A0A087YDL4_POEFO Loading...

Cadherin-22

Cadherins are calcium-dependent cell adhesion proteins. They preferentially interact with themselves in a homophilic manner in connecting cells; cadherins may thus contribute to the sorting of heterogeneous cell types. PB-cadherins may have a role in the morphological organization of pituitary gland and brain tissues.

AlphaFold DB , UniProt , Accession A0A087YDL4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 806 aa.

						>A0A087YDL4_POEFO|A0A087YDL4
MVPLWTAGPWTLLAALGLLSCCCFKWSEASRTSGTNSGRSEQQEEPSSLERVKRGWVWNQFFVVEEYTGTEPLYVGKIHTDSDEGEGNIKYTISGEGAGSIFIIDELTGDIHATERLDREEKAFYTLRAQARDRLTNAPLEPESEFVIKVQDINDSEPQFLEGPYIGSVAELSPTETSVMKVTASDADDPTYGSSARVVYSVLDGEKFFTVDRHTGIIMTAVADLDRETQDRYELVVKATDMAGQMGGLSGSTTVTIVITDVNDNPPRFPQKMYQFSVSEGAAVGTPVGRVIATDADMGENTDMSYLIIDEGDLFKVTTDVETQEAVVSIKKPLDFESKRIHSVIVEAVNKHVDSRFVDLGSFRDQTIVKVTVSDVDEPPIFLPAEGAVMEVQEDAKVGSLVGIVTARDPDVINKPVSRFSIDPTTDHDMIFHIDAESGAITLGKILDRETAGWHNITVKAVEADNHTMASFSAISIRILDVNDNPPELATPYEAAICEDAKPGQLIHTISVVDRDEPQAGHRFFFTLPSEAASSRHFTLWDVKDNTAGIRTQKSSFNRHEQNVYFLPILVVDSGPPSLSSTGTLTIHVCGCDTDAEGAIQTCNATAYVMSAALSPGALIALLVCMLILIVLVLLILTLKRHRKGQRMAEDEEDMRDNVIKYNDEGGGEQDTQAYDMSALRNLYDFPEAKSCDSGPDIRSLPQWIQANRVGGGVDGAMAAATDFSLFKGYIRKKVEQADADLSVPPYDSFQTYAFEGTSSPALSLSSIHTLSTTSELDFSYLSDWGPRFRQLAGYYAPGKTEEEAS
					

Structure Viewer

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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	36.4	Very low	35.9	Very low	245 Å²	245	144.4 Å²	144.4	100%	1.207	81%	0.805	S	S	*	*				0	154.9	0	-72.2	170.5	173.6	0	0	108.5
2	V	33.1	Very low	35.2	Very low	137 Å²	137	145.2 Å²	145.2	83%	0.83	81%	0.805	S	S	*	*			trans	-154.2	174.3	-173.9	-148.2	0	0	0	0	105.3
3	P	55.8	Low	34.8	Very low	101 Å²	101	146.4 Å²	146.4	66%	0.656	81%	0.808	S	S	*	*			cis	-95.2	-129.4	-19.1	-5.8	30.8	0	0	0	113.2
4	L	34	Very low	34.3	Very low	128 Å²	128	142.3 Å²	142.3	67%	0.67	80%	0.803	S	S	*	*			cis	-162	104.2	11.6	-162.2	134.4	0	0	0	115.7
5	W	32.9	Very low	34	Very low	217 Å²	217	139.1 Å²	139.1	82%	0.822	80%	0.801	S	S	*	*			trans	69	171.4	141.2	-62.6	10.1	0	0	0	118.5
6	T	31.2	Very low	33.7	Very low	111 Å²	111	140.8 Å²	140.8	68%	0.681	81%	0.806	S	S	*	*			cis	-153.3	148.3	1.7	-1.4	0	0	0	0	105.6
7	A	29.7	Very low	33.4	Very low	97 Å²	97	136.6 Å²	136.6	80%	0.802	80%	0.801	S	S	*	*			cis	69.4	109.6	41.6	0	0	0	0	0	115.7
8	G	26.3	Very low	33.1	Very low	79 Å²	79	137.7 Å²	137.7	81%	0.814	80%	0.802	S	S	*	*			trans	146.9	138.2	167	0	0	0	0	0	116.2
9	P	58	Low	32.9	Very low	120 Å²	120	139.5 Å²	139.5	78%	0.779	81%	0.807	S	S	*	*			trans	-112.8	-171.5	-179.3	40.8	-30.8	0	0	0	113.7
10	W	29.2	Very low	32.7	Very low	242 Å²	242	137.9 Å²	137.9	92%	0.917	80%	0.804	S	S	*	*			trans	-176.9	178.6	130.8	-104.4	49.8	0	0	0	111.5
11	T	28	Very low	32.5	Very low	111 Å²	111	136.7 Å²	136.7	68%	0.681	80%	0.802	S	S	*	*			trans	-128	171.3	-158.8	52.3	0	0	0	0	115.7
12	L	28.3	Very low	32.1	Very low	154 Å²	154	130.7 Å²	130.7	81%	0.806	78%	0.783	S	S	*	*			trans	73.6	145.2	165.8	-66.7	152.2	0	0	0	115.7
13	L	29.1	Very low	31.9	Very low	161 Å²	161	130 Å²	130	84%	0.843	78%	0.782	S	S	*	*			cis	-156.4	171.7	33.2	-127.4	145.2	0	0	0	114
14	A	28.7	Very low	30.7	Very low	89 Å²	89	134.5 Å²	134.5	74%	0.736	79%	0.792	S	S	*	*			trans	-63.2	156.8	-165.3	0	0	0	0	0	122.3
15	A	29	Very low	30.4	Very low	94 Å²	94	138 Å²	138	78%	0.777	80%	0.802	S	S	*	*				-173.7	120.3	126	0	0	0	0	0	109.9
16	L	28.7	Very low	30.1	Very low	167 Å²	167	139.4 Å²	139.4	87%	0.874	81%	0.807	S	S	*	*				92.3	124.6	63.4	-106.4	172.7	0	0	0	115.1	L18	L16-L18 HydrophobicContact CD2-CD1 4.36Å
17	G	28.6	Very low	30.1	Very low	70 Å²	70	139.3 Å²	139.3	72%	0.722	81%	0.811	S	S	*	*			trans	128.3	78	177.3	0	0	0	0	0	113.5
18	L	28.8	Very low	30	Very low	155 Å²	155	144.3 Å²	144.3	81%	0.812	82%	0.818	S	S	*	*				63.7	106.3	68.4	-78.6	172.7	0	0	0	116.5	L16	L16-L18 HydrophobicContact CD2-CD1 4.36Å
19	L	29.8	Very low	30.3	Very low	172 Å²	172	145 Å²	145	90%	0.901	82%	0.816	S	S	*	*			trans	155.1	139.5	148.3	-87.2	162.5	0	0	0	107.9
20	S	28.9	Very low	28.9	Very low	108 Å²	108	144.9 Å²	144.9	76%	0.755	82%	0.818	S	S	*	*			cis	-155.2	156.1	-22.1	-163.7	0	0	0	0	108.2
21	C	27.6	Very low	28.9	Very low	113 Å²	113	145.1 Å²	145.1	76%	0.764	82%	0.819	S	S	*	*			trans	-125.8	142.5	178.6	-171.3	0	0	0	0	110.9
22	C	29.1	Very low	29.1	Very low	119 Å²	119	146.5 Å²	146.5	80%	0.804	83%	0.827	S	S	*	*			trans	-125.7	98.6	-178.9	-79.4	0	0	0	0	111.5
23	C	28.4	Very low	29.2	Very low	121 Å²	121	145 Å²	145	82%	0.818	83%	0.83	S	S	*	*			trans	-115.1	125	161.7	-74.2	0	0	0	0	108.7
24	F	29.9	Very low	29.3	Very low	196 Å²	196	141.1 Å²	141.1	86%	0.86	83%	0.828	S	S	*	*			trans	-98.7	122.2	170.5	-105.6	-88.7	0	0	0	110.1
25	K	27.6	Very low	29.4	Very low	201 Å²	201	143.7 Å²	143.7	87%	0.874	84%	0.835	S	S	*	*			trans	-113.1	143.8	155.2	-85.7	-168.1	172.2	-174.9	0	108.2
26	W	27.3	Very low	29.5	Very low	247 Å²	247	147.1 Å²	147.1	94%	0.936	84%	0.84	S	S	*	*			trans	-78.8	155.1	170.5	-99.2	38.4	0	0	0	111.5
27	S	30.2	Very low	29.5	Very low	109 Å²	109	144.7 Å²	144.7	76%	0.762	84%	0.837	S	S	*	*			trans	-100.1	150.9	-176.5	57.5	0	0	0	0	112
28	E	28.7	Very low	29.6	Very low	203 Å²	203	145.1 Å²	145.1	95%	0.949	84%	0.841	S	S	*	*			trans	-124.7	139.5	156.8	-163.5	153.5	-134.1	0	0	109.2
29	A	32.1	Very low	29.7	Very low	92 Å²	92	148.8 Å²	148.8	76%	0.76	84%	0.844	S	S	*	*			trans	-111.7	132.7	-158.1	0	0	0	0	0	113.3
30	S	29.1	Very low	29.6	Very low	118 Å²	118	146.1 Å²	146.1	83%	0.825	84%	0.84	S	S	*	*			trans	-76.2	148.5	169.5	52.4	0	0	0	0	111.6
31	R	29.8	Very low	29.8	Very low	248 Å²	248	148 Å²	148	94%	0.936	84%	0.837	S	S	*	*			trans	-107	138.7	170.2	-79.8	-174.8	171.9	178.9	-1.3	110.7
32	T	32.1	Very low	29.9	Very low	139 Å²	139	150.6 Å²	150.6	85%	0.853	84%	0.838	S	S	*	*			trans	-88.5	162.8	178	42.7	0	0	0	0	112.4
33	S	29	Very low	30	Very low	124 Å²	124	151.8 Å²	151.8	87%	0.867	83%	0.832	S	S	*	*			trans	-77.6	153.7	175.4	48.3	0	0	0	0	112.6
34	G	31.4	Very low	30.2	Very low	78 Å²	78	154 Å²	154	80%	0.804	83%	0.83	S	S	*	*			trans	-151.2	120.9	170.7	0	0	0	0	0	110.3
35	T	30.2	Very low	30.6	Very low	144 Å²	144	153.2 Å²	153.2	88%	0.883	83%	0.829	S	S	*	*			trans	-105.4	135.6	179.5	40.4	0	0	0	0	111
36	N	31.7	Very low	31.7	Very low	165 Å²	165	149 Å²	149	88%	0.882	82%	0.822	S	S	*	*			trans	-155.4	159.8	149.7	-145.1	-12.4	0	0	0	111
37	S	29.6	Very low	32	Very low	117 Å²	117	142.7 Å²	142.7	82%	0.818	82%	0.816	S	S	*	*			trans	-109.8	148	-172.3	59.1	0	0	0	0	113.6
38	G	30.2	Very low	32.4	Very low	78 Å²	78	142.9 Å²	142.9	80%	0.804	82%	0.817	S	S	*	*			trans	-157.8	140.3	173	0	0	0	0	0	108.6
39	R	30.4	Very low	32.9	Very low	233 Å²	233	141.6 Å²	141.6	88%	0.879	82%	0.816	S	S	*	*			trans	-132.2	110.4	-158.6	176.2	-172.4	171.7	177.6	-0.7	113.6
40	S	27.8	Very low	33.3	Very low	115 Å²	115	146.1 Å²	146.1	80%	0.804	82%	0.821	S	S	*	*			trans	-180	148.8	151.4	51.3	0	0	0	0	109
41	E	33.8	Very low	33.8	Very low	147 Å²	147	152.1 Å²	152.1	69%	0.687	83%	0.826	S	S	*	*			cis	-176.7	150.9	-32.8	-152.3	164.6	-124.9	0	0	103.4
42	Q	30.1	Very low	34.3	Very low	169 Å²	169	146.8 Å²	146.8	79%	0.79	82%	0.821	S	S	*	*			trans	65	138.1	173.3	-55	173.6	6.1	0	0	116.7
43	Q	30.6	Very low	35.1	Very low	144 Å²	144	145.6 Å²	145.6	67%	0.673	80%	0.804	S	S	*	*			cis	177.8	142.7	-5.3	177.5	162.5	-10.7	0	0	106.2
44	E	33.3	Very low	35.8	Very low	166 Å²	166	151 Å²	151	78%	0.776	81%	0.805	S	S	*	*			trans	65.4	133.2	160	-76.3	154.5	-138.2	0	0	124.3
45	E	37	Very low	36.6	Very low	180 Å²	180	150 Å²	150	84%	0.841	80%	0.795	S	S	*	*			trans	-38.9	179.6	168.3	-67.7	-159.3	157.8	0	0	120.9
46	P	50.5	Low	37.5	Very low	113 Å²	113	149.9 Å²	149.9	73%	0.734	78%	0.779	S	S	*	*			cis	-137.3	173.8	-44.4	37.9	-22.3	0	0	0	112.6
47	S	34.9	Very low	38.5	Very low	115 Å²	115	147.7 Å²	147.7	80%	0.804	77%	0.771	S	S	*	*			trans	-149.5	124.5	160.6	64.4	0	0	0	0	112.2
48	S	37.6	Very low	39.8	Very low	113 Å²	113	152.9 Å²	152.9	79%	0.79	77%	0.773	S	S	*	*			trans	-70.2	135.2	-178.7	47.3	0	0	0	0	113.2	E50	S48-E50 PolarHBondContact O-N 3.39Å
49	L	40	Very low	41.7	Very low	175 Å²	175	154.4 Å²	154.4	92%	0.916	76%	0.762	S	S	*	*			trans	-80.6	111.1	165.8	-72.1	166.5	0	0	0	109.3
50	E	39.6	Very low	44.3	Very low	187 Å²	187	146.7 Å²	146.7	87%	0.874	74%	0.736	S	S	*	*			trans	-67.2	147.3	170.6	-73.2	-170.4	131.7	0	0	111.6	S48	S48-E50 PolarHBondContact O-N 3.39Å
51	R	39.5	Very low	47.3	Very low	244 Å²	244	143.3 Å²	143.3	92%	0.921	71%	0.707	S	S	*	*			trans	-106.7	103.7	-174.2	-160.2	-176.7	-161.8	-172.6	5.4	109.1	K53	R51-K53 PolarHBondContact O-N 3.35Å
52	V	41.6	Very low	49.9	Very low	137 Å²	137	140.6 Å²	140.6	83%	0.83	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-60.4	123.7	-179.6	-178.3	0	0	0	0	110.4	R54	V52-R54 PolarHBondContact O-N 2.75Å
53	K	47.9	Very low	52.8	Low	114 Å²	114	132.8 Å²	132.8	50%	0.496	66%	0.657	S	S	.	*	P	Polyproline II helix	trans	-60.8	128.2	177.7	-154	174.5	-171.3	176.7	0	109.1	R51 D81 E141	R51-K53 PolarHBondContact O-N 3.35Å; K53-D81 WeakPolarHBondContact CE-OD1 3.34Å; K53-D81 WeakPolarHBondContact CE-OD2 3.37Å; K53-D81 IonicContact NZ-OD1 2.68Å; K53-D81 PolarHBondContact NZ-OD1 2.98Å; K53-D81 IonicContact NZ-OD2 3.61Å; K53-E141 IonicContact NZ-OE1 3.55Å; K53-E141 PolarHBondContact NZ-OE1 2.87Å; K53-E141 IonicContact NZ-OE2 3.68Å; K53-E141 PolarHBondContact NZ-OE2 2.91Å
54	R	44.7	Very low	55.5	Low	236 Å²	236	128.8 Å²	128.8	89%	0.891	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-80.3	136.3	172.8	-73.9	-175.8	174.2	-174.2	-3	108.7	V52	V52-R54 PolarHBondContact O-N 2.75Å
55	G	48.6	Very low	58.2	Low	59 Å²	59	121 Å²	121	61%	0.608	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-63.6	161.1	172.4	0	0	0	0	0	112.4	V57	G55-V57 WeakPolarHBondContact O-CG2 2.92Å
56	W	48.3	Very low	60.4	Low	141 Å²	141	115.9 Å²	115.9	53%	0.534	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-52.1	138.6	-177	-60.3	89.9	0	0	0	113.2	H79	W56-H79 WeakPolarHBondContact CH2-O 3.38Å
57	V	53.3	Low	61.8	Low	119 Å²	119	115.5 Å²	115.5	72%	0.721	57%	0.567	S	S	*	*	S	Bend	trans	-125.9	30.6	179.8	-158	0	0	0	0	111.8	G55	G55-V57 WeakPolarHBondContact O-CG2 2.92Å
58	W	56.9	Low	63.5	Low	226 Å²	226	115.1 Å²	115.1	86%	0.856	56%	0.56	S	S	*	*			trans	-145.4	99.8	164.2	-64.1	107.6	0	0	0	107.7
59	N	69.9	Low	65.1	Low	109 Å²	109	111.5 Å²	111.5	58%	0.583	54%	0.54	S	S	*	.			trans	-107.5	10	-176.3	69.1	-47.2	0	0	0	113.4	F146 V147	N59-F146 WeakPolarHBondContact O-CA 3.35Å; N59-V147 PolarHBondContact O-N 2.79Å
60	Q	85.3	Confident	66.6	Low	72 Å²	72	110.1 Å²	110.1	34%	0.336	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	138	176.5	64.8	-174.7	2.5	0	0	111.5	F62 V147	Q60-F62 HydrophobicContact CG-CE2 3.99Å; Q60-F62 HydrophobicContact CG-CZ 4.2Å; Q60-V147 CarbonylContact C-O 3.56Å; Q60-V147 WeakPolarHBondContact CA-O 2.92Å
61	F	89.3	Confident	68.5	Low	43 Å²	43	108.3 Å²	108.3	19%	0.189	53%	0.531	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	166.4	161.5	-63.8	-76.5	0	0	0	109.4	V75 I78 I111 F146 V147 I148 K149	F61-V75 HydrophobicContact CB-CG1 3.81Å; F61-V75 HydrophobicContact CG-CG1 4.44Å; F61-I78 HydrophobicContact CE2-CG2 4.22Å; F61-I78 HydrophobicContact CZ-CG2 4.06Å; F61-I111 HydrophobicContact CE2-CD1 4.34Å; F61-F146 AromaticContact CD2-CD2 3.51Å; F61-F146 HydrophobicContact CD2-CD2 3.51Å; F61-F146 AromaticContact CD2-CE2 3.76Å; F61-F146 HydrophobicContact CD2-CE2 3.76Å; F61-F146 HydrophobicContact CD2-CG 4.38Å; F61-F146 AromaticContact CE2-CD2 3.73Å; F61-F146 HydrophobicContact CE2-CD2 3.73Å; F61-F146 AromaticContact CE2-CE2 3.93Å; F61-F146 HydrophobicContact CE2-CE2 3.93Å; F61-F146 HydrophobicContact CE2-CG 4.24Å; F61-V147 PolarHBondContact N-O 2.93Å; F61-I148 HydrophobicContact CB-CG1 4.48Å; F61-K149 PolarHBondContact O-N 2.75Å
62	F	88.8	Confident	70.6	Confident	91 Å²	91	99.8 Å²	99.8	40%	0.399	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	138.8	178.1	-68	-82.8	0	0	0	109.5	Q60 K149 Q151	Q60-F62 HydrophobicContact CG-CE2 3.99Å; Q60-F62 HydrophobicContact CG-CZ 4.2Å; F62-K149 WeakPolarHBondContact CA-O 3.5Å; F62-K149 HydrophobicContact CD1-CB 3.83Å; F62-K149 HydrophobicContact CE1-CB 3.95Å; F62-K149 HydrophobicContact CE1-CD 3.79Å; F62-K149 HydrophobicContact CE1-CG 4.48Å; F62-K149 HydrophobicContact CZ-CD 4.3Å; F62-Q151 HydrophobicContact CB-CG 3.92Å; F62-Q151 HydrophobicContact CD1-CG 3.82Å; F62-Q151 HydrophobicContact CG-CG 4.29Å
63	V	90.2	Very high	72.8	Confident	4 Å²	4	95 Å²	95	2%	0.024	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	135.6	177.1	62.9	0	0	0	0	108.2	L73 V75 A113 L117 I148 K149 V150 Q151	V63-L73 HydrophobicContact CG2-CD2 3.56Å; V63-L73 HydrophobicContact CG2-CG 4.22Å; V63-V75 HydrophobicContact CB-CG1 4.31Å; V63-V75 HydrophobicContact CB-CG2 4.14Å; V63-V75 HydrophobicContact CG2-CG2 3.9Å; V63-A113 HydrophobicContact CG2-CB 4.31Å; V63-L117 HydrophobicContact CB-CD1 4.23Å; V63-L117 HydrophobicContact CG1-CD1 3.36Å; V63-L117 HydrophobicContact CG2-CD1 3.81Å; V63-I148 HydrophobicContact CB-CG2 4.14Å; V63-I148 HydrophobicContact CG1-CG2 3.47Å; V63-I148 VanDerWaalsContact CG1-CG2 3.47Å; V63-K149 PolarHBondContact N-O 2.96Å; V63-V150 HydrophobicContact CG1-CG2 4.37Å; V63-V150 CarbonylContact O-C 3.56Å; V63-V150 WeakPolarHBondContact O-CA 3.32Å; V63-Q151 PolarHBondContact O-N 2.93Å
64	V	88.1	Confident	74.8	Confident	61 Å²	61	95.6 Å²	95.6	37%	0.37	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	141.7	179.1	-179.4	0	0	0	0	109.5	Q151 I153	V64-Q151 HydrophobicContact CG2-CB 4.26Å; V64-I153 HydrophobicContact CG1-CD1 3.66Å; V64-I153 HydrophobicContact CG1-CG1 3.99Å
65	E	89.8	Confident	76.9	Confident	2 Å²	2	84.9 Å²	84.9	1%	0.009	44%	0.437	C	S	.	.	S	Bend	trans	-80.4	176.2	-179.9	77.9	-167.1	117.2	0	0	114.8	Y67 L117 R119 V150 Q151 D152 I153	E65-Y67 PolarHBondContact O-N 3.03Å; E65-L117 WeakPolarHBondContact CB-O 3.46Å; E65-R119 WeakPolarHBondContact OE2-CB 3.46Å; E65-R119 PolarHBondContact OE2-N 3.36Å; E65-V150 HydrophobicContact CB-CG1 3.6Å; E65-Q151 PolarHBondContact N-O 2.82Å; E65-D152 WeakPolarHBondContact OE1-CA 3.34Å; E65-I153 HydrophobicContact CG-CB 4.04Å; E65-I153 HydrophobicContact CG-CD1 4.15Å; E65-I153 HydrophobicContact CG-CG1 4.02Å; E65-I153 WeakPolarHBondContact O-CD1 3.43Å; E65-I153 PolarHBondContact OE1-N 2.86Å
66	E	83.4	Confident	78.8	Confident	72 Å²	72	82.4 Å²	82.4	34%	0.336	41%	0.412	S	S	.	.	S	Bend	trans	39.6	36.8	-178.9	-104.2	-60	131.7	0	0	114.7	T68 R116 L117	E66-T68 WeakPolarHBondContact O-CG2 3.21Å; E66-T68 PolarHBondContact O-N 2.99Å; E66-R116 VanDerWaalsContact CD-NH1 3.33Å; E66-R116 WeakPolarHBondContact OE1-CD 3.48Å; E66-R116 IonicContact OE1-NH1 3.18Å; E66-R116 PolarHBondContact OE1-NH1 2.75Å; E66-R116 IonicContact OE2-CZ 3.42Å; E66-R116 IonicContact OE2-NE 3.88Å; E66-R116 IonicContact OE2-NH1 2.61Å; E66-R116 PolarHBondContact OE2-NH1 2.88Å; E66-L117 PolarHBondContact N-O 3.42Å
67	Y	80.1	Confident	80.7	Confident	105 Å²	105	80 Å²	80	41%	0.412	41%	0.405	S	S	.	.			trans	-66.8	110.8	-175.1	-177.9	-105.4	0	0	0	110.8	E65 G69 L73	E65-Y67 PolarHBondContact O-N 3.03Å; Y67-G69 VanDerWaalsContact C-N 3.28Å; Y67-G69 VanDerWaalsContact CE1-CA 3.48Å; Y67-G69 PolarHBondContact O-N 2.99Å; Y67-L73 HydrophobicContact CD1-CB 3.8Å; Y67-L73 HydrophobicContact CD1-CD1 4.34Å; Y67-L73 HydrophobicContact CD1-CD2 4.24Å; Y67-L73 HydrophobicContact CD1-CG 4.35Å; Y67-L73 HydrophobicContact CD2-CD1 4.13Å; Y67-L73 HydrophobicContact CD2-CD2 4.15Å; Y67-L73 HydrophobicContact CE1-CB 4.06Å; Y67-L73 HydrophobicContact CE1-CD1 4.24Å; Y67-L73 HydrophobicContact CE2-CD1 4.04Å; Y67-L73 HydrophobicContact CG-CB 4.25Å; Y67-L73 HydrophobicContact CG-CD1 4.28Å; Y67-L73 HydrophobicContact CG-CD2 3.81Å; Y67-L73 HydrophobicContact CG-CG 4.34Å
68	T	70	Confident	82.3	Confident	108 Å²	108	75.1 Å²	75.1	66%	0.663	38%	0.375	S	S	*	.			trans	-82.7	3.7	-173	52.1	0	0	0	0	114.7	E66	E66-T68 WeakPolarHBondContact O-CG2 3.21Å; E66-T68 PolarHBondContact O-N 2.99Å
69	G	72.7	Confident	83.7	Confident	36 Å²	36	69.1 Å²	69.1	37%	0.371	36%	0.356	S	S	.	.			trans	-69.9	158.3	-179.8	0	0	0	0	0	114.2	Y67	Y67-G69 VanDerWaalsContact C-N 3.28Å; Y67-G69 VanDerWaalsContact CE1-CA 3.48Å; Y67-G69 PolarHBondContact O-N 2.99Å
70	T	70.4	Confident	84.2	Confident	146 Å²	146	64.1 Å²	64.1	90%	0.896	33%	0.329	S	S	*	.	S	Bend	trans	-94.6	0.1	178.7	54.6	0	0	0	0	114
71	E	79.8	Confident	83.9	Confident	150 Å²	150	66.4 Å²	66.4	70%	0.701	34%	0.344	S	S	*	.	S	Bend	trans	-115.7	145.9	178.7	-63.9	-177.2	173.9	0	0	109	L73	E71-L73 PolarHBondContact O-N 3.12Å
72	P	83.3	Confident	83.2	Confident	65 Å²	65	67.1 Å²	67.1	42%	0.422	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-56	128.8	178.6	-26.8	36.2	0	0	0	112.2	Y74 H112 A113 T114	P72-Y74 PolarHBondContact O-N 3.49Å; P72-H112 HydrophobicContact CB-CB 3.75Å; P72-A113 CarbonylContact C-O 3.59Å; P72-A113 VanDerWaalsContact CA-O 3.24Å; P72-A113 WeakPolarHBondContact CA-O 3.29Å; P72-A113 WeakPolarHBondContact CB-O 3.34Å; P72-T114 HydrophobicContact CB-CG2 4.11Å; P72-T114 HydrophobicContact CG-CG2 4.05Å
73	L	87.1	Confident	82.5	Confident	37 Å²	37	64.2 Å²	64.2	19%	0.194	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	116.7	-175.1	176.4	59.2	0	0	0	110.4	V63 Y67 E71 V75 H112 A113	V63-L73 HydrophobicContact CG2-CD2 3.56Å; V63-L73 HydrophobicContact CG2-CG 4.22Å; Y67-L73 HydrophobicContact CD1-CB 3.8Å; Y67-L73 HydrophobicContact CD1-CD1 4.34Å; Y67-L73 HydrophobicContact CD1-CD2 4.24Å; Y67-L73 HydrophobicContact CD1-CG 4.35Å; Y67-L73 HydrophobicContact CD2-CD1 4.13Å; Y67-L73 HydrophobicContact CD2-CD2 4.15Å; Y67-L73 HydrophobicContact CE1-CB 4.06Å; Y67-L73 HydrophobicContact CE1-CD1 4.24Å; Y67-L73 HydrophobicContact CE2-CD1 4.04Å; Y67-L73 HydrophobicContact CG-CB 4.25Å; Y67-L73 HydrophobicContact CG-CD1 4.28Å; Y67-L73 HydrophobicContact CG-CD2 3.81Å; Y67-L73 HydrophobicContact CG-CG 4.34Å; E71-L73 PolarHBondContact O-N 3.12Å; L73-V75 PolarHBondContact O-N 3Å; L73-H112 CarbonylContact O-C 3.44Å; L73-H112 VanDerWaalsContact O-CA 3.25Å; L73-H112 WeakPolarHBondContact O-CA 3.36Å; L73-A113 HydrophobicContact CB-CB 4.41Å; L73-A113 PolarHBondContact N-O 3.01Å; L73-A113 PolarHBondContact O-N 2.9Å
74	Y	89.9	Confident	81.7	Confident	125 Å²	125	72.8 Å²	72.8	49%	0.49	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	121.3	176.3	174.5	-96.2	0	0	0	111.5	P72 G76 D110 H112	P72-Y74 PolarHBondContact O-N 3.49Å; Y74-G76 VanDerWaalsContact CE2-O 3.29Å; Y74-G76 WeakPolarHBondContact CE2-O 3.24Å; Y74-D110 HydrophobicContact CD2-CB 4.36Å; Y74-D110 HydrophobicContact CE2-CB 3.92Å; Y74-H112 AromaticContact CD2-NE2 3.79Å
75	V	89.8	Confident	80.6	Confident	12 Å²	12	72.9 Å²	72.9	7%	0.073	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-32.4	-177.2	-179.3	0	0	0	0	111.7	F61 V63 L73 F102 I111 A113 I148	F61-V75 HydrophobicContact CB-CG1 3.81Å; F61-V75 HydrophobicContact CG-CG1 4.44Å; V63-V75 HydrophobicContact CB-CG1 4.31Å; V63-V75 HydrophobicContact CB-CG2 4.14Å; V63-V75 HydrophobicContact CG2-CG2 3.9Å; L73-V75 PolarHBondContact O-N 3Å; V75-F102 HydrophobicContact CG2-CD1 4.3Å; V75-F102 HydrophobicContact CG2-CE1 4.31Å; V75-I111 HydrophobicContact CB-CG2 4.23Å; V75-I111 PolarHBondContact N-O 2.87Å; V75-A113 HydrophobicContact CG2-CB 4.03Å; V75-I148 HydrophobicContact CG1-CD1 4.19Å; V75-I148 HydrophobicContact CG1-CG1 4.3Å; V75-I148 HydrophobicContact CG1-CG2 4.01Å
76	G	88.9	Confident	79.6	Confident	7 Å²	7	79.5 Å²	79.5	7%	0.072	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.1	-169.7	-176.4	0	0	0	0	0	113	Y74 I111	Y74-G76 VanDerWaalsContact CE2-O 3.29Å; Y74-G76 WeakPolarHBondContact CE2-O 3.24Å; G76-I111 PolarHBondContact N-O 2.86Å; G76-I111 PolarHBondContact O-N 3.38Å
77	K	88.8	Confident	79	Confident	90 Å²	90	77 Å²	77	39%	0.391	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	137.7	-176.4	-173.6	-178.3	-160.3	77.2	0	110.9	T108 G109 D110	K77-T108 WeakPolarHBondContact CE-O 3.27Å; K77-T108 PolarHBondContact NZ-O 2.61Å; K77-G109 WeakPolarHBondContact CA-O 3.43Å; K77-D110 WeakPolarHBondContact CB-OD1 3.46Å; K77-D110 WeakPolarHBondContact CD-OD1 3.49Å; K77-D110 WeakPolarHBondContact CG-OD1 3.37Å; K77-D110 IonicContact NZ-OD1 2.71Å; K77-D110 PolarHBondContact NZ-OD1 3.06Å; K77-D110 IonicContact NZ-OD2 2.85Å; K77-D110 PolarHBondContact NZ-OD2 3.12Å
78	I	86.6	Confident	79.1	Confident	16 Å²	16	74.7 Å²	74.7	8%	0.082	42%	0.416	C	S	.	.			trans	-105.8	147.6	164.7	60.3	166.9	0	0	0	110.2	F61 Y91 I104 G109 I111 A129	F61-I78 HydrophobicContact CE2-CG2 4.22Å; F61-I78 HydrophobicContact CZ-CG2 4.06Å; I78-Y91 HydrophobicContact CD1-CD1 4.05Å; I78-Y91 HydrophobicContact CG1-CD1 4.01Å; I78-I104 HydrophobicContact CD1-CD1 3.44Å; I78-I104 VanDerWaalsContact CD1-CD1 3.44Å; I78-I104 HydrophobicContact CG1-CD1 3.57Å; I78-G109 PolarHBondContact N-O 3.13Å; I78-I111 HydrophobicContact CG2-CD1 4.09Å; I78-A129 HydrophobicContact CD1-CB 3.59Å; I78-A129 HydrophobicContact CG2-CB 4.21Å
79	H	84.8	Confident	79.8	Confident	101 Å²	101	69.9 Å²	69.9	47%	0.468	39%	0.386	S	S	.	.			trans	-158	142.7	-175.7	177.1	62.3	0	0	0	109.2	W56 D83 Y91	W56-H79 WeakPolarHBondContact CH2-O 3.38Å; H79-D83 IonicContact CE1-OD2 3.82Å; H79-D83 IonicContact ND1-OD2 3.6Å; H79-Y91 PolarHBondContact ND1-OH 3.28Å
80	T	82.1	Confident	80.6	Confident	3 Å²	3	70.1 Å²	70.1	2%	0.018	38%	0.377	C	S	.	.			trans	-107.4	146	173.2	166.4	0	0	0	0	110	S82 D83 I89 Y91 A131 E141	T80-S82 PolarHBondContact O-N 2.01Å; T80-S82 VanDerWaalsContact O-N 3.16Å; T80-S82 WeakPolarHBondContact OG1-CB 3.34Å; T80-S82 PolarHBondContact OG1-N 3.21Å; T80-S82 PolarHBondContact OG1-OG 2.99Å; T80-S82 VanDerWaalsContact OG1-OG 3.13Å; T80-D83 HydrophobicContact CG2-CB 4.27Å; T80-D83 VanDerWaalsContact O-CB 3.28Å; T80-D83 WeakPolarHBondContact O-CB 3.26Å; T80-D83 PolarHBondContact O-N 3.41Å; T80-I89 HydrophobicContact CG2-CD1 3.52Å; T80-I89 HydrophobicContact CG2-CG2 4.2Å; T80-Y91 HydrophobicContact CG2-CE1 4.2Å; T80-Y91 PolarHBondContact N-OH 3.4Å; T80-A131 HydrophobicContact CG2-CB 3.73Å; T80-E141 PolarHBondContact OG1-OE1 3.3Å
81	D	77.8	Confident	81.5	Confident	120 Å²	120	63.3 Å²	63.3	64%	0.642	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-3.7	170.8	61.7	-27.3	0	0	0	113.5	K53 D83	K53-D81 WeakPolarHBondContact CE-OD1 3.34Å; K53-D81 WeakPolarHBondContact CE-OD2 3.37Å; K53-D81 IonicContact NZ-OD1 2.68Å; K53-D81 PolarHBondContact NZ-OD1 2.98Å; K53-D81 IonicContact NZ-OD2 3.61Å; D81-D83 VanDerWaalsContact C-N 3.29Å
82	S	74.9	Confident	82.1	Confident	59 Å²	59	57.7 Å²	57.7	41%	0.413	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-6.3	167.8	-48.2	0	0	0	0	113.5	T80 E84	T80-S82 PolarHBondContact O-N 2.01Å; T80-S82 VanDerWaalsContact O-N 3.16Å; T80-S82 WeakPolarHBondContact OG1-CB 3.34Å; T80-S82 PolarHBondContact OG1-N 3.21Å; T80-S82 PolarHBondContact OG1-OG 2.99Å; T80-S82 VanDerWaalsContact OG1-OG 3.13Å; S82-E84 PolarHBondContact O-N 3.07Å
83	D	74.7	Confident	82.5	Confident	30 Å²	30	55.9 Å²	55.9	16%	0.16	30%	0.297	C	S	.	.			trans	-92.1	94.5	-176.8	-168.1	-4.3	0	0	0	111.6	H79 T80 D81 G85 I89 Y91	H79-D83 IonicContact CE1-OD2 3.82Å; H79-D83 IonicContact ND1-OD2 3.6Å; T80-D83 HydrophobicContact CG2-CB 4.27Å; T80-D83 VanDerWaalsContact O-CB 3.28Å; T80-D83 WeakPolarHBondContact O-CB 3.26Å; T80-D83 PolarHBondContact O-N 3.41Å; D81-D83 VanDerWaalsContact C-N 3.29Å; D83-G85 PolarHBondContact O-N 2.74Å; D83-G85 VanDerWaalsContact O-N 3.14Å; D83-G85 PolarHBondContact OD1-N 3Å; D83-G85 VanDerWaalsContact OD1-N 3.1Å; D83-I89 HydrophobicContact CB-CD1 3.93Å; D83-Y91 PolarHBondContact OD2-OH 3.09Å
84	E	72.4	Confident	82.7	Confident	183 Å²	183	56.7 Å²	56.7	86%	0.855	31%	0.306	S	S	*	.			trans	-73.6	6.5	176.3	-59.3	-167	160.5	0	0	113.6	S82	S82-E84 PolarHBondContact O-N 3.07Å
85	G	65.5	Low	82.8	Confident	64 Å²	64	53.3 Å²	53.3	66%	0.66	31%	0.309	S	S	*	.	S	Bend	trans	85.6	3.2	176.6	0	0	0	0	0	115.1	D83 G87	D83-G85 PolarHBondContact O-N 2.74Å; D83-G85 VanDerWaalsContact O-N 3.14Å; D83-G85 PolarHBondContact OD1-N 3Å; D83-G85 VanDerWaalsContact OD1-N 3.1Å; G85-G87 PolarHBondContact O-N 2.97Å
86	E	69.4	Low	82.8	Confident	141 Å²	141	56.5 Å²	56.5	66%	0.659	32%	0.323	S	S	*	.	S	Bend	trans	-73.6	-4.3	172.3	-60.9	-160.1	149	0	0	113.4	N88	E86-N88 WeakPolarHBondContact CB-ND2 3.49Å; E86-N88 PolarHBondContact O-N 3.03Å; E86-N88 PolarHBondContact OE2-ND2 3.03Å
87	G	69.7	Low	82.7	Confident	19 Å²	19	57 Å²	57	20%	0.196	33%	0.328	C	S	.	.	S	Bend	trans	68.4	17.9	-178.1	0	0	0	0	0	113.9	G85 I89 R134	G85-G87 PolarHBondContact O-N 2.97Å; G87-I89 PolarHBondContact O-N 2.91Å; G87-R134 WeakPolarHBondContact O-CD 3.45Å; G87-R134 PolarHBondContact O-NE 3.11Å; G87-R134 PolarHBondContact O-NH1 3.24Å; G87-R134 PolarHBondContact O-NH2 2.91Å
88	N	81.8	Confident	82.8	Confident	57 Å²	57	54.2 Å²	54.2	31%	0.305	32%	0.322	S	S	.	.			trans	-73.7	-2.5	179.3	-70.7	-36.4	0	0	0	113.9	E86 R134	E86-N88 WeakPolarHBondContact CB-ND2 3.49Å; E86-N88 PolarHBondContact O-N 3.03Å; E86-N88 PolarHBondContact OE2-ND2 3.03Å; N88-R134 WeakPolarHBondContact O-CB 3.4Å; N88-R134 PolarHBondContact O-N 3.32Å; N88-R134 PolarHBondContact OD1-NH2 3.05Å
89	I	86.1	Confident	82.7	Confident	7 Å²	7	56.6 Å²	56.6	4%	0.036	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	145.1	178.7	-62.6	-166.5	0	0	0	109.9	T80 D83 G87 Y91 A131 R132 L140	T80-I89 HydrophobicContact CG2-CD1 3.52Å; T80-I89 HydrophobicContact CG2-CG2 4.2Å; D83-I89 HydrophobicContact CB-CD1 3.93Å; G87-I89 PolarHBondContact O-N 2.91Å; I89-Y91 HydrophobicContact CG2-CD2 4.43Å; I89-Y91 HydrophobicContact CG2-CE1 4.13Å; I89-Y91 HydrophobicContact CG2-CE2 4.04Å; I89-A131 HydrophobicContact CG2-CB 4.04Å; I89-R132 CarbonylContact C-O 3.59Å; I89-R132 WeakPolarHBondContact CA-O 3.33Å; I89-L140 HydrophobicContact CD1-CD1 3.62Å; I89-L140 HydrophobicContact CG1-CD1 3.69Å
90	K	89.1	Confident	82.9	Confident	41 Å²	41	54.8 Å²	54.8	18%	0.178	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	118.8	172.7	166	161.8	176.4	147.2	0	108.7	T92 E106 R132 R134	K90-T92 HydrophobicContact CG-CG2 4.1Å; K90-E106 CarbonylContact C-O 3.6Å; K90-E106 VanDerWaalsContact CA-O 3.31Å; K90-E106 WeakPolarHBondContact CA-O 3.22Å; K90-E106 WeakPolarHBondContact CE-OE1 3.1Å; K90-E106 VanDerWaalsContact CE-OE2 3.3Å; K90-E106 WeakPolarHBondContact CE-OE2 3.01Å; K90-E106 HydrophobicContact CG-CB 4.38Å; K90-E106 IonicContact NZ-OE1 3.2Å; K90-E106 PolarHBondContact NZ-OE1 2.84Å; K90-E106 IonicContact NZ-OE2 2.71Å; K90-E106 PolarHBondContact NZ-OE2 2.93Å; K90-R132 PolarHBondContact N-O 2.73Å; K90-R132 PolarHBondContact O-N 3.34Å; K90-R134 HydrophobicContact CB-CB 4.41Å
91	Y	90.1	Very high	83.3	Confident	2 Å²	2	56 Å²	56	1%	0.008	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	139.6	174.3	-63.4	-79.4	0	0	0	110.3	I78 H79 T80 D83 I89 E106 A131	I78-Y91 HydrophobicContact CD1-CD1 4.05Å; I78-Y91 HydrophobicContact CG1-CD1 4.01Å; H79-Y91 PolarHBondContact ND1-OH 3.28Å; T80-Y91 HydrophobicContact CG2-CE1 4.2Å; T80-Y91 PolarHBondContact N-OH 3.4Å; D83-Y91 PolarHBondContact OD2-OH 3.09Å; I89-Y91 HydrophobicContact CG2-CD2 4.43Å; I89-Y91 HydrophobicContact CG2-CE1 4.13Å; I89-Y91 HydrophobicContact CG2-CE2 4.04Å; Y91-E106 PolarHBondContact N-O 3.17Å; Y91-A131 HydrophobicContact CD1-CB 4.36Å; Y91-A131 HydrophobicContact CE1-CB 4.27Å
92	T	90.9	Very high	84	Confident	32 Å²	32	50.2 Å²	50.2	20%	0.196	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	147.1	-179.9	50.5	0	0	0	0	111	K90 Q130	K90-T92 HydrophobicContact CG-CG2 4.1Å; T92-Q130 PolarHBondContact N-O 2.82Å; T92-Q130 PolarHBondContact O-N 2.84Å; T92-Q130 PolarHBondContact OG1-O 2.88Å
93	I	92.8	Very high	84.8	Confident	28 Å²	28	50.6 Å²	50.6	14%	0.144	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	150.5	172	60.3	176.3	0	0	0	111	A98 F102 I104 I111 L127 R128 F146	I93-A98 HydrophobicContact CG1-CB 4.26Å; I93-F102 HydrophobicContact CD1-CB 4.22Å; I93-I104 HydrophobicContact CD1-CB 4.09Å; I93-I104 HydrophobicContact CD1-CG2 4.27Å; I93-I104 HydrophobicContact CG1-CB 4.16Å; I93-I104 HydrophobicContact CG1-CG2 3.81Å; I93-I104 HydrophobicContact CG2-CB 4.31Å; I93-I104 HydrophobicContact CG2-CD1 3.85Å; I93-I104 HydrophobicContact CG2-CG2 4.31Å; I93-I111 HydrophobicContact CG2-CD1 4.25Å; I93-L127 HydrophobicContact CD1-CD2 4.08Å; I93-R128 CarbonylContact C-O 3.45Å; I93-R128 VanDerWaalsContact CA-O 3.28Å; I93-R128 WeakPolarHBondContact CA-O 3.29Å; I93-F146 HydrophobicContact CG2-CE1 4.31Å; I93-F146 HydrophobicContact CG2-CZ 4.18Å
94	S	91.4	Very high	85.7	Confident	54 Å²	54	50.5 Å²	50.5	38%	0.378	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	170.6	173.8	67	0	0	0	0	110.1	L127 R128	S94-L127 CarbonylContact O-C 3.57Å; S94-L127 VanDerWaalsContact O-CA 3.31Å; S94-L127 WeakPolarHBondContact O-CA 3.35Å; S94-R128 PolarHBondContact N-O 3.1Å; S94-R128 PolarHBondContact O-N 2.85Å
95	G	90.9	Very high	86.6	Confident	53 Å²	53	45.1 Å²	45.1	55%	0.546	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	106.6	-150.6	-176	0	0	0	0	0	112.4
96	E	90.1	Very high	87.7	Confident	79 Å²	79	46.6 Å²	46.6	37%	0.369	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	129.2	-172.2	-57.9	-170.8	122	0	0	112.2	A98 K122 Y125 T126 L127	E96-A98 PolarHBondContact O-N 3.16Å; E96-K122 IonicContact OE1-NZ 3.46Å; E96-K122 PolarHBondContact OE1-NZ 3.4Å; E96-K122 IonicContact OE2-NZ 2.68Å; E96-K122 PolarHBondContact OE2-NZ 2.84Å; E96-Y125 HydrophobicContact CB-CD1 4.25Å; E96-Y125 WeakPolarHBondContact OE2-CA 3.43Å; E96-T126 PolarHBondContact N-O 3.28Å; E96-T126 PolarHBondContact OE2-N 3.35Å; E96-L127 WeakPolarHBondContact O-CD1 3.29Å; E96-L127 WeakPolarHBondContact O-CG 3.4Å
97	G	86.8	Confident	88.6	Confident	17 Å²	17	44.5 Å²	44.5	18%	0.175	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.4	-1.3	180	0	0	0	0	0	115.5	G99 S100 I101 F102	G97-G99 PolarHBondContact O-N 2.04Å; G97-S100 PolarHBondContact O-N 3.38Å; G97-S100 VanDerWaalsContact O-N 3.16Å; G97-I101 PolarHBondContact O-N 2.86Å; G97-F102 PolarHBondContact O-N 3.39Å
98	A	90.1	Very high	89.4	Confident	32 Å²	32	46.2 Å²	46.2	26%	0.264	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-65.1	118.1	-177.9	0	0	0	0	0	111.5	I93 E96 L127	I93-A98 HydrophobicContact CG1-CB 4.26Å; E96-A98 PolarHBondContact O-N 3.16Å; A98-L127 HydrophobicContact CB-CD2 4.06Å
99	G	85.1	Confident	89.6	Confident	66 Å²	66	43.5 Å²	43.5	68%	0.68	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.7	2.4	-177.9	0	0	0	0	0	115.5	G97 F102	G97-G99 PolarHBondContact O-N 2.04Å; G99-F102 PolarHBondContact N-O 2.91Å
100	S	89.1	Confident	89.9	Confident	63 Å²	63	44.7 Å²	44.7	44%	0.441	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.7	-58.7	172.3	63.1	0	0	0	0	112.3	G97 T114	G97-S100 PolarHBondContact O-N 3.38Å; G97-S100 VanDerWaalsContact O-N 3.16Å; S100-T114 PolarHBondContact O-OG1 3.01Å
101	I	90.3	Very high	90	Very high	28 Å²	28	42.7 Å²	42.7	14%	0.144	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-43.2	177.8	-59.9	171.5	0	0	0	109.8	G97 A113 T114 E115 L117 Y125	G97-I101 PolarHBondContact O-N 2.86Å; I101-A113 CarbonylContact O-C 3.49Å; I101-A113 VanDerWaalsContact O-CA 3.27Å; I101-A113 WeakPolarHBondContact O-CA 3.41Å; I101-T114 PolarHBondContact O-N 3.48Å; I101-T114 PolarHBondContact O-OG1 2.82Å; I101-T114 VanDerWaalsContact O-OG1 3.14Å; I101-E115 WeakPolarHBondContact CG1-OE2 3.4Å; I101-L117 HydrophobicContact CG2-CD2 3.54Å; I101-Y125 HydrophobicContact CD1-CE1 3.7Å
102	F	92.9	Very high	90.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	123.9	179.6	-57.6	-70.8	0	0	0	110.5	V75 I93 G97 G99 H112 A113 L117 Y125 L127 I148	V75-F102 HydrophobicContact CG2-CD1 4.3Å; V75-F102 HydrophobicContact CG2-CE1 4.31Å; I93-F102 HydrophobicContact CD1-CB 4.22Å; G97-F102 PolarHBondContact O-N 3.39Å; G99-F102 PolarHBondContact N-O 2.91Å; F102-H112 WeakPolarHBondContact CA-O 3.47Å; F102-A113 HydrophobicContact CD1-CB 4Å; F102-A113 HydrophobicContact CE1-CB 3.9Å; F102-L117 HydrophobicContact CE1-CD1 4.1Å; F102-L117 HydrophobicContact CZ-CD1 4Å; F102-L117 HydrophobicContact CZ-CD2 4.32Å; F102-Y125 AromaticContact CE2-CD1 3.88Å; F102-Y125 HydrophobicContact CE2-CD1 3.88Å; F102-Y125 AromaticContact CE2-CD2 3.85Å; F102-Y125 HydrophobicContact CE2-CD2 3.85Å; F102-Y125 HydrophobicContact CE2-CE1 4.37Å; F102-Y125 HydrophobicContact CE2-CE2 4.36Å; F102-Y125 AromaticContact CE2-CG 3.6Å; F102-Y125 HydrophobicContact CE2-CG 3.6Å; F102-Y125 AromaticContact CZ-CD2 3.94Å; F102-Y125 HydrophobicContact CZ-CD2 3.94Å; F102-Y125 HydrophobicContact CZ-CE2 4.31Å; F102-Y125 HydrophobicContact CZ-CG 4.18Å; F102-L127 HydrophobicContact CB-CD2 4.18Å; F102-L127 HydrophobicContact CD2-CD1 4.15Å; F102-L127 HydrophobicContact CD2-CD2 4.19Å; F102-L127 HydrophobicContact CE2-CD1 4.41Å; F102-L127 HydrophobicContact CG-CD2 4.47Å; F102-I148 HydrophobicContact CB-CD1 4.43Å; F102-I148 HydrophobicContact CD1-CD1 3.52Å; F102-I148 HydrophobicContact CD2-CD1 3.87Å; F102-I148 HydrophobicContact CE1-CD1 3.61Å; F102-I148 HydrophobicContact CE1-CG2 3.93Å; F102-I148 HydrophobicContact CE2-CD1 3.97Å; F102-I148 HydrophobicContact CG-CD1 3.65Å; F102-I148 HydrophobicContact CZ-CB 4.26Å; F102-I148 HydrophobicContact CZ-CD1 3.85Å; F102-I148 HydrophobicContact CZ-CG2 3.87Å
103	I	92.4	Very high	90.1	Very high	67 Å²	67	43.8 Å²	43.8	34%	0.344	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	154.7	173.3	62.2	168.5	0	0	0	110.2	I111 H112 T114	I103-I111 CarbonylContact O-C 3.53Å; I103-I111 WeakPolarHBondContact O-CA 3.17Å; I103-H112 HydrophobicContact CG1-CB 4.07Å; I103-H112 PolarHBondContact N-O 3.32Å; I103-H112 PolarHBondContact O-N 2.8Å; I103-T114 HydrophobicContact CD1-CG2 3.62Å; I103-T114 HydrophobicContact CG1-CG2 3.91Å; I103-T114 HydrophobicContact CG2-CG2 4.17Å
104	I	92.8	Very high	89.8	Confident	28 Å²	28	45.4 Å²	45.4	14%	0.144	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.7	172.2	-168.5	169.4	0	0	0	110	I78 I93 E106 D110 I111	I78-I104 HydrophobicContact CD1-CD1 3.44Å; I78-I104 VanDerWaalsContact CD1-CD1 3.44Å; I78-I104 HydrophobicContact CG1-CD1 3.57Å; I93-I104 HydrophobicContact CD1-CB 4.09Å; I93-I104 HydrophobicContact CD1-CG2 4.27Å; I93-I104 HydrophobicContact CG1-CB 4.16Å; I93-I104 HydrophobicContact CG1-CG2 3.81Å; I93-I104 HydrophobicContact CG2-CB 4.31Å; I93-I104 HydrophobicContact CG2-CD1 3.85Å; I93-I104 HydrophobicContact CG2-CG2 4.31Å; I104-E106 PolarHBondContact O-N 3.48Å; I104-D110 WeakPolarHBondContact CA-O 3.22Å; I104-I111 HydrophobicContact CB-CG1 4.22Å; I104-I111 HydrophobicContact CD1-CD1 4.38Å; I104-I111 HydrophobicContact CD1-CG1 3.84Å; I104-I111 HydrophobicContact CG1-CG1 3.88Å
105	D	91.4	Very high	89.6	Confident	70 Å²	70	48.1 Å²	48.1	37%	0.374	29%	0.291	S	S	.	.			trans	-70.4	116.2	164.6	-175.1	-57.4	0	0	0	109	L107 T108 G109 D110	D105-L107 PolarHBondContact O-N 3.06Å; D105-L107 WeakPolarHBondContact OD1-CA 3.49Å; D105-L107 WeakPolarHBondContact OD1-CB 3.36Å; D105-L107 PolarHBondContact OD1-N 2.97Å; D105-T108 WeakPolarHBondContact CB-OG1 3.15Å; D105-T108 PolarHBondContact OD1-N 2.88Å; D105-G109 WeakPolarHBondContact O-CA 3.41Å; D105-G109 PolarHBondContact O-N 3.28Å; D105-D110 PolarHBondContact N-O 3.07Å
106	E	89.3	Confident	89.4	Confident	94 Å²	94	52 Å²	52	44%	0.439	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-21.4	-175.3	-59.9	-164.3	151.5	0	0	113.8	K90 Y91 I104	K90-E106 CarbonylContact C-O 3.6Å; K90-E106 VanDerWaalsContact CA-O 3.31Å; K90-E106 WeakPolarHBondContact CA-O 3.22Å; K90-E106 WeakPolarHBondContact CE-OE1 3.1Å; K90-E106 VanDerWaalsContact CE-OE2 3.3Å; K90-E106 WeakPolarHBondContact CE-OE2 3.01Å; K90-E106 HydrophobicContact CG-CB 4.38Å; K90-E106 IonicContact NZ-OE1 3.2Å; K90-E106 PolarHBondContact NZ-OE1 2.84Å; K90-E106 IonicContact NZ-OE2 2.71Å; K90-E106 PolarHBondContact NZ-OE2 2.93Å; Y91-E106 PolarHBondContact N-O 3.17Å; I104-E106 PolarHBondContact O-N 3.48Å
107	L	86.7	Confident	89.5	Confident	98 Å²	98	48.7 Å²	48.7	51%	0.513	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-39.7	-176.8	-64.6	173.2	0	0	0	112.2	D105	D105-L107 PolarHBondContact O-N 3.06Å; D105-L107 WeakPolarHBondContact OD1-CA 3.49Å; D105-L107 WeakPolarHBondContact OD1-CB 3.36Å; D105-L107 PolarHBondContact OD1-N 2.97Å
108	T	87	Confident	89.7	Confident	55 Å²	55	51.2 Å²	51.2	34%	0.337	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-22.3	-177.9	75.9	0	0	0	0	113.4	K77 D105 D110	K77-T108 WeakPolarHBondContact CE-O 3.27Å; K77-T108 PolarHBondContact NZ-O 2.61Å; D105-T108 WeakPolarHBondContact CB-OG1 3.15Å; D105-T108 PolarHBondContact OD1-N 2.88Å; T108-D110 VanDerWaalsContact C-N 3.32Å; T108-D110 WeakPolarHBondContact CB-OD2 3.47Å; T108-D110 WeakPolarHBondContact OG1-CB 3.34Å; T108-D110 VanDerWaalsContact OG1-CG 3.24Å; T108-D110 PolarHBondContact OG1-N 3.49Å; T108-D110 PolarHBondContact OG1-OD2 2.84Å
109	G	87.2	Confident	89.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.277	C	S	.	.			trans	77.2	11.8	-174	0	0	0	0	0	114.8	K77 I78 D105	K77-G109 WeakPolarHBondContact CA-O 3.43Å; I78-G109 PolarHBondContact N-O 3.13Å; D105-G109 WeakPolarHBondContact O-CA 3.41Å; D105-G109 PolarHBondContact O-N 3.28Å
110	D	90.9	Very high	90.1	Very high	31 Å²	31	51.2 Å²	51.2	17%	0.166	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	124	179.5	-64.7	-48.3	0	0	0	111.6	Y74 K77 I104 D105 T108 H112	Y74-D110 HydrophobicContact CD2-CB 4.36Å; Y74-D110 HydrophobicContact CE2-CB 3.92Å; K77-D110 WeakPolarHBondContact CB-OD1 3.46Å; K77-D110 WeakPolarHBondContact CD-OD1 3.49Å; K77-D110 WeakPolarHBondContact CG-OD1 3.37Å; K77-D110 IonicContact NZ-OD1 2.71Å; K77-D110 PolarHBondContact NZ-OD1 3.06Å; K77-D110 IonicContact NZ-OD2 2.85Å; K77-D110 PolarHBondContact NZ-OD2 3.12Å; I104-D110 WeakPolarHBondContact CA-O 3.22Å; D105-D110 PolarHBondContact N-O 3.07Å; T108-D110 VanDerWaalsContact C-N 3.32Å; T108-D110 WeakPolarHBondContact CB-OD2 3.47Å; T108-D110 WeakPolarHBondContact OG1-CB 3.34Å; T108-D110 VanDerWaalsContact OG1-CG 3.24Å; T108-D110 PolarHBondContact OG1-N 3.49Å; T108-D110 PolarHBondContact OG1-OD2 2.84Å; D110-H112 PolarHBondContact O-ND1 2.9Å
111	I	91.9	Very high	90.2	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	131.7	-177.6	-59	172.3	0	0	0	109.6	F61 V75 G76 I78 I93 I103 I104 F146	F61-I111 HydrophobicContact CE2-CD1 4.34Å; V75-I111 HydrophobicContact CB-CG2 4.23Å; V75-I111 PolarHBondContact N-O 2.87Å; G76-I111 PolarHBondContact N-O 2.86Å; G76-I111 PolarHBondContact O-N 3.38Å; I78-I111 HydrophobicContact CG2-CD1 4.09Å; I93-I111 HydrophobicContact CG2-CD1 4.25Å; I103-I111 CarbonylContact O-C 3.53Å; I103-I111 WeakPolarHBondContact O-CA 3.17Å; I104-I111 HydrophobicContact CB-CG1 4.22Å; I104-I111 HydrophobicContact CD1-CD1 4.38Å; I104-I111 HydrophobicContact CD1-CG1 3.84Å; I104-I111 HydrophobicContact CG1-CG1 3.88Å; I111-F146 HydrophobicContact CD1-CE2 4.24Å; I111-F146 HydrophobicContact CD1-CZ 3.88Å
112	H	91.4	Very high	90.2	Very high	52 Å²	52	57.9 Å²	57.9	24%	0.241	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	144.5	178.6	-56	75.5	0	0	0	111	P72 L73 Y74 F102 I103 D110	P72-H112 HydrophobicContact CB-CB 3.75Å; L73-H112 CarbonylContact O-C 3.44Å; L73-H112 VanDerWaalsContact O-CA 3.25Å; L73-H112 WeakPolarHBondContact O-CA 3.36Å; Y74-H112 AromaticContact CD2-NE2 3.79Å; F102-H112 WeakPolarHBondContact CA-O 3.47Å; I103-H112 HydrophobicContact CG1-CB 4.07Å; I103-H112 PolarHBondContact N-O 3.32Å; I103-H112 PolarHBondContact O-N 2.8Å; D110-H112 PolarHBondContact O-ND1 2.9Å
113	A	91.5	Very high	90.1	Very high	5 Å²	5	59.7 Å²	59.7	4%	0.041	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	128.4	167.5	0	0	0	0	0	110	V63 P72 L73 V75 I101 F102 L117	V63-A113 HydrophobicContact CG2-CB 4.31Å; P72-A113 CarbonylContact C-O 3.59Å; P72-A113 VanDerWaalsContact CA-O 3.24Å; P72-A113 WeakPolarHBondContact CA-O 3.29Å; P72-A113 WeakPolarHBondContact CB-O 3.34Å; L73-A113 HydrophobicContact CB-CB 4.41Å; L73-A113 PolarHBondContact N-O 3.01Å; L73-A113 PolarHBondContact O-N 2.9Å; V75-A113 HydrophobicContact CG2-CB 4.03Å; I101-A113 CarbonylContact O-C 3.49Å; I101-A113 VanDerWaalsContact O-CA 3.27Å; I101-A113 WeakPolarHBondContact O-CA 3.41Å; F102-A113 HydrophobicContact CD1-CB 4Å; F102-A113 HydrophobicContact CE1-CB 3.9Å; A113-L117 HydrophobicContact CB-CD1 4.5Å
114	T	86.9	Confident	90	Very high	61 Å²	61	62 Å²	62	37%	0.374	30%	0.304	S	S	.	.			trans	-102	-16	-176.9	26.2	0	0	0	0	114.2	P72 S100 I101 I103	P72-T114 HydrophobicContact CB-CG2 4.11Å; P72-T114 HydrophobicContact CG-CG2 4.05Å; S100-T114 PolarHBondContact O-OG1 3.01Å; I101-T114 PolarHBondContact O-N 3.48Å; I101-T114 PolarHBondContact O-OG1 2.82Å; I101-T114 VanDerWaalsContact O-OG1 3.14Å; I103-T114 HydrophobicContact CD1-CG2 3.62Å; I103-T114 HydrophobicContact CG1-CG2 3.91Å; I103-T114 HydrophobicContact CG2-CG2 4.17Å
