContact CA-O 3.16Å; C247-G384 PolarHBondContact N-O 3.17Å; K382-G384 PolarHBondContact O-N 2.87Å; K382-G384 VanDerWaalsContact O-N 3.14Å
385	K	83.4	Confident	84.9	Confident	147 Å²	147	72.7 Å²	72.7	64%	0.639	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.3	140.8	-179.1	-62.3	-179.5	-177.6	179	0	111.9	C247 K382 D383	C247-K385 PolarHBondContact SG-N 2.81Å; C247-K385 VanDerWaalsContact SG-N 3.37Å; C247-K385 PolarHBondContact SG-O 3.09Å; C247-K385 VanDerWaalsContact SG-O 3.34Å; K382-K385 PolarHBondContact N-O 2.9Å; K382-K385 PolarHBondContact O-N 3.41Å; D383-K385 VanDerWaalsContact C-N 3.29Å; D383-K385 PolarHBondContact O-N 3.23Å
386	L	85.6	Confident	84.8	Confident	31 Å²	31	74.2 Å²	74.2	16%	0.162	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	131.2	172	-161.9	69.7	0	0	0	109.6	N190 K192 C247 E388	N190-L386 HydrophobicContact CB-CD1 4.44Å; N190-L386 HydrophobicContact CB-CD2 4.23Å; N190-L386 VanDerWaalsContact O-CD2 3.28Å; N190-L386 WeakPolarHBondContact O-CD2 3.14Å; K192-L386 HydrophobicContact CG-CD2 4.27Å; C247-L386 HydrophobicContact CB-CB 4.23Å; C247-L386 HydrophobicContact CB-CD1 4.24Å; L386-E388 HydrophobicContact CD2-CG 4.47Å
387	I	85.7	Confident	84.9	Confident	42 Å²	42	73.2 Å²	73.2	22%	0.215	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	121.3	176.9	-62.2	-175.5	0	0	0	109.1	V380 K382 S392 L393	V380-I387 PolarHBondContact N-O 2.68Å; V380-I387 VanDerWaalsContact N-O 3.07Å; V380-I387 WeakPolarHBondContact O-CB 3.29Å; V380-I387 PolarHBondContact O-N 3.08Å; K382-I387 HydrophobicContact CB-CD1 3.76Å; K382-I387 HydrophobicContact CB-CG1 4.43Å; K382-I387 HydrophobicContact CD-CD1 4.04Å; K382-I387 HydrophobicContact CG-CD1 4.47Å; I387-S392 WeakPolarHBondContact CG2-OG 3.14Å; I387-L393 HydrophobicContact CB-CD2 4.49Å; I387-L393 HydrophobicContact CG2-CD2 3.92Å; I387-L393 HydrophobicContact CG2-CG 4.32Å
388	E	81.3	Confident	85.1	Confident	91 Å²	91	70.6 Å²	70.6	43%	0.425	40%	0.395	S	S	.	.			trans	-117.6	-16.1	179.1	-67.6	168.9	-136.2	0	0	112.8	K192 T379 L386 L390	K192-E388 WeakPolarHBondContact CE-OE1 3.34Å; K192-E388 IonicContact NZ-OE1 3.5Å; K192-E388 PolarHBondContact NZ-OE1 2.81Å; K192-E388 IonicContact NZ-OE2 2.86Å; K192-E388 PolarHBondContact NZ-OE2 3.4Å; T379-E388 HydrophobicContact CG2-CG 4.12Å; L386-E388 HydrophobicContact CD2-CG 4.47Å; E388-L390 PolarHBondContact O-N 2.97Å
389	D	82.5	Confident	85.3	Confident	92 Å²	92	70.4 Å²	70.4	49%	0.492	39%	0.394	S	S	.	.			trans	-76.7	118.7	-175.1	174.5	21.3	0	0	0	112.2	S391 S392 L393	D389-S391 PolarHBondContact O-N 2.9Å; D389-S391 PolarHBondContact OD1-N 2.77Å; D389-S391 WeakPolarHBondContact OD2-CB 3.16Å; D389-S391 PolarHBondContact OD2-OG 2.78Å; D389-S392 PolarHBondContact O-N 3.11Å; D389-S392 PolarHBondContact O-OG 2.88Å; D389-L393 WeakPolarHBondContact O-CG 3.42Å; D389-L393 PolarHBondContact O-N 2.88Å; D389-L393 VanDerWaalsContact O-N 3.11Å
390	L	74.5	Confident	85.6	Confident	139 Å²	139	72.8 Å²	72.8	73%	0.728	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.6	-31.4	172.8	-69.8	166.3	0	0	0	114.5	E388 S392	E388-L390 PolarHBondContact O-N 2.97Å; L390-S392 PolarHBondContact O-N 2.96Å
391	S	77.9	Confident	85.9	Confident	101 Å²	101	71 Å²	71	71%	0.706	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-22.7	178	89	0	0	0	0	113.8	D389	D389-S391 PolarHBondContact O-N 2.9Å; D389-S391 PolarHBondContact OD1-N 2.77Å; D389-S391 WeakPolarHBondContact OD2-CB 3.16Å; D389-S391 PolarHBondContact OD2-OG 2.78Å
392	S	80.4	Confident	86.3	Confident	66 Å²	66	71.5 Å²	71.5	46%	0.462	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-12.7	-171.4	67.3	0	0	0	0	114	I387 D389 L390	I387-S392 WeakPolarHBondContact CG2-OG 3.14Å; D389-S392 PolarHBondContact O-N 3.11Å; D389-S392 PolarHBondContact O-OG 2.88Å; L390-S392 PolarHBondContact O-N 2.96Å
393	L	84.1	Confident	86.8	Confident	18 Å²	18	65.9 Å²	65.9	9%	0.094	38%	0.378	C	S	.	.	S	Bend	trans	-75	156	172	-70.8	175.9	0	0	0	111.6	L378 V380 I387 D389	L378-L393 HydrophobicContact CB-CD1 4.49Å; L378-L393 HydrophobicContact CD2-CB 4.33Å; L378-L393 HydrophobicContact CD2-CD1 4.41Å; L378-L393 HydrophobicContact CD2-CD2 3.94Å; L378-L393 HydrophobicContact CD2-CG 4.47Å; L378-L393 HydrophobicContact CG-CD1 4.5Å; L378-L393 HydrophobicContact CG-CD2 4.13Å; L378-L393 WeakPolarHBondContact O-CD1 3.24Å; V380-L393 HydrophobicContact CB-CD2 4.12Å; V380-L393 HydrophobicContact CG2-CD2 3.73Å; I387-L393 HydrophobicContact CB-CD2 4.49Å; I387-L393 HydrophobicContact CG2-CD2 3.92Å; I387-L393 HydrophobicContact CG2-CG 4.32Å; D389-L393 WeakPolarHBondContact O-CG 3.42Å; D389-L393 PolarHBondContact O-N 2.88Å; D389-L393 VanDerWaalsContact O-N 3.11Å
394	P	84.5	Confident	87.5	Confident	67 Å²	67	62.3 Å²	62.3	44%	0.435	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-54.8	143.9	168.7	-24.2	33.7	0	0	0	111.8	R287	R287-P394 VanDerWaalsContact CZ-O 3.31Å; R287-P394 PolarHBondContact NE-O 3.21Å; R287-P394 PolarHBondContact NH2-O 2.79Å
395	P	88.3	Confident	88.2	Confident	116 Å²	116	60.6 Å²	60.6	75%	0.753	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-62.9	156.2	173.4	28.1	-35.1	0	0	0	111.2	R287	R287-P395 WeakPolarHBondContact CD-O 3.23Å; R287-P395 PolarHBondContact NE-O 2.76Å
396	K	91.4	Very high	88.5	Confident	111 Å²	111	55.5 Å²	55.5	48%	0.483	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-65.1	142	171.7	-57.8	-180	-170.3	-174.8	0	109.2	E373	E373-K396 HydrophobicContact CB-CD 4.27Å; E373-K396 WeakPolarHBondContact OE2-CE 3.08Å; E373-K396 IonicContact OE2-NZ 3.52Å; E373-K396 PolarHBondContact OE2-NZ 2.87Å
397	D	95.3	Very high	88.4	Confident	24 Å²	24	56.6 Å²	56.6	13%	0.128	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	145.1	175.6	-158.3	11.4	0	0	0	110	K289 F290 R293 G371 V372	K289-D397 VanDerWaalsContact CA-OD2 3.26Å; K289-D397 WeakPolarHBondContact CA-OD2 3.38Å; F290-D397 HydrophobicContact CD2-CB 4.29Å; F290-D397 PolarHBondContact N-OD2 3.35Å; R293-D397 IonicContact CZ-OD1 2.7Å; R293-D397 IonicContact CZ-OD2 3.57Å; R293-D397 IonicContact NH1-OD1 3.69Å; R293-D397 PolarHBondContact NH1-OD1 2.89Å; R293-D397 IonicContact NH1-OD2 2.84Å; R293-D397 PolarHBondContact NH1-OD2 3.11Å; R293-D397 IonicContact NH2-OD1 3.44Å; R293-D397 PolarHBondContact NH2-OD1 2.9Å; R293-D397 IonicContact NH2-OD2 3.19Å; R293-D397 PolarHBondContact NH2-OD2 2.68Å; G371-D397 WeakPolarHBondContact CA-O 3.22Å; V372-D397 HydrophobicContact CG1-CB 4.25Å; V372-D397 PolarHBondContact N-O 2.93Å
398	S	95.7	Very high	88.3	Confident	46 Å²	46	57.6 Å²	57.6	32%	0.322	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	152.2	179.6	64.5	0	0	0	0	111.8	I370	I370-S398 CarbonylContact O-C 3.54Å; I370-S398 WeakPolarHBondContact O-CA 3.21Å; I370-S398 WeakPolarHBondContact O-CB 3.32Å
399	V	96.1	Very high	88.4	Confident	5 Å²	5	55 Å²	55	3%	0.03	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	147.5	-175.9	72.2	0	0	0	0	110.9	F290 R293 Y295 I370	F290-V399 HydrophobicContact CB-CB 4.47Å; F290-V399 HydrophobicContact CD1-CB 4.44Å; F290-V399 HydrophobicContact CD1-CG1 3.69Å; F290-V399 HydrophobicContact CD2-CB 3.88Å; F290-V399 HydrophobicContact CD2-CG1 3.82Å; F290-V399 HydrophobicContact CE1-CG1 3.67Å; F290-V399 HydrophobicContact CE2-CB 4.18Å; F290-V399 HydrophobicContact CE2-CG1 3.8Å; F290-V399 HydrophobicContact CG-CB 4.02Å; F290-V399 HydrophobicContact CG-CG1 3.76Å; F290-V399 HydrophobicContact CZ-CG1 3.73Å; R293-V399 VanDerWaalsContact O-CG2 3.3Å; R293-V399 WeakPolarHBondContact O-CG2 3.4Å; Y295-V399 HydrophobicContact CD2-CG1 4.13Å; Y295-V399 HydrophobicContact CD2-CG2 3.88Å; Y295-V399 HydrophobicContact CE2-CG1 4.04Å; Y295-V399 HydrophobicContact CE2-CG2 3.95Å; I370-V399 HydrophobicContact CD1-CG1 3.85Å; I370-V399 HydrophobicContact CG1-CG1 3.53Å; I370-V399 PolarHBondContact N-O 2.75Å; I370-V399 PolarHBondContact O-N 2.82Å
400	S	95.2	Very high	88.4	Confident	66 Å²	66	53.5 Å²	53.5	46%	0.462	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	134.8	171.2	-58	0	0	0	0	110.9	Y295 L368	Y295-S400 PolarHBondContact N-O 3.09Å; L368-S400 CarbonylContact O-C 3.55Å; L368-S400 WeakPolarHBondContact O-CA 3.48Å
401	I	96.1	Very high	88.9	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	127.3	171.9	-53.2	179.2	0	0	0	107.4	Y295 L309 V311 V352 K367 L368 I370 V403	Y295-I401 WeakPolarHBondContact O-CA 3.19Å; L309-I401 HydrophobicContact CD2-CD1 3.97Å; L309-I401 HydrophobicContact CD2-CG1 4.36Å; L309-I401 HydrophobicContact CD2-CG2 3.48Å; L309-I401 VanDerWaalsContact CD2-CG2 3.48Å; V311-I401 HydrophobicContact CG1-CD1 3.95Å; V352-I401 HydrophobicContact CG2-CD1 3.91Å; K367-I401 WeakPolarHBondContact CA-O 3.24Å; L368-I401 HydrophobicContact CB-CB 4.32Å; L368-I401 PolarHBondContact N-O 3.03Å; L368-I401 PolarHBondContact O-N 2.69Å; I370-I401 HydrophobicContact CD1-CD1 3.7Å; I370-I401 HydrophobicContact CD1-CG1 4.45Å; I370-I401 HydrophobicContact CG1-CD1 4.01Å; I370-I401 HydrophobicContact CG1-CG1 4.38Å; I370-I401 HydrophobicContact CG2-CD1 4.15Å; I401-V403 HydrophobicContact CG2-CG2 4.07Å
402	T	96.1	Very high	89.5	Confident	39 Å²	39	44 Å²	44	24%	0.239	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	111.3	168.6	-51.2	0	0	0	0	108.3	Y295 E296 A297 L365 V366	Y295-T402 PolarHBondContact O-N 2.8Å; E296-T402 WeakPolarHBondContact CA-O 3.35Å; A297-T402 PolarHBondContact N-O 3.23Å; L365-T402 HydrophobicContact CB-CG2 4.3Å; L365-T402 HydrophobicContact CD2-CG2 4.06Å; V366-T402 CarbonylContact O-C 3.51Å; V366-T402 WeakPolarHBondContact O-CA 3.44Å
403	V	94.4	Very high	90	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	116.2	169.8	-172.8	0	0	0	0	107.9	A297 A299 I308 Y339 V366 L368 I401 M405	A297-V403 HydrophobicContact CB-CG2 4.44Å; A297-V403 WeakPolarHBondContact O-CA 3.34Å; A299-V403 HydrophobicContact CB-CG1 4.05Å; I308-V403 HydrophobicContact CD1-CG1 4Å; I308-V403 HydrophobicContact CD1-CG2 4.29Å; Y339-V403 HydrophobicContact CE1-CB 4.26Å; Y339-V403 HydrophobicContact CE1-CG1 4.01Å; Y339-V403 HydrophobicContact CE1-CG2 4.09Å; V366-V403 PolarHBondContact N-O 2.68Å; V366-V403 PolarHBondContact O-N 2.98Å; L368-V403 HydrophobicContact CD1-CG2 3.92Å; L368-V403 HydrophobicContact CG-CG2 4.36Å; I401-V403 HydrophobicContact CG2-CG2 4.07Å; V403-M405 PolarHBondContact O-N 3.03Å
404	K	93.6	Very high	90.3	Very high	68 Å²	68	44.7 Å²	44.7	30%	0.296	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	103.3	166.8	178.8	-178.4	157.8	-143.7	0	107.5	A297 E298 A299 T363 L365 V406	A297-K404 PolarHBondContact O-N 3.37Å; E298-K404 WeakPolarHBondContact CA-O 3.16Å; E298-K404 HydrophobicContact CG-CB 4.4Å; E298-K404 HydrophobicContact CG-CD 4.43Å; E298-K404 WeakPolarHBondContact OE1-CD 3.41Å; E298-K404 IonicContact OE1-NZ 2.65Å; E298-K404 PolarHBondContact OE1-NZ 2.82Å; A299-K404 PolarHBondContact N-O 2.92Å; T363-K404 HydrophobicContact CG2-CD 4.4Å; T363-K404 HydrophobicContact CG2-CG 4.01Å; L365-K404 HydrophobicContact CD2-CB 3.73Å; L365-K404 HydrophobicContact CD2-CG 3.96Å; K404-V406 HydrophobicContact CD-CG2 4.49Å; K404-V406 HydrophobicContact CG-CG2 4.29Å; K404-V406 PolarHBondContact O-N 3.17Å
405	M	90.6	Very high	90.6	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.015	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	114	163.7	-79.1	-69.3	-170.6	0	0	107.3	A299 V338 Y339 V354 F360 T363 T364 V366 V403	A299-M405 HydrophobicContact CB-CE 4.27Å; A299-M405 HydrophobicContact CB-SD 3.84Å; A299-M405 CarbonylContact O-C 3.57Å; A299-M405 WeakPolarHBondContact O-CA 3.33Å; V338-M405 HydrophobicContact CG1-CE 4.05Å; Y339-M405 HydrophobicContact CE1-CE 3.81Å; Y339-M405 VanDerWaalsContact OH-CE 3.26Å; Y339-M405 WeakPolarHBondContact OH-CE 3.49Å; V354-M405 HydrophobicContact CG1-CE 4.23Å; V354-M405 HydrophobicContact CG2-CE 3.77Å; F360-M405 HydrophobicContact CD2-CB 4Å; F360-M405 HydrophobicContact CD2-CG 3.99Å; F360-M405 HydrophobicContact CD2-SD 4.38Å; F360-M405 HydrophobicContact CE1-CG 4.44Å; F360-M405 HydrophobicContact CE2-CB 4.13Å; F360-M405 HydrophobicContact CE2-CE 4.07Å; F360-M405 HydrophobicContact CE2-CG 3.62Å; F360-M405 HydrophobicContact CE2-SD 4Å; F360-M405 HydrophobicContact CG-CB 4.19Å; F360-M405 HydrophobicContact CZ-CB 4.44Å; F360-M405 HydrophobicContact CZ-CG 3.86Å; T363-M405 CarbonylContact C-O 3.57Å; T363-M405 VanDerWaalsContact CA-O 3.26Å; T363-M405 WeakPolarHBondContact CA-O 3.05Å; T363-M405 WeakPolarHBondContact CG2-O 3.39Å; T364-M405 PolarHBondContact N-O 3.11Å; T364-M405 PolarHBondContact O-N 2.62Å; V366-M405 HydrophobicContact CG2-CG 4.47Å; V403-M405 PolarHBondContact O-N 3.03Å
406	V	88.8	Confident	90.5	Very high	40 Å²	40	45.8 Å²	45.8	24%	0.242	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	118.2	175.9	-178.1	0	0	0	0	106.8	E298 A299 E301 K404	E298-V406 HydrophobicContact CB-CG2 4.35Å; A299-V406 PolarHBondContact O-N 3.41Å; E301-V406 PolarHBondContact N-O 2.95Å; E301-V406 VanDerWaalsContact N-O 3.11Å; K404-V406 HydrophobicContact CD-CG2 4.49Å; K404-V406 HydrophobicContact CG-CG2 4.29Å; K404-V406 PolarHBondContact O-N 3.17Å
407	D	84.9	Confident	90.4	Very high	53 Å²	53	47 Å²	47	28%	0.283	25%	0.25	S	S	.	.			trans	-68.4	158.3	173.1	73.9	72.9	0	0	0	110.9	E301 F360 T363	E301-D407 WeakPolarHBondContact OE1-CA 3.36Å; E301-D407 WeakPolarHBondContact OE1-CB 3.44Å; F360-D407 WeakPolarHBondContact O-CB 3.43Å; T363-D407 WeakPolarHBondContact CA-OD2 3.5Å; T363-D407 VanDerWaalsContact CB-OD2 3.25Å; T363-D407 WeakPolarHBondContact CB-OD2 3.07Å; T363-D407 PolarHBondContact N-OD2 3.41Å; T363-D407 PolarHBondContact OG1-N 3.18Å; T363-D407 VanDerWaalsContact OG1-N 3.12Å; T363-D407 PolarHBondContact OG1-OD2 2.56Å
408	T	82.9	Confident	90.2	Very high	63 Å²	63	50 Å²	50	39%	0.387	27%	0.269	S	S	.	.			trans	-144.2	107.2	-178	-65.3	0	0	0	0	108.6	V300 E301 D410	V300-T408 VanDerWaalsContact CG1-OG1 3.25Å; V300-T408 WeakPolarHBondContact CG1-OG1 3.4Å; E301-T408 PolarHBondContact OE1-N 2.71Å; T408-D410 PolarHBondContact O-N 2.68Å; T408-D410 VanDerWaalsContact O-N 3.12Å
409	N	83.9	Confident	90.1	Very high	36 Å²	36	50 Å²	50	19%	0.193	26%	0.264	C	S	.	.			trans	-12.2	101.6	177.3	-172.2	104.9	0	0	0	114.2	D494 G496	N409-D494 VanDerWaalsContact ND2-CG 3.3Å; N409-D494 PolarHBondContact ND2-OD1 3.17Å; N409-D494 PolarHBondContact ND2-OD2 3.33Å; N409-G496 WeakPolarHBondContact OD1-CA 3.11Å
410	D	82	Confident	90	Very high	61 Å²	61	55 Å²	55	33%	0.326	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-71.2	170.2	-178.5	-136.9	-23.2	0	0	0	111.4	N359 T408 A500	N359-D410 PolarHBondContact ND2-OD2 3.06Å; T408-D410 PolarHBondContact O-N 2.68Å; T408-D410 VanDerWaalsContact O-N 3.12Å; D410-A500 WeakPolarHBondContact O-CB 3.18Å
411	A	85.3	Confident	89.9	Confident	42 Å²	42	52.8 Å²	52.8	35%	0.347	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-91.4	133.1	-178.2	0	0	0	0	0	112.5	L413 A500	A411-L413 PolarHBondContact O-N 3.18Å; A411-A500 HydrophobicContact CB-CB 4Å
412	P	90.6	Very high	89.8	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-59.4	120.4	-177.1	20.7	-33.5	0	0	0	111.9	V438 D440 I446 A492 D494 S502	P412-V438 HydrophobicContact CB-CG1 3.71Å; P412-D440 WeakPolarHBondContact CA-OD2 3.41Å; P412-D440 HydrophobicContact CB-CB 4.08Å; P412-D440 WeakPolarHBondContact CB-OD2 3.41Å; P412-I446 HydrophobicContact CB-CD1 4.02Å; P412-I446 HydrophobicContact CB-CG1 4.3Å; P412-I446 HydrophobicContact CB-CG2 4.48Å; P412-A492 HydrophobicContact CB-CB 4.33Å; P412-A492 HydrophobicContact CG-CB 4.08Å; P412-A492 WeakPolarHBondContact CG-O 3.3Å; P412-D494 WeakPolarHBondContact CD-OD2 3.4Å; P412-D494 HydrophobicContact CG-CB 4.49Å; P412-S502 VanDerWaalsContact O-CB 3.22Å; P412-S502 WeakPolarHBondContact O-CB 3.36Å; P412-S502 PolarHBondContact O-OG 2.65Å
413	L	90.1	Very high	89.7	Confident	92 Å²	92	58 Å²	58	48%	0.482	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	116.3	-166.8	-173.2	73.1	0	0	0	113.2	A411 Y417 V438 K439	A411-L413 PolarHBondContact O-N 3.18Å; L413-Y417 WeakPolarHBondContact CD1-OH 3.33Å; L413-V438 CarbonylContact O-C 3.54Å; L413-V438 WeakPolarHBondContact O-CA 3.26Å; L413-V438 WeakPolarHBondContact O-CG1 3.4Å; L413-K439 WeakPolarHBondContact CA-O 3.28Å; L413-K439 VanDerWaalsContact CB-O 3.29Å; L413-K439 WeakPolarHBondContact CB-O 3.33Å; L413-K439 PolarHBondContact N-O 3.44Å; L413-K439 PolarHBondContact O-N 3.45Å
414	F	91.2	Very high	89.5	Confident	6 Å²	6	60.5 Å²	60.5	3%	0.026	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	142.2	170.4	-73.1	-91	0	0	0	112.1	K416 P436 V438 I490 A492 S502 C504	F414-K416 WeakPolarHBondContact CB-O 3.29Å; F414-K416 PolarHBondContact O-N 2.97Å; F414-P436 HydrophobicContact CD1-CB 4.11Å; F414-P436 HydrophobicContact CE1-CB 3.79Å; F414-V438 HydrophobicContact CD1-CG2 3.5Å; F414-V438 HydrophobicContact CE1-CG2 3.57Å; F414-V438 HydrophobicContact CG-CG2 4Å; F414-V438 HydrophobicContact CZ-CG2 4.14Å; F414-I490 HydrophobicContact CE1-CD1 3.86Å; F414-I490 HydrophobicContact CE1-CG1 4.33Å; F414-I490 HydrophobicContact CZ-CD1 4.18Å; F414-I490 HydrophobicContact CZ-CG1 4.24Å; F414-A492 HydrophobicContact CD2-CB 4.49Å; F414-A492 HydrophobicContact CE1-CB 4.47Å; F414-A492 HydrophobicContact CE2-CB 3.6Å; F414-A492 HydrophobicContact CZ-CB 3.59Å; F414-S502 WeakPolarHBondContact CD2-OG 3.46Å; F414-S502 WeakPolarHBondContact CE2-OG 3.42Å; F414-C504 HydrophobicContact CD1-CB 3.54Å; F414-C504 HydrophobicContact CD2-CB 3.93Å; F414-C504 HydrophobicContact CE1-CB 3.47Å; F414-C504 VanDerWaalsContact CE1-CB 3.47Å; F414-C504 HydrophobicContact CE2-CB 3.86Å; F414-C504 HydrophobicContact CG-CB 3.79Å; F414-C504 HydrophobicContact CZ-CB 3.64Å
415	E	89.8	Confident	89.4	Confident	118 Å²	118	57.4 Å²	57.4	55%	0.551	29%	0.289	S	S	*	.	S	Bend	trans	-60.3	-25.7	171.9	-172.2	179.2	-113.9	0	0	112.2	K437	E415-K437 HydrophobicContact CB-CB 4.15Å; E415-K437 VanDerWaalsContact CD-NZ 3.34Å; E415-K437 PolarHBondContact N-O 3.26Å; E415-K437 IonicContact OE1-NZ 2.64Å; E415-K437 PolarHBondContact OE1-NZ 2.76Å; E415-K437 WeakPolarHBondContact OE2-CD 3.39Å; E415-K437 WeakPolarHBondContact OE2-CE 3.26Å; E415-K437 IonicContact OE2-NZ 3.83Å; E415-K437 PolarHBondContact OE2-NZ 2.89Å
416	K	87.4	Confident	89.3	Confident	88 Å²	88	60.8 Å²	60.8	38%	0.383	31%	0.305	S	S	.	.			trans	-145.9	137.2	172.2	-61.7	176.4	179.4	173.2	0	110.5	F414 T418 E419 C504	F414-K416 WeakPolarHBondContact CB-O 3.29Å; F414-K416 PolarHBondContact O-N 2.97Å; K416-T418 WeakPolarHBondContact CB-O 3.29Å; K416-E419 VanDerWaalsContact CD-OE2 3.31Å; K416-E419 WeakPolarHBondContact CD-OE2 3.39Å; K416-E419 IonicContact NZ-OE1 2.76Å; K416-E419 PolarHBondContact NZ-OE1 2.8Å; K416-E419 IonicContact NZ-OE2 2.69Å; K416-E419 PolarHBondContact NZ-OE2 3.43Å; K416-C504 PolarHBondContact O-SG 2.9Å
417	Y	87.8	Confident	89.4	Confident	137 Å²	137	60.4 Å²	60.4	54%	0.537	30%	0.304	S	S	.	.	S	Bend	trans	-79.2	-20.4	173.1	-65.8	-76.9	0	0	0	114	L413 C504 T505	L413-Y417 WeakPolarHBondContact CD1-OH 3.33Å; Y417-C504 WeakPolarHBondContact O-CA 3.32Å; Y417-T505 PolarHBondContact O-N 2.89Å
418	T	91.4	Very high	89.6	Confident	85 Å²	85	64.5 Å²	64.5	52%	0.521	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	136.5	174.3	-48.6	0	0	0	0	109.2	K416 T505	K416-T418 WeakPolarHBondContact CB-O 3.29Å; T418-T505 VanDerWaalsContact CA-O 3.25Å; T418-T505 WeakPolarHBondContact CA-O 3.5Å
419	E	93.8	Very high	90	Very high	47 Å²	47	66.7 Å²	66.7	22%	0.22	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	138	169.4	-171.8	73.4	117.4	0	0	111.3	K416 Y434 T505 V506 S507	K416-E419 VanDerWaalsContact CD-OE2 3.31Å; K416-E419 WeakPolarHBondContact CD-OE2 3.39Å; K416-E419 IonicContact NZ-OE1 2.76Å; K416-E419 PolarHBondContact NZ-OE1 2.8Å; K416-E419 IonicContact NZ-OE2 2.69Å; K416-E419 PolarHBondContact NZ-OE2 3.43Å; E419-Y434 HydrophobicContact CB-CD2 4.38Å; E419-Y434 HydrophobicContact CB-CE2 3.94Å; E419-Y434 HydrophobicContact CG-CD2 3.94Å; E419-Y434 HydrophobicContact CG-CE2 3.63Å; E419-T505 PolarHBondContact N-O 2.88Å; E419-V506 WeakPolarHBondContact O-CA 3.5Å; E419-S507 PolarHBondContact O-N 2.86Å
420	E	93.6	Very high	90.2	Very high	111 Å²	111	67.7 Å²	67.7	52%	0.519	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	124.9	171.7	-65	176.6	-163.8	0	0	110.3	Y422	E420-Y422 HydrophobicContact CB-CE2 3.78Å; E420-Y422 PolarHBondContact OE2-OH 2.89Å
421	V	93.6	Very high	90.7	Very high	18 Å²	18	68.1 Å²	68.1	11%	0.109	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	135.8	174	175.5	0	0	0	0	108.4	L433 V506 S507 V508 H509	V421-L433 HydrophobicContact CG1-CB 4.29Å; V421-L433 HydrophobicContact CG1-CD2 4.28Å; V421-L433 WeakPolarHBondContact CG2-O 3.32Å; V421-V506 HydrophobicContact CB-CG1 4.3Å; V421-V506 HydrophobicContact CG2-CG1 3.63Å; V421-S507 PolarHBondContact N-O 3.12Å; V421-V508 HydrophobicContact CB-CG2 4.34Å; V421-V508 CarbonylContact O-C 3.53Å; V421-V508 WeakPolarHBondContact O-CA 3.49Å; V421-H509 PolarHBondContact O-N 2.9Å
422	Y	93.7	Very high	91	Very high	129 Å²	129	70.2 Å²	70.2	51%	0.506	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	106.7	-178.2	-69.7	-95.3	0	0	0	109.7	E420 H509	E420-Y422 HydrophobicContact CB-CE2 3.78Å; E420-Y422 PolarHBondContact OE2-OH 2.89Å; Y422-H509 HydrophobicContact CD1-CB 3.75Å; Y422-H509 HydrophobicContact CE1-CB 3.84Å; Y422-H509 AromaticContact CE1-CD2 3.76Å; Y422-H509 AromaticContact CE1-CG 3.92Å; Y422-H509 HydrophobicContact CG-CB 4.42Å; Y422-H509 AromaticContact CZ-CD2 3.6Å
423	Q	93.3	Very high	91.1	Very high	22 Å²	22	71 Å²	71	10%	0.103	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	149.1	-175.6	-174.2	58.7	42.7	0	0	109.8	S427 L433 M473 V508 H509 L510 R511	Q423-S427 PolarHBondContact NE2-OG 3.07Å; Q423-L433 HydrophobicContact CB-CD2 4.34Å; Q423-L433 HydrophobicContact CG-CD2 4.08Å; Q423-M473 HydrophobicContact CG-SD 4.49Å; Q423-V508 HydrophobicContact CB-CG1 3.77Å; Q423-H509 PolarHBondContact N-O 2.98Å; Q423-L510 HydrophobicContact CB-CD2 4.25Å; Q423-L510 HydrophobicContact CG-CD2 4.42Å; Q423-L510 CarbonylContact O-C 3.55Å; Q423-L510 WeakPolarHBondContact O-CA 3.12Å; Q423-R511 PolarHBondContact O-N 2.84Å