115	E	86.8	Confident	90.1	Very high	111 Å²	111	61.5 Å²	61.5	52%	0.519	30%	0.301	S	S	.	.	S	Bend	trans	-116.1	161.4	177.6	-64.5	179.4	174.1	0	0	109	I101	I101-E115 WeakPolarHBondContact CG1-OE2 3.4Å
116	R	87.8	Confident	90.1	Very high	136 Å²	136	60.2 Å²	60.2	51%	0.513	30%	0.295	S	S	.	.			trans	-70.5	151	168.7	-67.4	-167	-177.4	-177.9	-4.9	109.6	E66	E66-R116 VanDerWaalsContact CD-NH1 3.33Å; E66-R116 WeakPolarHBondContact OE1-CD 3.48Å; E66-R116 IonicContact OE1-NH1 3.18Å; E66-R116 PolarHBondContact OE1-NH1 2.75Å; E66-R116 IonicContact OE2-CZ 3.42Å; E66-R116 IonicContact OE2-NE 3.88Å; E66-R116 IonicContact OE2-NH1 2.61Å; E66-R116 PolarHBondContact OE2-NH1 2.88Å
117	L	91.1	Very high	90.3	Very high	8 Å²	8	55.8 Å²	55.8	4%	0.042	28%	0.275	C	S	.	.			trans	-116.9	150.7	177.3	-57.7	176.1	0	0	0	108.3	V63 E65 E66 I101 F102 A113 Y125 V150	V63-L117 HydrophobicContact CB-CD1 4.23Å; V63-L117 HydrophobicContact CG1-CD1 3.36Å; V63-L117 HydrophobicContact CG2-CD1 3.81Å; E65-L117 WeakPolarHBondContact CB-O 3.46Å; E66-L117 PolarHBondContact N-O 3.42Å; I101-L117 HydrophobicContact CG2-CD2 3.54Å; F102-L117 HydrophobicContact CE1-CD1 4.1Å; F102-L117 HydrophobicContact CZ-CD1 4Å; F102-L117 HydrophobicContact CZ-CD2 4.32Å; A113-L117 HydrophobicContact CB-CD1 4.5Å; L117-Y125 HydrophobicContact CD2-CE2 4.09Å; L117-V150 HydrophobicContact CB-CG1 4.39Å; L117-V150 HydrophobicContact CB-CG2 4.42Å; L117-V150 HydrophobicContact CD1-CG2 4.34Å
118	D	91.1	Very high	90.5	Very high	70 Å²	70	56.6 Å²	56.6	37%	0.374	27%	0.271	S	S	.	.			trans	-138.7	120.4	-177.3	168.9	-32.8	0	0	0	104.5	E120 E121 K122	D118-E120 WeakPolarHBondContact OD1-CB 3.45Å; D118-E120 PolarHBondContact OD1-N 2.84Å; D118-E120 VanDerWaalsContact OD1-N 3.13Å; D118-E121 HydrophobicContact CB-CB 4.24Å; D118-E121 PolarHBondContact OD1-N 2.93Å; D118-K122 PolarHBondContact O-N 3.22Å
119	R	92.1	Very high	90.6	Very high	33 Å²	33	54.5 Å²	54.5	13%	0.125	26%	0.259	C	S	.	.	H	α-helix	trans	-80	-30.6	-172.6	-173.5	-147.3	70.6	97	11	110.9	E65 K122 A123 V150 D152 A187 D188 D189	E65-R119 WeakPolarHBondContact OE2-CB 3.46Å; E65-R119 PolarHBondContact OE2-N 3.36Å; R119-K122 CarbonylContact O-C 3.46Å; R119-K122 PolarHBondContact O-N 3.5Å; R119-A123 HydrophobicContact CG-CB 3.79Å; R119-A123 WeakPolarHBondContact O-CA 3.47Å; R119-A123 PolarHBondContact O-N 2.97Å; R119-V150 HydrophobicContact CB-CB 4.23Å; R119-V150 HydrophobicContact CB-CG1 3.8Å; R119-V150 HydrophobicContact CG-CB 4.23Å; R119-V150 HydrophobicContact CG-CG1 4.25Å; R119-D152 IonicContact NE-OD1 2.64Å; R119-A187 PolarHBondContact NH2-O 3.42Å; R119-D188 VanDerWaalsContact NH2-C 3.28Å; R119-D189 VanDerWaalsContact NH1-CB 3.31Å; R119-D189 IonicContact NH1-OD2 2.68Å
120	E	90.9	Very high	90.7	Very high	65 Å²	65	55.5 Å²	55.5	30%	0.304	26%	0.264	S	S	.	.	H	α-helix	trans	-66.7	-38	176.4	-69	54.4	-122.5	0	0	110.5	D118 A187	D118-E120 WeakPolarHBondContact OD1-CB 3.45Å; D118-E120 PolarHBondContact OD1-N 2.84Å; D118-E120 VanDerWaalsContact OD1-N 3.13Å; E120-A187 HydrophobicContact CG-CB 3.91Å
121	E	91.1	Very high	90.7	Very high	167 Å²	167	54.4 Å²	54.4	78%	0.78	26%	0.259	S	S	*	.	H	α-helix	trans	-72.5	-51.6	165.9	-174.6	175.1	-153.2	0	0	110.9	D118	D118-E121 HydrophobicContact CB-CB 4.24Å; D118-E121 PolarHBondContact OD1-N 2.93Å
122	K	91.1	Very high	90.5	Very high	64 Å²	64	58 Å²	58	28%	0.278	27%	0.273	S	S	.	.	H	α-helix	trans	-154.3	90.1	-178.2	-170.6	158.2	174.3	168.7	0	116.5	E96 D118 R119 F124 Y125 V150	E96-K122 IonicContact OE1-NZ 3.46Å; E96-K122 PolarHBondContact OE1-NZ 3.4Å; E96-K122 IonicContact OE2-NZ 2.68Å; E96-K122 PolarHBondContact OE2-NZ 2.84Å; D118-K122 PolarHBondContact O-N 3.22Å; R119-K122 CarbonylContact O-C 3.46Å; R119-K122 PolarHBondContact O-N 3.5Å; K122-F124 VanDerWaalsContact C-N 3.29Å; K122-F124 WeakPolarHBondContact CE-O 3.25Å; K122-F124 WeakPolarHBondContact CG-O 3.48Å; K122-F124 PolarHBondContact O-N 2.89Å; K122-Y125 HydrophobicContact CB-CE2 4.33Å; K122-Y125 HydrophobicContact CD-CD1 4.05Å; K122-Y125 HydrophobicContact CD-CE1 3.69Å; K122-Y125 HydrophobicContact CD-CE2 4.39Å; K122-Y125 HydrophobicContact CG-CD2 4.46Å; K122-Y125 HydrophobicContact CG-CE1 4.21Å; K122-Y125 HydrophobicContact CG-CE2 4.02Å; K122-V150 WeakPolarHBondContact O-CG2 3.32Å
123	A	90	Very high	90.3	Very high	39 Å²	39	57.3 Å²	57.3	32%	0.322	27%	0.271	S	S	.	.	S	Bend	trans	-55.7	-22.1	176.8	0	0	0	0	0	117.8	R119 V150	R119-A123 HydrophobicContact CG-CB 3.79Å; R119-A123 WeakPolarHBondContact O-CA 3.47Å; R119-A123 PolarHBondContact O-N 2.97Å; A123-V150 PolarHBondContact O-N 2.97Å
124	F	92.2	Very high	89.9	Confident	115 Å²	115	62 Å²	62	50%	0.504	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	152.9	176	70.9	-87.1	0	0	0	114.6	K122 V147 I148 K149	K122-F124 VanDerWaalsContact C-N 3.29Å; K122-F124 WeakPolarHBondContact CE-O 3.25Å; K122-F124 WeakPolarHBondContact CG-O 3.48Å; K122-F124 PolarHBondContact O-N 2.89Å; F124-V147 HydrophobicContact CB-CG1 3.84Å; F124-V147 HydrophobicContact CD2-CG1 3.91Å; F124-V147 HydrophobicContact CG-CG1 4.24Å; F124-I148 CarbonylContact C-O 3.53Å; F124-I148 VanDerWaalsContact CA-O 3.31Å; F124-I148 WeakPolarHBondContact CA-O 3.44Å; F124-K149 HydrophobicContact CB-CG 4.27Å
125	Y	93.1	Very high	89.7	Confident	18 Å²	18	66 Å²	66	7%	0.071	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	137.5	178.9	-61.9	-103.3	0	0	0	110.8	E96 I101 F102 L117 K122 V147 I148 V150	E96-Y125 HydrophobicContact CB-CD1 4.25Å; E96-Y125 WeakPolarHBondContact OE2-CA 3.43Å; I101-Y125 HydrophobicContact CD1-CE1 3.7Å; F102-Y125 AromaticContact CE2-CD1 3.88Å; F102-Y125 HydrophobicContact CE2-CD1 3.88Å; F102-Y125 AromaticContact CE2-CD2 3.85Å; F102-Y125 HydrophobicContact CE2-CD2 3.85Å; F102-Y125 HydrophobicContact CE2-CE1 4.37Å; F102-Y125 HydrophobicContact CE2-CE2 4.36Å; F102-Y125 AromaticContact CE2-CG 3.6Å; F102-Y125 HydrophobicContact CE2-CG 3.6Å; F102-Y125 AromaticContact CZ-CD2 3.94Å; F102-Y125 HydrophobicContact CZ-CD2 3.94Å; F102-Y125 HydrophobicContact CZ-CE2 4.31Å; F102-Y125 HydrophobicContact CZ-CG 4.18Å; L117-Y125 HydrophobicContact CD2-CE2 4.09Å; K122-Y125 HydrophobicContact CB-CE2 4.33Å; K122-Y125 HydrophobicContact CD-CD1 4.05Å; K122-Y125 HydrophobicContact CD-CE1 3.69Å; K122-Y125 HydrophobicContact CD-CE2 4.39Å; K122-Y125 HydrophobicContact CG-CD2 4.46Å; K122-Y125 HydrophobicContact CG-CE1 4.21Å; K122-Y125 HydrophobicContact CG-CE2 4.02Å; Y125-V147 CarbonylContact O-C 3.57Å; Y125-V147 WeakPolarHBondContact O-CA 3.21Å; Y125-I148 PolarHBondContact N-O 2.88Å; Y125-I148 PolarHBondContact O-N 3.27Å; Y125-V150 HydrophobicContact CD2-CG2 4.37Å; Y125-V150 HydrophobicContact CE2-CG2 3.99Å
126	T	92.8	Very high	89.6	Confident	42 Å²	42	65.3 Å²	65.3	26%	0.258	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	119.9	178.1	-50.7	0	0	0	0	111.3	E96 E145	E96-T126 PolarHBondContact N-O 3.28Å; E96-T126 PolarHBondContact OE2-N 3.35Å; T126-E145 HydrophobicContact CG2-CG 3.77Å
127	L	92	Very high	89.4	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	163.2	-177.5	-70.8	92.1	0	0	0	111.6	I93 S94 E96 A98 F102 E145 F146 I148	I93-L127 HydrophobicContact CD1-CD2 4.08Å; S94-L127 CarbonylContact O-C 3.57Å; S94-L127 VanDerWaalsContact O-CA 3.31Å; S94-L127 WeakPolarHBondContact O-CA 3.35Å; E96-L127 WeakPolarHBondContact O-CD1 3.29Å; E96-L127 WeakPolarHBondContact O-CG 3.4Å; A98-L127 HydrophobicContact CB-CD2 4.06Å; F102-L127 HydrophobicContact CB-CD2 4.18Å; F102-L127 HydrophobicContact CD2-CD1 4.15Å; F102-L127 HydrophobicContact CD2-CD2 4.19Å; F102-L127 HydrophobicContact CE2-CD1 4.41Å; F102-L127 HydrophobicContact CG-CD2 4.47Å; L127-E145 WeakPolarHBondContact O-CA 3.25Å; L127-F146 HydrophobicContact CB-CD1 4.35Å; L127-F146 HydrophobicContact CB-CD2 4.41Å; L127-F146 HydrophobicContact CB-CE1 3.74Å; L127-F146 HydrophobicContact CB-CE2 3.85Å; L127-F146 HydrophobicContact CB-CZ 3.48Å; L127-F146 VanDerWaalsContact CB-CZ 3.48Å; L127-F146 HydrophobicContact CD2-CZ 4.28Å; L127-F146 HydrophobicContact CG-CZ 4.41Å; L127-F146 PolarHBondContact N-O 2.94Å; L127-F146 PolarHBondContact O-N 2.93Å; L127-I148 HydrophobicContact CD1-CD1 3.82Å; L127-I148 HydrophobicContact CD1-CG1 4.08Å; L127-I148 HydrophobicContact CD2-CD1 4.42Å
128	R	91.1	Very high	89.2	Confident	116 Å²	116	64.2 Å²	64.2	44%	0.438	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	126.5	176.1	-67.5	-177.5	-179	165.2	4.8	110.6	I93 S94 S144 E145	I93-R128 CarbonylContact C-O 3.45Å; I93-R128 VanDerWaalsContact CA-O 3.28Å; I93-R128 WeakPolarHBondContact CA-O 3.29Å; S94-R128 PolarHBondContact N-O 3.1Å; S94-R128 PolarHBondContact O-N 2.85Å; R128-S144 WeakPolarHBondContact CA-O 3.19Å; R128-E145 HydrophobicContact CG-CB 4.14Å; R128-E145 HydrophobicContact CG-CG 4.12Å; R128-E145 IonicContact CZ-OE2 3.47Å; R128-E145 IonicContact NE-OE2 2.81Å; R128-E145 PolarHBondContact NE-OE2 3.44Å; R128-E145 IonicContact NH2-OE2 2.87Å; R128-E145 PolarHBondContact NH2-OE2 2.87Å
129	A	89.9	Confident	88.8	Confident	11 Å²	11	64.6 Å²	64.6	9%	0.091	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	143.6	176	0	0	0	0	0	110.6	I78 E143 S144 F146	I78-A129 HydrophobicContact CD1-CB 3.59Å; I78-A129 HydrophobicContact CG2-CB 4.21Å; A129-E143 WeakPolarHBondContact O-CA 3.45Å; A129-S144 PolarHBondContact N-O 2.94Å; A129-S144 PolarHBondContact O-N 2.93Å; A129-F146 HydrophobicContact CB-CD1 3.96Å; A129-F146 HydrophobicContact CB-CE1 3.72Å
130	Q	89.6	Confident	88.5	Confident	21 Å²	21	66.7 Å²	66.7	10%	0.098	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	131	169.9	-167.5	171.7	52.9	0	0	112	T92 R132 P139 E143	T92-Q130 PolarHBondContact N-O 2.82Å; T92-Q130 PolarHBondContact O-N 2.84Å; T92-Q130 PolarHBondContact OG1-O 2.88Å; Q130-R132 HydrophobicContact CG-CG 4.31Å; Q130-P139 HydrophobicContact CG-CB 4.46Å; Q130-E143 HydrophobicContact CB-CG 4.31Å; Q130-E143 HydrophobicContact CG-CG 4.35Å
131	A	89.5	Confident	88.1	Confident	8 Å²	8	64.8 Å²	64.8	7%	0.066	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	131.6	169.6	0	0	0	0	0	110.3	T80 I89 Y91 L140 E141	T80-A131 HydrophobicContact CG2-CB 3.73Å; I89-A131 HydrophobicContact CG2-CB 4.04Å; Y91-A131 HydrophobicContact CD1-CB 4.36Å; Y91-A131 HydrophobicContact CE1-CB 4.27Å; A131-L140 PolarHBondContact O-N 2.9Å; A131-E141 HydrophobicContact CB-CB 4.4Å; A131-E141 HydrophobicContact CB-CG 4.19Å; A131-E141 PolarHBondContact O-N 3.31Å
132	R	88.4	Confident	87.8	Confident	74 Å²	74	61.3 Å²	61.3	28%	0.279	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	153.9	-177.7	-67.8	174.8	172.9	-105.3	3.2	110.8	I89 K90 Q130 N137 A138	I89-R132 CarbonylContact C-O 3.59Å; I89-R132 WeakPolarHBondContact CA-O 3.33Å; K90-R132 PolarHBondContact N-O 2.73Å; K90-R132 PolarHBondContact O-N 3.34Å; Q130-R132 HydrophobicContact CG-CG 4.31Å; R132-N137 PolarHBondContact NH1-O 2.86Å; R132-A138 CarbonylContact C-O 3.53Å; R132-A138 WeakPolarHBondContact CA-O 3.3Å
133	D	86.8	Confident	87.6	Confident	38 Å²	38	62.9 Å²	62.9	20%	0.203	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	130	169.5	170.9	-82.6	0	0	0	110.1	L135 T136 N137 A138 L140	D133-L135 VanDerWaalsContact C-N 3.3Å; D133-L135 PolarHBondContact O-N 3.4Å; D133-L135 WeakPolarHBondContact OD1-CA 3.24Å; D133-L135 PolarHBondContact OD1-N 3.14Å; D133-T136 WeakPolarHBondContact CB-OG1 3.46Å; D133-T136 VanDerWaalsContact CG-OG1 3.23Å; D133-T136 WeakPolarHBondContact OD1-CB 3.47Å; D133-T136 PolarHBondContact OD1-N 3.45Å; D133-T136 PolarHBondContact OD1-OG1 3.32Å; D133-N137 WeakPolarHBondContact O-CA 3.27Å; D133-N137 PolarHBondContact O-N 2.69Å; D133-A138 PolarHBondContact N-O 3.31Å; D133-L140 HydrophobicContact CB-CD1 4.16Å; D133-L140 HydrophobicContact CB-CD2 4.19Å; D133-L140 HydrophobicContact CB-CG 4.17Å
134	R	84.4	Confident	87.4	Confident	104 Å²	104	62.3 Å²	62.3	39%	0.392	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-25.1	-173.1	-176.9	179.1	62.7	179.9	-9.9	113.7	G87 N88 K90	G87-R134 WeakPolarHBondContact O-CD 3.45Å; G87-R134 PolarHBondContact O-NE 3.11Å; G87-R134 PolarHBondContact O-NH1 3.24Å; G87-R134 PolarHBondContact O-NH2 2.91Å; N88-R134 WeakPolarHBondContact O-CB 3.4Å; N88-R134 PolarHBondContact O-N 3.32Å; N88-R134 PolarHBondContact OD1-NH2 3.05Å; K90-R134 HydrophobicContact CB-CB 4.41Å
135	L	82.4	Confident	87.2	Confident	144 Å²	144	61.6 Å²	61.6	75%	0.754	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-33.3	-175.5	-66.5	172.5	0	0	0	112.5	D133	D133-L135 VanDerWaalsContact C-N 3.3Å; D133-L135 PolarHBondContact O-N 3.4Å; D133-L135 WeakPolarHBondContact OD1-CA 3.24Å; D133-L135 PolarHBondContact OD1-N 3.14Å
136	T	84.4	Confident	87	Confident	97 Å²	97	61.1 Å²	61.1	60%	0.595	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.4	-14.7	-172.8	64.1	0	0	0	0	113.3	D133 A138	D133-T136 WeakPolarHBondContact CB-OG1 3.46Å; D133-T136 VanDerWaalsContact CG-OG1 3.23Å; D133-T136 WeakPolarHBondContact OD1-CB 3.47Å; D133-T136 PolarHBondContact OD1-N 3.45Å; D133-T136 PolarHBondContact OD1-OG1 3.32Å; T136-A138 PolarHBondContact O-N 2.86Å; T136-A138 VanDerWaalsContact O-N 3.14Å; T136-A138 WeakPolarHBondContact OG1-CB 3.33Å; T136-A138 PolarHBondContact OG1-N 2.86Å
137	N	83.4	Confident	87	Confident	77 Å²	77	60.8 Å²	60.8	41%	0.412	32%	0.319	S	S	.	.			trans	56.9	13.8	-171.3	-71.1	-90.3	0	0	0	114.9	R132 D133	R132-N137 PolarHBondContact NH1-O 2.86Å; D133-N137 WeakPolarHBondContact O-CA 3.27Å; D133-N137 PolarHBondContact O-N 2.69Å
138	A	85.9	Confident	87	Confident	45 Å²	45	60.7 Å²	60.7	37%	0.372	32%	0.318	S	S	.	.			trans	-65.7	139.3	174	0	0	0	0	0	110.5	R132 D133 T136 L140	R132-A138 CarbonylContact C-O 3.53Å; R132-A138 WeakPolarHBondContact CA-O 3.3Å; D133-A138 PolarHBondContact N-O 3.31Å; T136-A138 PolarHBondContact O-N 2.86Å; T136-A138 VanDerWaalsContact O-N 3.14Å; T136-A138 WeakPolarHBondContact OG1-CB 3.33Å; T136-A138 PolarHBondContact OG1-N 2.86Å; A138-L140 PolarHBondContact O-N 3.38Å
139	P	84.4	Confident	87	Confident	78 Å²	78	59 Å²	59	51%	0.506	31%	0.314	S	S	.	.	B	Isolated β-bridge	trans	-67.7	126.2	174	29.5	-33.7	0	0	0	110	Q130	Q130-P139 HydrophobicContact CG-CB 4.46Å
140	L	84.7	Confident	87.1	Confident	76 Å²	76	59.1 Å²	59.1	40%	0.398	31%	0.313	S	S	.	.	S	Bend	trans	-89.6	-34	175	-67.7	172.6	0	0	0	111.1	I89 A131 D133 A138	I89-L140 HydrophobicContact CD1-CD1 3.62Å; I89-L140 HydrophobicContact CG1-CD1 3.69Å; A131-L140 PolarHBondContact O-N 2.9Å; D133-L140 HydrophobicContact CB-CD1 4.16Å; D133-L140 HydrophobicContact CB-CD2 4.19Å; D133-L140 HydrophobicContact CB-CG 4.17Å; A138-L140 PolarHBondContact O-N 3.38Å
141	E	83.2	Confident	87	Confident	26 Å²	26	60.5 Å²	60.5	12%	0.121	32%	0.32	C	S	.	.	S	Bend	trans	-120.3	154.6	174.9	-61.6	-74.8	-172.3	0	0	109.8	K53 T80 A131	K53-E141 IonicContact NZ-OE1 3.55Å; K53-E141 PolarHBondContact NZ-OE1 2.87Å; K53-E141 IonicContact NZ-OE2 3.68Å; K53-E141 PolarHBondContact NZ-OE2 2.91Å; T80-E141 PolarHBondContact OG1-OE1 3.3Å; A131-E141 HydrophobicContact CB-CB 4.4Å; A131-E141 HydrophobicContact CB-CG 4.19Å; A131-E141 PolarHBondContact O-N 3.31Å
142	P	84.4	Confident	87	Confident	94 Å²	94	60.5 Å²	60.5	61%	0.61	32%	0.319	S	S	*	.			trans	-61.7	159.1	166.8	29.2	-35.8	0	0	0	111.2	S144	P142-S144 PolarHBondContact O-N 2.87Å
143	E	87	Confident	87	Confident	97 Å²	97	60.1 Å²	60.1	45%	0.453	32%	0.322	S	S	.	.			trans	-61.4	130.7	169.9	-64.5	-175.6	-177	0	0	110.1	A129 Q130	A129-E143 WeakPolarHBondContact O-CA 3.45Å; Q130-E143 HydrophobicContact CB-CG 4.31Å; Q130-E143 HydrophobicContact CG-CG 4.35Å
144	S	85.6	Confident	87.1	Confident	27 Å²	27	59.8 Å²	59.8	19%	0.189	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	121.9	173.8	-170.1	0	0	0	0	109.8	R128 A129 P142	R128-S144 WeakPolarHBondContact CA-O 3.19Å; A129-S144 PolarHBondContact N-O 2.94Å; A129-S144 PolarHBondContact O-N 2.93Å; P142-S144 PolarHBondContact O-N 2.87Å
145	E	89.3	Confident	87.3	Confident	99 Å²	99	58.5 Å²	58.5	46%	0.463	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	138.8	175.5	-164.3	164.1	101.1	0	0	110.9	T126 L127 R128	T126-E145 HydrophobicContact CG2-CG 3.77Å; L127-E145 WeakPolarHBondContact O-CA 3.25Å; R128-E145 HydrophobicContact CG-CB 4.14Å; R128-E145 HydrophobicContact CG-CG 4.12Å; R128-E145 IonicContact CZ-OE2 3.47Å; R128-E145 IonicContact NE-OE2 2.81Å; R128-E145 PolarHBondContact NE-OE2 3.44Å; R128-E145 IonicContact NH2-OE2 2.87Å; R128-E145 PolarHBondContact NH2-OE2 2.87Å
146	F	88.8	Confident	87.7	Confident	9 Å²	9	53 Å²	53	4%	0.039	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	152.5	177.8	69.8	-88.1	0	0	0	110.3	N59 F61 I93 I111 L127 A129 I148	N59-F146 WeakPolarHBondContact O-CA 3.35Å; F61-F146 AromaticContact CD2-CD2 3.51Å; F61-F146 HydrophobicContact CD2-CD2 3.51Å; F61-F146 AromaticContact CD2-CE2 3.76Å; F61-F146 HydrophobicContact CD2-CE2 3.76Å; F61-F146 HydrophobicContact CD2-CG 4.38Å; F61-F146 AromaticContact CE2-CD2 3.73Å; F61-F146 HydrophobicContact CE2-CD2 3.73Å; F61-F146 AromaticContact CE2-CE2 3.93Å; F61-F146 HydrophobicContact CE2-CE2 3.93Å; F61-F146 HydrophobicContact CE2-CG 4.24Å; I93-F146 HydrophobicContact CG2-CE1 4.31Å; I93-F146 HydrophobicContact CG2-CZ 4.18Å; I111-F146 HydrophobicContact CD1-CE2 4.24Å; I111-F146 HydrophobicContact CD1-CZ 3.88Å; L127-F146 HydrophobicContact CB-CD1 4.35Å; L127-F146 HydrophobicContact CB-CD2 4.41Å; L127-F146 HydrophobicContact CB-CE1 3.74Å; L127-F146 HydrophobicContact CB-CE2 3.85Å; L127-F146 HydrophobicContact CB-CZ 3.48Å; L127-F146 VanDerWaalsContact CB-CZ 3.48Å; L127-F146 HydrophobicContact CD2-CZ 4.28Å; L127-F146 HydrophobicContact CG-CZ 4.41Å; L127-F146 PolarHBondContact N-O 2.94Å; L127-F146 PolarHBondContact O-N 2.93Å; A129-F146 HydrophobicContact CB-CD1 3.96Å; A129-F146 HydrophobicContact CB-CE1 3.72Å; F146-I148 HydrophobicContact CD2-CG1 4.2Å; F146-I148 HydrophobicContact CE2-CD1 4.05Å; F146-I148 HydrophobicContact CE2-CG1 3.77Å
147	V	91.6	Very high	88.1	Confident	34 Å²	34	53.2 Å²	53.2	21%	0.206	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	130	179.1	-178	0	0	0	0	109.6	N59 Q60 F61 F124 Y125 K149	N59-V147 PolarHBondContact O-N 2.79Å; Q60-V147 CarbonylContact C-O 3.56Å; Q60-V147 WeakPolarHBondContact CA-O 2.92Å; F61-V147 PolarHBondContact N-O 2.93Å; F124-V147 HydrophobicContact CB-CG1 3.84Å; F124-V147 HydrophobicContact CD2-CG1 3.91Å; F124-V147 HydrophobicContact CG-CG1 4.24Å; Y125-V147 CarbonylContact O-C 3.57Å; Y125-V147 WeakPolarHBondContact O-CA 3.21Å; V147-K149 HydrophobicContact CG1-CG 4Å
148	I	91.8	Very high	88.7	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	115.5	162.8	-59.1	175.4	0	0	0	106.4	F61 V63 V75 F102 F124 Y125 L127 F146	F61-I148 HydrophobicContact CB-CG1 4.48Å; V63-I148 HydrophobicContact CB-CG2 4.14Å; V63-I148 HydrophobicContact CG1-CG2 3.47Å; V63-I148 VanDerWaalsContact CG1-CG2 3.47Å; V75-I148 HydrophobicContact CG1-CD1 4.19Å; V75-I148 HydrophobicContact CG1-CG1 4.3Å; V75-I148 HydrophobicContact CG1-CG2 4.01Å; F102-I148 HydrophobicContact CB-CD1 4.43Å; F102-I148 HydrophobicContact CD1-CD1 3.52Å; F102-I148 HydrophobicContact CD2-CD1 3.87Å; F102-I148 HydrophobicContact CE1-CD1 3.61Å; F102-I148 HydrophobicContact CE1-CG2 3.93Å; F102-I148 HydrophobicContact CE2-CD1 3.97Å; F102-I148 HydrophobicContact CG-CD1 3.65Å; F102-I148 HydrophobicContact CZ-CB 4.26Å; F102-I148 HydrophobicContact CZ-CD1 3.85Å; F102-I148 HydrophobicContact CZ-CG2 3.87Å; F124-I148 CarbonylContact C-O 3.53Å; F124-I148 VanDerWaalsContact CA-O 3.31Å; F124-I148 WeakPolarHBondContact CA-O 3.44Å; Y125-I148 PolarHBondContact N-O 2.88Å; Y125-I148 PolarHBondContact O-N 3.27Å; L127-I148 HydrophobicContact CD1-CD1 3.82Å; L127-I148 HydrophobicContact CD1-CG1 4.08Å; L127-I148 HydrophobicContact CD2-CD1 4.42Å; F146-I148 HydrophobicContact CD2-CG1 4.2Å; F146-I148 HydrophobicContact CE2-CD1 4.05Å; F146-I148 HydrophobicContact CE2-CG1 3.77Å
149	K	91	Very high	89	Confident	81 Å²	81	53.7 Å²	53.7	35%	0.352	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	131.7	172.7	-73.2	179.5	172.7	171.7	0	109.7	F61 F62 V63 F124 V147	F61-K149 PolarHBondContact O-N 2.75Å; F62-K149 WeakPolarHBondContact CA-O 3.5Å; F62-K149 HydrophobicContact CD1-CB 3.83Å; F62-K149 HydrophobicContact CE1-CB 3.95Å; F62-K149 HydrophobicContact CE1-CD 3.79Å; F62-K149 HydrophobicContact CE1-CG 4.48Å; F62-K149 HydrophobicContact CZ-CD 4.3Å; V63-K149 PolarHBondContact N-O 2.96Å; F124-K149 HydrophobicContact CB-CG 4.27Å; V147-K149 HydrophobicContact CG1-CG 4Å
150	V	91.8	Very high	89.5	Confident	12 Å²	12	51.7 Å²	51.7	7%	0.073	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	137.6	168.2	-172.1	0	0	0	0	107.9	V63 E65 L117 R119 K122 A123 Y125	V63-V150 HydrophobicContact CG1-CG2 4.37Å; V63-V150 CarbonylContact O-C 3.56Å; V63-V150 WeakPolarHBondContact O-CA 3.32Å; E65-V150 HydrophobicContact CB-CG1 3.6Å; L117-V150 HydrophobicContact CB-CG1 4.39Å; L117-V150 HydrophobicContact CB-CG2 4.42Å; L117-V150 HydrophobicContact CD1-CG2 4.34Å; R119-V150 HydrophobicContact CB-CB 4.23Å; R119-V150 HydrophobicContact CB-CG1 3.8Å; R119-V150 HydrophobicContact CG-CB 4.23Å; R119-V150 HydrophobicContact CG-CG1 4.25Å; K122-V150 WeakPolarHBondContact O-CG2 3.32Å; A123-V150 PolarHBondContact O-N 2.97Å; Y125-V150 HydrophobicContact CD2-CG2 4.37Å; Y125-V150 HydrophobicContact CE2-CG2 3.99Å
151	Q	89.3	Confident	89.7	Confident	50 Å²	50	53.3 Å²	53.3	23%	0.234	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	118.9	175.7	-71.2	-168.9	-45.9	0	0	109.7	F62 V63 V64 E65	F62-Q151 HydrophobicContact CB-CG 3.92Å; F62-Q151 HydrophobicContact CD1-CG 3.82Å; F62-Q151 HydrophobicContact CG-CG 4.29Å; V63-Q151 PolarHBondContact O-N 2.93Å; V64-Q151 HydrophobicContact CG2-CB 4.26Å; E65-Q151 PolarHBondContact N-O 2.82Å
152	D	89.4	Confident	89.7	Confident	9 Å²	9	58 Å²	58	5%	0.048	30%	0.295	C	S	.	.			trans	-43.5	127.6	173.5	-178.2	89	0	0	0	114.5	E65 R119 D189 Y192 S195	E65-D152 WeakPolarHBondContact OE1-CA 3.34Å; R119-D152 IonicContact NE-OD1 2.64Å; D152-D189 HydrophobicContact CB-CB 3.95Å; D152-D189 VanDerWaalsContact OD1-CB 3.3Å; D152-D189 WeakPolarHBondContact OD1-CB 3.41Å; D152-D189 PolarHBondContact OD1-N 3.38Å; D152-Y192 HydrophobicContact CB-CD1 3.54Å; D152-Y192 HydrophobicContact CB-CE1 4.26Å; D152-Y192 HydrophobicContact CB-CG 3.83Å; D152-Y192 WeakPolarHBondContact O-CD1 3.45Å; D152-Y192 WeakPolarHBondContact O-CE1 3.34Å; D152-Y192 WeakPolarHBondContact OD2-CD1 3.25Å; D152-S195 VanDerWaalsContact OD2-CB 3.29Å; D152-S195 WeakPolarHBondContact OD2-CB 3.48Å; D152-S195 PolarHBondContact OD2-OG 3.48Å
153	I	88.5	Confident	89.6	Confident	66 Å²	66	56 Å²	56	34%	0.338	29%	0.29	S	S	.	.			trans	-113.4	142.2	160.2	-68.2	-179.6	0	0	0	107.8	V64 E65 D155	V64-I153 HydrophobicContact CG1-CD1 3.66Å; V64-I153 HydrophobicContact CG1-CG1 3.99Å; E65-I153 HydrophobicContact CG-CB 4.04Å; E65-I153 HydrophobicContact CG-CD1 4.15Å; E65-I153 HydrophobicContact CG-CG1 4.02Å; E65-I153 WeakPolarHBondContact O-CD1 3.43Å; E65-I153 PolarHBondContact OE1-N 2.86Å; I153-D155 VanDerWaalsContact C-N 3.33Å; I153-D155 HydrophobicContact CG2-CB 4.25Å; I153-D155 PolarHBondContact O-N 3.25Å
154	N	88.6	Confident	89.5	Confident	30 Å²	30	56.8 Å²	56.8	16%	0.16	30%	0.304	C	S	.	.	S	Bend	trans	-76.8	80.8	173.8	-168.3	127.9	0	0	0	110.7	D188 S195 D241 M242	N154-D188 VanDerWaalsContact CA-OD2 3.27Å; N154-D188 WeakPolarHBondContact CA-OD2 3.5Å; N154-S195 VanDerWaalsContact OD1-CA 3.3Å; N154-S195 WeakPolarHBondContact OD1-CA 3.49Å; N154-D241 PolarHBondContact ND2-OD2 2.72Å; N154-M242 WeakPolarHBondContact OD1-CG 3.3Å
155	D	88.8	Confident	90	Very high	78 Å²	78	55.9 Å²	55.9	42%	0.417	30%	0.296	S	S	.	.			trans	-117.9	-12.4	178.8	84.4	-14.2	0	0	0	115.3	I153 L249	I153-D155 VanDerWaalsContact C-N 3.33Å; I153-D155 HydrophobicContact CG2-CB 4.25Å; I153-D155 PolarHBondContact O-N 3.25Å; D155-L249 WeakPolarHBondContact O-CD1 3.27Å
156	S	90.6	Very high	90.3	Very high	27 Å²	27	56.5 Å²	56.5	19%	0.189	30%	0.302	C	S	.	.	S	Bend	trans	-80.7	151	165.6	-59.8	0	0	0	0	111.6	D188 L249	S156-D188 WeakPolarHBondContact CB-OD1 3.33Å; S156-D188 PolarHBondContact N-OD1 3.31Å; S156-D188 PolarHBondContact OG-OD1 3.41Å; S156-L249 WeakPolarHBondContact O-CD1 3.46Å
157	E	92.5	Very high	90.5	Very high	102 Å²	102	56.5 Å²	56.5	48%	0.477	31%	0.305	S	S	.	.			trans	-109.2	145.7	172	70.8	175.4	177.2	0	0	112	Q159 L249	E157-Q159 WeakPolarHBondContact O-CG 3.41Å; E157-Q159 PolarHBondContact O-N 2.86Å; E157-Q159 VanDerWaalsContact O-N 3.15Å; E157-L249 HydrophobicContact CB-CB 3.84Å
158	P	94.6	Very high	90.8	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.318	C	S	.	.			trans	-56.9	115.7	178.9	-24	26.5	0	0	0	113.8	A184 D186 V198 A239 D241 G251	P158-A184 HydrophobicContact CB-CB 4.33Å; P158-D186 WeakPolarHBondContact CD-OD2 3.3Å; P158-D186 VanDerWaalsContact CG-OD2 3.3Å; P158-D186 WeakPolarHBondContact CG-OD2 3.37Å; P158-V198 HydrophobicContact CB-CG1 4.37Å; P158-V198 HydrophobicContact CB-CG2 4.04Å; P158-V198 HydrophobicContact CG-CG2 4.14Å; P158-A239 HydrophobicContact CB-CB 3.64Å; P158-A239 HydrophobicContact CG-CB 4.41Å; P158-D241 HydrophobicContact CG-CB 3.88Å; P158-G251 WeakPolarHBondContact O-CA 3.25Å; P158-G251 PolarHBondContact O-N 3.16Å
159	Q	93.9	Very high	91	Very high	133 Å²	133	58.6 Å²	58.6	62%	0.621	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	131.3	179.4	-58.5	-170	17.9	0	0	111.9	E157 A184 S185	E157-Q159 WeakPolarHBondContact O-CG 3.41Å; E157-Q159 PolarHBondContact O-N 2.86Å; E157-Q159 VanDerWaalsContact O-N 3.15Å; Q159-A184 CarbonylContact O-C 3.59Å; Q159-A184 WeakPolarHBondContact O-CA 3.39Å; Q159-S185 PolarHBondContact N-O 3.36Å; Q159-S185 PolarHBondContact O-N 3.08Å
160	F	94.4	Very high	91.1	Very high	36 Å²	36	56.4 Å²	56.4	16%	0.158	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	129.4	177.4	-77.1	-87.2	0	0	0	112	Y165 V182 A184 Y200 V237 A239 T253	F160-Y165 HydrophobicContact CB-CE2 3.92Å; F160-Y165 AromaticContact CD1-CE2 3.97Å; F160-Y165 HydrophobicContact CD1-CE2 3.97Å; F160-Y165 HydrophobicContact CG-CE2 4.26Å; F160-V182 HydrophobicContact CD1-CB 4.34Å; F160-V182 HydrophobicContact CE1-CB 4.07Å; F160-V182 HydrophobicContact CE1-CG2 3.97Å; F160-A184 HydrophobicContact CD1-CB 3.98Å; F160-A184 HydrophobicContact CD2-CB 4.36Å; F160-A184 HydrophobicContact CE1-CB 4.13Å; F160-A184 HydrophobicContact CE2-CB 4.49Å; F160-A184 HydrophobicContact CG-CB 4.12Å; F160-A184 HydrophobicContact CZ-CB 4.39Å; F160-Y200 HydrophobicContact CE1-CD1 4.3Å; F160-Y200 AromaticContact CE1-CE1 3.99Å; F160-Y200 HydrophobicContact CE1-CE1 3.99Å; F160-Y200 HydrophobicContact CZ-CD1 4.42Å; F160-Y200 HydrophobicContact CZ-CE1 4.39Å; F160-V237 HydrophobicContact CZ-CG1 4.26Å; F160-A239 HydrophobicContact CE1-CB 4.46Å; F160-A239 HydrophobicContact CE2-CB 3.68Å; F160-A239 HydrophobicContact CZ-CB 3.63Å; F160-T253 HydrophobicContact CB-CG2 4.39Å; F160-T253 HydrophobicContact CD1-CG2 3.65Å; F160-T253 HydrophobicContact CD2-CG2 3.84Å; F160-T253 HydrophobicContact CE1-CG2 3.73Å; F160-T253 HydrophobicContact CE2-CG2 3.92Å; F160-T253 HydrophobicContact CG-CG2 3.69Å; F160-T253 HydrophobicContact CZ-CG2 3.86Å
161	L	87.9	Confident	91.1	Very high	110 Å²	110	55.9 Å²	55.9	58%	0.576	31%	0.314	S	S	*	.	S	Bend	trans	-87.3	-33	-166.6	-60.2	-179.1	0	0	0	115.4	Y165 T183	L161-Y165 PolarHBondContact N-OH 3.29Å; L161-T183 HydrophobicContact CD1-CG2 4.29Å; L161-T183 PolarHBondContact N-O 2.89Å
162	E	83.2	Confident	91.1	Very high	125 Å²	125	56.4 Å²	56.4	58%	0.584	32%	0.318	S	S	*	.	S	Bend	trans	-116.6	31.7	-163.1	-63.7	170.3	159.2	0	0	112.8	Y165	E162-Y165 HydrophobicContact CB-CE1 3.71Å; E162-Y165 PolarHBondContact N-OH 2.98Å; E162-Y165 VanDerWaalsContact N-OH 3.08Å
163	G	82.2	Confident	91.2	Very high	50 Å²	50	56.7 Å²	56.7	52%	0.515	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-72.2	144.9	177.2	0	0	0	0	0	113.3
164	P	86.6	Confident	91.4	Very high	115 Å²	115	57.5 Å²	57.5	75%	0.747	33%	0.33	S	S	*	.	S	Bend	cis	-82.2	135.3	4.1	32.6	-34.5	0	0	0	113.1	I166	P164-I166 PolarHBondContact O-N 3.5Å
165	Y	94.3	Very high	91.6	Very high	7 Å²	7	59.8 Å²	59.8	3%	0.027	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	117	177.9	-63.9	-78.8	0	0	0	111.2	F160 L161 E162 M180 V182 T183 T253 V255 T256	F160-Y165 HydrophobicContact CB-CE2 3.92Å; F160-Y165 AromaticContact CD1-CE2 3.97Å; F160-Y165 HydrophobicContact CD1-CE2 3.97Å; F160-Y165 HydrophobicContact CG-CE2 4.26Å; L161-Y165 PolarHBondContact N-OH 3.29Å; E162-Y165 HydrophobicContact CB-CE1 3.71Å; E162-Y165 PolarHBondContact N-OH 2.98Å; E162-Y165 VanDerWaalsContact N-OH 3.08Å; Y165-M180 HydrophobicContact CD1-CE 3.94Å; Y165-M180 HydrophobicContact CG-CE 4.45Å; Y165-V182 HydrophobicContact CD1-CB 4.39Å; Y165-V182 HydrophobicContact CD1-CG1 3.73Å; Y165-V182 HydrophobicContact CD2-CG1 4.28Å; Y165-V182 HydrophobicContact CE1-CB 4.07Å; Y165-V182 HydrophobicContact CE1-CG1 3.92Å; Y165-V182 HydrophobicContact CE2-CG1 4.48Å; Y165-V182 HydrophobicContact CG-CG1 3.9Å; Y165-T183 PolarHBondContact OH-O 3.47Å; Y165-T253 HydrophobicContact CD2-CG2 3.73Å; Y165-T253 HydrophobicContact CE2-CG2 3.76Å; Y165-V255 HydrophobicContact CG-CG2 4.35Å; Y165-T256 PolarHBondContact O-N 2.93Å
166	I	95.6	Very high	91.9	Very high	113 Å²	113	63.3 Å²	63.3	58%	0.579	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.9	119.9	171.2	-52.7	178.8	0	0	0	107.6	P164 T256 V258	P164-I166 PolarHBondContact O-N 3.5Å; I166-T256 WeakPolarHBondContact CA-O 3.43Å; I166-V258 HydrophobicContact CG2-CG2 4.42Å
167	G	94.8	Very high	92.1	Very high	9 Å²	9	63.9 Å²	63.9	9%	0.093	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	167.7	174.8	0	0	0	0	0	111.2	M180 T256 I257 V258	G167-M180 VanDerWaalsContact CA-SD 3.58Å; G167-T256 PolarHBondContact N-O 2.61Å; G167-I257 WeakPolarHBondContact O-CA 3.37Å; G167-V258 PolarHBondContact O-N 2.9Å
168	S	96.3	Very high	92.3	Very high	70 Å²	70	62.7 Å²	62.7	49%	0.49	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	151.6	174.7	57.6	0	0	0	0	112.3	V258	S168-V258 WeakPolarHBondContact CA-O 3.39Å; S168-V258 WeakPolarHBondContact CB-O 3.48Å
169	V	96.2	Very high	92.4	Very high	8 Å²	8	63.6 Å²	63.6	5%	0.048	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	144.6	177.7	64.1	0	0	0	0	109.4	T177 V179 F209 T220 L225 I257 V258 I259 T260	V169-T177 HydrophobicContact CG2-CG2 3.98Å; V169-V179 HydrophobicContact CB-CG1 4.23Å; V169-V179 HydrophobicContact CB-CG2 4.01Å; V169-V179 HydrophobicContact CG1-CG1 4.5Å; V169-V179 HydrophobicContact CG1-CG2 4.2Å; V169-V179 HydrophobicContact CG2-CG2 4.25Å; V169-F209 HydrophobicContact CG1-CE1 4.29Å; V169-T220 HydrophobicContact CG2-CG2 4Å; V169-L225 HydrophobicContact CG1-CD1 4.1Å; V169-I257 HydrophobicContact CG1-CG2 4.05Å; V169-V258 PolarHBondContact N-O 2.97Å; V169-V258 VanDerWaalsContact N-O 3.15Å; V169-I259 HydrophobicContact CG1-CD1 3.79Å; V169-I259 CarbonylContact O-C 3.59Å; V169-I259 WeakPolarHBondContact O-CA 3.49Å; V169-T260 PolarHBondContact O-N 3.1Å; V169-T260 PolarHBondContact O-OG1 2.99Å
170	A	93.1	Very high	92.4	Very high	34 Å²	34	59 Å²	59	28%	0.281	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	145.5	175.1	0	0	0	0	0	111.2	S173 T260 V262	A170-S173 VanDerWaalsContact O-CB 3.22Å; A170-S173 WeakPolarHBondContact O-CB 3.43Å; A170-S173 PolarHBondContact O-N 2.94Å; A170-S173 PolarHBondContact O-OG 2.85Å; A170-T260 WeakPolarHBondContact CA-O 3.21Å; A170-T260 VanDerWaalsContact CA-OG1 3.28Å; A170-T260 WeakPolarHBondContact CA-OG1 3.01Å; A170-T260 PolarHBondContact N-OG1 3.1Å; A170-V262 HydrophobicContact CB-CG2 4.07Å
171	E	93	Very high	92.4	Very high	2 Å²	2	62.2 Å²	62.2	1%	0.009	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	162.5	166.5	66.2	-157.9	124.6	0	0	112.4	S173 L225 R227 I259 T260 D261 V262	E171-S173 PolarHBondContact O-N 3.28Å; E171-L225 WeakPolarHBondContact CB-O 3.28Å; E171-R227 WeakPolarHBondContact OE2-CB 3.32Å; E171-R227 PolarHBondContact OE2-N 2.81Å; E171-I259 HydrophobicContact CB-CG2 3.62Å; E171-T260 PolarHBondContact N-O 2.8Å; E171-D261 WeakPolarHBondContact OE1-CA 3.36Å; E171-V262 HydrophobicContact CG-CB 3.66Å; E171-V262 HydrophobicContact CG-CG2 3.84Å; E171-V262 PolarHBondContact OE1-N 3.16Å
172	L	89.3	Confident	92.8	Very high	61 Å²	61	57 Å²	57	32%	0.319	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	15.1	-171.4	-51.9	176.6	0	0	0	114.2	L225 D264 F357	L172-L225 PolarHBondContact N-O 3.46Å; L172-D264 HydrophobicContact CD1-CB 4.04Å; L172-F357 HydrophobicContact CD1-CE1 4.04Å; L172-F357 HydrophobicContact CD1-CZ 3.73Å
173	S	91.5	Very high	93.3	Very high	14 Å²	14	52.4 Å²	52.4	10%	0.098	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-62.7	135.6	172.9	-73.7	0	0	0	0	109.9	A170 E171 A223	A170-S173 VanDerWaalsContact O-CB 3.22Å; A170-S173 WeakPolarHBondContact O-CB 3.43Å; A170-S173 PolarHBondContact O-N 2.94Å; A170-S173 PolarHBondContact O-OG 2.85Å; E171-S173 PolarHBondContact O-N 3.28Å; S173-A223 WeakPolarHBondContact O-CA 3.45Å
174	P	92.3	Very high	93.9	Very high	84 Å²	84	50.5 Å²	50.5	55%	0.545	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-62.6	159.5	178.1	27.2	-33.9	0	0	0	111.3	T177 T220	P174-T177 WeakPolarHBondContact CD-OG1 3.42Å; P174-T177 WeakPolarHBondContact O-CB 3.27Å; P174-T177 PolarHBondContact O-N 3.14Å; P174-T177 PolarHBondContact O-OG1 2.92Å; P174-T220 PolarHBondContact O-OG1 3.17Å
175	T	93.7	Very high	94.1	Very high	77 Å²	77	48 Å²	48	47%	0.472	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	149.3	169.2	50.2	0	0	0	0	111.6	T177 T220 A223	T175-T177 PolarHBondContact O-N 3.29Å; T175-T220 WeakPolarHBondContact CA-OG1 3.45Å; T175-A223 HydrophobicContact CG2-CB 4.33Å
176	E	93.8	Very high	94.1	Very high	152 Å²	152	48.6 Å²	48.6	71%	0.71	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	15.1	-176.4	-49	-171.8	141.6	0	0	114.5	S178 T220	E176-S178 PolarHBondContact O-N 3.13Å; E176-T220 PolarHBondContact N-O 2.87Å; E176-T220 PolarHBondContact N-OG1 2.9Å
177	T	95.4	Very high	93.9	Very high	39 Å²	39	45.7 Å²	45.7	24%	0.239	28%	0.278	C	S	.	.			trans	-70.3	120.9	170.3	-63.4	0	0	0	0	110	V169 P174 T175 V179 M219 T220	V169-T177 HydrophobicContact CG2-CG2 3.98Å; P174-T177 WeakPolarHBondContact CD-OG1 3.42Å; P174-T177 WeakPolarHBondContact O-CB 3.27Å; P174-T177 PolarHBondContact O-N 3.14Å; P174-T177 PolarHBondContact O-OG1 2.92Å; T175-T177 PolarHBondContact O-N 3.29Å; T177-V179 PolarHBondContact O-N 2.89Å; T177-M219 CarbonylContact O-C 3.37Å; T177-M219 WeakPolarHBondContact O-CA 3.49Å; T177-T220 WeakPolarHBondContact CB-OG1 3.29Å; T177-T220 PolarHBondContact N-OG1 3.48Å; T177-T220 PolarHBondContact O-N 3.29Å
178	S	96.1	Very high	93.7	Very high	78 Å²	78	45.5 Å²	45.5	55%	0.545	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	118.4	177.1	170.7	0	0	0	0	111.7	E176	E176-S178 PolarHBondContact O-N 3.13Å
179	V	96.3	Very high	93.3	Very high	19 Å²	19	44.1 Å²	44.1	12%	0.115	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	-58.3	179.1	-176.9	0	0	0	0	110.9	V169 T177 F209 I218 T220 I257	V169-V179 HydrophobicContact CB-CG1 4.23Å; V169-V179 HydrophobicContact CB-CG2 4.01Å; V169-V179 HydrophobicContact CG1-CG1 4.5Å; V169-V179 HydrophobicContact CG1-CG2 4.2Å; V169-V179 HydrophobicContact CG2-CG2 4.25Å; T177-V179 PolarHBondContact O-N 2.89Å; V179-F209 HydrophobicContact CG2-CD1 4.1Å; V179-F209 HydrophobicContact CG2-CE1 4.18Å; V179-I218 HydrophobicContact CB-CG2 4.35Å; V179-I218 PolarHBondContact N-O 3.24Å; V179-T220 HydrophobicContact CG2-CG2 4.2Å; V179-I257 HydrophobicContact CG1-CD1 4.28Å; V179-I257 HydrophobicContact CG1-CG1 4.27Å; V179-I257 HydrophobicContact CG1-CG2 3.88Å
180	M	95	Very high	92.5	Very high	35 Å²	35	48.3 Å²	48.3	17%	0.172	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	178.3	179.1	72.7	-178	-55.8	0	0	110.8	Y165 G167 I217 I218 V255	Y165-M180 HydrophobicContact CD1-CE 3.94Å; Y165-M180 HydrophobicContact CG-CE 4.45Å; G167-M180 VanDerWaalsContact CA-SD 3.58Å; M180-I217 WeakPolarHBondContact O-CA 3.44Å; M180-I218 HydrophobicContact CG-CB 4.48Å; M180-I218 HydrophobicContact CG-CD1 3.94Å; M180-I218 PolarHBondContact O-N 3.41Å; M180-I218 HydrophobicContact SD-CD1 4.45Å; M180-V255 HydrophobicContact SD-CG1 3.45Å; M180-V255 WeakPolarHBondContact SD-CG1 3.47Å
181	K	94.9	Very high	91.8	Very high	104 Å²	104	52.8 Å²	52.8	45%	0.452	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138.7	170.1	-175	-174.6	174.4	-107.4	0	110.1	T183 T215 G216 I217	K181-T183 PolarHBondContact NZ-OG1 3.45Å; K181-T215 WeakPolarHBondContact CE-O 3.44Å; K181-G216 WeakPolarHBondContact CA-O 3.23Å; K181-I217 HydrophobicContact CB-CG1 4.35Å; K181-I217 HydrophobicContact CG-CG1 4.24Å
182	V	95.3	Very high	91	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	33%	0.331	C	S	.	.			trans	-105.7	150.4	164.7	-63.5	0	0	0	0	110.4	F160 Y165 Y200 G216 I218 V237 V255	F160-V182 HydrophobicContact CD1-CB 4.34Å; F160-V182 HydrophobicContact CE1-CB 4.07Å; F160-V182 HydrophobicContact CE1-CG2 3.97Å; Y165-V182 HydrophobicContact CD1-CB 4.39Å; Y165-V182 HydrophobicContact CD1-CG1 3.73Å; Y165-V182 HydrophobicContact CD2-CG1 4.28Å; Y165-V182 HydrophobicContact CE1-CB 4.07Å; Y165-V182 HydrophobicContact CE1-CG1 3.92Å; Y165-V182 HydrophobicContact CE2-CG1 4.48Å; Y165-V182 HydrophobicContact CG-CG1 3.9Å; V182-Y200 HydrophobicContact CG2-CD1 4.18Å; V182-Y200 HydrophobicContact CG2-CE1 4.27Å; V182-G216 WeakPolarHBondContact CG2-O 3.22Å; V182-G216 PolarHBondContact N-O 3.31Å; V182-I218 HydrophobicContact CG1-CD1 3.75Å; V182-I218 HydrophobicContact CG2-CD1 4.5Å; V182-V237 HydrophobicContact CG2-CG1 4.11Å; V182-V255 HydrophobicContact CG1-CG2 3.8Å
183	T	94.6	Very high	90	Very high	30 Å²	30	57 Å²	57	18%	0.184	34%	0.341	C	S	.	.			trans	-133.3	122.8	178.2	-47.3	0	0	0	0	110.3	L161 Y165 K181	L161-T183 HydrophobicContact CD1-CG2 4.29Å; L161-T183 PolarHBondContact N-O 2.89Å; Y165-T183 PolarHBondContact OH-O 3.47Å; K181-T183 PolarHBondContact NZ-OG1 3.45Å
184	A	93.9	Very high	89.4	Confident	10 Å²	10	58.4 Å²	58.4	8%	0.083	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	145.6	164.2	0	0	0	0	0	110.2	P158 Q159 F160 V198 Y200 A239	P158-A184 HydrophobicContact CB-CB 4.33Å; Q159-A184 CarbonylContact O-C 3.59Å; Q159-A184 WeakPolarHBondContact O-CA 3.39Å; F160-A184 HydrophobicContact CD1-CB 3.98Å; F160-A184 HydrophobicContact CD2-CB 4.36Å; F160-A184 HydrophobicContact CE1-CB 4.13Å; F160-A184 HydrophobicContact CE2-CB 4.49Å; F160-A184 HydrophobicContact CG-CB 4.12Å; F160-A184 HydrophobicContact CZ-CB 4.39Å; A184-V198 HydrophobicContact CB-CG1 4.39Å; A184-Y200 HydrophobicContact CB-CE1 4.12Å; A184-Y200 PolarHBondContact N-OH 3.29Å; A184-Y200 PolarHBondContact O-OH 2.68Å; A184-A239 HydrophobicContact CB-CB 3.63Å
185	S	92.1	Very high	88.8	Confident	61 Å²	61	54.6 Å²	54.6	43%	0.427	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	145.3	166.5	-164.5	0	0	0	0	108.9	Q159	Q159-S185 PolarHBondContact N-O 3.36Å; Q159-S185 PolarHBondContact O-N 3.08Å
186	D	93.3	Very high	88.3	Confident	20 Å²	20	51.9 Å²	51.9	11%	0.107	31%	0.311	C	S	.	.			trans	-96.4	171.2	159.3	-136.8	-55.2	0	0	0	110.1	P158 A196 V198 D241	P158-D186 WeakPolarHBondContact CD-OD2 3.3Å; P158-D186 VanDerWaalsContact CG-OD2 3.3Å; P158-D186 WeakPolarHBondContact CG-OD2 3.37Å; D186-A196 HydrophobicContact CB-CB 3.59Å; D186-V198 HydrophobicContact CB-CG2 4.13Å; D186-D241 WeakPolarHBondContact OD2-CB 3.47Å
187	A	91.5	Very high	88.1	Confident	53 Å²	53	51 Å²	51	44%	0.438	30%	0.301	S	S	.	.			trans	-104.8	-32.3	174.3	0	0	0	0	0	112.8	R119 E120	R119-A187 PolarHBondContact NH2-O 3.42Å; E120-A187 HydrophobicContact CG-CB 3.91Å
188	D	91.3	Very high	87.9	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.021	30%	0.298	C	S	.	.	S	Bend	trans	-52.6	172.9	-178.6	-56.4	-7.1	0	0	0	114.5	R119 N154 S156 P190 S195 A196	R119-D188 VanDerWaalsContact NH2-C 3.28Å; N154-D188 VanDerWaalsContact CA-OD2 3.27Å; N154-D188 WeakPolarHBondContact CA-OD2 3.5Å; S156-D188 WeakPolarHBondContact CB-OD1 3.33Å; S156-D188 PolarHBondContact N-OD1 3.31Å; S156-D188 PolarHBondContact OG-OD1 3.41Å; D188-P190 VanDerWaalsContact O-CD 3.26Å; D188-P190 WeakPolarHBondContact O-CD 3.39Å; D188-S195 WeakPolarHBondContact OD2-CB 3.34Å; D188-A196 HydrophobicContact CB-CB 3.93Å; D188-A196 VanDerWaalsContact O-CB 3.24Å; D188-A196 WeakPolarHBondContact O-CB 3.43Å