424	T	91.4	Very high	91.3	Very high	51 Å²	51	67.7 Å²	67.7	31%	0.313	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	137.9	166	-55	0	0	0	0	108.9	S427 R511 I513	T424-S427 VanDerWaalsContact O-CB 3.29Å; T424-S427 WeakPolarHBondContact O-CB 3.26Å; T424-S427 PolarHBondContact O-OG 2.96Å; T424-R511 HydrophobicContact CG2-CB 4.39Å; T424-I513 HydrophobicContact CG2-CD1 3.62Å; T424-I513 HydrophobicContact CG2-CG1 3.95Å
425	E	92	Very high	91.3	Very high	3 Å²	3	71.1 Å²	71.1	1%	0.014	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	175.1	178.5	79.1	-172.2	133.2	0	0	113.5	S427 M473 R475 R511 D512 I513	E425-S427 PolarHBondContact O-N 3.37Å; E425-M473 WeakPolarHBondContact CB-O 3.23Å; E425-R475 WeakPolarHBondContact OE2-CB 3.21Å; E425-R475 PolarHBondContact OE2-N 2.87Å; E425-R511 PolarHBondContact N-O 2.94Å; E425-D512 VanDerWaalsContact OE1-C 3.3Å; E425-D512 WeakPolarHBondContact OE1-CA 3.09Å; E425-I513 HydrophobicContact CG-CB 4.12Å; E425-I513 HydrophobicContact CG-CD1 4.27Å; E425-I513 HydrophobicContact CG-CG1 4.15Å; E425-I513 PolarHBondContact OE1-N 2.81Å
426	E	88.5	Confident	91.4	Very high	75 Å²	75	65.9 Å²	65.9	35%	0.35	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	10.2	-175.4	-91.5	-66.3	102.8	0	0	114.9	K472 M473	E426-K472 VanDerWaalsContact CD-CD 3.45Å; E426-K472 VanDerWaalsContact O-CE 3.31Å; E426-K472 WeakPolarHBondContact O-CE 3.5Å; E426-K472 PolarHBondContact O-NZ 2.69Å; E426-K472 WeakPolarHBondContact OE1-CD 3.09Å; E426-K472 IonicContact OE1-NZ 3.93Å; E426-K472 WeakPolarHBondContact OE2-CD 3.39Å; E426-K472 IonicContact OE2-NZ 2.79Å; E426-K472 PolarHBondContact OE2-NZ 3.46Å; E426-M473 PolarHBondContact N-O 2.89Å
427	S	89.8	Confident	91.7	Very high	32 Å²	32	67.3 Å²	67.3	22%	0.224	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-62.2	145.6	-178.6	-85	0	0	0	0	112.8	Q423 T424 E425 K429	Q423-S427 PolarHBondContact NE2-OG 3.07Å; T424-S427 VanDerWaalsContact O-CB 3.29Å; T424-S427 WeakPolarHBondContact O-CB 3.26Å; T424-S427 PolarHBondContact O-OG 2.96Å; E425-S427 PolarHBondContact O-N 3.37Å; S427-K429 PolarHBondContact O-N 3.26Å
428	E	89.9	Confident	91.8	Very high	139 Å²	139	61.9 Å²	61.9	65%	0.65	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-57.6	137.6	174.9	-70.9	-65.1	173.3	0	0	112	Q431	E428-Q431 WeakPolarHBondContact O-CG 3.04Å; E428-Q431 PolarHBondContact O-NE2 3.28Å
429	K	91.1	Very high	91.6	Very high	109 Å²	109	65.6 Å²	65.6	47%	0.474	33%	0.332	S	S	.	.	S	Bend	trans	-74.1	157.2	-177.5	57	175	163	-161.9	0	113.7	S427 I470 E471	S427-K429 PolarHBondContact O-N 3.26Å; K429-I470 WeakPolarHBondContact CD-O 3.49Å; K429-I470 PolarHBondContact NZ-O 2.65Å; K429-E471 IonicContact NZ-OE1 3.54Å; K429-E471 PolarHBondContact NZ-OE1 2.72Å; K429-E471 IonicContact NZ-OE2 2.87Å; K429-E471 PolarHBondContact NZ-OE2 2.58Å
430	G	88.6	Confident	91.2	Very high	57 Å²	57	64.8 Å²	64.8	59%	0.588	33%	0.33	S	S	*	.	S	Bend	trans	89.3	15.7	-173	0	0	0	0	0	113.9	T469	G430-T469 WeakPolarHBondContact CA-O 3.36Å; G430-T469 PolarHBondContact N-O 2.91Å; G430-T469 PolarHBondContact N-OG1 3.45Å; G430-T469 VanDerWaalsContact N-OG1 3.16Å
431	Q	90.9	Very high	90.4	Very high	69 Å²	69	63.4 Å²	63.4	32%	0.322	34%	0.337	S	S	.	.			trans	-79.9	140.3	173.1	-71.3	179.7	41.6	0	0	110.3	E428 T468 T469	E428-Q431 WeakPolarHBondContact O-CG 3.04Å; E428-Q431 PolarHBondContact O-NE2 3.28Å; Q431-T468 CarbonylContact O-C 3.55Å; Q431-T468 VanDerWaalsContact O-CA 3.24Å; Q431-T468 WeakPolarHBondContact O-CA 3.4Å; Q431-T469 PolarHBondContact N-OG1 3.02Å; Q431-T469 PolarHBondContact O-N 2.88Å
432	V	93	Very high	89.5	Confident	87 Å²	87	65.9 Å²	65.9	53%	0.527	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	119.6	172.6	174.5	0	0	0	0	108.6	I466 T468	V432-I466 HydrophobicContact CB-CG2 4.42Å; V432-I466 HydrophobicContact CG1-CG2 3.66Å; V432-I466 HydrophobicContact CG2-CG2 3.97Å; V432-T468 HydrophobicContact CG2-CG2 3.89Å
433	L	92.4	Very high	88.7	Confident	16 Å²	16	60.6 Å²	60.6	8%	0.084	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-44.6	178.3	-65	174.5	0	0	0	111.6	V421 Q423 V458 I467 T469 M473 I488 V508	V421-L433 HydrophobicContact CG1-CB 4.29Å; V421-L433 HydrophobicContact CG1-CD2 4.28Å; V421-L433 WeakPolarHBondContact CG2-O 3.32Å; Q423-L433 HydrophobicContact CB-CD2 4.34Å; Q423-L433 HydrophobicContact CG-CD2 4.08Å; L433-V458 HydrophobicContact CD1-CG1 3.58Å; L433-I467 HydrophobicContact CB-CG2 4.45Å; L433-I467 HydrophobicContact CD1-CG2 4.26Å; L433-I467 PolarHBondContact N-O 3.31Å; L433-T469 HydrophobicContact CD1-CG2 3.82Å; L433-T469 HydrophobicContact CD2-CG2 4.04Å; L433-T469 HydrophobicContact CG-CG2 3.95Å; L433-M473 HydrophobicContact CD1-CE 3.68Å; L433-M473 HydrophobicContact CD1-SD 4.43Å; L433-I488 HydrophobicContact CD1-CD1 4.33Å; L433-V508 HydrophobicContact CD1-CG2 4.36Å
434	Y	93.3	Very high	88	Confident	23 Å²	23	68.3 Å²	68.3	9%	0.09	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	148	-175.9	-175.6	-122.8	0	0	0	111.3	E419 P436 I467 V506	E419-Y434 HydrophobicContact CB-CD2 4.38Å; E419-Y434 HydrophobicContact CB-CE2 3.94Å; E419-Y434 HydrophobicContact CG-CD2 3.94Å; E419-Y434 HydrophobicContact CG-CE2 3.63Å; Y434-P436 HydrophobicContact CD1-CB 4.33Å; Y434-P436 VanDerWaalsContact CE1-CA 3.48Å; Y434-P436 HydrophobicContact CE1-CB 3.71Å; Y434-I467 HydrophobicContact CD1-CD1 4.23Å; Y434-I467 PolarHBondContact O-N 2.65Å; Y434-V506 HydrophobicContact CD1-CG2 3.66Å; Y434-V506 HydrophobicContact CE1-CG2 4.14Å; Y434-V506 HydrophobicContact CG-CG2 4.11Å
435	T	93.1	Very high	87.8	Confident	77 Å²	77	70.7 Å²	70.7	47%	0.472	38%	0.382	S	S	.	.			trans	-125.2	105.8	170	-61.4	0	0	0	0	107	I466	T435-I466 HydrophobicContact CG2-CG1 4.03Å
436	P	91.8	Very high	87.7	Confident	8 Å²	8	71.6 Å²	71.6	5%	0.052	39%	0.387	C	S	.	.			trans	-65.6	149.6	179.1	27.9	-33.4	0	0	0	110.4	F414 Y434 V438 Y448 G465 I490	F414-P436 HydrophobicContact CD1-CB 4.11Å; F414-P436 HydrophobicContact CE1-CB 3.79Å; Y434-P436 HydrophobicContact CD1-CB 4.33Å; Y434-P436 VanDerWaalsContact CE1-CA 3.48Å; Y434-P436 HydrophobicContact CE1-CB 3.71Å; P436-V438 HydrophobicContact CB-CG2 4.28Å; P436-Y448 HydrophobicContact CB-CE1 4.24Å; P436-Y448 HydrophobicContact CG-CD1 4.19Å; P436-Y448 HydrophobicContact CG-CE1 3.74Å; P436-G465 WeakPolarHBondContact CD-O 3.42Å; P436-G465 VanDerWaalsContact CG-O 3.29Å; P436-G465 WeakPolarHBondContact CG-O 3.46Å; P436-I490 HydrophobicContact CB-CD1 4.16Å; P436-I490 HydrophobicContact CG-CD1 4.11Å
437	K	92	Very high	87.9	Confident	119 Å²	119	71.9 Å²	71.9	52%	0.517	39%	0.385	S	S	.	.			trans	-116.4	119.8	162.1	-65.4	159.1	174.6	179	0	106.9	E415	E415-K437 HydrophobicContact CB-CB 4.15Å; E415-K437 VanDerWaalsContact CD-NZ 3.34Å; E415-K437 PolarHBondContact N-O 3.26Å; E415-K437 IonicContact OE1-NZ 2.64Å; E415-K437 PolarHBondContact OE1-NZ 2.76Å; E415-K437 WeakPolarHBondContact OE2-CD 3.39Å; E415-K437 WeakPolarHBondContact OE2-CE 3.26Å; E415-K437 IonicContact OE2-NZ 3.83Å; E415-K437 PolarHBondContact OE2-NZ 2.89Å
438	V	90.9	Very high	88.2	Confident	22 Å²	22	71.4 Å²	71.4	13%	0.133	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	145.1	177.5	-167.1	0	0	0	0	107.5	P412 L413 F414 P436 I446 Y448 A492	P412-V438 HydrophobicContact CB-CG1 3.71Å; L413-V438 CarbonylContact O-C 3.54Å; L413-V438 WeakPolarHBondContact O-CA 3.26Å; L413-V438 WeakPolarHBondContact O-CG1 3.4Å; F414-V438 HydrophobicContact CD1-CG2 3.5Å; F414-V438 HydrophobicContact CE1-CG2 3.57Å; F414-V438 HydrophobicContact CG-CG2 4Å; F414-V438 HydrophobicContact CZ-CG2 4.14Å; P436-V438 HydrophobicContact CB-CG2 4.28Å; V438-I446 HydrophobicContact CB-CD1 3.89Å; V438-I446 HydrophobicContact CG1-CD1 3.71Å; V438-Y448 HydrophobicContact CG2-CE1 3.66Å; V438-Y448 WeakPolarHBondContact CG2-OH 3.41Å; V438-A492 HydrophobicContact CG1-CB 4.04Å; V438-A492 HydrophobicContact CG2-CB 4.18Å
439	K	87.6	Confident	88.4	Confident	163 Å²	163	70.1 Å²	70.1	71%	0.709	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.8	134	173.1	-65.2	-178.1	-176.6	175.5	0	108.2	L413	L413-K439 WeakPolarHBondContact CA-O 3.28Å; L413-K439 VanDerWaalsContact CB-O 3.29Å; L413-K439 WeakPolarHBondContact CB-O 3.33Å; L413-K439 PolarHBondContact N-O 3.44Å; L413-K439 PolarHBondContact O-N 3.45Å
440	D	85.2	Confident	88.6	Confident	31 Å²	31	67.4 Å²	67.4	17%	0.166	36%	0.363	C	S	.	.			trans	-126	145.8	175.7	-172.4	-63.7	0	0	0	105	P412 E442 S443 I446	P412-D440 WeakPolarHBondContact CA-OD2 3.41Å; P412-D440 HydrophobicContact CB-CB 4.08Å; P412-D440 WeakPolarHBondContact CB-OD2 3.41Å; D440-E442 PolarHBondContact OD1-N 2.83Å; D440-S443 WeakPolarHBondContact CB-O 3.43Å; D440-S443 PolarHBondContact OD1-N 3.07Å; D440-I446 HydrophobicContact CB-CD1 4Å; D440-I446 HydrophobicContact CB-CG1 4.4Å
441	A	76.3	Confident	88.9	Confident	82 Å²	82	68.9 Å²	68.9	68%	0.678	36%	0.36	S	S	*	.	S	Bend	trans	-94.4	-15.3	-176.5	0	0	0	0	0	111.8
442	E	75.3	Confident	89.1	Confident	70 Å²	70	68.9 Å²	68.9	33%	0.327	36%	0.36	S	S	.	.	S	Bend	trans	-110.8	-32.1	-170.5	-65.2	64.1	-138	0	0	112	D440	D440-E442 PolarHBondContact OD1-N 2.83Å
443	S	76.7	Confident	89.2	Confident	18 Å²	18	65.6 Å²	65.6	13%	0.126	34%	0.34	C	S	.	.			trans	-133.8	126.2	-178.1	-173.8	0	0	0	0	115.2	D440 N445 D495	D440-S443 WeakPolarHBondContact CB-O 3.43Å; D440-S443 PolarHBondContact OD1-N 3.07Å; S443-N445 PolarHBondContact O-N 2.88Å; S443-N445 PolarHBondContact OG-N 2.82Å; S443-D495 WeakPolarHBondContact CB-OD1 3.31Å; S443-D495 PolarHBondContact OG-OD1 2.59Å
444	D	78.4	Confident	89.3	Confident	183 Å²	183	67.5 Å²	67.5	98%	0.979	35%	0.353	S	S	*	.	S	Bend	trans	-72.7	-6.6	167.1	-76.1	-52.7	0	0	0	113.5
445	N	86.8	Confident	89.3	Confident	101 Å²	101	67.5 Å²	67.5	54%	0.54	36%	0.358	S	S	.	.			trans	-111.6	62.3	-161.5	-173.4	39.2	0	0	0	113.9	S443 D495	S443-N445 PolarHBondContact O-N 2.88Å; S443-N445 PolarHBondContact OG-N 2.82Å; N445-D495 PolarHBondContact ND2-OD2 2.95Å
446	I	90.8	Very high	89.3	Confident	23 Å²	23	69.4 Å²	69.4	12%	0.118	37%	0.365	C	S	.	.			trans	-80.2	129.2	-176.4	-54.7	172.4	0	0	0	111.7	P412 V438 D440 Y448 A492	P412-I446 HydrophobicContact CB-CD1 4.02Å; P412-I446 HydrophobicContact CB-CG1 4.3Å; P412-I446 HydrophobicContact CB-CG2 4.48Å; V438-I446 HydrophobicContact CB-CD1 3.89Å; V438-I446 HydrophobicContact CG1-CD1 3.71Å; D440-I446 HydrophobicContact CB-CD1 4Å; D440-I446 HydrophobicContact CB-CG1 4.4Å; I446-Y448 HydrophobicContact CB-CE2 4.24Å; I446-Y448 HydrophobicContact CG2-CD2 4.41Å; I446-Y448 HydrophobicContact CG2-CE1 4.33Å; I446-Y448 HydrophobicContact CG2-CE2 3.87Å; I446-A492 HydrophobicContact CG2-CB 3.86Å
447	R	92.8	Very high	89.5	Confident	81 Å²	81	70 Å²	70	31%	0.306	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	140.7	169.6	172.4	172.7	66.9	-86.2	3.8	110.3	E462 I493 D494	R447-E462 WeakPolarHBondContact CA-O 3.19Å; R447-E462 HydrophobicContact CG-CG 4.02Å; R447-I493 WeakPolarHBondContact CA-O 3.37Å; R447-I493 WeakPolarHBondContact CB-O 3.39Å; R447-I493 PolarHBondContact N-O 2.84Å; R447-I493 PolarHBondContact O-N 3.04Å; R447-D494 PolarHBondContact NH1-O 3.35Å; R447-D494 PolarHBondContact NH2-O 2.57Å
448	Y	94.6	Very high	89.6	Confident	22 Å²	22	64.6 Å²	64.6	9%	0.086	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	137.6	177.7	-63.4	-93.7	0	0	0	111.4	P436 V438 I446 E462 G465 A491 A492	P436-Y448 HydrophobicContact CB-CE1 4.24Å; P436-Y448 HydrophobicContact CG-CD1 4.19Å; P436-Y448 HydrophobicContact CG-CE1 3.74Å; V438-Y448 HydrophobicContact CG2-CE1 3.66Å; V438-Y448 WeakPolarHBondContact CG2-OH 3.41Å; I446-Y448 HydrophobicContact CB-CE2 4.24Å; I446-Y448 HydrophobicContact CG2-CD2 4.41Å; I446-Y448 HydrophobicContact CG2-CE1 4.33Å; I446-Y448 HydrophobicContact CG2-CE2 3.87Å; Y448-E462 PolarHBondContact N-O 2.86Å; Y448-G465 VanDerWaalsContact CD1-CA 3.49Å; Y448-A491 WeakPolarHBondContact CA-O 3.29Å; Y448-A492 HydrophobicContact CD1-CB 4.38Å; Y448-A492 HydrophobicContact CE1-CB 4.18Å
449	E	94.7	Very high	89.9	Confident	111 Å²	111	66.6 Å²	66.6	52%	0.519	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	144.1	-179.8	-171.3	165.5	-179.2	0	0	111	I490 A491 I493	E449-I490 CarbonylContact O-C 3.47Å; E449-I490 WeakPolarHBondContact O-CA 3.14Å; E449-A491 PolarHBondContact N-O 2.95Å; E449-A491 VanDerWaalsContact N-O 3.09Å; E449-A491 PolarHBondContact O-N 3.48Å; E449-I493 HydrophobicContact CB-CD1 4.08Å; E449-I493 WeakPolarHBondContact OE2-CD1 3.28Å
450	L	95.7	Very high	90.3	Very high	53 Å²	53	59.9 Å²	59.9	28%	0.277	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	113.3	178.7	-176.2	62.6	0	0	0	108.9	D453 V458 V460 I488 I490	L450-D453 HydrophobicContact CD1-CB 4.21Å; L450-D453 HydrophobicContact CD2-CB 3.85Å; L450-D453 HydrophobicContact CG-CB 4.14Å; L450-V458 HydrophobicContact CD1-CG2 4.19Å; L450-V458 HydrophobicContact CD2-CG2 4.22Å; L450-V460 HydrophobicContact CB-CG1 3.86Å; L450-I488 HydrophobicContact CD1-CG2 3.81Å; L450-I490 HydrophobicContact CD1-CG2 4.01Å
451	V	94.9	Very high	90.7	Very high	88 Å²	88	62 Å²	62	53%	0.533	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-39.3	-173.4	-177.2	0	0	0	0	111.5	V489 A491	V451-V489 HydrophobicContact CB-CB 4.24Å; V451-V489 HydrophobicContact CB-CG1 4.09Å; V451-V489 HydrophobicContact CG1-CG1 4.47Å; V451-V489 PolarHBondContact N-O 2.86Å; V451-A491 HydrophobicContact CG2-CB 3.6Å
452	E	94.8	Very high	91.5	Very high	68 Å²	68	63.8 Å²	63.8	32%	0.318	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	119.4	-175.5	-158.1	-179.7	144.6	0	0	110.3	P454 R487 I488 V489	E452-P454 HydrophobicContact CG-CG 4.43Å; E452-R487 IonicContact OE1-CZ 3.85Å; E452-R487 IonicContact OE1-NH1 2.58Å; E452-R487 PolarHBondContact OE1-NH1 2.8Å; E452-R487 IonicContact OE2-CZ 3.42Å; E452-R487 IonicContact OE2-NH1 2.62Å; E452-R487 PolarHBondContact OE2-NH1 3.05Å; E452-R487 IonicContact OE2-NH2 2.68Å; E452-I488 WeakPolarHBondContact O-CA 3.46Å; E452-V489 HydrophobicContact CB-CB 3.68Å; E452-V489 HydrophobicContact CB-CG2 3.79Å; E452-V489 PolarHBondContact N-O 3.15Å; E452-V489 VanDerWaalsContact N-O 3.12Å; E452-V489 PolarHBondContact O-N 2.86Å
453	D	94.9	Very high	92.2	Very high	19 Å²	19	68.5 Å²	68.5	10%	0.102	35%	0.353	C	S	.	.			trans	-149.5	80.3	173.8	179.9	17.4	0	0	0	108.3	L450 A455 N456 W457 V458 Y486	L450-D453 HydrophobicContact CD1-CB 4.21Å; L450-D453 HydrophobicContact CD2-CB 3.85Å; L450-D453 HydrophobicContact CG-CB 4.14Å; D453-A455 VanDerWaalsContact C-N 3.29Å; D453-A455 PolarHBondContact O-N 3.05Å; D453-A455 VanDerWaalsContact O-N 3.13Å; D453-N456 PolarHBondContact O-N 3.14Å; D453-N456 VanDerWaalsContact OD2-C 3.29Å; D453-N456 WeakPolarHBondContact OD2-CA 3.28Å; D453-W457 PolarHBondContact OD1-N 3.35Å; D453-W457 PolarHBondContact OD2-N 2.03Å; D453-V458 HydrophobicContact CB-CG2 4.16Å; D453-V458 VanDerWaalsContact CG-CG2 3.48Å; D453-V458 VanDerWaalsContact OD2-CG2 3.28Å; D453-V458 WeakPolarHBondContact OD2-CG2 3.22Å; D453-V458 PolarHBondContact OD2-N 3.37Å; D453-Y486 WeakPolarHBondContact OD1-CE1 3.49Å; D453-Y486 PolarHBondContact OD1-OH 3.39Å
454	P	94.3	Very high	92.9	Very high	56 Å²	56	70.9 Å²	70.9	36%	0.364	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-34.8	-164.2	-30.2	37.1	0	0	0	116.1	E452 H479 Y486 R487	E452-P454 HydrophobicContact CG-CG 4.43Å; P454-H479 HydrophobicContact CB-CB 4.23Å; P454-Y486 HydrophobicContact CB-CE2 4.44Å; P454-Y486 WeakPolarHBondContact CD-OH 3.39Å; P454-Y486 VanDerWaalsContact N-OH 3.15Å; P454-R487 WeakPolarHBondContact CD-O 3.28Å
455	A	92.8	Very high	93.5	Very high	23 Å²	23	62.2 Å²	62.2	19%	0.19	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-3.3	178.7	0	0	0	0	0	114.3	D453 W457 H479 Y486	D453-A455 VanDerWaalsContact C-N 3.29Å; D453-A455 PolarHBondContact O-N 3.05Å; D453-A455 VanDerWaalsContact O-N 3.13Å; A455-W457 HydrophobicContact CB-CD2 3.58Å; A455-W457 HydrophobicContact CB-CE3 4.04Å; A455-W457 HydrophobicContact CB-CG 3.94Å; A455-W457 HydrophobicContact CB-CH2 4.34Å; A455-W457 HydrophobicContact CB-CZ2 3.95Å; A455-W457 HydrophobicContact CB-CZ3 4.39Å; A455-H479 HydrophobicContact CB-CB 3.92Å; A455-Y486 HydrophobicContact CB-CE2 3.94Å; A455-Y486 WeakPolarHBondContact CB-OH 3.34Å; A455-Y486 PolarHBondContact N-OH 3.14Å
456	N	94.3	Very high	93.8	Very high	117 Å²	117	59.8 Å²	59.8	63%	0.626	31%	0.307	S	S	*	.			trans	59.2	45.9	-175.8	-57.9	-109.9	0	0	0	112.6	D453	D453-N456 PolarHBondContact O-N 3.14Å; D453-N456 VanDerWaalsContact OD2-C 3.29Å; D453-N456 WeakPolarHBondContact OD2-CA 3.28Å
457	W	94.9	Very high	94	Very high	21 Å²	21	58.7 Å²	58.7	8%	0.08	30%	0.302	C	S	.	.			trans	-93	-14.7	-177.3	-73.3	-26.1	0	0	0	114.2	D453 A455 I470 E471 K472 M473 D474 S477 V480 Y486 L510	D453-W457 PolarHBondContact OD1-N 3.35Å; D453-W457 PolarHBondContact OD2-N 2.03Å; A455-W457 HydrophobicContact CB-CD2 3.58Å; A455-W457 HydrophobicContact CB-CE3 4.04Å; A455-W457 HydrophobicContact CB-CG 3.94Å; A455-W457 HydrophobicContact CB-CH2 4.34Å; A455-W457 HydrophobicContact CB-CZ2 3.95Å; A455-W457 HydrophobicContact CB-CZ3 4.39Å; W457-I470 WeakPolarHBondContact O-CG1 3.44Å; W457-I470 PolarHBondContact O-N 3.34Å; W457-E471 PolarHBondContact O-N 3.03Å; W457-K472 PolarHBondContact NE1-O 2.89Å; W457-M473 HydrophobicContact CB-CE 4.07Å; W457-M473 HydrophobicContact CB-CG 4.21Å; W457-M473 HydrophobicContact CD2-CB 4.36Å; W457-M473 HydrophobicContact CD2-CG 3.96Å; W457-M473 HydrophobicContact CE3-CB 4.04Å; W457-M473 HydrophobicContact CE3-CE 4.26Å; W457-M473 HydrophobicContact CE3-CG 3.67Å; W457-M473 HydrophobicContact CG-CG 4.24Å; W457-M473 HydrophobicContact CZ3-CB 4.19Å; W457-M473 HydrophobicContact CZ3-CG 4.29Å; W457-D474 WeakPolarHBondContact CH2-O 3.39Å; W457-S477 WeakPolarHBondContact CZ2-OG 3.35Å; W457-V480 HydrophobicContact CH2-CG2 3.67Å; W457-V480 HydrophobicContact CZ3-CG2 3.79Å; W457-Y486 HydrophobicContact CD2-CE2 4.47Å; W457-Y486 AromaticContact CE3-CD1 3.87Å; W457-Y486 HydrophobicContact CE3-CD1 3.87Å; W457-Y486 AromaticContact CE3-CD2 3.76Å; W457-Y486 HydrophobicContact CE3-CD2 3.76Å; W457-Y486 AromaticContact CE3-CE1 3.7Å; W457-Y486 HydrophobicContact CE3-CE1 3.7Å; W457-Y486 AromaticContact CE3-CE2 3.58Å; W457-Y486 HydrophobicContact CE3-CE2 3.58Å; W457-Y486 AromaticContact CE3-CG 3.89Å; W457-Y486 HydrophobicContact CE3-CG 3.89Å; W457-Y486 AromaticContact CE3-CZ 3.54Å; W457-Y486 HydrophobicContact CH2-CD2 4.4Å; W457-Y486 HydrophobicContact CH2-CE2 4.47Å; W457-Y486 HydrophobicContact CZ3-CD1 4.21Å; W457-Y486 AromaticContact CZ3-CD2 3.41Å; W457-Y486 HydrophobicContact CZ3-CD2 3.41Å; W457-Y486 VanDerWaalsContact CZ3-CD2 3.41Å; W457-Y486 HydrophobicContact CZ3-CE1 4.35Å; W457-Y486 AromaticContact CZ3-CE2 3.58Å; W457-Y486 HydrophobicContact CZ3-CE2 3.58Å; W457-Y486 AromaticContact CZ3-CG 3.73Å; W457-Y486 HydrophobicContact CZ3-CG 3.73Å; W457-L510 HydrophobicContact CZ3-CD1 4.37Å
458	V	95.9	Very high	94.1	Very high	4 Å²	4	56.6 Å²	56.6	2%	0.024	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	167.3	-175.3	-61.5	0	0	0	0	113.2	L433 L450 D453 I467 T468 M473 I488	L433-V458 HydrophobicContact CD1-CG1 3.58Å; L450-V458 HydrophobicContact CD1-CG2 4.19Å; L450-V458 HydrophobicContact CD2-CG2 4.22Å; D453-V458 HydrophobicContact CB-CG2 4.16Å; D453-V458 VanDerWaalsContact CG-CG2 3.48Å; D453-V458 VanDerWaalsContact OD2-CG2 3.28Å; D453-V458 WeakPolarHBondContact OD2-CG2 3.22Å; D453-V458 PolarHBondContact OD2-N 3.37Å; V458-I467 HydrophobicContact CB-CG2 3.8Å; V458-I467 HydrophobicContact CG1-CG2 4.01Å; V458-I467 HydrophobicContact CG2-CG2 4.05Å; V458-T468 CarbonylContact C-O 3.57Å; V458-T468 WeakPolarHBondContact CA-O 3.49Å; V458-T468 WeakPolarHBondContact CB-O 3.2Å; V458-M473 HydrophobicContact CG1-CE 3.59Å; V458-I488 HydrophobicContact CB-CD1 4.46Å; V458-I488 HydrophobicContact CG1-CD1 3.79Å; V458-I488 HydrophobicContact CG2-CD1 3.9Å; V458-I488 HydrophobicContact CG2-CG1 4.19Å; V458-I488 HydrophobicContact CG2-CG2 4.13Å
459	T	95.4	Very high	94.2	Very high	65 Å²	65	56 Å²	56	40%	0.399	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	150.5	164.2	-162.9	0	0	0	0	109.8	I467 T468 I470	T459-I467 WeakPolarHBondContact O-CA 3.48Å; T459-T468 WeakPolarHBondContact CG2-OG1 3.4Å; T459-T468 PolarHBondContact N-O 3.4Å; T459-T468 PolarHBondContact O-N 3.12Å; T459-I470 HydrophobicContact CG2-CG2 3.51Å
460	V	96.4	Very high	94.1	Very high	22 Å²	22	54 Å²	54	13%	0.133	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	137.2	175.8	74.4	0	0	0	0	109.3	L450 G465 I466 I467 I490	L450-V460 HydrophobicContact CB-CG1 3.86Å; V460-G465 WeakPolarHBondContact CG2-O 3.39Å; V460-I466 WeakPolarHBondContact CA-O 3.25Å; V460-I467 HydrophobicContact CG2-CG1 4.46Å; V460-I490 HydrophobicContact CB-CG2 4.49Å; V460-I490 HydrophobicContact CG2-CG2 4.22Å
461	D	94.6	Very high	94	Very high	76 Å²	76	56.1 Å²	56.1	41%	0.406	30%	0.297	S	S	.	.			trans	-77.4	124.6	169.1	175.3	-92.8	0	0	0	110.6	K463 T464 G465 I466	D461-K463 PolarHBondContact O-N 2.83Å; D461-K463 PolarHBondContact OD1-N 2.82Å; D461-K463 VanDerWaalsContact OD1-N 3.07Å; D461-T464 WeakPolarHBondContact CB-OG1 3.32Å; D461-T464 VanDerWaalsContact CG-OG1 3.23Å; D461-T464 PolarHBondContact O-N 2.93Å; D461-T464 WeakPolarHBondContact OD1-CB 3.33Å; D461-T464 PolarHBondContact OD1-N 2.82Å; D461-T464 PolarHBondContact OD1-OG1 2.77Å; D461-G465 WeakPolarHBondContact O-CA 3.42Å; D461-G465 PolarHBondContact O-N 2.86Å; D461-I466 PolarHBondContact N-O 2.79Å; D461-I466 VanDerWaalsContact N-O 3.11Å
462	E	92.7	Very high	93.9	Very high	119 Å²	119	55.3 Å²	55.3	56%	0.556	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-22.2	-173.1	-169.6	-174.5	-178.4	0	0	114.1	R447 Y448	R447-E462 WeakPolarHBondContact CA-O 3.19Å; R447-E462 HydrophobicContact CG-CG 4.02Å; Y448-E462 PolarHBondContact N-O 2.86Å
463	K	90.7	Very high	93.8	Very high	169 Å²	169	52.4 Å²	52.4	74%	0.735	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.8	-25	-171.8	-61.9	-170.8	176.1	-166.5	0	114.8	D461	D461-K463 PolarHBondContact O-N 2.83Å; D461-K463 PolarHBondContact OD1-N 2.82Å; D461-K463 VanDerWaalsContact OD1-N 3.07Å
464	T	90.6	Very high	93.8	Very high	68 Å²	68	54.4 Å²	54.4	42%	0.417	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	-11	-176.7	60	0	0	0	0	112.6	D461 I466	D461-T464 WeakPolarHBondContact CB-OG1 3.32Å; D461-T464 VanDerWaalsContact CG-OG1 3.23Å; D461-T464 PolarHBondContact O-N 2.93Å; D461-T464 WeakPolarHBondContact OD1-CB 3.33Å; D461-T464 PolarHBondContact OD1-N 2.82Å; D461-T464 PolarHBondContact OD1-OG1 2.77Å; T464-I466 PolarHBondContact O-N 2.81Å; T464-I466 VanDerWaalsContact O-N 3.1Å; T464-I466 WeakPolarHBondContact OG1-CD1 3.41Å; T464-I466 WeakPolarHBondContact OG1-CG1 3.36Å
465	G	90	Very high	93.8	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.272	C	S	.	.			trans	67	5.2	-179	0	0	0	0	0	114.4	P436 Y448 V460 D461 I467	P436-G465 WeakPolarHBondContact CD-O 3.42Å; P436-G465 VanDerWaalsContact CG-O 3.29Å; P436-G465 WeakPolarHBondContact CG-O 3.46Å; Y448-G465 VanDerWaalsContact CD1-CA 3.49Å; V460-G465 WeakPolarHBondContact CG2-O 3.39Å; D461-G465 WeakPolarHBondContact O-CA 3.42Å; D461-G465 PolarHBondContact O-N 2.86Å; G465-I467 PolarHBondContact O-N 3.17Å
466	I	94.6	Very high	93.8	Very high	51 Å²	51	53.9 Å²	53.9	26%	0.262	27%	0.271	S	S	.	.			trans	-65.2	122.7	-175.5	-61.9	172.7	0	0	0	109	V432 T435 V460 D461 T464 T468	V432-I466 HydrophobicContact CB-CG2 4.42Å; V432-I466 HydrophobicContact CG1-CG2 3.66Å; V432-I466 HydrophobicContact CG2-CG2 3.97Å; T435-I466 HydrophobicContact CG2-CG1 4.03Å; V460-I466 WeakPolarHBondContact CA-O 3.25Å; D461-I466 PolarHBondContact N-O 2.79Å; D461-I466 VanDerWaalsContact N-O 3.11Å; T464-I466 PolarHBondContact O-N 2.81Å; T464-I466 VanDerWaalsContact O-N 3.1Å; T464-I466 WeakPolarHBondContact OG1-CD1 3.41Å; T464-I466 WeakPolarHBondContact OG1-CG1 3.36Å; I466-T468 HydrophobicContact CG2-CG2 4.11Å
467	I	95.4	Very high	93.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	124.8	177.4	-51.4	-176.4	0	0	0	108.6	L433 Y434 V458 T459 V460 G465 I488 I490 V506	L433-I467 HydrophobicContact CB-CG2 4.45Å; L433-I467 HydrophobicContact CD1-CG2 4.26Å; L433-I467 PolarHBondContact N-O 3.31Å; Y434-I467 HydrophobicContact CD1-CD1 4.23Å; Y434-I467 PolarHBondContact O-N 2.65Å; V458-I467 HydrophobicContact CB-CG2 3.8Å; V458-I467 HydrophobicContact CG1-CG2 4.01Å; V458-I467 HydrophobicContact CG2-CG2 4.05Å; T459-I467 WeakPolarHBondContact O-CA 3.48Å; V460-I467 HydrophobicContact CG2-CG1 4.46Å; G465-I467 PolarHBondContact O-N 3.17Å; I467-I488 HydrophobicContact CD1-CG2 4.25Å; I467-I488 HydrophobicContact CG2-CD1 4.49Å; I467-I490 HydrophobicContact CD1-CD1 4.21Å; I467-I490 HydrophobicContact CD1-CG2 3.77Å; I467-I490 HydrophobicContact CG1-CG2 4.2Å; I467-V506 HydrophobicContact CD1-CB 4.39Å; I467-V506 HydrophobicContact CD1-CG2 3.84Å
468	T	94.6	Very high	93.6	Very high	36 Å²	36	53.9 Å²	53.9	22%	0.221	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	146.8	178.7	53.2	0	0	0	0	112.4	Q431 V432 V458 T459 I466	Q431-T468 CarbonylContact O-C 3.55Å; Q431-T468 VanDerWaalsContact O-CA 3.24Å; Q431-T468 WeakPolarHBondContact O-CA 3.4Å; V432-T468 HydrophobicContact CG2-CG2 3.89Å; V458-T468 CarbonylContact C-O 3.57Å; V458-T468 WeakPolarHBondContact CA-O 3.49Å; V458-T468 WeakPolarHBondContact CB-O 3.2Å; T459-T468 WeakPolarHBondContact CG2-OG1 3.4Å; T459-T468 PolarHBondContact N-O 3.4Å; T459-T468 PolarHBondContact O-N 3.12Å; I466-T468 HydrophobicContact CG2-CG2 4.11Å
469	T	95.1	Very high	93.4	Very high	10 Å²	10	58 Å²	58	6%	0.061	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	129	174.2	54.8	0	0	0	0	111.4	G430 Q431 L433 M473	G430-T469 WeakPolarHBondContact CA-O 3.36Å; G430-T469 PolarHBondContact N-O 2.91Å; G430-T469 PolarHBondContact N-OG1 3.45Å; G430-T469 VanDerWaalsContact N-OG1 3.16Å; Q431-T469 PolarHBondContact N-OG1 3.02Å; Q431-T469 PolarHBondContact O-N 2.88Å; L433-T469 HydrophobicContact CD1-CG2 3.82Å; L433-T469 HydrophobicContact CD2-CG2 4.04Å; L433-T469 HydrophobicContact CG-CG2 3.95Å; T469-M473 HydrophobicContact CG2-CE 4.25Å; T469-M473 HydrophobicContact CG2-SD 4.28Å
470	I	94.1	Very high	93.3	Very high	70 Å²	70	55.8 Å²	55.8	36%	0.359	29%	0.286	S	S	.	.	S	Bend	trans	-104	-24.4	174.3	57	168.3	0	0	0	113	K429 W457 T459	K429-I470 WeakPolarHBondContact CD-O 3.49Å; K429-I470 PolarHBondContact NZ-O 2.65Å; W457-I470 WeakPolarHBondContact O-CG1 3.44Å; W457-I470 PolarHBondContact O-N 3.34Å; T459-I470 HydrophobicContact CG2-CG2 3.51Å
471	E	93.4	Very high	93	Very high	96 Å²	96	59.4 Å²	59.4	45%	0.449	30%	0.304	S	S	.	.	S	Bend	trans	-132.5	175.5	169.6	-69.1	-55.7	158.5	0	0	110.4	K429 W457	K429-E471 IonicContact NZ-OE1 3.54Å; K429-E471 PolarHBondContact NZ-OE1 2.72Å; K429-E471 IonicContact NZ-OE2 2.87Å; K429-E471 PolarHBondContact NZ-OE2 2.58Å; W457-E471 PolarHBondContact O-N 3.03Å
472	K	93.3	Very high	92.5	Very high	72 Å²	72	59.9 Å²	59.9	31%	0.313	31%	0.31	S	S	.	.			trans	-72.5	140.4	174.9	-63.9	-161.8	170.3	-155.6	0	110.4	E426 W457	E426-K472 VanDerWaalsContact CD-CD 3.45Å; E426-K472 VanDerWaalsContact O-CE 3.31Å; E426-K472 WeakPolarHBondContact O-CE 3.5Å; E426-K472 PolarHBondContact O-NZ 2.69Å; E426-K472 WeakPolarHBondContact OE1-CD 3.09Å; E426-K472 IonicContact OE1-NZ 3.93Å; E426-K472 WeakPolarHBondContact OE2-CD 3.39Å; E426-K472 IonicContact OE2-NZ 2.79Å; E426-K472 PolarHBondContact OE2-NZ 3.46Å; W457-K472 PolarHBondContact NE1-O 2.89Å
473	M	92.9	Very high	92.3	Very high	6 Å²	6	58.3 Å²	58.3	3%	0.03	31%	0.305	C	S	.	.			trans	-90.1	135.6	169.9	-63.4	178.3	153.9	0	0	108.5	Q423 E425 E426 L433 W457 V458 T469 Y486 I488 V508 L510	Q423-M473 HydrophobicContact CG-SD 4.49Å; E425-M473 WeakPolarHBondContact CB-O 3.23Å; E426-M473 PolarHBondContact N-O 2.89Å; L433-M473 HydrophobicContact CD1-CE 3.68Å; L433-M473 HydrophobicContact CD1-SD 4.43Å; W457-M473 HydrophobicContact CB-CE 4.07Å; W457-M473 HydrophobicContact CB-CG 4.21Å; W457-M473 HydrophobicContact CD2-CB 4.36Å; W457-M473 HydrophobicContact CD2-CG 3.96Å; W457-M473 HydrophobicContact CE3-CB 4.04Å; W457-M473 HydrophobicContact CE3-CE 4.26Å; W457-M473 HydrophobicContact CE3-CG 3.67Å; W457-M473 HydrophobicContact CG-CG 4.24Å; W457-M473 HydrophobicContact CZ3-CB 4.19Å; W457-M473 HydrophobicContact CZ3-CG 4.29Å; V458-M473 HydrophobicContact CG1-CE 3.59Å; T469-M473 HydrophobicContact CG2-CE 4.25Å; T469-M473 HydrophobicContact CG2-SD 4.28Å; M473-Y486 HydrophobicContact CE-CD1 4.11Å; M473-Y486 HydrophobicContact CE-CE1 4.34Å; M473-I488 HydrophobicContact CE-CD1 4.48Å; M473-V508 HydrophobicContact SD-CG1 4.14Å; M473-L510 HydrophobicContact CB-CD1 4.25Å; M473-L510 HydrophobicContact CB-CD2 3.75Å; M473-L510 HydrophobicContact CG-CD2 4.49Å; M473-L510 HydrophobicContact SD-CD2 4.03Å
474	D	93.8	Very high	92.3	Very high	62 Å²	62	50.8 Å²	50.8	33%	0.332	27%	0.274	S	S	.	.			trans	-129.2	129	-179.9	109	56	0	0	0	108.5	W457 E476 S477	W457-D474 WeakPolarHBondContact CH2-O 3.39Å; D474-E476 PolarHBondContact OD1-N 2.81Å; D474-E476 VanDerWaalsContact OD1-N 3.12Å; D474-S477 WeakPolarHBondContact O-CB 3.08Å; D474-S477 PolarHBondContact OD1-N 2.95Å
475	R	94.4	Very high	92.5	Very high	30 Å²	30	48.4 Å²	48.4	11%	0.113	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-23.8	-169.1	-168.6	-168.8	72	76.9	11	112.3	E425 S477 S484 L510 D512 A542	E425-R475 WeakPolarHBondContact OE2-CB 3.21Å; E425-R475 PolarHBondContact OE2-N 2.87Å; R475-S477 VanDerWaalsContact C-N 3.31Å; R475-S484 PolarHBondContact NH1-OG 3.04Å; R475-L510 HydrophobicContact CB-CB 4.28Å; R475-L510 HydrophobicContact CB-CD1 4.37Å; R475-L510 HydrophobicContact CG-CB 4.11Å; R475-D512 IonicContact CZ-OD1 3.73Å; R475-D512 IonicContact NE-OD1 2.72Å; R475-D512 PolarHBondContact NE-OD1 2.81Å; R475-D512 IonicContact NH2-OD1 2.67Å; R475-D512 PolarHBondContact NH2-OD1 3.37Å; R475-A542 PolarHBondContact NH2-O 2.77Å
476	E	92.5	Very high	92.7	Very high	37 Å²	37	48.4 Å²	48.4	17%	0.173	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-12.6	-180	-69.6	61	-129.6	0	0	113.1	D474 A542	D474-E476 PolarHBondContact OD1-N 2.81Å; D474-E476 VanDerWaalsContact OD1-N 3.12Å; E476-A542 HydrophobicContact CB-CB 4.28Å; E476-A542 HydrophobicContact CG-CB 3.37Å
477	S	92.4	Very high	92.7	Very high	13 Å²	13	50.6 Å²	50.6	9%	0.091	26%	0.264	C	S	.	.	S	Bend	trans	-50	134.8	172.4	177	0	0	0	0	111.5	W457 D474 R475 H479 V480	W457-S477 WeakPolarHBondContact CZ2-OG 3.35Å; D474-S477 WeakPolarHBondContact O-CB 3.08Å; D474-S477 PolarHBondContact OD1-N 2.95Å; R475-S477 VanDerWaalsContact C-N 3.31Å; S477-H479 PolarHBondContact O-N 3.1Å; S477-H479 PolarHBondContact OG-ND1 3.05Å; S477-V480 PolarHBondContact O-N 2.89Å; S477-V480 VanDerWaalsContact O-N 3.13Å
478	P	92.4	Very high	92.7	Very high	125 Å²	125	50.6 Å²	50.6	81%	0.812	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	10.3	179.2	32.2	-37.4	0	0	0	114.2
479	H	92.5	Very high	92.8	Very high	90 Å²	90	49.2 Å²	49.2	42%	0.417	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-1.5	177.2	-49.8	88.2	0	0	0	112.7	P454 A455 S477 Y486	P454-H479 HydrophobicContact CB-CB 4.23Å; A455-H479 HydrophobicContact CB-CB 3.92Å; S477-H479 PolarHBondContact O-N 3.1Å; S477-H479 PolarHBondContact OG-ND1 3.05Å; H479-Y486 HydrophobicContact CB-CE2 4.11Å; H479-Y486 WeakPolarHBondContact O-CD2 3.12Å
480	V	92.6	Very high	92.8	Very high	20 Å²	20	48.8 Å²	48.8	12%	0.121	25%	0.253	C	S	.	.	S	Bend	trans	-100.4	134.7	175.7	-179	0	0	0	0	108.5	W457 S477 Y486 L510	W457-V480 HydrophobicContact CH2-CG2 3.67Å; W457-V480 HydrophobicContact CZ3-CG2 3.79Å; S477-V480 PolarHBondContact O-N 2.89Å; S477-V480 VanDerWaalsContact O-N 3.13Å; V480-Y486 HydrophobicContact CG2-CD2 4.11Å; V480-L510 HydrophobicContact CG1-CD1 4.33Å; V480-L510 HydrophobicContact CG2-CD1 3.89Å
481	D	89.6	Confident	92.8	Very high	98 Å²	98	45.6 Å²	45.6	52%	0.524	24%	0.237	S	C	.	.	B	Isolated β-bridge	trans	-69.2	160	178.9	-79.5	-45	0	0	0	112	D483 S484 T485	D481-D483 PolarHBondContact O-N 2.93Å; D481-S484 WeakPolarHBondContact O-CA 3.38Å; D481-S484 PolarHBondContact O-N 3.24Å; D481-T485 PolarHBondContact N-O 2.82Å
482	V	85.3	Confident	92.9	Very high	86 Å²	86	41 Å²	41	52%	0.521	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-22.1	-179.2	-65.7	0	0	0	0	114.2	S484 L783	V482-S484 PolarHBondContact O-N 2.8Å; V482-L783 WeakPolarHBondContact O-CG 3.32Å
483	D	87.4	Confident	92.8	Very high	85 Å²	85	38.3 Å²	38.3	46%	0.455	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	25.7	174.6	-60.4	-44.6	0	0	0	112.6	D481 T485	D481-D483 PolarHBondContact O-N 2.93Å; D483-T485 PolarHBondContact O-N 2.85Å; D483-T485 VanDerWaalsContact O-N 3.17Å; D483-T485 PolarHBondContact O-OG1 2.9Å
484	S	92.1	Very high	92.8	Very high	12 Å²	12	38 Å²	38	8%	0.084	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	38.6	-179.9	-54.2	0	0	0	0	113.2	R475 D481 V482 L510	R475-S484 PolarHBondContact NH1-OG 3.04Å; D481-S484 WeakPolarHBondContact O-CA 3.38Å; D481-S484 PolarHBondContact O-N 3.24Å; V482-S484 PolarHBondContact O-N 2.8Å; S484-L510 PolarHBondContact O-N 2.84Å
485	T	93.6	Very high	92.5	Very high	17 Å²	17	39.4 Å²	39.4	10%	0.104	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	129.7	-172.4	-57.5	0	0	0	0	109.9	D481 D483 V508 H509	D481-T485 PolarHBondContact N-O 2.82Å; D483-T485 PolarHBondContact O-N 2.85Å; D483-T485 VanDerWaalsContact O-N 3.17Å; D483-T485 PolarHBondContact O-OG1 2.9Å; T485-V508 WeakPolarHBondContact CA-O 3.16Å; T485-H509 PolarHBondContact OG1-CE1 3.35Å; T485-H509 VanDerWaalsContact OG1-CE1 3.28Å; T485-H509 PolarHBondContact OG1-ND1 3.34Å
486	Y	95.1	Very high	91.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	124.5	176.9	-175.3	-106.3	0	0	0	110.1	D453 P454 A455 W457 M473 H479 V480 I488 V508	D453-Y486 WeakPolarHBondContact OD1-CE1 3.49Å; D453-Y486 PolarHBondContact OD1-OH 3.39Å; P454-Y486 HydrophobicContact CB-CE2 4.44Å; P454-Y486 WeakPolarHBondContact CD-OH 3.39Å; P454-Y486 VanDerWaalsContact N-OH 3.15Å; A455-Y486 HydrophobicContact CB-CE2 3.94Å; A455-Y486 WeakPolarHBondContact CB-OH 3.34Å; A455-Y486 PolarHBondContact N-OH 3.14Å; W457-Y486 HydrophobicContact CD2-CE2 4.47Å; W457-Y486 AromaticContact CE3-CD1 3.87Å; W457-Y486 HydrophobicContact CE3-CD1 3.87Å; W457-Y486 AromaticContact CE3-CD2 3.76Å; W457-Y486 HydrophobicContact CE3-CD2 3.76Å; W457-Y486 AromaticContact CE3-CE1 3.7Å; W457-Y486 HydrophobicContact CE3-CE1 3.7Å; W457-Y486 AromaticContact CE3-CE2 3.58Å; W457-Y486 HydrophobicContact CE3-CE2 3.58Å; W457-Y486 AromaticContact CE3-CG 3.89Å; W457-Y486 HydrophobicContact CE3-CG 3.89Å; W457-Y486 AromaticContact CE3-CZ 3.54Å; W457-Y486 HydrophobicContact CH2-CD2 4.4Å; W457-Y486 HydrophobicContact CH2-CE2 4.47Å; W457-Y486 HydrophobicContact CZ3-CD1 4.21Å; W457-Y486 AromaticContact CZ3-CD2 3.41Å; W457-Y486 HydrophobicContact CZ3-CD2 3.41Å; W457-Y486 VanDerWaalsContact CZ3-CD2 3.41Å; W457-Y486 HydrophobicContact CZ3-CE1 4.35Å; W457-Y486 AromaticContact CZ3-CE2 3.58Å; W457-Y486 HydrophobicContact CZ3-CE2 3.58Å; W457-Y486 AromaticContact CZ3-CG 3.73Å; W457-Y486 HydrophobicContact CZ3-CG 3.73Å; M473-Y486 HydrophobicContact CE-CD1 4.11Å; M473-Y486 HydrophobicContact CE-CE1 4.34Å; H479-Y486 HydrophobicContact CB-CE2 4.11Å; H479-Y486 WeakPolarHBondContact O-CD2 3.12Å; V480-Y486 HydrophobicContact CG2-CD2 4.11Å; Y486-I488 HydrophobicContact CD1-CD1 4.14Å; Y486-I488 HydrophobicContact CD1-CG1 3.85Å; Y486-I488 HydrophobicContact CE1-CD1 4.19Å; Y486-I488 HydrophobicContact CE1-CG1 3.71Å; Y486-V508 PolarHBondContact N-O 2.76Å; Y486-V508 PolarHBondContact O-N 3.06Å
487	R	94.6	Very high	91.3	Very high	98 Å²	98	42.9 Å²	42.9	37%	0.37	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	122.5	-172.7	-176.5	171.9	174.8	-101	-11.4	111.4	E452 P454 V489 T505	E452-R487 IonicContact OE1-CZ 3.85Å; E452-R487 IonicContact OE1-NH1 2.58Å; E452-R487 PolarHBondContact OE1-NH1 2.8Å; E452-R487 IonicContact OE2-CZ 3.42Å; E452-R487 IonicContact OE2-NH1 2.62Å; E452-R487 PolarHBondContact OE2-NH1 3.05Å; E452-R487 IonicContact OE2-NH2 2.68Å; P454-R487 WeakPolarHBondContact CD-O 3.28Å; R487-V489 VanDerWaalsContact NH2-CG2 3.28Å; R487-T505 HydrophobicContact CG-CG2 3.86Å
488	I	95.4	Very high	90.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	140.3	173.4	-59.5	162.6	0	0	0	108.4	L433 L450 E452 V458 I467 M473 Y486 I490 T505 V506 V508	L433-I488 HydrophobicContact CD1-CD1 4.33Å; L450-I488 HydrophobicContact CD1-CG2 3.81Å; E452-I488 WeakPolarHBondContact O-CA 3.46Å; V458-I488 HydrophobicContact CB-CD1 4.46Å; V458-I488 HydrophobicContact CG1-CD1 3.79Å; V458-I488 HydrophobicContact CG2-CD1 3.9Å; V458-I488 HydrophobicContact CG2-CG1 4.19Å; V458-I488 HydrophobicContact CG2-CG2 4.13Å; I467-I488 HydrophobicContact CD1-CG2 4.25Å; I467-I488 HydrophobicContact CG2-CD1 4.49Å; M473-I488 HydrophobicContact CE-CD1 4.48Å; Y486-I488 HydrophobicContact CD1-CD1 4.14Å; Y486-I488 HydrophobicContact CD1-CG1 3.85Å; Y486-I488 HydrophobicContact CE1-CD1 4.19Å; Y486-I488 HydrophobicContact CE1-CG1 3.71Å; I488-I490 HydrophobicContact CG2-CG2 4.47Å; I488-T505 CarbonylContact O-C 3.51Å; I488-T505 WeakPolarHBondContact O-CA 3.46Å; I488-V506 HydrophobicContact CB-CB 4.36Å; I488-V506 PolarHBondContact N-O 2.98Å; I488-V506 PolarHBondContact O-N 3.16Å; I488-V508 HydrophobicContact CD1-CG2 3.71Å
489	V	95.7	Very high	90.6	Very high	7 Å²	7	44.4 Å²	44.4	4%	0.042	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	127.4	170.5	-174.7	0	0	0	0	110	V451 E452 R487 T503 C504 T505	V451-V489 HydrophobicContact CB-CB 4.24Å; V451-V489 HydrophobicContact CB-CG1 4.09Å; V451-V489 HydrophobicContact CG1-CG1 4.47Å; V451-V489 PolarHBondContact N-O 2.86Å; E452-V489 HydrophobicContact CB-CB 3.68Å; E452-V489 HydrophobicContact CB-CG2 3.79Å; E452-V489 PolarHBondContact N-O 3.15Å; E452-V489 VanDerWaalsContact N-O 3.12Å; E452-V489 PolarHBondContact O-N 2.86Å; R487-V489 VanDerWaalsContact NH2-CG2 3.28Å; V489-T503 HydrophobicContact CG1-CG2 4.37Å; V489-C504 WeakPolarHBondContact CA-O 3.48Å; V489-T505 HydrophobicContact CG2-CG2 4.48Å
490	I	95.7	Very high	90.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	148.2	171.2	57.3	165.4	0	0	0	110.5	F414 P436 E449 L450 V460 I467 I488 T503 C504	F414-I490 HydrophobicContact CE1-CD1 3.86Å; F414-I490 HydrophobicContact CE1-CG1 4.33Å; F414-I490 HydrophobicContact CZ-CD1 4.18Å; F414-I490 HydrophobicContact CZ-CG1 4.24Å; P436-I490 HydrophobicContact CB-CD1 4.16Å; P436-I490 HydrophobicContact CG-CD1 4.11Å; E449-I490 CarbonylContact O-C 3.47Å; E449-I490 WeakPolarHBondContact O-CA 3.14Å; L450-I490 HydrophobicContact CD1-CG2 4.01Å; V460-I490 HydrophobicContact CB-CG2 4.49Å; V460-I490 HydrophobicContact CG2-CG2 4.22Å; I467-I490 HydrophobicContact CD1-CD1 4.21Å; I467-I490 HydrophobicContact CD1-CG2 3.77Å; I467-I490 HydrophobicContact CG1-CG2 4.2Å; I488-I490 HydrophobicContact CG2-CG2 4.47Å; I490-T503 CarbonylContact O-C 3.45Å; I490-T503 VanDerWaalsContact O-CA 3.27Å; I490-T503 WeakPolarHBondContact O-CA 3.46Å; I490-C504 HydrophobicContact CD1-CB 4.48Å; I490-C504 HydrophobicContact CG1-CB 4.05Å; I490-C504 PolarHBondContact N-O 2.94Å; I490-C504 PolarHBondContact O-N 2.75Å
491	A	94.6	Very high	90.3	Very high	4 Å²	4	43.9 Å²	43.9	3%	0.033	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	145.9	168.8	0	0	0	0	0	110.7	Y448 E449 V451 I493 T501 S502 T503	Y448-A491 WeakPolarHBondContact CA-O 3.29Å; E449-A491 PolarHBondContact N-O 2.95Å; E449-A491 VanDerWaalsContact N-O 3.09Å; E449-A491 PolarHBondContact O-N 3.48Å; V451-A491 HydrophobicContact CG2-CB 3.6Å; A491-I493 HydrophobicContact CB-CD1 4.48Å; A491-I493 HydrophobicContact CB-CG1 4.16Å; A491-T501 HydrophobicContact CB-CG2 4Å; A491-S502 VanDerWaalsContact CA-O 3.25Å; A491-S502 WeakPolarHBondContact CA-O 3.44Å; A491-T503 HydrophobicContact CB-CG2 4.32Å
492	A	94.4	Very high	90.5	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.1	159.7	0	0	0	0	0	107.8	P412 F414 V438 I446 Y448 T501 S502	P412-A492 HydrophobicContact CB-CB 4.33Å; P412-A492 HydrophobicContact CG-CB 4.08Å; P412-A492 WeakPolarHBondContact CG-O 3.3Å; F414-A492 HydrophobicContact CD2-CB 4.49Å; F414-A492 HydrophobicContact CE1-CB 4.47Å; F414-A492 HydrophobicContact CE2-CB 3.6Å; F414-A492 HydrophobicContact CZ-CB 3.59Å; V438-A492 HydrophobicContact CG1-CB 4.04Å; V438-A492 HydrophobicContact CG2-CB 4.18Å; I446-A492 HydrophobicContact CG2-CB 3.86Å; Y448-A492 HydrophobicContact CD1-CB 4.38Å; Y448-A492 HydrophobicContact CE1-CB 4.18Å; A492-T501 WeakPolarHBondContact O-CA 3.5Å; A492-S502 PolarHBondContact N-O 2.87Å; A492-S502 PolarHBondContact O-N 2.93Å
493	I	92.5	Very high	90.9	Very high	15 Å²	15	39.2 Å²	39.2	8%	0.077	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	125	-173.4	-42.7	172.2	0	0	0	107.8	R447 E449 A491 P499 A500 T501	R447-I493 WeakPolarHBondContact CA-O 3.37Å; R447-I493 WeakPolarHBondContact CB-O 3.39Å; R447-I493 PolarHBondContact N-O 2.84Å; R447-I493 PolarHBondContact O-N 3.04Å; E449-I493 HydrophobicContact CB-CD1 4.08Å; E449-I493 WeakPolarHBondContact OE2-CD1 3.28Å; A491-I493 HydrophobicContact CB-CD1 4.48Å; A491-I493 HydrophobicContact CB-CG1 4.16Å; I493-P499 HydrophobicContact CG2-CB 4.28Å; I493-A500 WeakPolarHBondContact CG2-O 3.01Å; I493-T501 HydrophobicContact CG1-CG2 4.02Å
494	D	92	Very high	91.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	22%	0.216	C	C	.	.			trans	-74.9	-170.6	176.6	55.5	67.7	0	0	0	112.8	N409 P412 R447 G496 P499 A500	N409-D494 VanDerWaalsContact ND2-CG 3.3Å; N409-D494 PolarHBondContact ND2-OD1 3.17Å; N409-D494 PolarHBondContact ND2-OD2 3.33Å; P412-D494 WeakPolarHBondContact CD-OD2 3.4Å; P412-D494 HydrophobicContact CG-CB 4.49Å; R447-D494 PolarHBondContact NH1-O 3.35Å; R447-D494 PolarHBondContact NH2-O 2.57Å; D494-G496 VanDerWaalsContact OD1-CA 3.29Å; D494-G496 WeakPolarHBondContact OD1-CA 3.15Å; D494-G496 PolarHBondContact OD1-N 3.24Å; D494-P499 WeakPolarHBondContact OD1-CA 3.42Å; D494-P499 WeakPolarHBondContact OD1-CB 3.43Å; D494-A500 PolarHBondContact OD1-N 2.98Å; D494-A500 VanDerWaalsContact OD1-N 3.14Å; D494-A500 VanDerWaalsContact OD2-CA 3.22Å; D494-A500 WeakPolarHBondContact OD2-CA 3.42Å; D494-A500 VanDerWaalsContact OD2-CB 3.29Å; D494-A500 WeakPolarHBondContact OD2-CB 3.24Å; D494-A500 PolarHBondContact OD2-N 2.77Å; D494-A500 VanDerWaalsContact OD2-O 3.05Å
495	D	87.6	Confident	91.4	Very high	90 Å²	90	36 Å²	36	48%	0.481	22%	0.22	S	C	.	.	S	Bend	trans	-111.1	25	169.8	67.7	-18	0	0	0	113.7	S443 N445	S443-D495 WeakPolarHBondContact CB-OD1 3.31Å; S443-D495 PolarHBondContact OG-OD1 2.59Å; N445-D495 PolarHBondContact ND2-OD2 2.95Å
496	G	81.6	Confident	91.5	Very high	19 Å²	19	35.1 Å²	35.1	20%	0.196	22%	0.216	C	C	.	.			trans	-64.1	177.2	175.8	0	0	0	0	0	115.9	N409 D494 P498 P499	N409-G496 WeakPolarHBondContact OD1-CA 3.11Å; D494-G496 VanDerWaalsContact OD1-CA 3.29Å; D494-G496 WeakPolarHBondContact OD1-CA 3.15Å; D494-G496 PolarHBondContact OD1-N 3.24Å; G496-P498 VanDerWaalsContact C-C 3.43Å; G496-P498 CarbonylContact C-O 3.56Å; G496-P498 CarbonylContact O-C 3.53Å; G496-P499 WeakPolarHBondContact O-CD 3.25Å
497	S	79.6	Confident	91.6	Very high	122 Å²	122	36.3 Å²	36.3	85%	0.853	22%	0.224	S	C	*	.	S	Bend	trans	-142.7	93.6	-177.9	-162.1	0	0	0	0	112.6
498	P	83.6	Confident	91.6	Very high	101 Å²	101	31.7 Å²	31.7	66%	0.656	21%	0.206	S	C	*	.	S	Bend	cis	-66.4	152.8	-2.8	31.5	-36.5	0	0	0	111.8	G496	G496-P498 VanDerWaalsContact C-C 3.43Å; G496-P498 CarbonylContact C-O 3.56Å; G496-P498 CarbonylContact O-C 3.53Å
499	P	86.4	Confident	91.5	Very high	69 Å²	69	33.8 Å²	33.8	45%	0.448	22%	0.216	S	C	.	.			trans	-71.4	135.7	174.5	30	-34	0	0	0	110	I493 D494 G496	I493-P499 HydrophobicContact CG2-CB 4.28Å; D494-P499 WeakPolarHBondContact OD1-CA 3.42Å; D494-P499 WeakPolarHBondContact OD1-CB 3.43Å; G496-P499 WeakPolarHBondContact O-CD 3.25Å