189	D	86.2	Confident	87.8	Confident	42 Å²	42	47 Å²	47	23%	0.225	27%	0.273	C	S	.	.			trans	-76.1	113.8	176.5	-160.3	-45.3	0	0	0	112	R119 D152 T191 Y192	R119-D189 VanDerWaalsContact NH1-CB 3.31Å; R119-D189 IonicContact NH1-OD2 2.68Å; D152-D189 HydrophobicContact CB-CB 3.95Å; D152-D189 VanDerWaalsContact OD1-CB 3.3Å; D152-D189 WeakPolarHBondContact OD1-CB 3.41Å; D152-D189 PolarHBondContact OD1-N 3.38Å; D189-T191 PolarHBondContact O-N 2.86Å; D189-T191 VanDerWaalsContact O-N 3.07Å; D189-T191 WeakPolarHBondContact OD1-CA 3.39Å; D189-T191 VanDerWaalsContact OD1-CB 3.25Å; D189-T191 WeakPolarHBondContact OD1-CB 3.32Å; D189-T191 PolarHBondContact OD1-N 2.7Å; D189-T191 PolarHBondContact OD1-OG1 3.43Å; D189-Y192 PolarHBondContact O-N 2.78Å
190	P	79.4	Confident	87.8	Confident	96 Å²	96	47 Å²	47	62%	0.623	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-6	177.7	30.6	-36.7	0	0	0	113.6	D188 A196	D188-P190 VanDerWaalsContact O-CD 3.26Å; D188-P190 WeakPolarHBondContact O-CD 3.39Å; P190-A196 HydrophobicContact CB-CB 4.14Å
191	T	79.5	Confident	87.8	Confident	127 Å²	127	47.5 Å²	47.5	78%	0.779	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	-16.1	177.5	77.4	0	0	0	0	113.6	D189	D189-T191 PolarHBondContact O-N 2.86Å; D189-T191 VanDerWaalsContact O-N 3.07Å; D189-T191 WeakPolarHBondContact OD1-CA 3.39Å; D189-T191 VanDerWaalsContact OD1-CB 3.25Å; D189-T191 WeakPolarHBondContact OD1-CB 3.32Å; D189-T191 PolarHBondContact OD1-N 2.7Å; D189-T191 PolarHBondContact OD1-OG1 3.43Å
192	Y	75.3	Confident	87.8	Confident	102 Å²	102	43.8 Å²	43.8	40%	0.4	26%	0.264	S	S	.	.	S	Bend	trans	-104.8	148.5	174	-158.8	-99.1	0	0	0	110.3	D152 D189 S194 S195	D152-Y192 HydrophobicContact CB-CD1 3.54Å; D152-Y192 HydrophobicContact CB-CE1 4.26Å; D152-Y192 HydrophobicContact CB-CG 3.83Å; D152-Y192 WeakPolarHBondContact O-CD1 3.45Å; D152-Y192 WeakPolarHBondContact O-CE1 3.34Å; D152-Y192 WeakPolarHBondContact OD2-CD1 3.25Å; D189-Y192 PolarHBondContact O-N 2.78Å; Y192-S194 WeakPolarHBondContact O-CA 3.45Å; Y192-S194 PolarHBondContact O-N 3.31Å; Y192-S195 PolarHBondContact O-N 2.89Å; Y192-S195 PolarHBondContact O-OG 2.95Å
193	G	69.4	Low	87.7	Confident	50 Å²	50	48.7 Å²	48.7	52%	0.515	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	-25.4	176.3	0	0	0	0	0	118.4	S195	G193-S195 VanDerWaalsContact C-N 3.28Å
194	S	77.8	Confident	87.6	Confident	44 Å²	44	52.6 Å²	52.6	31%	0.308	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.6	24.5	-140.2	-43.3	0	0	0	0	114.3	Y192 R197 M242	Y192-S194 WeakPolarHBondContact O-CA 3.45Å; Y192-S194 PolarHBondContact O-N 3.31Å; S194-R197 WeakPolarHBondContact O-CB 3.1Å; S194-R197 PolarHBondContact O-N 2.85Å; S194-R197 VanDerWaalsContact O-N 3.17Å; S194-M242 VanDerWaalsContact O-CA 3.27Å; S194-M242 WeakPolarHBondContact O-CA 3.44Å; S194-M242 PolarHBondContact O-N 3.07Å
195	S	79.4	Confident	87.3	Confident	4 Å²	4	52.8 Å²	52.8	3%	0.028	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-72.7	-172.7	-43.7	0	0	0	0	111	D152 N154 D188 Y192 G193 R197 D241 M242	D152-S195 VanDerWaalsContact OD2-CB 3.29Å; D152-S195 WeakPolarHBondContact OD2-CB 3.48Å; D152-S195 PolarHBondContact OD2-OG 3.48Å; N154-S195 VanDerWaalsContact OD1-CA 3.3Å; N154-S195 WeakPolarHBondContact OD1-CA 3.49Å; D188-S195 WeakPolarHBondContact OD2-CB 3.34Å; Y192-S195 PolarHBondContact O-N 2.89Å; Y192-S195 PolarHBondContact O-OG 2.95Å; G193-S195 VanDerWaalsContact C-N 3.28Å; S195-R197 PolarHBondContact O-N 2.6Å; S195-D241 WeakPolarHBondContact O-CB 3.17Å; S195-M242 PolarHBondContact O-N 3.08Å
196	A	83.6	Confident	87.3	Confident	19 Å²	19	57 Å²	57	16%	0.157	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	13.4	174.3	0	0	0	0	0	116.4	D186 D188 P190 V198	D186-A196 HydrophobicContact CB-CB 3.59Å; D188-A196 HydrophobicContact CB-CB 3.93Å; D188-A196 VanDerWaalsContact O-CB 3.24Å; D188-A196 WeakPolarHBondContact O-CB 3.43Å; P190-A196 HydrophobicContact CB-CB 4.14Å; A196-V198 PolarHBondContact O-N 2.99Å
197	R	89.2	Confident	87.2	Confident	135 Å²	135	62.8 Å²	62.8	51%	0.509	35%	0.35	S	S	.	.			trans	-85.3	78.5	179.1	-168	173.7	170.6	-172.8	-0.9	111.5	S194 S195 A243	S194-R197 WeakPolarHBondContact O-CB 3.1Å; S194-R197 PolarHBondContact O-N 2.85Å; S194-R197 VanDerWaalsContact O-N 3.17Å; S195-R197 PolarHBondContact O-N 2.6Å; R197-A243 HydrophobicContact CG-CB 4.24Å; R197-A243 VanDerWaalsContact O-CA 3.26Å; R197-A243 WeakPolarHBondContact O-CA 3.45Å; R197-A243 PolarHBondContact O-N 2.92Å
198	V	92.1	Very high	87.3	Confident	27 Å²	27	62.2 Å²	62.2	16%	0.164	34%	0.338	C	S	.	.			trans	-57.3	140.9	176.3	-173.7	0	0	0	0	112.9	P158 A184 D186 A196 Y200 A239 T240	P158-V198 HydrophobicContact CB-CG1 4.37Å; P158-V198 HydrophobicContact CB-CG2 4.04Å; P158-V198 HydrophobicContact CG-CG2 4.14Å; A184-V198 HydrophobicContact CB-CG1 4.39Å; D186-V198 HydrophobicContact CB-CG2 4.13Å; A196-V198 PolarHBondContact O-N 2.99Å; V198-Y200 HydrophobicContact CG1-CE1 4.29Å; V198-Y200 HydrophobicContact CG1-CE2 4.4Å; V198-A239 HydrophobicContact CG1-CB 3.71Å; V198-T240 CarbonylContact C-O 3.51Å; V198-T240 WeakPolarHBondContact CA-O 3.23Å
199	V	94.3	Very high	87.5	Confident	4 Å²	4	62.1 Å²	62.1	2%	0.024	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	147.4	164.7	-68.4	0	0	0	0	110.9	R213 T240	V199-R213 VanDerWaalsContact CA-O 3.29Å; V199-R213 WeakPolarHBondContact CA-O 3.28Å; V199-R213 HydrophobicContact CB-CG 3.92Å; V199-R213 HydrophobicContact CG1-CG 4.23Å; V199-T240 WeakPolarHBondContact CG2-O 3.29Å; V199-T240 PolarHBondContact N-O 3.37Å; V199-T240 PolarHBondContact O-N 2.88Å
200	Y	95.7	Very high	88	Confident	20 Å²	20	63 Å²	63	8%	0.078	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	147.4	-177.1	-58	-83.9	0	0	0	112.4	F160 V182 A184 V198 R213 V237 K238 A239	F160-Y200 HydrophobicContact CE1-CD1 4.3Å; F160-Y200 AromaticContact CE1-CE1 3.99Å; F160-Y200 HydrophobicContact CE1-CE1 3.99Å; F160-Y200 HydrophobicContact CZ-CD1 4.42Å; F160-Y200 HydrophobicContact CZ-CE1 4.39Å; V182-Y200 HydrophobicContact CG2-CD1 4.18Å; V182-Y200 HydrophobicContact CG2-CE1 4.27Å; A184-Y200 HydrophobicContact CB-CE1 4.12Å; A184-Y200 PolarHBondContact N-OH 3.29Å; A184-Y200 PolarHBondContact O-OH 2.68Å; V198-Y200 HydrophobicContact CG1-CE1 4.29Å; V198-Y200 HydrophobicContact CG1-CE2 4.4Å; Y200-R213 PolarHBondContact N-O 2.9Å; Y200-V237 HydrophobicContact CD1-CG1 4.46Å; Y200-K238 WeakPolarHBondContact CA-O 3.23Å; Y200-A239 HydrophobicContact CD1-CB 4.39Å; Y200-A239 HydrophobicContact CE1-CB 4.28Å
201	S	95.1	Very high	88.8	Confident	46 Å²	46	59.1 Å²	59.1	32%	0.322	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	146.9	173	55.5	0	0	0	0	110.7	K238	S201-K238 PolarHBondContact N-O 3.22Å; S201-K238 PolarHBondContact O-N 2.78Å
202	V	95.9	Very high	89.6	Confident	25 Å²	25	55.8 Å²	55.8	15%	0.152	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	143	167.5	-176.7	0	0	0	0	109.6	D204 E206 V211 L235	V202-D204 WeakPolarHBondContact CG1-O 3.29Å; V202-E206 HydrophobicContact CB-CB 4.2Å; V202-E206 HydrophobicContact CG1-CB 3.88Å; V202-V211 HydrophobicContact CG2-CB 4.28Å; V202-V211 HydrophobicContact CG2-CG1 3.96Å; V202-L235 HydrophobicContact CB-CD1 4.48Å; V202-L235 HydrophobicContact CG1-CD1 3.53Å; V202-L235 HydrophobicContact CG1-CG 4.39Å; V202-L235 HydrophobicContact CG2-CD1 4.07Å
203	L	92.6	Very high	90.6	Very high	104 Å²	104	56.2 Å²	56.2	55%	0.545	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	-35.3	170.2	-76.7	176.8	0	0	0	112.8	V236 K238	L203-V236 HydrophobicContact CB-CB 4.27Å; L203-V236 HydrophobicContact CB-CG1 4.09Å; L203-V236 HydrophobicContact CD1-CG1 4.18Å; L203-V236 PolarHBondContact N-O 3.23Å; L203-K238 HydrophobicContact CD1-CB 3.74Å; L203-K238 HydrophobicContact CD1-CD 4.16Å; L203-K238 HydrophobicContact CD1-CG 4.27Å; L203-K238 HydrophobicContact CD2-CB 4.47Å; L203-K238 HydrophobicContact CD2-CD 4.13Å; L203-K238 HydrophobicContact CG-CB 3.75Å; L203-K238 HydrophobicContact CG-CD 4.26Å
204	D	91.9	Very high	91.7	Very high	111 Å²	111	58.9 Å²	58.9	59%	0.594	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.1	144.7	176	-166.1	4	0	0	0	108.9	V202 L235 V236	V202-D204 WeakPolarHBondContact CG1-O 3.29Å; D204-L235 WeakPolarHBondContact O-CD1 3.31Å; D204-V236 HydrophobicContact CB-CB 4.16Å; D204-V236 HydrophobicContact CB-CG2 4.12Å; D204-V236 PolarHBondContact O-N 2.87Å
205	G	88.4	Confident	92.4	Very high	15 Å²	15	59.8 Å²	59.8	16%	0.155	30%	0.299	C	S	.	.			trans	92.9	2.5	-170.5	0	0	0	0	0	115.7	K207 F208 F209	G205-K207 PolarHBondContact O-N 3.26Å; G205-F208 PolarHBondContact O-N 2.93Å; G205-F209 PolarHBondContact O-N 3.35Å
206	E	90.8	Very high	93.1	Very high	149 Å²	149	59.6 Å²	59.6	70%	0.696	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-19.3	-175.4	64.9	167.9	-166.5	0	0	114.9	V202 F208 F209	V202-E206 HydrophobicContact CB-CB 4.2Å; V202-E206 HydrophobicContact CG1-CB 3.88Å; E206-F208 VanDerWaalsContact C-N 3.28Å; E206-F208 PolarHBondContact O-N 3.47Å; E206-F209 WeakPolarHBondContact CA-O 3.38Å
207	K	91.4	Very high	93.7	Very high	142 Å²	142	61.3 Å²	61.3	62%	0.617	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-33.9	174.5	178.2	177.4	176.5	-93.3	0	112.6	G205 V222	G205-K207 PolarHBondContact O-N 3.26Å; K207-V222 WeakPolarHBondContact O-CG1 3.47Å
208	F	93.6	Very high	94.1	Very high	41 Å²	41	54.9 Å²	54.9	18%	0.18	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-28.8	-168.9	-62.2	-80.9	0	0	0	112.9	G205 E206 A221 V222 L225 Y233	G205-F208 PolarHBondContact O-N 2.93Å; E206-F208 VanDerWaalsContact C-N 3.28Å; E206-F208 PolarHBondContact O-N 3.47Å; F208-A221 PolarHBondContact O-N 2.8Å; F208-V222 HydrophobicContact CD1-CG2 4.13Å; F208-L225 HydrophobicContact CB-CD2 4.38Å; F208-L225 HydrophobicContact CD1-CD2 4.01Å; F208-Y233 HydrophobicContact CB-CD1 4.42Å; F208-Y233 HydrophobicContact CB-CE1 4.38Å; F208-Y233 AromaticContact CD1-CE1 3.79Å; F208-Y233 HydrophobicContact CD1-CE1 3.79Å; F208-Y233 AromaticContact CD2-CD1 3.9Å; F208-Y233 HydrophobicContact CD2-CD1 3.9Å; F208-Y233 AromaticContact CD2-CE1 3.67Å; F208-Y233 HydrophobicContact CD2-CE1 3.67Å; F208-Y233 AromaticContact CE1-CE1 3.78Å; F208-Y233 HydrophobicContact CE1-CE1 3.78Å; F208-Y233 HydrophobicContact CE2-CD1 4.21Å; F208-Y233 AromaticContact CE2-CE1 3.68Å; F208-Y233 HydrophobicContact CE2-CE1 3.68Å; F208-Y233 HydrophobicContact CG-CD1 4.09Å; F208-Y233 AromaticContact CG-CE1 3.7Å; F208-Y233 HydrophobicContact CG-CE1 3.7Å; F208-Y233 AromaticContact CZ-CE1 3.71Å; F208-Y233 HydrophobicContact CZ-CE1 3.71Å
209	F	96.4	Very high	94.3	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.009	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	146.6	-179.2	-52.3	-84.5	0	0	0	111.8	V169 V179 G205 E206 I218 M219 T220 L225 Y233 L235 I257 I259	V169-F209 HydrophobicContact CG1-CE1 4.29Å; V179-F209 HydrophobicContact CG2-CD1 4.1Å; V179-F209 HydrophobicContact CG2-CE1 4.18Å; G205-F209 PolarHBondContact O-N 3.35Å; E206-F209 WeakPolarHBondContact CA-O 3.38Å; F209-I218 HydrophobicContact CB-CG2 4.1Å; F209-M219 CarbonylContact C-O 3.56Å; F209-M219 VanDerWaalsContact CA-O 3.31Å; F209-M219 WeakPolarHBondContact CA-O 3.5Å; F209-T220 HydrophobicContact CE1-CG2 4.34Å; F209-L225 HydrophobicContact CE1-CD1 3.89Å; F209-L225 HydrophobicContact CZ-CD1 4.03Å; F209-L225 HydrophobicContact CZ-CD2 4.25Å; F209-Y233 HydrophobicContact CE2-CD1 4.17Å; F209-Y233 HydrophobicContact CE2-CD2 4.09Å; F209-Y233 AromaticContact CE2-CG 3.71Å; F209-Y233 HydrophobicContact CE2-CG 3.71Å; F209-Y233 HydrophobicContact CZ-CD2 4.14Å; F209-Y233 HydrophobicContact CZ-CG 4.23Å; F209-L235 HydrophobicContact CB-CD1 3.93Å; F209-L235 HydrophobicContact CB-CD2 4.11Å; F209-L235 HydrophobicContact CD2-CD1 4.41Å; F209-I257 HydrophobicContact CB-CD1 4.42Å; F209-I257 HydrophobicContact CD1-CD1 3.66Å; F209-I257 HydrophobicContact CD2-CD1 3.75Å; F209-I257 HydrophobicContact CE1-CD1 3.78Å; F209-I257 HydrophobicContact CE1-CG2 3.92Å; F209-I257 HydrophobicContact CE2-CB 4.49Å; F209-I257 HydrophobicContact CE2-CD1 3.89Å; F209-I257 HydrophobicContact CG-CD1 3.65Å; F209-I257 HydrophobicContact CZ-CB 4.21Å; F209-I257 HydrophobicContact CZ-CD1 3.91Å; F209-I257 HydrophobicContact CZ-CG2 3.76Å; F209-I259 HydrophobicContact CZ-CD1 4.43Å
210	T	95.8	Very high	94.4	Very high	61 Å²	61	55.5 Å²	55.5	37%	0.374	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	163.3	172.1	-173.1	0	0	0	0	109.9	I218 M219	T210-I218 CarbonylContact O-C 3.48Å; T210-I218 WeakPolarHBondContact O-CA 3.21Å; T210-M219 HydrophobicContact CG2-CB 3.99Å; T210-M219 HydrophobicContact CG2-CE 4.1Å; T210-M219 PolarHBondContact N-O 2.92Å; T210-M219 PolarHBondContact O-N 2.8Å
211	V	97.1	Very high	94.3	Very high	13 Å²	13	56.4 Å²	56.4	8%	0.079	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	132.5	172.6	70.4	0	0	0	0	109.6	V202 R213 I217 I218 V237	V202-V211 HydrophobicContact CG2-CB 4.28Å; V202-V211 HydrophobicContact CG2-CG1 3.96Å; V211-R213 PolarHBondContact O-N 3.12Å; V211-I217 CarbonylContact C-O 3.59Å; V211-I217 WeakPolarHBondContact CA-O 3.22Å; V211-I218 HydrophobicContact CB-CG1 4.36Å; V211-I218 HydrophobicContact CG2-CG1 3.97Å; V211-V237 HydrophobicContact CG1-CG1 4.49Å
212	D	96.4	Very high	94.2	Very high	57 Å²	57	55.6 Å²	55.6	31%	0.305	29%	0.286	S	S	.	.			trans	-66.4	123.4	172	174.3	-95.8	0	0	0	110.2	H214 T215 G216 I217 M219	D212-H214 PolarHBondContact O-N 2.84Å; D212-H214 PolarHBondContact OD1-N 2.95Å; D212-H214 VanDerWaalsContact OD1-N 3.09Å; D212-T215 WeakPolarHBondContact CB-OG1 3.34Å; D212-T215 VanDerWaalsContact CG-OG1 3.27Å; D212-T215 WeakPolarHBondContact OD1-CB 3.37Å; D212-T215 WeakPolarHBondContact OD1-CG2 3.31Å; D212-T215 PolarHBondContact OD1-N 3.32Å; D212-T215 PolarHBondContact OD1-OG1 3.19Å; D212-G216 PolarHBondContact O-N 3.47Å; D212-G216 VanDerWaalsContact O-N 3.08Å; D212-I217 PolarHBondContact N-O 2.67Å; D212-M219 HydrophobicContact CB-CE 4.49Å
213	R	94.9	Very high	93.8	Very high	111 Å²	111	56.7 Å²	56.7	42%	0.419	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.3	-170	-170.8	171.9	-170.9	-91	-4.8	114.2	V199 Y200 V211 A243	V199-R213 VanDerWaalsContact CA-O 3.29Å; V199-R213 WeakPolarHBondContact CA-O 3.28Å; V199-R213 HydrophobicContact CB-CG 3.92Å; V199-R213 HydrophobicContact CG1-CG 4.23Å; Y200-R213 PolarHBondContact N-O 2.9Å; V211-R213 PolarHBondContact O-N 3.12Å; R213-A243 PolarHBondContact NH2-O 2.78Å
214	H	92.5	Very high	93.6	Very high	107 Å²	107	57.3 Å²	57.3	50%	0.495	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.8	-25.9	-171.3	-66.5	-45.5	0	0	0	114.5	D212	D212-H214 PolarHBondContact O-N 2.84Å; D212-H214 PolarHBondContact OD1-N 2.95Å; D212-H214 VanDerWaalsContact OD1-N 3.09Å
215	T	94.1	Very high	93.6	Very high	62 Å²	62	52 Å²	52	38%	0.38	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-18.2	-179.1	61.9	0	0	0	0	113.3	K181 D212 I217	K181-T215 WeakPolarHBondContact CE-O 3.44Å; D212-T215 WeakPolarHBondContact CB-OG1 3.34Å; D212-T215 VanDerWaalsContact CG-OG1 3.27Å; D212-T215 WeakPolarHBondContact OD1-CB 3.37Å; D212-T215 WeakPolarHBondContact OD1-CG2 3.31Å; D212-T215 PolarHBondContact OD1-N 3.32Å; D212-T215 PolarHBondContact OD1-OG1 3.19Å; T215-I217 PolarHBondContact O-N 3.1Å; T215-I217 WeakPolarHBondContact OG1-CG1 3.25Å; T215-I217 PolarHBondContact OG1-N 3.09Å
216	G	93.5	Very high	93.9	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.28	C	S	.	.			trans	72.9	13.8	-176.3	0	0	0	0	0	113.9	K181 V182 D212	K181-G216 WeakPolarHBondContact CA-O 3.23Å; V182-G216 WeakPolarHBondContact CG2-O 3.22Å; V182-G216 PolarHBondContact N-O 3.31Å; D212-G216 PolarHBondContact O-N 3.47Å; D212-G216 VanDerWaalsContact O-N 3.08Å
217	I	96.8	Very high	94.1	Very high	55 Å²	55	48 Å²	48	28%	0.282	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	122.7	175	-62.5	171.6	0	0	0	108.9	M180 K181 V211 D212 T215 M219	M180-I217 WeakPolarHBondContact O-CA 3.44Å; K181-I217 HydrophobicContact CB-CG1 4.35Å; K181-I217 HydrophobicContact CG-CG1 4.24Å; V211-I217 CarbonylContact C-O 3.59Å; V211-I217 WeakPolarHBondContact CA-O 3.22Å; D212-I217 PolarHBondContact N-O 2.67Å; T215-I217 PolarHBondContact O-N 3.1Å; T215-I217 WeakPolarHBondContact OG1-CG1 3.25Å; T215-I217 PolarHBondContact OG1-N 3.09Å; I217-M219 HydrophobicContact CG2-CG 3.98Å
218	I	96.9	Very high	94.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	133	174.6	-62.9	164.4	0	0	0	108.3	V179 M180 V182 F209 T210 V211 L235 V237 V255 I257	V179-I218 HydrophobicContact CB-CG2 4.35Å; V179-I218 PolarHBondContact N-O 3.24Å; M180-I218 HydrophobicContact CG-CB 4.48Å; M180-I218 HydrophobicContact CG-CD1 3.94Å; M180-I218 PolarHBondContact O-N 3.41Å; M180-I218 HydrophobicContact SD-CD1 4.45Å; V182-I218 HydrophobicContact CG1-CD1 3.75Å; V182-I218 HydrophobicContact CG2-CD1 4.5Å; F209-I218 HydrophobicContact CB-CG2 4.1Å; T210-I218 CarbonylContact O-C 3.48Å; T210-I218 WeakPolarHBondContact O-CA 3.21Å; V211-I218 HydrophobicContact CB-CG1 4.36Å; V211-I218 HydrophobicContact CG2-CG1 3.97Å; I218-L235 HydrophobicContact CD1-CD2 3.92Å; I218-L235 HydrophobicContact CG1-CD2 4.21Å; I218-L235 HydrophobicContact CG2-CD2 3.73Å; I218-V237 HydrophobicContact CD1-CG2 4.14Å; I218-V255 HydrophobicContact CD1-CB 4.42Å; I218-V255 HydrophobicContact CD1-CG1 4.03Å; I218-V255 HydrophobicContact CD1-CG2 3.99Å; I218-I257 HydrophobicContact CG2-CD1 4.05Å
219	M	96.6	Very high	94.3	Very high	43 Å²	43	47.6 Å²	47.6	21%	0.212	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	155.3	-177.6	-55.3	180	-68.7	0	0	111.1	T177 F209 T210 D212 I217 A221	T177-M219 CarbonylContact O-C 3.37Å; T177-M219 WeakPolarHBondContact O-CA 3.49Å; F209-M219 CarbonylContact C-O 3.56Å; F209-M219 VanDerWaalsContact CA-O 3.31Å; F209-M219 WeakPolarHBondContact CA-O 3.5Å; T210-M219 HydrophobicContact CG2-CB 3.99Å; T210-M219 HydrophobicContact CG2-CE 4.1Å; T210-M219 PolarHBondContact N-O 2.92Å; T210-M219 PolarHBondContact O-N 2.8Å; D212-M219 HydrophobicContact CB-CE 4.49Å; I217-M219 HydrophobicContact CG2-CG 3.98Å; M219-A221 PolarHBondContact O-N 3.41Å
220	T	96.5	Very high	94.2	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.006	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	130.6	172.2	55.2	0	0	0	0	111.1	V169 P174 T175 E176 T177 V179 F209 L225	V169-T220 HydrophobicContact CG2-CG2 4Å; P174-T220 PolarHBondContact O-OG1 3.17Å; T175-T220 WeakPolarHBondContact CA-OG1 3.45Å; E176-T220 PolarHBondContact N-O 2.87Å; E176-T220 PolarHBondContact N-OG1 2.9Å; T177-T220 WeakPolarHBondContact CB-OG1 3.29Å; T177-T220 PolarHBondContact N-OG1 3.48Å; T177-T220 PolarHBondContact O-N 3.29Å; V179-T220 HydrophobicContact CG2-CG2 4.2Å; F209-T220 HydrophobicContact CE1-CG2 4.34Å; T220-L225 HydrophobicContact CG2-CD1 3.72Å
221	A	93.8	Very high	94.2	Very high	40 Å²	40	52.7 Å²	52.7	33%	0.331	28%	0.282	S	S	.	.	S	Bend	trans	-93.4	-15.4	174.1	0	0	0	0	0	112.7	F208 M219	F208-A221 PolarHBondContact O-N 2.8Å; M219-A221 PolarHBondContact O-N 3.41Å
222	V	92.6	Very high	94.1	Very high	29 Å²	29	57.7 Å²	57.7	18%	0.176	30%	0.3	C	S	.	.			trans	-130.4	170.5	178.3	-58.3	0	0	0	0	110.9	K207 F208 D224 L225	K207-V222 WeakPolarHBondContact O-CG1 3.47Å; F208-V222 HydrophobicContact CD1-CG2 4.13Å; V222-D224 VanDerWaalsContact CB-OD1 3.27Å; V222-D224 WeakPolarHBondContact CB-OD1 3.27Å; V222-D224 WeakPolarHBondContact CG2-OD1 3.13Å; V222-L225 HydrophobicContact CG2-CD2 3.92Å; V222-L225 HydrophobicContact CG2-CG 4.12Å
223	A	87.6	Confident	94	Very high	48 Å²	48	55.8 Å²	55.8	40%	0.397	29%	0.288	S	S	.	.	S	Bend	trans	-116.4	-3	177.7	0	0	0	0	0	113.6	S173 T175	S173-A223 WeakPolarHBondContact O-CA 3.45Å; T175-A223 HydrophobicContact CG2-CB 4.33Å
224	D	87.6	Confident	94.1	Very high	117 Å²	117	55.8 Å²	55.8	63%	0.626	29%	0.293	S	S	*	.			trans	-101.9	44.6	176.2	59.7	-25.6	0	0	0	111.2	V222	V222-D224 VanDerWaalsContact CB-OD1 3.27Å; V222-D224 WeakPolarHBondContact CB-OD1 3.27Å; V222-D224 WeakPolarHBondContact CG2-OD1 3.13Å
225	L	93.4	Very high	94.2	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.27	C	S	.	.			trans	-74.8	131.9	160.2	-62.8	178.6	0	0	0	108	V169 E171 L172 F208 F209 T220 V222 Y233 I259	V169-L225 HydrophobicContact CG1-CD1 4.1Å; E171-L225 WeakPolarHBondContact CB-O 3.28Å; L172-L225 PolarHBondContact N-O 3.46Å; F208-L225 HydrophobicContact CB-CD2 4.38Å; F208-L225 HydrophobicContact CD1-CD2 4.01Å; F209-L225 HydrophobicContact CE1-CD1 3.89Å; F209-L225 HydrophobicContact CZ-CD1 4.03Å; F209-L225 HydrophobicContact CZ-CD2 4.25Å; T220-L225 HydrophobicContact CG2-CD1 3.72Å; V222-L225 HydrophobicContact CG2-CD2 3.92Å; V222-L225 HydrophobicContact CG2-CG 4.12Å; L225-Y233 HydrophobicContact CD2-CE2 4.09Å; L225-I259 HydrophobicContact CB-CD1 4.41Å; L225-I259 HydrophobicContact CD1-CD1 4.07Å
226	D	93.8	Very high	94.3	Very high	56 Å²	56	49.6 Å²	49.6	30%	0.299	26%	0.262	S	S	.	.			trans	-148.3	120.4	-165.4	152.1	-1.5	0	0	0	106.8	E228 T229 Q230	D226-E228 WeakPolarHBondContact OD1-CB 3.17Å; D226-E228 PolarHBondContact OD1-N 3.19Å; D226-T229 VanDerWaalsContact CG-CB 3.45Å; D226-T229 VanDerWaalsContact CG-OG1 3.26Å; D226-T229 WeakPolarHBondContact OD1-CB 3.4Å; D226-T229 PolarHBondContact OD1-N 3.47Å; D226-T229 PolarHBondContact OD1-OG1 3.04Å; D226-T229 VanDerWaalsContact OD2-CB 3.29Å; D226-T229 WeakPolarHBondContact OD2-CB 3.42Å; D226-T229 PolarHBondContact OD2-OG1 3.11Å; D226-Q230 PolarHBondContact O-N 3.39Å
227	R	95.6	Very high	94.4	Very high	24 Å²	24	49.6 Å²	49.6	9%	0.091	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-26.4	-173	-161.2	-161.1	57.1	31.3	3.8	112.2	E171 T229 D231 I259 D261 A296 D297	E171-R227 WeakPolarHBondContact OE2-CB 3.32Å; E171-R227 PolarHBondContact OE2-N 2.81Å; R227-T229 VanDerWaalsContact C-N 3.27Å; R227-D231 HydrophobicContact CG-CB 3.89Å; R227-D231 PolarHBondContact O-N 2.98Å; R227-I259 HydrophobicContact CB-CB 4.36Å; R227-I259 HydrophobicContact CB-CG2 3.89Å; R227-I259 HydrophobicContact CG-CB 4.17Å; R227-I259 HydrophobicContact CG-CG2 4.2Å; R227-D261 IonicContact CZ-OD1 2.76Å; R227-D261 IonicContact NE-OD1 2.72Å; R227-D261 PolarHBondContact NE-OD1 2.92Å; R227-D261 IonicContact NH2-OD1 3.17Å; R227-D261 PolarHBondContact NH2-OD1 2.83Å; R227-A296 PolarHBondContact NH2-O 3.28Å; R227-D297 VanDerWaalsContact NH2-C 3.27Å
228	E	94.5	Very high	94.3	Very high	65 Å²	65	49.4 Å²	49.4	30%	0.304	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-38	173.8	-79.4	44.1	-96.2	0	0	110.4	D226 A296	D226-E228 WeakPolarHBondContact OD1-CB 3.17Å; D226-E228 PolarHBondContact OD1-N 3.19Å; E228-A296 HydrophobicContact CG-CB 3.9Å
229	T	94.2	Very high	94.3	Very high	108 Å²	108	49.4 Å²	49.4	66%	0.663	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-46.9	174.9	-67.2	0	0	0	0	112	D226 R227	D226-T229 VanDerWaalsContact CG-CB 3.45Å; D226-T229 VanDerWaalsContact CG-OG1 3.26Å; D226-T229 WeakPolarHBondContact OD1-CB 3.4Å; D226-T229 PolarHBondContact OD1-N 3.47Å; D226-T229 PolarHBondContact OD1-OG1 3.04Å; D226-T229 VanDerWaalsContact OD2-CB 3.29Å; D226-T229 WeakPolarHBondContact OD2-CB 3.42Å; D226-T229 PolarHBondContact OD2-OG1 3.11Å; R227-T229 VanDerWaalsContact C-N 3.27Å
230	Q	94.5	Very high	94.1	Very high	76 Å²	76	48.1 Å²	48.1	36%	0.355	25%	0.254	S	S	.	.			trans	-156.6	103.8	-178.6	-174.4	169.1	-5.5	0	0	113.8	D226 R232 Y233	D226-Q230 PolarHBondContact O-N 3.39Å; Q230-R232 WeakPolarHBondContact CG-O 3.35Å; Q230-R232 PolarHBondContact NE2-O 3.38Å; Q230-R232 PolarHBondContact O-N 3.41Å; Q230-Y233 HydrophobicContact CB-CE2 4.23Å; Q230-Y233 HydrophobicContact CG-CD2 4.43Å; Q230-Y233 HydrophobicContact CG-CE1 4.08Å; Q230-Y233 HydrophobicContact CG-CE2 3.97Å; Q230-Y233 WeakPolarHBondContact O-CE2 3.1Å; Q230-Y233 VanDerWaalsContact OE1-CE1 3.3Å
231	D	94.9	Very high	93.9	Very high	94 Å²	94	48.1 Å²	48.1	50%	0.503	25%	0.254	S	S	.	.	S	Bend	trans	-69.2	-24.6	179.5	72.8	-30.7	0	0	0	115.3	R227 I259	R227-D231 HydrophobicContact CG-CB 3.89Å; R227-D231 PolarHBondContact O-N 2.98Å; D231-I259 PolarHBondContact O-N 2.6Å
232	R	95.9	Very high	93.7	Very high	119 Å²	119	48.4 Å²	48.4	45%	0.449	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	134.9	-172.8	175	177.1	163.9	157.2	-2.7	113	Q230 E234 T256 I257	Q230-R232 WeakPolarHBondContact CG-O 3.35Å; Q230-R232 PolarHBondContact NE2-O 3.38Å; Q230-R232 PolarHBondContact O-N 3.41Å; R232-E234 IonicContact CZ-OE1 3.33Å; R232-E234 IonicContact NE-OE1 2.69Å; R232-E234 PolarHBondContact NE-OE1 3.39Å; R232-E234 IonicContact NH2-OE1 2.68Å; R232-E234 PolarHBondContact NH2-OE1 2.96Å; R232-T256 HydrophobicContact CG-CG2 3.96Å; R232-I257 WeakPolarHBondContact CA-O 3.38Å
233	Y	95.2	Very high	93.3	Very high	17 Å²	17	47.8 Å²	47.8	7%	0.067	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	148.9	172	-65.8	-92.9	0	0	0	111.1	F208 F209 L225 Q230 I257 I259	F208-Y233 HydrophobicContact CB-CD1 4.42Å; F208-Y233 HydrophobicContact CB-CE1 4.38Å; F208-Y233 AromaticContact CD1-CE1 3.79Å; F208-Y233 HydrophobicContact CD1-CE1 3.79Å; F208-Y233 AromaticContact CD2-CD1 3.9Å; F208-Y233 HydrophobicContact CD2-CD1 3.9Å; F208-Y233 AromaticContact CD2-CE1 3.67Å; F208-Y233 HydrophobicContact CD2-CE1 3.67Å; F208-Y233 AromaticContact CE1-CE1 3.78Å; F208-Y233 HydrophobicContact CE1-CE1 3.78Å; F208-Y233 HydrophobicContact CE2-CD1 4.21Å; F208-Y233 AromaticContact CE2-CE1 3.68Å; F208-Y233 HydrophobicContact CE2-CE1 3.68Å; F208-Y233 HydrophobicContact CG-CD1 4.09Å; F208-Y233 AromaticContact CG-CE1 3.7Å; F208-Y233 HydrophobicContact CG-CE1 3.7Å; F208-Y233 AromaticContact CZ-CE1 3.71Å; F208-Y233 HydrophobicContact CZ-CE1 3.71Å; F209-Y233 HydrophobicContact CE2-CD1 4.17Å; F209-Y233 HydrophobicContact CE2-CD2 4.09Å; F209-Y233 AromaticContact CE2-CG 3.71Å; F209-Y233 HydrophobicContact CE2-CG 3.71Å; F209-Y233 HydrophobicContact CZ-CD2 4.14Å; F209-Y233 HydrophobicContact CZ-CG 4.23Å; L225-Y233 HydrophobicContact CD2-CE2 4.09Å; Q230-Y233 HydrophobicContact CB-CE2 4.23Å; Q230-Y233 HydrophobicContact CG-CD2 4.43Å; Q230-Y233 HydrophobicContact CG-CE1 4.08Å; Q230-Y233 HydrophobicContact CG-CE2 3.97Å; Q230-Y233 WeakPolarHBondContact O-CE2 3.1Å; Q230-Y233 VanDerWaalsContact OE1-CE1 3.3Å; Y233-I257 PolarHBondContact N-O 3.27Å; Y233-I257 PolarHBondContact O-N 3.45Å; Y233-I259 HydrophobicContact CD2-CD1 3.87Å; Y233-I259 HydrophobicContact CD2-CG1 3.89Å; Y233-I259 HydrophobicContact CE2-CD1 3.88Å; Y233-I259 HydrophobicContact CE2-CG1 3.7Å
234	E	95.3	Very high	93	Very high	111 Å²	111	47.2 Å²	47.2	52%	0.519	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	128.5	169.4	-59.5	-166	161.3	0	0	108.6	R232 T254 V255	R232-E234 IonicContact CZ-OE1 3.33Å; R232-E234 IonicContact NE-OE1 2.69Å; R232-E234 PolarHBondContact NE-OE1 3.39Å; R232-E234 IonicContact NH2-OE1 2.68Å; R232-E234 PolarHBondContact NH2-OE1 2.96Å; E234-T254 HydrophobicContact CB-CG2 4.28Å; E234-V255 WeakPolarHBondContact CA-O 3.49Å
235	L	95.3	Very high	92.8	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	120.3	-173.2	179.8	79.5	0	0	0	108.1	V202 D204 F209 I218 V237 V255 I257	V202-L235 HydrophobicContact CB-CD1 4.48Å; V202-L235 HydrophobicContact CG1-CD1 3.53Å; V202-L235 HydrophobicContact CG1-CG 4.39Å; V202-L235 HydrophobicContact CG2-CD1 4.07Å; D204-L235 WeakPolarHBondContact O-CD1 3.31Å; F209-L235 HydrophobicContact CB-CD1 3.93Å; F209-L235 HydrophobicContact CB-CD2 4.11Å; F209-L235 HydrophobicContact CD2-CD1 4.41Å; I218-L235 HydrophobicContact CD1-CD2 3.92Å; I218-L235 HydrophobicContact CG1-CD2 4.21Å; I218-L235 HydrophobicContact CG2-CD2 3.73Å; L235-V237 HydrophobicContact CD2-CG2 3.79Å; L235-V237 HydrophobicContact CG-CG2 4.02Å; L235-V255 HydrophobicContact CB-CB 4.31Å; L235-V255 PolarHBondContact N-O 2.79Å; L235-V255 PolarHBondContact O-N 2.73Å; L235-I257 HydrophobicContact CB-CD1 4.4Å; L235-I257 HydrophobicContact CD2-CD1 4.05Å
236	V	95.6	Very high	92.1	Very high	37 Å²	37	57 Å²	57	22%	0.224	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	110.8	176.6	-177	0	0	0	0	108.5	L203 D204	L203-V236 HydrophobicContact CB-CB 4.27Å; L203-V236 HydrophobicContact CB-CG1 4.09Å; L203-V236 HydrophobicContact CD1-CG1 4.18Å; L203-V236 PolarHBondContact N-O 3.23Å; D204-V236 HydrophobicContact CB-CB 4.16Å; D204-V236 HydrophobicContact CB-CG2 4.12Å; D204-V236 PolarHBondContact O-N 2.87Å
237	V	96.1	Very high	91.3	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	133.2	177.3	-172.6	0	0	0	0	109.6	F160 V182 Y200 V211 I218 L235 S252 T253 V255	F160-V237 HydrophobicContact CZ-CG1 4.26Å; V182-V237 HydrophobicContact CG2-CG1 4.11Å; Y200-V237 HydrophobicContact CD1-CG1 4.46Å; V211-V237 HydrophobicContact CG1-CG1 4.49Å; I218-V237 HydrophobicContact CD1-CG2 4.14Å; L235-V237 HydrophobicContact CD2-CG2 3.79Å; L235-V237 HydrophobicContact CG-CG2 4.02Å; V237-S252 CarbonylContact O-C 3.57Å; V237-S252 VanDerWaalsContact O-CA 3.31Å; V237-S252 WeakPolarHBondContact O-CA 3.26Å; V237-T253 HydrophobicContact CB-CG2 4.5Å; V237-T253 PolarHBondContact N-O 3.41Å; V237-T253 PolarHBondContact O-N 3.18Å; V237-V255 HydrophobicContact CG2-CG2 3.84Å
238	K	95.2	Very high	90.9	Very high	51 Å²	51	57.5 Å²	57.5	22%	0.222	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	134.7	175.2	-179.7	-174	-172.6	-166.7	0	110.1	Y200 S201 L203 T240 S250	Y200-K238 WeakPolarHBondContact CA-O 3.23Å; S201-K238 PolarHBondContact N-O 3.22Å; S201-K238 PolarHBondContact O-N 2.78Å; L203-K238 HydrophobicContact CD1-CB 3.74Å; L203-K238 HydrophobicContact CD1-CD 4.16Å; L203-K238 HydrophobicContact CD1-CG 4.27Å; L203-K238 HydrophobicContact CD2-CB 4.47Å; L203-K238 HydrophobicContact CD2-CD 4.13Å; L203-K238 HydrophobicContact CG-CB 3.75Å; L203-K238 HydrophobicContact CG-CD 4.26Å; K238-T240 WeakPolarHBondContact CE-OG1 3.49Å; K238-T240 PolarHBondContact NZ-OG1 3.28Å; K238-S250 WeakPolarHBondContact CE-OG 3.41Å; K238-S250 PolarHBondContact NZ-OG 3Å
239	A	95.8	Very high	90.8	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	134.1	162.5	0	0	0	0	0	107.9	P158 F160 A184 V198 Y200 S250 G251	P158-A239 HydrophobicContact CB-CB 3.64Å; P158-A239 HydrophobicContact CG-CB 4.41Å; F160-A239 HydrophobicContact CE1-CB 4.46Å; F160-A239 HydrophobicContact CE2-CB 3.68Å; F160-A239 HydrophobicContact CZ-CB 3.63Å; A184-A239 HydrophobicContact CB-CB 3.63Å; V198-A239 HydrophobicContact CG1-CB 3.71Å; Y200-A239 HydrophobicContact CD1-CB 4.39Å; Y200-A239 HydrophobicContact CE1-CB 4.28Å; A239-S250 WeakPolarHBondContact O-CA 3.49Å; A239-S250 WeakPolarHBondContact O-CB 3.24Å; A239-G251 PolarHBondContact N-O 3.42Å
240	T	94.3	Very high	90.8	Very high	17 Å²	17	54.2 Å²	54.2	10%	0.104	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	133.8	173.9	-46.2	0	0	0	0	108.4	V198 V199 K238 L249	V198-T240 CarbonylContact C-O 3.51Å; V198-T240 WeakPolarHBondContact CA-O 3.23Å; V199-T240 WeakPolarHBondContact CG2-O 3.29Å; V199-T240 PolarHBondContact N-O 3.37Å; V199-T240 PolarHBondContact O-N 2.88Å; K238-T240 WeakPolarHBondContact CE-OG1 3.49Å; K238-T240 PolarHBondContact NZ-OG1 3.28Å; T240-L249 WeakPolarHBondContact CG2-O 3.46Å
241	D	92.3	Very high	90.7	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.288	C	S	.	.	S	Bend	trans	-71.4	-162.5	175.3	63.7	17.6	0	0	0	111.9	N154 P158 D186 S195 A243 G244 G248 L249	N154-D241 PolarHBondContact ND2-OD2 2.72Å; P158-D241 HydrophobicContact CG-CB 3.88Å; D186-D241 WeakPolarHBondContact OD2-CB 3.47Å; S195-D241 WeakPolarHBondContact O-CB 3.17Å; D241-A243 PolarHBondContact O-N 3.22Å; D241-G244 PolarHBondContact O-N 2.77Å; D241-G248 WeakPolarHBondContact OD1-CA 3.44Å; D241-L249 PolarHBondContact N-O 3.16Å; D241-L249 PolarHBondContact OD1-N 3.42Å; D241-L249 VanDerWaalsContact OD2-CA 3.26Å; D241-L249 WeakPolarHBondContact OD2-CA 3.37Å; D241-L249 WeakPolarHBondContact OD2-CB 3Å; D241-L249 PolarHBondContact OD2-N 2.97Å
242	M	88	Confident	90.7	Very high	46 Å²	46	50.4 Å²	50.4	23%	0.227	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	20.6	173.4	-63.2	-155.1	87.1	0	0	115.5	N154 S194 S195 G244 Q245	N154-M242 WeakPolarHBondContact OD1-CG 3.3Å; S194-M242 VanDerWaalsContact O-CA 3.27Å; S194-M242 WeakPolarHBondContact O-CA 3.44Å; S194-M242 PolarHBondContact O-N 3.07Å; S195-M242 PolarHBondContact O-N 3.08Å; M242-G244 PolarHBondContact O-N 3.15Å; M242-Q245 HydrophobicContact CB-CB 4.32Å; M242-Q245 WeakPolarHBondContact O-CG 3.13Å; M242-Q245 PolarHBondContact O-N 3.38Å; M242-Q245 PolarHBondContact O-NE2 3.35Å
243	A	84.3	Confident	90.6	Very high	17 Å²	17	45.9 Å²	45.9	14%	0.14	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	23.3	-164.8	0	0	0	0	0	115.6	R197 R213 D241	R197-A243 HydrophobicContact CG-CB 4.24Å; R197-A243 VanDerWaalsContact O-CA 3.26Å; R197-A243 WeakPolarHBondContact O-CA 3.45Å; R197-A243 PolarHBondContact O-N 2.92Å; R213-A243 PolarHBondContact NH2-O 2.78Å; D241-A243 PolarHBondContact O-N 3.22Å
244	G	81.3	Confident	90.6	Very high	36 Å²	36	48.6 Å²	48.6	37%	0.371	30%	0.295	S	S	.	.	S	Bend	trans	80.2	36.2	-180	0	0	0	0	0	114.1	D241 M242	D241-G244 PolarHBondContact O-N 2.77Å; M242-G244 PolarHBondContact O-N 3.15Å
245	Q	84.2	Confident	90.7	Very high	122 Å²	122	43.3 Å²	43.3	57%	0.57	27%	0.27	S	S	*	.			trans	-90	167.4	177.6	-70.6	177.1	70.3	0	0	112.4	M242 G247 G248	M242-Q245 HydrophobicContact CB-CB 4.32Å; M242-Q245 WeakPolarHBondContact O-CG 3.13Å; M242-Q245 PolarHBondContact O-N 3.38Å; M242-Q245 PolarHBondContact O-NE2 3.35Å; Q245-G247 PolarHBondContact O-N 3.03Å; Q245-G248 PolarHBondContact O-N 3.33Å
246	M	78.4	Confident	90.7	Very high	201 Å²	201	44.2 Å²	44.2	99%	0.99	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	121.4	172.1	-76.3	-173.1	174.7	0	0	110.3
247	G	77.7	Confident	90.8	Very high	67 Å²	67	42.4 Å²	42.4	69%	0.691	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	126.5	-25.2	-176.6	0	0	0	0	0	112.6	Q245	Q245-G247 PolarHBondContact O-N 3.03Å
248	G	86.6	Confident	90.8	Very high	23 Å²	23	45 Å²	45	24%	0.237	28%	0.28	C	S	.	.			trans	-71	147.4	-173	0	0	0	0	0	117.1	D241 Q245	D241-G248 WeakPolarHBondContact OD1-CA 3.44Å; Q245-G248 PolarHBondContact O-N 3.33Å
249	L	91.8	Very high	90.9	Very high	64 Å²	64	42.8 Å²	42.8	34%	0.335	27%	0.271	S	S	.	.			trans	-88.4	169.9	173.2	-50.7	176.3	0	0	0	110.9	D155 S156 E157 T240 D241	D155-L249 WeakPolarHBondContact O-CD1 3.27Å; S156-L249 WeakPolarHBondContact O-CD1 3.46Å; E157-L249 HydrophobicContact CB-CB 3.84Å; T240-L249 WeakPolarHBondContact CG2-O 3.46Å; D241-L249 PolarHBondContact N-O 3.16Å; D241-L249 PolarHBondContact OD1-N 3.42Å; D241-L249 VanDerWaalsContact OD2-CA 3.26Å; D241-L249 WeakPolarHBondContact OD2-CA 3.37Å; D241-L249 WeakPolarHBondContact OD2-CB 3Å; D241-L249 PolarHBondContact OD2-N 2.97Å
250	S	93.7	Very high	90.8	Very high	39 Å²	39	45.6 Å²	45.6	27%	0.273	29%	0.288	S	S	.	.			trans	-170.9	117.3	-170.6	55.5	0	0	0	0	116.9	K238 A239	K238-S250 WeakPolarHBondContact CE-OG 3.41Å; K238-S250 PolarHBondContact NZ-OG 3Å; A239-S250 WeakPolarHBondContact O-CA 3.49Å; A239-S250 WeakPolarHBondContact O-CB 3.24Å
251	G	93.3	Very high	90.7	Very high	12 Å²	12	46.5 Å²	46.5	12%	0.124	29%	0.292	C	S	.	.			trans	-77.1	159.4	160.8	0	0	0	0	0	113.8	P158 A239	P158-G251 WeakPolarHBondContact O-CA 3.25Å; P158-G251 PolarHBondContact O-N 3.16Å; A239-G251 PolarHBondContact N-O 3.42Å
252	S	94.1	Very high	90.6	Very high	78 Å²	78	47 Å²	47	55%	0.545	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	156.4	171.5	63	0	0	0	0	111.5	V237	V237-S252 CarbonylContact O-C 3.57Å; V237-S252 VanDerWaalsContact O-CA 3.31Å; V237-S252 WeakPolarHBondContact O-CA 3.26Å
253	T	94.8	Very high	90.6	Very high	25 Å²	25	45 Å²	45	15%	0.153	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	149.3	178.7	-160.1	0	0	0	0	110.9	F160 Y165 V237 V255	F160-T253 HydrophobicContact CB-CG2 4.39Å; F160-T253 HydrophobicContact CD1-CG2 3.65Å; F160-T253 HydrophobicContact CD2-CG2 3.84Å; F160-T253 HydrophobicContact CE1-CG2 3.73Å; F160-T253 HydrophobicContact CE2-CG2 3.92Å; F160-T253 HydrophobicContact CG-CG2 3.69Å; F160-T253 HydrophobicContact CZ-CG2 3.86Å; Y165-T253 HydrophobicContact CD2-CG2 3.73Å; Y165-T253 HydrophobicContact CE2-CG2 3.76Å; V237-T253 HydrophobicContact CB-CG2 4.5Å; V237-T253 PolarHBondContact N-O 3.41Å; V237-T253 PolarHBondContact O-N 3.18Å; T253-V255 HydrophobicContact CG2-CG2 4.35Å
254	T	95.4	Very high	90.6	Very high	74 Å²	74	46.8 Å²	46.8	45%	0.454	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	124.2	173.5	-53.4	0	0	0	0	109.4	E234	E234-T254 HydrophobicContact CB-CG2 4.28Å
255	V	96.1	Very high	90.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	128.5	172.9	-177.1	0	0	0	0	108.2	Y165 M180 V182 I218 E234 L235 V237 T253 I257	Y165-V255 HydrophobicContact CG-CG2 4.35Å; M180-V255 HydrophobicContact SD-CG1 3.45Å; M180-V255 WeakPolarHBondContact SD-CG1 3.47Å; V182-V255 HydrophobicContact CG1-CG2 3.8Å; I218-V255 HydrophobicContact CD1-CB 4.42Å; I218-V255 HydrophobicContact CD1-CG1 4.03Å; I218-V255 HydrophobicContact CD1-CG2 3.99Å; E234-V255 WeakPolarHBondContact CA-O 3.49Å; L235-V255 HydrophobicContact CB-CB 4.31Å; L235-V255 PolarHBondContact N-O 2.79Å; L235-V255 PolarHBondContact O-N 2.73Å; V237-V255 HydrophobicContact CG2-CG2 3.84Å; T253-V255 HydrophobicContact CG2-CG2 4.35Å; V255-I257 HydrophobicContact CG1-CG1 4.11Å
256	T	96.6	Very high	91.1	Very high	19 Å²	19	42 Å²	42	12%	0.117	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	128.5	168.3	-60.4	0	0	0	0	108.9	Y165 I166 G167 R232 V258	Y165-T256 PolarHBondContact O-N 2.93Å; I166-T256 WeakPolarHBondContact CA-O 3.43Å; G167-T256 PolarHBondContact N-O 2.61Å; R232-T256 HydrophobicContact CG-CG2 3.96Å; T256-V258 HydrophobicContact CG2-CG2 4.32Å
257	I	96.4	Very high	91.7	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	121.9	173.4	-59.2	173.3	0	0	0	108	G167 V169 V179 F209 I218 R232 Y233 L235 V255 I259	G167-I257 WeakPolarHBondContact O-CA 3.37Å; V169-I257 HydrophobicContact CG1-CG2 4.05Å; V179-I257 HydrophobicContact CG1-CD1 4.28Å; V179-I257 HydrophobicContact CG1-CG1 4.27Å; V179-I257 HydrophobicContact CG1-CG2 3.88Å; F209-I257 HydrophobicContact CB-CD1 4.42Å; F209-I257 HydrophobicContact CD1-CD1 3.66Å; F209-I257 HydrophobicContact CD2-CD1 3.75Å; F209-I257 HydrophobicContact CE1-CD1 3.78Å; F209-I257 HydrophobicContact CE1-CG2 3.92Å; F209-I257 HydrophobicContact CE2-CB 4.49Å; F209-I257 HydrophobicContact CE2-CD1 3.89Å; F209-I257 HydrophobicContact CG-CD1 3.65Å; F209-I257 HydrophobicContact CZ-CB 4.21Å; F209-I257 HydrophobicContact CZ-CD1 3.91Å; F209-I257 HydrophobicContact CZ-CG2 3.76Å; I218-I257 HydrophobicContact CG2-CD1 4.05Å; R232-I257 WeakPolarHBondContact CA-O 3.38Å; Y233-I257 PolarHBondContact N-O 3.27Å; Y233-I257 PolarHBondContact O-N 3.45Å; L235-I257 HydrophobicContact CB-CD1 4.4Å; L235-I257 HydrophobicContact CD2-CD1 4.05Å; V255-I257 HydrophobicContact CG1-CG1 4.11Å; I257-I259 HydrophobicContact CG2-CD1 4.48Å
258	V	96.9	Very high	92.4	Very high	55 Å²	55	34.7 Å²	34.7	33%	0.333	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	127.7	176.4	-177.3	0	0	0	0	109	I166 G167 S168 V169 T256	I166-V258 HydrophobicContact CG2-CG2 4.42Å; G167-V258 PolarHBondContact O-N 2.9Å; S168-V258 WeakPolarHBondContact CA-O 3.39Å; S168-V258 WeakPolarHBondContact CB-O 3.48Å; V169-V258 PolarHBondContact N-O 2.97Å; V169-V258 VanDerWaalsContact N-O 3.15Å; T256-V258 HydrophobicContact CG2-CG2 4.32Å
259	I	96.4	Very high	92.9	Very high	4 Å²	4	34 Å²	34	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	127.2	173.6	-53	-52.4	0	0	0	108.5	V169 E171 F209 L225 R227 D231 Y233 I257	V169-I259 HydrophobicContact CG1-CD1 3.79Å; V169-I259 CarbonylContact O-C 3.59Å; V169-I259 WeakPolarHBondContact O-CA 3.49Å; E171-I259 HydrophobicContact CB-CG2 3.62Å; F209-I259 HydrophobicContact CZ-CD1 4.43Å; L225-I259 HydrophobicContact CB-CD1 4.41Å; L225-I259 HydrophobicContact CD1-CD1 4.07Å; R227-I259 HydrophobicContact CB-CB 4.36Å; R227-I259 HydrophobicContact CB-CG2 3.89Å; R227-I259 HydrophobicContact CG-CB 4.17Å; R227-I259 HydrophobicContact CG-CG2 4.2Å; D231-I259 PolarHBondContact O-N 2.6Å; Y233-I259 HydrophobicContact CD2-CD1 3.87Å; Y233-I259 HydrophobicContact CD2-CG1 3.89Å; Y233-I259 HydrophobicContact CE2-CD1 3.88Å; Y233-I259 HydrophobicContact CE2-CG1 3.7Å; I257-I259 HydrophobicContact CG2-CD1 4.48Å
260	T	94.6	Very high	93	Very high	59 Å²	59	35.1 Å²	35.1	36%	0.362	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	135.8	178.8	60.3	0	0	0	0	111.4	V169 A170 E171	V169-T260 PolarHBondContact O-N 3.1Å; V169-T260 PolarHBondContact O-OG1 2.99Å; A170-T260 WeakPolarHBondContact CA-O 3.21Å; A170-T260 VanDerWaalsContact CA-OG1 3.28Å; A170-T260 WeakPolarHBondContact CA-OG1 3.01Å; A170-T260 PolarHBondContact N-OG1 3.1Å; E171-T260 PolarHBondContact N-O 2.8Å