500	A	88.8	Confident	91.5	Very high	23 Å²	23	33.9 Å²	33.9	19%	0.19	22%	0.216	C	C	.	.			trans	-89.2	174.6	172.6	0	0	0	0	0	110.3	D410 A411 I493 D494	D410-A500 WeakPolarHBondContact O-CB 3.18Å; A411-A500 HydrophobicContact CB-CB 4Å; I493-A500 WeakPolarHBondContact CG2-O 3.01Å; D494-A500 PolarHBondContact OD1-N 2.98Å; D494-A500 VanDerWaalsContact OD1-N 3.14Å; D494-A500 VanDerWaalsContact OD2-CA 3.22Å; D494-A500 WeakPolarHBondContact OD2-CA 3.42Å; D494-A500 VanDerWaalsContact OD2-CB 3.29Å; D494-A500 WeakPolarHBondContact OD2-CB 3.24Å; D494-A500 PolarHBondContact OD2-N 2.77Å; D494-A500 VanDerWaalsContact OD2-O 3.05Å
501	T	91.6	Very high	91.3	Very high	76 Å²	76	40.9 Å²	40.9	47%	0.466	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	136	-173.8	-60.5	0	0	0	0	110.5	A491 A492 I493	A491-T501 HydrophobicContact CB-CG2 4Å; A492-T501 WeakPolarHBondContact O-CA 3.5Å; I493-T501 HydrophobicContact CG1-CG2 4.02Å
502	S	92.8	Very high	91.1	Very high	16 Å²	16	41.7 Å²	41.7	11%	0.112	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	166.4	167.9	75.6	0	0	0	0	110.5	P412 F414 A491 A492	P412-S502 VanDerWaalsContact O-CB 3.22Å; P412-S502 WeakPolarHBondContact O-CB 3.36Å; P412-S502 PolarHBondContact O-OG 2.65Å; F414-S502 WeakPolarHBondContact CD2-OG 3.46Å; F414-S502 WeakPolarHBondContact CE2-OG 3.42Å; A491-S502 VanDerWaalsContact CA-O 3.25Å; A491-S502 WeakPolarHBondContact CA-O 3.44Å; A492-S502 PolarHBondContact N-O 2.87Å; A492-S502 PolarHBondContact O-N 2.93Å
503	T	94.6	Very high	91	Very high	70 Å²	70	44.7 Å²	44.7	43%	0.429	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	144.5	179.8	55.6	0	0	0	0	112.3	V489 I490 A491	V489-T503 HydrophobicContact CG1-CG2 4.37Å; I490-T503 CarbonylContact O-C 3.45Å; I490-T503 VanDerWaalsContact O-CA 3.27Å; I490-T503 WeakPolarHBondContact O-CA 3.46Å; A491-T503 HydrophobicContact CB-CG2 4.32Å
504	C	94.6	Very high	90.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	135.8	172.1	-176.7	0	0	0	0	109.7	F414 K416 Y417 V489 I490	F414-C504 HydrophobicContact CD1-CB 3.54Å; F414-C504 HydrophobicContact CD2-CB 3.93Å; F414-C504 HydrophobicContact CE1-CB 3.47Å; F414-C504 VanDerWaalsContact CE1-CB 3.47Å; F414-C504 HydrophobicContact CE2-CB 3.86Å; F414-C504 HydrophobicContact CG-CB 3.79Å; F414-C504 HydrophobicContact CZ-CB 3.64Å; K416-C504 PolarHBondContact O-SG 2.9Å; Y417-C504 WeakPolarHBondContact O-CA 3.32Å; V489-C504 WeakPolarHBondContact CA-O 3.48Å; I490-C504 HydrophobicContact CD1-CB 4.48Å; I490-C504 HydrophobicContact CG1-CB 4.05Å; I490-C504 PolarHBondContact N-O 2.94Å; I490-C504 PolarHBondContact O-N 2.75Å
505	T	95.8	Very high	90.7	Very high	28 Å²	28	49.2 Å²	49.2	17%	0.172	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	124	173.7	-58.6	0	0	0	0	109.8	Y417 T418 E419 R487 I488 V489	Y417-T505 PolarHBondContact O-N 2.89Å; T418-T505 VanDerWaalsContact CA-O 3.25Å; T418-T505 WeakPolarHBondContact CA-O 3.5Å; E419-T505 PolarHBondContact N-O 2.88Å; R487-T505 HydrophobicContact CG-CG2 3.86Å; I488-T505 CarbonylContact O-C 3.51Å; I488-T505 WeakPolarHBondContact O-CA 3.46Å; V489-T505 HydrophobicContact CG2-CG2 4.48Å
506	V	95.8	Very high	90.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	116.6	172.9	-178.7	0	0	0	0	108.5	E419 V421 Y434 I467 I488 V508	E419-V506 WeakPolarHBondContact O-CA 3.5Å; V421-V506 HydrophobicContact CB-CG1 4.3Å; V421-V506 HydrophobicContact CG2-CG1 3.63Å; Y434-V506 HydrophobicContact CD1-CG2 3.66Å; Y434-V506 HydrophobicContact CE1-CG2 4.14Å; Y434-V506 HydrophobicContact CG-CG2 4.11Å; I467-V506 HydrophobicContact CD1-CB 4.39Å; I467-V506 HydrophobicContact CD1-CG2 3.84Å; I488-V506 HydrophobicContact CB-CB 4.36Å; I488-V506 PolarHBondContact N-O 2.98Å; I488-V506 PolarHBondContact O-N 3.16Å; V506-V508 HydrophobicContact CG1-CG2 4.15Å
507	S	95.3	Very high	91.3	Very high	25 Å²	25	47.6 Å²	47.6	18%	0.175	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	106.2	176.6	-66	0	0	0	0	109	E419 V421	E419-S507 PolarHBondContact O-N 2.86Å; V421-S507 PolarHBondContact N-O 3.12Å
508	V	95.3	Very high	91.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	103	178.9	-174.5	0	0	0	0	109.1	V421 Q423 L433 M473 T485 Y486 I488 V506 L510	V421-V508 HydrophobicContact CB-CG2 4.34Å; V421-V508 CarbonylContact O-C 3.53Å; V421-V508 WeakPolarHBondContact O-CA 3.49Å; Q423-V508 HydrophobicContact CB-CG1 3.77Å; L433-V508 HydrophobicContact CD1-CG2 4.36Å; M473-V508 HydrophobicContact SD-CG1 4.14Å; T485-V508 WeakPolarHBondContact CA-O 3.16Å; Y486-V508 PolarHBondContact N-O 2.76Å; Y486-V508 PolarHBondContact O-N 3.06Å; I488-V508 HydrophobicContact CD1-CG2 3.71Å; V506-V508 HydrophobicContact CG1-CG2 4.15Å; V508-L510 HydrophobicContact CG1-CD2 4.24Å; V508-L510 PolarHBondContact O-N 3.16Å
509	H	94.4	Very high	92.3	Very high	44 Å²	44	41.2 Å²	41.2	20%	0.204	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	114.4	172.4	-59.8	-69	0	0	0	109.6	V421 Y422 Q423 T485	V421-H509 PolarHBondContact O-N 2.9Å; Y422-H509 HydrophobicContact CD1-CB 3.75Å; Y422-H509 HydrophobicContact CE1-CB 3.84Å; Y422-H509 AromaticContact CE1-CD2 3.76Å; Y422-H509 AromaticContact CE1-CG 3.92Å; Y422-H509 HydrophobicContact CG-CB 4.42Å; Y422-H509 AromaticContact CZ-CD2 3.6Å; Q423-H509 PolarHBondContact N-O 2.98Å; T485-H509 PolarHBondContact OG1-CE1 3.35Å; T485-H509 VanDerWaalsContact OG1-CE1 3.28Å; T485-H509 PolarHBondContact OG1-ND1 3.34Å
510	L	93.9	Very high	92.5	Very high	10 Å²	10	38.8 Å²	38.8	5%	0.052	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	129.7	179.4	-67.6	173.9	0	0	0	110.6	Q423 W457 M473 R475 V480 S484 V508	Q423-L510 HydrophobicContact CB-CD2 4.25Å; Q423-L510 HydrophobicContact CG-CD2 4.42Å; Q423-L510 CarbonylContact O-C 3.55Å; Q423-L510 WeakPolarHBondContact O-CA 3.12Å; W457-L510 HydrophobicContact CZ3-CD1 4.37Å; M473-L510 HydrophobicContact CB-CD1 4.25Å; M473-L510 HydrophobicContact CB-CD2 3.75Å; M473-L510 HydrophobicContact CG-CD2 4.49Å; M473-L510 HydrophobicContact SD-CD2 4.03Å; R475-L510 HydrophobicContact CB-CB 4.28Å; R475-L510 HydrophobicContact CB-CD1 4.37Å; R475-L510 HydrophobicContact CG-CB 4.11Å; V480-L510 HydrophobicContact CG1-CD1 4.33Å; V480-L510 HydrophobicContact CG2-CD1 3.89Å; S484-L510 PolarHBondContact O-N 2.84Å; V508-L510 HydrophobicContact CG1-CD2 4.24Å; V508-L510 PolarHBondContact O-N 3.16Å
511	R	92	Very high	92.5	Very high	146 Å²	146	42.3 Å²	42.3	55%	0.551	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	125.3	171.7	-63.7	-179.5	179.7	161.3	3.8	110.6	Q423 T424 E425	Q423-R511 PolarHBondContact O-N 2.84Å; T424-R511 HydrophobicContact CG2-CB 4.39Å; E425-R511 PolarHBondContact N-O 2.94Å
512	D	91.1	Very high	92.4	Very high	22 Å²	22	43.6 Å²	43.6	12%	0.118	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-57.3	141.2	179.4	-162.3	54.2	0	0	0	113.8	E425 R475 L544 F547	E425-D512 VanDerWaalsContact OE1-C 3.3Å; E425-D512 WeakPolarHBondContact OE1-CA 3.09Å; R475-D512 IonicContact CZ-OD1 3.73Å; R475-D512 IonicContact NE-OD1 2.72Å; R475-D512 PolarHBondContact NE-OD1 2.81Å; R475-D512 IonicContact NH2-OD1 2.67Å; R475-D512 PolarHBondContact NH2-OD1 3.37Å; D512-L544 HydrophobicContact CB-CB 4.25Å; D512-L544 PolarHBondContact OD1-N 2.78Å; D512-L544 WeakPolarHBondContact OD2-CA 3.4Å; D512-L544 VanDerWaalsContact OD2-CB 3.24Å; D512-L544 WeakPolarHBondContact OD2-CB 3.43Å; D512-L544 PolarHBondContact OD2-N 3.02Å; D512-F547 HydrophobicContact CB-CD2 4.24Å; D512-F547 HydrophobicContact CB-CE2 4.45Å; D512-F547 WeakPolarHBondContact O-CE2 3.39Å; D512-F547 WeakPolarHBondContact OD2-CD2 3.24Å
513	I	91.2	Very high	92.2	Very high	62 Å²	62	47.9 Å²	47.9	32%	0.318	25%	0.245	S	C	.	.			trans	-130.4	149.4	172.1	-72.4	-176.6	0	0	0	109	T424 E425 D515	T424-I513 HydrophobicContact CG2-CD1 3.62Å; T424-I513 HydrophobicContact CG2-CG1 3.95Å; E425-I513 HydrophobicContact CG-CB 4.12Å; E425-I513 HydrophobicContact CG-CD1 4.27Å; E425-I513 HydrophobicContact CG-CG1 4.15Å; E425-I513 PolarHBondContact OE1-N 2.81Å; I513-D515 HydrophobicContact CG2-CB 4.38Å; I513-D515 PolarHBondContact O-N 2.81Å
514	N	90.1	Very high	91.9	Very high	26 Å²	26	48 Å²	48	14%	0.139	25%	0.25	C	C	.	.	S	Bend	trans	-72.5	68.8	172.3	-158.8	-21.3	0	0	0	113.2	D543 F547 D596 Q600	N514-D543 WeakPolarHBondContact CA-OD2 3.4Å; N514-F547 HydrophobicContact CB-CB 4.2Å; N514-F547 HydrophobicContact CB-CD1 3.56Å; N514-F547 HydrophobicContact CB-CE1 4.21Å; N514-F547 HydrophobicContact CB-CG 4.13Å; N514-D596 PolarHBondContact ND2-OD2 3.36Å; N514-D596 PolarHBondContact OD1-OD2 3.06Å; N514-Q600 PolarHBondContact O-NE2 3.29Å; N514-Q600 PolarHBondContact OD1-NE2 3.14Å
515	D	89.3	Confident	91.5	Very high	85 Å²	85	48.6 Å²	48.6	46%	0.455	25%	0.254	S	S	.	.			trans	-96	-27.2	-179.3	142	-70.1	0	0	0	111.6	I513 D543	I513-D515 HydrophobicContact CG2-CB 4.38Å; I513-D515 PolarHBondContact O-N 2.81Å; D515-D543 PolarHBondContact N-OD2 2.62Å
516	N	90.4	Very high	91.1	Very high	29 Å²	29	50.8 Å²	50.8	16%	0.155	26%	0.264	C	S	.	.	S	Bend	trans	-91.3	-159.7	175.3	-67.4	-91.8	0	0	0	112.5	K519 D541 A542 D543 Q600	N516-K519 PolarHBondContact OD1-NZ 2.68Å; N516-K519 VanDerWaalsContact OD1-NZ 3.15Å; N516-D541 WeakPolarHBondContact CB-OD1 3.49Å; N516-A542 HydrophobicContact CB-CB 4.27Å; N516-D543 WeakPolarHBondContact CB-OD1 3.38Å; N516-D543 PolarHBondContact N-OD1 3.01Å; N516-D543 PolarHBondContact N-OD2 2.73Å; N516-D543 VanDerWaalsContact N-OD2 3.16Å; N516-D543 PolarHBondContact ND2-OD1 2.75Å; N516-Q600 PolarHBondContact O-NE2 2.84Å
517	T	91	Very high	90.6	Very high	46 Å²	46	50.9 Å²	50.9	28%	0.282	26%	0.264	S	S	.	.			trans	-167.9	141.3	-167.7	31.8	0	0	0	0	108.9	K519 D541 Q600	T517-K519 WeakPolarHBondContact O-CD 3.4Å; T517-K519 VanDerWaalsContact O-CE 3.32Å; T517-K519 WeakPolarHBondContact O-CE 3.35Å; T517-K519 PolarHBondContact O-N 3.06Å; T517-D541 VanDerWaalsContact C-CG 3.47Å; T517-D541 WeakPolarHBondContact CA-OD2 3.38Å; T517-D541 PolarHBondContact N-OD1 3.15Å; T517-D541 PolarHBondContact N-OD2 3.44Å; T517-Q600 HydrophobicContact CG2-CG 4.01Å
518	P	92.3	Very high	90.1	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.259	C	S	.	.			trans	-67.3	121.3	-170.3	-24.9	33.2	0	0	0	112.3	A539 D541 F551 I594 D596 S602	P518-A539 HydrophobicContact CB-CB 4.37Å; P518-D541 VanDerWaalsContact CA-OD2 3.26Å; P518-D541 WeakPolarHBondContact CA-OD2 3.36Å; P518-D541 WeakPolarHBondContact CD-OD2 3.46Å; P518-D541 VanDerWaalsContact CG-OD2 3.29Å; P518-D541 WeakPolarHBondContact CG-OD2 3.33Å; P518-F551 HydrophobicContact CB-CD1 3.55Å; P518-F551 HydrophobicContact CB-CE1 3.71Å; P518-F551 HydrophobicContact CB-CG 4.38Å; P518-F551 HydrophobicContact CG-CD1 3.47Å; P518-F551 VanDerWaalsContact CG-CD1 3.47Å; P518-F551 HydrophobicContact CG-CE1 3.68Å; P518-I594 HydrophobicContact CB-CB 4.16Å; P518-I594 HydrophobicContact CB-CG2 3.66Å; P518-I594 HydrophobicContact CG-CG2 4.32Å; P518-D596 HydrophobicContact CG-CB 3.92Å; P518-S602 WeakPolarHBondContact O-CB 3.27Å; P518-S602 PolarHBondContact O-OG 2.78Å
519	K	91	Very high	89.1	Confident	88 Å²	88	52.6 Å²	52.6	38%	0.383	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	150.3	-180	-69.7	134.1	-168.6	155.8	0	110.7	N516 T517 L521 A539 K540	N516-K519 PolarHBondContact OD1-NZ 2.68Å; N516-K519 VanDerWaalsContact OD1-NZ 3.15Å; T517-K519 WeakPolarHBondContact O-CD 3.4Å; T517-K519 VanDerWaalsContact O-CE 3.32Å; T517-K519 WeakPolarHBondContact O-CE 3.35Å; T517-K519 PolarHBondContact O-N 3.06Å; K519-L521 PolarHBondContact O-N 3.17Å; K519-A539 CarbonylContact O-C 3.6Å; K519-A539 VanDerWaalsContact O-CA 3.26Å; K519-A539 WeakPolarHBondContact O-CA 3.29Å; K519-K540 PolarHBondContact N-O 2.75Å; K519-K540 PolarHBondContact O-N 2.82Å
520	L	91	Very high	88.3	Confident	18 Å²	18	54.8 Å²	54.8	9%	0.094	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	125.1	174.9	-76.2	178.8	0	0	0	110.5	N522 V537 L592 I594 E604 L606	L520-N522 PolarHBondContact O-N 2.86Å; L520-V537 HydrophobicContact CD2-CG1 3.47Å; L520-V537 VanDerWaalsContact CD2-CG1 3.47Å; L520-L592 HydrophobicContact CD1-CD1 4.35Å; L520-L592 HydrophobicContact CD2-CD1 4.2Å; L520-I594 HydrophobicContact CD2-CD1 3.64Å; L520-I594 HydrophobicContact CG-CD1 3.93Å; L520-E604 HydrophobicContact CD1-CB 3.84Å; L520-E604 HydrophobicContact CD1-CG 4.42Å; L520-E604 HydrophobicContact CG-CB 3.84Å; L520-E604 HydrophobicContact CG-CG 3.99Å; L520-E604 PolarHBondContact N-OE1 2.86Å; L520-L606 HydrophobicContact CD1-CB 4.14Å; L520-L606 HydrophobicContact CD1-CD1 4.31Å
521	L	89.8	Confident	87.3	Confident	98 Å²	98	58.7 Å²	58.7	51%	0.513	31%	0.308	S	S	.	.	S	Bend	trans	-65.4	-33	175.6	-170.3	152.3	0	0	0	111.2	K519 R538	K519-L521 PolarHBondContact O-N 3.17Å; L521-R538 HydrophobicContact CB-CB 4.15Å; L521-R538 PolarHBondContact N-O 3.42Å
522	N	89	Confident	86.6	Confident	102 Å²	102	54 Å²	54	55%	0.545	30%	0.301	S	S	.	.			trans	-131	118.1	168.3	-70.7	-61.2	0	0	0	109.5	L520 S524 L606	L520-N522 PolarHBondContact O-N 2.86Å; N522-S524 VanDerWaalsContact C-N 3.28Å; N522-S524 PolarHBondContact O-N 2.77Å; N522-L606 WeakPolarHBondContact O-CD1 3.06Å
523	N	88.1	Confident	86.1	Confident	106 Å²	106	56.2 Å²	56.2	57%	0.567	31%	0.312	S	S	*	.	S	Bend	trans	-83.7	0.6	176.3	67.5	6.9	0	0	0	113.7	S607	N523-S607 PolarHBondContact O-N 3.3Å
524	S	88.5	Confident	85.9	Confident	74 Å²	74	58 Å²	58	52%	0.517	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	142.9	175.2	68	0	0	0	0	111.7	N522 S607	N522-S524 VanDerWaalsContact C-N 3.28Å; N522-S524 PolarHBondContact O-N 2.77Å; S524-S607 CarbonylContact C-O 3.58Å; S524-S607 WeakPolarHBondContact CA-O 3.37Å
525	A	87.1	Confident	85.8	Confident	12 Å²	12	57.9 Å²	57.9	10%	0.099	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	148.9	-177.7	0	0	0	0	0	110.3	V535 L606 S607 V608 V609	A525-V535 HydrophobicContact CB-CG1 4.14Å; A525-V535 HydrophobicContact CB-CG2 3.86Å; A525-L606 HydrophobicContact CB-CD1 3.98Å; A525-L606 HydrophobicContact CB-CD2 4.12Å; A525-L606 HydrophobicContact CB-CG 4.16Å; A525-S607 PolarHBondContact N-O 2.58Å; A525-V608 HydrophobicContact CB-CG2 4.35Å; A525-V608 CarbonylContact O-C 3.58Å; A525-V608 WeakPolarHBondContact O-CA 2.97Å; A525-V609 PolarHBondContact O-N 2.98Å
526	I	85.9	Confident	85.8	Confident	73 Å²	73	58 Å²	58	37%	0.374	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	121.6	176	-63.5	172.4	0	0	0	108	V609 G617	I526-V609 HydrophobicContact CG1-CB 4.33Å; I526-G617 WeakPolarHBondContact CD1-O 3.13Å
527	L	85.9	Confident	85.8	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.01	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	107	179.3	-178.4	56.1	0	0	0	109.8	S529 A532 K534 W565 L579 V608 V609 L610 C611	L527-S529 PolarHBondContact O-N 3.26Å; L527-S529 VanDerWaalsContact O-N 3.17Å; L527-A532 HydrophobicContact CD1-CB 4.41Å; L527-A532 WeakPolarHBondContact CD1-O 3.21Å; L527-K534 WeakPolarHBondContact CD1-O 3.16Å; L527-W565 HydrophobicContact CD2-CH2 4.07Å; L527-W565 HydrophobicContact CD2-CZ3 3.79Å; L527-L579 HydrophobicContact CD2-CB 4.05Å; L527-L579 HydrophobicContact CD2-CD2 4.3Å; L527-V608 HydrophobicContact CB-CG1 3.81Å; L527-V609 PolarHBondContact N-O 3.45Å; L527-L610 HydrophobicContact CB-CD1 3.97Å; L527-L610 HydrophobicContact CD2-CD1 3.77Å; L527-L610 HydrophobicContact CG-CD1 3.74Å; L527-C611 PolarHBondContact O-N 2.95Å
528	C	84	Confident	85.8	Confident	8 Å²	8	61 Å²	61	5%	0.054	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	97.4	-179	-64.4	0	0	0	0	110.7	N530 E531 A532 C611 C613 G617	C528-N530 PolarHBondContact O-N 3.08Å; C528-E531 HydrophobicContact CB-CB 3.87Å; C528-E531 HydrophobicContact CB-CG 4.35Å; C528-E531 PolarHBondContact O-N 3.44Å; C528-A532 PolarHBondContact O-N 3.32Å; C528-C611 WeakPolarHBondContact CA-O 3.3Å; C528-C613 WeakPolarHBondContact CA-SG 3.43Å; C528-C613 HydrophobicContact CB-CB 3.56Å; C528-C613 WeakPolarHBondContact CB-SG 3.24Å; C528-C613 WeakPolarHBondContact SG-CB 3.24Å; C528-C613 CovalentContact SG-SG 2.03Å; C528-C613 PolarHBondContact SG-SG 3.26Å; C528-G617 PolarHBondContact SG-N 3.07Å; C528-G617 VanDerWaalsContact SG-N 3.35Å
529	S	76.1	Confident	85.7	Confident	54 Å²	54	61.3 Å²	61.3	38%	0.378	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-6.6	-172.6	59.2	0	0	0	0	114.9	L527 N585 C611 N612	L527-S529 PolarHBondContact O-N 3.26Å; L527-S529 VanDerWaalsContact O-N 3.17Å; S529-N585 PolarHBondContact OG-OD1 2.86Å; S529-C611 PolarHBondContact N-O 3.11Å; S529-C611 PolarHBondContact OG-O 3.43Å; S529-N612 PolarHBondContact OG-OD1 3.35Å
530	N	76.1	Confident	85.7	Confident	89 Å²	89	61.3 Å²	61.3	48%	0.476	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-8.1	173.4	61.2	-56.6	0	0	0	114.7	C528 N612 C613	C528-N530 PolarHBondContact O-N 3.08Å; N530-N612 WeakPolarHBondContact OD1-CA 3.49Å; N530-C613 PolarHBondContact ND2-O 3.08Å; N530-C613 VanDerWaalsContact ND2-O 3.09Å; N530-C613 PolarHBondContact OD1-N 2.82Å
531	E	72.8	Confident	85.8	Confident	92 Å²	92	60.7 Å²	60.7	43%	0.43	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.1	-34.2	-172.8	-67.4	171.7	-171.5	0	0	113.3	C528 P616	C528-E531 HydrophobicContact CB-CB 3.87Å; C528-E531 HydrophobicContact CB-CG 4.35Å; C528-E531 PolarHBondContact O-N 3.44Å; E531-P616 WeakPolarHBondContact OE2-CA 3.41Å
532	A	78.4	Confident	85.8	Confident	49 Å²	49	57.4 Å²	57.4	41%	0.405	31%	0.307	S	S	.	.			trans	-146.7	150.8	-177.5	0	0	0	0	0	112.8	L527 C528	L527-A532 HydrophobicContact CD1-CB 4.41Å; L527-A532 WeakPolarHBondContact CD1-O 3.21Å; C528-A532 PolarHBondContact O-N 3.32Å
533	D	81.3	Confident	85.9	Confident	67 Å²	67	52.8 Å²	52.8	36%	0.358	28%	0.283	S	S	.	.	S	Bend	trans	-101	1.4	173.1	70.6	-21.6	0	0	0	113.3	R578 L579	D533-R578 WeakPolarHBondContact O-CA 3.2Å; D533-R578 IonicContact OD1-NE 3.78Å; D533-R578 IonicContact OD2-CZ 2.83Å; D533-R578 VanDerWaalsContact OD2-CZ 3.22Å; D533-R578 IonicContact OD2-NE 2.95Å; D533-R578 PolarHBondContact OD2-NE 3.4Å; D533-R578 IonicContact OD2-NH2 2.83Å; D533-R578 PolarHBondContact OD2-NH2 3.18Å; D533-L579 PolarHBondContact O-N 3.42Å
534	K	86.1	Confident	86	Confident	100 Å²	100	50.3 Å²	50.3	44%	0.435	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	154.3	-178.6	69.3	-176.2	-164.9	161.6	0	112.7	L527 I577 R578	L527-K534 WeakPolarHBondContact CD1-O 3.16Å; K534-I577 CarbonylContact C-O 3.46Å; K534-I577 VanDerWaalsContact CA-O 3.26Å; K534-I577 WeakPolarHBondContact CA-O 3.48Å; K534-R578 HydrophobicContact CB-CB 4.06Å; K534-R578 HydrophobicContact CB-CG 4.19Å
535	V	88.6	Confident	85.8	Confident	23 Å²	23	52.3 Å²	52.3	14%	0.139	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	142.8	171.7	68.9	0	0	0	0	110.6	A525 V537 S576 I577	A525-V535 HydrophobicContact CB-CG1 4.14Å; A525-V535 HydrophobicContact CB-CG2 3.86Å; V535-V537 HydrophobicContact CG1-CG2 4.39Å; V535-S576 CarbonylContact O-C 3.56Å; V535-S576 WeakPolarHBondContact O-CA 3.48Å; V535-I577 HydrophobicContact CG1-CB 4.41Å; V535-I577 PolarHBondContact N-O 2.89Å; V535-I577 PolarHBondContact O-N 2.72Å
536	M	88.1	Confident	85.9	Confident	88 Å²	88	54.6 Å²	54.6	43%	0.433	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	142.1	177.9	-52.8	-53.9	-55.4	0	0	110.5	E574 V575 S576	M536-E574 HydrophobicContact CB-CG 4.06Å; M536-E574 VanDerWaalsContact CB-OE1 3.31Å; M536-E574 WeakPolarHBondContact CB-OE1 3.09Å; M536-E574 HydrophobicContact CE-CG 3.75Å; M536-V575 WeakPolarHBondContact CA-O 3.42Å; M536-S576 WeakPolarHBondContact SD-CB 3.16Å
537	V	90.3	Very high	86	Confident	6 Å²	6	53.5 Å²	53.5	4%	0.036	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	126.8	-174.6	-176.5	0	0	0	0	108.9	L520 V535 E574 V575 I577 L592 L606	L520-V537 HydrophobicContact CD2-CG1 3.47Å; L520-V537 VanDerWaalsContact CD2-CG1 3.47Å; V535-V537 HydrophobicContact CG1-CG2 4.39Å; V537-E574 WeakPolarHBondContact O-CA 3.34Å; V537-V575 HydrophobicContact CB-CG2 4.37Å; V537-V575 PolarHBondContact N-O 3.31Å; V537-V575 PolarHBondContact O-N 3.48Å; V537-I577 HydrophobicContact CB-CD1 4.47Å; V537-I577 HydrophobicContact CG2-CB 4.46Å; V537-I577 HydrophobicContact CG2-CD1 3.78Å; V537-I577 HydrophobicContact CG2-CG1 3.81Å; V537-L592 HydrophobicContact CG1-CD1 4.42Å; V537-L606 HydrophobicContact CG1-CD2 4.47Å; V537-L606 HydrophobicContact CG2-CD2 3.58Å
538	R	91.1	Very high	86.1	Confident	133 Å²	133	54.5 Å²	54.5	50%	0.502	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	134.7	-180	-62.4	-178.9	-176.6	-146.2	-16.6	110.1	L521 E574	L521-R538 HydrophobicContact CB-CB 4.15Å; L521-R538 PolarHBondContact N-O 3.42Å; R538-E574 HydrophobicContact CG-CB 3.94Å; R538-E574 HydrophobicContact CG-CG 3.74Å; R538-E574 WeakPolarHBondContact CG-OE1 3.25Å; R538-E574 IonicContact CZ-OE1 2.75Å; R538-E574 IonicContact CZ-OE2 3.55Å; R538-E574 IonicContact NE-OE1 3.5Å; R538-E574 PolarHBondContact NE-OE1 3.15Å; R538-E574 IonicContact NE-OE2 3.09Å; R538-E574 PolarHBondContact NE-OE2 2.69Å; R538-E574 VanDerWaalsContact NH2-CD 3.34Å; R538-E574 IonicContact NH2-OE1 2.68Å; R538-E574 PolarHBondContact NH2-OE1 2.75Å; R538-E574 IonicContact NH2-OE2 2.6Å; R538-E574 PolarHBondContact NH2-OE2 2.63Å
539	A	91.1	Very high	86.1	Confident	6 Å²	6	54.4 Å²	54.4	5%	0.05	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	166.6	161.7	0	0	0	0	0	109.6	P518 K519 F551 F553 I594	P518-A539 HydrophobicContact CB-CB 4.37Å; K519-A539 CarbonylContact O-C 3.6Å; K519-A539 VanDerWaalsContact O-CA 3.26Å; K519-A539 WeakPolarHBondContact O-CA 3.29Å; A539-F551 HydrophobicContact CB-CD2 3.71Å; A539-F551 HydrophobicContact CB-CE2 4.02Å; A539-F551 HydrophobicContact CB-CG 4Å; A539-F553 HydrophobicContact CB-CE1 4.14Å; A539-F553 HydrophobicContact CB-CE2 4.48Å; A539-F553 HydrophobicContact CB-CZ 3.59Å; A539-I594 HydrophobicContact CB-CD1 4.28Å; A539-I594 HydrophobicContact CB-CG2 4.06Å
540	K	91.2	Very high	86.8	Confident	87 Å²	87	53.4 Å²	53.4	38%	0.378	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	141.5	163.5	171.9	157	-175.9	156.5	0	108.4	K519 S781	K519-K540 PolarHBondContact N-O 2.75Å; K519-K540 PolarHBondContact O-N 2.82Å; K540-S781 PolarHBondContact NZ-OG 3.13Å
541	D	91.8	Very high	87.5	Confident	5 Å²	5	49.2 Å²	49.2	3%	0.027	25%	0.254	C	S	.	.			trans	-100.2	169.6	162.8	-126.4	-43.9	0	0	0	112.5	N516 T517 P518 F551	N516-D541 WeakPolarHBondContact CB-OD1 3.49Å; T517-D541 VanDerWaalsContact C-CG 3.47Å; T517-D541 WeakPolarHBondContact CA-OD2 3.38Å; T517-D541 PolarHBondContact N-OD1 3.15Å; T517-D541 PolarHBondContact N-OD2 3.44Å; P518-D541 VanDerWaalsContact CA-OD2 3.26Å; P518-D541 WeakPolarHBondContact CA-OD2 3.36Å; P518-D541 WeakPolarHBondContact CD-OD2 3.46Å; P518-D541 VanDerWaalsContact CG-OD2 3.29Å; P518-D541 WeakPolarHBondContact CG-OD2 3.33Å; D541-F551 HydrophobicContact CB-CE1 4.17Å; D541-F551 HydrophobicContact CB-CZ 4.34Å
542	A	90	Very high	88.3	Confident	29 Å²	29	45.7 Å²	45.7	24%	0.24	24%	0.242	C	C	.	.	S	Bend	trans	-89.4	-38.1	172.3	0	0	0	0	0	111.1	R475 E476 N516	R475-A542 PolarHBondContact NH2-O 2.77Å; E476-A542 HydrophobicContact CB-CB 4.28Å; E476-A542 HydrophobicContact CG-CB 3.37Å; N516-A542 HydrophobicContact CB-CB 4.27Å
543	D	91.6	Very high	88.9	Confident	5 Å²	5	43.6 Å²	43.6	3%	0.027	22%	0.224	C	C	.	.	S	Bend	trans	-56.4	159.6	174	-50.7	-1.4	0	0	0	112.7	N514 D515 N516 F547 S548	N514-D543 WeakPolarHBondContact CA-OD2 3.4Å; D515-D543 PolarHBondContact N-OD2 2.62Å; N516-D543 WeakPolarHBondContact CB-OD1 3.38Å; N516-D543 PolarHBondContact N-OD1 3.01Å; N516-D543 PolarHBondContact N-OD2 2.73Å; N516-D543 VanDerWaalsContact N-OD2 3.16Å; N516-D543 PolarHBondContact ND2-OD1 2.75Å; D543-F547 HydrophobicContact CB-CB 4.04Å; D543-S548 WeakPolarHBondContact O-CB 3.44Å; D543-S548 PolarHBondContact O-OG 3.01Å
544	L	89.4	Confident	89.3	Confident	54 Å²	54	42.6 Å²	42.6	28%	0.283	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-96.5	166.9	-175.8	-168.9	58.2	0	0	0	112.4	D512 F547 S548 L783	D512-L544 HydrophobicContact CB-CB 4.25Å; D512-L544 PolarHBondContact OD1-N 2.78Å; D512-L544 WeakPolarHBondContact OD2-CA 3.4Å; D512-L544 VanDerWaalsContact OD2-CB 3.24Å; D512-L544 WeakPolarHBondContact OD2-CB 3.43Å; D512-L544 PolarHBondContact OD2-N 3.02Å; L544-F547 CarbonylContact O-C 3.57Å; L544-F547 WeakPolarHBondContact O-CA 3.33Å; L544-F547 PolarHBondContact O-N 3.37Å; L544-S548 WeakPolarHBondContact O-CB 3.41Å; L544-S548 PolarHBondContact O-N 2.8Å; L544-L783 HydrophobicContact CD1-CD1 3.46Å; L544-L783 VanDerWaalsContact CD1-CD1 3.46Å; L544-L783 HydrophobicContact CD2-CD1 3.78Å; L544-L783 HydrophobicContact CG-CD1 4.29Å
545	E	85.7	Confident	89.5	Confident	117 Å²	117	38.7 Å²	38.7	55%	0.547	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	120.5	166.4	169.3	74	-104.1	0	0	109	K597	E545-K597 IonicContact OE1-NZ 3.81Å; E545-K597 PolarHBondContact OE1-NZ 3.37Å; E545-K597 IonicContact OE2-NZ 3.78Å; E545-K597 PolarHBondContact OE2-NZ 3.47Å; E545-K597 VanDerWaalsContact OE2-NZ 3.09Å
546	P	87.7	Confident	89.4	Confident	60 Å²	60	38.9 Å²	38.9	39%	0.39	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	cis	-112	19.3	22.9	43.6	-36.9	0	0	0	115.7	Q598	P546-Q598 PolarHBondContact O-NE2 3.02Å
547	F	88.8	Confident	88.9	Confident	49 Å²	49	41.8 Å²	41.8	22%	0.215	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-26.3	176.3	-59.8	-70.7	0	0	0	112.1	D512 N514 D543 L544 D596 Q598	D512-F547 HydrophobicContact CB-CD2 4.24Å; D512-F547 HydrophobicContact CB-CE2 4.45Å; D512-F547 WeakPolarHBondContact O-CE2 3.39Å; D512-F547 WeakPolarHBondContact OD2-CD2 3.24Å; N514-F547 HydrophobicContact CB-CB 4.2Å; N514-F547 HydrophobicContact CB-CD1 3.56Å; N514-F547 HydrophobicContact CB-CE1 4.21Å; N514-F547 HydrophobicContact CB-CG 4.13Å; D543-F547 HydrophobicContact CB-CB 4.04Å; L544-F547 CarbonylContact O-C 3.57Å; L544-F547 WeakPolarHBondContact O-CA 3.33Å; L544-F547 PolarHBondContact O-N 3.37Å; F547-D596 WeakPolarHBondContact O-CB 3.2Å; F547-Q598 HydrophobicContact CD1-CG 4.49Å
548	S	87.9	Confident	88.4	Confident	24 Å²	24	44.4 Å²	44.4	17%	0.168	24%	0.241	C	C	.	.	S	Bend	trans	-72.7	-152.5	174.5	-145.2	0	0	0	0	114.2	D543 L544 K597	D543-S548 WeakPolarHBondContact O-CB 3.44Å; D543-S548 PolarHBondContact O-OG 3.01Å; L544-S548 WeakPolarHBondContact O-CB 3.41Å; L544-S548 PolarHBondContact O-N 2.8Å; S548-K597 WeakPolarHBondContact O-CB 3.39Å; S548-K597 PolarHBondContact O-N 2.87Å
549	G	85.1	Confident	87.6	Confident	6 Å²	6	46.2 Å²	46.2	6%	0.062	25%	0.253	C	S	.	.			trans	-63.5	174	176.3	0	0	0	0	0	115.4
550	P	88.9	Confident	87	Confident	33 Å²	33	48.5 Å²	48.5	21%	0.214	27%	0.267	C	S	.	.	S	Bend	cis	-77.8	148.7	5.6	-10.3	26.3	0	0	0	113.5	Y571 E573	P550-Y571 HydrophobicContact CB-CD1 4.46Å; P550-Y571 HydrophobicContact CB-CE1 3.8Å; P550-Y571 HydrophobicContact CB-CE2 4.33Å; P550-Y571 HydrophobicContact CG-CE1 4.11Å; P550-Y571 VanDerWaalsContact O-CE2 3.23Å; P550-Y571 WeakPolarHBondContact O-CE2 3.35Å; P550-E573 WeakPolarHBondContact CA-OE1 3.19Å
551	F	91.3	Very high	86.6	Confident	1 Å²	1	45 Å²	45	0%	0.004	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	140.8	-167.9	-50.8	-75.8	0	0	0	112.6	P518 A539 D541 F553 Y571 G572 E573 I594 Q595	P518-F551 HydrophobicContact CB-CD1 3.55Å; P518-F551 HydrophobicContact CB-CE1 3.71Å; P518-F551 HydrophobicContact CB-CG 4.38Å; P518-F551 HydrophobicContact CG-CD1 3.47Å; P518-F551 VanDerWaalsContact CG-CD1 3.47Å; P518-F551 HydrophobicContact CG-CE1 3.68Å; A539-F551 HydrophobicContact CB-CD2 3.71Å; A539-F551 HydrophobicContact CB-CE2 4.02Å; A539-F551 HydrophobicContact CB-CG 4Å; D541-F551 HydrophobicContact CB-CE1 4.17Å; D541-F551 HydrophobicContact CB-CZ 4.34Å; F551-F553 HydrophobicContact CB-CD2 4.13Å; F551-F553 HydrophobicContact CB-CE2 3.69Å; F551-F553 HydrophobicContact CB-CZ 4.33Å; F551-Y571 CarbonylContact O-C 3.57Å; F551-Y571 VanDerWaalsContact O-CA 3.29Å; F551-Y571 WeakPolarHBondContact O-CA 3.27Å; F551-G572 PolarHBondContact N-O 3.45Å; F551-G572 VanDerWaalsContact N-O 3.09Å; F551-G572 PolarHBondContact O-N 2.58Å; F551-E573 WeakPolarHBondContact CE2-OE2 3.32Å; F551-I594 HydrophobicContact CB-CG2 3.88Å; F551-I594 HydrophobicContact CG-CG2 4.38Å; F551-Q595 CarbonylContact C-O 3.59Å; F551-Q595 WeakPolarHBondContact CA-O 3.41Å; F551-Q595 WeakPolarHBondContact CB-O 3.29Å
552	G	90.6	Very high	86	Confident	17 Å²	17	49.2 Å²	49.2	18%	0.175	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	126.5	165.2	0	0	0	0	0	110.8	I594 Q595	G552-I594 CarbonylContact O-C 3.54Å; G552-I594 WeakPolarHBondContact O-CA 3.28Å; G552-Q595 PolarHBondContact N-O 2.93Å; G552-Q595 PolarHBondContact O-N 2.9Å
553	F	91.1	Very high	85.7	Confident	5 Å²	5	53.9 Å²	53.9	2%	0.022	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	124.4	-179.2	-74.4	-98.2	0	0	0	111.3	A539 F551 I567 E570 G572 V575 I594	A539-F553 HydrophobicContact CB-CE1 4.14Å; A539-F553 HydrophobicContact CB-CE2 4.48Å; A539-F553 HydrophobicContact CB-CZ 3.59Å; F551-F553 HydrophobicContact CB-CD2 4.13Å; F551-F553 HydrophobicContact CB-CE2 3.69Å; F551-F553 HydrophobicContact CB-CZ 4.33Å; F553-I567 HydrophobicContact CB-CD1 4.09Å; F553-I567 HydrophobicContact CB-CG2 4.05Å; F553-E570 PolarHBondContact N-O 3.05Å; F553-G572 WeakPolarHBondContact CE2-O 3.36Å; F553-V575 HydrophobicContact CB-CG1 4.22Å; F553-V575 HydrophobicContact CB-CG2 4.04Å; F553-V575 HydrophobicContact CD1-CG2 3.67Å; F553-V575 HydrophobicContact CD2-CB 4.17Å; F553-V575 HydrophobicContact CD2-CG1 3.33Å; F553-V575 HydrophobicContact CD2-CG2 3.72Å; F553-V575 HydrophobicContact CE1-CG2 3.89Å; F553-V575 HydrophobicContact CE2-CB 4.43Å; F553-V575 HydrophobicContact CE2-CG1 3.71Å; F553-V575 HydrophobicContact CE2-CG2 3.91Å; F553-V575 HydrophobicContact CG-CB 4.36Å; F553-V575 HydrophobicContact CG-CG1 3.91Å; F553-V575 HydrophobicContact CG-CG2 3.56Å; F553-V575 HydrophobicContact CZ-CG2 3.99Å; F553-I594 HydrophobicContact CD1-CD1 4.31Å; F553-I594 HydrophobicContact CD1-CG1 3.96Å; F553-I594 HydrophobicContact CD1-CG2 4.08Å; F553-I594 HydrophobicContact CE1-CD1 3.85Å; F553-I594 HydrophobicContact CE1-CG1 4Å; F553-I594 HydrophobicContact CE1-CG2 3.92Å; F553-I594 HydrophobicContact CE2-CG2 4.46Å; F553-I594 HydrophobicContact CG-CG2 4.43Å; F553-I594 HydrophobicContact CZ-CG2 4.14Å
554	S	89.5	Confident	85.3	Confident	47 Å²	47	57 Å²	57	33%	0.329	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	150.7	173.9	65.5	0	0	0	0	112.5	V593	S554-V593 PolarHBondContact N-O 3.43Å; S554-V593 PolarHBondContact O-N 2.79Å; S554-V593 PolarHBondContact OG-O 3.22Å
555	L	89.5	Confident	85.2	Confident	18 Å²	18	54.6 Å²	54.6	9%	0.094	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	135.8	170.2	-67.3	169.2	0	0	0	109.4	K562 W565 I567 V590 L592	L555-K562 HydrophobicContact CB-CG 4.18Å; L555-K562 HydrophobicContact CD1-CG 4.09Å; L555-K562 WeakPolarHBondContact O-CE 2.94Å; L555-W565 HydrophobicContact CD1-CB 4.11Å; L555-W565 VanDerWaalsContact CD1-O 3.22Å; L555-W565 WeakPolarHBondContact CD1-O 3.4Å; L555-W565 HydrophobicContact CD2-CB 4.3Å; L555-I567 HydrophobicContact CD2-CD1 4.19Å; L555-I567 HydrophobicContact CD2-CG1 4.28Å; L555-I567 HydrophobicContact CG-CD1 4.02Å; L555-I567 HydrophobicContact CG-CG1 4.06Å; L555-V590 HydrophobicContact CD2-CG1 3.68Å; L555-L592 HydrophobicContact CD2-CD2 3.97Å
556	A	86	Confident	85.4	Confident	27 Å²	27	53 Å²	53	22%	0.223	28%	0.277	C	S	.	.			trans	-54.1	152.3	171.3	0	0	0	0	0	111.2	D558 P591	A556-D558 PolarHBondContact O-N 3.1Å; A556-P591 HydrophobicContact CB-CB 3.92Å; A556-P591 HydrophobicContact CB-CG 3.97Å; A556-P591 PolarHBondContact N-O 2.82Å; A556-P591 VanDerWaalsContact N-O 3.16Å
557	D	78	Confident	85.5	Confident	149 Å²	149	50.5 Å²	50.5	80%	0.797	26%	0.26	S	S	*	.	S	Bend	trans	-81.1	59.7	-159	-153	27.4	0	0	0	115	K562	D557-K562 IonicContact OD1-NZ 3.19Å; D557-K562 PolarHBondContact OD1-NZ 3.29Å
558	D	79.7	Confident	85.4	Confident	61 Å²	61	51.1 Å²	51.1	33%	0.326	26%	0.263	S	S	.	.			trans	-110.7	122.1	170	172.1	10.1	0	0	0	109.4	A556 T560 L561 K562 R564	A556-D558 PolarHBondContact O-N 3.1Å; D558-T560 PolarHBondContact O-N 2.95Å; D558-T560 WeakPolarHBondContact OD1-CB 3.12Å; D558-T560 WeakPolarHBondContact OD1-CG2 2.94Å; D558-T560 PolarHBondContact OD1-N 3.07Å; D558-T560 PolarHBondContact OD1-OG1 3Å; D558-T560 VanDerWaalsContact OD1-OG1 3.05Å; D558-T560 PolarHBondContact OD2-OG1 2.93Å; D558-L561 HydrophobicContact CB-CB 4.18Å; D558-L561 HydrophobicContact CB-CD1 4.01Å; D558-L561 HydrophobicContact CB-CG 4.14Å; D558-L561 PolarHBondContact O-N 3.32Å; D558-L561 VanDerWaalsContact O-N 3.14Å; D558-K562 PolarHBondContact O-N 2.97Å; D558-R564 IonicContact OD2-NH2 2.69Å
559	K	75.8	Confident	85.3	Confident	170 Å²	170	53.7 Å²	53.7	74%	0.739	28%	0.279	S	S	*	.	H	α-helix	trans	-55.2	-39.5	176.1	-65.7	-179.6	179.1	-179	0	111.9	L561 K562 E563	K559-L561 VanDerWaalsContact C-N 3.32Å; K559-L561 PolarHBondContact O-N 2.72Å; K559-K562 PolarHBondContact O-N 2.83Å; K559-E563 WeakPolarHBondContact O-CG 3.38Å; K559-E563 PolarHBondContact O-N 2.83Å
560	T	78.3	Confident	85.3	Confident	55 Å²	55	59.8 Å²	59.8	34%	0.337	31%	0.306	S	S	.	.	H	α-helix	trans	-73	-25.4	-177	85	0	0	0	0	112.3	D558 R564	D558-T560 PolarHBondContact O-N 2.95Å; D558-T560 WeakPolarHBondContact OD1-CB 3.12Å; D558-T560 WeakPolarHBondContact OD1-CG2 2.94Å; D558-T560 PolarHBondContact OD1-N 3.07Å; D558-T560 PolarHBondContact OD1-OG1 3Å; D558-T560 VanDerWaalsContact OD1-OG1 3.05Å; D558-T560 PolarHBondContact OD2-OG1 2.93Å; T560-R564 VanDerWaalsContact C-CZ 3.47Å; T560-R564 WeakPolarHBondContact O-CG 3.36Å; T560-R564 PolarHBondContact O-N 3.17Å; T560-R564 PolarHBondContact O-NE 3.45Å; T560-R564 PolarHBondContact O-NH1 3.11Å; T560-R564 PolarHBondContact O-NH2 2.86Å; T560-R564 PolarHBondContact OG1-NH1 3.32Å; T560-R564 PolarHBondContact OG1-NH2 3.5Å
561	L	81.8	Confident	85.3	Confident	12 Å²	12	64 Å²	64	6%	0.063	32%	0.319	C	S	.	.	H	α-helix	trans	-73.5	-42.9	170.4	-77.8	173.6	0	0	0	111.4	D558 K559 E563 R564 W565 P591	D558-L561 HydrophobicContact CB-CB 4.18Å; D558-L561 HydrophobicContact CB-CD1 4.01Å; D558-L561 HydrophobicContact CB-CG 4.14Å; D558-L561 PolarHBondContact O-N 3.32Å; D558-L561 VanDerWaalsContact O-N 3.14Å; K559-L561 VanDerWaalsContact C-N 3.32Å; K559-L561 PolarHBondContact O-N 2.72Å; L561-E563 PolarHBondContact O-N 3.02Å; L561-R564 PolarHBondContact O-N 2.85Å; L561-W565 PolarHBondContact O-N 2.71Å; L561-P591 HydrophobicContact CD1-CG 3.41Å; L561-P591 VanDerWaalsContact CD1-CG 3.41Å
562	K	79.6	Confident	85.1	Confident	95 Å²	95	64.8 Å²	64.8	41%	0.413	33%	0.327	S	S	.	.	H	α-helix	trans	-67.9	-19.3	178.2	-65.5	176	179	-178.6	0	113.3	L555 D557 D558 K559	L555-K562 HydrophobicContact CB-CG 4.18Å; L555-K562 HydrophobicContact CD1-CG 4.09Å; L555-K562 WeakPolarHBondContact O-CE 2.94Å; D557-K562 IonicContact OD1-NZ 3.19Å; D557-K562 PolarHBondContact OD1-NZ 3.29Å; D558-K562 PolarHBondContact O-N 2.97Å; K559-K562 PolarHBondContact O-N 2.83Å
563	E	82.6	Confident	84.9	Confident	127 Å²	127	68.8 Å²	68.8	59%	0.593	34%	0.341	S	S	*	.	H	α-helix	trans	-79.8	-27.7	168.3	-74.5	167.4	-174	0	0	113.7	K559 L561	K559-E563 WeakPolarHBondContact O-CG 3.38Å; K559-E563 PolarHBondContact O-N 2.83Å; L561-E563 PolarHBondContact O-N 3.02Å
564	R	84.6	Confident	84.8	Confident	69 Å²	69	71.7 Å²	71.7	26%	0.26	35%	0.354	S	S	.	.	H	α-helix	trans	-93.8	-37.2	-176.7	-72.3	-175.3	-64.4	-93	0.7	113.2	D558 T560 L561 L580 L583	D558-R564 IonicContact OD2-NH2 2.69Å; T560-R564 VanDerWaalsContact C-CZ 3.47Å; T560-R564 WeakPolarHBondContact O-CG 3.36Å; T560-R564 PolarHBondContact O-N 3.17Å; T560-R564 PolarHBondContact O-NE 3.45Å; T560-R564 PolarHBondContact O-NH1 3.11Å; T560-R564 PolarHBondContact O-NH2 2.86Å; T560-R564 PolarHBondContact OG1-NH1 3.32Å; T560-R564 PolarHBondContact OG1-NH2 3.5Å; L561-R564 PolarHBondContact O-N 2.85Å; R564-L580 PolarHBondContact O-N 2.92Å; R564-L583 HydrophobicContact CG-CD2 4.35Å
565	W	87.6	Confident	84.9	Confident	4 Å²	4	69.4 Å²	69.4	2%	0.015	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	150.5	-171.4	-56.5	101.4	0	0	0	111.1	L527 L555 L561 I577 R578 L579 L583 Y588 V590 V608	L527-W565 HydrophobicContact CD2-CH2 4.07Å; L527-W565 HydrophobicContact CD2-CZ3 3.79Å; L555-W565 HydrophobicContact CD1-CB 4.11Å; L555-W565 VanDerWaalsContact CD1-O 3.22Å; L555-W565 WeakPolarHBondContact CD1-O 3.4Å; L555-W565 HydrophobicContact CD2-CB 4.3Å; L561-W565 PolarHBondContact O-N 2.71Å; W565-I577 HydrophobicContact CB-CG2 4.33Å; W565-I577 HydrophobicContact CD2-CG2 4.39Å; W565-I577 HydrophobicContact CE3-CG2 3.82Å; W565-R578 CarbonylContact C-O 3.34Å; W565-R578 VanDerWaalsContact CA-O 3.31Å; W565-R578 WeakPolarHBondContact CA-O 3.33Å; W565-L579 HydrophobicContact CD2-CD1 4.15Å; W565-L579 HydrophobicContact CE3-CB 4.12Å; W565-L579 HydrophobicContact CE3-CD1 3.91Å; W565-L579 HydrophobicContact CH2-CD1 3.81Å; W565-L579 HydrophobicContact CZ2-CD1 4.02Å; W565-L579 HydrophobicContact CZ3-CB 3.87Å; W565-L579 HydrophobicContact CZ3-CD1 3.75Å; W565-L579 HydrophobicContact CZ3-CG 4.37Å; W565-L583 HydrophobicContact CZ2-CD1 4.24Å; W565-Y588 HydrophobicContact CZ2-CG 4.39Å; W565-V590 HydrophobicContact CD2-CG2 4.09Å; W565-V590 HydrophobicContact CG-CG2 4.36Å; W565-V590 HydrophobicContact CZ2-CG2 3.94Å; W565-V608 HydrophobicContact CH2-CB 4.16Å; W565-V608 HydrophobicContact CH2-CG1 3.8Å; W565-V608 HydrophobicContact CH2-CG2 4.42Å; W565-V608 HydrophobicContact CZ3-CG1 4.45Å
566	K	88.8	Confident	84.8	Confident	85 Å²	85	68.9 Å²	68.9	37%	0.37	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	146.3	170.2	-170.2	-177.6	175.6	-163	0	109.7	E568 I577 R578 L580	K566-E568 HydrophobicContact CD-CG 3.88Å; K566-E568 WeakPolarHBondContact CD-OE1 3.48Å; K566-E568 WeakPolarHBondContact CE-OE1 3.23Å; K566-E568 HydrophobicContact CG-CG 4.08Å; K566-E568 IonicContact NZ-OE1 4Å; K566-E568 PolarHBondContact NZ-OE1 3.35Å; K566-I577 WeakPolarHBondContact O-CA 3.32Å; K566-R578 PolarHBondContact N-O 2.82Å; K566-R578 PolarHBondContact O-N 2.56Å; K566-L580 HydrophobicContact CB-CD1 4.13Å; K566-L580 HydrophobicContact CB-CD2 3.96Å; K566-L580 HydrophobicContact CB-CG 4.09Å
567	I	90	Very high	85	Confident	6 Å²	6	67.6 Å²	67.6	3%	0.031	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	128.4	173.2	-47.8	-174.7	0	0	0	107.9	F553 L555 P569 V575 I577 L592	F553-I567 HydrophobicContact CB-CD1 4.09Å; F553-I567 HydrophobicContact CB-CG2 4.05Å; L555-I567 HydrophobicContact CD2-CD1 4.19Å; L555-I567 HydrophobicContact CD2-CG1 4.28Å; L555-I567 HydrophobicContact CG-CD1 4.02Å; L555-I567 HydrophobicContact CG-CG1 4.06Å; I567-P569 WeakPolarHBondContact CG2-O 3.49Å; I567-V575 HydrophobicContact CG2-CB 3.75Å; I567-V575 HydrophobicContact CG2-CG1 4.32Å; I567-V575 HydrophobicContact CG2-CG2 3.74Å; I567-I577 HydrophobicContact CG1-CG1 4.38Å; I567-L592 HydrophobicContact CD1-CD2 3.93Å
568	E	85.9	Confident	85.5	Confident	62 Å²	62	64.9 Å²	64.9	29%	0.29	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	116.8	179.4	-59.3	-170.4	132.6	0	0	109.4	K566 S576 R578	K566-E568 HydrophobicContact CD-CG 3.88Å; K566-E568 WeakPolarHBondContact CD-OE1 3.48Å; K566-E568 WeakPolarHBondContact CE-OE1 3.23Å; K566-E568 HydrophobicContact CG-CG 4.08Å; K566-E568 IonicContact NZ-OE1 4Å; K566-E568 PolarHBondContact NZ-OE1 3.35Å; E568-S576 PolarHBondContact N-O 2.72Å; E568-S576 WeakPolarHBondContact O-CB 3.48Å; E568-S576 PolarHBondContact O-N 2.9Å; E568-S576 PolarHBondContact O-OG 2.67Å; E568-R578 VanDerWaalsContact OE2-CD 3.28Å; E568-R578 WeakPolarHBondContact OE2-CD 3.26Å; E568-R578 IonicContact OE2-NH1 2.62Å; E568-R578 PolarHBondContact OE2-NH1 2.89Å
569	P	87.1	Confident	85.9	Confident	78 Å²	78	63.2 Å²	63.2	51%	0.506	30%	0.295	S	S	.	.	S	Bend	cis	-69.9	167.5	-14.9	34.6	-37.1	0	0	0	112.1	I567 Y571 V575	I567-P569 WeakPolarHBondContact CG2-O 3.49Å; P569-Y571 VanDerWaalsContact C-N 3.28Å; P569-Y571 WeakPolarHBondContact CG-O 3.26Å; P569-Y571 PolarHBondContact O-N 3.46Å; P569-V575 WeakPolarHBondContact O-CB 3.39Å; P569-V575 WeakPolarHBondContact O-CG1 3.34Å
570	E	85.3	Confident	86.2	Confident	134 Å²	134	59.3 Å²	59.3	63%	0.626	28%	0.282	S	S	*	.	S	Bend	trans	-83.2	1.5	176.6	-62.6	179.1	163.5	0	0	113.4	F553	F553-E570 PolarHBondContact N-O 3.05Å
571	Y	87.6	Confident	86.3	Confident	123 Å²	123	59.7 Å²	59.7	48%	0.482	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	135.6	-178.3	-178.7	-98.2	0	0	0	111.7	P550 F551 P569	P550-Y571 HydrophobicContact CB-CD1 4.46Å; P550-Y571 HydrophobicContact CB-CE1 3.8Å; P550-Y571 HydrophobicContact CB-CE2 4.33Å; P550-Y571 HydrophobicContact CG-CE1 4.11Å; P550-Y571 VanDerWaalsContact O-CE2 3.23Å; P550-Y571 WeakPolarHBondContact O-CE2 3.35Å; F551-Y571 CarbonylContact O-C 3.57Å; F551-Y571 VanDerWaalsContact O-CA 3.29Å; F551-Y571 WeakPolarHBondContact O-CA 3.27Å; P569-Y571 VanDerWaalsContact C-N 3.28Å; P569-Y571 WeakPolarHBondContact CG-O 3.26Å; P569-Y571 PolarHBondContact O-N 3.46Å
572	G	87.7	Confident	86.1	Confident	16 Å²	16	69.4 Å²	69.4	17%	0.165	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	152.7	-177.2	176.4	0	0	0	0	0	114	F551 F553	F551-G572 PolarHBondContact N-O 3.45Å; F551-G572 VanDerWaalsContact N-O 3.09Å; F551-G572 PolarHBondContact O-N 2.58Å; F553-G572 WeakPolarHBondContact CE2-O 3.36Å
573	E	86	Confident	86.1	Confident	102 Å²	102	66.6 Å²	66.6	48%	0.477	32%	0.315	S	S	.	.	S	Bend	trans	-72.9	-35.6	170.7	-63.7	-56.2	134.5	0	0	112.4	P550 F551	P550-E573 WeakPolarHBondContact CA-OE1 3.19Å; F551-E573 WeakPolarHBondContact CE2-OE2 3.32Å
574	E	89.3	Confident	86.1	Confident	65 Å²	65	65 Å²	65	30%	0.304	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	124	-178.8	-176.4	167.6	-134.5	0	0	109.5	M536 V537 R538	M536-E574 HydrophobicContact CB-CG 4.06Å; M536-E574 VanDerWaalsContact CB-OE1 3.31Å; M536-E574 WeakPolarHBondContact CB-OE1 3.09Å; M536-E574 HydrophobicContact CE-CG 3.75Å; V537-E574 WeakPolarHBondContact O-CA 3.34Å; R538-E574 HydrophobicContact CG-CB 3.94Å; R538-E574 HydrophobicContact CG-CG 3.74Å; R538-E574 WeakPolarHBondContact CG-OE1 3.25Å; R538-E574 IonicContact CZ-OE1 2.75Å; R538-E574 IonicContact CZ-OE2 3.55Å; R538-E574 IonicContact NE-OE1 3.5Å; R538-E574 PolarHBondContact NE-OE1 3.15Å; R538-E574 IonicContact NE-OE2 3.09Å; R538-E574 PolarHBondContact NE-OE2 2.69Å; R538-E574 VanDerWaalsContact NH2-CD 3.34Å; R538-E574 IonicContact NH2-OE1 2.68Å; R538-E574 PolarHBondContact NH2-OE1 2.75Å; R538-E574 IonicContact NH2-OE2 2.6Å; R538-E574 PolarHBondContact NH2-OE2 2.63Å
575	V	90.7	Very high	86	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	153.5	178.7	-63.2	0	0	0	0	110.7	M536 V537 F553 I567 P569	M536-V575 WeakPolarHBondContact CA-O 3.42Å; V537-V575 HydrophobicContact CB-CG2 4.37Å; V537-V575 PolarHBondContact N-O 3.31Å; V537-V575 PolarHBondContact O-N 3.48Å; F553-V575 HydrophobicContact CB-CG1 4.22Å; F553-V575 HydrophobicContact CB-CG2 4.04Å; F553-V575 HydrophobicContact CD1-CG2 3.67Å; F553-V575 HydrophobicContact CD2-CB 4.17Å; F553-V575 HydrophobicContact CD2-CG1 3.33Å; F553-V575 HydrophobicContact CD2-CG2 3.72Å; F553-V575 HydrophobicContact CE1-CG2 3.89Å; F553-V575 HydrophobicContact CE2-CB 4.43Å; F553-V575 HydrophobicContact CE2-CG1 3.71Å; F553-V575 HydrophobicContact CE2-CG2 3.91Å; F553-V575 HydrophobicContact CG-CB 4.36Å; F553-V575 HydrophobicContact CG-CG1 3.91Å; F553-V575 HydrophobicContact CG-CG2 3.56Å; F553-V575 HydrophobicContact CZ-CG2 3.99Å; I567-V575 HydrophobicContact CG2-CB 3.75Å; I567-V575 HydrophobicContact CG2-CG1 4.32Å; I567-V575 HydrophobicContact CG2-CG2 3.74Å; P569-V575 WeakPolarHBondContact O-CB 3.39Å; P569-V575 WeakPolarHBondContact O-CG1 3.34Å
576	S	89.4	Confident	85.7	Confident	6 Å²	6	67 Å²	67	4%	0.042	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	123.1	172.5	79.3	0	0	0	0	110.9	V535 M536 E568	V535-S576 CarbonylContact O-C 3.56Å; V535-S576 WeakPolarHBondContact O-CA 3.48Å; M536-S576 WeakPolarHBondContact SD-CB 3.16Å; E568-S576 PolarHBondContact N-O 2.72Å; E568-S576 WeakPolarHBondContact O-CB 3.48Å; E568-S576 PolarHBondContact O-N 2.9Å; E568-S576 PolarHBondContact O-OG 2.67Å