261	D	92.1	Very high	93	Very high	36 Å²	36	38.3 Å²	38.3	19%	0.193	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-52.3	136.8	-174.5	-154.1	78.2	0	0	0	115	E171 R227 M298 N301	E171-D261 WeakPolarHBondContact OE1-CA 3.36Å; R227-D261 IonicContact CZ-OD1 2.76Å; R227-D261 IonicContact NE-OD1 2.72Å; R227-D261 PolarHBondContact NE-OD1 2.92Å; R227-D261 IonicContact NH2-OD1 3.17Å; R227-D261 PolarHBondContact NH2-OD1 2.83Å; D261-M298 HydrophobicContact CB-CB 4.2Å; D261-M298 WeakPolarHBondContact OD1-CB 3.48Å; D261-M298 PolarHBondContact OD1-N 2.98Å; D261-M298 PolarHBondContact OD2-N 2.62Å; D261-M298 VanDerWaalsContact OD2-O 3.13Å; D261-N301 WeakPolarHBondContact OD2-CB 3.33Å; D261-N301 PolarHBondContact OD2-ND2 3.36Å
262	V	89	Confident	93	Very high	9 Å²	9	43.3 Å²	43.3	6%	0.055	23%	0.234	C	C	.	.			trans	-127	139.5	169.4	167.5	0	0	0	0	109.2	A170 E171 D264 F357	A170-V262 HydrophobicContact CB-CG2 4.07Å; E171-V262 HydrophobicContact CG-CB 3.66Å; E171-V262 HydrophobicContact CG-CG2 3.84Å; E171-V262 PolarHBondContact OE1-N 3.16Å; V262-D264 HydrophobicContact CG1-CB 4.49Å; V262-D264 PolarHBondContact O-N 3.14Å; V262-F357 HydrophobicContact CG1-CE2 3.74Å; V262-F357 HydrophobicContact CG1-CZ 4.14Å
263	N	88.1	Confident	93.2	Very high	6 Å²	6	44.3 Å²	44.3	3%	0.032	23%	0.231	C	C	.	.	S	Bend	trans	-71.6	89.3	176.5	-153.3	-66.8	0	0	0	111	D297 N301 F357 F363	N263-D297 VanDerWaalsContact CA-OD2 3.3Å; N263-D297 WeakPolarHBondContact CA-OD2 3.36Å; N263-N301 HydrophobicContact CB-CB 4.11Å; N263-N301 WeakPolarHBondContact CB-OD1 3.47Å; N263-N301 PolarHBondContact N-ND2 3.04Å; N263-N301 WeakPolarHBondContact ND2-CA 3.3Å; N263-N301 WeakPolarHBondContact ND2-CB 3.33Å; N263-N301 PolarHBondContact ND2-O 2.87Å; N263-N301 PolarHBondContact ND2-OD1 3.24Å; N263-N301 VanDerWaalsContact ND2-OD1 3.13Å; N263-F357 VanDerWaalsContact O-CD2 3.27Å; N263-F357 WeakPolarHBondContact O-CD2 3.29Å; N263-F357 WeakPolarHBondContact O-CE2 3.37Å; N263-F363 HydrophobicContact CB-CE1 4.4Å; N263-F363 WeakPolarHBondContact O-CE1 3.26Å; N263-F363 VanDerWaalsContact OD1-CD1 3.27Å; N263-F363 WeakPolarHBondContact OD1-CD1 3.44Å; N263-F363 WeakPolarHBondContact OD1-CE1 3.23Å
264	D	85.6	Confident	93.3	Very high	54 Å²	54	44.3 Å²	44.3	29%	0.289	23%	0.229	S	C	.	.			trans	-125.7	-17.3	178.8	110.1	-48.9	0	0	0	113.5	L172 V262 P266 F357	L172-D264 HydrophobicContact CD1-CB 4.04Å; V262-D264 HydrophobicContact CG1-CB 4.49Å; V262-D264 PolarHBondContact O-N 3.14Å; D264-P266 WeakPolarHBondContact O-CD 3.38Å; D264-F357 HydrophobicContact CB-CE2 4.16Å; D264-F357 HydrophobicContact CB-CZ 4.19Å
265	N	86.8	Confident	93.4	Very high	43 Å²	43	46 Å²	46	23%	0.23	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-91.9	124.5	174.1	-62.2	-84.1	0	0	0	112.6	A296 D297	N265-A296 HydrophobicContact CB-CB 3.97Å; N265-D297 WeakPolarHBondContact CB-OD1 3.42Å; N265-D297 PolarHBondContact N-OD1 3.22Å; N265-D297 PolarHBondContact ND2-OD1 3.16Å
266	P	88.1	Confident	93.4	Very high	14 Å²	14	48.5 Å²	48.5	9%	0.091	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-66	155.6	164.9	12.1	-23.2	0	0	0	113.3	D264 R268 S362	D264-P266 WeakPolarHBondContact O-CD 3.38Å; P266-R268 PolarHBondContact O-N 2.88Å; P266-S362 WeakPolarHBondContact CA-O 3.38Å; P266-S362 WeakPolarHBondContact CB-O 3.03Å; P266-S362 VanDerWaalsContact CD-O 3.27Å; P266-S362 WeakPolarHBondContact CD-O 3.47Å; P266-S362 WeakPolarHBondContact CG-O 3.38Å
267	P	92.3	Very high	93.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-76	125.8	175.2	28.4	-16.1	0	0	0	107.4	A293 D295 M304 A348 N350 D365	P267-A293 HydrophobicContact CB-CB 4.14Å; P267-D295 WeakPolarHBondContact CA-OD2 3.45Å; P267-M304 HydrophobicContact CB-CE 3.91Å; P267-M304 HydrophobicContact CB-SD 3.97Å; P267-A348 HydrophobicContact CB-CB 4.24Å; P267-A348 HydrophobicContact CG-CB 4.08Å; P267-N350 WeakPolarHBondContact CD-OD1 3.23Å; P267-N350 WeakPolarHBondContact CG-OD1 3.35Å; P267-D365 WeakPolarHBondContact O-CB 3.28Å
268	R	92.7	Very high	93.4	Very high	115 Å²	115	51.9 Å²	51.9	43%	0.434	27%	0.266	S	S	.	.	B	Isolated β-bridge	trans	-111.4	129	-172.6	-64.7	-49	-163.7	-171.6	-1.3	113.1	P266 P270 A293 T294	P266-R268 PolarHBondContact O-N 2.88Å; R268-P270 WeakPolarHBondContact O-CD 3.07Å; R268-A293 CarbonylContact O-C 3.51Å; R268-A293 VanDerWaalsContact O-CA 3.31Å; R268-A293 WeakPolarHBondContact O-CA 3.43Å; R268-T294 PolarHBondContact N-O 3.33Å; R268-T294 PolarHBondContact O-N 3.13Å; R268-T294 PolarHBondContact O-OG1 2.96Å
269	F	95.5	Very high	93.4	Very high	7 Å²	7	51 Å²	51	3%	0.031	26%	0.263	C	S	.	.			trans	-77.3	121.7	168.1	-73.9	-73.2	0	0	0	110.5	Q271 Y274 V291 I292 A293 Y306 V346 A348 D365 T367	F269-Q271 PolarHBondContact O-N 3.09Å; F269-Q271 VanDerWaalsContact O-N 3.12Å; F269-Y274 HydrophobicContact CD1-CE2 4.26Å; F269-V291 HydrophobicContact CE1-CB 4.38Å; F269-V291 HydrophobicContact CE1-CG2 3.93Å; F269-I292 VanDerWaalsContact CD1-O 3.31Å; F269-I292 WeakPolarHBondContact CD1-O 3.5Å; F269-A293 HydrophobicContact CD1-CB 3.97Å; F269-A293 HydrophobicContact CD2-CB 4.37Å; F269-A293 HydrophobicContact CE1-CB 3.9Å; F269-A293 HydrophobicContact CE2-CB 4.32Å; F269-A293 HydrophobicContact CG-CB 4.21Å; F269-A293 HydrophobicContact CZ-CB 4.09Å; F269-Y306 HydrophobicContact CE1-CE1 4Å; F269-Y306 HydrophobicContact CZ-CD1 4.03Å; F269-Y306 AromaticContact CZ-CE1 3.88Å; F269-Y306 HydrophobicContact CZ-CE1 3.88Å; F269-V346 HydrophobicContact CZ-CG1 4.08Å; F269-A348 HydrophobicContact CE2-CB 3.72Å; F269-A348 HydrophobicContact CZ-CB 3.78Å; F269-D365 HydrophobicContact CD2-CB 4.23Å; F269-D365 WeakPolarHBondContact CE2-O 3.24Å; F269-D365 PolarHBondContact N-OD2 2.85Å; F269-T367 HydrophobicContact CB-CG2 4.38Å; F269-T367 HydrophobicContact CD1-CG2 3.59Å; F269-T367 HydrophobicContact CD2-CG2 3.83Å; F269-T367 HydrophobicContact CE1-CG2 3.69Å; F269-T367 HydrophobicContact CE2-CG2 3.9Å; F269-T367 HydrophobicContact CG-CG2 3.67Å; F269-T367 HydrophobicContact CZ-CG2 3.84Å
270	P	94.6	Very high	93.3	Very high	88 Å²	88	51.7 Å²	51.7	57%	0.571	27%	0.266	S	S	*	.	S	Bend	trans	-62.2	-18.8	177.3	-25.3	35.9	0	0	0	114.3	R268 I292	R268-P270 WeakPolarHBondContact O-CD 3.07Å; P270-I292 WeakPolarHBondContact CD-O 3.41Å
271	Q	94.4	Very high	93.2	Very high	106 Å²	106	52 Å²	52	50%	0.495	28%	0.281	S	S	.	.			trans	-129.3	134.1	174.3	-53.2	-178.6	9	0	0	109.9	F269 M273 Y274 T367	F269-Q271 PolarHBondContact O-N 3.09Å; F269-Q271 VanDerWaalsContact O-N 3.12Å; Q271-M273 VanDerWaalsContact C-N 3.32Å; Q271-Y274 HydrophobicContact CB-CD2 4.31Å; Q271-Y274 HydrophobicContact CB-CE1 4.09Å; Q271-Y274 HydrophobicContact CB-CE2 3.86Å; Q271-Y274 HydrophobicContact CG-CE1 4.17Å; Q271-Y274 VanDerWaalsContact O-CE2 3.27Å; Q271-Y274 WeakPolarHBondContact O-CE2 3.15Å; Q271-T367 PolarHBondContact O-OG1 3.23Å
272	K	93.4	Very high	93.4	Very high	117 Å²	117	51.1 Å²	51.1	51%	0.509	28%	0.279	S	S	.	.	S	Bend	trans	-81.5	-9.8	175.9	-62.6	-55.2	-172.9	-174.3	0	114.2	D365 T367 I368	K272-D365 IonicContact NZ-OD1 2.69Å; K272-D365 PolarHBondContact NZ-OD1 3.08Å; K272-D365 IonicContact NZ-OD2 3.13Å; K272-D365 PolarHBondContact NZ-OD2 3.25Å; K272-T367 VanDerWaalsContact C-OG1 3.22Å; K272-T367 PolarHBondContact O-OG1 3.36Å; K272-I368 PolarHBondContact O-N 3.03Å; K272-I368 VanDerWaalsContact O-N 3.13Å
273	M	96.4	Very high	93.7	Very high	99 Å²	99	54 Å²	54	49%	0.488	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	128.5	167.8	-174.6	-172.2	72.4	0	0	109.5	Q271 I368 K370	Q271-M273 VanDerWaalsContact C-N 3.32Å; M273-I368 CarbonylContact C-O 3.35Å; M273-I368 WeakPolarHBondContact CA-O 3.41Å; M273-I368 HydrophobicContact CB-CB 4.49Å; M273-I368 HydrophobicContact CG-CB 4.27Å; M273-I368 HydrophobicContact CG-CG2 4.43Å; M273-I368 WeakPolarHBondContact CG-O 2.98Å; M273-K370 HydrophobicContact CG-CB 4.34Å; M273-K370 HydrophobicContact SD-CB 4.29Å; M273-K370 HydrophobicContact SD-CD 4.16Å
274	Y	97.1	Very high	94.1	Very high	26 Å²	26	57.7 Å²	57.7	10%	0.102	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	150.7	166.9	-64.9	-97.9	0	0	0	108.7	F269 Q271 F276 V291 T367 I368 K370	F269-Y274 HydrophobicContact CD1-CE2 4.26Å; Q271-Y274 HydrophobicContact CB-CD2 4.31Å; Q271-Y274 HydrophobicContact CB-CE1 4.09Å; Q271-Y274 HydrophobicContact CB-CE2 3.86Å; Q271-Y274 HydrophobicContact CG-CE1 4.17Å; Q271-Y274 VanDerWaalsContact O-CE2 3.27Å; Q271-Y274 WeakPolarHBondContact O-CE2 3.15Å; Y274-F276 HydrophobicContact CD1-CZ 4.49Å; Y274-V291 HydrophobicContact CD1-CB 4.45Å; Y274-V291 HydrophobicContact CD1-CG1 3.71Å; Y274-V291 HydrophobicContact CD2-CB 4.05Å; Y274-V291 HydrophobicContact CD2-CG1 3.49Å; Y274-V291 VanDerWaalsContact CD2-CG1 3.49Å; Y274-V291 HydrophobicContact CE1-CB 4.34Å; Y274-V291 HydrophobicContact CE1-CG1 4.08Å; Y274-V291 HydrophobicContact CE2-CB 3.94Å; Y274-V291 HydrophobicContact CE2-CG1 3.9Å; Y274-V291 HydrophobicContact CG-CB 4.32Å; Y274-V291 HydrophobicContact CG-CG1 3.4Å; Y274-T367 HydrophobicContact CD2-CG2 3.89Å; Y274-T367 WeakPolarHBondContact CD2-OG1 3.46Å; Y274-T367 HydrophobicContact CE2-CG2 3.87Å; Y274-T367 WeakPolarHBondContact CE2-OG1 3.4Å; Y274-I368 PolarHBondContact N-O 3.08Å; Y274-K370 PolarHBondContact O-N 3.24Å
275	Q	97.4	Very high	94.5	Very high	108 Å²	108	56.7 Å²	56.7	51%	0.505	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	127.5	174.4	-173.7	174.4	-31.1	0	0	111.1	K370	Q275-K370 WeakPolarHBondContact CA-O 3.16Å; Q275-K370 HydrophobicContact CB-CB 4.5Å; Q275-K370 HydrophobicContact CG-CB 4.43Å; Q275-K370 HydrophobicContact CG-CD 4.31Å; Q275-K370 HydrophobicContact CG-CG 4.45Å
276	F	97.4	Very high	95	Very high	53 Å²	53	56.9 Å²	56.9	23%	0.232	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	163.2	175.3	-56.5	-72.1	0	0	0	110.2	Y274 V288 R290 V291 V369 K370 T372	Y274-F276 HydrophobicContact CD1-CZ 4.49Å; F276-V288 HydrophobicContact CB-CG1 4.06Å; F276-V288 WeakPolarHBondContact CB-O 3.3Å; F276-R290 WeakPolarHBondContact CZ-O 3.12Å; F276-V291 HydrophobicContact CE2-CG1 3.89Å; F276-V291 HydrophobicContact CZ-CG1 4.13Å; F276-V369 HydrophobicContact CD2-CG1 3.64Å; F276-V369 HydrophobicContact CE2-CG1 3.86Å; F276-K370 PolarHBondContact N-O 3.21Å; F276-T372 PolarHBondContact O-N 3.23Å; F276-T372 PolarHBondContact O-OG1 3.45Å
277	S	96.4	Very high	95.4	Very high	77 Å²	77	60.3 Å²	60.3	54%	0.538	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	142	174.1	-150.3	0	0	0	0	110.3	T372	S277-T372 VanDerWaalsContact CA-O 3.23Å; S277-T372 WeakPolarHBondContact CA-O 3.25Å; S277-T372 WeakPolarHBondContact CB-OG1 3.45Å; S277-T372 PolarHBondContact OG-O 3.29Å; S277-T372 PolarHBondContact OG-OG1 3.02Å
278	V	96.8	Very high	95.6	Very high	14 Å²	14	61 Å²	61	9%	0.085	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	146.6	178	72.6	0	0	0	0	110.1	A282 V288 I330 L334 V371 T372 V373 S374	V278-A282 HydrophobicContact CG2-CB 3.71Å; V278-V288 HydrophobicContact CB-CG1 4.35Å; V278-V288 HydrophobicContact CB-CG2 4.47Å; V278-V288 HydrophobicContact CG1-CG1 4.37Å; V278-V288 HydrophobicContact CG1-CG2 4.35Å; V278-V288 HydrophobicContact CG2-CG2 4.42Å; V278-I330 HydrophobicContact CG2-CD1 4.01Å; V278-L334 HydrophobicContact CG1-CD1 3.74Å; V278-V371 HydrophobicContact CG1-CG1 3.69Å; V278-T372 PolarHBondContact N-O 3.17Å; V278-V373 CarbonylContact O-C 3.42Å; V278-V373 VanDerWaalsContact O-CA 3.3Å; V278-V373 WeakPolarHBondContact O-CA 3.41Å; V278-S374 PolarHBondContact O-N 3.43Å; V278-S374 PolarHBondContact O-OG 2.65Å
279	S	96.1	Very high	95.7	Very high	37 Å²	37	56 Å²	56	26%	0.259	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	148.5	171.8	169.3	0	0	0	0	110.5	G281 A282 S374 V376	S279-G281 PolarHBondContact OG-N 3.25Å; S279-A282 WeakPolarHBondContact O-CB 3.33Å; S279-A282 PolarHBondContact O-N 3.42Å; S279-S374 WeakPolarHBondContact CA-OG 3.33Å; S279-V376 WeakPolarHBondContact OG-CG2 3.44Å
280	E	95.4	Very high	95.7	Very high	17 Å²	17	60.4 Å²	60.4	8%	0.079	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-36.3	173	64.1	-149.2	110.4	0	0	113.3	A282 L334 F336 V373 D375 V376	E280-A282 PolarHBondContact O-N 3.25Å; E280-L334 HydrophobicContact CB-CB 4.42Å; E280-F336 VanDerWaalsContact CD-CB 3.48Å; E280-F336 VanDerWaalsContact OE1-CB 3.29Å; E280-F336 WeakPolarHBondContact OE1-CB 3.3Å; E280-F336 WeakPolarHBondContact OE2-CB 3.34Å; E280-F336 PolarHBondContact OE2-N 3.49Å; E280-V373 HydrophobicContact CB-CG1 3.8Å; E280-D375 WeakPolarHBondContact OE1-CA 3.44Å; E280-D375 PolarHBondContact OE1-N 3.3Å; E280-V376 PolarHBondContact OE1-N 3.45Å
281	G	92.6	Very high	95.8	Very high	66 Å²	66	56.3 Å²	56.3	68%	0.68	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	5.6	169.8	0	0	0	0	0	114.5	S279 A283	S279-G281 PolarHBondContact OG-N 3.25Å; G281-A283 PolarHBondContact O-N 3.29Å
282	A	95.4	Very high	95.9	Very high	18 Å²	18	54.2 Å²	54.2	15%	0.149	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-71.9	119.9	171.7	0	0	0	0	0	111	V278 S279 E280 T286 I330	V278-A282 HydrophobicContact CG2-CB 3.71Å; S279-A282 WeakPolarHBondContact O-CB 3.33Å; S279-A282 PolarHBondContact O-N 3.42Å; E280-A282 PolarHBondContact O-N 3.25Å; A282-T286 HydrophobicContact CB-CG2 4.17Å; A282-I330 HydrophobicContact CB-CD1 3.68Å
283	A	95.9	Very high	95.9	Very high	69 Å²	69	48.9 Å²	48.9	57%	0.57	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-57.7	149.9	-177.7	0	0	0	0	0	113.3	G281 G285 T286	G281-A283 PolarHBondContact O-N 3.29Å; A283-G285 PolarHBondContact O-N 3.21Å; A283-T286 VanDerWaalsContact O-CB 3.26Å; A283-T286 WeakPolarHBondContact O-CB 3.46Å; A283-T286 PolarHBondContact O-N 3.32Å; A283-T286 PolarHBondContact O-OG1 3.34Å
284	V	96.1	Very high	95.7	Very high	83 Å²	83	47.7 Å²	47.7	50%	0.503	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	131.5	173.8	174.9	0	0	0	0	110.1	I330 K331 P333	V284-I330 HydrophobicContact CG2-CG2 4.38Å; V284-K331 WeakPolarHBondContact CG1-O 3.41Å; V284-P333 HydrophobicContact CG2-CG 4.18Å
285	G	94.7	Very high	95.5	Very high	34 Å²	34	47.9 Å²	47.9	35%	0.351	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.3	-13.3	-172.4	0	0	0	0	0	115	A283 I330	A283-G285 PolarHBondContact O-N 3.21Å; G285-I330 WeakPolarHBondContact CA-O 3.32Å; G285-I330 PolarHBondContact N-O 2.61Å
286	T	96.8	Very high	95.2	Very high	47 Å²	47	45 Å²	45	29%	0.288	30%	0.297	S	S	.	.			trans	-57.4	129.8	175.8	-60.8	0	0	0	0	111	A282 A283 V288 S329 I330	A282-T286 HydrophobicContact CB-CG2 4.17Å; A283-T286 VanDerWaalsContact O-CB 3.26Å; A283-T286 WeakPolarHBondContact O-CB 3.46Å; A283-T286 PolarHBondContact O-N 3.32Å; A283-T286 PolarHBondContact O-OG1 3.34Å; T286-V288 PolarHBondContact O-N 3.16Å; T286-S329 CarbonylContact O-C 3.54Å; T286-S329 VanDerWaalsContact O-CA 3.23Å; T286-S329 WeakPolarHBondContact O-CA 3.32Å; T286-S329 VanDerWaalsContact O-CB 3.26Å; T286-S329 WeakPolarHBondContact O-CB 3.04Å; T286-I330 PolarHBondContact O-N 2.92Å
287	P	96.4	Very high	95	Very high	85 Å²	85	43 Å²	43	55%	0.552	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	127	172.5	29.5	-33.6	0	0	0	110.6	V327	P287-V327 HydrophobicContact CB-CG1 3.9Å
288	V	96.4	Very high	94.7	Very high	14 Å²	14	44.5 Å²	44.5	9%	0.085	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-37.5	179.4	179	0	0	0	0	110.8	F276 V278 T286 F315 V328 I330 V371	F276-V288 HydrophobicContact CB-CG1 4.06Å; F276-V288 WeakPolarHBondContact CB-O 3.3Å; V278-V288 HydrophobicContact CB-CG1 4.35Å; V278-V288 HydrophobicContact CB-CG2 4.47Å; V278-V288 HydrophobicContact CG1-CG1 4.37Å; V278-V288 HydrophobicContact CG1-CG2 4.35Å; V278-V288 HydrophobicContact CG2-CG2 4.42Å; T286-V288 PolarHBondContact O-N 3.16Å; V288-F315 HydrophobicContact CG2-CD1 4.31Å; V288-F315 HydrophobicContact CG2-CE1 4.14Å; V288-V328 PolarHBondContact N-O 2.75Å; V288-I330 HydrophobicContact CG2-CD1 4.46Å; V288-I330 HydrophobicContact CG2-CG1 3.72Å; V288-V371 HydrophobicContact CG1-CB 4.32Å; V288-V371 HydrophobicContact CG1-CG1 3.66Å; V288-V371 HydrophobicContact CG1-CG2 3.72Å
289	G	95.1	Very high	94.3	Very high	11 Å²	11	46.3 Å²	46.3	11%	0.113	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.7	169.6	-178.9	0	0	0	0	0	112.7	V328	G289-V328 PolarHBondContact N-O 2.9Å; G289-V328 PolarHBondContact O-N 2.8Å
290	R	95.8	Very high	93.8	Very high	100 Å²	100	51.6 Å²	51.6	38%	0.377	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	132	176.8	-73.5	174.4	170.1	-102.5	-6	109	F276 D320 T323 E325 A326 V327	F276-R290 WeakPolarHBondContact CZ-O 3.12Å; R290-D320 IonicContact CZ-OD2 3.97Å; R290-D320 IonicContact NH1-OD2 3.76Å; R290-D320 PolarHBondContact NH1-OD2 2.98Å; R290-D320 IonicContact NH2-OD2 3.63Å; R290-D320 PolarHBondContact NH2-OD2 2.8Å; R290-T323 PolarHBondContact NH1-OG1 2.98Å; R290-E325 HydrophobicContact CB-CB 4.46Å; R290-E325 WeakPolarHBondContact CD-OE2 3.46Å; R290-E325 IonicContact CZ-OE2 3.15Å; R290-E325 IonicContact NE-OE2 2.77Å; R290-E325 IonicContact NH1-OE2 2.7Å; R290-E325 PolarHBondContact NH1-OE2 2.86Å; R290-A326 WeakPolarHBondContact CA-O 3.43Å; R290-V327 HydrophobicContact CG-CG2 4.25Å
291	V	96.4	Very high	93.4	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.012	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	154	172.7	-56.6	0	0	0	0	109.1	F269 Y274 F276 A326 V346 T367 V369	F269-V291 HydrophobicContact CE1-CB 4.38Å; F269-V291 HydrophobicContact CE1-CG2 3.93Å; Y274-V291 HydrophobicContact CD1-CB 4.45Å; Y274-V291 HydrophobicContact CD1-CG1 3.71Å; Y274-V291 HydrophobicContact CD2-CB 4.05Å; Y274-V291 HydrophobicContact CD2-CG1 3.49Å; Y274-V291 VanDerWaalsContact CD2-CG1 3.49Å; Y274-V291 HydrophobicContact CE1-CB 4.34Å; Y274-V291 HydrophobicContact CE1-CG1 4.08Å; Y274-V291 HydrophobicContact CE2-CB 3.94Å; Y274-V291 HydrophobicContact CE2-CG1 3.9Å; Y274-V291 HydrophobicContact CG-CB 4.32Å; Y274-V291 HydrophobicContact CG-CG1 3.4Å; F276-V291 HydrophobicContact CE2-CG1 3.89Å; F276-V291 HydrophobicContact CZ-CG1 4.13Å; V291-A326 HydrophobicContact CG2-CB 3.74Å; V291-A326 PolarHBondContact N-O 2.93Å; V291-A326 WeakPolarHBondContact O-CA 3.35Å; V291-A326 WeakPolarHBondContact O-CB 3.26Å; V291-A326 PolarHBondContact O-N 2.87Å; V291-V346 HydrophobicContact CG2-CG1 4.35Å; V291-T367 HydrophobicContact CG2-CG2 4.44Å; V291-V369 HydrophobicContact CG1-CG2 3.86Å; V291-V369 HydrophobicContact CG2-CG2 4.31Å
292	I	94.9	Very high	93.2	Very high	62 Å²	62	51.5 Å²	51.5	32%	0.318	32%	0.317	S	S	.	.			trans	-136.3	133.1	-177	-170.9	165.1	0	0	0	109.5	F269 P270 E325	F269-I292 VanDerWaalsContact CD1-O 3.31Å; F269-I292 WeakPolarHBondContact CD1-O 3.5Å; P270-I292 WeakPolarHBondContact CD-O 3.41Å; I292-E325 HydrophobicContact CB-CG 4.23Å; I292-E325 HydrophobicContact CD1-CG 4.16Å
293	A	94.5	Very high	92.8	Very high	4 Å²	4	53.2 Å²	53.2	3%	0.033	32%	0.323	C	S	.	.			trans	-95.6	141.9	160.8	0	0	0	0	0	108.4	P267 R268 F269 M304 Y306 A348	P267-A293 HydrophobicContact CB-CB 4.14Å; R268-A293 CarbonylContact O-C 3.51Å; R268-A293 VanDerWaalsContact O-CA 3.31Å; R268-A293 WeakPolarHBondContact O-CA 3.43Å; F269-A293 HydrophobicContact CD1-CB 3.97Å; F269-A293 HydrophobicContact CD2-CB 4.37Å; F269-A293 HydrophobicContact CE1-CB 3.9Å; F269-A293 HydrophobicContact CE2-CB 4.32Å; F269-A293 HydrophobicContact CG-CB 4.21Å; F269-A293 HydrophobicContact CZ-CB 4.09Å; A293-M304 HydrophobicContact CB-SD 3.84Å; A293-Y306 HydrophobicContact CB-CE1 4.02Å; A293-Y306 PolarHBondContact N-OH 2.86Å; A293-A348 HydrophobicContact CB-CB 3.61Å
294	T	93.1	Very high	92.5	Very high	74 Å²	74	50.6 Å²	50.6	45%	0.454	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-110.7	128.6	176.2	52.2	0	0	0	0	108.7	R268	R268-T294 PolarHBondContact N-O 3.33Å; R268-T294 PolarHBondContact O-N 3.13Å; R268-T294 PolarHBondContact O-OG1 2.96Å
295	D	91.9	Very high	92.3	Very high	31 Å²	31	48.5 Å²	48.5	17%	0.166	29%	0.289	C	S	.	.			trans	-95	162.5	169.7	-144.4	-63.2	0	0	0	110.3	P267 D297 T302 M304 N350	P267-D295 WeakPolarHBondContact CA-OD2 3.45Å; D295-D297 PolarHBondContact OD1-N 3.02Å; D295-T302 HydrophobicContact CB-CG2 4.12Å; D295-M304 HydrophobicContact CB-CE 3.86Å; D295-N350 PolarHBondContact OD2-ND2 2.9Å
296	A	91.7	Very high	92.3	Very high	48 Å²	48	47.6 Å²	47.6	40%	0.397	28%	0.275	S	S	.	.			trans	-109.8	-19.4	179.3	0	0	0	0	0	113.1	R227 E228 N265	R227-A296 PolarHBondContact NH2-O 3.28Å; E228-A296 HydrophobicContact CG-CB 3.9Å; N265-A296 HydrophobicContact CB-CB 3.97Å
297	D	91.9	Very high	92.2	Very high	11 Å²	11	49.6 Å²	49.6	6%	0.059	28%	0.283	C	S	.	.	S	Bend	trans	-63.4	-173.2	176.7	-63.1	-7.6	0	0	0	112.7	R227 N263 N265 D295 N301 T302	R227-D297 VanDerWaalsContact NH2-C 3.27Å; N263-D297 VanDerWaalsContact CA-OD2 3.3Å; N263-D297 WeakPolarHBondContact CA-OD2 3.36Å; N265-D297 WeakPolarHBondContact CB-OD1 3.42Å; N265-D297 PolarHBondContact N-OD1 3.22Å; N265-D297 PolarHBondContact ND2-OD1 3.16Å; D295-D297 PolarHBondContact OD1-N 3.02Å; D297-N301 HydrophobicContact CB-CB 3.66Å; D297-T302 HydrophobicContact CB-CG2 4.09Å; D297-T302 WeakPolarHBondContact O-CG2 3.31Å
298	M	90.8	Very high	92.2	Very high	108 Å²	108	47.2 Å²	47.2	53%	0.532	27%	0.265	S	S	.	.			trans	-126.9	143.4	-179.7	-162.8	175.9	-63	0	0	113.4	D261 E300 N301	D261-M298 HydrophobicContact CB-CB 4.2Å; D261-M298 WeakPolarHBondContact OD1-CB 3.48Å; D261-M298 PolarHBondContact OD1-N 2.98Å; D261-M298 PolarHBondContact OD2-N 2.62Å; D261-M298 VanDerWaalsContact OD2-O 3.13Å; M298-E300 PolarHBondContact O-N 3.19Å; M298-N301 PolarHBondContact O-N 2.97Å
299	G	87.9	Confident	92	Very high	51 Å²	51	50.9 Å²	50.9	53%	0.526	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	62.9	-129.7	172.9	0	0	0	0	0	112.7	N301 T302	G299-N301 PolarHBondContact O-N 3.04Å; G299-N301 VanDerWaalsContact O-N 3.14Å; G299-T302 PolarHBondContact O-N 3.02Å; G299-T302 PolarHBondContact O-OG1 3.3Å
300	E	86.8	Confident	91.7	Very high	148 Å²	148	54.4 Å²	54.4	69%	0.692	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-63.6	-17.6	-175.1	-62.7	-175.6	170.3	0	0	113.8	M298 D303 H352	M298-E300 PolarHBondContact O-N 3.19Å; E300-D303 WeakPolarHBondContact O-CB 3.11Å; E300-D303 PolarHBondContact O-N 3.02Å; E300-H352 PolarHBondContact O-ND1 2.77Å
301	N	87.2	Confident	91.4	Very high	32 Å²	32	50.9 Å²	50.9	17%	0.171	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-73.8	-37.3	178.6	-73.1	-27.1	0	0	0	112.8	D261 N263 D297 M298 G299 D303 N350	D261-N301 WeakPolarHBondContact OD2-CB 3.33Å; D261-N301 PolarHBondContact OD2-ND2 3.36Å; N263-N301 HydrophobicContact CB-CB 4.11Å; N263-N301 WeakPolarHBondContact CB-OD1 3.47Å; N263-N301 PolarHBondContact N-ND2 3.04Å; N263-N301 WeakPolarHBondContact ND2-CA 3.3Å; N263-N301 WeakPolarHBondContact ND2-CB 3.33Å; N263-N301 PolarHBondContact ND2-O 2.87Å; N263-N301 PolarHBondContact ND2-OD1 3.24Å; N263-N301 VanDerWaalsContact ND2-OD1 3.13Å; D297-N301 HydrophobicContact CB-CB 3.66Å; M298-N301 PolarHBondContact O-N 2.97Å; G299-N301 PolarHBondContact O-N 3.04Å; G299-N301 VanDerWaalsContact O-N 3.14Å; N301-D303 PolarHBondContact O-N 3.27Å; N301-D303 VanDerWaalsContact O-N 3.13Å; N301-N350 PolarHBondContact O-ND2 2.77Å
302	T	88.2	Confident	91.1	Very high	49 Å²	49	52.1 Å²	52.1	30%	0.301	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-64.5	-10.7	170.9	69.1	0	0	0	0	114.8	D295 D297 G299 M304	D295-T302 HydrophobicContact CB-CG2 4.12Å; D297-T302 HydrophobicContact CB-CG2 4.09Å; D297-T302 WeakPolarHBondContact O-CG2 3.31Å; G299-T302 PolarHBondContact O-N 3.02Å; G299-T302 PolarHBondContact O-OG1 3.3Å; T302-M304 WeakPolarHBondContact O-CE 3.46Å; T302-M304 PolarHBondContact O-N 2.8Å
303	D	87.4	Confident	91	Very high	54 Å²	54	54 Å²	54	29%	0.289	31%	0.312	S	S	.	.			trans	-78.5	94.5	-164.1	-163.3	33.5	0	0	0	110.5	E300 N301 K351	E300-D303 WeakPolarHBondContact O-CB 3.11Å; E300-D303 PolarHBondContact O-N 3.02Å; N301-D303 PolarHBondContact O-N 3.27Å; N301-D303 VanDerWaalsContact O-N 3.13Å; D303-K351 VanDerWaalsContact O-CB 3.25Å; D303-K351 WeakPolarHBondContact O-CB 3.28Å; D303-K351 WeakPolarHBondContact O-CG 3.35Å; D303-K351 PolarHBondContact O-N 2.98Å; D303-K351 IonicContact OD1-NZ 3.55Å; D303-K351 PolarHBondContact OD1-NZ 3.5Å; D303-K351 WeakPolarHBondContact OD2-CD 3.43Å; D303-K351 WeakPolarHBondContact OD2-CE 3.47Å; D303-K351 IonicContact OD2-NZ 3.15Å; D303-K351 PolarHBondContact OD2-NZ 2.94Å
304	M	89.6	Confident	91	Very high	15 Å²	15	56 Å²	56	7%	0.074	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	167.4	-167.3	72	-175.8	76	0	0	114.6	P267 A293 D295 T302 Y306 V349 K351	P267-M304 HydrophobicContact CB-CE 3.91Å; P267-M304 HydrophobicContact CB-SD 3.97Å; A293-M304 HydrophobicContact CB-SD 3.84Å; D295-M304 HydrophobicContact CB-CE 3.86Å; T302-M304 WeakPolarHBondContact O-CE 3.46Å; T302-M304 PolarHBondContact O-N 2.8Å; M304-Y306 HydrophobicContact CG-CE2 4.44Å; M304-Y306 HydrophobicContact SD-CE1 4.25Å; M304-Y306 HydrophobicContact SD-CE2 4.49Å; M304-V349 CarbonylContact C-O 3.58Å; M304-V349 WeakPolarHBondContact CA-O 3.26Å; M304-K351 WeakPolarHBondContact O-CE 3.44Å
305	S	90.8	Very high	91.2	Very high	39 Å²	39	52.5 Å²	52.5	27%	0.273	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	148.4	177.1	64.8	0	0	0	0	110.5	A348 V349	S305-A348 CarbonylContact O-C 3.56Å; S305-A348 WeakPolarHBondContact O-CA 3.45Å; S305-V349 PolarHBondContact N-O 2.89Å; S305-V349 PolarHBondContact O-N 2.82Å; S305-V349 PolarHBondContact OG-O 3.25Å; S305-V349 VanDerWaalsContact OG-O 3.08Å
306	Y	94.9	Very high	91.4	Very high	14 Å²	14	55.1 Å²	55.1	6%	0.055	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	138.2	-179.4	-61	-79.9	0	0	0	111.7	F269 A293 M304 V317 T319 Q324 A326 V346 E347 A348	F269-Y306 HydrophobicContact CE1-CE1 4Å; F269-Y306 HydrophobicContact CZ-CD1 4.03Å; F269-Y306 AromaticContact CZ-CE1 3.88Å; F269-Y306 HydrophobicContact CZ-CE1 3.88Å; A293-Y306 HydrophobicContact CB-CE1 4.02Å; A293-Y306 PolarHBondContact N-OH 2.86Å; M304-Y306 HydrophobicContact CG-CE2 4.44Å; M304-Y306 HydrophobicContact SD-CE1 4.25Å; M304-Y306 HydrophobicContact SD-CE2 4.49Å; Y306-V317 WeakPolarHBondContact O-CG1 3.3Å; Y306-T319 HydrophobicContact CD2-CG2 4.11Å; Y306-T319 HydrophobicContact CE2-CG2 4.07Å; Y306-Q324 VanDerWaalsContact CE2-O 3.25Å; Y306-Q324 WeakPolarHBondContact CE2-O 3.28Å; Y306-Q324 PolarHBondContact OH-O 3.12Å; Y306-A326 HydrophobicContact CD1-CB 3.64Å; Y306-A326 HydrophobicContact CD2-CB 3.68Å; Y306-A326 HydrophobicContact CE1-CB 3.87Å; Y306-A326 HydrophobicContact CE2-CB 3.94Å; Y306-A326 HydrophobicContact CG-CB 3.51Å; Y306-V346 HydrophobicContact CD1-CG1 4.47Å; Y306-E347 CarbonylContact C-O 3.52Å; Y306-E347 WeakPolarHBondContact CA-O 3.42Å; Y306-A348 HydrophobicContact CD1-CB 3.77Å; Y306-A348 HydrophobicContact CE1-CB 3.75Å
307	L	94.3	Very high	91.7	Very high	90 Å²	90	54.2 Å²	54.2	47%	0.471	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	152.7	-177.5	-61.4	173.7	0	0	0	110.3	V346 E347 V349	L307-V346 WeakPolarHBondContact O-CA 3.16Å; L307-E347 PolarHBondContact N-O 3.38Å; L307-E347 PolarHBondContact O-N 3.15Å; L307-V349 HydrophobicContact CD1-CG2 4.31Å
308	I	95.7	Very high	91.8	Very high	34 Å²	34	57.2 Å²	57.2	17%	0.174	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.3	167.5	-69.9	175	0	0	0	108.1	D310 F315 K316 V317 V344 I345 V346	I308-D310 WeakPolarHBondContact CG2-O 3.49Å; I308-F315 HydrophobicContact CD1-CB 3.96Å; I308-K316 VanDerWaalsContact CD1-C 3.43Å; I308-V317 HydrophobicContact CD1-CB 3.92Å; I308-V317 HydrophobicContact CD1-CG1 4.28Å; I308-V317 HydrophobicContact CG1-CB 3.89Å; I308-V317 HydrophobicContact CG1-CG1 3.84Å; I308-V344 HydrophobicContact CD1-CG1 3.85Å; I308-V344 HydrophobicContact CG1-CG1 3.99Å; I308-V344 HydrophobicContact CG2-CG1 3.71Å; I308-I345 WeakPolarHBondContact CA-O 3.47Å; I308-V346 HydrophobicContact CG1-CG2 4.37Å
309	I	92.2	Very high	91.9	Very high	92 Å²	92	54.7 Å²	54.7	47%	0.472	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-38.1	179.6	-62.7	178.6	0	0	0	111.3	I345 E347	I309-I345 HydrophobicContact CB-CB 4.35Å; I309-I345 HydrophobicContact CB-CG2 4.21Å; I309-I345 HydrophobicContact CD1-CG2 4.42Å; I309-I345 PolarHBondContact N-O 3.46Å; I309-E347 HydrophobicContact CD1-CB 3.72Å; I309-E347 HydrophobicContact CD1-CG 4.3Å; I309-E347 WeakPolarHBondContact CD1-OE1 3.26Å; I309-E347 HydrophobicContact CG1-CB 4.18Å
310	D	89.9	Confident	92.1	Very high	85 Å²	85	54 Å²	54	46%	0.455	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	148.8	-178.3	-166.7	10.3	0	0	0	111.1	I308 G312 I345	I308-D310 WeakPolarHBondContact CG2-O 3.49Å; D310-G312 PolarHBondContact O-N 3.49Å; D310-I345 HydrophobicContact CB-CB 4.19Å; D310-I345 HydrophobicContact CB-CD1 4.04Å; D310-I345 HydrophobicContact CB-CG1 4.07Å
311	E	90.3	Very high	92.1	Very high	25 Å²	25	53 Å²	53	12%	0.117	30%	0.297	C	S	.	.	S	Bend	trans	63.2	11.5	-170.3	-45.4	-102.8	-159.1	0	0	114.6	D313 L314 F315 K339 H342 S343 V344	E311-D313 PolarHBondContact O-N 2.9Å; E311-L314 PolarHBondContact O-N 3.31Å; E311-F315 HydrophobicContact CB-CD2 3.84Å; E311-F315 HydrophobicContact CB-CE2 4.26Å; E311-F315 PolarHBondContact O-N 2.69Å; E311-F315 VanDerWaalsContact O-N 3.08Å; E311-K339 WeakPolarHBondContact OE1-CE 3.39Å; E311-K339 IonicContact OE1-NZ 2.77Å; E311-K339 PolarHBondContact OE1-NZ 2.83Å; E311-K339 IonicContact OE2-NZ 3.85Å; E311-K339 PolarHBondContact OE2-NZ 2.76Å; E311-H342 HydrophobicContact CG-CB 4.47Å; E311-H342 WeakPolarHBondContact OE1-CA 3.45Å; E311-H342 WeakPolarHBondContact OE1-CB 3.41Å; E311-H342 IonicContact OE1-CG 3.64Å; E311-H342 IonicContact OE1-ND1 3.89Å; E311-H342 PolarHBondContact OE1-ND1 2.65Å; E311-H342 IonicContact OE2-CE1 2.99Å; E311-H342 IonicContact OE2-CG 2.64Å; E311-H342 IonicContact OE2-ND1 3.7Å; E311-H342 PolarHBondContact OE2-ND1 2.9Å; E311-S343 PolarHBondContact OE1-N 3.27Å; E311-V344 HydrophobicContact CB-CG2 4.08Å; E311-V344 HydrophobicContact CG-CG2 4.32Å
312	G	89	Confident	92.1	Very high	28 Å²	28	60.5 Å²	60.5	29%	0.289	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-0.2	-179.6	0	0	0	0	0	115.8	D310 F315 K331	D310-G312 PolarHBondContact O-N 3.49Å; G312-F315 CarbonylContact C-O 3.56Å; G312-K331 WeakPolarHBondContact O-CD 3.37Å; G312-K331 PolarHBondContact O-NZ 2.82Å
313	D	93.4	Very high	92.2	Very high	102 Å²	102	61.2 Å²	61.2	55%	0.545	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-31.1	168.7	-114.9	-41.5	0	0	0	113	E311 K332	E311-D313 PolarHBondContact O-N 2.9Å; D313-K332 VanDerWaalsContact CG-NZ 3.31Å; D313-K332 VanDerWaalsContact O-CD 3.27Å; D313-K332 WeakPolarHBondContact O-CD 3.37Å; D313-K332 WeakPolarHBondContact O-CE 3.27Å; D313-K332 WeakPolarHBondContact O-CG 3.5Å; D313-K332 PolarHBondContact O-NZ 3.21Å; D313-K332 IonicContact OD1-NZ 3.69Å; D313-K332 PolarHBondContact OD1-NZ 2.64Å
314	L	94.9	Very high	92.2	Very high	46 Å²	46	62.2 Å²	62.2	24%	0.241	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-26.5	-178.2	-63	179.4	0	0	0	112.7	E311 K331 K332 L334 H342	E311-L314 PolarHBondContact O-N 3.31Å; L314-K331 WeakPolarHBondContact O-CA 3.5Å; L314-K331 WeakPolarHBondContact O-CB 3.37Å; L314-K331 PolarHBondContact O-N 3.04Å; L314-K332 HydrophobicContact CD2-CB 4.02Å; L314-K332 HydrophobicContact CD2-CD 4.26Å; L314-K332 PolarHBondContact O-N 3.33Å; L314-L334 HydrophobicContact CB-CD2 4.25Å; L314-L334 HydrophobicContact CD1-CD2 4.46Å; L314-H342 WeakPolarHBondContact CD1-CE1 3.36Å
315	F	97.1	Very high	92.4	Very high	1 Å²	1	63.8 Å²	63.8	0%	0.004	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	160.5	178.3	-57.2	-86	0	0	0	112	V288 I308 E311 G312 V328 S329 K331 L334 H342 V344 V371	V288-F315 HydrophobicContact CG2-CD1 4.31Å; V288-F315 HydrophobicContact CG2-CE1 4.14Å; I308-F315 HydrophobicContact CD1-CB 3.96Å; E311-F315 HydrophobicContact CB-CD2 3.84Å; E311-F315 HydrophobicContact CB-CE2 4.26Å; E311-F315 PolarHBondContact O-N 2.69Å; E311-F315 VanDerWaalsContact O-N 3.08Å; G312-F315 CarbonylContact C-O 3.56Å; F315-V328 HydrophobicContact CB-CG1 4.38Å; F315-V328 HydrophobicContact CD1-CG1 4.36Å; F315-S329 CarbonylContact C-O 3.52Å; F315-S329 WeakPolarHBondContact CA-O 3.36Å; F315-K331 WeakPolarHBondContact O-CD 3.37Å; F315-L334 HydrophobicContact CE1-CD1 4.07Å; F315-L334 HydrophobicContact CE1-CD2 4.31Å; F315-L334 HydrophobicContact CE2-CD2 4.32Å; F315-L334 HydrophobicContact CZ-CD1 3.99Å; F315-L334 HydrophobicContact CZ-CD2 3.8Å; F315-H342 HydrophobicContact CE2-CB 3.74Å; F315-H342 AromaticContact CE2-CG 3.69Å; F315-H342 AromaticContact CE2-ND1 3.83Å; F315-H342 HydrophobicContact CZ-CB 4.04Å; F315-H342 AromaticContact CZ-CG 3.94Å; F315-V344 HydrophobicContact CB-CG1 4.38Å; F315-V344 HydrophobicContact CB-CG2 4.42Å; F315-V344 HydrophobicContact CD1-CG2 4.41Å; F315-V344 HydrophobicContact CD2-CG2 3.42Å; F315-V344 VanDerWaalsContact CD2-CG2 3.42Å; F315-V344 HydrophobicContact CE2-CG2 3.7Å; F315-V344 HydrophobicContact CG-CG2 3.82Å; F315-V344 HydrophobicContact CZ-CG2 4.3Å; F315-V371 HydrophobicContact CE1-CG1 4.32Å; F315-V371 HydrophobicContact CE1-CG2 4.22Å; F315-V371 HydrophobicContact CZ-CB 4.35Å; F315-V371 HydrophobicContact CZ-CG1 4.32Å; F315-V371 HydrophobicContact CZ-CG2 4.3Å
316	K	95.9	Very high	92.6	Very high	86 Å²	86	62 Å²	62	37%	0.374	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	152.7	169.1	67.8	-175.3	-177.7	177.7	0	109.1	I308 S329 K331	I308-K316 VanDerWaalsContact CD1-C 3.43Å; K316-S329 WeakPolarHBondContact CE-OG 3.36Å; K316-S329 WeakPolarHBondContact CG-OG 3.4Å; K316-S329 PolarHBondContact N-O 3.46Å; K316-S329 PolarHBondContact O-N 3.24Å; K316-K331 HydrophobicContact CB-CB 4.26Å; K316-K331 HydrophobicContact CB-CD 4.47Å; K316-K331 HydrophobicContact CG-CB 4.48Å
317	V	96.8	Very high	92.7	Very high	29 Å²	29	62 Å²	62	18%	0.176	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	143.6	171	65	0	0	0	0	109.5	Y306 I308 A326 V327	Y306-V317 WeakPolarHBondContact O-CG1 3.3Å; I308-V317 HydrophobicContact CD1-CB 3.92Å; I308-V317 HydrophobicContact CD1-CG1 4.28Å; I308-V317 HydrophobicContact CG1-CB 3.89Å; I308-V317 HydrophobicContact CG1-CG1 3.84Å; V317-A326 HydrophobicContact CG2-CB 3.73Å; V317-V327 WeakPolarHBondContact CA-O 3.45Å
318	T	94.5	Very high	92.9	Very high	74 Å²	74	57.7 Å²	57.7	45%	0.454	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	129.3	173.3	49.7	0	0	0	0	109.1	V327	T318-V327 PolarHBondContact N-O 2.78Å; T318-V327 WeakPolarHBondContact O-CB 3.5Å; T318-V327 PolarHBondContact O-N 3.07Å
319	T	93.6	Very high	92.9	Very high	55 Å²	55	56.3 Å²	56.3	34%	0.337	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	131.8	172.4	-43.9	0	0	0	0	110.2	Y306 E325	Y306-T319 HydrophobicContact CD2-CG2 4.11Å; Y306-T319 HydrophobicContact CE2-CG2 4.07Å; T319-E325 CarbonylContact C-O 3.51Å; T319-E325 WeakPolarHBondContact CA-O 3.41Å
320	D	91.7	Very high	93.2	Very high	36 Å²	36	51.9 Å²	51.9	19%	0.193	28%	0.282	C	S	.	.			trans	-75.5	129.7	168.2	-165.6	-56.3	0	0	0	110.1	R290 E322 T323 Q324 E325 V327	R290-D320 IonicContact CZ-OD2 3.97Å; R290-D320 IonicContact NH1-OD2 3.76Å; R290-D320 PolarHBondContact NH1-OD2 2.98Å; R290-D320 IonicContact NH2-OD2 3.63Å; R290-D320 PolarHBondContact NH2-OD2 2.8Å; D320-E322 PolarHBondContact OD1-N 2.97Å; D320-T323 WeakPolarHBondContact CB-OG1 3.4Å; D320-T323 PolarHBondContact OD1-N 3.03Å; D320-Q324 VanDerWaalsContact O-CA 3.23Å; D320-Q324 WeakPolarHBondContact O-CA 3.43Å; D320-Q324 PolarHBondContact O-N 2.83Å; D320-E325 HydrophobicContact CB-CB 4.48Å; D320-E325 PolarHBondContact N-O 2.76Å; D320-V327 HydrophobicContact CB-CG2 4.12Å
321	V	87.7	Confident	93.5	Very high	128 Å²	128	52.3 Å²	52.3	78%	0.776	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-30.6	-175.8	-176.6	0	0	0	0	111.8	Q324	V321-Q324 PolarHBondContact O-NE2 2.78Å; V321-Q324 VanDerWaalsContact O-NE2 3.16Å
322	E	87.3	Confident	93.7	Very high	188 Å²	188	55.1 Å²	55.1	88%	0.879	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-37.5	-178	-64.8	-175.3	-171.9	0	0	112.1	D320	D320-E322 PolarHBondContact OD1-N 2.97Å
323	T	88.6	Confident	94	Very high	64 Å²	64	58.4 Å²	58.4	39%	0.393	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-9.5	-174.8	65.5	0	0	0	0	115.4	R290 D320 E325	R290-T323 PolarHBondContact NH1-OG1 2.98Å; D320-T323 WeakPolarHBondContact CB-OG1 3.4Å; D320-T323 PolarHBondContact OD1-N 3.03Å; T323-E325 WeakPolarHBondContact CB-OE2 3.25Å; T323-E325 PolarHBondContact O-N 3.27Å; T323-E325 VanDerWaalsContact O-N 3.12Å; T323-E325 WeakPolarHBondContact OG1-CB 3.4Å; T323-E325 VanDerWaalsContact OG1-CG 3.29Å; T323-E325 WeakPolarHBondContact OG1-CG 3.37Å; T323-E325 PolarHBondContact OG1-OE2 2.96Å
324	Q	88.6	Confident	94.1	Very high	76 Å²	76	54.2 Å²	54.2	36%	0.355	29%	0.286	S	S	.	.			trans	54.3	22.4	-171.3	-58.3	-59.1	-45.1	0	0	114	Y306 D320 V321	Y306-Q324 VanDerWaalsContact CE2-O 3.25Å; Y306-Q324 WeakPolarHBondContact CE2-O 3.28Å; Y306-Q324 PolarHBondContact OH-O 3.12Å; D320-Q324 VanDerWaalsContact O-CA 3.23Å; D320-Q324 WeakPolarHBondContact O-CA 3.43Å; D320-Q324 PolarHBondContact O-N 2.83Å; V321-Q324 PolarHBondContact O-NE2 2.78Å; V321-Q324 VanDerWaalsContact O-NE2 3.16Å
325	E	93.6	Very high	94	Very high	48 Å²	48	55.4 Å²	55.4	22%	0.224	29%	0.293	C	S	.	.			trans	-80.7	143.7	173.3	-67.2	172.8	114.3	0	0	111.4	R290 I292 T319 D320 T323 V327	R290-E325 HydrophobicContact CB-CB 4.46Å; R290-E325 WeakPolarHBondContact CD-OE2 3.46Å; R290-E325 IonicContact CZ-OE2 3.15Å; R290-E325 IonicContact NE-OE2 2.77Å; R290-E325 IonicContact NH1-OE2 2.7Å; R290-E325 PolarHBondContact NH1-OE2 2.86Å; I292-E325 HydrophobicContact CB-CG 4.23Å; I292-E325 HydrophobicContact CD1-CG 4.16Å; T319-E325 CarbonylContact C-O 3.51Å; T319-E325 WeakPolarHBondContact CA-O 3.41Å; D320-E325 HydrophobicContact CB-CB 4.48Å; D320-E325 PolarHBondContact N-O 2.76Å; T323-E325 WeakPolarHBondContact CB-OE2 3.25Å; T323-E325 PolarHBondContact O-N 3.27Å; T323-E325 VanDerWaalsContact O-N 3.12Å; T323-E325 WeakPolarHBondContact OG1-CB 3.4Å; T323-E325 VanDerWaalsContact OG1-CG 3.29Å; T323-E325 WeakPolarHBondContact OG1-CG 3.37Å; T323-E325 PolarHBondContact OG1-OE2 2.96Å; E325-V327 PolarHBondContact O-N 2.92Å
326	A	95.3	Very high	93.8	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	106.2	165.1	0	0	0	0	0	110.2	R290 V291 Y306 V317 V328	R290-A326 WeakPolarHBondContact CA-O 3.43Å; V291-A326 HydrophobicContact CG2-CB 3.74Å; V291-A326 PolarHBondContact N-O 2.93Å; V291-A326 WeakPolarHBondContact O-CA 3.35Å; V291-A326 WeakPolarHBondContact O-CB 3.26Å; V291-A326 PolarHBondContact O-N 2.87Å; Y306-A326 HydrophobicContact CD1-CB 3.64Å; Y306-A326 HydrophobicContact CD2-CB 3.68Å; Y306-A326 HydrophobicContact CE1-CB 3.87Å; Y306-A326 HydrophobicContact CE2-CB 3.94Å; Y306-A326 HydrophobicContact CG-CB 3.51Å; V317-A326 HydrophobicContact CG2-CB 3.73Å; A326-V328 PolarHBondContact O-N 3.37Å
327	V	96.8	Very high	93.6	Very high	14 Å²	14	55.1 Å²	55.1	9%	0.085	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	107.4	172.6	-168.5	0	0	0	0	108.9	P287 R290 V317 T318 D320 E325	P287-V327 HydrophobicContact CB-CG1 3.9Å; R290-V327 HydrophobicContact CG-CG2 4.25Å; V317-V327 WeakPolarHBondContact CA-O 3.45Å; T318-V327 PolarHBondContact N-O 2.78Å; T318-V327 WeakPolarHBondContact O-CB 3.5Å; T318-V327 PolarHBondContact O-N 3.07Å; D320-V327 HydrophobicContact CB-CG2 4.12Å; E325-V327 PolarHBondContact O-N 2.92Å
328	V	97.3	Very high	93.4	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	128	173	-178.3	0	0	0	0	108.4	V288 G289 F315 A326 V346 V369	V288-V328 PolarHBondContact N-O 2.75Å; G289-V328 PolarHBondContact N-O 2.9Å; G289-V328 PolarHBondContact O-N 2.8Å; F315-V328 HydrophobicContact CB-CG1 4.38Å; F315-V328 HydrophobicContact CD1-CG1 4.36Å; A326-V328 PolarHBondContact O-N 3.37Å; V328-V346 HydrophobicContact CG2-CG2 3.96Å; V328-V369 HydrophobicContact CG2-CG2 4.42Å
329	S	97	Very high	93.3	Very high	5 Å²	5	58.8 Å²	58.8	4%	0.035	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	158.9	-175.5	52.7	0	0	0	0	112.9	T286 F315 K316	T286-S329 CarbonylContact O-C 3.54Å; T286-S329 VanDerWaalsContact O-CA 3.23Å; T286-S329 WeakPolarHBondContact O-CA 3.32Å; T286-S329 VanDerWaalsContact O-CB 3.26Å; T286-S329 WeakPolarHBondContact O-CB 3.04Å; F315-S329 CarbonylContact C-O 3.52Å; F315-S329 WeakPolarHBondContact CA-O 3.36Å; K316-S329 WeakPolarHBondContact CE-OG 3.36Å; K316-S329 WeakPolarHBondContact CG-OG 3.4Å; K316-S329 PolarHBondContact N-O 3.46Å; K316-S329 PolarHBondContact O-N 3.24Å
330	I	97.4	Very high	93.3	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	135.9	-178.1	-59.8	-175.3	0	0	0	110.6	V278 A282 V284 G285 T286 V288 K332 L334	V278-I330 HydrophobicContact CG2-CD1 4.01Å; A282-I330 HydrophobicContact CB-CD1 3.68Å; V284-I330 HydrophobicContact CG2-CG2 4.38Å; G285-I330 WeakPolarHBondContact CA-O 3.32Å; G285-I330 PolarHBondContact N-O 2.61Å; T286-I330 PolarHBondContact O-N 2.92Å; V288-I330 HydrophobicContact CG2-CD1 4.46Å; V288-I330 HydrophobicContact CG2-CG1 3.72Å; I330-K332 WeakPolarHBondContact CG2-O 3.47Å; I330-L334 HydrophobicContact CD1-CD1 4.09Å; I330-L334 HydrophobicContact CD1-CG 4.48Å; I330-L334 HydrophobicContact CG1-CD1 4.43Å