577	I	90.1	Very high	85.7	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	112.9	171.9	-56.9	-169.6	0	0	0	107.7	K534 V535 V537 W565 K566 I567 L592 L606	K534-I577 CarbonylContact C-O 3.46Å; K534-I577 VanDerWaalsContact CA-O 3.26Å; K534-I577 WeakPolarHBondContact CA-O 3.48Å; V535-I577 HydrophobicContact CG1-CB 4.41Å; V535-I577 PolarHBondContact N-O 2.89Å; V535-I577 PolarHBondContact O-N 2.72Å; V537-I577 HydrophobicContact CB-CD1 4.47Å; V537-I577 HydrophobicContact CG2-CB 4.46Å; V537-I577 HydrophobicContact CG2-CD1 3.78Å; V537-I577 HydrophobicContact CG2-CG1 3.81Å; W565-I577 HydrophobicContact CB-CG2 4.33Å; W565-I577 HydrophobicContact CD2-CG2 4.39Å; W565-I577 HydrophobicContact CE3-CG2 3.82Å; K566-I577 WeakPolarHBondContact O-CA 3.32Å; I567-I577 HydrophobicContact CG1-CG1 4.38Å; I577-L592 HydrophobicContact CD1-CD1 3.88Å; I577-L592 HydrophobicContact CD1-CD2 3.8Å; I577-L592 HydrophobicContact CD1-CG 4.43Å; I577-L606 HydrophobicContact CD1-CD2 3.94Å
578	R	87.6	Confident	85.6	Confident	93 Å²	93	71 Å²	71	35%	0.351	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	137.9	-174.8	-170.2	175.2	-169.4	-179.6	3.3	111.3	D533 K534 W565 K566 E568	D533-R578 WeakPolarHBondContact O-CA 3.2Å; D533-R578 IonicContact OD1-NE 3.78Å; D533-R578 IonicContact OD2-CZ 2.83Å; D533-R578 VanDerWaalsContact OD2-CZ 3.22Å; D533-R578 IonicContact OD2-NE 2.95Å; D533-R578 PolarHBondContact OD2-NE 3.4Å; D533-R578 IonicContact OD2-NH2 2.83Å; D533-R578 PolarHBondContact OD2-NH2 3.18Å; K534-R578 HydrophobicContact CB-CB 4.06Å; K534-R578 HydrophobicContact CB-CG 4.19Å; W565-R578 CarbonylContact C-O 3.34Å; W565-R578 VanDerWaalsContact CA-O 3.31Å; W565-R578 WeakPolarHBondContact CA-O 3.33Å; K566-R578 PolarHBondContact N-O 2.82Å; K566-R578 PolarHBondContact O-N 2.56Å; E568-R578 VanDerWaalsContact OE2-CD 3.28Å; E568-R578 WeakPolarHBondContact OE2-CD 3.26Å; E568-R578 IonicContact OE2-NH1 2.62Å; E568-R578 PolarHBondContact OE2-NH1 2.89Å
579	L	87.3	Confident	85.7	Confident	25 Å²	25	72.1 Å²	72.1	13%	0.131	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	116.9	176.3	-176.8	68.8	0	0	0	110	L527 D533 W565 T581 L583 L610	L527-L579 HydrophobicContact CD2-CB 4.05Å; L527-L579 HydrophobicContact CD2-CD2 4.3Å; D533-L579 PolarHBondContact O-N 3.42Å; W565-L579 HydrophobicContact CD2-CD1 4.15Å; W565-L579 HydrophobicContact CE3-CB 4.12Å; W565-L579 HydrophobicContact CE3-CD1 3.91Å; W565-L579 HydrophobicContact CH2-CD1 3.81Å; W565-L579 HydrophobicContact CZ2-CD1 4.02Å; W565-L579 HydrophobicContact CZ3-CB 3.87Å; W565-L579 HydrophobicContact CZ3-CD1 3.75Å; W565-L579 HydrophobicContact CZ3-CG 4.37Å; L579-T581 WeakPolarHBondContact CD1-O 3.3Å; L579-T581 VanDerWaalsContact CG-O 3.26Å; L579-T581 WeakPolarHBondContact CG-O 3.4Å; L579-L583 HydrophobicContact CD1-CD1 3.66Å; L579-L583 HydrophobicContact CD1-CG 4.02Å; L579-L610 HydrophobicContact CD2-CD1 3.98Å; L579-L610 HydrophobicContact CD2-CD2 4.48Å
580	L	83.9	Confident	85.9	Confident	89 Å²	89	68.4 Å²	68.4	47%	0.466	35%	0.351	S	S	.	.			trans	-83.7	-29.9	-179.4	-63	-178	0	0	0	113.2	R564 K566	R564-L580 PolarHBondContact O-N 2.92Å; K566-L580 HydrophobicContact CB-CD1 4.13Å; K566-L580 HydrophobicContact CB-CD2 3.96Å; K566-L580 HydrophobicContact CB-CG 4.09Å
581	T	79.7	Confident	86.1	Confident	62 Å²	62	63.7 Å²	63.7	38%	0.38	33%	0.332	S	S	.	.	S	Bend	trans	-125.6	137.4	-175	55.7	0	0	0	0	111.2	L579 L583	L579-T581 WeakPolarHBondContact CD1-O 3.3Å; L579-T581 VanDerWaalsContact CG-O 3.26Å; L579-T581 WeakPolarHBondContact CG-O 3.4Å; T581-L583 PolarHBondContact O-N 2.85Å
582	K	76.4	Confident	86.3	Confident	217 Å²	217	58 Å²	58	94%	0.943	31%	0.31	S	S	*	.			trans	-67.8	100.5	178.1	-70.1	-170.6	175.6	-172.8	0	111.4
583	L	81.4	Confident	86.5	Confident	36 Å²	36	58.6 Å²	58.6	19%	0.188	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-84	155.2	173.3	-64.1	176	0	0	0	111	R564 W565 L579 T581 Y588 L610	R564-L583 HydrophobicContact CG-CD2 4.35Å; W565-L583 HydrophobicContact CZ2-CD1 4.24Å; L579-L583 HydrophobicContact CD1-CD1 3.66Å; L579-L583 HydrophobicContact CD1-CG 4.02Å; T581-L583 PolarHBondContact O-N 2.85Å; L583-Y588 HydrophobicContact CB-CE2 4.18Å; L583-Y588 HydrophobicContact CD1-CD1 4.09Å; L583-Y588 HydrophobicContact CD1-CD2 4.46Å; L583-Y588 HydrophobicContact CD1-CE1 3.88Å; L583-Y588 HydrophobicContact CD1-CE2 4.26Å; L583-Y588 HydrophobicContact CD1-CG 4.39Å; L583-L610 HydrophobicContact CB-CD2 3.84Å; L583-L610 VanDerWaalsContact O-CD2 3.27Å; L583-L610 WeakPolarHBondContact O-CD2 3.23Å
584	P	81.8	Confident	86.7	Confident	93 Å²	93	53.7 Å²	53.7	60%	0.604	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-70.7	156.9	170.3	30.4	-34.6	0	0	0	111.4	G586 Y588 L610	P584-G586 PolarHBondContact O-N 3.05Å; P584-Y588 WeakPolarHBondContact CD-OH 3.29Å; P584-Y588 WeakPolarHBondContact CG-OH 3.37Å; P584-Y588 WeakPolarHBondContact O-CE2 3.46Å; P584-Y588 PolarHBondContact O-OH 3.12Å; P584-L610 WeakPolarHBondContact O-CD2 3.15Å
585	N	81.7	Confident	86.8	Confident	86 Å²	86	53.5 Å²	53.5	46%	0.46	29%	0.286	S	S	.	.	S	Bend	trans	-63.8	133.5	178.6	-67.8	-14.9	0	0	0	111.3	S529 L610 N612	S529-N585 PolarHBondContact OG-OD1 2.86Å; N585-L610 CarbonylContact C-O 3.51Å; N585-L610 WeakPolarHBondContact CA-O 3.37Å; N585-L610 WeakPolarHBondContact CB-O 3.36Å; N585-N612 PolarHBondContact ND2-N 3.46Å; N585-N612 PolarHBondContact ND2-OD1 3.36Å
586	G	82.8	Confident	86.8	Confident	28 Å²	28	53.7 Å²	53.7	29%	0.289	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	163.2	-179.5	-172.1	0	0	0	0	0	112.5	P584 Y588 L610	P584-G586 PolarHBondContact O-N 3.05Å; G586-Y588 WeakPolarHBondContact O-CD2 3.48Å; G586-L610 PolarHBondContact N-O 3.01Å; G586-L610 PolarHBondContact O-N 2.84Å
587	N	88.1	Confident	86.7	Confident	123 Å²	123	57.4 Å²	57.4	66%	0.658	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	131.9	-179.4	-62.7	11.8	0	0	0	110.4
588	Y	87.9	Confident	86.5	Confident	54 Å²	54	61.6 Å²	61.6	21%	0.212	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	122.6	-177.5	-68.5	-79.1	0	0	0	111.1	W565 L583 P584 G586 V608 L610	W565-Y588 HydrophobicContact CZ2-CG 4.39Å; L583-Y588 HydrophobicContact CB-CE2 4.18Å; L583-Y588 HydrophobicContact CD1-CD1 4.09Å; L583-Y588 HydrophobicContact CD1-CD2 4.46Å; L583-Y588 HydrophobicContact CD1-CE1 3.88Å; L583-Y588 HydrophobicContact CD1-CE2 4.26Å; L583-Y588 HydrophobicContact CD1-CG 4.39Å; P584-Y588 WeakPolarHBondContact CD-OH 3.29Å; P584-Y588 WeakPolarHBondContact CG-OH 3.37Å; P584-Y588 WeakPolarHBondContact O-CE2 3.46Å; P584-Y588 PolarHBondContact O-OH 3.12Å; G586-Y588 WeakPolarHBondContact O-CD2 3.48Å; Y588-V608 PolarHBondContact N-O 3Å; Y588-V608 PolarHBondContact O-N 2.68Å; Y588-L610 HydrophobicContact CD2-CB 4.07Å; Y588-L610 HydrophobicContact CE2-CB 4.02Å; Y588-L610 HydrophobicContact CE2-CD2 4.33Å
589	S	88.8	Confident	86.3	Confident	84 Å²	84	62.6 Å²	62.6	59%	0.587	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.7	121.9	170.3	-56.5	0	0	0	0	110	P591	S589-P591 WeakPolarHBondContact O-CD 3.14Å
590	V	89.7	Confident	86.3	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	94.8	174.3	-174	0	0	0	0	108	L555 W565 L592 L606 V608	L555-V590 HydrophobicContact CD2-CG1 3.68Å; W565-V590 HydrophobicContact CD2-CG2 4.09Å; W565-V590 HydrophobicContact CG-CG2 4.36Å; W565-V590 HydrophobicContact CZ2-CG2 3.94Å; V590-L592 HydrophobicContact CG1-CD2 4.01Å; V590-L606 HydrophobicContact CB-CB 4.41Å; V590-L606 PolarHBondContact N-O 3.2Å; V590-L606 PolarHBondContact O-N 2.94Å; V590-V608 HydrophobicContact CG2-CG2 3.81Å
591	P	91.1	Very high	86.6	Confident	36 Å²	36	64.2 Å²	64.2	23%	0.234	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	129.5	174.5	27.7	-34.4	0	0	0	111.1	A556 L561 S589 E604	A556-P591 HydrophobicContact CB-CB 3.92Å; A556-P591 HydrophobicContact CB-CG 3.97Å; A556-P591 PolarHBondContact N-O 2.82Å; A556-P591 VanDerWaalsContact N-O 3.16Å; L561-P591 HydrophobicContact CD1-CG 3.41Å; L561-P591 VanDerWaalsContact CD1-CG 3.41Å; S589-P591 WeakPolarHBondContact O-CD 3.14Å; P591-E604 WeakPolarHBondContact CA-O 3.25Å
592	L	90.7	Very high	87.1	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.01	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	144.3	-176.3	-60.1	175.7	0	0	0	109.8	L520 V537 L555 I567 I577 V590 I594 E604 L606	L520-L592 HydrophobicContact CD1-CD1 4.35Å; L520-L592 HydrophobicContact CD2-CD1 4.2Å; V537-L592 HydrophobicContact CG1-CD1 4.42Å; L555-L592 HydrophobicContact CD2-CD2 3.97Å; I567-L592 HydrophobicContact CD1-CD2 3.93Å; I577-L592 HydrophobicContact CD1-CD1 3.88Å; I577-L592 HydrophobicContact CD1-CD2 3.8Å; I577-L592 HydrophobicContact CD1-CG 4.43Å; V590-L592 HydrophobicContact CG1-CD2 4.01Å; L592-I594 HydrophobicContact CB-CG1 4.22Å; L592-E604 PolarHBondContact N-O 2.86Å; L592-E604 PolarHBondContact O-N 3.34Å; L592-L606 HydrophobicContact CD1-CB 4.29Å
593	V	91.7	Very high	87.8	Confident	29 Å²	29	60.1 Å²	60.1	18%	0.176	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	114.7	162	-179.6	0	0	0	0	106	S554 Q595 P601 S602 K603	S554-V593 PolarHBondContact N-O 3.43Å; S554-V593 PolarHBondContact O-N 2.79Å; S554-V593 PolarHBondContact OG-O 3.22Å; V593-Q595 HydrophobicContact CG1-CG 4.41Å; V593-P601 HydrophobicContact CG1-CB 4.07Å; V593-S602 WeakPolarHBondContact CA-O 3.43Å; V593-K603 HydrophobicContact CG2-CG 4.43Å
594	I	91.8	Very high	88.3	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	132.4	179.4	-43.2	176	0	0	0	106.6	P518 L520 A539 F551 G552 F553 L592 P601 S602 E604	P518-I594 HydrophobicContact CB-CB 4.16Å; P518-I594 HydrophobicContact CB-CG2 3.66Å; P518-I594 HydrophobicContact CG-CG2 4.32Å; L520-I594 HydrophobicContact CD2-CD1 3.64Å; L520-I594 HydrophobicContact CG-CD1 3.93Å; A539-I594 HydrophobicContact CB-CD1 4.28Å; A539-I594 HydrophobicContact CB-CG2 4.06Å; F551-I594 HydrophobicContact CB-CG2 3.88Å; F551-I594 HydrophobicContact CG-CG2 4.38Å; G552-I594 CarbonylContact O-C 3.54Å; G552-I594 WeakPolarHBondContact O-CA 3.28Å; F553-I594 HydrophobicContact CD1-CD1 4.31Å; F553-I594 HydrophobicContact CD1-CG1 3.96Å; F553-I594 HydrophobicContact CD1-CG2 4.08Å; F553-I594 HydrophobicContact CE1-CD1 3.85Å; F553-I594 HydrophobicContact CE1-CG1 4Å; F553-I594 HydrophobicContact CE1-CG2 3.92Å; F553-I594 HydrophobicContact CE2-CG2 4.46Å; F553-I594 HydrophobicContact CG-CG2 4.43Å; F553-I594 HydrophobicContact CZ-CG2 4.14Å; L592-I594 HydrophobicContact CB-CG1 4.22Å; I594-P601 CarbonylContact O-C 3.57Å; I594-P601 WeakPolarHBondContact O-CA 3.48Å; I594-S602 PolarHBondContact N-O 3.01Å; I594-S602 PolarHBondContact O-N 3.39Å; I594-E604 HydrophobicContact CD1-CB 4.05Å; I594-E604 HydrophobicContact CD1-CG 4.07Å
595	Q	90.6	Very high	88.7	Confident	60 Å²	60	59.6 Å²	59.6	28%	0.28	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	141.1	179.2	-61.5	-173.4	-97.3	0	0	108.7	F551 G552 V593 N599 Q600 P601	F551-Q595 CarbonylContact C-O 3.59Å; F551-Q595 WeakPolarHBondContact CA-O 3.41Å; F551-Q595 WeakPolarHBondContact CB-O 3.29Å; G552-Q595 PolarHBondContact N-O 2.93Å; G552-Q595 PolarHBondContact O-N 2.9Å; V593-Q595 HydrophobicContact CG1-CG 4.41Å; Q595-N599 PolarHBondContact NE2-O 3.42Å; Q595-Q600 WeakPolarHBondContact CA-O 3.5Å; Q595-P601 HydrophobicContact CG-CB 4.06Å
596	D	90.1	Very high	89.2	Confident	5 Å²	5	55.6 Å²	55.6	3%	0.027	30%	0.296	C	S	.	.			trans	-72	-171.9	169.5	69.7	0.7	0	0	0	111.7	N514 P518 F547 Q598 N599 Q600	N514-D596 PolarHBondContact ND2-OD2 3.36Å; N514-D596 PolarHBondContact OD1-OD2 3.06Å; P518-D596 HydrophobicContact CG-CB 3.92Å; F547-D596 WeakPolarHBondContact O-CB 3.2Å; D596-Q598 PolarHBondContact O-N 3.22Å; D596-Q598 WeakPolarHBondContact OD1-CA 3.49Å; D596-Q598 PolarHBondContact OD1-N 3.09Å; D596-N599 PolarHBondContact O-N 2.93Å; D596-N599 WeakPolarHBondContact OD1-CA 3.44Å; D596-N599 PolarHBondContact OD1-N 2.87Å; D596-Q600 PolarHBondContact N-O 3.29Å; D596-Q600 PolarHBondContact OD1-N 2.72Å; D596-Q600 WeakPolarHBondContact OD2-CB 3.43Å
597	K	87	Confident	89.5	Confident	83 Å²	83	56.3 Å²	56.3	36%	0.361	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-14.4	175.4	-164.3	171.8	-165.9	164.5	0	114.3	E545 S548	E545-K597 IonicContact OE1-NZ 3.81Å; E545-K597 PolarHBondContact OE1-NZ 3.37Å; E545-K597 IonicContact OE2-NZ 3.78Å; E545-K597 PolarHBondContact OE2-NZ 3.47Å; E545-K597 VanDerWaalsContact OE2-NZ 3.09Å; S548-K597 WeakPolarHBondContact O-CB 3.39Å; S548-K597 PolarHBondContact O-N 2.87Å
598	Q	85.6	Confident	89.5	Confident	89 Å²	89	50.4 Å²	50.4	42%	0.416	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	4	-177	-54	-161.9	11.2	0	0	113.6	P546 F547 D596	P546-Q598 PolarHBondContact O-NE2 3.02Å; F547-Q598 HydrophobicContact CD1-CG 4.49Å; D596-Q598 PolarHBondContact O-N 3.22Å; D596-Q598 WeakPolarHBondContact OD1-CA 3.49Å; D596-Q598 PolarHBondContact OD1-N 3.09Å
599	N	85.1	Confident	89.5	Confident	114 Å²	114	49.6 Å²	49.6	61%	0.61	27%	0.266	S	S	*	.			trans	79.4	11.5	-179.7	-47.4	-97.1	0	0	0	116.4	Q595 D596 P601	Q595-N599 PolarHBondContact NE2-O 3.42Å; D596-N599 PolarHBondContact O-N 2.93Å; D596-N599 WeakPolarHBondContact OD1-CA 3.44Å; D596-N599 PolarHBondContact OD1-N 2.87Å; N599-P601 VanDerWaalsContact O-CD 3.29Å; N599-P601 WeakPolarHBondContact O-CD 3.27Å
600	Q	87.4	Confident	89.4	Confident	70 Å²	70	45.8 Å²	45.8	33%	0.327	24%	0.239	S	C	.	.			trans	-65	115.3	176	-167.7	140.1	-72.3	0	0	110.2	N514 N516 T517 Q595 D596	N514-Q600 PolarHBondContact O-NE2 3.29Å; N514-Q600 PolarHBondContact OD1-NE2 3.14Å; N516-Q600 PolarHBondContact O-NE2 2.84Å; T517-Q600 HydrophobicContact CG2-CG 4.01Å; Q595-Q600 WeakPolarHBondContact CA-O 3.5Å; D596-Q600 PolarHBondContact N-O 3.29Å; D596-Q600 PolarHBondContact OD1-N 2.72Å; D596-Q600 WeakPolarHBondContact OD2-CB 3.43Å
601	P	89.2	Confident	89.1	Confident	77 Å²	77	46.3 Å²	46.3	50%	0.5	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	113.7	-165.4	34.8	-30.9	0	0	0	113.6	V593 I594 Q595 N599	V593-P601 HydrophobicContact CG1-CB 4.07Å; I594-P601 CarbonylContact O-C 3.57Å; I594-P601 WeakPolarHBondContact O-CA 3.48Å; Q595-P601 HydrophobicContact CG-CB 4.06Å; N599-P601 VanDerWaalsContact O-CD 3.29Å; N599-P601 WeakPolarHBondContact O-CD 3.27Å
602	S	91.1	Very high	88.7	Confident	11 Å²	11	48.7 Å²	48.7	8%	0.077	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	162.4	164.7	93.3	0	0	0	0	111.7	P518 V593 I594	P518-S602 WeakPolarHBondContact O-CB 3.27Å; P518-S602 PolarHBondContact O-OG 2.78Å; V593-S602 WeakPolarHBondContact CA-O 3.43Å; I594-S602 PolarHBondContact N-O 3.01Å; I594-S602 PolarHBondContact O-N 3.39Å
603	K	91.2	Very high	88	Confident	182 Å²	182	49 Å²	49	79%	0.791	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.5	103.7	175.5	-71.9	179.9	-178.2	170.5	0	109.5	V593	V593-K603 HydrophobicContact CG2-CG 4.43Å
604	E	90.9	Very high	87.2	Confident	50 Å²	50	52.9 Å²	52.9	23%	0.234	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	167.2	-173.7	-83.2	-73.6	-165.6	0	0	111.5	L520 P591 L592 I594	L520-E604 HydrophobicContact CD1-CB 3.84Å; L520-E604 HydrophobicContact CD1-CG 4.42Å; L520-E604 HydrophobicContact CG-CB 3.84Å; L520-E604 HydrophobicContact CG-CG 3.99Å; L520-E604 PolarHBondContact N-OE1 2.86Å; P591-E604 WeakPolarHBondContact CA-O 3.25Å; L592-E604 PolarHBondContact N-O 2.86Å; L592-E604 PolarHBondContact O-N 3.34Å; I594-E604 HydrophobicContact CD1-CB 4.05Å; I594-E604 HydrophobicContact CD1-CG 4.07Å
605	T	90.9	Very high	86.1	Confident	69 Å²	69	60 Å²	60	42%	0.423	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	113.1	175.4	-65	0	0	0	0	111.7
606	L	91	Very high	85	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.01	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	123.6	176.6	-174.6	72.3	0	0	0	110.4	L520 N522 A525 V537 I577 V590 L592 V608	L520-L606 HydrophobicContact CD1-CB 4.14Å; L520-L606 HydrophobicContact CD1-CD1 4.31Å; N522-L606 WeakPolarHBondContact O-CD1 3.06Å; A525-L606 HydrophobicContact CB-CD1 3.98Å; A525-L606 HydrophobicContact CB-CD2 4.12Å; A525-L606 HydrophobicContact CB-CG 4.16Å; V537-L606 HydrophobicContact CG1-CD2 4.47Å; V537-L606 HydrophobicContact CG2-CD2 3.58Å; I577-L606 HydrophobicContact CD1-CD2 3.94Å; V590-L606 HydrophobicContact CB-CB 4.41Å; V590-L606 PolarHBondContact N-O 3.2Å; V590-L606 PolarHBondContact O-N 2.94Å; L592-L606 HydrophobicContact CD1-CB 4.29Å; L606-V608 HydrophobicContact CD2-CG2 3.65Å; L606-V608 HydrophobicContact CG-CG2 3.88Å; L606-V608 PolarHBondContact O-N 3.45Å
607	S	90.3	Very high	83.9	Confident	42 Å²	42	63.8 Å²	63.8	29%	0.294	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	100.5	171.7	-165.7	0	0	0	0	110.1	N523 S524 A525	N523-S607 PolarHBondContact O-N 3.3Å; S524-S607 CarbonylContact C-O 3.58Å; S524-S607 WeakPolarHBondContact CA-O 3.37Å; A525-S607 PolarHBondContact N-O 2.58Å
608	V	88.4	Confident	83.4	Confident	0 Å²	0	64 Å²	64	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	113.8	178.6	-172.3	0	0	0	0	110.1	A525 L527 W565 Y588 V590 L606	A525-V608 HydrophobicContact CB-CG2 4.35Å; A525-V608 CarbonylContact O-C 3.58Å; A525-V608 WeakPolarHBondContact O-CA 2.97Å; L527-V608 HydrophobicContact CB-CG1 3.81Å; W565-V608 HydrophobicContact CH2-CB 4.16Å; W565-V608 HydrophobicContact CH2-CG1 3.8Å; W565-V608 HydrophobicContact CH2-CG2 4.42Å; W565-V608 HydrophobicContact CZ3-CG1 4.45Å; Y588-V608 PolarHBondContact N-O 3Å; Y588-V608 PolarHBondContact O-N 2.68Å; V590-V608 HydrophobicContact CG2-CG2 3.81Å; L606-V608 HydrophobicContact CD2-CG2 3.65Å; L606-V608 HydrophobicContact CG-CG2 3.88Å; L606-V608 PolarHBondContact O-N 3.45Å
609	V	88.2	Confident	83	Confident	36 Å²	36	61.9 Å²	61.9	22%	0.218	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	111.5	171.6	-177.4	0	0	0	0	108.7	A525 I526 L527	A525-V609 PolarHBondContact O-N 2.98Å; I526-V609 HydrophobicContact CG1-CB 4.33Å; L527-V609 PolarHBondContact N-O 3.45Å
610	L	86.4	Confident	82.4	Confident	4 Å²	4	59.1 Å²	59.1	2%	0.021	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	121.4	174.4	-166.3	79.7	0	0	0	109.8	L527 L579 L583 P584 N585 G586 Y588	L527-L610 HydrophobicContact CB-CD1 3.97Å; L527-L610 HydrophobicContact CD2-CD1 3.77Å; L527-L610 HydrophobicContact CG-CD1 3.74Å; L579-L610 HydrophobicContact CD2-CD1 3.98Å; L579-L610 HydrophobicContact CD2-CD2 4.48Å; L583-L610 HydrophobicContact CB-CD2 3.84Å; L583-L610 VanDerWaalsContact O-CD2 3.27Å; L583-L610 WeakPolarHBondContact O-CD2 3.23Å; P584-L610 WeakPolarHBondContact O-CD2 3.15Å; N585-L610 CarbonylContact C-O 3.51Å; N585-L610 WeakPolarHBondContact CA-O 3.37Å; N585-L610 WeakPolarHBondContact CB-O 3.36Å; G586-L610 PolarHBondContact N-O 3.01Å; G586-L610 PolarHBondContact O-N 2.84Å; Y588-L610 HydrophobicContact CD2-CB 4.07Å; Y588-L610 HydrophobicContact CE2-CB 4.02Å; Y588-L610 HydrophobicContact CE2-CD2 4.33Å
611	C	83.1	Confident	81.3	Confident	11 Å²	11	58.9 Å²	58.9	7%	0.074	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	157.9	-176.9	63.2	0	0	0	0	112.8	L527 C528 S529 C613 C619	L527-C611 PolarHBondContact O-N 2.95Å; C528-C611 WeakPolarHBondContact CA-O 3.3Å; S529-C611 PolarHBondContact N-O 3.11Å; S529-C611 PolarHBondContact OG-O 3.43Å; C611-C613 PolarHBondContact O-N 3.39Å; C611-C619 HydrophobicContact CB-CB 3.59Å; C611-C619 WeakPolarHBondContact CB-SG 3.36Å; C611-C619 WeakPolarHBondContact SG-CA 3.35Å; C611-C619 WeakPolarHBondContact SG-CB 3.28Å; C611-C619 CovalentContact SG-SG 2.03Å; C611-C619 PolarHBondContact SG-SG 2.88Å
612	N	81.8	Confident	79.8	Confident	86 Å²	86	61.3 Å²	61.3	46%	0.46	37%	0.374	S	S	.	.			trans	-73.6	119.4	163.4	-63.9	17.2	0	0	0	107.7	S529 N530 N585 A620	S529-N612 PolarHBondContact OG-OD1 3.35Å; N530-N612 WeakPolarHBondContact OD1-CA 3.49Å; N585-N612 PolarHBondContact ND2-N 3.46Å; N585-N612 PolarHBondContact ND2-OD1 3.36Å; N612-A620 WeakPolarHBondContact O-CB 3.23Å; N612-A620 PolarHBondContact O-N 2.99Å
613	C	77.2	Confident	77.9	Confident	10 Å²	10	70.1 Å²	70.1	7%	0.068	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	150.3	179.4	-70.9	0	0	0	0	112.3	C528 N530 C611 K615 V618	C528-C613 WeakPolarHBondContact CA-SG 3.43Å; C528-C613 HydrophobicContact CB-CB 3.56Å; C528-C613 WeakPolarHBondContact CB-SG 3.24Å; C528-C613 WeakPolarHBondContact SG-CB 3.24Å; C528-C613 CovalentContact SG-SG 2.03Å; C528-C613 PolarHBondContact SG-SG 3.26Å; N530-C613 PolarHBondContact ND2-O 3.08Å; N530-C613 VanDerWaalsContact ND2-O 3.09Å; N530-C613 PolarHBondContact OD1-N 2.82Å; C611-C613 PolarHBondContact O-N 3.39Å; C613-K615 WeakPolarHBondContact CB-O 3.35Å; C613-V618 VanDerWaalsContact CA-O 3.26Å; C613-V618 WeakPolarHBondContact CA-O 3.39Å
614	V	73.4	Confident	75.9	Confident	109 Å²	109	67.5 Å²	67.5	66%	0.661	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.9	-21.7	171.4	-170.7	0	0	0	0	111	V618 A620	V614-V618 PolarHBondContact N-O 3Å; V614-A620 HydrophobicContact CG2-CB 3.7Å
615	K	70.4	Confident	73.8	Confident	151 Å²	151	72.9 Å²	72.9	66%	0.657	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147	155.9	168.5	-63.6	-172.8	178.3	-173.3	0	107.5	C613 G617 V618	C613-K615 WeakPolarHBondContact CB-O 3.35Å; K615-G617 PolarHBondContact O-N 3.01Å; K615-V618 PolarHBondContact O-N 3.43Å
616	P	67.1	Low	71.6	Confident	108 Å²	108	75.2 Å²	75.2	70%	0.701	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.8	126.3	176.1	-30.2	35.8	0	0	0	112.4	E531 V618	E531-P616 WeakPolarHBondContact OE2-CA 3.41Å; P616-V618 VanDerWaalsContact C-N 3.33Å; P616-V618 PolarHBondContact O-N 3.11Å
617	G	65.6	Low	69.7	Low	36 Å²	36	80.7 Å²	80.7	37%	0.371	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	6.7	-178.1	0	0	0	0	0	116.3	I526 C528 K615	I526-G617 WeakPolarHBondContact CD1-O 3.13Å; C528-G617 PolarHBondContact SG-N 3.07Å; C528-G617 VanDerWaalsContact SG-N 3.35Å; K615-G617 PolarHBondContact O-N 3.01Å
618	V	77.3	Confident	67.9	Low	87 Å²	87	83.5 Å²	83.5	53%	0.527	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	106.5	-178.2	-173.2	0	0	0	0	112.3	C613 V614 K615 P616	C613-V618 VanDerWaalsContact CA-O 3.26Å; C613-V618 WeakPolarHBondContact CA-O 3.39Å; V614-V618 PolarHBondContact N-O 3Å; K615-V618 PolarHBondContact O-N 3.43Å; P616-V618 VanDerWaalsContact C-N 3.33Å; P616-V618 PolarHBondContact O-N 3.11Å
619	C	77.8	Confident	66.6	Low	45 Å²	45	90 Å²	90	30%	0.304	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-62.5	142.8	177.7	-59.9	0	0	0	0	113.8	C611 G621	C611-C619 HydrophobicContact CB-CB 3.59Å; C611-C619 WeakPolarHBondContact CB-SG 3.36Å; C611-C619 WeakPolarHBondContact SG-CA 3.35Å; C611-C619 WeakPolarHBondContact SG-CB 3.28Å; C611-C619 CovalentContact SG-SG 2.03Å; C611-C619 PolarHBondContact SG-SG 2.88Å; C619-G621 PolarHBondContact O-N 3.28Å
620	A	70.9	Confident	65.5	Low	56 Å²	56	90.7 Å²	90.7	46%	0.463	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-67.3	120.6	168.8	0	0	0	0	0	111.4	N612 V614	N612-A620 WeakPolarHBondContact O-CB 3.23Å; N612-A620 PolarHBondContact O-N 2.99Å; V614-A620 HydrophobicContact CG2-CB 3.7Å
621	G	65.3	Low	64.6	Low	65 Å²	65	97.5 Å²	97.5	67%	0.67	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-68.2	151.1	177.5	0	0	0	0	0	113.6	C619	C619-G621 PolarHBondContact O-N 3.28Å
622	P	57.6	Low	63.9	Low	127 Å²	127	101 Å²	101	83%	0.825	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-67.4	141	178.9	28.6	-34.8	0	0	0	111.8
623	K	51.4	Low	63.1	Low	196 Å²	196	98.8 Å²	98.8	85%	0.852	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-69.4	130.1	172.7	-66.2	-177.9	179.4	-180	0	109.5
624	P	49.8	Very low	62.9	Low	127 Å²	127	102.4 Å²	102.4	83%	0.825	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-68.7	135.1	-176.9	27.1	-34.3	0	0	0	111.8
625	L	45.6	Very low	63	Low	163 Å²	163	99.2 Å²	99.2	85%	0.853	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-82.5	119.8	172.5	-130.7	76.9	0	0	0	109.3
626	S	44.2	Very low	63.3	Low	118 Å²	118	98.2 Å²	98.2	83%	0.825	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-83.9	122	176.9	-174.7	0	0	0	0	111
627	T	51.7	Low	63.8	Low	118 Å²	118	98.1 Å²	98.1	72%	0.724	63%	0.627	S	S	*	*			trans	-127.8	113.5	171.2	48.1	0	0	0	0	110
628	A	53.3	Low	64.5	Low	101 Å²	101	101 Å²	101	84%	0.835	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-84.3	121.2	179.2	0	0	0	0	0	110.8
629	I	61.1	Low	64.6	Low	136 Å²	136	99.2 Å²	99.2	70%	0.697	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-80.7	123.7	178.3	-61.5	176.6	0	0	0	109.6	A633	I629-A633 HydrophobicContact CG2-CB 3.9Å
630	G	65	Low	64.6	Low	50 Å²	50	100 Å²	100	52%	0.515	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-69.8	145.7	-176.9	0	0	0	0	0	114.1	A632 A633	G630-A632 PolarHBondContact O-N 2.82Å; G630-A633 WeakPolarHBondContact O-CB 3.47Å; G630-A633 PolarHBondContact O-N 2.8Å
631	I	66.9	Low	65	Low	148 Å²	148	102 Å²	102	76%	0.759	64%	0.639	S	S	*	*	H	α-helix	trans	-52.8	-32.6	-174.5	-59.1	169.6	0	0	0	113.1	A633 I634 G635	I631-A633 VanDerWaalsContact C-N 3.29Å; I631-A633 PolarHBondContact O-N 3.34Å; I631-I634 WeakPolarHBondContact O-CB 3.49Å; I631-I634 PolarHBondContact O-N 2.85Å; I631-I634 VanDerWaalsContact O-N 3.14Å; I631-G635 PolarHBondContact O-N 3.4Å; I631-G635 VanDerWaalsContact O-N 3.11Å
632	A	68.1	Low	65.7	Low	83 Å²	83	104 Å²	104	69%	0.686	63%	0.634	S	S	*	*	H	α-helix	trans	-59.8	-34.6	177.4	0	0	0	0	0	113.7	G630 L636	G630-A632 PolarHBondContact O-N 2.82Å; A632-L636 PolarHBondContact O-N 3.27Å
633	A	66.1	Low	66.8	Low	40 Å²	40	102.3 Å²	102.3	33%	0.331	62%	0.621	S	S	.	*	H	α-helix	trans	-69.8	-37.8	176.2	0	0	0	0	0	111.6	I629 G630 I631 G635 L636 I637	I629-A633 HydrophobicContact CG2-CB 3.9Å; G630-A633 WeakPolarHBondContact O-CB 3.47Å; G630-A633 PolarHBondContact O-N 2.8Å; I631-A633 VanDerWaalsContact C-N 3.29Å; I631-A633 PolarHBondContact O-N 3.34Å; A633-G635 VanDerWaalsContact C-N 3.34Å; A633-G635 PolarHBondContact O-N 3.36Å; A633-L636 PolarHBondContact O-N 3.43Å; A633-I637 WeakPolarHBondContact O-CG1 3.48Å; A633-I637 PolarHBondContact O-N 3.42Å; A633-I637 VanDerWaalsContact O-N 3.09Å
634	I	72.8	Confident	68	Low	86 Å²	86	99.1 Å²	99.1	44%	0.441	61%	0.608	S	S	.	*	H	α-helix	trans	-62.9	-42.8	177.2	-53.9	177.5	0	0	0	110.1	I631 L636 I637 I638	I631-I634 WeakPolarHBondContact O-CB 3.49Å; I631-I634 PolarHBondContact O-N 2.85Å; I631-I634 VanDerWaalsContact O-N 3.14Å; I634-L636 PolarHBondContact O-N 2.96Å; I634-I637 PolarHBondContact O-N 2.85Å; I634-I638 HydrophobicContact CG2-CD1 3.94Å; I634-I638 WeakPolarHBondContact O-CG1 3.44Å; I634-I638 PolarHBondContact O-N 2.93Å
635	G	74.3	Confident	69.1	Low	42 Å²	42	97.6 Å²	97.6	43%	0.433	59%	0.592	S	S	.	*	H	α-helix	trans	-59.6	-41.9	175.6	0	0	0	0	0	113.7	I631 A633 I638 A639	I631-G635 PolarHBondContact O-N 3.4Å; I631-G635 VanDerWaalsContact O-N 3.11Å; A633-G635 VanDerWaalsContact C-N 3.34Å; A633-G635 PolarHBondContact O-N 3.36Å; G635-I638 PolarHBondContact O-N 2.9Å; G635-A639 WeakPolarHBondContact O-CB 3.16Å; G635-A639 PolarHBondContact O-N 2.61Å
636	L	78.2	Confident	70.5	Confident	131 Å²	131	95.1 Å²	95.1	69%	0.686	58%	0.579	S	S	*	*	H	α-helix	trans	-66.5	-39.4	176.6	-73.6	169.7	0	0	0	112.6	A632 A633 I634 A639 A640	A632-L636 PolarHBondContact O-N 3.27Å; A633-L636 PolarHBondContact O-N 3.43Å; I634-L636 PolarHBondContact O-N 2.96Å; L636-A639 PolarHBondContact O-N 2.83Å; L636-A640 WeakPolarHBondContact O-CB 3.21Å; L636-A640 PolarHBondContact O-N 2.72Å
637	I	77.8	Confident	71.7	Confident	105 Å²	105	94 Å²	94	54%	0.538	56%	0.563	S	S	.	*	H	α-helix	trans	-64.9	-42.7	177.2	-67.5	163.9	0	0	0	110.9	A633 I634 A640 L641	A633-I637 WeakPolarHBondContact O-CG1 3.48Å; A633-I637 PolarHBondContact O-N 3.42Å; A633-I637 VanDerWaalsContact O-N 3.09Å; I634-I637 PolarHBondContact O-N 2.85Å; I637-A640 PolarHBondContact O-N 2.81Å; I637-L641 HydrophobicContact CG2-CD1 4.36Å; I637-L641 PolarHBondContact O-N 3.49Å
638	I	79.1	Confident	72.2	Confident	96 Å²	96	92.3 Å²	92.3	49%	0.492	55%	0.549	S	S	.	.	H	α-helix	trans	-64.4	-43	176.3	-67.6	168.3	0	0	0	111	I634 G635 A640 L641 L642	I634-I638 HydrophobicContact CG2-CD1 3.94Å; I634-I638 WeakPolarHBondContact O-CG1 3.44Å; I634-I638 PolarHBondContact O-N 2.93Å; G635-I638 PolarHBondContact O-N 2.9Å; I638-A640 PolarHBondContact O-N 2.86Å; I638-L641 PolarHBondContact O-N 3.07Å; I638-L642 HydrophobicContact CG2-CD1 4.21Å; I638-L642 WeakPolarHBondContact O-CG 3.25Å; I638-L642 PolarHBondContact O-N 3.37Å
639	A	79	Confident	72.8	Confident	51 Å²	51	93.7 Å²	93.7	42%	0.421	54%	0.542	S	S	.	.	H	α-helix	trans	-61.9	-42.6	177.1	0	0	0	0	0	112.2	G635 L636 L642 V643	G635-A639 WeakPolarHBondContact O-CB 3.16Å; G635-A639 PolarHBondContact O-N 2.61Å; L636-A639 PolarHBondContact O-N 2.83Å; A639-L642 PolarHBondContact O-N 3.14Å; A639-V643 WeakPolarHBondContact O-CG2 3.49Å; A639-V643 PolarHBondContact O-N 3.36Å
640	A	78.8	Confident	73	Confident	61 Å²	61	93.4 Å²	93.4	50%	0.504	54%	0.541	S	S	.	.	H	α-helix	trans	-63	-42.1	176	0	0	0	0	0	112.4	L636 I637 I638 L642 V643 F644	L636-A640 WeakPolarHBondContact O-CB 3.21Å; L636-A640 PolarHBondContact O-N 2.72Å; I637-A640 PolarHBondContact O-N 2.81Å; I638-A640 PolarHBondContact O-N 2.86Å; A640-L642 PolarHBondContact O-N 3.26Å; A640-V643 PolarHBondContact O-N 3.3Å; A640-F644 WeakPolarHBondContact O-CB 3.15Å; A640-F644 PolarHBondContact O-N 2.86Å
641	L	78.8	Confident	72.8	Confident	97 Å²	97	97.7 Å²	97.7	51%	0.508	55%	0.552	S	S	.	*	H	α-helix	trans	-62.1	-40.2	176.2	-92.7	163.7	0	0	0	113	I637 I638 F644 L645	I637-L641 HydrophobicContact CG2-CD1 4.36Å; I637-L641 PolarHBondContact O-N 3.49Å; I638-L641 PolarHBondContact O-N 3.07Å; L641-F644 PolarHBondContact O-N 2.91Å; L641-L645 PolarHBondContact O-N 2.92Å
642	L	80.4	Confident	72.3	Confident	109 Å²	109	95.7 Å²	95.7	57%	0.571	55%	0.547	S	S	*	.	H	α-helix	trans	-66.2	-40	177.1	-72.6	170.6	0	0	0	112.4	I638 A639 A640 L645 L646	I638-L642 HydrophobicContact CG2-CD1 4.21Å; I638-L642 WeakPolarHBondContact O-CG 3.25Å; I638-L642 PolarHBondContact O-N 3.37Å; A639-L642 PolarHBondContact O-N 3.14Å; A640-L642 PolarHBondContact O-N 3.26Å; L642-L645 PolarHBondContact O-N 3.29Å; L642-L646 PolarHBondContact O-N 2.9Å; L642-L646 VanDerWaalsContact O-N 3.1Å
643	V	80.3	Confident	71.5	Confident	91 Å²	91	103 Å²	103	55%	0.552	56%	0.556	S	S	*	*	H	α-helix	trans	-65.7	-39.7	174.5	173.5	0	0	0	0	111.3	A639 A640 L646 L647	A639-V643 WeakPolarHBondContact O-CG2 3.49Å; A639-V643 PolarHBondContact O-N 3.36Å; A640-V643 PolarHBondContact O-N 3.3Å; V643-L646 PolarHBondContact O-N 3.26Å; V643-L647 HydrophobicContact CG1-CD1 4.33Å; V643-L647 PolarHBondContact O-N 3Å
644	F	77	Confident	70.5	Confident	128 Å²	128	110.7 Å²	110.7	56%	0.561	58%	0.582	S	S	*	*	H	α-helix	trans	-65	-41.6	177.2	-173.2	-109.8	0	0	0	112.6	A640 L641 L646 L647 L648	A640-F644 WeakPolarHBondContact O-CB 3.15Å; A640-F644 PolarHBondContact O-N 2.86Å; L641-F644 PolarHBondContact O-N 2.91Å; F644-L646 PolarHBondContact O-N 2.86Å; F644-L647 PolarHBondContact O-N 3.06Å; F644-L648 HydrophobicContact CD1-CD1 3.87Å; F644-L648 HydrophobicContact CE1-CD1 3.6Å; F644-L648 HydrophobicContact CE1-CG 4.48Å; F644-L648 HydrophobicContact CZ-CD1 4.16Å; F644-L648 PolarHBondContact O-N 2.79Å
645	L	73.6	Confident	68.9	Low	95 Å²	95	114 Å²	114	50%	0.497	60%	0.596	S	S	.	*	H	α-helix	trans	-61.8	-40.1	172.7	-89.2	162.2	0	0	0	112.6	L641 L642 L647 L648 L649	L641-L645 PolarHBondContact O-N 2.92Å; L642-L645 PolarHBondContact O-N 3.29Å; L645-L647 VanDerWaalsContact C-N 3.35Å; L645-L647 PolarHBondContact O-N 3Å; L645-L648 PolarHBondContact O-N 3.41Å; L645-L649 WeakPolarHBondContact O-CG 3.16Å; L645-L649 PolarHBondContact O-N 3.29Å; L645-L649 VanDerWaalsContact O-N 3.11Å
646	L	73.9	Confident	67.1	Low	111 Å²	111	120.4 Å²	120.4	58%	0.581	61%	0.612	S	S	*	*	H	α-helix	trans	-63.9	-38.5	176	-114.6	163.6	0	0	0	112.4	L642 V643 F644 L650	L642-L646 PolarHBondContact O-N 2.9Å; L642-L646 VanDerWaalsContact O-N 3.1Å; V643-L646 PolarHBondContact O-N 3.26Å; F644-L646 PolarHBondContact O-N 2.86Å; L646-L650 WeakPolarHBondContact O-CG 3.43Å; L646-L650 PolarHBondContact O-N 2.62Å
647	L	70.4	Confident	65.1	Low	95 Å²	95	120.7 Å²	120.7	50%	0.497	62%	0.619	S	S	.	*	H	α-helix	trans	-65.6	-42.2	173.9	-84.1	160	0	0	0	112.6	V643 F644 L645 L649 L650 L651	V643-L647 HydrophobicContact CG1-CD1 4.33Å; V643-L647 PolarHBondContact O-N 3Å; F644-L647 PolarHBondContact O-N 3.06Å; L645-L647 VanDerWaalsContact C-N 3.35Å; L645-L647 PolarHBondContact O-N 3Å; L647-L649 VanDerWaalsContact C-N 3.33Å; L647-L649 PolarHBondContact O-N 2.99Å; L647-L650 PolarHBondContact O-N 2.85Å; L647-L651 WeakPolarHBondContact O-CG 3.27Å; L647-L651 PolarHBondContact O-N 2.97Å; L647-L651 VanDerWaalsContact O-N 3.16Å
648	L	61.9	Low	63	Low	82 Å²	82	125.5 Å²	125.5	43%	0.429	64%	0.637	S	S	.	*	H	α-helix	trans	-62.9	-36.9	176.7	-78.2	165.5	0	0	0	112.9	F644 L645 L650 T652	F644-L648 HydrophobicContact CD1-CD1 3.87Å; F644-L648 HydrophobicContact CE1-CD1 3.6Å; F644-L648 HydrophobicContact CE1-CG 4.48Å; F644-L648 HydrophobicContact CZ-CD1 4.16Å; F644-L648 PolarHBondContact O-N 2.79Å; L645-L648 PolarHBondContact O-N 3.41Å; L648-L650 VanDerWaalsContact C-N 3.31Å; L648-L650 PolarHBondContact O-N 3.31Å; L648-T652 WeakPolarHBondContact O-CG2 3.48Å; L648-T652 PolarHBondContact O-OG1 3.16Å
649	L	64.7	Low	60.8	Low	130 Å²	130	127.7 Å²	127.7	68%	0.681	65%	0.648	S	S	*	*	H	α-helix	trans	-70.1	-24.3	175.9	-72.6	168.8	0	0	0	113.5	L645 L647 T652	L645-L649 WeakPolarHBondContact O-CG 3.16Å; L645-L649 PolarHBondContact O-N 3.29Å; L645-L649 VanDerWaalsContact O-N 3.11Å; L647-L649 VanDerWaalsContact C-N 3.33Å; L647-L649 PolarHBondContact O-N 2.99Å; L649-T652 PolarHBondContact O-OG1 2.73Å
650	L	65.6	Low	58.4	Low	131 Å²	131	134.1 Å²	134.1	69%	0.686	67%	0.672	S	S	*	*	H	α-helix	trans	-84.7	-29.1	176.6	-71.7	169.3	0	0	0	113.1	L646 L647 L648	L646-L650 WeakPolarHBondContact O-CG 3.43Å; L646-L650 PolarHBondContact O-N 2.62Å; L647-L650 PolarHBondContact O-N 2.85Å; L648-L650 VanDerWaalsContact C-N 3.31Å; L648-L650 PolarHBondContact O-N 3.31Å
651	L	61.5	Low	56.3	Low	140 Å²	140	136.8 Å²	136.8	73%	0.733	68%	0.683	S	S	*	*	H	α-helix	trans	-81.8	-13.3	-177	-71.5	168.3	0	0	0	114.4	L647 R653	L647-L651 WeakPolarHBondContact O-CG 3.27Å; L647-L651 PolarHBondContact O-N 2.97Å; L647-L651 VanDerWaalsContact O-N 3.16Å; L651-R653 VanDerWaalsContact C-N 3.33Å; L651-R653 PolarHBondContact O-N 2.83Å
652	T	55.7	Low	54	Low	106 Å²	106	139.2 Å²	139.2	65%	0.65	70%	0.696	S	S	*	*			trans	-90	23.2	-171.2	38.8	0	0	0	0	115	L648 L649	L648-T652 WeakPolarHBondContact O-CG2 3.48Å; L648-T652 PolarHBondContact O-OG1 3.16Å; L649-T652 PolarHBondContact O-OG1 2.73Å
653	R	51.8	Low	51.9	Low	235 Å²	235	141.2 Å²	141.2	89%	0.887	71%	0.706	S	S	*	*			trans	-110.7	56.7	178.1	-106.2	-169.2	177.7	-161.6	1.1	114.9	L651	L651-R653 VanDerWaalsContact C-N 3.33Å; L651-R653 PolarHBondContact O-N 2.83Å
654	K	45	Very low	49.6	Very low	203 Å²	203	144.5 Å²	144.5	88%	0.883	72%	0.721	S	S	*	*	S	Bend	trans	-162.2	151.5	150.1	-109.3	157.3	-172	178	0	112.2
655	Q	38.4	Very low	47.6	Very low	154 Å²	154	145.2 Å²	145.2	72%	0.72	73%	0.731	S	S	*	*			trans	-31.7	152.6	177.5	-72	-177.3	2.4	0	0	116.7
656	K	38	Very low	45.9	Very low	177 Å²	177	146.8 Å²	146.8	77%	0.77	74%	0.735	S	S	*	*			cis	-156.4	169	25.9	-134.3	150	-174	158.4	0	112.6
657	T	36.3	Very low	43.7	Very low	137 Å²	137	152.4 Å²	152.4	84%	0.84	75%	0.75	S	S	*	*			trans	-73	129.1	178.8	47.2	0	0	0	0	113.7
658	F	32.9	Very low	41.8	Very low	206 Å²	206	154.3 Å²	154.3	90%	0.904	76%	0.755	S	S	*	*			trans	-140.1	148.2	142	-152	-97.3	0	0	0	108.3
659	L	33.4	Very low	40.3	Very low	142 Å²	142	158 Å²	158	74%	0.743	77%	0.769	S	S	*	*			trans	-126.3	127.2	-166.6	-178.2	146.8	0	0	0	110.4	T661	L659-T661 HydrophobicContact CD2-CG2 3.95Å
660	M	28	Very low	38.6	Very low	186 Å²	186	156.8 Å²	156.8	92%	0.916	77%	0.768	S	S	*	*			trans	-144.1	125.3	173.6	-178.3	170.7	171.1	0	0	107.5
661	T	33.8	Very low	36.9	Very low	118 Å²	118	157.4 Å²	157.4	72%	0.724	77%	0.771	S	S	*	*			trans	-104	115.7	-167.9	44.4	0	0	0	0	112.5	L659	L659-T661 HydrophobicContact CD2-CG2 3.95Å
662	N	31.9	Very low	35.3	Very low	148 Å²	148	159.9 Å²	159.9	79%	0.791	78%	0.781	S	S	*	*			trans	27.4	120.8	147.2	-74	11.2	0	0	0	120.4
663	L	34.8	Very low	33.8	Very low	151 Å²	151	163.6 Å²	163.6	79%	0.791	79%	0.788	S	S	*	*			trans	-57.2	154	135.7	-71.9	150.6	0	0	0	110.6
664	N	33.3	Very low	32.9	Very low	159 Å²	159	162.8 Å²	162.8	85%	0.85	79%	0.787	S	S	*	*			trans	-122.6	127	158	-112.8	17.8	0	0	0	107.3
665	D	34.2	Very low	32.4	Very low	144 Å²	144	159.1 Å²	159.1	77%	0.77	78%	0.777	S	S	*	*			trans	-94.1	173.7	-172.8	-87.6	-47.7	0	0	0	114.2
666	E	37.3	Very low	32.1	Very low	127 Å²	127	159.1 Å²	159.1	59%	0.593	78%	0.777	S	S	*	*			trans	-51.1	169.3	-178	-44.6	-179.2	131.8	0	0	116.6	K668	E666-K668 WeakPolarHBondContact OE1-CE 3.41Å; E666-K668 IonicContact OE1-NZ 3.44Å; E666-K668 PolarHBondContact OE1-NZ 3.34Å; E666-K668 IonicContact OE2-NZ 3.92Å; E666-K668 PolarHBondContact OE2-NZ 2.91Å
667	Y	29.5	Very low	31.9	Very low	229 Å²	229	160.1 Å²	160.1	90%	0.898	78%	0.784	S	S	*	*				-139.2	139.8	123.6	-119.1	-84	0	0	0	112.2
668	K	29.3	Very low	31.6	Very low	136 Å²	136	156.7 Å²	156.7	59%	0.591	78%	0.776	S	S	*	*			trans	-89.2	179.2	169.2	-56.6	-172.2	172	84	0	109.1	E666	E666-K668 WeakPolarHBondContact OE1-CE 3.41Å; E666-K668 IonicContact OE1-NZ 3.44Å; E666-K668 PolarHBondContact OE1-NZ 3.34Å; E666-K668 IonicContact OE2-NZ 3.92Å; E666-K668 PolarHBondContact OE2-NZ 2.91Å
669	Q	30	Very low	31.5	Very low	158 Å²	158	156 Å²	156	74%	0.738	78%	0.781	S	S	*	*				172.8	150.1	61.6	-148.8	-176	-33.7	0	0	113.4
670	T	29.2	Very low	31.3	Very low	105 Å²	105	152.5 Å²	152.5	64%	0.644	78%	0.779	S	S	*	*			trans	48.2	120.3	149.5	43.9	0	0	0	0	121.7
671	L	30	Very low	31.6	Very low	144 Å²	144	149.7 Å²	149.7	75%	0.754	77%	0.772	S	S	*	*				72.7	125.8	62.1	-168.6	154.7	0	0	0	115.1
672	M	27.4	Very low	31.4	Very low	193 Å²	193	151.1 Å²	151.1	95%	0.951	78%	0.776	S	S	*	*			trans	-140.7	173.2	159.2	-84.5	-124.4	173.6	0	0	110.6
673	K	26	Very low	31.2	Very low	183 Å²	183	149.6 Å²	149.6	80%	0.796	78%	0.775	S	S	*	*			trans	-116.3	159.2	-161.5	-78.7	-177	172.1	-177.1	0	115.2
674	Y	32.8	Very low	30.9	Very low	218 Å²	218	152.4 Å²	152.4	86%	0.855	78%	0.781	S	S	*	*			trans	4.1	142.2	139.7	-79.2	-93.3	0	0	0	117.8
675	N	32.8	Very low	30.7	Very low	126 Å²	126	149.2 Å²	149.2	67%	0.674	78%	0.777	S	S	*	*				-163	151.8	73	62.9	-49.9	0	0	0	118.7
676	E	32.5	Very low	30.6	Very low	155 Å²	155	151.2 Å²	151.2	72%	0.724	78%	0.781	S	S	*	*			trans	66.7	142.4	138.8	-71.7	156.3	161.8	0	0	124.9
677	E	33.8	Very low	31.3	Very low	197 Å²	197	149.6 Å²	149.6	92%	0.921	78%	0.782	S	S	*	*			trans	60.3	150	159.8	-65.3	174.8	-174.8	0	0	120.6
678	G	29.8	Very low	31.3	Very low	65 Å²	65	144.9 Å²	144.9	67%	0.67	77%	0.773	S	S	*	*			cis	158.5	114.1	-12.9	0	0	0	0	0	115.7
679	L	31.1	Very low	31.4	Very low	193 Å²	193	145.1 Å²	145.1	100%	1.01	78%	0.779	S	S	*	*			trans	64.8	155	164.5	-61.4	164.5	0	0	0	120.2
680	G	29.7	Very low	31.3	Very low	67 Å²	67	144.7 Å²	144.7	69%	0.691	78%	0.781	S	S	*	*			trans	119.3	70.2	141.1	0	0	0	0	0	123.2
681	T	33.5	Very low	31.2	Very low	128 Å²	128	143.4 Å²	143.4	79%	0.785	78%	0.781	S	S	*	*			trans	30.3	136.1	137.5	54.3	0	0	0	0	125.3
682	D	31.4	Very low	31.1	Very low	148 Å²	148	141.8 Å²	141.8	79%	0.791	78%	0.781	S	S	*	*			trans	65.8	128.2	136.9	-65.1	10.5	0	0	0	124.7
683	C	26.1	Very low	31.2	Very low	116 Å²	116	141.3 Å²	141.3	78%	0.784	77%	0.774	S	S	*	*				176.4	122	108.7	-92.9	0	0	0	0	117.4
684	K	29.1	Very low	31.3	Very low	210 Å²	210	138 Å²	138	91%	0.913	77%	0.769	S	S	*	*			trans	56.3	175.6	140.5	-67.5	-177.6	177	177.2	0	121
685	A	28.7	Very low	31.1	Very low	92 Å²	92	133 Å²	133	76%	0.76	76%	0.761	S	S	*	*			trans	-149.4	173.9	-158.8	0	0	0	0	0	115
686	E	32.7	Very low	30.9	Very low	185 Å²	185	133.9 Å²	133.9	86%	0.864	76%	0.762	S	S	*	*			trans	69.8	168.4	159.3	-99.2	-165.6	-152.2	0	0	118.9
687	P	52.7	Low	30.7	Very low	94 Å²	94	130 Å²	130	61%	0.61	75%	0.752	S	S	*	*			cis	-136.8	177.9	-3.8	32.1	-9.9	0	0	0	117.6
688	N	29.6	Very low	30.3	Very low	130 Å²	130	128.3 Å²	128.3	70%	0.695	75%	0.747	S	S	*	*				127.8	130.5	109.9	-126.2	-15.5	0	0	0	121.9
689	I	31.3	Very low	30.6	Very low	141 Å²	141	130.6 Å²	130.6	72%	0.723	75%	0.748	S	S	*	*			trans	55.4	154.4	157.1	43.1	176.6	0	0	0	121
690	L	27.3	Very low	30.5	Very low	149 Å²	149	128.7 Å²	128.7	78%	0.78	74%	0.739	S	S	*	*			cis	-152.6	142.4	17.7	-160.8	89.8	0	0	0	115
691	A	27.1	Very low	30.5	Very low	78 Å²	78	129.1 Å²	129.1	65%	0.645	74%	0.744	S	S	*	*			trans	55.3	110.4	143.5	0	0	0	0	0	126.1
692	S	28.6	Very low	30.3	Very low	109 Å²	109	130 Å²	130	76%	0.762	74%	0.742	S	S	*	*				107.4	140.3	102	76.2	0	0	0	0	125
693	K	28.8	Very low	30.3	Very low	184 Å²	184	132.1 Å²	132.1	80%	0.8	74%	0.744	S	S	*	*			trans	76.5	98.3	138.3	-82.5	-174.7	175.1	-172.3	0	124.5
694	T	27.8	Very low	30.5	Very low	114 Å²	114	135.3 Å²	135.3	70%	0.699	75%	0.752	S	S	*	*				54.6	155.8	111.5	59.6	0	0	0	0	124.7
695	T	28.6	Very low	30.4	Very low	111 Å²	111	128 Å²	128	68%	0.681	74%	0.736	S	S	*	*			trans	84.1	110.8	145.1	33.1	0	0	0	0	122.1
696	E	28.1	Very low	30.5	Very low	146 Å²	146	129.4 Å²	129.4	68%	0.682	74%	0.74	S	S	*	*				55.9	112	121.6	-65.9	-178.7	150.2	0	0	123.5
697	S	28.6	Very low	30.1	Very low	74 Å²	74	128.2 Å²	128.2	52%	0.517	74%	0.737	S	S	.	*				85.4	167.3	118.5	81.8	0	0	0	0	122.2
698	I	26.6	Very low	29.1	Very low	160 Å²	160	130.4 Å²	130.4	82%	0.821	74%	0.739	S	S	*	*			trans	80.6	140	161	-67.9	166.6	0	0	0	118.1
699	T	34.6	Very low	29	Very low	113 Å²	113	130.3 Å²	130.3	69%	0.693	74%	0.738	S	S	*	*			trans	-103.4	154.9	173.7	55.4	0	0	0	0	110.7
700	D	30	Very low	28.8	Very low	154 Å²	154	130.8 Å²	130.8	82%	0.824	74%	0.741	S	S	*	*				158.5	148.6	127.3	-82.2	5.2	0	0	0	112.1
701	G	28.8	Very low	29.3	Very low	76 Å²	76	133.2 Å²	133.2	78%	0.784	75%	0.748	S	S	*	*			trans	170.1	110.8	177.4	0	0	0	0	0	112.2
702	I	30.4	Very low	29.3	Very low	146 Å²	146	133.8 Å²	133.8	75%	0.749	75%	0.753	S	S	*	*			trans	-118	132.1	-163.2	-70.3	179.2	0	0	0	113
703	K	31	Very low	29.5	Very low	192 Å²	192	134.3 Å²	134.3	84%	0.835	76%	0.757	S	S	*	*			trans	60.4	112.9	159.5	-73.6	169.6	-178.8	174.8	0	120.7
704	L	29.8	Very low	31	Very low	184 Å²	184	131.9 Å²	131.9	96%	0.963	76%	0.76	S	S	*	*				-159.2	152.3	126.5	-131.5	66.7	0	0	0	108
705	G	27.6	Very low	31	Very low	55 Å²	55	130.2 Å²	130.2	57%	0.567	77%	0.765	S	S	*	*			cis	165.9	144	-12	0	0	0	0	0	111
706	S	30.5	Very low	30.9	Very low	122 Å²	122	133.9 Å²	133.9	85%	0.853	78%	0.777	S	S	*	*			trans	57.7	118.2	-177.8	40.7	0	0	0	0	116
707	M	24.7	Very low	31	Very low	160 Å²	160	132.5 Å²	132.5	79%	0.788	78%	0.778	S	S	*	*				99.9	104.8	59.8	-94.4	-170.3	74.5	0	0	114.3
708	Q	30.6	Very low	31.2	Very low	141 Å²	141	137.3 Å²	137.3	66%	0.659	79%	0.792	S	S	*	*				73.8	130.9	127	-89.9	-163.9	-12.8	0	0	123.7
709	N	28.9	Very low	31.3	Very low	127 Å²	127	135.7 Å²	135.7	68%	0.679	79%	0.786	S	S	*	*			trans	76.4	153.5	146.2	-50.2	-16.1	0	0	0	116.4
710	I	27.3	Very low	31.1	Very low	151 Å²	151	138.5 Å²	138.5	77%	0.774	79%	0.793	S	S	*	*			cis	-132	133.3	16.1	-61.4	161.9	0	0	0	111.8	A712	I710-A712 HydrophobicContact CG2-CB 3.98Å
711	E	36.4	Very low	31.1	Very low	201 Å²	201	134.8 Å²	134.8	94%	0.939	79%	0.791	S	S	*	*			trans	-105.5	137.1	141.6	-81	-165.6	133.4	0	0	108.4
712	A	27.6	Very low	31.1	Very low	90 Å²	90	137.1 Å²	137.1	74%	0.744	80%	0.795	S	S	*	*			trans	-161.3	125.2	166.6	0	0	0	0	0	112.3	I710	I710-A712 HydrophobicContact CG2-CB 3.98Å
713	S	33.3	Very low	30.9	Very low	120 Å²	120	135.7 Å²	135.7	84%	0.839	80%	0.797	S	S	*	*			trans	-108.3	-177	153.5	-61.3	0	0	0	0	107.8
714	P	60.4	Low	30.8	Very low	133 Å²	133	133.9 Å²	133.9	86%	0.864	79%	0.791	S	S	*	*			cis	-126	-174.8	-16.4	34	-15	0	0	0	112.7
715	G	28.1	Very low	30.9	Very low	79 Å²	79	133.1 Å²	133.1	81%	0.814	78%	0.775	S	S	*	*			trans	-176.5	137.6	166.7	0	0	0	0	0	114.7