331	K	96.3	Very high	93.5	Very high	93 Å²	93	63.6 Å²	63.6	40%	0.404	33%	0.326	S	S	.	.	S	Bend	trans	-114.4	-29.4	178.1	176	-177.4	166.2	-178.1	0	113	V284 G312 L314 F315 K316	V284-K331 WeakPolarHBondContact CG1-O 3.41Å; G312-K331 WeakPolarHBondContact O-CD 3.37Å; G312-K331 PolarHBondContact O-NZ 2.82Å; L314-K331 WeakPolarHBondContact O-CA 3.5Å; L314-K331 WeakPolarHBondContact O-CB 3.37Å; L314-K331 PolarHBondContact O-N 3.04Å; F315-K331 WeakPolarHBondContact O-CD 3.37Å; K316-K331 HydrophobicContact CB-CB 4.26Å; K316-K331 HydrophobicContact CB-CD 4.47Å; K316-K331 HydrophobicContact CG-CB 4.48Å
332	K	95.7	Very high	93.9	Very high	84 Å²	84	57.7 Å²	57.7	37%	0.365	29%	0.29	S	S	.	.	S	Bend	trans	-136.8	156.5	169.4	-63.4	178.9	-165.5	161.4	0	108.6	D313 L314 I330	D313-K332 VanDerWaalsContact CG-NZ 3.31Å; D313-K332 VanDerWaalsContact O-CD 3.27Å; D313-K332 WeakPolarHBondContact O-CD 3.37Å; D313-K332 WeakPolarHBondContact O-CE 3.27Å; D313-K332 WeakPolarHBondContact O-CG 3.5Å; D313-K332 PolarHBondContact O-NZ 3.21Å; D313-K332 IonicContact OD1-NZ 3.69Å; D313-K332 PolarHBondContact OD1-NZ 2.64Å; L314-K332 HydrophobicContact CD2-CB 4.02Å; L314-K332 HydrophobicContact CD2-CD 4.26Å; L314-K332 PolarHBondContact O-N 3.33Å; I330-K332 WeakPolarHBondContact CG2-O 3.47Å
333	P	95	Very high	94.3	Very high	98 Å²	98	51.5 Å²	51.5	64%	0.636	27%	0.267	S	S	*	.			trans	-51	148.1	173.9	-25.6	35.5	0	0	0	112	V284	V284-P333 HydrophobicContact CG2-CG 4.18Å
334	L	95.1	Very high	94.7	Very high	14 Å²	14	48.4 Å²	48.4	7%	0.073	25%	0.248	C	C	.	.			trans	-99.3	164.6	173	-56.4	178.5	0	0	0	109	V278 E280 L314 F315 I330 V373	V278-L334 HydrophobicContact CG1-CD1 3.74Å; E280-L334 HydrophobicContact CB-CB 4.42Å; L314-L334 HydrophobicContact CB-CD2 4.25Å; L314-L334 HydrophobicContact CD1-CD2 4.46Å; F315-L334 HydrophobicContact CE1-CD1 4.07Å; F315-L334 HydrophobicContact CE1-CD2 4.31Å; F315-L334 HydrophobicContact CE2-CD2 4.32Å; F315-L334 HydrophobicContact CZ-CD1 3.99Å; F315-L334 HydrophobicContact CZ-CD2 3.8Å; I330-L334 HydrophobicContact CD1-CD1 4.09Å; I330-L334 HydrophobicContact CD1-CG 4.48Å; I330-L334 HydrophobicContact CG1-CD1 4.43Å; L334-V373 HydrophobicContact CB-CG2 4.44Å; L334-V373 HydrophobicContact CD1-CG2 4.15Å
335	D	93.2	Very high	95	Very high	71 Å²	71	46.9 Å²	46.9	38%	0.38	24%	0.242	S	C	.	.			trans	-150.4	110.9	-171.8	164.8	-10.9	0	0	0	106.3	E337 S338 K339	D335-E337 PolarHBondContact OD1-N 3.28Å; D335-S338 VanDerWaalsContact CG-OG 3.22Å; D335-S338 WeakPolarHBondContact OD1-CB 3.41Å; D335-S338 PolarHBondContact OD1-N 3.15Å; D335-S338 PolarHBondContact OD1-OG 2.84Å; D335-S338 VanDerWaalsContact OD2-CB 3.23Å; D335-S338 WeakPolarHBondContact OD2-CB 3.46Å; D335-S338 PolarHBondContact OD2-OG 3.22Å; D335-K339 PolarHBondContact O-N 3.4Å
336	F	93.7	Very high	95.2	Very high	19 Å²	19	44.6 Å²	44.6	8%	0.083	23%	0.231	C	C	.	.	H	α-helix	trans	-70.6	-38.4	-174.8	-179.5	-109.5	0	0	0	111.3	E280 S338 K339 R340 V373 D375	E280-F336 VanDerWaalsContact CD-CB 3.48Å; E280-F336 VanDerWaalsContact OE1-CB 3.29Å; E280-F336 WeakPolarHBondContact OE1-CB 3.3Å; E280-F336 WeakPolarHBondContact OE2-CB 3.34Å; E280-F336 PolarHBondContact OE2-N 3.49Å; F336-S338 VanDerWaalsContact C-N 3.33Å; F336-S338 PolarHBondContact O-N 3.41Å; F336-K339 PolarHBondContact O-N 2.91Å; F336-R340 HydrophobicContact CD1-CG 4.24Å; F336-R340 HydrophobicContact CD2-CB 3.86Å; F336-R340 HydrophobicContact CD2-CG 3.54Å; F336-R340 HydrophobicContact CE1-CG 4.29Å; F336-R340 VanDerWaalsContact CE1-NE 3.35Å; F336-R340 HydrophobicContact CE2-CB 3.8Å; F336-R340 HydrophobicContact CE2-CG 3.58Å; F336-R340 HydrophobicContact CG-CG 3.88Å; F336-R340 HydrophobicContact CZ-CG 3.98Å; F336-R340 WeakPolarHBondContact O-CG 3.23Å; F336-R340 PolarHBondContact O-N 2.96Å; F336-V373 HydrophobicContact CB-CG1 3.97Å; F336-V373 HydrophobicContact CD2-CB 4.02Å; F336-V373 HydrophobicContact CD2-CG1 4.06Å; F336-V373 WeakPolarHBondContact CD2-O 3.48Å; F336-V373 VanDerWaalsContact CE2-O 3.24Å; F336-V373 WeakPolarHBondContact CE2-O 3.07Å; F336-D375 HydrophobicContact CD1-CB 3.88Å; F336-D375 HydrophobicContact CE1-CB 3.47Å; F336-D375 VanDerWaalsContact CE1-CB 3.47Å; F336-D375 VanDerWaalsContact CE1-CG 3.43Å; F336-D375 WeakPolarHBondContact CE1-OD2 3.43Å; F336-D375 HydrophobicContact CE2-CB 4.21Å; F336-D375 HydrophobicContact CG-CB 4.39Å; F336-D375 HydrophobicContact CZ-CB 3.67Å
337	E	90.7	Very high	95.1	Very high	62 Å²	62	45 Å²	45	29%	0.29	23%	0.233	S	C	.	.	H	α-helix	trans	-62.4	-40	177.8	-82.3	28.7	-92.9	0	0	111.8	D335 R340 P410	D335-E337 PolarHBondContact OD1-N 3.28Å; E337-R340 IonicContact OE1-CZ 3.59Å; E337-R340 IonicContact OE1-NE 2.65Å; E337-R340 IonicContact OE1-NH2 2.78Å; E337-R340 PolarHBondContact OE1-NH2 3.01Å; E337-P410 HydrophobicContact CG-CB 4.14Å; E337-P410 WeakPolarHBondContact CG-O 3.27Å
338	S	91.7	Very high	95	Very high	94 Å²	94	44.4 Å²	44.4	66%	0.657	23%	0.229	S	C	*	.	H	α-helix	trans	-73.2	-48.5	170.9	-72.2	0	0	0	0	112.3	D335 F336	D335-S338 VanDerWaalsContact CG-OG 3.22Å; D335-S338 WeakPolarHBondContact OD1-CB 3.41Å; D335-S338 PolarHBondContact OD1-N 3.15Å; D335-S338 PolarHBondContact OD1-OG 2.84Å; D335-S338 VanDerWaalsContact OD2-CB 3.23Å; D335-S338 WeakPolarHBondContact OD2-CB 3.46Å; D335-S338 PolarHBondContact OD2-OG 3.22Å; F336-S338 VanDerWaalsContact C-N 3.33Å; F336-S338 PolarHBondContact O-N 3.41Å
339	K	93.3	Very high	94.6	Very high	85 Å²	85	45.6 Å²	45.6	37%	0.37	24%	0.237	S	C	.	.	H	α-helix	trans	-156.9	89.9	-172.7	-166.2	164	170	-170.8	0	115.7	E311 D335 F336 I341 H342	E311-K339 WeakPolarHBondContact OE1-CE 3.39Å; E311-K339 IonicContact OE1-NZ 2.77Å; E311-K339 PolarHBondContact OE1-NZ 2.83Å; E311-K339 IonicContact OE2-NZ 3.85Å; E311-K339 PolarHBondContact OE2-NZ 2.76Å; D335-K339 PolarHBondContact O-N 3.4Å; F336-K339 PolarHBondContact O-N 2.91Å; K339-I341 VanDerWaalsContact C-N 3.25Å; K339-I341 WeakPolarHBondContact CE-O 3.38Å; K339-I341 WeakPolarHBondContact CG-O 3.2Å; K339-I341 PolarHBondContact O-N 2.86Å; K339-I341 VanDerWaalsContact O-N 3.11Å; K339-H342 PolarHBondContact O-NE2 3.27Å
340	R	93.9	Very high	94.2	Very high	111 Å²	111	45.5 Å²	45.5	42%	0.419	24%	0.236	S	C	.	.	S	Bend	trans	-59.3	-20.5	176.1	-52.4	-170	173.1	-152.3	-5	116.4	F336 E337 V373	F336-R340 HydrophobicContact CD1-CG 4.24Å; F336-R340 HydrophobicContact CD2-CB 3.86Å; F336-R340 HydrophobicContact CD2-CG 3.54Å; F336-R340 HydrophobicContact CE1-CG 4.29Å; F336-R340 VanDerWaalsContact CE1-NE 3.35Å; F336-R340 HydrophobicContact CE2-CB 3.8Å; F336-R340 HydrophobicContact CE2-CG 3.58Å; F336-R340 HydrophobicContact CG-CG 3.88Å; F336-R340 HydrophobicContact CZ-CG 3.98Å; F336-R340 WeakPolarHBondContact O-CG 3.23Å; F336-R340 PolarHBondContact O-N 2.96Å; E337-R340 IonicContact OE1-CZ 3.59Å; E337-R340 IonicContact OE1-NE 2.65Å; E337-R340 IonicContact OE1-NH2 2.78Å; E337-R340 PolarHBondContact OE1-NH2 3.01Å; R340-V373 PolarHBondContact O-N 3.23Å
341	I	95.8	Very high	93.4	Very high	82 Å²	82	50.5 Å²	50.5	42%	0.421	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	125.3	-178.2	-52.3	-177.9	0	0	0	110.8	K339 K370 V371 T372	K339-I341 VanDerWaalsContact C-N 3.25Å; K339-I341 WeakPolarHBondContact CE-O 3.38Å; K339-I341 WeakPolarHBondContact CG-O 3.2Å; K339-I341 PolarHBondContact O-N 2.86Å; K339-I341 VanDerWaalsContact O-N 3.11Å; I341-K370 HydrophobicContact CG2-CG 3.98Å; I341-V371 WeakPolarHBondContact CA-O 3Å; I341-T372 HydrophobicContact CG1-CG2 4.35Å
342	H	95.8	Very high	92.5	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.019	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	149.1	170.1	-61.3	-98.4	0	0	0	111	E311 L314 F315 K339 V344 K370 V371	E311-H342 HydrophobicContact CG-CB 4.47Å; E311-H342 WeakPolarHBondContact OE1-CA 3.45Å; E311-H342 WeakPolarHBondContact OE1-CB 3.41Å; E311-H342 IonicContact OE1-CG 3.64Å; E311-H342 IonicContact OE1-ND1 3.89Å; E311-H342 PolarHBondContact OE1-ND1 2.65Å; E311-H342 IonicContact OE2-CE1 2.99Å; E311-H342 IonicContact OE2-CG 2.64Å; E311-H342 IonicContact OE2-ND1 3.7Å; E311-H342 PolarHBondContact OE2-ND1 2.9Å; L314-H342 WeakPolarHBondContact CD1-CE1 3.36Å; F315-H342 HydrophobicContact CE2-CB 3.74Å; F315-H342 AromaticContact CE2-CG 3.69Å; F315-H342 AromaticContact CE2-ND1 3.83Å; F315-H342 HydrophobicContact CZ-CB 4.04Å; F315-H342 AromaticContact CZ-CG 3.94Å; K339-H342 PolarHBondContact O-NE2 3.27Å; H342-V344 HydrophobicContact CB-CG2 4.45Å; H342-K370 WeakPolarHBondContact O-CA 2.99Å; H342-V371 HydrophobicContact CB-CB 4.35Å; H342-V371 PolarHBondContact N-O 3.11Å; H342-V371 PolarHBondContact O-N 3.48Å
343	S	96.1	Very high	91.2	Very high	57 Å²	57	49.4 Å²	49.4	40%	0.399	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	75.7	179.7	-67.6	0	0	0	0	109.4	E311 I345	E311-S343 PolarHBondContact OE1-N 3.27Å; S343-I345 PolarHBondContact O-N 2.97Å
344	V	96.1	Very high	90	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	117.5	-174.8	-171.2	0	0	0	0	109.1	I308 E311 F315 H342 V346 V369 V371	I308-V344 HydrophobicContact CD1-CG1 3.85Å; I308-V344 HydrophobicContact CG1-CG1 3.99Å; I308-V344 HydrophobicContact CG2-CG1 3.71Å; E311-V344 HydrophobicContact CB-CG2 4.08Å; E311-V344 HydrophobicContact CG-CG2 4.32Å; F315-V344 HydrophobicContact CB-CG1 4.38Å; F315-V344 HydrophobicContact CB-CG2 4.42Å; F315-V344 HydrophobicContact CD1-CG2 4.41Å; F315-V344 HydrophobicContact CD2-CG2 3.42Å; F315-V344 VanDerWaalsContact CD2-CG2 3.42Å; F315-V344 HydrophobicContact CE2-CG2 3.7Å; F315-V344 HydrophobicContact CG-CG2 3.82Å; F315-V344 HydrophobicContact CZ-CG2 4.3Å; H342-V344 HydrophobicContact CB-CG2 4.45Å; V344-V346 HydrophobicContact CG1-CG2 4.37Å; V344-V346 PolarHBondContact O-N 2.82Å; V344-V369 HydrophobicContact CB-CB 4.27Å; V344-V369 PolarHBondContact N-O 3.14Å; V344-V369 PolarHBondContact O-N 3.46Å; V344-V371 HydrophobicContact CG2-CG2 4.13Å
345	I	95.9	Very high	88.8	Confident	44 Å²	44	50.7 Å²	50.7	23%	0.226	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	113.5	176.2	-60	177.3	0	0	0	108.4	I308 I309 D310 S343 Q366	I308-I345 WeakPolarHBondContact CA-O 3.47Å; I309-I345 HydrophobicContact CB-CB 4.35Å; I309-I345 HydrophobicContact CB-CG2 4.21Å; I309-I345 HydrophobicContact CD1-CG2 4.42Å; I309-I345 PolarHBondContact N-O 3.46Å; D310-I345 HydrophobicContact CB-CB 4.19Å; D310-I345 HydrophobicContact CB-CD1 4.04Å; D310-I345 HydrophobicContact CB-CG1 4.07Å; S343-I345 PolarHBondContact O-N 2.97Å; I345-Q366 HydrophobicContact CG2-CB 4.49Å
346	V	96.4	Very high	87.7	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	127.1	175.1	-177.9	0	0	0	0	108.9	F269 V291 Y306 L307 I308 V328 V344 Q366 T367 V369	F269-V346 HydrophobicContact CZ-CG1 4.08Å; V291-V346 HydrophobicContact CG2-CG1 4.35Å; Y306-V346 HydrophobicContact CD1-CG1 4.47Å; L307-V346 WeakPolarHBondContact O-CA 3.16Å; I308-V346 HydrophobicContact CG1-CG2 4.37Å; V328-V346 HydrophobicContact CG2-CG2 3.96Å; V344-V346 HydrophobicContact CG1-CG2 4.37Å; V344-V346 PolarHBondContact O-N 2.82Å; V346-Q366 WeakPolarHBondContact O-CA 3.5Å; V346-T367 HydrophobicContact CB-CG2 4.28Å; V346-T367 PolarHBondContact N-O 3.28Å; V346-T367 PolarHBondContact O-N 3.31Å; V346-V369 HydrophobicContact CB-CG2 4.37Å; V346-V369 HydrophobicContact CG2-CB 4.35Å; V346-V369 HydrophobicContact CG2-CG2 3.63Å
347	E	94.5	Very high	86.4	Confident	9 Å²	9	54.8 Å²	54.8	4%	0.042	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	138.1	173.4	-176.7	166.9	-86.3	0	0	109.7	Y306 L307 I309 V349 R364 D365 Q366	Y306-E347 CarbonylContact C-O 3.52Å; Y306-E347 WeakPolarHBondContact CA-O 3.42Å; L307-E347 PolarHBondContact N-O 3.38Å; L307-E347 PolarHBondContact O-N 3.15Å; I309-E347 HydrophobicContact CD1-CB 3.72Å; I309-E347 HydrophobicContact CD1-CG 4.3Å; I309-E347 WeakPolarHBondContact CD1-OE1 3.26Å; I309-E347 HydrophobicContact CG1-CB 4.18Å; E347-V349 HydrophobicContact CG-CG2 3.75Å; E347-V349 WeakPolarHBondContact OE2-CG2 3.28Å; E347-R364 HydrophobicContact CG-CB 4.18Å; E347-R364 VanDerWaalsContact OE1-CD 3.29Å; E347-R364 WeakPolarHBondContact OE1-CD 3.14Å; E347-R364 IonicContact OE1-NH1 2.8Å; E347-R364 IonicContact OE2-CZ 3.76Å; E347-R364 IonicContact OE2-NH1 3.73Å; E347-R364 PolarHBondContact OE2-NH1 2.54Å; E347-D365 WeakPolarHBondContact CA-O 3.18Å; E347-Q366 HydrophobicContact CB-CG 4.04Å; E347-Q366 HydrophobicContact CG-CG 4.02Å; E347-Q366 PolarHBondContact OE1-NE2 3.29Å
348	A	93.8	Very high	85.2	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	138.8	165.6	0	0	0	0	0	108.7	P267 F269 A293 S305 Y306 R364 D365	P267-A348 HydrophobicContact CB-CB 4.24Å; P267-A348 HydrophobicContact CG-CB 4.08Å; F269-A348 HydrophobicContact CE2-CB 3.72Å; F269-A348 HydrophobicContact CZ-CB 3.78Å; A293-A348 HydrophobicContact CB-CB 3.61Å; S305-A348 CarbonylContact O-C 3.56Å; S305-A348 WeakPolarHBondContact O-CA 3.45Å; Y306-A348 HydrophobicContact CD1-CB 3.77Å; Y306-A348 HydrophobicContact CE1-CB 3.75Å; A348-R364 WeakPolarHBondContact O-CA 3.09Å; A348-R364 WeakPolarHBondContact O-CB 3.42Å; A348-D365 PolarHBondContact N-O 3.04Å; A348-D365 PolarHBondContact O-N 3Å; A348-D365 VanDerWaalsContact O-N 3.17Å
349	V	89.6	Confident	83.7	Confident	25 Å²	25	58.9 Å²	58.9	15%	0.152	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	130.1	-179.1	-166.8	0	0	0	0	109.8	M304 S305 L307 E347 F363 R364	M304-V349 CarbonylContact C-O 3.58Å; M304-V349 WeakPolarHBondContact CA-O 3.26Å; S305-V349 PolarHBondContact N-O 2.89Å; S305-V349 PolarHBondContact O-N 2.82Å; S305-V349 PolarHBondContact OG-O 3.25Å; S305-V349 VanDerWaalsContact OG-O 3.08Å; L307-V349 HydrophobicContact CD1-CG2 4.31Å; E347-V349 HydrophobicContact CG-CG2 3.75Å; E347-V349 WeakPolarHBondContact OE2-CG2 3.28Å; V349-F363 WeakPolarHBondContact CA-O 3.45Å; V349-F363 WeakPolarHBondContact CG1-O 3.5Å; V349-R364 HydrophobicContact CG2-CB 4.17Å
350	N	87.9	Confident	82	Confident	4 Å²	4	60.8 Å²	60.8	2%	0.021	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	140.2	172.3	-54	76.1	0	0	0	110	P267 D295 N301 H352 F363	P267-N350 WeakPolarHBondContact CD-OD1 3.23Å; P267-N350 WeakPolarHBondContact CG-OD1 3.35Å; D295-N350 PolarHBondContact OD2-ND2 2.9Å; N301-N350 PolarHBondContact O-ND2 2.77Å; N350-H352 VanDerWaalsContact C-N 3.33Å; N350-H352 WeakPolarHBondContact CB-O 3.35Å; N350-F363 PolarHBondContact N-O 2.6Å; N350-F363 PolarHBondContact OD1-O 2.81Å
351	K	81.4	Confident	80.2	Confident	105 Å²	105	57.7 Å²	57.7	46%	0.457	32%	0.315	S	S	.	.	S	Bend	trans	-72.2	-33.6	174.5	-63.6	170.7	-143.3	168.1	0	111.1	D303 M304	D303-K351 VanDerWaalsContact O-CB 3.25Å; D303-K351 WeakPolarHBondContact O-CB 3.28Å; D303-K351 WeakPolarHBondContact O-CG 3.35Å; D303-K351 PolarHBondContact O-N 2.98Å; D303-K351 IonicContact OD1-NZ 3.55Å; D303-K351 PolarHBondContact OD1-NZ 3.5Å; D303-K351 WeakPolarHBondContact OD2-CD 3.43Å; D303-K351 WeakPolarHBondContact OD2-CE 3.47Å; D303-K351 IonicContact OD2-NZ 3.15Å; D303-K351 PolarHBondContact OD2-NZ 2.94Å; M304-K351 WeakPolarHBondContact O-CE 3.44Å
352	H	76.4	Confident	78.5	Confident	80 Å²	80	55.6 Å²	55.6	37%	0.37	31%	0.308	S	S	.	.	S	Bend	trans	-97.3	140	173.2	-55.8	113.5	0	0	0	109.4	E300 N350	E300-H352 PolarHBondContact O-ND1 2.77Å; N350-H352 VanDerWaalsContact C-N 3.33Å; N350-H352 WeakPolarHBondContact CB-O 3.35Å
353	V	69.2	Low	77.6	Confident	73 Å²	73	56 Å²	56	44%	0.442	31%	0.309	S	S	.	.			trans	-143	113	-174.1	163.4	0	0	0	0	106.7	S355 V358 F363	V353-S355 PolarHBondContact O-N 2.73Å; V353-V358 HydrophobicContact CG1-CG2 3.63Å; V353-F363 HydrophobicContact CB-CD2 4.26Å; V353-F363 HydrophobicContact CB-CE2 4.49Å; V353-F363 HydrophobicContact CG1-CD2 3.63Å; V353-F363 HydrophobicContact CG1-CE2 3.76Å; V353-F363 HydrophobicContact CG1-CG 4.43Å; V353-F363 HydrophobicContact CG2-CB 4.06Å; V353-F363 HydrophobicContact CG2-CD2 4.11Å; V353-F363 HydrophobicContact CG2-CG 4.12Å
354	D	69.4	Low	77.2	Confident	38 Å²	38	59.2 Å²	59.2	20%	0.203	31%	0.313	C	S	.	.			trans	-76.6	121.4	174.5	-171.5	-21.9	0	0	0	110	R356 F357	D354-R356 PolarHBondContact O-N 3.12Å; D354-R356 WeakPolarHBondContact OD1-CG 3.37Å; D354-R356 PolarHBondContact OD1-N 3.43Å; D354-R356 IonicContact OD1-NE 2.66Å; D354-R356 IonicContact OD2-CZ 2.65Å; D354-R356 IonicContact OD2-NE 3.77Å; D354-R356 PolarHBondContact OD2-NE 3.34Å; D354-R356 IonicContact OD2-NH2 2.72Å; D354-R356 PolarHBondContact OD2-NH2 3.27Å; D354-F357 HydrophobicContact CB-CD2 4.04Å; D354-F357 HydrophobicContact CB-CE2 4.35Å; D354-F357 PolarHBondContact O-N 3.13Å
355	S	69.4	Low	77	Confident	102 Å²	102	60.1 Å²	60.1	71%	0.713	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-36.4	-34.3	167.2	58.5	0	0	0	0	115.7	V353 F357	V353-S355 PolarHBondContact O-N 2.73Å; S355-F357 VanDerWaalsContact C-N 3.31Å; S355-F357 PolarHBondContact O-N 3.1Å
356	R	69.8	Low	76.9	Confident	139 Å²	139	62.2 Å²	62.2	53%	0.525	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-26.6	-178.9	-69.7	-176	-70.4	159.1	-1.9	114.2	D354	D354-R356 PolarHBondContact O-N 3.12Å; D354-R356 WeakPolarHBondContact OD1-CG 3.37Å; D354-R356 PolarHBondContact OD1-N 3.43Å; D354-R356 IonicContact OD1-NE 2.66Å; D354-R356 IonicContact OD2-CZ 2.65Å; D354-R356 IonicContact OD2-NE 3.77Å; D354-R356 PolarHBondContact OD2-NE 3.34Å; D354-R356 IonicContact OD2-NH2 2.72Å; D354-R356 PolarHBondContact OD2-NH2 3.27Å
357	F	67.6	Low	76.9	Confident	37 Å²	37	62.3 Å²	62.3	16%	0.162	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120	3.7	-173.1	-44.4	-77.3	0	0	0	113.9	L172 V262 N263 D264 D354 S355 D359 L360 F363	L172-F357 HydrophobicContact CD1-CE1 4.04Å; L172-F357 HydrophobicContact CD1-CZ 3.73Å; V262-F357 HydrophobicContact CG1-CE2 3.74Å; V262-F357 HydrophobicContact CG1-CZ 4.14Å; N263-F357 VanDerWaalsContact O-CD2 3.27Å; N263-F357 WeakPolarHBondContact O-CD2 3.29Å; N263-F357 WeakPolarHBondContact O-CE2 3.37Å; D264-F357 HydrophobicContact CB-CE2 4.16Å; D264-F357 HydrophobicContact CB-CZ 4.19Å; D354-F357 HydrophobicContact CB-CD2 4.04Å; D354-F357 HydrophobicContact CB-CE2 4.35Å; D354-F357 PolarHBondContact O-N 3.13Å; S355-F357 VanDerWaalsContact C-N 3.31Å; S355-F357 PolarHBondContact O-N 3.1Å; F357-D359 VanDerWaalsContact C-N 3.26Å; F357-D359 PolarHBondContact O-N 2.83Å; F357-L360 HydrophobicContact CB-CD1 4.23Å; F357-L360 HydrophobicContact CD1-CD1 4.37Å; F357-L360 WeakPolarHBondContact O-CB 3.41Å; F357-L360 PolarHBondContact O-N 2.89Å; F357-L360 VanDerWaalsContact O-N 3.09Å; F357-F363 HydrophobicContact CB-CE2 3.88Å; F357-F363 HydrophobicContact CB-CZ 3.67Å; F357-F363 HydrophobicContact CD2-CZ 4.08Å; F357-F363 HydrophobicContact CG-CZ 4.36Å
358	V	65.5	Low	77	Confident	72 Å²	72	65.3 Å²	65.3	44%	0.436	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-49.8	-43.9	179.9	170	0	0	0	0	112.8	V353 L360 G361	V353-V358 HydrophobicContact CG1-CG2 3.63Å; V358-L360 PolarHBondContact O-N 3.26Å; V358-G361 PolarHBondContact O-N 3.04Å; V358-G361 VanDerWaalsContact O-N 3.14Å
359	D	59.3	Low	77.2	Confident	169 Å²	169	65.3 Å²	65.3	90%	0.904	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-67.4	-14.7	-175.3	-70.6	-24.2	0	0	0	114.2	F357 G361	F357-D359 VanDerWaalsContact C-N 3.26Å; F357-D359 PolarHBondContact O-N 2.83Å; D359-G361 VanDerWaalsContact C-N 3.31Å
360	L	58.8	Low	77.5	Confident	125 Å²	125	66.8 Å²	66.8	65%	0.654	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-79.6	-14.3	176.4	-71.2	159.5	0	0	0	112.7	F357 V358 S362	F357-L360 HydrophobicContact CB-CD1 4.23Å; F357-L360 HydrophobicContact CD1-CD1 4.37Å; F357-L360 WeakPolarHBondContact O-CB 3.41Å; F357-L360 PolarHBondContact O-N 2.89Å; F357-L360 VanDerWaalsContact O-N 3.09Å; V358-L360 PolarHBondContact O-N 3.26Å; L360-S362 PolarHBondContact O-N 3.39Å; L360-S362 PolarHBondContact O-OG 3.1Å
361	G	54.7	Low	78	Confident	46 Å²	46	66.6 Å²	66.6	47%	0.474	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.1	8	-171.2	0	0	0	0	0	113.9	V358 D359 F363	V358-G361 PolarHBondContact O-N 3.04Å; V358-G361 VanDerWaalsContact O-N 3.14Å; D359-G361 VanDerWaalsContact C-N 3.31Å; G361-F363 VanDerWaalsContact C-N 3.32Å; G361-F363 PolarHBondContact O-N 2.72Å
362	S	61.5	Low	78.7	Confident	38 Å²	38	63 Å²	63	27%	0.266	33%	0.333	S	S	.	.			trans	-88.5	36.7	-166.1	-67.2	0	0	0	0	114.9	P266 L360	P266-S362 WeakPolarHBondContact CA-O 3.38Å; P266-S362 WeakPolarHBondContact CB-O 3.03Å; P266-S362 VanDerWaalsContact CD-O 3.27Å; P266-S362 WeakPolarHBondContact CD-O 3.47Å; P266-S362 WeakPolarHBondContact CG-O 3.38Å; L360-S362 PolarHBondContact O-N 3.39Å; L360-S362 PolarHBondContact O-OG 3.1Å
363	F	76.4	Confident	79.7	Confident	12 Å²	12	59.5 Å²	59.5	5%	0.053	32%	0.317	C	S	.	.	S	Bend	trans	-120.7	26.1	169.8	-62.8	-60.4	0	0	0	112.1	N263 V349 N350 V353 F357 G361	N263-F363 HydrophobicContact CB-CE1 4.4Å; N263-F363 WeakPolarHBondContact O-CE1 3.26Å; N263-F363 VanDerWaalsContact OD1-CD1 3.27Å; N263-F363 WeakPolarHBondContact OD1-CD1 3.44Å; N263-F363 WeakPolarHBondContact OD1-CE1 3.23Å; V349-F363 WeakPolarHBondContact CA-O 3.45Å; V349-F363 WeakPolarHBondContact CG1-O 3.5Å; N350-F363 PolarHBondContact N-O 2.6Å; N350-F363 PolarHBondContact OD1-O 2.81Å; V353-F363 HydrophobicContact CB-CD2 4.26Å; V353-F363 HydrophobicContact CB-CE2 4.49Å; V353-F363 HydrophobicContact CG1-CD2 3.63Å; V353-F363 HydrophobicContact CG1-CE2 3.76Å; V353-F363 HydrophobicContact CG1-CG 4.43Å; V353-F363 HydrophobicContact CG2-CB 4.06Å; V353-F363 HydrophobicContact CG2-CD2 4.11Å; V353-F363 HydrophobicContact CG2-CG 4.12Å; F357-F363 HydrophobicContact CB-CE2 3.88Å; F357-F363 HydrophobicContact CB-CZ 3.67Å; F357-F363 HydrophobicContact CD2-CZ 4.08Å; F357-F363 HydrophobicContact CG-CZ 4.36Å; G361-F363 VanDerWaalsContact C-N 3.32Å; G361-F363 PolarHBondContact O-N 2.72Å
364	R	87.2	Confident	80.9	Confident	126 Å²	126	58.4 Å²	58.4	48%	0.475	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	155.7	176.7	69.7	-178.1	83.2	-145.1	6	112.8	E347 A348 V349	E347-R364 HydrophobicContact CG-CB 4.18Å; E347-R364 VanDerWaalsContact OE1-CD 3.29Å; E347-R364 WeakPolarHBondContact OE1-CD 3.14Å; E347-R364 IonicContact OE1-NH1 2.8Å; E347-R364 IonicContact OE2-CZ 3.76Å; E347-R364 IonicContact OE2-NH1 3.73Å; E347-R364 PolarHBondContact OE2-NH1 2.54Å; A348-R364 WeakPolarHBondContact O-CA 3.09Å; A348-R364 WeakPolarHBondContact O-CB 3.42Å; V349-R364 HydrophobicContact CG2-CB 4.17Å
365	D	92.3	Very high	82	Confident	18 Å²	18	60.7 Å²	60.7	10%	0.096	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	158.3	164.4	-169.2	24.8	0	0	0	110	P267 F269 K272 E347 A348	P267-D365 WeakPolarHBondContact O-CB 3.28Å; F269-D365 HydrophobicContact CD2-CB 4.23Å; F269-D365 WeakPolarHBondContact CE2-O 3.24Å; F269-D365 PolarHBondContact N-OD2 2.85Å; K272-D365 IonicContact NZ-OD1 2.69Å; K272-D365 PolarHBondContact NZ-OD1 3.08Å; K272-D365 IonicContact NZ-OD2 3.13Å; K272-D365 PolarHBondContact NZ-OD2 3.25Å; E347-D365 WeakPolarHBondContact CA-O 3.18Å; A348-D365 PolarHBondContact N-O 3.04Å; A348-D365 PolarHBondContact O-N 3Å; A348-D365 VanDerWaalsContact O-N 3.17Å
366	Q	94.3	Very high	83	Confident	89 Å²	89	59 Å²	59	42%	0.416	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	145.1	-176.9	-65.7	178.7	1.2	0	0	111.2	I345 V346 E347	I345-Q366 HydrophobicContact CG2-CB 4.49Å; V346-Q366 WeakPolarHBondContact O-CA 3.5Å; E347-Q366 HydrophobicContact CB-CG 4.04Å; E347-Q366 HydrophobicContact CG-CG 4.02Å; E347-Q366 PolarHBondContact OE1-NE2 3.29Å
367	T	95.8	Very high	83.8	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.006	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	149.7	170.7	-165.8	0	0	0	0	111.3	F269 Q271 K272 Y274 V291 V346 V369	F269-T367 HydrophobicContact CB-CG2 4.38Å; F269-T367 HydrophobicContact CD1-CG2 3.59Å; F269-T367 HydrophobicContact CD2-CG2 3.83Å; F269-T367 HydrophobicContact CE1-CG2 3.69Å; F269-T367 HydrophobicContact CE2-CG2 3.9Å; F269-T367 HydrophobicContact CG-CG2 3.67Å; F269-T367 HydrophobicContact CZ-CG2 3.84Å; Q271-T367 PolarHBondContact O-OG1 3.23Å; K272-T367 VanDerWaalsContact C-OG1 3.22Å; K272-T367 PolarHBondContact O-OG1 3.36Å; Y274-T367 HydrophobicContact CD2-CG2 3.89Å; Y274-T367 WeakPolarHBondContact CD2-OG1 3.46Å; Y274-T367 HydrophobicContact CE2-CG2 3.87Å; Y274-T367 WeakPolarHBondContact CE2-OG1 3.4Å; V291-T367 HydrophobicContact CG2-CG2 4.44Å; V346-T367 HydrophobicContact CB-CG2 4.28Å; V346-T367 PolarHBondContact N-O 3.28Å; V346-T367 PolarHBondContact O-N 3.31Å; T367-V369 HydrophobicContact CG2-CG2 4.42Å
368	I	96.6	Very high	84.7	Confident	73 Å²	73	58.6 Å²	58.6	37%	0.374	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	113	179	-58.2	175	0	0	0	108.9	K272 M273 Y274 K370	K272-I368 PolarHBondContact O-N 3.03Å; K272-I368 VanDerWaalsContact O-N 3.13Å; M273-I368 CarbonylContact C-O 3.35Å; M273-I368 WeakPolarHBondContact CA-O 3.41Å; M273-I368 HydrophobicContact CB-CB 4.49Å; M273-I368 HydrophobicContact CG-CB 4.27Å; M273-I368 HydrophobicContact CG-CG2 4.43Å; M273-I368 WeakPolarHBondContact CG-O 2.98Å; Y274-I368 PolarHBondContact N-O 3.08Å; I368-K370 PolarHBondContact O-N 2.92Å
369	V	97.5	Very high	85.7	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	96.7	171.7	-177.7	0	0	0	0	108.3	F276 V291 V328 V344 V346 T367 V371	F276-V369 HydrophobicContact CD2-CG1 3.64Å; F276-V369 HydrophobicContact CE2-CG1 3.86Å; V291-V369 HydrophobicContact CG1-CG2 3.86Å; V291-V369 HydrophobicContact CG2-CG2 4.31Å; V328-V369 HydrophobicContact CG2-CG2 4.42Å; V344-V369 HydrophobicContact CB-CB 4.27Å; V344-V369 PolarHBondContact N-O 3.14Å; V344-V369 PolarHBondContact O-N 3.46Å; V346-V369 HydrophobicContact CB-CG2 4.37Å; V346-V369 HydrophobicContact CG2-CB 4.35Å; V346-V369 HydrophobicContact CG2-CG2 3.63Å; T367-V369 HydrophobicContact CG2-CG2 4.42Å; V369-V371 HydrophobicContact CG1-CG2 4.23Å; V369-V371 PolarHBondContact O-N 3.33Å
370	K	97.3	Very high	87.1	Confident	56 Å²	56	49.4 Å²	49.4	24%	0.243	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	111	177.7	-176.3	-175.4	173.2	-165.5	0	109.6	M273 Y274 Q275 F276 I341 H342 I368	M273-K370 HydrophobicContact CG-CB 4.34Å; M273-K370 HydrophobicContact SD-CB 4.29Å; M273-K370 HydrophobicContact SD-CD 4.16Å; Y274-K370 PolarHBondContact O-N 3.24Å; Q275-K370 WeakPolarHBondContact CA-O 3.16Å; Q275-K370 HydrophobicContact CB-CB 4.5Å; Q275-K370 HydrophobicContact CG-CB 4.43Å; Q275-K370 HydrophobicContact CG-CD 4.31Å; Q275-K370 HydrophobicContact CG-CG 4.45Å; F276-K370 PolarHBondContact N-O 3.21Å; I341-K370 HydrophobicContact CG2-CG 3.98Å; H342-K370 WeakPolarHBondContact O-CA 2.99Å; I368-K370 PolarHBondContact O-N 2.92Å
371	V	97.2	Very high	88.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	117.6	177.7	-175.6	0	0	0	0	108.6	V278 V288 F315 I341 H342 V344 V369	V278-V371 HydrophobicContact CG1-CG1 3.69Å; V288-V371 HydrophobicContact CG1-CB 4.32Å; V288-V371 HydrophobicContact CG1-CG1 3.66Å; V288-V371 HydrophobicContact CG1-CG2 3.72Å; F315-V371 HydrophobicContact CE1-CG1 4.32Å; F315-V371 HydrophobicContact CE1-CG2 4.22Å; F315-V371 HydrophobicContact CZ-CB 4.35Å; F315-V371 HydrophobicContact CZ-CG1 4.32Å; F315-V371 HydrophobicContact CZ-CG2 4.3Å; I341-V371 WeakPolarHBondContact CA-O 3Å; H342-V371 HydrophobicContact CB-CB 4.35Å; H342-V371 PolarHBondContact N-O 3.11Å; H342-V371 PolarHBondContact O-N 3.48Å; V344-V371 HydrophobicContact CG2-CG2 4.13Å; V369-V371 HydrophobicContact CG1-CG2 4.23Å; V369-V371 PolarHBondContact O-N 3.33Å
372	T	96.8	Very high	90.2	Very high	28 Å²	28	44.9 Å²	44.9	17%	0.172	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	120.9	167.4	48.9	0	0	0	0	109.5	F276 S277 V278 I341	F276-T372 PolarHBondContact O-N 3.23Å; F276-T372 PolarHBondContact O-OG1 3.45Å; S277-T372 VanDerWaalsContact CA-O 3.23Å; S277-T372 WeakPolarHBondContact CA-O 3.25Å; S277-T372 WeakPolarHBondContact CB-OG1 3.45Å; S277-T372 PolarHBondContact OG-O 3.29Å; S277-T372 PolarHBondContact OG-OG1 3.02Å; V278-T372 PolarHBondContact N-O 3.17Å; I341-T372 HydrophobicContact CG1-CG2 4.35Å
373	V	96.8	Very high	91.4	Very high	8 Å²	8	46.8 Å²	46.8	5%	0.048	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	142.2	171.9	-174.4	0	0	0	0	108.1	V278 E280 L334 F336 R340	V278-V373 CarbonylContact O-C 3.42Å; V278-V373 VanDerWaalsContact O-CA 3.3Å; V278-V373 WeakPolarHBondContact O-CA 3.41Å; E280-V373 HydrophobicContact CB-CG1 3.8Å; L334-V373 HydrophobicContact CB-CG2 4.44Å; L334-V373 HydrophobicContact CD1-CG2 4.15Å; F336-V373 HydrophobicContact CB-CG1 3.97Å; F336-V373 HydrophobicContact CD2-CB 4.02Å; F336-V373 HydrophobicContact CD2-CG1 4.06Å; F336-V373 WeakPolarHBondContact CD2-O 3.48Å; F336-V373 VanDerWaalsContact CE2-O 3.24Å; F336-V373 WeakPolarHBondContact CE2-O 3.07Å; R340-V373 PolarHBondContact O-N 3.23Å
374	S	95	Very high	91.7	Very high	49 Å²	49	50.2 Å²	50.2	34%	0.343	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	106.3	174.4	64.8	0	0	0	0	111.7	V278 S279	V278-S374 PolarHBondContact O-N 3.43Å; V278-S374 PolarHBondContact O-OG 2.65Å; S279-S374 WeakPolarHBondContact CA-OG 3.33Å
375	D	92.1	Very high	91	Very high	87 Å²	87	47.3 Å²	47.3	47%	0.465	27%	0.266	S	S	.	.			trans	-0.8	119.4	149.3	-154.6	-42.5	0	0	0	115.8	E280 F336	E280-D375 WeakPolarHBondContact OE1-CA 3.44Å; E280-D375 PolarHBondContact OE1-N 3.3Å; F336-D375 HydrophobicContact CD1-CB 3.88Å; F336-D375 HydrophobicContact CE1-CB 3.47Å; F336-D375 VanDerWaalsContact CE1-CB 3.47Å; F336-D375 VanDerWaalsContact CE1-CG 3.43Å; F336-D375 WeakPolarHBondContact CE1-OD2 3.43Å; F336-D375 HydrophobicContact CE2-CB 4.21Å; F336-D375 HydrophobicContact CG-CB 4.39Å; F336-D375 HydrophobicContact CZ-CB 3.67Å
376	V	90.1	Very high	90.3	Very high	67 Å²	67	54.5 Å²	54.5	41%	0.406	30%	0.299	S	S	.	.			trans	-143.2	107.8	170.6	-179.8	0	0	0	0	112.5	S279 E280 E378	S279-V376 WeakPolarHBondContact OG-CG2 3.44Å; E280-V376 PolarHBondContact OE1-N 3.45Å; V376-E378 PolarHBondContact O-N 2.61Å; V376-E378 VanDerWaalsContact O-N 3.1Å
377	D	86.3	Confident	89.3	Confident	83 Å²	83	52.9 Å²	52.9	44%	0.444	31%	0.307	S	S	.	.			trans	-5.7	90.9	162.7	-151.8	72.5	0	0	0	114.9	D411 N466 M469	D377-D411 VanDerWaalsContact CA-OD2 3.24Å; D377-D411 WeakPolarHBondContact CA-OD2 3.45Å; D377-N466 PolarHBondContact OD2-ND2 2.71Å; D377-M469 VanDerWaalsContact OD2-CG 3.28Å; D377-M469 WeakPolarHBondContact OD2-CG 3.43Å
378	E	86.6	Confident	88.9	Confident	83 Å²	83	53.5 Å²	53.5	39%	0.388	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-94.2	153.2	-179.8	-78	-138.1	123.3	0	0	112.8	V376 P410 D411	V376-E378 PolarHBondContact O-N 2.61Å; V376-E378 VanDerWaalsContact O-N 3.1Å; E378-P410 HydrophobicContact CB-CB 4.37Å; E378-P410 HydrophobicContact CB-CG 3.79Å; E378-P410 WeakPolarHBondContact OE2-CG 3.23Å; E378-D411 PolarHBondContact N-OD2 2.79Å
379	P	87.8	Confident	88.7	Confident	49 Å²	49	54.3 Å²	54.3	32%	0.318	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-76.7	142.6	174.7	31.1	-34.4	0	0	0	112.7	I381 M469	P379-I381 PolarHBondContact O-N 2.84Å; P379-M469 HydrophobicContact CB-CB 4.47Å
380	P	89	Confident	88.5	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-54.4	132.1	-179.1	-26.8	30.8	0	0	0	114.6	A407 R408 D409 S418 A461 S471	P380-A407 HydrophobicContact CB-CB 4.46Å; P380-R408 CarbonylContact C-O 3.59Å; P380-R408 WeakPolarHBondContact CA-O 3.29Å; P380-D409 WeakPolarHBondContact CG-OD2 3.08Å; P380-S418 WeakPolarHBondContact CB-OG 3.33Å; P380-A461 HydrophobicContact CB-CB 4.44Å; P380-S471 WeakPolarHBondContact O-CB 3.12Å; P380-S471 PolarHBondContact O-OG 3.29Å
381	I	88.6	Confident	88.3	Confident	66 Å²	66	57.2 Å²	57.2	34%	0.338	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	126.2	-178	-55.6	179.2	0	0	0	110.6	P379 A407 R408 P410	P379-I381 PolarHBondContact O-N 2.84Å; I381-A407 CarbonylContact O-C 3.18Å; I381-A407 VanDerWaalsContact O-CA 3.26Å; I381-A407 WeakPolarHBondContact O-CA 3.42Å; I381-R408 PolarHBondContact N-O 3.28Å; I381-R408 PolarHBondContact O-N 3.38Å; I381-P410 HydrophobicContact CD1-CG 3.89Å; I381-P410 HydrophobicContact CG1-CG 4.15Å
382	F	89.1	Confident	88.2	Confident	10 Å²	10	57.8 Å²	57.8	4%	0.044	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	151.9	174.8	-79.4	-89.9	0	0	0	112.8	P384 A385 V405 A407 F420 V459 A461 S471	F382-P384 CarbonylContact C-O 3.52Å; F382-P384 CarbonylContact O-C 3.57Å; F382-A385 VanDerWaalsContact O-CA 3.26Å; F382-A385 WeakPolarHBondContact O-CA 3.39Å; F382-A385 PolarHBondContact O-N 2.68Å; F382-V405 HydrophobicContact CD1-CB 4.46Å; F382-V405 HydrophobicContact CE1-CB 4.29Å; F382-V405 HydrophobicContact CE1-CG2 4.42Å; F382-A407 HydrophobicContact CD1-CB 4.26Å; F382-A407 HydrophobicContact CG-CB 4.38Å; F382-F420 HydrophobicContact CE1-CD1 4.29Å; F382-F420 HydrophobicContact CE1-CE1 4.05Å; F382-V459 HydrophobicContact CE1-CG1 4.03Å; F382-V459 HydrophobicContact CZ-CB 4.45Å; F382-V459 HydrophobicContact CZ-CG1 4.01Å; F382-V459 WeakPolarHBondContact CZ-O 3.4Å; F382-A461 HydrophobicContact CE1-CB 4.4Å; F382-A461 HydrophobicContact CE2-CB 3.75Å; F382-A461 HydrophobicContact CZ-CB 3.61Å; F382-S471 WeakPolarHBondContact CD2-OG 3.38Å; F382-S471 VanDerWaalsContact CE2-OG 3.27Å; F382-S471 WeakPolarHBondContact CE2-OG 3.44Å
383	L	86	Confident	88	Confident	77 Å²	77	61.3 Å²	61.3	40%	0.403	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	111.2	176.9	-62.6	174.8	0	0	0	109.4	T406 R408	L383-T406 PolarHBondContact N-O 2.99Å; L383-T406 PolarHBondContact O-OG1 3.34Å; L383-R408 HydrophobicContact CD1-CB 4.35Å; L383-R408 HydrophobicContact CD1-CG 4.07Å; L383-R408 HydrophobicContact CG-CG 4.45Å
384	P	83	Confident	87.7	Confident	84 Å²	84	61.8 Å²	61.8	55%	0.545	35%	0.354	S	S	.	.	S	Bend	cis	-63.3	157.3	-7.1	30.9	-36.6	0	0	0	112.2	F382 A388	F382-P384 CarbonylContact C-O 3.52Å; F382-P384 CarbonylContact O-C 3.57Å; P384-A388 HydrophobicContact CG-CB 4.27Å
385	A	72.3	Confident	87.5	Confident	65 Å²	65	64.1 Å²	64.1	54%	0.537	36%	0.363	S	S	.	.	S	Bend	trans	-65.1	-41	-175.4	0	0	0	0	0	113.1	F382 S473	F382-A385 VanDerWaalsContact O-CA 3.26Å; F382-A385 WeakPolarHBondContact O-CA 3.39Å; F382-A385 PolarHBondContact O-N 2.68Å; A385-S473 PolarHBondContact O-OG 3.39Å
386	E	78.4	Confident	87.6	Confident	170 Å²	170	60.9 Å²	60.9	79%	0.794	35%	0.348	S	S	*	.	S	Bend	trans	-133.3	154.6	-178.8	-63.3	-174.1	165.5	0	0	111.2	A388	E386-A388 PolarHBondContact O-N 2.97Å
387	G	73.8	Confident	87.7	Confident	55 Å²	55	65.8 Å²	65.8	57%	0.567	36%	0.364	S	S	*	.			trans	67.6	38.3	163.2	0	0	0	0	0	115.4	V389	G387-V389 PolarHBondContact O-N 3.41Å; G387-V389 VanDerWaalsContact O-N 3.15Å
388	A	86.8	Confident	88.1	Confident	14 Å²	14	66 Å²	66	12%	0.116	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	114.5	174.2	0	0	0	0	0	110.3	P384 E386 I475 S476	P384-A388 HydrophobicContact CG-CB 4.27Å; E386-A388 PolarHBondContact O-N 2.97Å; A388-I475 HydrophobicContact CB-CG1 4.39Å; A388-I475 HydrophobicContact CB-CG2 4.36Å; A388-I475 WeakPolarHBondContact O-CA 3.14Å; A388-I475 WeakPolarHBondContact O-CG2 3.4Å; A388-S476 PolarHBondContact O-N 3.01Å
389	V	92.1	Very high	88.3	Confident	89 Å²	89	64.8 Å²	64.8	54%	0.539	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	131.2	171.9	-177.5	0	0	0	0	109.1	G387 W454 S476	G387-V389 PolarHBondContact O-N 3.41Å; G387-V389 VanDerWaalsContact O-N 3.15Å; V389-W454 HydrophobicContact CG1-CZ3 4.3Å; V389-S476 WeakPolarHBondContact CA-O 2.97Å
390	M	93.4	Very high	88.6	Confident	20 Å²	20	63.9 Å²	63.9	10%	0.099	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	150.3	172.6	-59.8	-175.2	180	0	0	108.9	V402 V405 I441 I475 S476 I477 R478	M390-V402 HydrophobicContact CB-CG1 4.09Å; M390-V402 HydrophobicContact SD-CG1 4.42Å; M390-V405 HydrophobicContact CE-CG1 3.87Å; M390-I441 HydrophobicContact CE-CD1 4.06Å; M390-I441 HydrophobicContact SD-CD1 4.06Å; M390-I475 HydrophobicContact CE-CD1 4.32Å; M390-I475 HydrophobicContact CE-CG2 4.17Å; M390-I475 HydrophobicContact CG-CG2 4.01Å; M390-I475 HydrophobicContact SD-CG2 4.02Å; M390-S476 PolarHBondContact N-O 3.14Å; M390-I477 HydrophobicContact CB-CG1 4.41Å; M390-I477 CarbonylContact O-C 3.53Å; M390-I477 WeakPolarHBondContact O-CA 3.43Å; M390-R478 PolarHBondContact O-N 3.38Å
391	E	94.3	Very high	88.9	Confident	98 Å²	98	68.9 Å²	68.9	46%	0.458	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	133.9	-179.2	-55.9	-164.5	129.6	0	0	110.1	R478 L480	E391-R478 WeakPolarHBondContact CA-O 3.38Å; E391-R478 HydrophobicContact CG-CB 4.23Å; E391-R478 VanDerWaalsContact OE1-CD 3.25Å; E391-R478 WeakPolarHBondContact OE1-CD 3.15Å; E391-R478 IonicContact OE1-CZ 3.79Å; E391-R478 IonicContact OE1-NE 3.08Å; E391-R478 IonicContact OE1-NH1 2.7Å; E391-R478 PolarHBondContact OE1-NH1 3.36Å; E391-L480 HydrophobicContact CB-CD1 3.83Å; E391-L480 HydrophobicContact CB-CD2 4.27Å; E391-L480 HydrophobicContact CB-CG 3.96Å; E391-L480 HydrophobicContact CG-CD2 4.5Å
392	V	95.1	Very high	89.2	Confident	11 Å²	11	66.4 Å²	66.4	7%	0.067	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	137.5	178.5	60.6	0	0	0	0	110.3	A396 V402 L447 I477 R478 I479 L480	V392-A396 HydrophobicContact CG2-CB 3.69Å; V392-V402 HydrophobicContact CB-CG1 4.2Å; V392-V402 HydrophobicContact CB-CG2 4.33Å; V392-V402 HydrophobicContact CG1-CG1 4.21Å; V392-V402 HydrophobicContact CG1-CG2 4.4Å; V392-V402 HydrophobicContact CG2-CG2 4.23Å; V392-L447 HydrophobicContact CG1-CD1 3.81Å; V392-L447 HydrophobicContact CG2-CD1 4.22Å; V392-I477 HydrophobicContact CG1-CG2 3.79Å; V392-R478 PolarHBondContact N-O 2.92Å; V392-I479 HydrophobicContact CG1-CD1 3.73Å; V392-I479 CarbonylContact O-C 3.55Å; V392-I479 WeakPolarHBondContact O-CA 3.34Å; V392-L480 PolarHBondContact O-N 2.73Å
393	Q	91.7	Very high	89.4	Confident	102 Å²	102	66.8 Å²	66.8	48%	0.477	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	146.8	175.2	-59.9	-173.3	-99.5	0	0	110.8	D395 A396 L480 V482	Q393-D395 WeakPolarHBondContact CB-OD1 3.25Å; Q393-D395 PolarHBondContact O-N 2.86Å; Q393-A396 WeakPolarHBondContact O-CB 3.21Å; Q393-A396 PolarHBondContact O-N 2.9Å; Q393-A396 VanDerWaalsContact O-N 3.15Å; Q393-L480 HydrophobicContact CG-CB 4.21Å; Q393-V482 HydrophobicContact CB-CG2 4.04Å
394	E	91.2	Very high	89.6	Confident	18 Å²	18	67.7 Å²	67.7	8%	0.084	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-27.8	-179	64.6	-156.4	112.8	0	0	114.8	A396 L447 R449 I479 L480 D481 V482	E394-A396 PolarHBondContact O-N 2.66Å; E394-A396 VanDerWaalsContact O-N 3.12Å; E394-L447 HydrophobicContact CB-CB 3.98Å; E394-R449 VanDerWaalsContact CD-CB 3.44Å; E394-R449 WeakPolarHBondContact OE1-CB 2.94Å; E394-R449 WeakPolarHBondContact OE1-CD 3.41Å; E394-R449 WeakPolarHBondContact OE2-CB 3.45Å; E394-R449 PolarHBondContact OE2-N 3.48Å; E394-I479 HydrophobicContact CB-CG2 3.78Å; E394-L480 PolarHBondContact N-O 3.43Å; E394-D481 WeakPolarHBondContact OE1-CA 3.48Å; E394-V482 HydrophobicContact CG-CB 3.99Å; E394-V482 HydrophobicContact CG-CG2 4.07Å; E394-V482 PolarHBondContact OE1-N 3.1Å
395	D	90.8	Very high	90	Very high	98 Å²	98	64.1 Å²	64.1	52%	0.524	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-3.5	172.4	90	-45.8	0	0	0	113.3	Q393 K397 V482	Q393-D395 WeakPolarHBondContact CB-OD1 3.25Å; Q393-D395 PolarHBondContact O-N 2.86Å; D395-K397 PolarHBondContact O-N 3.28Å; D395-V482 HydrophobicContact CB-CG1 4.33Å; D395-V482 HydrophobicContact CB-CG2 4.18Å
396	A	93.2	Very high	90.7	Very high	19 Å²	19	64.4 Å²	64.4	16%	0.157	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-59.8	127.5	178	0	0	0	0	0	111	V392 Q393 E394 L443	V392-A396 HydrophobicContact CG2-CB 3.69Å; Q393-A396 WeakPolarHBondContact O-CB 3.21Å; Q393-A396 PolarHBondContact O-N 2.9Å; Q393-A396 VanDerWaalsContact O-N 3.15Å; E394-A396 PolarHBondContact O-N 2.66Å; E394-A396 VanDerWaalsContact O-N 3.12Å; A396-L443 HydrophobicContact CB-CD2 4.13Å; A396-L443 WeakPolarHBondContact O-CD2 3.39Å
397	K	93.6	Very high	91.2	Very high	171 Å²	171	57.4 Å²	57.4	74%	0.743	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-75.1	146.2	-176.3	-66.3	166.7	-172.4	165.3	0	110.6	D395 G399 S400	D395-K397 PolarHBondContact O-N 3.28Å; K397-G399 PolarHBondContact O-N 3.05Å; K397-S400 WeakPolarHBondContact O-CB 3.5Å; K397-S400 PolarHBondContact O-N 3.44Å; K397-S400 PolarHBondContact O-OG 3.25Å
398	V	93.3	Very high	91.7	Very high	87 Å²	87	61.9 Å²	61.9	53%	0.527	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.5	128.5	167.9	177.7	0	0	0	0	110	L443 G444 I446	V398-L443 CarbonylContact C-O 3.52Å; V398-L443 WeakPolarHBondContact CA-O 3.22Å; V398-G444 WeakPolarHBondContact CG1-O 3.14Å; V398-I446 HydrophobicContact CG2-CG2 4.36Å