716	M	25.8	Very low	31	Very low	187 Å²	187	135.5 Å²	135.5	92%	0.921	78%	0.779	S	S	*	*			trans	-104.8	158.5	176.8	-68.7	-179.9	171.8	0	0	111.8
717	V	29.4	Very low	30.9	Very low	118 Å²	118	138.9 Å²	138.9	72%	0.715	77%	0.774	S	S	*	*				165.5	117.6	113	157.7	0	0	0	0	112.2
718	Q	32.5	Very low	31.2	Very low	174 Å²	174	136.1 Å²	136.1	81%	0.813	77%	0.771	S	S	*	*			trans	59.2	157.4	150.7	-71.3	164.6	-16.2	0	0	119.8
719	D	29	Very low	31.2	Very low	127 Å²	127	135.6 Å²	135.6	68%	0.679	78%	0.777	S	S	*	*			cis	-141.4	176.6	18.9	-157.4	18.4	0	0	0	116.2
720	M	31.4	Very low	31.2	Very low	172 Å²	172	137 Å²	137	85%	0.847	78%	0.781	S	S	*	*			trans	-18.1	148.3	-177.5	-64.1	-172	-175.2	0	0	121.3
721	G	29.3	Very low	31.2	Very low	76 Å²	76	134.7 Å²	134.7	78%	0.784	78%	0.778	S	S	*	*			cis	150	156.8	-6.5	0	0	0	0	0	115.2
722	S	29.3	Very low	30.8	Very low	124 Å²	124	130 Å²	130	87%	0.867	77%	0.768	S	S	*	*			trans	-167.5	163.5	155.5	-163.4	0	0	0	0	112
723	C	25.6	Very low	30.7	Very low	116 Å²	116	132.6 Å²	132.6	78%	0.784	77%	0.769	S	S	*	*			trans	-71	141.1	-167.4	-65.2	0	0	0	0	114.3
724	H	29.3	Very low	30.3	Very low	154 Å²	154	133.9 Å²	133.9	71%	0.713	76%	0.764	S	S	*	*				69.6	135.4	63.6	-95.6	41.2	0	0	0	113.8
725	R	32.1	Very low	28.7	Very low	169 Å²	169	133.5 Å²	133.5	64%	0.638	76%	0.755	S	S	*	*			cis	-165.6	175.6	11.5	-148.4	-179.6	-154.7	-151.1	4.5	113.9
726	T	29.3	Very low	28.7	Very low	105 Å²	105	135.1 Å²	135.1	64%	0.644	75%	0.749	S	S	*	*			trans	71.5	143.8	155.1	59.1	0	0	0	0	119.2
727	Y	29.6	Very low	28.6	Very low	193 Å²	193	139.1 Å²	139.1	76%	0.757	75%	0.754	S	S	*	*			cis	-160.4	-168.6	-24.1	-116.2	-35.8	0	0	0	111.7
728	S	30.6	Very low	28.5	Very low	101 Å²	101	139.8 Å²	139.8	71%	0.706	75%	0.753	S	S	*	*			trans	-141.6	-167.8	178.2	58.2	0	0	0	0	111.4
729	V	30.9	Very low	28.4	Very low	130 Å²	130	135.6 Å²	135.6	79%	0.788	74%	0.743	S	S	*	*			trans	112.8	156.9	163.3	-175.6	0	0	0	0	116.8
730	M	27.6	Very low	28.5	Very low	158 Å²	158	137.7 Å²	137.7	78%	0.778	75%	0.749	S	S	*	*			trans	-89.2	170.3	-152.7	-48.6	118	59.6	0	0	117.8
731	S	27.2	Very low	28.4	Very low	102 Å²	102	136.3 Å²	136.3	71%	0.713	74%	0.74	S	S	*	*				101.2	134.6	126	68.6	0	0	0	0	123.2
732	S	28.1	Very low	28.5	Very low	103 Å²	103	141.2 Å²	141.2	72%	0.72	74%	0.743	S	S	*	*			trans	85.9	117.3	145.8	69.1	0	0	0	0	122.7
733	N	26.4	Very low	28.4	Very low	143 Å²	143	139.2 Å²	139.2	77%	0.765	74%	0.741	S	S	*	*			trans	73.4	125.7	135.1	-67.5	7.6	0	0	0	124.1
734	M	24.2	Very low	28.4	Very low	148 Å²	148	137.2 Å²	137.2	73%	0.729	74%	0.74	S	S	*	*			trans	67.5	104.3	133.3	-73.9	173.8	64.1	0	0	120.4
735	N	27.4	Very low	28.4	Very low	125 Å²	125	138.2 Å²	138.2	67%	0.668	75%	0.748	S	S	*	*				143.1	145.6	100.1	-88	-4.4	0	0	0	115.1
736	T	27.5	Very low	28.3	Very low	113 Å²	113	138.8 Å²	138.8	69%	0.693	76%	0.755	S	S	*	*			trans	47	111.7	151.2	54.8	0	0	0	0	119.5
737	W	25.1	Very low	28.2	Very low	270 Å²	270	144.9 Å²	144.9	100%	1.023	77%	0.766	S	S	*	*				-107.8	118.4	128.8	-101.8	54.7	0	0	0	108
738	D	27.3	Very low	28.2	Very low	132 Å²	132	142.7 Å²	142.7	71%	0.706	77%	0.768	S	S	*	*			trans	-119.8	114	173.9	-171.7	-5	0	0	0	109
739	S	29.3	Very low	28.2	Very low	86 Å²	86	142.1 Å²	142.1	60%	0.601	76%	0.763	S	S	*	*			trans	43.4	169.3	153.6	71.6	0	0	0	0	123.3
740	Q	31.4	Very low	28.1	Very low	171 Å²	171	147.6 Å²	147.6	80%	0.799	77%	0.77	S	S	*	*			trans	69.5	143.9	162.2	-64.3	-172.4	18.5	0	0	119.5
741	Q	29.7	Very low	28.2	Very low	143 Å²	143	143.1 Å²	143.1	67%	0.668	76%	0.764	S	S	*	*			cis	172.2	150.4	-28.5	-120.1	-169.5	17.5	0	0	106.8
742	Q	30.3	Very low	28.4	Very low	180 Å²	180	143.2 Å²	143.2	84%	0.841	77%	0.765	S	S	*	*			trans	64.6	156.2	155.6	-61.3	-178.3	41.4	0	0	119.3
743	G	27.3	Very low	28.4	Very low	81 Å²	81	144.2 Å²	144.2	84%	0.835	77%	0.767	S	S	*	*			trans	142.8	11.1	170.2	0	0	0	0	0	119.1
744	G	26.7	Very low	28.4	Very low	74 Å²	74	148.7 Å²	148.7	76%	0.763	77%	0.773	S	S	*	*			trans	-81.7	158.1	-178.5	0	0	0	0	0	115
745	M	28.5	Very low	28.6	Very low	176 Å²	176	145.5 Å²	145.5	87%	0.867	77%	0.766	S	S	*	*			trans	-162.1	152.1	163.1	-122.6	-165.2	-162	0	0	116.4
746	K	29.2	Very low	28.8	Very low	181 Å²	181	144 Å²	144	79%	0.787	77%	0.765	S	S	*	*			trans	78.3	106.4	159.5	-65.1	170.2	-176.6	173	0	120
747	R	27.8	Very low	28.9	Very low	232 Å²	232	146 Å²	146	88%	0.875	77%	0.771	S	S	*	*				22.5	142.1	114	-66.7	179.7	174.5	166.1	-2.8	116.7
748	N	29.3	Very low	29.1	Very low	148 Å²	148	143.7 Å²	143.7	79%	0.791	76%	0.762	S	S	*	*			cis	-171.8	168.9	46.8	-146.5	15.8	0	0	0	114.6
749	S	30	Very low	29.3	Very low	88 Å²	88	149.2 Å²	149.2	62%	0.615	77%	0.773	S	S	*	*			trans	74.5	113.2	148	-167.6	0	0	0	0	122.6
750	R	29.5	Very low	29.4	Very low	245 Å²	245	148.4 Å²	148.4	93%	0.925	78%	0.779	S	S	*	*				31	141	129.9	-57.3	172.1	167.1	170.6	-6	121.2
751	G	29	Very low	29.3	Very low	64 Å²	64	147.8 Å²	147.8	66%	0.66	79%	0.786	S	S	*	*				135.8	83.5	116.3	0	0	0	0	0	120.1
752	S	32	Very low	29.4	Very low	105 Å²	105	150.4 Å²	150.4	73%	0.734	80%	0.796	S	S	*	*			trans	43.4	119.1	132.3	60.8	0	0	0	0	122.5
753	T	29.2	Very low	29.5	Very low	123 Å²	123	150.8 Å²	150.8	76%	0.755	80%	0.798	S	S	*	*			trans	70.2	130.6	130.4	60.6	0	0	0	0	123
754	W	26.4	Very low	29.5	Very low	237 Å²	237	150.1 Å²	150.1	90%	0.898	79%	0.791	S	S	*	*				118.1	119.8	117.7	-111.3	8	0	0	0	121.6
755	S	28.3	Very low	29.5	Very low	82 Å²	82	154.6 Å²	154.6	57%	0.573	80%	0.797	S	S	*	*				82.9	104.6	120	74.9	0	0	0	0	122.3
756	S	31.5	Very low	29.6	Very low	93 Å²	93	150.9 Å²	150.9	65%	0.65	79%	0.789	S	S	*	*				56	134.7	116.2	73.5	0	0	0	0	123.1
757	N	28	Very low	29.6	Very low	155 Å²	155	147.7 Å²	147.7	83%	0.829	79%	0.785	S	S	*	*				-163.6	135.7	121.9	-85.4	-43.8	0	0	0	106.7
758	R	30.2	Very low	29.8	Very low	222 Å²	222	145 Å²	145	84%	0.838	78%	0.78	S	S	*	*			cis	72.1	89.4	11.8	-147.2	-175.1	-152.7	-148.1	7.2	116.6
759	R	31.6	Very low	29.7	Very low	248 Å²	248	145.6 Å²	145.6	94%	0.936	78%	0.775	S	S	*	*				176.1	152.4	123.1	-94.9	168.9	-164.9	-140.5	4	111.2
760	G	32.1	Very low	29.6	Very low	69 Å²	69	151.9 Å²	151.9	71%	0.711	79%	0.785	S	S	*	*			trans	-130.7	178.7	163.5	0	0	0	0	0	110.3
761	T	29.6	Very low	29.5	Very low	157 Å²	157	144.7 Å²	144.7	96%	0.963	77%	0.772	S	S	*	*			trans	-149.7	177.6	173.6	0.7	0	0	0	0	111.1
762	F	31.5	Very low	29.6	Very low	198 Å²	198	149.2 Å²	149.2	87%	0.868	78%	0.78	S	S	*	*			trans	-131.5	-177.2	-145.2	-150.7	-102.4	0	0	0	113.5
763	Q	30.8	Very low	29.6	Very low	189 Å²	189	148.7 Å²	148.7	88%	0.883	78%	0.776	S	S	*	*			trans	80.9	144.9	174.6	-52.1	178.6	-25.2	0	0	116.5
764	G	28	Very low	29.7	Very low	67 Å²	67	146.4 Å²	146.4	69%	0.691	77%	0.766	S	S	*	*			cis	165.8	155.3	-9.5	0	0	0	0	0	114.7
765	N	26.3	Very low	30.1	Very low	167 Å²	167	146.6 Å²	146.6	89%	0.893	77%	0.766	S	S	*	*			trans	65.8	151.4	176.9	-66.1	-13.2	0	0	0	117.7
766	S	31.7	Very low	30.4	Very low	99 Å²	99	146.9 Å²	146.9	69%	0.692	77%	0.768	S	S	*	*			cis	-174	177.4	-24.6	63	0	0	0	0	107.6
767	T	29.4	Very low	30.6	Very low	113 Å²	113	149.1 Å²	149.1	69%	0.693	77%	0.773	S	S	*	*			cis	-163.3	153.8	6.2	-15.6	0	0	0	0	109.7
768	F	30.5	Very low	30.9	Very low	177 Å²	177	144.6 Å²	144.6	78%	0.776	76%	0.763	S	S	*	*			trans	66.1	152.6	156.6	-88	-169.3	0	0	0	118.8
769	K	28	Very low	31.1	Very low	160 Å²	160	143.3 Å²	143.3	70%	0.696	76%	0.758	S	S	*	*			cis	-156.2	147.9	-1.4	-136.3	174.2	-176.8	176.1	0	112.7
770	R	28.2	Very low	31.3	Very low	220 Å²	220	136.3 Å²	136.3	83%	0.83	74%	0.743	S	S	*	*			trans	12.8	129.7	147.8	-81.9	-167.7	174.1	-160	-3.5	120.5
771	S	27.7	Very low	31.2	Very low	93 Å²	93	136 Å²	136	65%	0.65	73%	0.729	S	S	*	*				71.8	155	74.2	88.7	0	0	0	0	114.2
772	I	31.1	Very low	31.4	Very low	159 Å²	159	132.3 Å²	132.3	82%	0.815	71%	0.71	S	S	*	*			cis	-151	178.3	15.1	-162.7	147	0	0	0	107.1
773	S	31.6	Very low	31.5	Very low	94 Å²	94	126.1 Å²	126.1	66%	0.657	69%	0.686	S	S	*	*			cis	-142.9	-170.9	24.3	59.8	0	0	0	0	111.2
774	S	32.3	Very low	31.6	Very low	76 Å²	76	123.9 Å²	123.9	53%	0.531	68%	0.679	S	S	.	*			cis	74.9	147.4	22.8	120.2	0	0	0	0	116
775	W	34.3	Very low	32.1	Very low	240 Å²	240	126.1 Å²	126.1	91%	0.909	68%	0.675	S	S	*	*			cis	-154.7	175.4	5.9	-111.4	-33.3	0	0	0	108.2
776	S	34.9	Very low	32.4	Very low	88 Å²	88	126.9 Å²	126.9	62%	0.615	67%	0.666	S	S	*	*			cis	-156.2	-150.3	-9.8	48.6	0	0	0	0	106.4
777	D	35.3	Very low	32.6	Very low	141 Å²	141	130.6 Å²	130.6	75%	0.754	67%	0.665	S	S	*	*			cis	-163.4	-179	-1	-122.6	-51.1	0	0	0	107
778	G	32.8	Very low	32.5	Very low	60 Å²	60	131.8 Å²	131.8	62%	0.619	67%	0.666	S	S	*	*			cis	177.2	157.9	-1.9	0	0	0	0	0	115.2
779	R	36.4	Very low	32.4	Very low	194 Å²	194	129.9 Å²	129.9	73%	0.732	67%	0.669	S	S	*	*			trans	15.8	157.5	149.7	-71.9	-174.5	178.6	-126.9	-8.6	122.7
780	V	34.7	Very low	32.5	Very low	101 Å²	101	128.2 Å²	128.2	61%	0.612	67%	0.672	S	S	*	*			cis	171.3	172.3	-24.4	120.8	0	0	0	0	109.4
781	S	31.1	Very low	32.5	Very low	62 Å²	62	124.4 Å²	124.4	43%	0.434	67%	0.673	S	S	.	*			trans	73.5	149.9	156.8	56.6	0	0	0	0	120.7	K540	K540-S781 PolarHBondContact NZ-OG 3.13Å
782	S	31.9	Very low	32.6	Very low	80 Å²	80	127.2 Å²	127.2	56%	0.559	68%	0.681	S	S	*	*			cis	-179.4	148.7	-17.9	54.4	0	0	0	0	114.9
783	L	34	Very low	32.5	Very low	68 Å²	68	125.7 Å²	125.7	36%	0.356	68%	0.684	S	S	.	*			trans	74.6	169.6	134.6	-74.2	166	0	0	0	125.2	V482 L544	V482-L783 WeakPolarHBondContact O-CG 3.32Å; L544-L783 HydrophobicContact CD1-CD1 3.46Å; L544-L783 VanDerWaalsContact CD1-CD1 3.46Å; L544-L783 HydrophobicContact CD2-CD1 3.78Å; L544-L783 HydrophobicContact CG-CD1 4.29Å
784	L	34.2	Very low	32.4	Very low	143 Å²	143	128.6 Å²	128.6	75%	0.749	69%	0.693	S	S	*	*			trans	-131.9	-163.3	-169.6	-53.6	98.1	0	0	0	110.8
785	D	37.8	Very low	33.1	Very low	113 Å²	113	129.5 Å²	129.5	60%	0.604	70%	0.696	S	S	*	*			cis	-160.8	147.6	8.9	-173.8	19.5	0	0	0	112.5
786	R	33.1	Very low	32.9	Very low	183 Å²	183	124.3 Å²	124.3	69%	0.691	69%	0.692	S	S	*	*			trans	61.5	174.7	151.5	-95.8	152.6	129.5	-180	6.2	121.3
787	R	34.4	Very low	32.5	Very low	178 Å²	178	127.1 Å²	127.1	67%	0.672	70%	0.7	S	S	*	*			cis	-157.4	155.1	9.2	-133	-171.6	-147.2	-142.1	8.6	113.7
788	L	28.9	Very low	32.2	Very low	137 Å²	137	124.8 Å²	124.8	72%	0.717	69%	0.694	S	S	*	*			trans	66.7	159	154.7	-66.6	169.6	0	0	0	118.9
789	T	27.6	Very low	32	Very low	137 Å²	137	127.2 Å²	127.2	84%	0.84	70%	0.702	S	S	*	*			cis	-130	-175.4	16.7	49.5	0	0	0	0	115.3
790	V	29.7	Very low	31.7	Very low	125 Å²	125	125.8 Å²	125.8	76%	0.758	71%	0.709	S	S	*	*			trans	-116.8	145.5	-169	170.1	0	0	0	0	113.3
791	T	29.5	Very low	31.4	Very low	140 Å²	140	128.1 Å²	128.1	86%	0.859	72%	0.718	S	S	*	*			trans	-170.8	159.4	140.9	22.5	0	0	0	0	113.3
792	D	29.3	Very low	31.3	Very low	152 Å²	152	131.9 Å²	131.9	81%	0.813	73%	0.728	S	S	*	*			trans	-69.6	151.2	-175.4	-62.4	-85.1	0	0	0	117.6
793	S	28.3	Very low	31.1	Very low	127 Å²	127	134.8 Å²	134.8	89%	0.888	74%	0.743	S	S	*	*				173.7	162.8	115.7	43.1	0	0	0	0	114.2
794	N	29.2	Very low	31	Very low	156 Å²	156	138.3 Å²	138.3	83%	0.834	76%	0.755	S	S	*	*			trans	-119.8	168.6	-178.6	-124.8	-15.7	0	0	0	108.6
795	P	48	Very low	30.5	Very low	94 Å²	94	140 Å²	140	61%	0.61	76%	0.761	S	S	*	*			cis	-135.7	-168.5	-9.4	42.1	-24.1	0	0	0	114.2
796	T	29.5	Very low	29.9	Very low	132 Å²	132	143.7 Å²	143.7	81%	0.81	77%	0.768	S	S	*	*			trans	66.6	154.9	167.5	60.7	0	0	0	0	116.4
797	D	27.3	Very low	29.7	Very low	147 Å²	147	142.5 Å²	142.5	79%	0.786	77%	0.77	S	S	*	*			cis	-151.5	-178.4	11.1	-159	0.4	0	0	0	112.1
798	S	27.6	Very low	29.5	Very low	91 Å²	91	143.1 Å²	143.1	64%	0.636	77%	0.774	S	S	*	*			trans	68.1	98.6	153.3	62	0	0	0	0	121.5
799	S	29.4	Very low	29.6	Very low	111 Å²	111	144.3 Å²	144.3	78%	0.776	78%	0.776	S	S	*	*				45	125.9	123.7	63.6	0	0	0	0	123.3
800	D	30.7	Very low	29.6	Very low	165 Å²	165	141.1 Å²	141.1	88%	0.882	77%	0.77	S	S	*	*			trans	-52.2	149.1	141	-86.4	-56.2	0	0	0	112.2
801	D	28.8	Very low	29.6	Very low	150 Å²	150	143.4 Å²	143.4	80%	0.802	78%	0.778	S	S	*	*			trans	-151.6	161.4	143.9	-146.9	-18.9	0	0	0	112.4
802	H	28.4	Very low	29.6	Very low	140 Å²	140	139.4 Å²	139.4	65%	0.648	76%	0.764	S	S	*	*			trans	-83.2	165.3	-165.5	-61.4	-74.5	0	0	0	115.6
803	V	27.3	Very low	29.6	Very low	142 Å²	142	139.1 Å²	139.1	86%	0.861	76%	0.762	S	S	*	*			trans	-124.6	122	135.3	-178.7	0	0	0	0	110.1
804	K	31.9	Very low	29.8	Very low	142 Å²	142	138 Å²	138	62%	0.617	76%	0.755	S	S	*	*			trans	-104	150.1	162.6	-68.2	172.2	-178.3	164	0	108.6
805	M	23.7	Very low	29.8	Very low	178 Å²	178	135.4 Å²	135.4	88%	0.877	75%	0.748	S	S	*	*			trans	-136.7	132.9	157.5	-90.4	-72.4	-81.3	0	0	109.7
806	Y	25.9	Very low	29	Very low	191 Å²	191	138.4 Å²	138.4	75%	0.749	76%	0.756	S	S	*	*			trans	-90.8	-169.7	167.3	-76.5	-83.7	0	0	0	107.9
807	Q	28.5	Very low	29	Very low	158 Å²	158	136.9 Å²	136.9	74%	0.738	75%	0.75	S	S	*	*			cis	-171.3	162.2	26.3	-159.6	169.3	-1.6	0	0	112.1
808	Y	30.9	Very low	29.2	Very low	191 Å²	191	135.6 Å²	135.6	75%	0.749	74%	0.743	S	S	*	*			trans	69.8	161.6	152.5	-105.8	-149.4	0	0	0	117.5
809	E	29.5	Very low	29.3	Very low	162 Å²	162	136.6 Å²	136.6	76%	0.757	74%	0.741	S	S	*	*			cis	-139.8	156.8	1.8	-164.4	163.5	-138.6	0	0	109.2
810	G	27.5	Very low	29.3	Very low	69 Å²	69	138.7 Å²	138.7	71%	0.711	74%	0.74	S	S	*	*			trans	-138.8	174.6	-177.1	0	0	0	0	0	113.2
811	N	30.8	Very low	29.1	Very low	174 Å²	174	137 Å²	137	93%	0.93	73%	0.731	S	S	*	*			trans	-161.2	152.4	173.8	-149.3	-12.5	0	0	0	114.8
812	G	30.1	Very low	29	Very low	55 Å²	55	133.9 Å²	133.9	57%	0.567	72%	0.72	S	S	*	*			trans	116.9	63.5	143.2	0	0	0	0	0	121.3
813	N	28.3	Very low	29.1	Very low	146 Å²	146	131.7 Å²	131.7	78%	0.781	72%	0.721	S	S	*	*			trans	59.4	124.3	147.9	-50.5	-16	0	0	0	119.3
814	S	32.3	Very low	29.2	Very low	104 Å²	104	132.3 Å²	132.3	73%	0.727	71%	0.714	S	S	*	*			cis	76.6	143.1	36.3	96.4	0	0	0	0	114.6
815	C	28.6	Very low	28.9	Very low	102 Å²	102	134.8 Å²	134.8	69%	0.689	72%	0.721	S	S	*	*			cis	-160.1	157.4	14	-139.6	0	0	0	0	114.7
816	M	31.7	Very low	29.2	Very low	157 Å²	157	134.1 Å²	134.1	77%	0.773	72%	0.716	S	S	*	*			trans	67.7	159.3	149.3	-76.2	172.2	83	0	0	119.2	L818	M816-L818 HydrophobicContact CE-CD1 4.07Å
817	S	30.9	Very low	29.5	Very low	99 Å²	99	133.6 Å²	133.6	69%	0.692	72%	0.72	S	S	*	*			cis	-164.6	159.2	5.1	119	0	0	0	0	109.1
818	L	29.7	Very low	29.7	Very low	121 Å²	121	133.8 Å²	133.8	63%	0.634	73%	0.726	S	S	*	*			cis	-169.4	173.8	-8.2	-113.3	171	0	0	0	109.6	M816	M816-L818 HydrophobicContact CE-CD1 4.07Å
819	D	29.9	Very low	29.8	Very low	111 Å²	111	130.8 Å²	130.8	59%	0.594	72%	0.723	S	S	*	*			trans	70.2	140.6	147.5	-78.9	-19.2	0	0	0	121.2
820	M	29.9	Very low	30.3	Very low	155 Å²	155	130 Å²	130	76%	0.764	72%	0.723	S	S	*	*			cis	-150.9	156.5	-1.9	-101.5	-154.9	-177.1	0	0	109.3
821	L	26.3	Very low	30.8	Very low	130 Å²	130	130.3 Å²	130.3	68%	0.681	72%	0.715	S	S	*	*			cis	-164.2	-178.3	-23.7	-125.7	-177.8	0	0	0	109.2
822	S	27.5	Very low	31.3	Very low	84 Å²	84	130.6 Å²	130.6	59%	0.587	71%	0.708	S	S	*	*			trans	-81	-165.4	168.8	60	0	0	0	0	111.7
823	S	29.8	Very low	32	Very low	94 Å²	94	133.8 Å²	133.8	66%	0.657	71%	0.712	S	S	*	*			cis	-174.6	163	14.4	14.2	0	0	0	0	107.8
824	E	29.1	Very low	32.8	Very low	156 Å²	156	134.1 Å²	134.1	73%	0.729	71%	0.714	S	S	*	*			cis	-173.1	-169	-13.8	-107.4	175.4	84.2	0	0	108.4
825	Y	26.7	Very low	33.3	Very low	194 Å²	194	136.3 Å²	136.3	76%	0.761	72%	0.717	S	S	*	*			trans	83.2	133.1	161.8	-84.1	-88.5	0	0	0	122.5
826	Q	30	Very low	33.8	Very low	164 Å²	164	138.9 Å²	138.9	77%	0.766	72%	0.723	S	S	*	*			trans	-4.2	147.8	150.1	-62.3	169.3	-24.6	0	0	117.9
827	Q	30.8	Very low	34	Very low	180 Å²	180	134 Å²	134	84%	0.841	71%	0.713	S	S	*	*			cis	-161.2	175.5	49.5	-161	164.6	8.4	0	0	112.7
828	N	32.7	Very low	34.4	Very low	161 Å²	161	135.8 Å²	135.8	86%	0.861	72%	0.722	S	S	*	*			trans	-58.2	131.5	-178.7	-57.1	-13.4	0	0	0	114.2
829	D	33	Very low	35	Very low	129 Å²	129	138.2 Å²	138.2	69%	0.69	73%	0.73	S	S	*	*			trans	-151.7	146.9	131	-166.3	18	0	0	0	110	S831	D829-S831 VanDerWaalsContact CG-OG 3.29Å; D829-S831 WeakPolarHBondContact OD2-CB 3.4Å; D829-S831 PolarHBondContact OD2-OG 3.48Å
830	L	41.9	Very low	35.7	Very low	144 Å²	144	142.2 Å²	142.2	75%	0.754	74%	0.743	S	S	*	*			trans	-114.2	28.6	-175.8	-94	169.9	0	0	0	113	F832	L830-F832 PolarHBondContact O-N 3.48Å
831	S	37.6	Very low	36.2	Very low	77 Å²	77	144.1 Å²	144.1	54%	0.538	75%	0.747	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.3	14	-179.4	43.2	0	0	0	0	115.5	D829	D829-S831 VanDerWaalsContact CG-OG 3.29Å; D829-S831 WeakPolarHBondContact OD2-CB 3.4Å; D829-S831 PolarHBondContact OD2-OG 3.48Å
832	F	41	Very low	37.3	Very low	180 Å²	180	143.2 Å²	143.2	79%	0.789	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-18.2	175.9	168.4	-117.5	0	0	0	113.8	L830 D834	L830-F832 PolarHBondContact O-N 3.48Å; F832-D834 VanDerWaalsContact C-N 3.34Å; F832-D834 PolarHBondContact O-N 3.17Å
833	L	44.6	Very low	38	Very low	121 Å²	121	146.4 Å²	146.4	63%	0.634	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-10.9	-174.6	-69.9	172.7	0	0	0	114.9
834	D	44.1	Very low	38.5	Very low	154 Å²	154	150.2 Å²	150.2	82%	0.824	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-1.9	-170.9	-73.9	-39.3	0	0	0	115.5	F832	F832-D834 VanDerWaalsContact C-N 3.34Å; F832-D834 PolarHBondContact O-N 3.17Å
835	D	43.2	Very low	39.1	Very low	150 Å²	150	149.5 Å²	149.5	80%	0.802	76%	0.758	S	S	*	*			trans	-115.4	31.6	-178.7	-154.6	12.6	0	0	0	114.1	G837	D835-G837 PolarHBondContact O-N 3.24Å; D835-G837 VanDerWaalsContact O-N 3.15Å
836	L	40.7	Very low	40	Very low	156 Å²	156	146.7 Å²	146.7	82%	0.817	76%	0.755	S	S	*	*			trans	-81.9	85.6	166.7	-79.4	173.3	0	0	0	110.7
837	G	35.4	Very low	40.6	Very low	54 Å²	54	146 Å²	146	56%	0.557	76%	0.755	S	S	*	*			trans	-58.4	172.6	179	0	0	0	0	0	116.4	D835 Q839	D835-G837 PolarHBondContact O-N 3.24Å; D835-G837 VanDerWaalsContact O-N 3.15Å; G837-Q839 PolarHBondContact O-N 3.36Å; G837-Q839 VanDerWaalsContact O-N 3.16Å
838	P	38.5	Very low	41	Very low	137 Å²	137	145.4 Å²	145.4	89%	0.89	75%	0.754	S	S	*	*	S	Bend	trans	-84.7	99.8	-149.6	31.4	-37	0	0	0	115.2
839	Q	42.1	Very low	41.4	Very low	171 Å²	171	144.5 Å²	144.5	80%	0.799	75%	0.745	S	S	*	*	S	Bend	trans	-126.6	-1.8	158.1	-72.1	-164.3	-14.7	0	0	115.2	G837	G837-Q839 PolarHBondContact O-N 3.36Å; G837-Q839 VanDerWaalsContact O-N 3.16Å
840	F	44.5	Very low	41.8	Very low	196 Å²	196	145.9 Å²	145.9	86%	0.86	75%	0.753	S	S	*	*			trans	-124.8	52.4	-170.9	-72.3	-78.9	0	0	0	115.5
841	K	40.1	Very low	41.6	Very low	194 Å²	194	148.7 Å²	148.7	84%	0.843	76%	0.758	S	S	*	*			trans	-141.8	63.7	166.7	-76.1	-155.4	174.3	-166	0	114.4
842	T	50.3	Low	41.6	Very low	111 Å²	111	149 Å²	149	68%	0.681	76%	0.761	S	S	*	*	S	Bend	trans	-140.3	25.5	174.7	-24.5	0	0	0	0	115
843	L	42.9	Very low	41.6	Very low	152 Å²	152	149.3 Å²	149.3	80%	0.796	77%	0.765	S	S	*	*	S	Bend	trans	-111.7	-21.8	173.3	-90.5	163.2	0	0	0	114.3	K845	L843-K845 VanDerWaalsContact C-N 3.31Å; L843-K845 PolarHBondContact O-N 3.15Å
844	E	40.4	Very low	41.4	Very low	173 Å²	173	150.1 Å²	150.1	81%	0.808	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-10.4	179.2	-160.6	169.6	-150.1	0	0	113.2
845	K	41.5	Very low	41.1	Very low	141 Å²	141	150.6 Å²	150.6	61%	0.613	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-6.7	-171.7	-140.9	-168.3	175.4	-152.7	0	115.8	L843 E849	L843-K845 VanDerWaalsContact C-N 3.31Å; L843-K845 PolarHBondContact O-N 3.15Å; K845-E849 IonicContact NZ-OE1 2.72Å
846	I	43.9	Very low	40.8	Very low	135 Å²	135	153 Å²	153	69%	0.692	78%	0.78	S	S	*	*	S	Bend	trans	-94.1	-14.9	-177.9	-67.7	174.8	0	0	0	112.2
847	I	42.7	Very low	40.9	Very low	150 Å²	150	150.5 Å²	150.5	77%	0.769	78%	0.781	S	S	*	*	S	Bend	trans	-90.6	-11.3	-175.1	-64.9	176.3	0	0	0	113.2
848	M	40.8	Very low	41.1	Very low	168 Å²	168	156.5 Å²	156.5	83%	0.828	80%	0.795	S	S	*	*	S	Bend	trans	-110.7	-10.4	-177.5	-77.1	-159.6	171.5	0	0	116.8
849	E	40.2	Very low	41.1	Very low	141 Å²	141	159 Å²	159	66%	0.659	79%	0.791	S	S	*	*	S	Bend	trans	-88.4	2.1	-177.2	-92.8	171.5	-166.3	0	0	114.8	K845	K845-E849 IonicContact NZ-OE1 2.72Å
850	N	40.5	Very low	40.7	Very low	159 Å²	159	156 Å²	156	85%	0.85	79%	0.79	S	S	*	*	S	Bend	trans	-117.7	39.7	-176.8	-152.3	1.7	0	0	0	114.1
851	K	38.3	Very low	40.8	Very low	202 Å²	202	153.2 Å²	153.2	88%	0.878	78%	0.783	S	S	*	*	S	Bend	trans	-140.1	21.4	-179.5	-149.2	172.5	-175.9	173.7	0	114.7
852	S	37.8	Very low	40.7	Very low	84 Å²	84	155.7 Å²	155.7	59%	0.587	80%	0.804	S	S	*	*	S	Bend	trans	-120.5	-15.5	-170.6	42.8	0	0	0	0	115.5
853	E	40.3	Very low	40.2	Very low	187 Å²	187	158 Å²	158	87%	0.874	81%	0.81	S	S	*	*	S	Bend	trans	-96.1	-3.2	-174.7	-62.4	-153.6	127.3	0	0	115.4
854	V	41.9	Very low	40.1	Very low	138 Å²	138	158.3 Å²	158.3	84%	0.836	81%	0.81	S	S	*	*	S	Bend	trans	-94.7	1.9	-176.9	-173.2	0	0	0	0	113.2
855	L	37.1	Very low	40.1	Very low	164 Å²	164	157.4 Å²	157.4	86%	0.859	81%	0.811	S	S	*	*	S	Bend	trans	-132	43	-175.7	-74.5	174.1	0	0	0	114.4
856	K	36.9	Very low	40	Very low	201 Å²	201	158.4 Å²	158.4	87%	0.874	82%	0.822	S	S	*	*	S	Bend	trans	-137.5	33.5	169.9	-80.4	-166.2	175	178.2	0	114.4
857	A	42	Very low	39.7	Very low	102 Å²	102	159.9 Å²	159.9	84%	0.843	83%	0.83	S	S	*	*	S	Bend	trans	-136.2	38.6	-179.9	0	0	0	0	0	113.4
858	E	41.4	Very low	39.5	Very low	181 Å²	181	160.5 Å²	160.5	85%	0.846	83%	0.834	S	S	*	*			trans	-151.2	137.7	167.3	-133.8	176.6	-145.2	0	0	111.3
859	K	38.1	Very low	39.5	Very low	188 Å²	188	160 Å²	160	82%	0.817	84%	0.835	S	S	*	*			trans	67.2	126.3	-166	-55	169.6	-175.8	171.1	0	113.3
860	S	34.3	Very low	39.4	Very low	110 Å²	110	161.5 Å²	161.5	77%	0.769	85%	0.848	S	S	*	*	S	Bend	cis	-115.7	111.4	16.5	56.3	0	0	0	0	114.8
861	D	45.6	Very low	39.3	Very low	136 Å²	136	161.7 Å²	161.7	73%	0.727	85%	0.848	S	S	*	*			trans	39.1	92.5	132	-44.6	-6.9	0	0	0	119.1
862	I	38.2	Very low	39.4	Very low	247 Å²	247	158 Å²	158	100%	1.267	85%	0.845	S	S	*	*			trans	-169	0	132.2	-99.4	159.3	0	0	0	109.6

Retrieved 862 of 862 residues in 1233.5 ms (Link to these results)

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