399	G	91.9	Very high	91.7	Very high	58 Å²	58	61.7 Å²	61.7	60%	0.598	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.7	1.9	-170.4	0	0	0	0	0	115.3	K397 L443	K397-G399 PolarHBondContact O-N 3.05Å; G399-L443 PolarHBondContact N-O 2.81Å
400	S	93.8	Very high	91.5	Very high	30 Å²	30	58.5 Å²	58.5	21%	0.21	32%	0.318	C	S	.	.			trans	-66.8	153	169.3	61.6	0	0	0	0	111.6	K397 T442 L443	K397-S400 WeakPolarHBondContact O-CB 3.5Å; K397-S400 PolarHBondContact O-N 3.44Å; K397-S400 PolarHBondContact O-OG 3.25Å; S400-T442 CarbonylContact O-C 3.55Å; S400-T442 WeakPolarHBondContact O-CA 3.49Å; S400-T442 VanDerWaalsContact O-CB 3.31Å; S400-T442 WeakPolarHBondContact O-CB 3.25Å; S400-L443 PolarHBondContact O-N 3.31Å; S400-L443 VanDerWaalsContact OG-CB 3.3Å; S400-L443 WeakPolarHBondContact OG-CB 3.3Å
401	L	95.1	Very high	91.1	Very high	105 Å²	105	59.1 Å²	59.1	55%	0.55	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	123	172.9	-177.1	72.8	0	0	0	109.3	G403 I404 A440 T442	L401-G403 WeakPolarHBondContact CD1-O 2.94Å; L401-I404 HydrophobicContact CD1-CG1 4.24Å; L401-I404 HydrophobicContact CD2-CG1 4.49Å; L401-A440 HydrophobicContact CD1-CB 3.85Å; L401-T442 HydrophobicContact CD1-CG2 4.32Å
402	V	94.8	Very high	90.3	Very high	14 Å²	14	56.3 Å²	56.3	9%	0.085	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	-39.2	174	178.2	0	0	0	0	110.5	M390 V392 F432 I441 L443 I477	M390-V402 HydrophobicContact CB-CG1 4.09Å; M390-V402 HydrophobicContact SD-CG1 4.42Å; V392-V402 HydrophobicContact CB-CG1 4.2Å; V392-V402 HydrophobicContact CB-CG2 4.33Å; V392-V402 HydrophobicContact CG1-CG1 4.21Å; V392-V402 HydrophobicContact CG1-CG2 4.4Å; V392-V402 HydrophobicContact CG2-CG2 4.23Å; V402-F432 HydrophobicContact CG2-CD1 4.13Å; V402-F432 HydrophobicContact CG2-CE1 4.13Å; V402-I441 HydrophobicContact CB-CG2 4.22Å; V402-I441 PolarHBondContact N-O 2.9Å; V402-L443 HydrophobicContact CG2-CB 4.36Å; V402-I477 HydrophobicContact CG1-CD1 4.2Å; V402-I477 HydrophobicContact CG1-CG1 4.37Å; V402-I477 HydrophobicContact CG1-CG2 3.8Å
403	G	92.1	Very high	88.8	Confident	17 Å²	17	61.9 Å²	61.9	18%	0.175	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.2	-173.1	179	0	0	0	0	0	111.8	L401 I441	L401-G403 WeakPolarHBondContact CD1-O 2.94Å; G403-I441 PolarHBondContact N-O 3.27Å; G403-I441 PolarHBondContact O-N 3.08Å
404	I	91.4	Very high	87.3	Confident	96 Å²	96	64.7 Å²	64.7	49%	0.492	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	127.1	178.2	-58.3	176.7	0	0	0	107.3	L401 S438 G439 A440	L401-I404 HydrophobicContact CD1-CG1 4.24Å; L401-I404 HydrophobicContact CD2-CG1 4.49Å; I404-S438 WeakPolarHBondContact CG2-O 3.39Å; I404-G439 WeakPolarHBondContact CA-O 3.24Å; I404-A440 HydrophobicContact CG1-CB 4.28Å
405	V	90.6	Very high	85.8	Confident	10 Å²	10	70 Å²	70	6%	0.061	38%	0.381	C	S	.	.			trans	-86.4	148	164.3	-71.1	0	0	0	0	110.3	F382 M390 F420 I434 G439 I441 V459 I475	F382-V405 HydrophobicContact CD1-CB 4.46Å; F382-V405 HydrophobicContact CE1-CB 4.29Å; F382-V405 HydrophobicContact CE1-CG2 4.42Å; M390-V405 HydrophobicContact CE-CG1 3.87Å; V405-F420 HydrophobicContact CG2-CD1 3.78Å; V405-F420 HydrophobicContact CG2-CE1 3.94Å; V405-F420 HydrophobicContact CG2-CG 4.34Å; V405-I434 HydrophobicContact CG2-CD1 3.68Å; V405-G439 WeakPolarHBondContact CG2-O 3.14Å; V405-G439 PolarHBondContact N-O 2.91Å; V405-I441 HydrophobicContact CG1-CD1 4.11Å; V405-V459 HydrophobicContact CG2-CG1 4.22Å; V405-I475 HydrophobicContact CG1-CD1 3.41Å; V405-I475 VanDerWaalsContact CG1-CD1 3.41Å; V405-I475 HydrophobicContact CG1-CG1 4.49Å
406	T	88.4	Confident	84.4	Confident	71 Å²	71	71.2 Å²	71.2	44%	0.436	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	142.8	166.3	58.3	0	0	0	0	109.5	L383	L383-T406 PolarHBondContact N-O 2.99Å; L383-T406 PolarHBondContact O-OG1 3.34Å
407	A	87.7	Confident	82.8	Confident	22 Å²	22	70.7 Å²	70.7	18%	0.182	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	150.3	167.3	0	0	0	0	0	107.9	P380 I381 F382 F420 A461	P380-A407 HydrophobicContact CB-CB 4.46Å; I381-A407 CarbonylContact O-C 3.18Å; I381-A407 VanDerWaalsContact O-CA 3.26Å; I381-A407 WeakPolarHBondContact O-CA 3.42Å; F382-A407 HydrophobicContact CD1-CB 4.26Å; F382-A407 HydrophobicContact CG-CB 4.38Å; A407-F420 HydrophobicContact CB-CE1 3.81Å; A407-F420 HydrophobicContact CB-CZ 3.95Å; A407-A461 HydrophobicContact CB-CB 4.25Å
408	R	85.4	Confident	81.6	Confident	149 Å²	149	63.1 Å²	63.1	56%	0.562	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	149.6	171	66.7	172.8	-174.9	-159.6	3.7	108.4	P380 I381 L383	P380-R408 CarbonylContact C-O 3.59Å; P380-R408 WeakPolarHBondContact CA-O 3.29Å; I381-R408 PolarHBondContact N-O 3.28Å; I381-R408 PolarHBondContact O-N 3.38Å; L383-R408 HydrophobicContact CD1-CB 4.35Å; L383-R408 HydrophobicContact CD1-CG 4.07Å; L383-R408 HydrophobicContact CG-CG 4.45Å
409	D	86.8	Confident	81.2	Confident	11 Å²	11	64 Å²	64	6%	0.059	35%	0.351	C	S	.	.			trans	-87.4	141.5	166.6	-158.8	-96	0	0	0	109.3	P380 D411 V412 V417	P380-D409 WeakPolarHBondContact CG-OD2 3.08Å; D409-D411 PolarHBondContact OD1-N 3.39Å; D409-V412 HydrophobicContact CB-CB 4.22Å; D409-V412 PolarHBondContact OD1-N 2.76Å; D409-V417 HydrophobicContact CB-CB 3.69Å; D409-V417 HydrophobicContact CB-CG1 3.6Å; D409-V417 HydrophobicContact CB-CG2 3.64Å
410	P	86.2	Confident	81.1	Confident	21 Å²	21	62 Å²	62	14%	0.136	33%	0.326	C	S	.	.	S	Bend	trans	-65.3	-47.6	174.1	-20.3	34.9	0	0	0	111.4	E337 E378 I381	E337-P410 HydrophobicContact CG-CB 4.14Å; E337-P410 WeakPolarHBondContact CG-O 3.27Å; E378-P410 HydrophobicContact CB-CB 4.37Å; E378-P410 HydrophobicContact CB-CG 3.79Å; E378-P410 WeakPolarHBondContact OE2-CG 3.23Å; I381-P410 HydrophobicContact CD1-CG 3.89Å; I381-P410 HydrophobicContact CG1-CG 4.15Å
411	D	85.6	Confident	81	Confident	33 Å²	33	63 Å²	63	18%	0.176	33%	0.332	C	S	.	.	S	Bend	trans	-76.1	-37.8	-166.4	-41.8	-20	0	0	0	111.2	D377 E378 D409 I413	D377-D411 VanDerWaalsContact CA-OD2 3.24Å; D377-D411 WeakPolarHBondContact CA-OD2 3.45Å; E378-D411 PolarHBondContact N-OD2 2.79Å; D409-D411 PolarHBondContact OD1-N 3.39Å; D411-I413 PolarHBondContact O-N 3.44Å
412	V	77.4	Confident	81	Confident	39 Å²	39	59.2 Å²	59.2	24%	0.236	31%	0.313	C	S	.	.	S	Bend	trans	-97.8	82.7	-169.7	-172.5	0	0	0	0	112.9	D409 N414 K415 V417	D409-V412 HydrophobicContact CB-CB 4.22Å; D409-V412 PolarHBondContact OD1-N 2.76Å; V412-N414 PolarHBondContact O-N 3.18Å; V412-K415 HydrophobicContact CG1-CB 3.9Å; V412-K415 HydrophobicContact CG1-CD 3.66Å; V412-K415 HydrophobicContact CG1-CG 3.78Å; V412-V417 HydrophobicContact CB-CG2 3.83Å; V412-V417 HydrophobicContact CG1-CG2 3.88Å
413	I	64.8	Low	80.8	Confident	128 Å²	128	60.6 Å²	60.6	66%	0.656	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	120	174.9	-60.7	175.9	0	0	0	112	D411	D411-I413 PolarHBondContact O-N 3.44Å
414	N	59.3	Low	80.7	Confident	161 Å²	161	64.1 Å²	64.1	86%	0.861	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	35.1	169.8	-61.1	-35.4	0	0	0	117.8	V412	V412-N414 PolarHBondContact O-N 3.18Å
415	K	59.8	Low	80.6	Confident	130 Å²	130	64.2 Å²	64.2	57%	0.565	35%	0.345	S	S	*	.	S	Bend	trans	-112.2	159.4	159.7	-65.2	-170.8	-159.1	160.1	0	111.6	V412 V417	V412-K415 HydrophobicContact CG1-CB 3.9Å; V412-K415 HydrophobicContact CG1-CD 3.66Å; V412-K415 HydrophobicContact CG1-CG 3.78Å; K415-V417 HydrophobicContact CB-CG2 3.86Å; K415-V417 WeakPolarHBondContact O-CG2 3.39Å; K415-V417 PolarHBondContact O-N 2.68Å
416	P	61.5	Low	80.7	Confident	123 Å²	123	66.1 Å²	66.1	80%	0.799	36%	0.356	S	S	*	.			trans	-77.6	102.4	156.8	31.3	-29.1	0	0	0	108.2
417	V	59.7	Low	80.8	Confident	8 Å²	8	63.3 Å²	63.3	5%	0.048	34%	0.339	C	S	.	.			trans	-96.7	-27.4	-167	-171.9	0	0	0	0	112.9	D409 V412 K415 E463 A464	D409-V417 HydrophobicContact CB-CB 3.69Å; D409-V417 HydrophobicContact CB-CG1 3.6Å; D409-V417 HydrophobicContact CB-CG2 3.64Å; V412-V417 HydrophobicContact CB-CG2 3.83Å; V412-V417 HydrophobicContact CG1-CG2 3.88Å; K415-V417 HydrophobicContact CB-CG2 3.86Å; K415-V417 WeakPolarHBondContact O-CG2 3.39Å; K415-V417 PolarHBondContact O-N 2.68Å; V417-E463 HydrophobicContact CG1-CG 3.67Å; V417-E463 WeakPolarHBondContact CG1-OE1 3.44Å; V417-E463 CarbonylContact O-C 3.31Å; V417-A464 VanDerWaalsContact O-CB 3.23Å; V417-A464 WeakPolarHBondContact O-CB 3.34Å; V417-A464 PolarHBondContact O-N 2.71Å
418	S	66.9	Low	80.7	Confident	12 Å²	12	69.3 Å²	69.3	8%	0.084	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	129.5	-169.9	-54.2	0	0	0	0	113.4	P380 V462	P380-S418 WeakPolarHBondContact CB-OG 3.33Å; S418-V462 CarbonylContact C-O 3.46Å; S418-V462 VanDerWaalsContact CA-O 3.28Å; S418-V462 WeakPolarHBondContact CA-O 3.36Å
419	R	85.9	Confident	80.8	Confident	105 Å²	105	67 Å²	67	40%	0.396	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	127.5	157.1	-66.5	-172.2	176.7	-72.2	-4.4	109.7	A436 E437 A461 V462	R419-A436 WeakPolarHBondContact CA-O 3.27Å; R419-E437 IonicContact NH1-OE1 2.71Å; R419-A461 WeakPolarHBondContact O-CA 3.29Å; R419-V462 HydrophobicContact CB-CG2 3.86Å; R419-V462 PolarHBondContact N-O 3.05Å; R419-V462 PolarHBondContact O-N 3.43Å
420	F	90.4	Very high	80.9	Confident	18 Å²	18	72.4 Å²	72.4	8%	0.079	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	146.5	-177.2	-61.4	-81	0	0	0	113.2	F382 V405 A407 I434 A436 V459 K460 A461	F382-F420 HydrophobicContact CE1-CD1 4.29Å; F382-F420 HydrophobicContact CE1-CE1 4.05Å; V405-F420 HydrophobicContact CG2-CD1 3.78Å; V405-F420 HydrophobicContact CG2-CE1 3.94Å; V405-F420 HydrophobicContact CG2-CG 4.34Å; A407-F420 HydrophobicContact CB-CE1 3.81Å; A407-F420 HydrophobicContact CB-CZ 3.95Å; F420-I434 HydrophobicContact CB-CD1 3.67Å; F420-I434 HydrophobicContact CB-CG1 4.05Å; F420-I434 HydrophobicContact CG-CD1 4.34Å; F420-A436 PolarHBondContact N-O 3.19Å; F420-A436 VanDerWaalsContact N-O 3.08Å; F420-V459 HydrophobicContact CD1-CG1 4.33Å; F420-K460 WeakPolarHBondContact CA-O 3.34Å; F420-A461 HydrophobicContact CD1-CB 4.2Å; F420-A461 HydrophobicContact CE1-CB 4.1Å
421	S	91.9	Very high	81.2	Confident	49 Å²	49	72.6 Å²	72.6	34%	0.343	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	146.9	174.9	51.9	0	0	0	0	111.2	V459 K460	S421-V459 CarbonylContact O-C 3.58Å; S421-V459 WeakPolarHBondContact O-CA 3.31Å; S421-K460 PolarHBondContact N-O 3.31Å; S421-K460 PolarHBondContact O-N 2.94Å; S421-K460 PolarHBondContact OG-O 2.76Å
422	I	93.4	Very high	81.7	Confident	26 Å²	26	71.2 Å²	71.2	13%	0.133	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	139.9	171.1	-66.9	160.5	0	0	0	108.4	P424 D427 F432 I434 I457 V459	I422-P424 VanDerWaalsContact O-CD 3.28Å; I422-P424 WeakPolarHBondContact O-CD 3.34Å; I422-D427 HydrophobicContact CG2-CB 3.97Å; I422-F432 HydrophobicContact CD1-CB 3.87Å; I422-I434 HydrophobicContact CD1-CB 3.99Å; I422-I434 HydrophobicContact CD1-CG2 4.12Å; I422-I434 HydrophobicContact CG1-CB 4.04Å; I422-I434 HydrophobicContact CG1-CG2 3.8Å; I422-I457 HydrophobicContact CD1-CD1 4.17Å; I422-I457 HydrophobicContact CG1-CD1 4.24Å; I422-I457 HydrophobicContact CG2-CB 4.42Å; I422-V459 HydrophobicContact CG1-CG2 3.97Å
423	D	92.1	Very high	82.5	Confident	43 Å²	43	74 Å²	74	23%	0.23	39%	0.39	C	S	.	.			trans	-71.1	116.4	174.1	-167.5	-45.4	0	0	0	110.6	T425 T426 D427 T458	D423-T425 VanDerWaalsContact CG-OG1 3.27Å; D423-T425 PolarHBondContact O-N 2.96Å; D423-T425 VanDerWaalsContact OD1-CB 3.3Å; D423-T425 WeakPolarHBondContact OD1-CB 3.45Å; D423-T425 WeakPolarHBondContact OD1-CG2 3.23Å; D423-T425 PolarHBondContact OD1-N 2.87Å; D423-T425 PolarHBondContact OD1-OG1 3.17Å; D423-T426 HydrophobicContact CB-CG2 4.34Å; D423-T426 PolarHBondContact O-N 3.2Å; D423-T426 PolarHBondContact O-OG1 2.84Å; D423-D427 PolarHBondContact O-N 2.88Å; D423-T458 PolarHBondContact N-O 3.12Å
424	P	89.4	Confident	83.9	Confident	91 Å²	91	69.4 Å²	69.4	59%	0.591	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-9.6	-178.9	-20.4	33.7	0	0	0	114.6	I422 H428	I422-P424 VanDerWaalsContact O-CD 3.28Å; I422-P424 WeakPolarHBondContact O-CD 3.34Å; P424-H428 PolarHBondContact O-ND1 3.32Å
425	T	89.3	Confident	85.5	Confident	98 Å²	98	65.3 Å²	65.3	60%	0.601	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-19.9	171.2	66.9	0	0	0	0	113.1	D423 H428	D423-T425 VanDerWaalsContact CG-OG1 3.27Å; D423-T425 PolarHBondContact O-N 2.96Å; D423-T425 VanDerWaalsContact OD1-CB 3.3Å; D423-T425 WeakPolarHBondContact OD1-CB 3.45Å; D423-T425 WeakPolarHBondContact OD1-CG2 3.23Å; D423-T425 PolarHBondContact OD1-N 2.87Å; D423-T425 PolarHBondContact OD1-OG1 3.17Å; T425-H428 PolarHBondContact O-CE1 3.2Å; T425-H428 VanDerWaalsContact O-CE1 3.27Å; T425-H428 PolarHBondContact O-ND1 2.78Å
426	T	91.9	Very high	86.9	Confident	50 Å²	50	61 Å²	61	31%	0.307	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-31.8	-179.8	64.5	0	0	0	0	113.2	D423 T458	D423-T426 HydrophobicContact CB-CG2 4.34Å; D423-T426 PolarHBondContact O-N 3.2Å; D423-T426 PolarHBondContact O-OG1 2.84Å; T426-T458 PolarHBondContact OG1-N 3.16Å
427	D	91	Very high	88.1	Confident	12 Å²	12	62.1 Å²	62.1	6%	0.064	33%	0.328	C	S	.	.			trans	-116.8	71	170.3	-173.5	9.9	0	0	0	110.9	I422 D423 D429 M430 I431 F432 I457	I422-D427 HydrophobicContact CG2-CB 3.97Å; D423-D427 PolarHBondContact O-N 2.88Å; D427-D429 PolarHBondContact O-N 3.07Å; D427-M430 PolarHBondContact O-N 2.89Å; D427-M430 WeakPolarHBondContact OD1-CA 3.45Å; D427-M430 PolarHBondContact OD1-N 3.5Å; D427-M430 WeakPolarHBondContact OD2-CA 3.11Å; D427-I431 VanDerWaalsContact CG-N 3.29Å; D427-I431 PolarHBondContact OD1-N 3.23Å; D427-I431 PolarHBondContact OD2-N 3.27Å; D427-F432 PolarHBondContact OD2-N 2.68Å; D427-I457 HydrophobicContact CB-CG2 4.09Å
428	H	85.3	Confident	89.5	Confident	148 Å²	148	64.8 Å²	64.8	69%	0.685	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-29.9	176.7	-76	-16.8	0	0	0	113.6	P424 T425	P424-H428 PolarHBondContact O-ND1 3.32Å; T425-H428 PolarHBondContact O-CE1 3.2Å; T425-H428 VanDerWaalsContact O-CE1 3.27Å; T425-H428 PolarHBondContact O-ND1 2.78Å
429	D	87.1	Confident	90.6	Very high	102 Å²	102	64.2 Å²	64.2	55%	0.545	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-7.3	-176.8	-100.3	-72.3	0	0	0	112.9	D427 I431 K445	D427-D429 PolarHBondContact O-N 3.07Å; D429-I431 VanDerWaalsContact C-N 3.28Å; D429-I431 HydrophobicContact CB-CD1 4.08Å; D429-I431 HydrophobicContact CB-CG1 3.74Å; D429-I431 PolarHBondContact O-N 2.71Å; D429-K445 WeakPolarHBondContact O-CD 3.44Å; D429-K445 WeakPolarHBondContact O-CE 3.42Å; D429-K445 PolarHBondContact O-NZ 3.32Å; D429-K445 IonicContact OD1-NZ 3.81Å; D429-K445 PolarHBondContact OD1-NZ 2.89Å
430	M	90.4	Very high	90.9	Very high	123 Å²	123	60 Å²	60	61%	0.606	33%	0.33	S	S	*	.			trans	55.1	44.8	-173.9	-52.5	179.7	179.5	0	0	111.7	D427	D427-M430 PolarHBondContact O-N 2.89Å; D427-M430 WeakPolarHBondContact OD1-CA 3.45Å; D427-M430 PolarHBondContact OD1-N 3.5Å; D427-M430 WeakPolarHBondContact OD2-CA 3.11Å
431	I	92.6	Very high	91.1	Very high	25 Å²	25	59.1 Å²	59.1	13%	0.128	33%	0.326	C	S	.	.			trans	-66.4	-30.1	175.1	-58	176.8	0	0	0	110.2	D427 D429 L443 G444 K445 L447 H455	D427-I431 VanDerWaalsContact CG-N 3.29Å; D427-I431 PolarHBondContact OD1-N 3.23Å; D427-I431 PolarHBondContact OD2-N 3.27Å; D429-I431 VanDerWaalsContact C-N 3.28Å; D429-I431 HydrophobicContact CB-CD1 4.08Å; D429-I431 HydrophobicContact CB-CG1 3.74Å; D429-I431 PolarHBondContact O-N 2.71Å; I431-L443 HydrophobicContact CG2-CD1 4.21Å; I431-G444 WeakPolarHBondContact O-CA 2.95Å; I431-G444 PolarHBondContact O-N 2.76Å; I431-K445 HydrophobicContact CG1-CD 4.08Å; I431-K445 HydrophobicContact CG2-CB 4.49Å; I431-K445 PolarHBondContact O-N 2.77Å; I431-L447 HydrophobicContact CG2-CD2 3.95Å; I431-H455 WeakPolarHBondContact CD1-CE1 3.31Å
432	F	95.4	Very high	91.3	Very high	5 Å²	5	58.7 Å²	58.7	2%	0.022	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	149.6	-178.3	-55.3	-77.6	0	0	0	112	V402 I422 D427 I441 T442 L443 L447 H455 I457 I477	V402-F432 HydrophobicContact CG2-CD1 4.13Å; V402-F432 HydrophobicContact CG2-CE1 4.13Å; I422-F432 HydrophobicContact CD1-CB 3.87Å; D427-F432 PolarHBondContact OD2-N 2.68Å; F432-I441 HydrophobicContact CB-CG2 4.2Å; F432-I441 HydrophobicContact CD1-CG2 4.38Å; F432-T442 WeakPolarHBondContact CA-O 3.38Å; F432-L443 HydrophobicContact CD1-CD1 4.19Å; F432-L443 HydrophobicContact CE1-CD1 3.89Å; F432-L447 HydrophobicContact CZ-CD2 4.43Å; F432-H455 HydrophobicContact CE2-CB 3.69Å; F432-H455 AromaticContact CE2-CG 3.88Å; F432-H455 HydrophobicContact CZ-CB 4.07Å; F432-I457 HydrophobicContact CB-CD1 4.36Å; F432-I457 HydrophobicContact CD2-CD1 4.48Å; F432-I457 HydrophobicContact CD2-CG2 3.95Å; F432-I457 HydrophobicContact CE2-CG2 4.39Å; F432-I457 HydrophobicContact CG-CD1 4.47Å; F432-I477 HydrophobicContact CD1-CD1 3.75Å; F432-I477 HydrophobicContact CD2-CD1 4.01Å; F432-I477 HydrophobicContact CE1-CD1 3.62Å; F432-I477 HydrophobicContact CE1-CG2 4.06Å; F432-I477 HydrophobicContact CE2-CD1 3.88Å; F432-I477 HydrophobicContact CG-CD1 3.94Å; F432-I477 HydrophobicContact CZ-CB 4.31Å; F432-I477 HydrophobicContact CZ-CD1 3.69Å; F432-I477 HydrophobicContact CZ-CG2 4Å
433	H	94.4	Very high	91.4	Very high	96 Å²	96	57.6 Å²	57.6	44%	0.444	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	129.6	176.4	-64.7	-15.6	0	0	0	109.2	T442	H433-T442 PolarHBondContact N-O 2.87Å; H433-T442 PolarHBondContact O-N 2.88Å; H433-T442 PolarHBondContact O-OG1 2.89Å
434	I	94.2	Very high	91.4	Very high	32 Å²	32	56.4 Å²	56.4	16%	0.164	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	134.9	176.5	-168.1	162.4	0	0	0	110.8	V405 F420 I422 A440 I441 V459	V405-I434 HydrophobicContact CG2-CD1 3.68Å; F420-I434 HydrophobicContact CB-CD1 3.67Å; F420-I434 HydrophobicContact CB-CG1 4.05Å; F420-I434 HydrophobicContact CG-CD1 4.34Å; I422-I434 HydrophobicContact CD1-CB 3.99Å; I422-I434 HydrophobicContact CD1-CG2 4.12Å; I422-I434 HydrophobicContact CG1-CB 4.04Å; I422-I434 HydrophobicContact CG1-CG2 3.8Å; I434-A440 WeakPolarHBondContact CA-O 3.37Å; I434-I441 HydrophobicContact CB-CG1 4.29Å; I434-I441 HydrophobicContact CD1-CD1 4.3Å; I434-I441 HydrophobicContact CD1-CG1 3.81Å; I434-I441 HydrophobicContact CG1-CG1 3.97Å; I434-V459 HydrophobicContact CD1-CG1 3.62Å; I434-V459 HydrophobicContact CD1-CG2 4.14Å
435	D	92.4	Very high	91.5	Very high	76 Å²	76	56 Å²	56	41%	0.406	30%	0.303	S	S	.	.			trans	-75	129.1	168	177.8	-104	0	0	0	110.7	E437 S438 G439 A440	D435-E437 VanDerWaalsContact C-N 3.29Å; D435-E437 PolarHBondContact O-N 2.73Å; D435-E437 PolarHBondContact OD1-N 2.95Å; D435-S438 WeakPolarHBondContact CB-OG 3.33Å; D435-S438 VanDerWaalsContact CG-OG 3.32Å; D435-S438 VanDerWaalsContact OD1-CB 3.32Å; D435-S438 WeakPolarHBondContact OD1-CB 3.29Å; D435-S438 PolarHBondContact OD1-N 3.01Å; D435-S438 PolarHBondContact OD1-OG 2.6Å; D435-G439 PolarHBondContact O-N 2.78Å; D435-G439 VanDerWaalsContact O-N 3.1Å; D435-A440 HydrophobicContact CB-CB 4.35Å; D435-A440 PolarHBondContact N-O 2.78Å
436	A	89.6	Confident	91.6	Very high	40 Å²	40	58.1 Å²	58.1	33%	0.331	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-15.1	-167.7	0	0	0	0	0	114.5	R419 F420	R419-A436 WeakPolarHBondContact CA-O 3.27Å; F420-A436 PolarHBondContact N-O 3.19Å; F420-A436 VanDerWaalsContact N-O 3.08Å
437	E	87.3	Confident	91.6	Very high	146 Å²	146	56.7 Å²	56.7	68%	0.682	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.2	-31.5	-176.2	-61.3	-171.8	169.6	0	0	112.9	R419 D435	R419-E437 IonicContact NH1-OE1 2.71Å; D435-E437 VanDerWaalsContact C-N 3.29Å; D435-E437 PolarHBondContact O-N 2.73Å; D435-E437 PolarHBondContact OD1-N 2.95Å
438	S	88.6	Confident	91.6	Very high	64 Å²	64	59.8 Å²	59.8	45%	0.448	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-12.4	179.4	65.2	0	0	0	0	114.8	I404 D435 A440	I404-S438 WeakPolarHBondContact CG2-O 3.39Å; D435-S438 WeakPolarHBondContact CB-OG 3.33Å; D435-S438 VanDerWaalsContact CG-OG 3.32Å; D435-S438 VanDerWaalsContact OD1-CB 3.32Å; D435-S438 WeakPolarHBondContact OD1-CB 3.29Å; D435-S438 PolarHBondContact OD1-N 3.01Å; D435-S438 PolarHBondContact OD1-OG 2.6Å; S438-A440 PolarHBondContact O-N 3.08Å
439	G	89.6	Confident	91.8	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.289	C	S	.	.			trans	69	11	-176.1	0	0	0	0	0	114.1	I404 V405 D435 I441	I404-G439 WeakPolarHBondContact CA-O 3.24Å; V405-G439 WeakPolarHBondContact CG2-O 3.14Å; V405-G439 PolarHBondContact N-O 2.91Å; D435-G439 PolarHBondContact O-N 2.78Å; D435-G439 VanDerWaalsContact O-N 3.1Å; G439-I441 PolarHBondContact O-N 2.89Å
440	A	93.1	Very high	91.9	Very high	15 Å²	15	52.2 Å²	52.2	12%	0.124	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	120.2	179.4	0	0	0	0	0	111.2	L401 I404 I434 D435 S438	L401-A440 HydrophobicContact CD1-CB 3.85Å; I404-A440 HydrophobicContact CG1-CB 4.28Å; I434-A440 WeakPolarHBondContact CA-O 3.37Å; D435-A440 HydrophobicContact CB-CB 4.35Å; D435-A440 PolarHBondContact N-O 2.78Å; S438-A440 PolarHBondContact O-N 3.08Å
441	I	94.8	Very high	91.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	125	176.7	-60.3	175.3	0	0	0	108.5	M390 V402 G403 V405 F432 I434 G439 I457 V459 I475	M390-I441 HydrophobicContact CE-CD1 4.06Å; M390-I441 HydrophobicContact SD-CD1 4.06Å; V402-I441 HydrophobicContact CB-CG2 4.22Å; V402-I441 PolarHBondContact N-O 2.9Å; G403-I441 PolarHBondContact N-O 3.27Å; G403-I441 PolarHBondContact O-N 3.08Å; V405-I441 HydrophobicContact CG1-CD1 4.11Å; F432-I441 HydrophobicContact CB-CG2 4.2Å; F432-I441 HydrophobicContact CD1-CG2 4.38Å; I434-I441 HydrophobicContact CB-CG1 4.29Å; I434-I441 HydrophobicContact CD1-CD1 4.3Å; I434-I441 HydrophobicContact CD1-CG1 3.81Å; I434-I441 HydrophobicContact CG1-CG1 3.97Å; G439-I441 PolarHBondContact O-N 2.89Å; I441-I457 HydrophobicContact CD1-CD1 4.38Å; I441-V459 HydrophobicContact CD1-CG2 4.15Å; I441-I475 HydrophobicContact CD1-CD1 3.56Å
442	T	95.2	Very high	91.6	Very high	41 Å²	41	51.9 Å²	51.9	25%	0.252	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	155.6	-175.3	58.6	0	0	0	0	111.5	S400 L401 F432 H433	S400-T442 CarbonylContact O-C 3.55Å; S400-T442 WeakPolarHBondContact O-CA 3.49Å; S400-T442 VanDerWaalsContact O-CB 3.31Å; S400-T442 WeakPolarHBondContact O-CB 3.25Å; L401-T442 HydrophobicContact CD1-CG2 4.32Å; F432-T442 WeakPolarHBondContact CA-O 3.38Å; H433-T442 PolarHBondContact N-O 2.87Å; H433-T442 PolarHBondContact O-N 2.88Å; H433-T442 PolarHBondContact O-OG1 2.89Å
443	L	95.4	Very high	91.3	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.01	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	122.3	-174.2	-172.7	65.7	0	0	0	112.1	A396 V398 G399 S400 V402 I431 F432 K445 L447	A396-L443 HydrophobicContact CB-CD2 4.13Å; A396-L443 WeakPolarHBondContact O-CD2 3.39Å; V398-L443 CarbonylContact C-O 3.52Å; V398-L443 WeakPolarHBondContact CA-O 3.22Å; G399-L443 PolarHBondContact N-O 2.81Å; S400-L443 PolarHBondContact O-N 3.31Å; S400-L443 VanDerWaalsContact OG-CB 3.3Å; S400-L443 WeakPolarHBondContact OG-CB 3.3Å; V402-L443 HydrophobicContact CG2-CB 4.36Å; I431-L443 HydrophobicContact CG2-CD1 4.21Å; F432-L443 HydrophobicContact CD1-CD1 4.19Å; F432-L443 HydrophobicContact CE1-CD1 3.89Å; L443-K445 VanDerWaalsContact CD1-O 3.28Å; L443-K445 WeakPolarHBondContact CD1-O 3.37Å; L443-K445 WeakPolarHBondContact CD2-O 3.4Å; L443-K445 WeakPolarHBondContact CG-O 3.43Å; L443-L447 HydrophobicContact CD1-CD1 3.84Å; L443-L447 HydrophobicContact CD1-CD2 3.93Å; L443-L447 HydrophobicContact CD1-CG 3.78Å; L443-L447 HydrophobicContact CD2-CD1 3.84Å; L443-L447 HydrophobicContact CD2-CG 4.07Å
444	G	92	Very high	91.2	Very high	19 Å²	19	54.9 Å²	54.9	20%	0.196	30%	0.301	C	S	.	.			trans	-95.2	-25.6	-180	0	0	0	0	0	115.1	V398 I431	V398-G444 WeakPolarHBondContact CG1-O 3.14Å; I431-G444 WeakPolarHBondContact O-CA 2.95Å; I431-G444 PolarHBondContact O-N 2.76Å
445	K	92	Very high	91.2	Very high	82 Å²	82	55.3 Å²	55.3	36%	0.357	30%	0.302	S	S	.	.	S	Bend	trans	-127.8	160.8	177.7	-77.3	176.5	161.8	172.2	0	111.5	D429 I431 L443	D429-K445 WeakPolarHBondContact O-CD 3.44Å; D429-K445 WeakPolarHBondContact O-CE 3.42Å; D429-K445 PolarHBondContact O-NZ 3.32Å; D429-K445 IonicContact OD1-NZ 3.81Å; D429-K445 PolarHBondContact OD1-NZ 2.89Å; I431-K445 HydrophobicContact CG1-CD 4.08Å; I431-K445 HydrophobicContact CG2-CB 4.49Å; I431-K445 PolarHBondContact O-N 2.77Å; L443-K445 VanDerWaalsContact CD1-O 3.28Å; L443-K445 WeakPolarHBondContact CD1-O 3.37Å; L443-K445 WeakPolarHBondContact CD2-O 3.4Å; L443-K445 WeakPolarHBondContact CG-O 3.43Å
446	I	90.9	Very high	91.2	Very high	143 Å²	143	56.9 Å²	56.9	73%	0.733	31%	0.31	S	S	*	.			trans	-63.8	151.2	166.2	59.9	175.7	0	0	0	110.2	V398	V398-I446 HydrophobicContact CG2-CG2 4.36Å
447	L	92.3	Very high	91.4	Very high	19 Å²	19	55.1 Å²	55.1	10%	0.099	30%	0.296	C	S	.	.			trans	-102.4	164.7	176.7	-65	165.1	0	0	0	110.1	V392 E394 I431 F432 L443 I479	V392-L447 HydrophobicContact CG1-CD1 3.81Å; V392-L447 HydrophobicContact CG2-CD1 4.22Å; E394-L447 HydrophobicContact CB-CB 3.98Å; I431-L447 HydrophobicContact CG2-CD2 3.95Å; F432-L447 HydrophobicContact CZ-CD2 4.43Å; L443-L447 HydrophobicContact CD1-CD1 3.84Å; L443-L447 HydrophobicContact CD1-CD2 3.93Å; L443-L447 HydrophobicContact CD1-CG 3.78Å; L443-L447 HydrophobicContact CD2-CD1 3.84Å; L443-L447 HydrophobicContact CD2-CG 4.07Å; L447-I479 HydrophobicContact CB-CG2 4.49Å; L447-I479 HydrophobicContact CD1-CD1 3.98Å; L447-I479 HydrophobicContact CD2-CD1 3.84Å; L447-I479 HydrophobicContact CG-CD1 4.45Å
448	D	90.6	Very high	91.7	Very high	77 Å²	77	49.9 Å²	49.9	41%	0.412	27%	0.274	S	S	.	.			trans	-159.5	105.3	-179.4	166.1	-14.7	0	0	0	105.3	E450 T451 A452	D448-E450 PolarHBondContact OD1-N 3.11Å; D448-T451 VanDerWaalsContact OD1-CB 3.26Å; D448-T451 WeakPolarHBondContact OD1-CB 2.95Å; D448-T451 PolarHBondContact OD1-N 3.29Å; D448-T451 PolarHBondContact OD1-OG1 2.9Å; D448-T451 WeakPolarHBondContact OD2-CB 3.49Å; D448-T451 PolarHBondContact OD2-OG1 3.34Å; D448-A452 PolarHBondContact O-N 2.96Å
449	R	90	Very high	91.9	Very high	29 Å²	29	46.9 Å²	46.9	11%	0.109	25%	0.252	C	S	.	.	H	α-helix	trans	-76.8	-31.1	-170.9	-172.8	-177.5	148.7	-75.3	10.9	112	E394 T451 A452 G453 I479 D481 D516 E517	E394-R449 VanDerWaalsContact CD-CB 3.44Å; E394-R449 WeakPolarHBondContact OE1-CB 2.94Å; E394-R449 WeakPolarHBondContact OE1-CD 3.41Å; E394-R449 WeakPolarHBondContact OE2-CB 3.45Å; E394-R449 PolarHBondContact OE2-N 3.48Å; R449-T451 PolarHBondContact O-N 3.18Å; R449-A452 CarbonylContact O-C 3.56Å; R449-A452 VanDerWaalsContact O-C 3.31Å; R449-A452 PolarHBondContact O-N 3.3Å; R449-A452 VanDerWaalsContact O-N 3.16Å; R449-G453 PolarHBondContact O-N 2.93Å; R449-I479 HydrophobicContact CB-CB 4.37Å; R449-I479 HydrophobicContact CB-CG2 3.8Å; R449-I479 HydrophobicContact CG-CB 4.11Å; R449-I479 HydrophobicContact CG-CG2 4Å; R449-D481 VanDerWaalsContact CD-CA 3.48Å; R449-D481 IonicContact CZ-OD1 2.73Å; R449-D481 IonicContact NE-OD1 3.01Å; R449-D481 IonicContact NH1-OD1 3.67Å; R449-D481 PolarHBondContact NH1-OD1 2.7Å; R449-D481 VanDerWaalsContact NH1-OD1 3.08Å; R449-D481 IonicContact NH2-OD1 2.6Å; R449-D481 PolarHBondContact NH2-OD1 3.13Å; R449-D481 VanDerWaalsContact NH2-OD1 3.15Å; R449-D516 PolarHBondContact NH1-O 3.01Å; R449-D516 PolarHBondContact NH2-O 3.18Å; R449-E517 IonicContact CZ-OE1 3.48Å; R449-E517 IonicContact NE-OE1 3.79Å; R449-E517 VanDerWaalsContact NH2-CG 3.29Å; R449-E517 IonicContact NH2-OE1 2.81Å; R449-E517 PolarHBondContact NH2-OE1 3.25Å
450	E	89.1	Confident	91.9	Very high	63 Å²	63	49.7 Å²	49.7	29%	0.294	27%	0.265	S	S	.	.	H	α-helix	trans	-69.5	-27.2	177	-72.2	59.4	-105.2	0	0	111.2	D448 N485 R515	D448-E450 PolarHBondContact OD1-N 3.11Å; E450-N485 PolarHBondContact OE2-ND2 3.25Å; E450-R515 HydrophobicContact CG-CB 3.79Å
451	T	88.8	Confident	91.8	Very high	112 Å²	112	49 Å²	49	69%	0.687	26%	0.259	S	S	*	.	H	α-helix	trans	-76.6	-47.4	164.8	-69.6	0	0	0	0	111.9	D448 R449	D448-T451 VanDerWaalsContact OD1-CB 3.26Å; D448-T451 WeakPolarHBondContact OD1-CB 2.95Å; D448-T451 PolarHBondContact OD1-N 3.29Å; D448-T451 PolarHBondContact OD1-OG1 2.9Å; D448-T451 WeakPolarHBondContact OD2-CB 3.49Å; D448-T451 PolarHBondContact OD2-OG1 3.34Å; R449-T451 PolarHBondContact O-N 3.18Å
452	A	88.3	Confident	91.5	Very high	29 Å²	29	49.7 Å²	49.7	24%	0.24	26%	0.263	C	S	.	.	H	α-helix	trans	-154.5	91.8	-177	0	0	0	0	0	115.1	D448 R449 W454 I479	D448-A452 PolarHBondContact O-N 2.96Å; R449-A452 CarbonylContact O-C 3.56Å; R449-A452 VanDerWaalsContact O-C 3.31Å; R449-A452 PolarHBondContact O-N 3.3Å; R449-A452 VanDerWaalsContact O-N 3.16Å; A452-W454 PolarHBondContact O-N 2.61Å; A452-W454 VanDerWaalsContact O-N 3.1Å; A452-I479 WeakPolarHBondContact O-CG1 3.19Å
453	G	89.1	Confident	90.9	Very high	24 Å²	24	48.7 Å²	48.7	25%	0.247	26%	0.255	C	S	.	.	S	Bend	trans	-67.3	-6.5	177.4	0	0	0	0	0	117.1	R449 I479	R449-G453 PolarHBondContact O-N 2.93Å; G453-I479 PolarHBondContact O-N 2.95Å
454	W	92.5	Very high	89.7	Confident	140 Å²	140	50 Å²	50	53%	0.53	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	138.5	178.1	-70.9	84.7	0	0	0	111.6	V389 A452 I477 R478	V389-W454 HydrophobicContact CG1-CZ3 4.3Å; A452-W454 PolarHBondContact O-N 2.61Å; A452-W454 VanDerWaalsContact O-N 3.1Å; W454-I477 WeakPolarHBondContact CA-O 3.17Å; W454-R478 HydrophobicContact CD2-CB 4.16Å; W454-R478 HydrophobicContact CD2-CG 4.16Å; W454-R478 HydrophobicContact CE3-CB 3.85Å; W454-R478 HydrophobicContact CE3-CG 4.32Å; W454-R478 HydrophobicContact CH2-CB 3.75Å; W454-R478 HydrophobicContact CH2-CG 3.86Å; W454-R478 HydrophobicContact CZ2-CB 4.04Å; W454-R478 HydrophobicContact CZ2-CG 3.64Å; W454-R478 HydrophobicContact CZ3-CB 3.64Å; W454-R478 HydrophobicContact CZ3-CG 4.19Å
455	H	92.9	Very high	88.7	Confident	41 Å²	41	55.7 Å²	55.7	19%	0.19	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	128.4	169.4	-70.2	-92.5	0	0	0	110.2	I431 F432 I477	I431-H455 WeakPolarHBondContact CD1-CE1 3.31Å; F432-H455 HydrophobicContact CE2-CB 3.69Å; F432-H455 AromaticContact CE2-CG 3.88Å; F432-H455 HydrophobicContact CZ-CB 4.07Å; H455-I477 HydrophobicContact CB-CB 4.46Å; H455-I477 PolarHBondContact N-O 3.17Å; H455-I477 PolarHBondContact O-N 2.7Å
456	N	93.6	Very high	87.7	Confident	108 Å²	108	53.8 Å²	53.8	58%	0.578	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	115.4	174.2	-71.5	-31	0	0	0	109.2	I475 S476	N456-I475 WeakPolarHBondContact CA-O 3.3Å; N456-S476 WeakPolarHBondContact OD1-CA 3.21Å; N456-S476 WeakPolarHBondContact OD1-CB 3.44Å; N456-S476 PolarHBondContact OD1-OG 3.17Å
457	I	93.5	Very high	86.7	Confident	4 Å²	4	53 Å²	53	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	147.1	177.1	65.3	173	0	0	0	110.4	I422 D427 F432 I441 V459 I475 I477	I422-I457 HydrophobicContact CD1-CD1 4.17Å; I422-I457 HydrophobicContact CG1-CD1 4.24Å; I422-I457 HydrophobicContact CG2-CB 4.42Å; D427-I457 HydrophobicContact CB-CG2 4.09Å; F432-I457 HydrophobicContact CB-CD1 4.36Å; F432-I457 HydrophobicContact CD2-CD1 4.48Å; F432-I457 HydrophobicContact CD2-CG2 3.95Å; F432-I457 HydrophobicContact CE2-CG2 4.39Å; F432-I457 HydrophobicContact CG-CD1 4.47Å; I441-I457 HydrophobicContact CD1-CD1 4.38Å; I457-V459 HydrophobicContact CD1-CG2 4.31Å; I457-I475 HydrophobicContact CG1-CB 4.02Å; I457-I475 PolarHBondContact N-O 3.38Å; I457-I475 PolarHBondContact O-N 3.33Å; I457-I477 HydrophobicContact CD1-CD1 3.63Å; I457-I477 HydrophobicContact CG1-CD1 4.05Å
458	T	93.3	Very high	85.9	Confident	36 Å²	36	57.1 Å²	57.1	22%	0.221	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124.4	169.4	-64.2	0	0	0	0	108.9	D423 T426 F472 S473	D423-T458 PolarHBondContact N-O 3.12Å; T426-T458 PolarHBondContact OG1-N 3.16Å; T458-F472 HydrophobicContact CG2-CB 3.89Å; T458-F472 HydrophobicContact CG2-CD1 3.95Å; T458-F472 HydrophobicContact CG2-CG 4.42Å; T458-S473 WeakPolarHBondContact CA-O 3.18Å
459	V	92.6	Very high	85.6	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	131.8	171.6	174.1	0	0	0	0	109.4	F382 V405 F420 S421 I422 I434 I441 I457 F472 S473 I475	F382-V459 HydrophobicContact CE1-CG1 4.03Å; F382-V459 HydrophobicContact CZ-CB 4.45Å; F382-V459 HydrophobicContact CZ-CG1 4.01Å; F382-V459 WeakPolarHBondContact CZ-O 3.4Å; V405-V459 HydrophobicContact CG2-CG1 4.22Å; F420-V459 HydrophobicContact CD1-CG1 4.33Å; S421-V459 CarbonylContact O-C 3.58Å; S421-V459 WeakPolarHBondContact O-CA 3.31Å; I422-V459 HydrophobicContact CG1-CG2 3.97Å; I434-V459 HydrophobicContact CD1-CG1 3.62Å; I434-V459 HydrophobicContact CD1-CG2 4.14Å; I441-V459 HydrophobicContact CD1-CG2 4.15Å; I457-V459 HydrophobicContact CD1-CG2 4.31Å; V459-F472 CarbonylContact O-C 3.59Å; V459-F472 WeakPolarHBondContact O-CA 3.4Å; V459-S473 PolarHBondContact N-O 2.95Å; V459-S473 PolarHBondContact O-N 2.84Å; V459-I475 HydrophobicContact CB-CD1 3.96Å; V459-I475 HydrophobicContact CG2-CD1 3.41Å; V459-I475 VanDerWaalsContact CG2-CD1 3.41Å; V459-I475 HydrophobicContact CG2-CG1 4.34Å
460	K	91.1	Very high	85.4	Confident	59 Å²	59	56.1 Å²	56.1	26%	0.257	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	131	175.2	-173.7	-169.4	-174.5	-160.2	0	110.1	F420 S421 V462 S471 F472	F420-K460 WeakPolarHBondContact CA-O 3.34Å; S421-K460 PolarHBondContact N-O 3.31Å; S421-K460 PolarHBondContact O-N 2.94Å; S421-K460 PolarHBondContact OG-O 2.76Å; K460-V462 HydrophobicContact CD-CG1 4.03Å; K460-V462 HydrophobicContact CG-CG1 4.28Å; K460-S471 VanDerWaalsContact CA-O 3.3Å; K460-S471 WeakPolarHBondContact CA-O 3.4Å; K460-S471 WeakPolarHBondContact CG-O 3.28Å; K460-F472 HydrophobicContact CB-CD1 3.85Å; K460-F472 HydrophobicContact CB-CE1 3.86Å; K460-F472 HydrophobicContact CD-CE1 3.72Å; K460-F472 HydrophobicContact CD-CZ 3.86Å; K460-F472 HydrophobicContact CG-CD1 3.9Å; K460-F472 HydrophobicContact CG-CE1 3.59Å; K460-F472 HydrophobicContact CG-CE2 4.5Å; K460-F472 HydrophobicContact CG-CZ 3.92Å
461	A	89.9	Confident	85.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	142.8	164	0	0	0	0	0	109.4	P380 F382 A407 R419 F420 A470 S471	P380-A461 HydrophobicContact CB-CB 4.44Å; F382-A461 HydrophobicContact CE1-CB 4.4Å; F382-A461 HydrophobicContact CE2-CB 3.75Å; F382-A461 HydrophobicContact CZ-CB 3.61Å; A407-A461 HydrophobicContact CB-CB 4.25Å; R419-A461 WeakPolarHBondContact O-CA 3.29Å; F420-A461 HydrophobicContact CD1-CB 4.2Å; F420-A461 HydrophobicContact CE1-CB 4.1Å; A461-A470 WeakPolarHBondContact O-CA 3.37Å; A461-S471 PolarHBondContact N-O 2.71Å; A461-S471 PolarHBondContact O-N 2.66Å
462	V	87.9	Confident	85.5	Confident	15 Å²	15	54.2 Å²	54.2	9%	0.091	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	150.1	169.4	-59.5	0	0	0	0	110.5	S418 R419 K460 M469 A470	S418-V462 CarbonylContact C-O 3.46Å; S418-V462 VanDerWaalsContact CA-O 3.28Å; S418-V462 WeakPolarHBondContact CA-O 3.36Å; R419-V462 HydrophobicContact CB-CG2 3.86Å; R419-V462 PolarHBondContact N-O 3.05Å; R419-V462 PolarHBondContact O-N 3.43Å; K460-V462 HydrophobicContact CD-CG1 4.03Å; K460-V462 HydrophobicContact CG-CG1 4.28Å; V462-M469 WeakPolarHBondContact CA-O 3.36Å; V462-A470 HydrophobicContact CG1-CB 3.94Å
463	E	83.1	Confident	85.7	Confident	20 Å²	20	53.2 Å²	53.2	9%	0.093	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	144.8	174.5	-149.3	-83.4	119.8	0	0	110.3	V417 D465 N466 M469	V417-E463 HydrophobicContact CG1-CG 3.67Å; V417-E463 WeakPolarHBondContact CG1-OE1 3.44Å; V417-E463 CarbonylContact O-C 3.31Å; E463-D465 WeakPolarHBondContact OE2-CA 3.45Å; E463-D465 PolarHBondContact OE2-N 2.95Å; E463-N466 HydrophobicContact CB-CB 4.27Å; E463-N466 WeakPolarHBondContact CB-O 3.27Å; E463-N466 WeakPolarHBondContact OE2-CB 3.48Å; E463-N466 PolarHBondContact OE2-N 3.04Å; E463-M469 PolarHBondContact N-O 3.03Å
464	A	71	Confident	85.8	Confident	30 Å²	30	55 Å²	55	25%	0.248	29%	0.293	C	S	.	.	S	Bend	trans	-73.1	-29.9	-171	0	0	0	0	0	112.9	V417	V417-A464 VanDerWaalsContact O-CB 3.23Å; V417-A464 WeakPolarHBondContact O-CB 3.34Å; V417-A464 PolarHBondContact O-N 2.71Å
465	D	69.8	Low	85.8	Confident	138 Å²	138	48.4 Å²	48.4	74%	0.738	27%	0.268	S	S	*	.	S	Bend	trans	-101.2	-31.7	178.6	-68.1	-33.3	0	0	0	111.4	E463	E463-D465 WeakPolarHBondContact OE2-CA 3.45Å; E463-D465 PolarHBondContact OE2-N 2.95Å
466	N	71.2	Confident	85.9	Confident	42 Å²	42	48 Å²	48	23%	0.225	27%	0.27	C	S	.	.			trans	-113.9	89.1	177.7	-175.5	5.7	0	0	0	113.4	D377 E463 T468 M469	D377-N466 PolarHBondContact OD2-ND2 2.71Å; E463-N466 HydrophobicContact CB-CB 4.27Å; E463-N466 WeakPolarHBondContact CB-O 3.27Å; E463-N466 WeakPolarHBondContact OE2-CB 3.48Å; E463-N466 PolarHBondContact OE2-N 3.04Å; N466-T468 PolarHBondContact ND2-OG1 3.02Å; N466-T468 PolarHBondContact O-N 3.39Å; N466-T468 WeakPolarHBondContact OD1-CB 3.27Å; N466-T468 PolarHBondContact OD1-N 2.8Å; N466-T468 PolarHBondContact OD1-OG1 3.41Å; N466-M469 PolarHBondContact O-N 2.86Å
467	H	69.8	Low	85.9	Confident	126 Å²	126	42.9 Å²	42.9	58%	0.583	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-4.6	176.7	-71	-161.7	0	0	0	115.8
468	T	76.4	Confident	86	Confident	106 Å²	106	46.3 Å²	46.3	65%	0.65	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-31.4	178.5	70.5	0	0	0	0	113.2	N466	N466-T468 PolarHBondContact ND2-OG1 3.02Å; N466-T468 PolarHBondContact O-N 3.39Å; N466-T468 WeakPolarHBondContact OD1-CB 3.27Å; N466-T468 PolarHBondContact OD1-N 2.8Å; N466-T468 PolarHBondContact OD1-OG1 3.41Å
469	M	83.1	Confident	85.9	Confident	57 Å²	57	44.7 Å²	44.7	28%	0.281	25%	0.245	S	C	.	.			trans	-78	124.3	172.4	-73.2	-48.9	108.4	0	0	109.7	D377 P379 V462 E463 N466	D377-M469 VanDerWaalsContact OD2-CG 3.28Å; D377-M469 WeakPolarHBondContact OD2-CG 3.43Å; P379-M469 HydrophobicContact CB-CB 4.47Å; V462-M469 WeakPolarHBondContact CA-O 3.36Å; E463-M469 PolarHBondContact N-O 3.03Å; N466-M469 PolarHBondContact O-N 2.86Å
470	A	87.4	Confident	85.8	Confident	29 Å²	29	46.8 Å²	46.8	24%	0.24	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	134.7	-165.3	0	0	0	0	0	111.7	A461 V462 F472	A461-A470 WeakPolarHBondContact O-CA 3.37Å; V462-A470 HydrophobicContact CG1-CB 3.94Å; A470-F472 HydrophobicContact CB-CE2 4.42Å
471	S	89.8	Confident	85.6	Confident	20 Å²	20	45.7 Å²	45.7	14%	0.14	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	164.7	171.6	68.1	0	0	0	0	111.1	P380 F382 K460 A461	P380-S471 WeakPolarHBondContact O-CB 3.12Å; P380-S471 PolarHBondContact O-OG 3.29Å; F382-S471 WeakPolarHBondContact CD2-OG 3.38Å; F382-S471 VanDerWaalsContact CE2-OG 3.27Å; F382-S471 WeakPolarHBondContact CE2-OG 3.44Å; K460-S471 VanDerWaalsContact CA-O 3.3Å; K460-S471 WeakPolarHBondContact CA-O 3.4Å; K460-S471 WeakPolarHBondContact CG-O 3.28Å; A461-S471 PolarHBondContact N-O 2.71Å; A461-S471 PolarHBondContact O-N 2.66Å
472	F	90.1	Very high	85.6	Confident	115 Å²	115	47 Å²	47	50%	0.504	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	136.4	-176.3	-59.9	-98.5	0	0	0	108.8	T458 V459 K460 A470	T458-F472 HydrophobicContact CG2-CB 3.89Å; T458-F472 HydrophobicContact CG2-CD1 3.95Å; T458-F472 HydrophobicContact CG2-CG 4.42Å; V459-F472 CarbonylContact O-C 3.59Å; V459-F472 WeakPolarHBondContact O-CA 3.4Å; K460-F472 HydrophobicContact CB-CD1 3.85Å; K460-F472 HydrophobicContact CB-CE1 3.86Å; K460-F472 HydrophobicContact CD-CE1 3.72Å; K460-F472 HydrophobicContact CD-CZ 3.86Å; K460-F472 HydrophobicContact CG-CD1 3.9Å; K460-F472 HydrophobicContact CG-CE1 3.59Å; K460-F472 HydrophobicContact CG-CE2 4.5Å; K460-F472 HydrophobicContact CG-CZ 3.92Å; A470-F472 HydrophobicContact CB-CE2 4.42Å
473	S	91.1	Very high	85.5	Confident	7 Å²	7	46.8 Å²	46.8	5%	0.049	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	136	172.7	-167.8	0	0	0	0	110.3	A385 T458 V459	A385-S473 PolarHBondContact O-OG 3.39Å; T458-S473 WeakPolarHBondContact CA-O 3.18Å; V459-S473 PolarHBondContact N-O 2.95Å; V459-S473 PolarHBondContact O-N 2.84Å
474	A	92	Very high	85.7	Confident	62 Å²	62	51 Å²	51	51%	0.512	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	127.4	177	0	0	0	0	0	109.9
475	I	93.1	Very high	86.5	Confident	1 Å²	1	51 Å²	51	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.2	-178.3	-49.4	-179.6	0	0	0	108.3	A388 M390 V405 I441 N456 I457 V459 I477	A388-I475 HydrophobicContact CB-CG1 4.39Å; A388-I475 HydrophobicContact CB-CG2 4.36Å; A388-I475 WeakPolarHBondContact O-CA 3.14Å; A388-I475 WeakPolarHBondContact O-CG2 3.4Å; M390-I475 HydrophobicContact CE-CD1 4.32Å; M390-I475 HydrophobicContact CE-CG2 4.17Å; M390-I475 HydrophobicContact CG-CG2 4.01Å; M390-I475 HydrophobicContact SD-CG2 4.02Å; V405-I475 HydrophobicContact CG1-CD1 3.41Å; V405-I475 VanDerWaalsContact CG1-CD1 3.41Å; V405-I475 HydrophobicContact CG1-CG1 4.49Å; I441-I475 HydrophobicContact CD1-CD1 3.56Å; N456-I475 WeakPolarHBondContact CA-O 3.3Å; I457-I475 HydrophobicContact CG1-CB 4.02Å; I457-I475 PolarHBondContact N-O 3.38Å; I457-I475 PolarHBondContact O-N 3.33Å; V459-I475 HydrophobicContact CB-CD1 3.96Å; V459-I475 HydrophobicContact CG2-CD1 3.41Å; V459-I475 VanDerWaalsContact CG2-CD1 3.41Å; V459-I475 HydrophobicContact CG2-CG1 4.34Å; I475-I477 HydrophobicContact CG2-CG1 4.1Å
476	S	93.9	Very high	87.4	Confident	34 Å²	34	47.2 Å²	47.2	24%	0.238	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	106.3	173.6	-63.8	0	0	0	0	109.2	A388 V389 M390 N456	A388-S476 PolarHBondContact O-N 3.01Å; V389-S476 WeakPolarHBondContact CA-O 2.97Å; M390-S476 PolarHBondContact N-O 3.14Å; N456-S476 WeakPolarHBondContact OD1-CA 3.21Å; N456-S476 WeakPolarHBondContact OD1-CB 3.44Å; N456-S476 PolarHBondContact OD1-OG 3.17Å
477	I	94.4	Very high	88.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	110.7	175.8	-56.2	174.3	0	0	0	107.5	M390 V392 V402 F432 W454 H455 I457 I475 I479	M390-I477 HydrophobicContact CB-CG1 4.41Å; M390-I477 CarbonylContact O-C 3.53Å; M390-I477 WeakPolarHBondContact O-CA 3.43Å; V392-I477 HydrophobicContact CG1-CG2 3.79Å; V402-I477 HydrophobicContact CG1-CD1 4.2Å; V402-I477 HydrophobicContact CG1-CG1 4.37Å; V402-I477 HydrophobicContact CG1-CG2 3.8Å; F432-I477 HydrophobicContact CD1-CD1 3.75Å; F432-I477 HydrophobicContact CD2-CD1 4.01Å; F432-I477 HydrophobicContact CE1-CD1 3.62Å; F432-I477 HydrophobicContact CE1-CG2 4.06Å; F432-I477 HydrophobicContact CE2-CD1 3.88Å; F432-I477 HydrophobicContact CG-CD1 3.94Å; F432-I477 HydrophobicContact CZ-CB 4.31Å; F432-I477 HydrophobicContact CZ-CD1 3.69Å; F432-I477 HydrophobicContact CZ-CG2 4Å; W454-I477 WeakPolarHBondContact CA-O 3.17Å; H455-I477 HydrophobicContact CB-CB 4.46Å; H455-I477 PolarHBondContact N-O 3.17Å; H455-I477 PolarHBondContact O-N 2.7Å; I457-I477 HydrophobicContact CD1-CD1 3.63Å; I457-I477 HydrophobicContact CG1-CD1 4.05Å; I475-I477 HydrophobicContact CG2-CG1 4.1Å; I477-I479 HydrophobicContact CG2-CD1 4.18Å
478	R	93.9	Very high	89.1	Confident	75 Å²	75	43.8 Å²	43.8	28%	0.283	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	132.5	172.8	-172.6	-176.6	176.8	-158.6	-2.7	109.4	M390 E391 V392 W454 L480	M390-R478 PolarHBondContact O-N 3.38Å; E391-R478 WeakPolarHBondContact CA-O 3.38Å; E391-R478 HydrophobicContact CG-CB 4.23Å; E391-R478 VanDerWaalsContact OE1-CD 3.25Å; E391-R478 WeakPolarHBondContact OE1-CD 3.15Å; E391-R478 IonicContact OE1-CZ 3.79Å; E391-R478 IonicContact OE1-NE 3.08Å; E391-R478 IonicContact OE1-NH1 2.7Å; E391-R478 PolarHBondContact OE1-NH1 3.36Å; V392-R478 PolarHBondContact N-O 2.92Å; W454-R478 HydrophobicContact CD2-CB 4.16Å; W454-R478 HydrophobicContact CD2-CG 4.16Å; W454-R478 HydrophobicContact CE3-CB 3.85Å; W454-R478 HydrophobicContact CE3-CG 4.32Å; W454-R478 HydrophobicContact CH2-CB 3.75Å; W454-R478 HydrophobicContact CH2-CG 3.86Å; W454-R478 HydrophobicContact CZ2-CB 4.04Å; W454-R478 HydrophobicContact CZ2-CG 3.64Å; W454-R478 HydrophobicContact CZ3-CB 3.64Å; W454-R478 HydrophobicContact CZ3-CG 4.19Å; R478-L480 HydrophobicContact CG-CD2 4.4Å
479	I	92.9	Very high	89.6	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	125.7	170.6	-47.6	-48.4	0	0	0	107.9	V392 E394 L447 R449 A452 G453 I477	V392-I479 HydrophobicContact CG1-CD1 3.73Å; V392-I479 CarbonylContact O-C 3.55Å; V392-I479 WeakPolarHBondContact O-CA 3.34Å; E394-I479 HydrophobicContact CB-CG2 3.78Å; L447-I479 HydrophobicContact CB-CG2 4.49Å; L447-I479 HydrophobicContact CD1-CD1 3.98Å; L447-I479 HydrophobicContact CD2-CD1 3.84Å; L447-I479 HydrophobicContact CG-CD1 4.45Å; R449-I479 HydrophobicContact CB-CB 4.37Å; R449-I479 HydrophobicContact CB-CG2 3.8Å; R449-I479 HydrophobicContact CG-CB 4.11Å; R449-I479 HydrophobicContact CG-CG2 4Å; A452-I479 WeakPolarHBondContact O-CG1 3.19Å; G453-I479 PolarHBondContact O-N 2.95Å; I477-I479 HydrophobicContact CG2-CD1 4.18Å
480	L	90.3	Very high	89.6	Confident	45 Å²	45	37.4 Å²	37.4	24%	0.236	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	137.5	179.4	-64.8	-176.9	0	0	0	110.6	E391 V392 Q393 E394 R478	E391-L480 HydrophobicContact CB-CD1 3.83Å; E391-L480 HydrophobicContact CB-CD2 4.27Å; E391-L480 HydrophobicContact CB-CG 3.96Å; E391-L480 HydrophobicContact CG-CD2 4.5Å; V392-L480 PolarHBondContact O-N 2.73Å; Q393-L480 HydrophobicContact CG-CB 4.21Å; E394-L480 PolarHBondContact N-O 3.43Å; R478-L480 HydrophobicContact CG-CD2 4.4Å
481	D	87.3	Confident	89.2	Confident	36 Å²	36	41.1 Å²	41.1	19%	0.193	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-58	135	-177	-164.7	78.3	0	0	0	113.1	E394 R449 D516 E517	E394-D481 WeakPolarHBondContact OE1-CA 3.48Å; R449-D481 VanDerWaalsContact CD-CA 3.48Å; R449-D481 IonicContact CZ-OD1 2.73Å; R449-D481 IonicContact NE-OD1 3.01Å; R449-D481 IonicContact NH1-OD1 3.67Å; R449-D481 PolarHBondContact NH1-OD1 2.7Å; R449-D481 VanDerWaalsContact NH1-OD1 3.08Å; R449-D481 IonicContact NH2-OD1 2.6Å; R449-D481 PolarHBondContact NH2-OD1 3.13Å; R449-D481 VanDerWaalsContact NH2-OD1 3.15Å; D481-D516 WeakPolarHBondContact OD1-CA 3.34Å; D481-D516 WeakPolarHBondContact OD1-CB 3.43Å; D481-E517 HydrophobicContact CB-CB 4.44Å; D481-E517 PolarHBondContact OD1-N 3.43Å
482	V	88.1	Confident	88.4	Confident	28 Å²	28	43.9 Å²	43.9	17%	0.17	25%	0.248	C	C	.	.			trans	-129.2	127.2	163.5	179.9	0	0	0	0	107.8	Q393 E394 D395 D484	Q393-V482 HydrophobicContact CB-CG2 4.04Å; E394-V482 HydrophobicContact CG-CB 3.99Å; E394-V482 HydrophobicContact CG-CG2 4.07Å; E394-V482 PolarHBondContact OE1-N 3.1Å; D395-V482 HydrophobicContact CB-CG1 4.33Å; D395-V482 HydrophobicContact CB-CG2 4.18Å; V482-D484 VanDerWaalsContact C-N 3.32Å; V482-D484 WeakPolarHBondContact O-CB 3.27Å; V482-D484 PolarHBondContact O-N 3.18Å
483	N	87.3	Confident	87.8	Confident	9 Å²	9	43.4 Å²	43.4	5%	0.048	24%	0.243	C	C	.	.			trans	-68.8	85.1	-174.3	-168.1	125.2	0	0	0	111.5	D516 D573 G575 L579	N483-D516 WeakPolarHBondContact CA-OD2 3.37Å; N483-D573 PolarHBondContact ND2-OD2 3.27Å; N483-G575 WeakPolarHBondContact OD1-CA 3.26Å; N483-L579 VanDerWaalsContact O-CD1 3.31Å; N483-L579 WeakPolarHBondContact O-CD1 3.44Å
484	D	87.1	Confident	87.5	Confident	108 Å²	108	49.1 Å²	49.1	58%	0.578	27%	0.269	S	S	*	.			trans	-110.8	-30	-167.2	161.4	-74	0	0	0	111.9	V482 D516 L579	V482-D484 VanDerWaalsContact C-N 3.32Å; V482-D484 WeakPolarHBondContact O-CB 3.27Å; V482-D484 PolarHBondContact O-N 3.18Å; D484-D516 PolarHBondContact N-OD2 2.77Å; D484-L579 WeakPolarHBondContact O-CD1 3.27Å
485	N	88.1	Confident	87.2	Confident	30 Å²	30	46.6 Å²	46.6	16%	0.16	25%	0.248	C	C	.	.	S	Bend	trans	-87.8	137.9	174.2	-61.9	-93.9	0	0	0	111	E450 R515 D516	E450-N485 PolarHBondContact OE2-ND2 3.25Å; N485-R515 HydrophobicContact CB-CB 3.99Å; N485-R515 HydrophobicContact CB-CG 4.41Å; N485-D516 VanDerWaalsContact CB-OD1 3.25Å; N485-D516 WeakPolarHBondContact CB-OD1 3.37Å; N485-D516 PolarHBondContact N-OD1 2.92Å; N485-D516 PolarHBondContact ND2-OD1 3.19Å
486	P	88.7	Confident	86.8	Confident	59 Å²	59	48.4 Å²	48.4	38%	0.383	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-84.5	141.8	172.9	32.4	-33	0	0	0	111.5	E488 L579	P486-E488 PolarHBondContact O-N 3Å; P486-L579 HydrophobicContact CB-CB 4.11Å
487	P	89.4	Confident	86.5	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-61	123.7	-178.9	20	-33.1	0	0	0	113	V512 D514 F524 V571 D573 S581	P487-V512 HydrophobicContact CB-CG1 3.51Å; P487-D514 WeakPolarHBondContact CA-OD2 3.22Å; P487-D514 WeakPolarHBondContact CB-OD2 3.48Å; P487-F524 HydrophobicContact CB-CD1 3.87Å; P487-F524 HydrophobicContact CB-CE1 3.87Å; P487-F524 HydrophobicContact CG-CD1 4.32Å; P487-V571 HydrophobicContact CB-CG1 3.88Å; P487-V571 HydrophobicContact CG-CB 4.4Å; P487-V571 HydrophobicContact CG-CG1 3.89Å; P487-D573 HydrophobicContact CG-CB 4.03Å; P487-S581 VanDerWaalsContact O-CB 3.25Å; P487-S581 WeakPolarHBondContact O-CB 3.49Å; P487-S581 PolarHBondContact O-OG 3.13Å
488	E	86.8	Confident	85.9	Confident	97 Å²	97	47.1 Å²	47.1	45%	0.453	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	145.5	176.6	-62	-165.6	129.3	0	0	111.4	P486 V512 V513	P486-E488 PolarHBondContact O-N 3Å; E488-V512 CarbonylContact O-C 3.56Å; E488-V512 WeakPolarHBondContact O-CA 3.35Å; E488-V512 WeakPolarHBondContact O-CG1 3.49Å; E488-V513 PolarHBondContact N-O 2.92Å; E488-V513 PolarHBondContact O-N 3.39Å
489	L	86.9	Confident	85.2	Confident	8 Å²	8	46.8 Å²	46.8	4%	0.042	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	139.8	169.4	-73.7	-175.6	0	0	0	109.9	Y493 I510 V571	L489-Y493 HydrophobicContact CB-CD1 4.32Å; L489-Y493 HydrophobicContact CB-CE1 3.81Å; L489-Y493 WeakPolarHBondContact O-CE1 3.21Å; L489-Y493 PolarHBondContact O-OH 2.8Å; L489-I510 HydrophobicContact CD2-CB 4.44Å; L489-I510 HydrophobicContact CD2-CD1 3.66Å; L489-V571 HydrophobicContact CD2-CG2 3.66Å; L489-V571 HydrophobicContact CG-CG2 4.35Å
490	A	83.5	Confident	84.5	Confident	20 Å²	20	51.1 Å²	51.1	17%	0.165	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-68.8	150.3	170.5	0	0	0	0	0	111.3	S511 V513	A490-S511 WeakPolarHBondContact CB-O 3.44Å; A490-S511 VanDerWaalsContact CB-OG 3.23Å; A490-S511 WeakPolarHBondContact CB-OG 3.48Å; A490-S511 PolarHBondContact N-O 2.86Å; A490-V513 HydrophobicContact CB-CG2 4.16Å
491	T	77.4	Confident	84	Confident	107 Å²	107	49 Å²	49	66%	0.656	27%	0.267	S	S	*	.	S	Bend	trans	-78.2	148.6	171.6	49.3	0	0	0	0	111	Y493	T491-Y493 HydrophobicContact CG2-CD2 4.15Å; T491-Y493 HydrophobicContact CG2-CE1 4.13Å; T491-Y493 HydrophobicContact CG2-CE2 3.62Å
492	P	73.5	Confident	83.7	Confident	79 Å²	79	54.2 Å²	54.2	51%	0.513	29%	0.289	S	S	.	.	P	Polyproline II helix	cis	-86.6	149.5	8.4	34.7	-35.8	0	0	0	115	E494	P492-E494 PolarHBondContact O-N 2.94Å
493	Y	78.6	Confident	83.5	Confident	104 Å²	104	56.7 Å²	56.7	41%	0.408	31%	0.305	S	S	.	.			trans	-85.8	18.8	174.7	-52.5	-49.7	0	0	0	114.1	L489 T491 T586	L489-Y493 HydrophobicContact CB-CD1 4.32Å; L489-Y493 HydrophobicContact CB-CE1 3.81Å; L489-Y493 WeakPolarHBondContact O-CE1 3.21Å; L489-Y493 PolarHBondContact O-OH 2.8Å; T491-Y493 HydrophobicContact CG2-CD2 4.15Å; T491-Y493 HydrophobicContact CG2-CE1 4.13Å; T491-Y493 HydrophobicContact CG2-CE2 3.62Å; Y493-T586 PolarHBondContact O-N 3.46Å
494	E	84.9	Confident	83.2	Confident	128 Å²	128	58 Å²	58	60%	0.598	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.2	131.4	-177.8	-67.1	-175.8	178.1	0	0	110.6	P492 T586	P492-E494 PolarHBondContact O-N 2.94Å; E494-T586 WeakPolarHBondContact CA-O 3.3Å
495	A	85.3	Confident	83	Confident	8 Å²	8	56.3 Å²	56.3	7%	0.066	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	157.6	171.7	0	0	0	0	0	110.1	I507 H508 L585 T586 I587 H588	A495-I507 HydrophobicContact CB-CG2 4.15Å; A495-H508 HydrophobicContact CB-CB 3.89Å; A495-L585 HydrophobicContact CB-CD1 4.26Å; A495-L585 HydrophobicContact CB-CD2 4.06Å; A495-L585 HydrophobicContact CB-CG 4.35Å; A495-T586 PolarHBondContact N-O 2.96Å; A495-I587 HydrophobicContact CB-CG1 4.5Å; A495-I587 CarbonylContact O-C 3.59Å; A495-I587 WeakPolarHBondContact O-CA 3.48Å; A495-H588 PolarHBondContact O-N 2.87Å
496	A	85.1	Confident	82.9	Confident	39 Å²	39	58.9 Å²	58.9	32%	0.322	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	144.1	179.9	0	0	0	0	0	110.4	H588 I600	A496-H588 WeakPolarHBondContact CA-O 3.31Å; A496-I600 HydrophobicContact CB-CD1 3.62Å
497	I	86.4	Confident	82.8	Confident	4 Å²	4	57.2 Å²	57.2	2%	0.021	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	149.1	179.1	-161.3	-174.9	0	0	0	111.1	A501 I507 T552 F557 I587 H588 V589 C590	I497-A501 HydrophobicContact CD1-CB 3.65Å; I497-A501 HydrophobicContact CG1-CB 3.73Å; I497-I507 HydrophobicContact CB-CG2 4.28Å; I497-I507 HydrophobicContact CD1-CD1 3.66Å; I497-I507 HydrophobicContact CD1-CG1 3.74Å; I497-I507 HydrophobicContact CG1-CD1 4.49Å; I497-I507 HydrophobicContact CG1-CG1 4.16Å; I497-T552 HydrophobicContact CD1-CG2 3.36Å; I497-F557 HydrophobicContact CD1-CD2 4.27Å; I497-F557 HydrophobicContact CD1-CE2 3.99Å; I497-F557 HydrophobicContact CD1-CZ 4.41Å; I497-I587 HydrophobicContact CB-CG2 4.14Å; I497-I587 HydrophobicContact CG2-CG2 3.76Å; I497-H588 PolarHBondContact N-O 2.98Å; I497-V589 HydrophobicContact CG2-CB 4.5Å; I497-V589 HydrophobicContact CG2-CG2 4.08Å; I497-V589 WeakPolarHBondContact O-CA 3.33Å; I497-C590 PolarHBondContact O-N 2.92Å
498	C	82.3	Confident	82.6	Confident	3 Å²	3	59.9 Å²	59.9	2%	0.02	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	148.7	170.1	-155.8	0	0	0	0	113.5	D500 A501 C592	C498-D500 VanDerWaalsContact C-N 3.3Å; C498-D500 PolarHBondContact O-N 2.8Å; C498-D500 PolarHBondContact SG-OD1 2.97Å; C498-A501 HydrophobicContact CB-CB 4.32Å; C498-A501 VanDerWaalsContact O-CB 3.27Å; C498-A501 WeakPolarHBondContact O-CB 3.5Å; C498-A501 PolarHBondContact O-N 2.91Å; C498-C592 WeakPolarHBondContact CA-SG 3.35Å; C498-C592 HydrophobicContact CB-CB 4.29Å; C498-C592 WeakPolarHBondContact CB-SG 3.03Å; C498-C592 WeakPolarHBondContact SG-CB 3.21Å; C498-C592 CovalentContact SG-SG 2.01Å; C498-C592 PolarHBondContact SG-SG 3.05Å
499	E	80.3	Confident	82.6	Confident	69 Å²	69	58.2 Å²	58.2	32%	0.322	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-27	170	57.7	-165.5	154.5	0	0	114.1	F557 R559 V589 C590 G591	E499-F557 WeakPolarHBondContact CA-O 3.22Å; E499-F557 WeakPolarHBondContact CB-O 3.45Å; E499-F557 PolarHBondContact O-N 3.48Å; E499-R559 HydrophobicContact CB-CB 4.44Å; E499-R559 VanDerWaalsContact OE2-CB 3.24Å; E499-R559 WeakPolarHBondContact OE2-CB 3.44Å; E499-V589 HydrophobicContact CB-CG1 3.86Å; E499-C590 PolarHBondContact N-O 3.31Å; E499-G591 WeakPolarHBondContact OE1-CA 2.98Å
500	D	78.3	Confident	82.7	Confident	93 Å²	93	58.1 Å²	58.1	50%	0.497	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	1.6	177.3	93.2	-29	0	0	0	114.6	C498 K502	C498-D500 VanDerWaalsContact C-N 3.3Å; C498-D500 PolarHBondContact O-N 2.8Å; C498-D500 PolarHBondContact SG-OD1 2.97Å; D500-K502 PolarHBondContact O-N 3.42Å
501	A	79.4	Confident	82.8	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-56.2	125	-166.1	0	0	0	0	0	113.2	I497 C498 T552	I497-A501 HydrophobicContact CD1-CB 3.65Å; I497-A501 HydrophobicContact CG1-CB 3.73Å; C498-A501 HydrophobicContact CB-CB 4.32Å; C498-A501 VanDerWaalsContact O-CB 3.27Å; C498-A501 WeakPolarHBondContact O-CB 3.5Å; C498-A501 PolarHBondContact O-N 2.91Å; A501-T552 HydrophobicContact CB-CG2 4.06Å
502	K	81.1	Confident	83.2	Confident	146 Å²	146	54.7 Å²	54.7	64%	0.635	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-76.9	150.9	-173.6	-66.4	162.4	-171.4	156.6	0	110.4	D500 G504 Q505 T552	D500-K502 PolarHBondContact O-N 3.42Å; K502-G504 PolarHBondContact O-N 2.72Å; K502-Q505 VanDerWaalsContact N-OE1 3.13Å; K502-Q505 VanDerWaalsContact O-CB 3.22Å; K502-Q505 WeakPolarHBondContact O-CB 3.35Å; K502-Q505 PolarHBondContact O-N 2.89Å; K502-T552 PolarHBondContact O-OG1 3.38Å
503	P	83	Confident	83.7	Confident	80 Å²	80	54.6 Å²	54.6	52%	0.519	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	137.1	176.2	-23.3	33.7	0	0	0	112.6	T552	P503-T552 WeakPolarHBondContact CA-OG1 3.16Å
504	G	80.4	Confident	84.2	Confident	36 Å²	36	50.9 Å²	50.9	37%	0.371	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.6	-2.6	-179.7	0	0	0	0	0	115.8	K502 R551 T552	K502-G504 PolarHBondContact O-N 2.72Å; G504-R551 WeakPolarHBondContact O-CD 3.31Å; G504-R551 PolarHBondContact O-NH1 3.15Å; G504-R551 VanDerWaalsContact O-NH1 3.1Å; G504-T552 PolarHBondContact N-O 3.29Å; G504-T552 PolarHBondContact N-OG1 3.14Å
505	Q	84.6	Confident	84.2	Confident	73 Å²	73	52 Å²	52	34%	0.341	28%	0.281	S	S	.	.			trans	-66.1	134.2	174.2	-178.7	170.6	-11	0	0	110.6	K502 R551 T552	K502-Q505 VanDerWaalsContact N-OE1 3.13Å; K502-Q505 VanDerWaalsContact O-CB 3.22Å; K502-Q505 WeakPolarHBondContact O-CB 3.35Å; K502-Q505 PolarHBondContact O-N 2.89Å; Q505-R551 WeakPolarHBondContact O-CA 3.35Å; Q505-R551 WeakPolarHBondContact O-CB 3.45Å; Q505-T552 PolarHBondContact N-OG1 3.06Å; Q505-T552 PolarHBondContact O-N 2.86Å; Q505-T552 PolarHBondContact O-OG1 2.75Å
506	L	85	Confident	84.1	Confident	83 Å²	83	52 Å²	52	44%	0.435	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	133.5	174.9	-173.8	71.2	0	0	0	109.7	R551	L506-R551 HydrophobicContact CD1-CG 4.33Å
507	I	86	Confident	83.3	Confident	25 Å²	25	54 Å²	54	13%	0.128	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-52	179.7	-56.2	169.2	0	0	0	109.4	A495 I497 F538 I550 T552 I587	A495-I507 HydrophobicContact CB-CG2 4.15Å; I497-I507 HydrophobicContact CB-CG2 4.28Å; I497-I507 HydrophobicContact CD1-CD1 3.66Å; I497-I507 HydrophobicContact CD1-CG1 3.74Å; I497-I507 HydrophobicContact CG1-CD1 4.49Å; I497-I507 HydrophobicContact CG1-CG1 4.16Å; I507-F538 HydrophobicContact CD1-CD1 3.42Å; I507-F538 VanDerWaalsContact CD1-CD1 3.42Å; I507-F538 HydrophobicContact CD1-CE1 3.6Å; I507-I550 HydrophobicContact CD1-CG2 4.34Å; I507-I550 PolarHBondContact N-O 3.39Å; I507-T552 HydrophobicContact CD1-CG2 4.09Å; I507-T552 HydrophobicContact CG1-CG2 4.32Å; I507-I587 HydrophobicContact CD1-CD1 4.48Å; I507-I587 HydrophobicContact CG2-CG2 4.21Å
508	H	85.6	Confident	82.1	Confident	56 Å²	56	58.8 Å²	58.8	26%	0.259	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	159.6	-179.6	-160.3	55.1	0	0	0	109.9	A495 I550 L585	A495-H508 HydrophobicContact CB-CB 3.89Å; H508-I550 PolarHBondContact O-N 2.86Å; H508-L585 HydrophobicContact CB-CD2 4.48Å
509	T	88.1	Confident	80.9	Confident	61 Å²	61	63.9 Å²	63.9	37%	0.374	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	113.3	168.8	-62.4	0	0	0	0	106.9	T547 A548	T509-T547 HydrophobicContact CG2-CG2 4.26Å; T509-T547 VanDerWaalsContact CG2-OG1 3.25Å; T509-T547 WeakPolarHBondContact CG2-OG1 3.46Å; T509-A548 WeakPolarHBondContact CA-O 3.5Å
510	I	87.6	Confident	79.7	Confident	7 Å²	7	65.8 Å²	65.8	4%	0.036	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	140.1	177.9	51.1	156.6	0	0	0	110.4	L489 F526 L540 T547 A548 I550 I569 L585	L489-I510 HydrophobicContact CD2-CB 4.44Å; L489-I510 HydrophobicContact CD2-CD1 3.66Å; I510-F526 HydrophobicContact CD1-CD1 3.74Å; I510-F526 HydrophobicContact CD1-CE1 3.82Å; I510-F526 HydrophobicContact CG1-CE1 4.36Å; I510-L540 HydrophobicContact CD1-CD1 4.49Å; I510-T547 VanDerWaalsContact O-CA 3.29Å; I510-T547 WeakPolarHBondContact O-CA 3.24Å; I510-T547 VanDerWaalsContact O-CB 3.27Å; I510-T547 WeakPolarHBondContact O-CB 3.2Å; I510-A548 HydrophobicContact CD1-CB 4.13Å; I510-A548 HydrophobicContact CG1-CB 3.91Å; I510-A548 WeakPolarHBondContact CG1-O 3.28Å; I510-A548 PolarHBondContact N-O 2.92Å; I510-A548 PolarHBondContact O-N 2.64Å; I510-I550 HydrophobicContact CD1-CD1 4.4Å; I510-I550 HydrophobicContact CG1-CD1 4.15Å; I510-I550 HydrophobicContact CG2-CD1 3.89Å; I510-I569 HydrophobicContact CD1-CD1 3.68Å; I510-I569 HydrophobicContact CD1-CG2 3.95Å; I510-L585 HydrophobicContact CG2-CD2 4.43Å
511	S	86.3	Confident	78.8	Confident	52 Å²	52	64.5 Å²	64.5	36%	0.364	37%	0.373	S	S	.	.			trans	-112.8	173.5	168.6	53	0	0	0	0	110.5	A490	A490-S511 WeakPolarHBondContact CB-O 3.44Å; A490-S511 VanDerWaalsContact CB-OG 3.23Å; A490-S511 WeakPolarHBondContact CB-OG 3.48Å; A490-S511 PolarHBondContact N-O 2.86Å
512	V	85.3	Confident	78.4	Confident	3 Å²	3	66 Å²	66	2%	0.018	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	141.5	-175.7	170.5	0	0	0	0	109.1	P487 E488 Q519 F524 F526 V571	P487-V512 HydrophobicContact CB-CG1 3.51Å; E488-V512 CarbonylContact O-C 3.56Å; E488-V512 WeakPolarHBondContact O-CA 3.35Å; E488-V512 WeakPolarHBondContact O-CG1 3.49Å; V512-Q519 PolarHBondContact O-NE2 3.18Å; V512-F524 HydrophobicContact CB-CD2 3.78Å; V512-F524 HydrophobicContact CB-CE2 4.02Å; V512-F524 HydrophobicContact CB-CG 4.06Å; V512-F524 HydrophobicContact CG1-CD1 3.83Å; V512-F524 HydrophobicContact CG1-CD2 3.88Å; V512-F524 HydrophobicContact CG1-CE1 3.82Å; V512-F524 HydrophobicContact CG1-CE2 3.85Å; V512-F524 HydrophobicContact CG1-CG 3.88Å; V512-F524 HydrophobicContact CG1-CZ 3.83Å; V512-F524 HydrophobicContact CG2-CB 4.35Å; V512-F524 HydrophobicContact CG2-CD2 4.26Å; V512-F524 HydrophobicContact CG2-CG 4.18Å; V512-F526 HydrophobicContact CG2-CE1 3.44Å; V512-F526 VanDerWaalsContact CG2-CE1 3.44Å; V512-F526 HydrophobicContact CG2-CZ 3.49Å; V512-F526 VanDerWaalsContact CG2-CZ 3.49Å; V512-V571 HydrophobicContact CG1-CG1 4.43Å; V512-V571 HydrophobicContact CG2-CG1 3.75Å; V512-V571 HydrophobicContact CG2-CG2 4.34Å
513	V	85.1	Confident	78.4	Confident	76 Å²	76	64.3 Å²	64.3	46%	0.461	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	127.2	164.2	-178.5	0	0	0	0	106.8	E488 A490	E488-V513 PolarHBondContact N-O 2.92Å; E488-V513 PolarHBondContact O-N 3.39Å; A490-V513 HydrophobicContact CB-CG2 4.16Å
514	D	87.3	Confident	78.5	Confident	27 Å²	27	60.6 Å²	60.6	14%	0.144	35%	0.346	C	S	.	.			trans	-123.6	157.4	170.5	-145.2	-31.2	0	0	0	108.2	P487 F524	P487-D514 WeakPolarHBondContact CA-OD2 3.22Å; P487-D514 WeakPolarHBondContact CB-OD2 3.48Å; D514-F524 HydrophobicContact CB-CE1 4.01Å; D514-F524 HydrophobicContact CB-CZ 3.8Å; D514-F524 WeakPolarHBondContact OD2-CE1 3.31Å
515	R	86.1	Confident	78.8	Confident	152 Å²	152	63.4 Å²	63.4	57%	0.574	35%	0.348	S	S	*	.	S	Bend	trans	-102.5	-30.6	-169.7	-61.7	-167.5	-178.2	-174.4	5.3	114.5	E450 N485	E450-R515 HydrophobicContact CG-CB 3.79Å; N485-R515 HydrophobicContact CB-CB 3.99Å; N485-R515 HydrophobicContact CB-CG 4.41Å
516	D	82.9	Confident	79	Confident	6 Å²	6	60.8 Å²	60.8	3%	0.032	34%	0.335	C	S	.	.	S	Bend	trans	-56.9	-98.8	-171.8	-55.3	-15.7	0	0	0	112.6	R449 D481 N483 D484 N485	R449-D516 PolarHBondContact NH1-O 3.01Å; R449-D516 PolarHBondContact NH2-O 3.18Å; D481-D516 WeakPolarHBondContact OD1-CA 3.34Å; D481-D516 WeakPolarHBondContact OD1-CB 3.43Å; N483-D516 WeakPolarHBondContact CA-OD2 3.37Å; D484-D516 PolarHBondContact N-OD2 2.77Å; N485-D516 VanDerWaalsContact CB-OD1 3.25Å; N485-D516 WeakPolarHBondContact CB-OD1 3.37Å; N485-D516 PolarHBondContact N-OD1 2.92Å; N485-D516 PolarHBondContact ND2-OD1 3.19Å
517	E	67.5	Low	79.1	Confident	82 Å²	82	59.8 Å²	59.8	38%	0.383	33%	0.333	S	S	.	.	S	Bend	trans	-113.8	144.5	178.2	-151.6	148.4	-107.2	0	0	111.9	R449 D481 H522	R449-E517 IonicContact CZ-OE1 3.48Å; R449-E517 IonicContact NE-OE1 3.79Å; R449-E517 VanDerWaalsContact NH2-CG 3.29Å; R449-E517 IonicContact NH2-OE1 2.81Å; R449-E517 PolarHBondContact NH2-OE1 3.25Å; D481-E517 HydrophobicContact CB-CB 4.44Å; D481-E517 PolarHBondContact OD1-N 3.43Å; E517-H522 PolarHBondContact O-CD2 3.23Å
518	P	62.8	Low	79.1	Confident	104 Å²	104	60.2 Å²	60.2	68%	0.675	34%	0.335	S	S	*	.			trans	-62.6	149.7	-160.5	19.3	-30.8	0	0	0	114.5	A520 G521	P518-A520 PolarHBondContact O-N 3.39Å; P518-G521 PolarHBondContact O-N 3.41Å
519	Q	55.3	Low	79	Confident	111 Å²	111	59.2 Å²	59.2	52%	0.519	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.9	-4.3	-166.7	-62.6	173.9	-33.5	0	0	118.6	V512 N546	V512-Q519 PolarHBondContact O-NE2 3.18Å; Q519-N546 PolarHBondContact O-ND2 3.09Å
520	A	55.5	Low	78.4	Confident	108 Å²	108	61.3 Å²	61.3	89%	0.893	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-22	173.6	0	0	0	0	0	113.8	P518	P518-A520 PolarHBondContact O-N 3.39Å
521	G	59.9	Low	77.8	Confident	66 Å²	66	68.9 Å²	68.9	68%	0.68	39%	0.386	S	S	*	.	S	Bend	trans	-92.6	-37.3	-178.7	0	0	0	0	0	115.3	P518	P518-G521 PolarHBondContact O-N 3.41Å
522	H	70.5	Confident	77.2	Confident	32 Å²	32	67 Å²	67	15%	0.148	37%	0.374	C	S	.	.			trans	-94.3	157.3	-167.3	-60.1	-120.2	0	0	0	111.3	E517 F524 N546	E517-H522 PolarHBondContact O-CD2 3.23Å; H522-F524 HydrophobicContact CB-CZ 4.34Å; H522-N546 PolarHBondContact O-ND2 2.97Å
523	R	81.1	Confident	76.5	Confident	110 Å²	110	69.3 Å²	69.3	42%	0.415	39%	0.393	S	S	.	.			trans	-128.7	121.5	173.9	-177.7	179.8	177	-164.2	-2.5	112	F525 D542 N546 D573 S574	R523-F525 HydrophobicContact CG-CZ 4.41Å; R523-D542 IonicContact CZ-OD2 2.76Å; R523-D542 IonicContact NH2-OD2 2.71Å; R523-D542 PolarHBondContact NH2-OD2 2.84Å; R523-N546 WeakPolarHBondContact CA-OD1 3.38Å; R523-D573 CarbonylContact O-C 3.58Å; R523-S574 PolarHBondContact N-OG 2.84Å; R523-S574 WeakPolarHBondContact O-CB 3.33Å; R523-S574 PolarHBondContact O-N 2.87Å
524	F	85.8	Confident	75.7	Confident	3 Å²	3	69.9 Å²	69.9	1%	0.013	40%	0.4	C	S	.	.			trans	-85.7	137.5	178.2	-52.3	-64.6	0	0	0	112.5	P487 V512 D514 H522 F526 N546 V571 V572 D573	P487-F524 HydrophobicContact CB-CD1 3.87Å; P487-F524 HydrophobicContact CB-CE1 3.87Å; P487-F524 HydrophobicContact CG-CD1 4.32Å; V512-F524 HydrophobicContact CB-CD2 3.78Å; V512-F524 HydrophobicContact CB-CE2 4.02Å; V512-F524 HydrophobicContact CB-CG 4.06Å; V512-F524 HydrophobicContact CG1-CD1 3.83Å; V512-F524 HydrophobicContact CG1-CD2 3.88Å; V512-F524 HydrophobicContact CG1-CE1 3.82Å; V512-F524 HydrophobicContact CG1-CE2 3.85Å; V512-F524 HydrophobicContact CG1-CG 3.88Å; V512-F524 HydrophobicContact CG1-CZ 3.83Å; V512-F524 HydrophobicContact CG2-CB 4.35Å; V512-F524 HydrophobicContact CG2-CD2 4.26Å; V512-F524 HydrophobicContact CG2-CG 4.18Å; D514-F524 HydrophobicContact CB-CE1 4.01Å; D514-F524 HydrophobicContact CB-CZ 3.8Å; D514-F524 WeakPolarHBondContact OD2-CE1 3.31Å; H522-F524 HydrophobicContact CB-CZ 4.34Å; F524-F526 HydrophobicContact CB-CD2 4.46Å; F524-F526 HydrophobicContact CB-CE2 3.81Å; F524-F526 HydrophobicContact CB-CZ 4.01Å; F524-N546 HydrophobicContact CD2-CB 3.93Å; F524-N546 HydrophobicContact CE2-CB 4.36Å; F524-N546 PolarHBondContact N-OD1 2.67Å; F524-V571 HydrophobicContact CB-CG1 4.1Å; F524-V571 HydrophobicContact CD1-CG1 4.42Å; F524-V572 CarbonylContact C-O 3.59Å; F524-V572 WeakPolarHBondContact CA-O 3.41Å; F524-D573 HydrophobicContact CD1-CB 4.31Å; F524-D573 HydrophobicContact CE1-CB 4.27Å
525	F	86.7	Confident	75	Confident	94 Å²	94	71 Å²	71	41%	0.412	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	115.1	174.7	-62.4	-82.3	0	0	0	109.9	R523 V572	R523-F525 HydrophobicContact CG-CZ 4.41Å; F525-V572 HydrophobicContact CB-CB 4.39Å; F525-V572 PolarHBondContact N-O 3.2Å; F525-V572 PolarHBondContact O-N 3.46Å
526	F	88.6	Confident	74.5	Confident	18 Å²	18	72.5 Å²	72.5	8%	0.079	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	129.4	-175.8	-60.4	-96	0	0	0	110.9	I510 V512 F524 L540 N546 A548 I569 V571	I510-F526 HydrophobicContact CD1-CD1 3.74Å; I510-F526 HydrophobicContact CD1-CE1 3.82Å; I510-F526 HydrophobicContact CG1-CE1 4.36Å; V512-F526 HydrophobicContact CG2-CE1 3.44Å; V512-F526 VanDerWaalsContact CG2-CE1 3.44Å; V512-F526 HydrophobicContact CG2-CZ 3.49Å; V512-F526 VanDerWaalsContact CG2-CZ 3.49Å; F524-F526 HydrophobicContact CB-CD2 4.46Å; F524-F526 HydrophobicContact CB-CE2 3.81Å; F524-F526 HydrophobicContact CB-CZ 4.01Å; F526-L540 HydrophobicContact CB-CD1 3.94Å; F526-L540 HydrophobicContact CB-CD2 3.49Å; F526-L540 VanDerWaalsContact CB-CD2 3.49Å; F526-L540 HydrophobicContact CB-CG 4.35Å; F526-N546 WeakPolarHBondContact CZ-O 3.43Å; F526-A548 HydrophobicContact CB-CB 3.8Å; F526-A548 HydrophobicContact CD1-CB 3.59Å; F526-A548 HydrophobicContact CD2-CB 3.63Å; F526-A548 HydrophobicContact CE1-CB 3.95Å; F526-A548 HydrophobicContact CE2-CB 3.99Å; F526-A548 HydrophobicContact CG-CB 3.4Å; F526-A548 VanDerWaalsContact CG-CB 3.4Å; F526-A548 HydrophobicContact CZ-CB 4.14Å; F526-I569 HydrophobicContact CD1-CG2 4.46Å; F526-V571 HydrophobicContact CD1-CG1 4.49Å; F526-V571 HydrophobicContact CD1-CG2 3.93Å; F526-V571 HydrophobicContact CE1-CG1 4.38Å; F526-V571 HydrophobicContact CE1-CG2 4.12Å
527	T	87.2	Confident	74.4	Confident	63 Å²	63	73.9 Å²	73.9	39%	0.387	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	153.6	177.9	60.9	0	0	0	0	111.8	L570	T527-L570 PolarHBondContact N-O 3.39Å; T527-L570 PolarHBondContact O-N 2.81Å; T527-L570 WeakPolarHBondContact OG1-CB 3.34Å; T527-L570 PolarHBondContact OG1-O 3.08Å
528	L	86.6	Confident	75.3	Confident	33 Å²	33	70.4 Å²	70.4	17%	0.173	41%	0.406	C	S	.	.			trans	-94.9	127.2	168.6	-63.9	-177.5	0	0	0	108.5	A532 A533 L540 L567 I569	L528-A532 HydrophobicContact CB-CB 4.41Å; L528-A533 HydrophobicContact CB-CB 4.17Å; L528-L540 HydrophobicContact CD1-CB 4.42Å; L528-L540 HydrophobicContact CD2-CB 4.42Å; L528-L540 HydrophobicContact CD2-CD1 4.38Å; L528-L540 HydrophobicContact CG-CB 4.17Å; L528-L567 HydrophobicContact CD1-CD1 4.31Å; L528-L567 HydrophobicContact CD2-CD1 3.73Å; L528-L567 HydrophobicContact CD2-CD2 4.38Å; L528-L567 HydrophobicContact CD2-CG 4.07Å; L528-I569 HydrophobicContact CD2-CG1 3.96Å
529	P	82.9	Confident	76.5	Confident	35 Å²	35	67.9 Å²	67.9	23%	0.227	39%	0.389	C	S	.	.			trans	-53.6	149.4	171.7	-26.7	36.1	0	0	0	111.6	E531 A532 A533 P568 L570 T582	P529-E531 PolarHBondContact O-N 2.83Å; P529-A532 PolarHBondContact O-N 2.92Å; P529-A533 PolarHBondContact O-N 2.95Å; P529-P568 WeakPolarHBondContact CD-O 3.27Å; P529-P568 HydrophobicContact CG-CB 4.27Å; P529-P568 HydrophobicContact CG-CG 4.35Å; P529-L570 HydrophobicContact CG-CB 4.31Å; P529-T582 HydrophobicContact CG-CG2 4.49Å
530	S	76.7	Confident	78	Confident	106 Å²	106	64.4 Å²	64.4	74%	0.741	37%	0.373	S	S	*	.	H	α-helix	trans	-49	-35.9	-172	-55.8	0	0	0	0	114.2	S534	S530-S534 VanDerWaalsContact O-CB 3.3Å; S530-S534 WeakPolarHBondContact O-CB 3.35Å; S530-S534 PolarHBondContact O-N 2.65Å
531	E	74.1	Confident	79.4	Confident	166 Å²	166	63.8 Å²	63.8	78%	0.776	35%	0.348	S	S	*	.	H	α-helix	trans	-66.3	-52.2	177.8	-64.6	168.7	177.6	0	0	111.6	P529 S534 S535	P529-E531 PolarHBondContact O-N 2.83Å; E531-S534 PolarHBondContact O-N 3.13Å; E531-S534 PolarHBondContact O-OG 3.32Å; E531-S535 PolarHBondContact O-N 3.03Å
532	A	73.1	Confident	80.3	Confident	13 Å²	13	63.1 Å²	63.1	11%	0.107	33%	0.329	C	S	.	.	H	α-helix	trans	-62.4	-44.3	176.3	0	0	0	0	0	111.8	L528 P529 S534 S535 L567 P568	L528-A532 HydrophobicContact CB-CB 4.41Å; P529-A532 PolarHBondContact O-N 2.92Å; A532-S534 VanDerWaalsContact C-N 3.31Å; A532-S534 PolarHBondContact O-N 3.39Å; A532-S535 WeakPolarHBondContact O-CB 3.26Å; A532-S535 PolarHBondContact O-N 2.85Å; A532-S535 VanDerWaalsContact O-N 3.14Å; A532-S535 PolarHBondContact O-OG 2.66Å; A532-L567 HydrophobicContact CB-CD1 4.19Å; A532-P568 HydrophobicContact CB-CG 3.98Å
533	A	70.2	Confident	80.7	Confident	50 Å²	50	63.5 Å²	63.5	41%	0.413	33%	0.333	S	S	.	.	H	α-helix	trans	-61.5	-35.8	176.5	0	0	0	0	0	112.7	L528 P529 S535	L528-A533 HydrophobicContact CB-CB 4.17Å; P529-A533 PolarHBondContact O-N 2.95Å; A533-S535 PolarHBondContact O-N 2.72Å
534	S	69.1	Low	80.3	Confident	88 Å²	88	66.5 Å²	66.5	62%	0.615	35%	0.349	S	S	*	.	H	α-helix	trans	-65.1	-26.5	176.8	79.5	0	0	0	0	113.4	S530 E531 A532 R536	S530-S534 VanDerWaalsContact O-CB 3.3Å; S530-S534 WeakPolarHBondContact O-CB 3.35Å; S530-S534 PolarHBondContact O-N 2.65Å; E531-S534 PolarHBondContact O-N 3.13Å; E531-S534 PolarHBondContact O-OG 3.32Å; A532-S534 VanDerWaalsContact C-N 3.31Å; A532-S534 PolarHBondContact O-N 3.39Å; S534-R536 VanDerWaalsContact C-N 3.3Å; S534-R536 PolarHBondContact O-N 3.21Å
535	S	72.7	Confident	79.8	Confident	50 Å²	50	71 Å²	71	35%	0.35	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-20.6	-172.1	81.9	0	0	0	0	114.4	E531 A532 A533 H537	E531-S535 PolarHBondContact O-N 3.03Å; A532-S535 WeakPolarHBondContact O-CB 3.26Å; A532-S535 PolarHBondContact O-N 2.85Å; A532-S535 VanDerWaalsContact O-N 3.14Å; A532-S535 PolarHBondContact O-OG 2.66Å; A533-S535 PolarHBondContact O-N 2.72Å; S535-H537 PolarHBondContact O-N 2.83Å; S535-H537 PolarHBondContact O-ND1 2.69Å; S535-H537 VanDerWaalsContact O-ND1 3.12Å; S535-H537 PolarHBondContact OG-ND1 3.34Å
536	R	74.9	Confident	79.4	Confident	185 Å²	185	68.3 Å²	68.3	70%	0.698	36%	0.364	S	S	*	.			trans	52.8	20.9	-178.1	-58.1	-175.8	-178.6	-168.8	-0.3	116.3	S534 Q553	S534-R536 VanDerWaalsContact C-N 3.3Å; S534-R536 PolarHBondContact O-N 3.21Å; R536-Q553 VanDerWaalsContact CA-OE1 3.24Å; R536-Q553 WeakPolarHBondContact O-CB 3.44Å
537	H	81.5	Confident	79.2	Confident	35 Å²	35	68.6 Å²	68.6	16%	0.162	37%	0.367	C	S	.	.	S	Bend	trans	-75	-45.4	173.8	-71.7	92.2	0	0	0	111.4	S535 Q553 K554 F557 Y565	S535-H537 PolarHBondContact O-N 2.83Å; S535-H537 PolarHBondContact O-ND1 2.69Å; S535-H537 VanDerWaalsContact O-ND1 3.12Å; S535-H537 PolarHBondContact OG-ND1 3.34Å; H537-Q553 PolarHBondContact O-N 2.72Å; H537-K554 WeakPolarHBondContact CD2-CD 2.85Å; H537-K554 PolarHBondContact NE2-NZ 3.03Å; H537-K554 PolarHBondContact O-N 2.76Å; H537-F557 HydrophobicContact CB-CE1 4.23Å; H537-F557 AromaticContact CD2-CE1 3.96Å; H537-Y565 AromaticContact CD2-CE1 3.56Å; H537-Y565 AromaticContact CD2-CZ 3.86Å; H537-Y565 AromaticContact CG-CE1 3.81Å; H537-Y565 AromaticContact NE2-CE1 3.81Å
538	F	87	Confident	79.2	Confident	8 Å²	8	65.6 Å²	65.6	4%	0.035	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	151.8	-172.1	-49.9	-69.7	0	0	0	111.3	I507 I550 R551 F557 Y565 L567 I587	I507-F538 HydrophobicContact CD1-CD1 3.42Å; I507-F538 VanDerWaalsContact CD1-CD1 3.42Å; I507-F538 HydrophobicContact CD1-CE1 3.6Å; F538-I550 HydrophobicContact CB-CG2 4.41Å; F538-R551 CarbonylContact C-O 3.55Å; F538-R551 VanDerWaalsContact CA-O 3.25Å; F538-R551 WeakPolarHBondContact CA-O 3.4Å; F538-F557 HydrophobicContact CD1-CZ 4.22Å; F538-F557 AromaticContact CE1-CE1 3.6Å; F538-F557 HydrophobicContact CE1-CE1 3.6Å; F538-F557 AromaticContact CE1-CZ 3.59Å; F538-F557 HydrophobicContact CE1-CZ 3.59Å; F538-F557 HydrophobicContact CZ-CD1 4.5Å; F538-F557 AromaticContact CZ-CE1 3.61Å; F538-F557 HydrophobicContact CZ-CE1 3.61Å; F538-F557 HydrophobicContact CZ-CZ 4.1Å; F538-Y565 AromaticContact CE2-CD1 3.84Å; F538-Y565 HydrophobicContact CE2-CD1 3.84Å; F538-Y565 HydrophobicContact CE2-CD2 4.46Å; F538-Y565 AromaticContact CE2-CG 3.76Å; F538-Y565 HydrophobicContact CE2-CG 3.76Å; F538-Y565 HydrophobicContact CZ-CD1 4.25Å; F538-Y565 HydrophobicContact CZ-CD2 4.1Å; F538-Y565 AromaticContact CZ-CG 3.85Å; F538-Y565 HydrophobicContact CZ-CG 3.85Å; F538-L567 HydrophobicContact CB-CD1 4.49Å; F538-L567 HydrophobicContact CB-CD2 4.14Å; F538-L567 HydrophobicContact CD2-CD1 4.16Å; F538-L567 HydrophobicContact CD2-CD2 4.26Å; F538-L567 HydrophobicContact CG-CD2 4.31Å; F538-I587 HydrophobicContact CD1-CD1 4.16Å; F538-I587 HydrophobicContact CD2-CD1 4.22Å; F538-I587 HydrophobicContact CE1-CD1 3.96Å; F538-I587 HydrophobicContact CE1-CG2 4.36Å; F538-I587 HydrophobicContact CE2-CD1 4.03Å; F538-I587 HydrophobicContact CG-CD1 4.27Å; F538-I587 HydrophobicContact CZ-CB 4.44Å; F538-I587 HydrophobicContact CZ-CD1 3.9Å; F538-I587 HydrophobicContact CZ-CG2 4.22Å
539	T	86.5	Confident	79.3	Confident	52 Å²	52	64 Å²	64	32%	0.319	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	143.3	169.4	42.4	0	0	0	0	110.1	R551 Q553	T539-R551 PolarHBondContact N-O 2.84Å; T539-R551 PolarHBondContact O-N 2.81Å; T539-Q553 HydrophobicContact CG2-CB 3.98Å; T539-Q553 HydrophobicContact CG2-CG 4.22Å
540	L	87.5	Confident	79.6	Confident	38 Å²	38	62.4 Å²	62.4	20%	0.199	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	145.5	175.8	-174.5	148.2	0	0	0	109.5	I510 F526 L528 A548 I550 I569	I510-L540 HydrophobicContact CD1-CD1 4.49Å; F526-L540 HydrophobicContact CB-CD1 3.94Å; F526-L540 HydrophobicContact CB-CD2 3.49Å; F526-L540 VanDerWaalsContact CB-CD2 3.49Å; F526-L540 HydrophobicContact CB-CG 4.35Å; L528-L540 HydrophobicContact CD1-CB 4.42Å; L528-L540 HydrophobicContact CD2-CB 4.42Å; L528-L540 HydrophobicContact CD2-CD1 4.38Å; L528-L540 HydrophobicContact CG-CB 4.17Å; L540-A548 HydrophobicContact CD1-CB 4.05Å; L540-A548 HydrophobicContact CD2-CB 3.86Å; L540-A548 HydrophobicContact CG-CB 3.98Å; L540-I550 HydrophobicContact CD1-CG1 4.49Å; L540-I569 HydrophobicContact CD1-CD1 4.4Å; L540-I569 HydrophobicContact CD1-CG2 3.79Å
541	W	84.1	Confident	80.1	Confident	94 Å²	94	61.5 Å²	61.5	36%	0.356	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	132.7	170.6	67.3	-71.1	0	0	0	111.3	V543 A548 G549 R551	W541-V543 HydrophobicContact CD2-CG2 4.24Å; W541-V543 HydrophobicContact CE3-CG2 4.09Å; W541-V543 HydrophobicContact CH2-CB 4.29Å; W541-V543 HydrophobicContact CH2-CG1 3.98Å; W541-V543 HydrophobicContact CH2-CG2 3.77Å; W541-V543 HydrophobicContact CZ2-CG2 3.9Å; W541-V543 HydrophobicContact CZ3-CB 4.15Å; W541-V543 HydrophobicContact CZ3-CG1 4.13Å; W541-V543 HydrophobicContact CZ3-CG2 3.87Å; W541-V543 PolarHBondContact O-N 2.7Å; W541-A548 WeakPolarHBondContact O-CA 3.37Å; W541-G549 VanDerWaalsContact CD1-C 3.5Å; W541-G549 PolarHBondContact N-O 2.98Å; W541-G549 PolarHBondContact NE1-O 3.33Å; W541-G549 PolarHBondContact O-N 3.49Å; W541-R551 VanDerWaalsContact CE2-NH2 3.34Å; W541-R551 VanDerWaalsContact CZ2-NH2 3.32Å
542	D	78.9	Confident	80.7	Confident	52 Å²	52	53.7 Å²	53.7	28%	0.278	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	122.1	170.7	171.4	15.3	0	0	0	109.6	R523 K544	R523-D542 IonicContact CZ-OD2 2.76Å; R523-D542 IonicContact NH2-OD2 2.71Å; R523-D542 PolarHBondContact NH2-OD2 2.84Å; D542-K544 WeakPolarHBondContact OD1-CA 3.29Å; D542-K544 PolarHBondContact OD1-N 2.9Å
543	V	80.3	Confident	81.2	Confident	40 Å²	40	57.5 Å²	57.5	24%	0.242	29%	0.289	C	S	.	.			trans	-86.2	-13.7	-178.5	-173.1	0	0	0	0	111.3	W541 D545 T547	W541-V543 HydrophobicContact CD2-CG2 4.24Å; W541-V543 HydrophobicContact CE3-CG2 4.09Å; W541-V543 HydrophobicContact CH2-CB 4.29Å; W541-V543 HydrophobicContact CH2-CG1 3.98Å; W541-V543 HydrophobicContact CH2-CG2 3.77Å; W541-V543 HydrophobicContact CZ2-CG2 3.9Å; W541-V543 HydrophobicContact CZ3-CB 4.15Å; W541-V543 HydrophobicContact CZ3-CG1 4.13Å; W541-V543 HydrophobicContact CZ3-CG2 3.87Å; W541-V543 PolarHBondContact O-N 2.7Å; V543-D545 VanDerWaalsContact C-N 3.32Å; V543-D545 VanDerWaalsContact CB-OD1 3.32Å; V543-D545 WeakPolarHBondContact CB-OD1 3.45Å; V543-D545 WeakPolarHBondContact CG1-OD1 3.35Å; V543-D545 WeakPolarHBondContact CG1-OD2 3.4Å; V543-T547 WeakPolarHBondContact CB-O 3.49Å; V543-T547 WeakPolarHBondContact CB-OG1 3.46Å; V543-T547 PolarHBondContact N-O 3.35Å; V543-T547 VanDerWaalsContact N-O 3.1Å
544	K	71.7	Confident	81.6	Confident	173 Å²	173	58.3 Å²	58.3	75%	0.752	28%	0.283	S	S	*	.	S	Bend	trans	70.4	17.6	179.9	-49.2	178.8	-177	178	0	115.8	D542	D542-K544 WeakPolarHBondContact OD1-CA 3.29Å; D542-K544 PolarHBondContact OD1-N 2.9Å
545	D	75.2	Confident	81.4	Confident	98 Å²	98	58 Å²	58	52%	0.524	28%	0.281	S	S	.	.	S	Bend	trans	-120.4	27.2	175.7	61.5	0.4	0	0	0	111.4	V543 T547	V543-D545 VanDerWaalsContact C-N 3.32Å; V543-D545 VanDerWaalsContact CB-OD1 3.32Å; V543-D545 WeakPolarHBondContact CB-OD1 3.45Å; V543-D545 WeakPolarHBondContact CG1-OD1 3.35Å; V543-D545 WeakPolarHBondContact CG1-OD2 3.4Å; D545-T547 PolarHBondContact O-N 2.99Å; D545-T547 VanDerWaalsContact OD1-CB 3.28Å; D545-T547 WeakPolarHBondContact OD1-CB 3.4Å; D545-T547 WeakPolarHBondContact OD1-CG2 3.38Å; D545-T547 PolarHBondContact OD1-N 3.35Å; D545-T547 PolarHBondContact OD1-OG1 3.35Å
546	N	77.9	Confident	81.2	Confident	38 Å²	38	58.9 Å²	58.9	20%	0.203	29%	0.287	C	S	.	.	S	Bend	trans	61.8	15.5	-169.4	-75	-18.4	0	0	0	115.3	Q519 H522 R523 F524 F526	Q519-N546 PolarHBondContact O-ND2 3.09Å; H522-N546 PolarHBondContact O-ND2 2.97Å; R523-N546 WeakPolarHBondContact CA-OD1 3.38Å; F524-N546 HydrophobicContact CD2-CB 3.93Å; F524-N546 HydrophobicContact CE2-CB 4.36Å; F524-N546 PolarHBondContact N-OD1 2.67Å; F526-N546 WeakPolarHBondContact CZ-O 3.43Å
547	T	85.3	Confident	81.4	Confident	24 Å²	24	50.2 Å²	50.2	15%	0.147	26%	0.255	C	S	.	.			trans	-111.6	160.2	167.1	80.3	0	0	0	0	112.8	T509 I510 V543 D545	T509-T547 HydrophobicContact CG2-CG2 4.26Å; T509-T547 VanDerWaalsContact CG2-OG1 3.25Å; T509-T547 WeakPolarHBondContact CG2-OG1 3.46Å; I510-T547 VanDerWaalsContact O-CA 3.29Å; I510-T547 WeakPolarHBondContact O-CA 3.24Å; I510-T547 VanDerWaalsContact O-CB 3.27Å; I510-T547 WeakPolarHBondContact O-CB 3.2Å; V543-T547 WeakPolarHBondContact CB-O 3.49Å; V543-T547 WeakPolarHBondContact CB-OG1 3.46Å; V543-T547 PolarHBondContact N-O 3.35Å; V543-T547 VanDerWaalsContact N-O 3.1Å; D545-T547 PolarHBondContact O-N 2.99Å; D545-T547 VanDerWaalsContact OD1-CB 3.28Å; D545-T547 WeakPolarHBondContact OD1-CB 3.4Å; D545-T547 WeakPolarHBondContact OD1-CG2 3.38Å; D545-T547 PolarHBondContact OD1-N 3.35Å; D545-T547 PolarHBondContact OD1-OG1 3.35Å
548	A	87.8	Confident	81.2	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	128.5	170.5	0	0	0	0	0	111.6	T509 I510 F526 L540 W541	T509-A548 WeakPolarHBondContact CA-O 3.5Å; I510-A548 HydrophobicContact CD1-CB 4.13Å; I510-A548 HydrophobicContact CG1-CB 3.91Å; I510-A548 WeakPolarHBondContact CG1-O 3.28Å; I510-A548 PolarHBondContact N-O 2.92Å; I510-A548 PolarHBondContact O-N 2.64Å; F526-A548 HydrophobicContact CB-CB 3.8Å; F526-A548 HydrophobicContact CD1-CB 3.59Å; F526-A548 HydrophobicContact CD2-CB 3.63Å; F526-A548 HydrophobicContact CE1-CB 3.95Å; F526-A548 HydrophobicContact CE2-CB 3.99Å; F526-A548 HydrophobicContact CG-CB 3.4Å; F526-A548 VanDerWaalsContact CG-CB 3.4Å; F526-A548 HydrophobicContact CZ-CB 4.14Å; L540-A548 HydrophobicContact CD1-CB 4.05Å; L540-A548 HydrophobicContact CD2-CB 3.86Å; L540-A548 HydrophobicContact CG-CB 3.98Å; W541-A548 WeakPolarHBondContact O-CA 3.37Å
549	G	88	Confident	80.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	139.1	173.6	0	0	0	0	0	110.9	W541	W541-G549 VanDerWaalsContact CD1-C 3.5Å; W541-G549 PolarHBondContact N-O 2.98Å; W541-G549 PolarHBondContact NE1-O 3.33Å; W541-G549 PolarHBondContact O-N 3.49Å
550	I	88.6	Confident	79.9	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	126.4	179.6	-58.8	164.5	0	0	0	108.2	I507 H508 I510 F538 L540 L567 I569 L585 I587	I507-I550 HydrophobicContact CD1-CG2 4.34Å; I507-I550 PolarHBondContact N-O 3.39Å; H508-I550 PolarHBondContact O-N 2.86Å; I510-I550 HydrophobicContact CD1-CD1 4.4Å; I510-I550 HydrophobicContact CG1-CD1 4.15Å; I510-I550 HydrophobicContact CG2-CD1 3.89Å; F538-I550 HydrophobicContact CB-CG2 4.41Å; L540-I550 HydrophobicContact CD1-CG1 4.49Å; I550-L567 HydrophobicContact CD1-CD2 4.37Å; I550-L567 HydrophobicContact CG2-CD2 3.7Å; I550-I569 HydrophobicContact CD1-CD1 3.56Å; I550-I569 HydrophobicContact CG1-CD1 4.41Å; I550-L585 HydrophobicContact CD1-CD2 3.37Å; I550-I587 HydrophobicContact CG2-CD1 4.46Å
551	R	88.3	Confident	79.4	Confident	87 Å²	87	65 Å²	65	33%	0.328	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	157.5	-175.8	-63.7	178.9	-172	-118.8	5.7	112.3	G504 Q505 L506 F538 T539 W541	G504-R551 WeakPolarHBondContact O-CD 3.31Å; G504-R551 PolarHBondContact O-NH1 3.15Å; G504-R551 VanDerWaalsContact O-NH1 3.1Å; Q505-R551 WeakPolarHBondContact O-CA 3.35Å; Q505-R551 WeakPolarHBondContact O-CB 3.45Å; L506-R551 HydrophobicContact CD1-CG 4.33Å; F538-R551 CarbonylContact C-O 3.55Å; F538-R551 VanDerWaalsContact CA-O 3.25Å; F538-R551 WeakPolarHBondContact CA-O 3.4Å; T539-R551 PolarHBondContact N-O 2.84Å; T539-R551 PolarHBondContact O-N 2.81Å; W541-R551 VanDerWaalsContact CE2-NH2 3.34Å; W541-R551 VanDerWaalsContact CZ2-NH2 3.32Å
552	T	86.1	Confident	79.2	Confident	2 Å²	2	64.2 Å²	64.2	1%	0.012	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	140.4	166.2	48.6	0	0	0	0	112.1	I497 A501 K502 P503 G504 Q505 I507 F557	I497-T552 HydrophobicContact CD1-CG2 3.36Å; A501-T552 HydrophobicContact CB-CG2 4.06Å; K502-T552 PolarHBondContact O-OG1 3.38Å; P503-T552 WeakPolarHBondContact CA-OG1 3.16Å; G504-T552 PolarHBondContact N-O 3.29Å; G504-T552 PolarHBondContact N-OG1 3.14Å; Q505-T552 PolarHBondContact N-OG1 3.06Å; Q505-T552 PolarHBondContact O-N 2.86Å; Q505-T552 PolarHBondContact O-OG1 2.75Å; I507-T552 HydrophobicContact CD1-CG2 4.09Å; I507-T552 HydrophobicContact CG1-CG2 4.32Å; T552-F557 HydrophobicContact CG2-CE2 3.71Å; T552-F557 HydrophobicContact CG2-CZ 4.17Å
553	Q	82.9	Confident	79.3	Confident	93 Å²	93	65.2 Å²	65.2	44%	0.435	33%	0.325	S	S	.	.			trans	-114.8	-29.7	164.1	-176.2	173.5	51.3	0	0	112.1	R536 H537 T539	R536-Q553 VanDerWaalsContact CA-OE1 3.24Å; R536-Q553 WeakPolarHBondContact O-CB 3.44Å; H537-Q553 PolarHBondContact O-N 2.72Å; T539-Q553 HydrophobicContact CG2-CB 3.98Å; T539-Q553 HydrophobicContact CG2-CG 4.22Å
554	K	78.6	Confident	79.5	Confident	67 Å²	67	64.9 Å²	64.9	29%	0.291	32%	0.323	S	S	.	.	S	Bend	trans	-76.9	155.7	170.4	-165.8	176.3	179.3	-178.4	0	111.1	H537 S556 F557	H537-K554 WeakPolarHBondContact CD2-CD 2.85Å; H537-K554 PolarHBondContact NE2-NZ 3.03Å; H537-K554 PolarHBondContact O-N 2.76Å; K554-S556 WeakPolarHBondContact CD-O 3.47Å; K554-S556 VanDerWaalsContact CE-O 3.26Å; K554-S556 WeakPolarHBondContact CE-O 3.32Å; K554-S556 WeakPolarHBondContact CG-O 3.46Å; K554-F557 HydrophobicContact CB-CE2 4.3Å; K554-F557 HydrophobicContact CB-CZ 4.02Å; K554-F557 HydrophobicContact CD-CE1 4.49Å
555	S	64.9	Low	80.2	Confident	82 Å²	82	57.5 Å²	57.5	57%	0.573	29%	0.29	S	S	*	.	S	Bend	trans	-99.2	-0	-174.9	59.8	0	0	0	0	115.8
556	S	69.1	Low	80.8	Confident	68 Å²	68	59.8 Å²	59.8	48%	0.476	30%	0.296	S	S	.	.			trans	-169.4	147.4	175.5	52	0	0	0	0	110.3	K554	K554-S556 WeakPolarHBondContact CD-O 3.47Å; K554-S556 VanDerWaalsContact CE-O 3.26Å; K554-S556 WeakPolarHBondContact CE-O 3.32Å; K554-S556 WeakPolarHBondContact CG-O 3.46Å
557	F	79.4	Confident	81.2	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.009	29%	0.287	C	S	.	.			trans	-124.8	105	179.8	-69	-95	0	0	0	109.5	I497 E499 H537 F538 T552 K554 R559 Y565 V589	I497-F557 HydrophobicContact CD1-CD2 4.27Å; I497-F557 HydrophobicContact CD1-CE2 3.99Å; I497-F557 HydrophobicContact CD1-CZ 4.41Å; E499-F557 WeakPolarHBondContact CA-O 3.22Å; E499-F557 WeakPolarHBondContact CB-O 3.45Å; E499-F557 PolarHBondContact O-N 3.48Å; H537-F557 HydrophobicContact CB-CE1 4.23Å; H537-F557 AromaticContact CD2-CE1 3.96Å; F538-F557 HydrophobicContact CD1-CZ 4.22Å; F538-F557 AromaticContact CE1-CE1 3.6Å; F538-F557 HydrophobicContact CE1-CE1 3.6Å; F538-F557 AromaticContact CE1-CZ 3.59Å; F538-F557 HydrophobicContact CE1-CZ 3.59Å; F538-F557 HydrophobicContact CZ-CD1 4.5Å; F538-F557 AromaticContact CZ-CE1 3.61Å; F538-F557 HydrophobicContact CZ-CE1 3.61Å; F538-F557 HydrophobicContact CZ-CZ 4.1Å; T552-F557 HydrophobicContact CG2-CE2 3.71Å; T552-F557 HydrophobicContact CG2-CZ 4.17Å; K554-F557 HydrophobicContact CB-CE2 4.3Å; K554-F557 HydrophobicContact CB-CZ 4.02Å; K554-F557 HydrophobicContact CD-CE1 4.49Å; F557-R559 PolarHBondContact O-N 3.48Å; F557-Y565 HydrophobicContact CD1-CD2 4.48Å; F557-Y565 AromaticContact CD1-CE2 3.72Å; F557-Y565 HydrophobicContact CD1-CE2 3.72Å; F557-Y565 AromaticContact CD1-CZ 3.95Å; F557-Y565 HydrophobicContact CE1-CE2 4.28Å; F557-V589 HydrophobicContact CB-CG1 3.92Å; F557-V589 HydrophobicContact CB-CG2 4.15Å
558	N	77.3	Confident	81.4	Confident	64 Å²	64	58.8 Å²	58.8	34%	0.342	29%	0.292	S	S	.	.			trans	-75.1	102	-179.5	-174.8	-4.5	0	0	0	110.8	H560 E561 Q562	N558-H560 PolarHBondContact O-N 2.99Å; N558-H560 VanDerWaalsContact O-N 3.11Å; N558-H560 WeakPolarHBondContact OD1-CB 3.5Å; N558-H560 PolarHBondContact OD1-N 2.83Å; N558-E561 HydrophobicContact CB-CB 4.15Å; N558-E561 HydrophobicContact CB-CG 4.17Å; N558-E561 VanDerWaalsContact ND2-CD 3.27Å; N558-E561 WeakPolarHBondContact ND2-CG 3.37Å; N558-E561 PolarHBondContact ND2-OE1 2.88Å; N558-E561 PolarHBondContact O-N 2.89Å; N558-Q562 PolarHBondContact O-N 2.94Å
559	R	74.8	Confident	81.5	Confident	48 Å²	48	58.8 Å²	58.8	18%	0.181	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-22.6	178.5	-169.1	173.8	-179.2	-128.7	-5.4	114.1	E499 F557 N563 V589 T602 C603 N604	E499-R559 HydrophobicContact CB-CB 4.44Å; E499-R559 VanDerWaalsContact OE2-CB 3.24Å; E499-R559 WeakPolarHBondContact OE2-CB 3.44Å; F557-R559 PolarHBondContact O-N 3.48Å; R559-N563 HydrophobicContact CG-CB 4.32Å; R559-V589 HydrophobicContact CB-CG1 3.96Å; R559-V589 WeakPolarHBondContact CD-O 3.06Å; R559-V589 HydrophobicContact CG-CB 4.43Å; R559-V589 HydrophobicContact CG-CG1 4.27Å; R559-V589 WeakPolarHBondContact CG-O 3.15Å; R559-V589 PolarHBondContact NE-O 3.12Å; R559-T602 PolarHBondContact NH2-O 3Å; R559-C603 VanDerWaalsContact NH2-C 3.29Å; R559-C603 PolarHBondContact NH2-O 2.79Å; R559-N604 PolarHBondContact NH2-O 3.06Å
560	H	71.3	Confident	81.5	Confident	178 Å²	178	61.2 Å²	61.2	82%	0.824	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-20.2	175.5	-62.1	-64.3	0	0	0	114.1	N558	N558-H560 PolarHBondContact O-N 2.99Å; N558-H560 VanDerWaalsContact O-N 3.11Å; N558-H560 WeakPolarHBondContact OD1-CB 3.5Å; N558-H560 PolarHBondContact OD1-N 2.83Å
561	E	77.9	Confident	81.6	Confident	153 Å²	153	61.1 Å²	61.1	72%	0.715	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-47	172.6	-75.2	164.8	-147	0	0	111	N558	N558-E561 HydrophobicContact CB-CB 4.15Å; N558-E561 HydrophobicContact CB-CG 4.17Å; N558-E561 VanDerWaalsContact ND2-CD 3.27Å; N558-E561 WeakPolarHBondContact ND2-CG 3.37Å; N558-E561 PolarHBondContact ND2-OE1 2.88Å; N558-E561 PolarHBondContact O-N 2.89Å
562	Q	79	Confident	81.6	Confident	78 Å²	78	58.8 Å²	58.8	36%	0.364	30%	0.299	S	S	.	.			trans	-149.2	109.1	-179	-174.7	167.8	7.3	0	0	110.6	N558 V564 Y565	N558-Q562 PolarHBondContact O-N 2.94Å; Q562-V564 WeakPolarHBondContact CG-O 3.34Å; Q562-V564 PolarHBondContact NE2-O 2.95Å; Q562-Y565 HydrophobicContact CB-CE2 4.2Å; Q562-Y565 VanDerWaalsContact CD-CZ 3.42Å; Q562-Y565 HydrophobicContact CG-CD2 4.21Å; Q562-Y565 HydrophobicContact CG-CE1 4.13Å; Q562-Y565 HydrophobicContact CG-CE2 3.79Å; Q562-Y565 VanDerWaalsContact OE1-CZ 3.31Å; Q562-Y565 PolarHBondContact OE1-OH 2.87Å
563	N	80.5	Confident	81.7	Confident	74 Å²	74	58.8 Å²	58.8	40%	0.396	30%	0.299	S	S	.	.	S	Bend	trans	-92.9	-10	179.3	65.8	-29.3	0	0	0	114.1	R559 V589	R559-N563 HydrophobicContact CG-CB 4.32Å; N563-V589 PolarHBondContact O-N 2.66Å
564	V	85.4	Confident	81.8	Confident	33 Å²	33	57 Å²	57	20%	0.2	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	132.8	179.2	-175	0	0	0	0	110.1	Q562 F566 T586	Q562-V564 WeakPolarHBondContact CG-O 3.34Å; Q562-V564 PolarHBondContact NE2-O 2.95Å; V564-F566 HydrophobicContact CG1-CE1 4.07Å; V564-F566 HydrophobicContact CG1-CE2 4.22Å; V564-F566 HydrophobicContact CG1-CZ 3.85Å; V564-T586 HydrophobicContact CG1-CG2 3.49Å; V564-T586 VanDerWaalsContact CG1-CG2 3.49Å
565	Y	86.5	Confident	81.8	Confident	17 Å²	17	54.3 Å²	54.3	7%	0.067	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	129.9	171.5	-72	-93.7	0	0	0	109.7	H537 F538 F557 Q562 I587 V589	H537-Y565 AromaticContact CD2-CE1 3.56Å; H537-Y565 AromaticContact CD2-CZ 3.86Å; H537-Y565 AromaticContact CG-CE1 3.81Å; H537-Y565 AromaticContact NE2-CE1 3.81Å; F538-Y565 AromaticContact CE2-CD1 3.84Å; F538-Y565 HydrophobicContact CE2-CD1 3.84Å; F538-Y565 HydrophobicContact CE2-CD2 4.46Å; F538-Y565 AromaticContact CE2-CG 3.76Å; F538-Y565 HydrophobicContact CE2-CG 3.76Å; F538-Y565 HydrophobicContact CZ-CD1 4.25Å; F538-Y565 HydrophobicContact CZ-CD2 4.1Å; F538-Y565 AromaticContact CZ-CG 3.85Å; F538-Y565 HydrophobicContact CZ-CG 3.85Å; F557-Y565 HydrophobicContact CD1-CD2 4.48Å; F557-Y565 AromaticContact CD1-CE2 3.72Å; F557-Y565 HydrophobicContact CD1-CE2 3.72Å; F557-Y565 AromaticContact CD1-CZ 3.95Å; F557-Y565 HydrophobicContact CE1-CE2 4.28Å; Q562-Y565 HydrophobicContact CB-CE2 4.2Å; Q562-Y565 VanDerWaalsContact CD-CZ 3.42Å; Q562-Y565 HydrophobicContact CG-CD2 4.21Å; Q562-Y565 HydrophobicContact CG-CE1 4.13Å; Q562-Y565 HydrophobicContact CG-CE2 3.79Å; Q562-Y565 VanDerWaalsContact OE1-CZ 3.31Å; Q562-Y565 PolarHBondContact OE1-OH 2.87Å; Y565-I587 PolarHBondContact N-O 2.9Å; Y565-I587 PolarHBondContact O-N 3.43Å; Y565-V589 HydrophobicContact CD2-CG2 3.91Å; Y565-V589 HydrophobicContact CE2-CG2 3.76Å
566	F	86.8	Confident	82.4	Confident	146 Å²	146	56.1 Å²	56.1	64%	0.64	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	114.1	168.8	-59.8	-70.2	0	0	0	108	V564 P568 T584 T586	V564-F566 HydrophobicContact CG1-CE1 4.07Å; V564-F566 HydrophobicContact CG1-CE2 4.22Å; V564-F566 HydrophobicContact CG1-CZ 3.85Å; F566-P568 VanDerWaalsContact O-CD 3.29Å; F566-P568 WeakPolarHBondContact O-CD 3.29Å; F566-T584 HydrophobicContact CB-CG2 3.87Å; F566-T584 HydrophobicContact CD1-CG2 4.3Å; F566-T586 HydrophobicContact CD1-CG2 4.06Å; F566-T586 HydrophobicContact CE1-CG2 3.73Å
567	L	87.6	Confident	83.2	Confident	4 Å²	4	57 Å²	57	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	97.3	179.7	-176.3	61.3	0	0	0	108.8	L528 A532 F538 I550 I569 T584 L585 I587	L528-L567 HydrophobicContact CD1-CD1 4.31Å; L528-L567 HydrophobicContact CD2-CD1 3.73Å; L528-L567 HydrophobicContact CD2-CD2 4.38Å; L528-L567 HydrophobicContact CD2-CG 4.07Å; A532-L567 HydrophobicContact CB-CD1 4.19Å; F538-L567 HydrophobicContact CB-CD1 4.49Å; F538-L567 HydrophobicContact CB-CD2 4.14Å; F538-L567 HydrophobicContact CD2-CD1 4.16Å; F538-L567 HydrophobicContact CD2-CD2 4.26Å; F538-L567 HydrophobicContact CG-CD2 4.31Å; I550-L567 HydrophobicContact CD1-CD2 4.37Å; I550-L567 HydrophobicContact CG2-CD2 3.7Å; L567-I569 HydrophobicContact CD2-CD1 4.34Å; L567-I569 HydrophobicContact CG-CD1 4.41Å; L567-I569 HydrophobicContact CG-CG1 4.13Å; L567-T584 WeakPolarHBondContact O-CA 3.45Å; L567-L585 PolarHBondContact N-O 2.74Å; L567-L585 PolarHBondContact O-N 3.47Å; L567-I587 HydrophobicContact CB-CD1 4.19Å; L567-I587 HydrophobicContact CD2-CD1 3.85Å
568	P	88.6	Confident	83.6	Confident	38 Å²	38	60.4 Å²	60.4	25%	0.247	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	136.1	170.6	30.2	-34.2	0	0	0	109.4	P529 A532 F566 T582 G583	P529-P568 WeakPolarHBondContact CD-O 3.27Å; P529-P568 HydrophobicContact CG-CB 4.27Å; P529-P568 HydrophobicContact CG-CG 4.35Å; A532-P568 HydrophobicContact CB-CG 3.98Å; F566-P568 VanDerWaalsContact O-CD 3.29Å; F566-P568 WeakPolarHBondContact O-CD 3.29Å; P568-T582 HydrophobicContact CB-CG2 3.82Å; P568-G583 CarbonylContact C-O 3.6Å; P568-G583 WeakPolarHBondContact CA-O 3.37Å
569	I	88.9	Confident	84.2	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	116.2	-178.4	-57.2	174.9	0	0	0	106.5	I510 F526 L528 L540 I550 L567 V571 T582 G583 L585	I510-I569 HydrophobicContact CD1-CD1 3.68Å; I510-I569 HydrophobicContact CD1-CG2 3.95Å; F526-I569 HydrophobicContact CD1-CG2 4.46Å; L528-I569 HydrophobicContact CD2-CG1 3.96Å; L540-I569 HydrophobicContact CD1-CD1 4.4Å; L540-I569 HydrophobicContact CD1-CG2 3.79Å; I550-I569 HydrophobicContact CD1-CD1 3.56Å; I550-I569 HydrophobicContact CG1-CD1 4.41Å; L567-I569 HydrophobicContact CD2-CD1 4.34Å; L567-I569 HydrophobicContact CG-CD1 4.41Å; L567-I569 HydrophobicContact CG-CG1 4.13Å; I569-V571 HydrophobicContact CG2-CG2 4.39Å; I569-T582 WeakPolarHBondContact O-CA 3.46Å; I569-G583 PolarHBondContact N-O 2.87Å; I569-G583 PolarHBondContact O-N 2.84Å; I569-G583 VanDerWaalsContact O-N 3.13Å; I569-L585 HydrophobicContact CD1-CB 4.26Å
570	L	89.6	Confident	84.9	Confident	50 Å²	50	60.6 Å²	60.6	26%	0.262	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	115.8	174.5	173	65.9	0	0	0	107.9	T527 P529 V572 S581	T527-L570 PolarHBondContact N-O 3.39Å; T527-L570 PolarHBondContact O-N 2.81Å; T527-L570 WeakPolarHBondContact OG1-CB 3.34Å; T527-L570 PolarHBondContact OG1-O 3.08Å; P529-L570 HydrophobicContact CG-CB 4.31Å; L570-V572 HydrophobicContact CG-CG2 4.3Å; L570-S581 WeakPolarHBondContact CA-O 3.33Å; L570-S581 WeakPolarHBondContact CD1-O 3.36Å
571	V	89.5	Confident	85.8	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	132.8	172.6	-172.8	0	0	0	0	107.8	P487 L489 V512 F524 F526 I569 S580 S581	P487-V571 HydrophobicContact CB-CG1 3.88Å; P487-V571 HydrophobicContact CG-CB 4.4Å; P487-V571 HydrophobicContact CG-CG1 3.89Å; L489-V571 HydrophobicContact CD2-CG2 3.66Å; L489-V571 HydrophobicContact CG-CG2 4.35Å; V512-V571 HydrophobicContact CG1-CG1 4.43Å; V512-V571 HydrophobicContact CG2-CG1 3.75Å; V512-V571 HydrophobicContact CG2-CG2 4.34Å; F524-V571 HydrophobicContact CB-CG1 4.1Å; F524-V571 HydrophobicContact CD1-CG1 4.42Å; F526-V571 HydrophobicContact CD1-CG1 4.49Å; F526-V571 HydrophobicContact CD1-CG2 3.93Å; F526-V571 HydrophobicContact CE1-CG1 4.38Å; F526-V571 HydrophobicContact CE1-CG2 4.12Å; I569-V571 HydrophobicContact CG2-CG2 4.39Å; V571-S580 CarbonylContact O-C 3.58Å; V571-S580 WeakPolarHBondContact O-CA 3.18Å; V571-S580 WeakPolarHBondContact O-CB 3.43Å; V571-S581 PolarHBondContact N-O 3.08Å; V571-S581 PolarHBondContact O-N 3Å
572	V	88.8	Confident	86.3	Confident	37 Å²	37	50 Å²	50	22%	0.224	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	140.1	172.9	-167.7	0	0	0	0	107.5	F524 F525 L570 L579	F524-V572 CarbonylContact C-O 3.59Å; F524-V572 WeakPolarHBondContact CA-O 3.41Å; F525-V572 HydrophobicContact CB-CB 4.39Å; F525-V572 PolarHBondContact N-O 3.2Å; F525-V572 PolarHBondContact O-N 3.46Å; L570-V572 HydrophobicContact CG-CG2 4.3Å; V572-L579 WeakPolarHBondContact CA-O 3.25Å; V572-L579 VanDerWaalsContact CG1-O 3.31Å; V572-L579 WeakPolarHBondContact CG1-O 3.35Å
573	D	88.3	Confident	86.8	Confident	2 Å²	2	47 Å²	47	1%	0.011	29%	0.285	C	S	.	.			trans	-79	-167.4	173.4	60	48.5	0	0	0	112.2	N483 P487 R523 F524 G575 S578 L579	N483-D573 PolarHBondContact ND2-OD2 3.27Å; P487-D573 HydrophobicContact CG-CB 4.03Å; R523-D573 CarbonylContact O-C 3.58Å; F524-D573 HydrophobicContact CD1-CB 4.31Å; F524-D573 HydrophobicContact CE1-CB 4.27Å; D573-G575 WeakPolarHBondContact OD1-CA 3.2Å; D573-G575 PolarHBondContact OD1-N 3.41Å; D573-S578 WeakPolarHBondContact OD1-CA 3.33Å; D573-S578 WeakPolarHBondContact OD1-CB 3.47Å; D573-L579 VanDerWaalsContact CG-N 3.34Å; D573-L579 PolarHBondContact N-O 2.92Å; D573-L579 PolarHBondContact OD1-N 3.5Å; D573-L579 VanDerWaalsContact OD2-CA 3.22Å; D573-L579 WeakPolarHBondContact OD2-CA 3.31Å; D573-L579 VanDerWaalsContact OD2-CB 3.22Å; D573-L579 WeakPolarHBondContact OD2-CB 3.3Å; D573-L579 PolarHBondContact OD2-N 2.74Å
574	S	84.2	Confident	87.1	Confident	55 Å²	55	46.4 Å²	46.4	39%	0.385	28%	0.284	S	S	.	.	S	Bend	trans	-113.6	17.7	171.2	61.3	0	0	0	0	113.3	R523	R523-S574 PolarHBondContact N-OG 2.84Å; R523-S574 WeakPolarHBondContact O-CB 3.33Å; R523-S574 PolarHBondContact O-N 2.87Å
575	G	79.4	Confident	87.3	Confident	12 Å²	12	44.9 Å²	44.9	12%	0.124	28%	0.275	C	S	.	.			trans	-73.4	161.9	-174.5	0	0	0	0	0	114.6	N483 D573 P577 S578	N483-G575 WeakPolarHBondContact OD1-CA 3.26Å; D573-G575 WeakPolarHBondContact OD1-CA 3.2Å; D573-G575 PolarHBondContact OD1-N 3.41Å; G575-P577 VanDerWaalsContact C-C 3.46Å; G575-P577 CarbonylContact C-O 3.48Å; G575-P577 CarbonylContact O-C 3.56Å; G575-S578 VanDerWaalsContact O-CA 3.27Å; G575-S578 WeakPolarHBondContact O-CA 3.43Å; G575-S578 WeakPolarHBondContact O-CB 3.37Å; G575-S578 PolarHBondContact O-N 2.65Å
576	P	77.8	Confident	87.3	Confident	119 Å²	119	45.3 Å²	45.3	77%	0.773	28%	0.28	S	S	*	.	S	Bend	trans	-114.6	102.6	164.8	34.6	-21.5	0	0	0	111
577	P	85.8	Confident	87.4	Confident	87 Å²	87	38.3 Å²	38.3	57%	0.565	25%	0.249	S	C	*	.	S	Bend	cis	-76.7	153.5	2.1	34.1	-36	0	0	0	112.4	G575 L579	G575-P577 VanDerWaalsContact C-C 3.46Å; G575-P577 CarbonylContact C-O 3.48Å; G575-P577 CarbonylContact O-C 3.56Å; P577-L579 PolarHBondContact O-N 3.09Å
578	S	86.6	Confident	87.3	Confident	74 Å²	74	40.8 Å²	40.8	52%	0.517	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-80.8	120.5	179.2	60.8	0	0	0	0	111	D573 G575	D573-S578 WeakPolarHBondContact OD1-CA 3.33Å; D573-S578 WeakPolarHBondContact OD1-CB 3.47Å; G575-S578 VanDerWaalsContact O-CA 3.27Å; G575-S578 WeakPolarHBondContact O-CA 3.43Å; G575-S578 WeakPolarHBondContact O-CB 3.37Å; G575-S578 PolarHBondContact O-N 2.65Å
579	L	89.8	Confident	87.1	Confident	49 Å²	49	39 Å²	39	26%	0.257	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-93.8	169.2	176.3	-54.5	-179.5	0	0	0	110.8	N483 D484 P486 V572 D573 P577	N483-L579 VanDerWaalsContact O-CD1 3.31Å; N483-L579 WeakPolarHBondContact O-CD1 3.44Å; D484-L579 WeakPolarHBondContact O-CD1 3.27Å; P486-L579 HydrophobicContact CB-CB 4.11Å; V572-L579 WeakPolarHBondContact CA-O 3.25Å; V572-L579 VanDerWaalsContact CG1-O 3.31Å; V572-L579 WeakPolarHBondContact CG1-O 3.35Å; D573-L579 VanDerWaalsContact CG-N 3.34Å; D573-L579 PolarHBondContact N-O 2.92Å; D573-L579 PolarHBondContact OD1-N 3.5Å; D573-L579 VanDerWaalsContact OD2-CA 3.22Å; D573-L579 WeakPolarHBondContact OD2-CA 3.31Å; D573-L579 VanDerWaalsContact OD2-CB 3.22Å; D573-L579 WeakPolarHBondContact OD2-CB 3.3Å; D573-L579 PolarHBondContact OD2-N 2.74Å; P577-L579 PolarHBondContact O-N 3.09Å
580	S	90	Very high	86.8	Confident	66 Å²	66	39 Å²	39	46%	0.462	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	144.2	-177.9	64.3	0	0	0	0	112.8	V571	V571-S580 CarbonylContact O-C 3.58Å; V571-S580 WeakPolarHBondContact O-CA 3.18Å; V571-S580 WeakPolarHBondContact O-CB 3.43Å
581	S	90.8	Very high	86.1	Confident	27 Å²	27	37 Å²	37	19%	0.189	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	158.4	172.4	92.5	0	0	0	0	110.9	P487 L570 V571	P487-S581 VanDerWaalsContact O-CB 3.25Å; P487-S581 WeakPolarHBondContact O-CB 3.49Å; P487-S581 PolarHBondContact O-OG 3.13Å; L570-S581 WeakPolarHBondContact CA-O 3.33Å; L570-S581 WeakPolarHBondContact CD1-O 3.36Å; V571-S581 PolarHBondContact N-O 3.08Å; V571-S581 PolarHBondContact O-N 3Å
582	T	89.4	Confident	85.4	Confident	82 Å²	82	38.3 Å²	38.3	50%	0.503	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	92.2	171.8	-57.7	0	0	0	0	109.9	P529 P568 I569	P529-T582 HydrophobicContact CG-CG2 4.49Å; P568-T582 HydrophobicContact CB-CG2 3.82Å; I569-T582 WeakPolarHBondContact O-CA 3.46Å
583	G	87.5	Confident	84.3	Confident	15 Å²	15	39.5 Å²	39.5	16%	0.155	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	155	168.4	0	0	0	0	0	111.2	P568 I569	P568-G583 CarbonylContact C-O 3.6Å; P568-G583 WeakPolarHBondContact CA-O 3.37Å; I569-G583 PolarHBondContact N-O 2.87Å; I569-G583 PolarHBondContact O-N 2.84Å; I569-G583 VanDerWaalsContact O-N 3.13Å
584	T	88.2	Confident	82.9	Confident	61 Å²	61	45.8 Å²	45.8	37%	0.374	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	114.8	177.2	-62.5	0	0	0	0	110.2	F566 L567	F566-T584 HydrophobicContact CB-CG2 3.87Å; F566-T584 HydrophobicContact CD1-CG2 4.3Å; L567-T584 WeakPolarHBondContact O-CA 3.45Å
585	L	88.6	Confident	81.6	Confident	2 Å²	2	50 Å²	50	1%	0.01	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	127.2	171.3	-175.2	72.7	0	0	0	109.5	A495 H508 I510 I550 L567 I569 I587	A495-L585 HydrophobicContact CB-CD1 4.26Å; A495-L585 HydrophobicContact CB-CD2 4.06Å; A495-L585 HydrophobicContact CB-CG 4.35Å; H508-L585 HydrophobicContact CB-CD2 4.48Å; I510-L585 HydrophobicContact CG2-CD2 4.43Å; I550-L585 HydrophobicContact CD1-CD2 3.37Å; L567-L585 PolarHBondContact N-O 2.74Å; L567-L585 PolarHBondContact O-N 3.47Å; I569-L585 HydrophobicContact CD1-CB 4.26Å; L585-I587 HydrophobicContact CD2-CD1 4.25Å; L585-I587 HydrophobicContact CD2-CG1 3.99Å; L585-I587 HydrophobicContact CG-CG1 4.17Å
586	T	88.1	Confident	80.2	Confident	25 Å²	25	51.9 Å²	51.9	15%	0.153	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	116	174	-54	0	0	0	0	109.3	Y493 E494 A495 V564 F566 H588	Y493-T586 PolarHBondContact O-N 3.46Å; E494-T586 WeakPolarHBondContact CA-O 3.3Å; A495-T586 PolarHBondContact N-O 2.96Å; V564-T586 HydrophobicContact CG1-CG2 3.49Å; V564-T586 VanDerWaalsContact CG1-CG2 3.49Å; F566-T586 HydrophobicContact CD1-CG2 4.06Å; F566-T586 HydrophobicContact CE1-CG2 3.73Å; T586-H588 WeakPolarHBondContact CG2-NE2 3.46Å
587	I	87.4	Confident	79.1	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	112.1	-179.7	-55.8	175.3	0	0	0	109	A495 I497 I507 F538 I550 Y565 L567 L585	A495-I587 HydrophobicContact CB-CG1 4.5Å; A495-I587 CarbonylContact O-C 3.59Å; A495-I587 WeakPolarHBondContact O-CA 3.48Å; I497-I587 HydrophobicContact CB-CG2 4.14Å; I497-I587 HydrophobicContact CG2-CG2 3.76Å; I507-I587 HydrophobicContact CD1-CD1 4.48Å; I507-I587 HydrophobicContact CG2-CG2 4.21Å; F538-I587 HydrophobicContact CD1-CD1 4.16Å; F538-I587 HydrophobicContact CD2-CD1 4.22Å; F538-I587 HydrophobicContact CE1-CD1 3.96Å; F538-I587 HydrophobicContact CE1-CG2 4.36Å; F538-I587 HydrophobicContact CE2-CD1 4.03Å; F538-I587 HydrophobicContact CG-CD1 4.27Å; F538-I587 HydrophobicContact CZ-CB 4.44Å; F538-I587 HydrophobicContact CZ-CD1 3.9Å; F538-I587 HydrophobicContact CZ-CG2 4.22Å; I550-I587 HydrophobicContact CG2-CD1 4.46Å; Y565-I587 PolarHBondContact N-O 2.9Å; Y565-I587 PolarHBondContact O-N 3.43Å; L567-I587 HydrophobicContact CB-CD1 4.19Å; L567-I587 HydrophobicContact CD2-CD1 3.85Å; L585-I587 HydrophobicContact CD2-CD1 4.25Å; L585-I587 HydrophobicContact CD2-CG1 3.99Å; L585-I587 HydrophobicContact CG-CG1 4.17Å
588	H	86.4	Confident	77.7	Confident	55 Å²	55	53.3 Å²	53.3	26%	0.255	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	131.1	178.1	-65.7	-88.7	0	0	0	111.3	A495 A496 I497 T586 C590	A495-H588 PolarHBondContact O-N 2.87Å; A496-H588 WeakPolarHBondContact CA-O 3.31Å; I497-H588 PolarHBondContact N-O 2.98Å; T586-H588 WeakPolarHBondContact CG2-NE2 3.46Å; H588-C590 PolarHBondContact O-SG 2.76Å; H588-C590 VanDerWaalsContact O-SG 3.38Å
589	V	84.6	Confident	76.5	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.006	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	122.6	172.8	-171.5	0	0	0	0	109.5	I497 E499 F557 R559 N563 Y565	I497-V589 HydrophobicContact CG2-CB 4.5Å; I497-V589 HydrophobicContact CG2-CG2 4.08Å; I497-V589 WeakPolarHBondContact O-CA 3.33Å; E499-V589 HydrophobicContact CB-CG1 3.86Å; F557-V589 HydrophobicContact CB-CG1 3.92Å; F557-V589 HydrophobicContact CB-CG2 4.15Å; R559-V589 HydrophobicContact CB-CG1 3.96Å; R559-V589 WeakPolarHBondContact CD-O 3.06Å; R559-V589 HydrophobicContact CG-CB 4.43Å; R559-V589 HydrophobicContact CG-CG1 4.27Å; R559-V589 WeakPolarHBondContact CG-O 3.15Å; R559-V589 PolarHBondContact NE-O 3.12Å; N563-V589 PolarHBondContact O-N 2.66Å; Y565-V589 HydrophobicContact CD2-CG2 3.91Å; Y565-V589 HydrophobicContact CE2-CG2 3.76Å
590	C	81.9	Confident	75.5	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	153.8	-167.8	-47.8	0	0	0	0	110.9	I497 E499 H588 I600 C603	I497-C590 PolarHBondContact O-N 2.92Å; E499-C590 PolarHBondContact N-O 3.31Å; H588-C590 PolarHBondContact O-SG 2.76Å; H588-C590 VanDerWaalsContact O-SG 3.38Å; C590-I600 HydrophobicContact CB-CG2 3.4Å; C590-C603 HydrophobicContact CB-CB 3.94Å; C590-C603 WeakPolarHBondContact CB-SG 3.5Å; C590-C603 WeakPolarHBondContact SG-CA 3.21Å; C590-C603 WeakPolarHBondContact SG-CB 3.38Å; C590-C603 CovalentContact SG-SG 2.04Å; C590-C603 PolarHBondContact SG-SG 3.01Å
591	G	75.7	Confident	74.2	Confident	8 Å²	8	55.8 Å²	55.8	8%	0.082	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	148.1	172.9	0	0	0	0	0	111.3	E499 Q601 T602	E499-G591 WeakPolarHBondContact OE1-CA 2.98Å; G591-Q601 PolarHBondContact O-N 2.88Å; G591-T602 PolarHBondContact N-O 2.92Å; G591-T602 PolarHBondContact O-N 3.41Å
592	C	73.3	Confident	72.9	Confident	28 Å²	28	58.2 Å²	58.2	19%	0.189	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	162.9	-169.7	-48	0	0	0	0	112.8	C498 A599	C498-C592 WeakPolarHBondContact CA-SG 3.35Å; C498-C592 HydrophobicContact CB-CB 4.29Å; C498-C592 WeakPolarHBondContact CB-SG 3.03Å; C498-C592 WeakPolarHBondContact SG-CB 3.21Å; C498-C592 CovalentContact SG-SG 2.01Å; C498-C592 PolarHBondContact SG-SG 3.05Å; C592-A599 WeakPolarHBondContact CA-O 3.34Å; C592-A599 WeakPolarHBondContact CB-O 3.38Å
593	D	65.6	Low	71.7	Confident	62 Å²	62	56.6 Å²	56.6	33%	0.332	33%	0.331	S	S	.	.			trans	-83.1	134.3	175.7	-140.9	-38	0	0	0	111.3	D595 A596 A599 Q601	D593-D595 PolarHBondContact O-N 2.86Å; D593-A596 HydrophobicContact CB-CB 4.32Å; D593-A599 PolarHBondContact N-O 2.86Å; D593-A599 VanDerWaalsContact N-O 3.13Å; D593-Q601 HydrophobicContact CB-CG 4.04Å; D593-Q601 PolarHBondContact OD2-NE2 3.38Å
594	T	60.2	Low	70.3	Confident	133 Å²	133	62.5 Å²	62.5	82%	0.816	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-20.9	177.3	47.2	0	0	0	0	112.7
595	D	55.4	Low	68.3	Low	144 Å²	144	62.2 Å²	62.2	77%	0.77	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	-3.8	-163.2	-64.9	16.2	0	0	0	112.6	D593	D593-D595 PolarHBondContact O-N 2.86Å
596	A	51.2	Low	66.2	Low	51 Å²	51	69 Å²	69	42%	0.421	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.7	52.2	-172.5	0	0	0	0	0	113.2	D593 G598 A599	D593-A596 HydrophobicContact CB-CB 4.32Å; A596-G598 PolarHBondContact O-N 2.94Å; A596-A599 HydrophobicContact CB-CB 4.21Å; A596-A599 WeakPolarHBondContact O-CB 3.16Å; A596-A599 PolarHBondContact O-N 2.94Å
597	E	53.8	Low	63.6	Low	210 Å²	210	71.3 Å²	71.3	98%	0.981	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	32.5	168.9	-59	-167.3	129.1	0	0	116.3
598	G	57.4	Low	61	Low	26 Å²	26	82.1 Å²	82.1	27%	0.268	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	17.6	177.8	0	0	0	0	0	114.9	A596 I600	A596-G598 PolarHBondContact O-N 2.94Å; G598-I600 PolarHBondContact O-N 2.88Å
599	A	60.9	Low	58.6	Low	51 Å²	51	85.7 Å²	85.7	42%	0.421	49%	0.494	S	S	.	.			trans	-57.9	129.7	172.5	0	0	0	0	0	111.8	C592 D593 A596 Q601	C592-A599 WeakPolarHBondContact CA-O 3.34Å; C592-A599 WeakPolarHBondContact CB-O 3.38Å; D593-A599 PolarHBondContact N-O 2.86Å; D593-A599 VanDerWaalsContact N-O 3.13Å; A596-A599 HydrophobicContact CB-CB 4.21Å; A596-A599 WeakPolarHBondContact O-CB 3.16Å; A596-A599 PolarHBondContact O-N 2.94Å; A599-Q601 PolarHBondContact O-N 2.72Å
600	I	68.1	Low	56.2	Low	72 Å²	72	93.7 Å²	93.7	37%	0.369	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	118.2	-177.3	-63.7	176.7	0	0	0	109.6	A496 C590 G598	A496-I600 HydrophobicContact CB-CD1 3.62Å; C590-I600 HydrophobicContact CB-CG2 3.4Å; G598-I600 PolarHBondContact O-N 2.88Å
601	Q	63.5	Low	54.3	Low	118 Å²	118	98.4 Å²	98.4	55%	0.551	57%	0.567	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-83.9	-55.1	177.6	-76.3	-171.1	-12.6	0	0	112.1	G591 D593 A599	G591-Q601 PolarHBondContact O-N 2.88Å; D593-Q601 HydrophobicContact CB-CG 4.04Å; D593-Q601 PolarHBondContact OD2-NE2 3.38Å; A599-Q601 PolarHBondContact O-N 2.72Å
602	T	63.2	Low	53	Low	78 Å²	78	102.7 Å²	102.7	48%	0.479	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-146.9	123	-174.8	56.7	0	0	0	0	113.4	R559 G591	R559-T602 PolarHBondContact NH2-O 3Å; G591-T602 PolarHBondContact N-O 2.92Å; G591-T602 PolarHBondContact O-N 3.41Å
603	C	65.3	Low	52.1	Low	48 Å²	48	105.5 Å²	105.5	32%	0.324	63%	0.627	S	S	.	*			trans	-86.9	-29.5	170.2	-64.1	0	0	0	0	112.7	R559 C590 A605	R559-C603 VanDerWaalsContact NH2-C 3.29Å; R559-C603 PolarHBondContact NH2-O 2.79Å; C590-C603 HydrophobicContact CB-CB 3.94Å; C590-C603 WeakPolarHBondContact CB-SG 3.5Å; C590-C603 WeakPolarHBondContact SG-CA 3.21Å; C590-C603 WeakPolarHBondContact SG-CB 3.38Å; C590-C603 CovalentContact SG-SG 2.04Å; C590-C603 PolarHBondContact SG-SG 3.01Å; C603-A605 PolarHBondContact O-N 2.87Å
604	N	58.2	Low	51.7	Low	140 Å²	140	107.4 Å²	107.4	75%	0.749	64%	0.636	S	S	*	*			trans	-54.7	114.2	176.7	-74.2	-8	0	0	0	111	R559	R559-N604 PolarHBondContact NH2-O 3.06Å
605	A	45.8	Very low	52	Low	54 Å²	54	104.3 Å²	104.3	45%	0.446	62%	0.621	S	S	.	*			trans	-67.7	136.6	161.3	0	0	0	0	0	107.8	C603 A607	C603-A605 PolarHBondContact O-N 2.87Å; A605-A607 PolarHBondContact O-N 3.34Å
606	T	43.2	Very low	52.6	Low	144 Å²	144	102.3 Å²	102.3	88%	0.883	62%	0.615	S	S	*	*			trans	-75.1	63.5	170.6	53.7	0	0	0	0	110	Y608	T606-Y608 PolarHBondContact O-N 3.15Å
607	A	34.7	Very low	53.5	Low	75 Å²	75	102 Å²	102	62%	0.62	62%	0.617	S	S	*	*			trans	-55.3	129.9	159.1	0	0	0	0	0	107.3	A605 V609	A605-A607 PolarHBondContact O-N 3.34Å; A607-V609 PolarHBondContact O-N 2.84Å
608	Y	32.1	Very low	54.1	Low	226 Å²	226	93.6 Å²	93.6	89%	0.886	58%	0.584	S	S	*	*			trans	-59.1	112	173.2	-128.5	-97	0	0	0	107.2	T606 M610	T606-Y608 PolarHBondContact O-N 3.15Å; Y608-M610 PolarHBondContact O-N 2.82Å
609	V	35.6	Very low	54.8	Low	130 Å²	130	97 Å²	97	79%	0.788	60%	0.595	S	S	*	*			trans	-73.1	80.3	179.3	-176.1	0	0	0	0	108.2	A607 S611	A607-V609 PolarHBondContact O-N 2.84Å; V609-S611 VanDerWaalsContact C-N 3.29Å; V609-S611 PolarHBondContact O-N 2.88Å
610	M	34	Very low	55.6	Low	169 Å²	169	99.6 Å²	99.6	83%	0.833	60%	0.601	S	S	*	*			trans	-59.1	105.1	147.1	-72	-149.2	72.6	0	0	105.9	Y608 A612	Y608-M610 PolarHBondContact O-N 2.82Å; M610-A612 PolarHBondContact O-N 2.82Å
611	S	43.5	Very low	55.9	Low	99 Å²	99	98.9 Å²	98.9	69%	0.692	61%	0.606	S	S	*	*			trans	-55	105.9	172.5	53.6	0	0	0	0	108.1	V609 A613	V609-S611 VanDerWaalsContact C-N 3.29Å; V609-S611 PolarHBondContact O-N 2.88Å; S611-A613 PolarHBondContact O-N 2.88Å
612	A	47.2	Very low	56.7	Low	98 Å²	98	98 Å²	98	81%	0.81	60%	0.604	S	S	*	*			trans	-68.7	77.7	171	0	0	0	0	0	107.9	M610 L614	M610-A612 PolarHBondContact O-N 2.82Å; A612-L614 PolarHBondContact O-N 2.94Å
613	A	55	Low	57.6	Low	88 Å²	88	99.7 Å²	99.7	73%	0.727	61%	0.61	S	S	*	*			trans	-58.8	106.5	172	0	0	0	0	0	106.9	S611 S615	S611-A613 PolarHBondContact O-N 2.88Å; A613-S615 PolarHBondContact O-N 3.06Å; A613-S615 VanDerWaalsContact O-N 3.17Å
614	L	57.4	Low	58.6	Low	101 Å²	101	100.9 Å²	100.9	53%	0.529	62%	0.615	S	S	.	*			trans	-45.7	125.3	172.5	-78.7	159.2	0	0	0	107.8	A612 A618 L619	A612-L614 PolarHBondContact O-N 2.94Å; L614-A618 HydrophobicContact CB-CB 4.35Å; L614-A618 HydrophobicContact CD2-CB 3.94Å; L614-L619 HydrophobicContact CB-CD1 4.34Å; L614-L619 HydrophobicContact CB-CG 3.96Å; L614-L619 HydrophobicContact CD1-CD2 4.32Å
615	S	66.3	Low	59.6	Low	69 Å²	69	97.5 Å²	97.5	48%	0.483	60%	0.602	S	S	.	*			trans	-56.7	150.2	-179.2	75.1	0	0	0	0	109.1	A613 G617 A618 L619	A613-S615 PolarHBondContact O-N 3.06Å; A613-S615 VanDerWaalsContact O-N 3.17Å; S615-G617 PolarHBondContact O-N 2.73Å; S615-A618 WeakPolarHBondContact O-CB 3.15Å; S615-A618 PolarHBondContact O-N 2.68Å; S615-A618 PolarHBondContact OG-N 3.46Å; S615-L619 PolarHBondContact O-N 3.25Å; S615-L619 VanDerWaalsContact O-N 3.16Å
616	P	67.6	Low	61.4	Low	102 Å²	102	100.4 Å²	100.4	66%	0.662	61%	0.608	S	S	*	*	H	α-helix	trans	-52.4	-32.5	179	-29.6	36.4	0	0	0	112.8	I620	P616-I620 WeakPolarHBondContact O-CB 3.3Å; P616-I620 WeakPolarHBondContact O-CD1 3.28Å; P616-I620 WeakPolarHBondContact O-CG1 3.38Å; P616-I620 PolarHBondContact O-N 3.44Å
617	G	71.6	Confident	63.5	Low	45 Å²	45	98.1 Å²	98.1	46%	0.464	59%	0.589	S	S	.	*	H	α-helix	trans	-64.3	-37.2	172.9	0	0	0	0	0	114.6	S615 A621	S615-G617 PolarHBondContact O-N 2.73Å; G617-A621 VanDerWaalsContact O-CB 3.29Å; G617-A621 WeakPolarHBondContact O-CB 3.18Å; G617-A621 PolarHBondContact O-N 3.01Å
618	A	65.4	Low	65.9	Low	33 Å²	33	99.3 Å²	99.3	27%	0.273	59%	0.585	S	S	.	*	H	α-helix	trans	-71.8	-39.3	176.6	0	0	0	0	0	112.1	L614 S615 A621 L622	L614-A618 HydrophobicContact CB-CB 4.35Å; L614-A618 HydrophobicContact CD2-CB 3.94Å; S615-A618 WeakPolarHBondContact O-CB 3.15Å; S615-A618 PolarHBondContact O-N 2.68Å; S615-A618 PolarHBondContact OG-N 3.46Å; A618-A621 PolarHBondContact O-N 3.48Å; A618-L622 PolarHBondContact O-N 3.28Å
619	L	73.3	Confident	68.5	Low	96 Å²	96	93.1 Å²	93.1	50%	0.503	57%	0.566	S	S	.	*	H	α-helix	trans	-64.9	-42.2	172.2	-79.5	166.2	0	0	0	111.7	L614 S615 L622 L623	L614-L619 HydrophobicContact CB-CD1 4.34Å; L614-L619 HydrophobicContact CB-CG 3.96Å; L614-L619 HydrophobicContact CD1-CD2 4.32Å; S615-L619 PolarHBondContact O-N 3.25Å; S615-L619 VanDerWaalsContact O-N 3.16Å; L619-L622 PolarHBondContact O-N 2.85Å; L619-L623 WeakPolarHBondContact O-CB 3.45Å; L619-L623 PolarHBondContact O-N 2.69Å
620	I	76.9	Confident	70.8	Confident	106 Å²	106	91.4 Å²	91.4	54%	0.544	55%	0.551	S	S	.	*	H	α-helix	trans	-62.8	-42.1	173.6	-71	164.6	0	0	0	110.8	P616 L622 L623 V624	P616-I620 WeakPolarHBondContact O-CB 3.3Å; P616-I620 WeakPolarHBondContact O-CD1 3.28Å; P616-I620 WeakPolarHBondContact O-CG1 3.38Å; P616-I620 PolarHBondContact O-N 3.44Å; I620-L622 PolarHBondContact O-N 3.33Å; I620-L623 PolarHBondContact O-N 2.97Å; I620-V624 HydrophobicContact CG2-CG2 4.29Å; I620-V624 WeakPolarHBondContact O-CB 3.22Å; I620-V624 WeakPolarHBondContact O-CG2 3.41Å; I620-V624 PolarHBondContact O-N 2.6Å
621	A	74.6	Confident	73.3	Confident	57 Å²	57	87.7 Å²	87.7	47%	0.471	54%	0.538	S	S	.	.	H	α-helix	trans	-61.9	-42.6	177.7	0	0	0	0	0	112.3	G617 A618 V624 C625	G617-A621 VanDerWaalsContact O-CB 3.29Å; G617-A621 WeakPolarHBondContact O-CB 3.18Å; G617-A621 PolarHBondContact O-N 3.01Å; A618-A621 PolarHBondContact O-N 3.48Å; A621-V624 PolarHBondContact O-N 2.77Å; A621-C625 WeakPolarHBondContact O-CB 3.4Å; A621-C625 PolarHBondContact O-N 3.06Å
622	L	79.8	Confident	75.2	Confident	101 Å²	101	87.4 Å²	87.4	53%	0.529	53%	0.529	S	S	.	.	H	α-helix	trans	-64	-41.9	173.2	-75.1	168.1	0	0	0	111.9	A618 L619 I620 V624 C625 M626	A618-L622 PolarHBondContact O-N 3.28Å; L619-L622 PolarHBondContact O-N 2.85Å; I620-L622 PolarHBondContact O-N 3.33Å; L622-V624 PolarHBondContact O-N 3.07Å; L622-C625 PolarHBondContact O-N 2.68Å; L622-M626 WeakPolarHBondContact O-CB 3.49Å; L622-M626 VanDerWaalsContact O-CG 3.29Å; L622-M626 WeakPolarHBondContact O-CG 3.37Å; L622-M626 PolarHBondContact O-N 2.7Å
623	L	82	Confident	77	Confident	113 Å²	113	86.5 Å²	86.5	59%	0.592	51%	0.513	S	S	*	.	H	α-helix	trans	-63.4	-40.8	176.6	-125	166.9	0	0	0	112.1	L619 I620 L627	L619-L623 WeakPolarHBondContact O-CB 3.45Å; L619-L623 PolarHBondContact O-N 2.69Å; I620-L623 PolarHBondContact O-N 2.97Å; L623-L627 HydrophobicContact CD2-CD1 4.23Å; L623-L627 WeakPolarHBondContact O-CB 3.3Å; L623-L627 WeakPolarHBondContact O-CG 3.46Å; L623-L627 PolarHBondContact O-N 3.24Å
624	V	85.6	Confident	78.3	Confident	73 Å²	73	87 Å²	87	44%	0.442	50%	0.503	S	S	.	.	H	α-helix	trans	-66.2	-41.4	174	169	0	0	0	0	111.1	I620 A621 L622 L627 I628	I620-V624 HydrophobicContact CG2-CG2 4.29Å; I620-V624 WeakPolarHBondContact O-CB 3.22Å; I620-V624 WeakPolarHBondContact O-CG2 3.41Å; I620-V624 PolarHBondContact O-N 2.6Å; A621-V624 PolarHBondContact O-N 2.77Å; L622-V624 PolarHBondContact O-N 3.07Å; V624-L627 PolarHBondContact O-N 2.78Å; V624-I628 HydrophobicContact CG1-CD1 3.82Å; V624-I628 HydrophobicContact CG1-CG1 4.47Å; V624-I628 VanDerWaalsContact O-CG1 3.27Å; V624-I628 WeakPolarHBondContact O-CG1 3.27Å; V624-I628 PolarHBondContact O-N 2.9Å
625	C	80.5	Confident	79.4	Confident	69 Å²	69	86.9 Å²	86.9	47%	0.466	50%	0.502	S	S	.	.	H	α-helix	trans	-65.1	-41.9	177.5	-160.2	0	0	0	0	111.9	A621 L622 I628 L629	A621-C625 WeakPolarHBondContact O-CB 3.4Å; A621-C625 PolarHBondContact O-N 3.06Å; L622-C625 PolarHBondContact O-N 2.68Å; C625-I628 PolarHBondContact O-N 3.3Å; C625-L629 PolarHBondContact O-N 2.91Å
626	M	84.1	Confident	80	Confident	114 Å²	114	88 Å²	88	56%	0.562	50%	0.501	S	S	*	.	H	α-helix	trans	-64.6	-39.5	173	-69.7	-69	-81.8	0	0	112.2	L622 L629 I630	L622-M626 WeakPolarHBondContact O-CB 3.49Å; L622-M626 VanDerWaalsContact O-CG 3.29Å; L622-M626 WeakPolarHBondContact O-CG 3.37Å; L622-M626 PolarHBondContact O-N 2.7Å; M626-L629 PolarHBondContact O-N 3.17Å; M626-I630 WeakPolarHBondContact O-CB 3.03Å; M626-I630 WeakPolarHBondContact O-CD1 3.26Å; M626-I630 VanDerWaalsContact O-CG1 3.24Å; M626-I630 WeakPolarHBondContact O-CG1 3.18Å; M626-I630 PolarHBondContact O-N 2.75Å
627	L	85.7	Confident	80.4	Confident	96 Å²	96	87.8 Å²	87.8	50%	0.503	49%	0.494	S	S	.	.	H	α-helix	trans	-64.1	-41.1	173.4	-80.8	165.2	0	0	0	112.2	L623 V624 I630 V631	L623-L627 HydrophobicContact CD2-CD1 4.23Å; L623-L627 WeakPolarHBondContact O-CB 3.3Å; L623-L627 WeakPolarHBondContact O-CG 3.46Å; L623-L627 PolarHBondContact O-N 3.24Å; V624-L627 PolarHBondContact O-N 2.78Å; L627-I630 PolarHBondContact O-N 3.39Å; L627-V631 WeakPolarHBondContact O-CG2 3.29Å; L627-V631 PolarHBondContact O-N 2.97Å
628	I	86.8	Confident	80.5	Confident	101 Å²	101	89.6 Å²	89.6	52%	0.518	50%	0.496	S	S	.	.	H	α-helix	trans	-62.1	-46.2	174.4	-70.5	164.3	0	0	0	110.2	V624 C625 I630 V631 L632	V624-I628 HydrophobicContact CG1-CD1 3.82Å; V624-I628 HydrophobicContact CG1-CG1 4.47Å; V624-I628 VanDerWaalsContact O-CG1 3.27Å; V624-I628 WeakPolarHBondContact O-CG1 3.27Å; V624-I628 PolarHBondContact O-N 2.9Å; C625-I628 PolarHBondContact O-N 3.3Å; I628-I630 PolarHBondContact O-N 2.94Å; I628-V631 PolarHBondContact O-N 3.02Å; I628-L632 VanDerWaalsContact O-CB 3.3Å; I628-L632 WeakPolarHBondContact O-CB 3.07Å; I628-L632 PolarHBondContact O-N 3.42Å
629	L	84.7	Confident	80.7	Confident	95 Å²	95	93 Å²	93	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-59.6	-44.4	175.4	-83.1	164.7	0	0	0	112.4	C625 M626 L632 V633	C625-L629 PolarHBondContact O-N 2.91Å; M626-L629 PolarHBondContact O-N 3.17Å; L629-L632 PolarHBondContact O-N 2.99Å; L629-V633 WeakPolarHBondContact O-CB 3.47Å; L629-V633 WeakPolarHBondContact O-CG2 3.02Å; L629-V633 PolarHBondContact O-N 3.47Å
630	I	84.9	Confident	80.3	Confident	94 Å²	94	96 Å²	96	48%	0.482	52%	0.519	S	S	.	.	H	α-helix	trans	-62.5	-43.6	176.9	-70.9	163.4	0	0	0	111	M626 L627 I628 L632 V633 L634	M626-I630 WeakPolarHBondContact O-CB 3.03Å; M626-I630 WeakPolarHBondContact O-CD1 3.26Å; M626-I630 VanDerWaalsContact O-CG1 3.24Å; M626-I630 WeakPolarHBondContact O-CG1 3.18Å; M626-I630 PolarHBondContact O-N 2.75Å; L627-I630 PolarHBondContact O-N 3.39Å; I628-I630 PolarHBondContact O-N 2.94Å; I630-L632 VanDerWaalsContact C-N 3.34Å; I630-L632 PolarHBondContact O-N 2.88Å; I630-V633 PolarHBondContact O-N 2.99Å; I630-L634 HydrophobicContact CG2-CD1 4Å; I630-L634 WeakPolarHBondContact O-CB 3.2Å; I630-L634 VanDerWaalsContact O-CG 3.27Å; I630-L634 WeakPolarHBondContact O-CG 2.92Å; I630-L634 PolarHBondContact O-N 2.89Å
631	V	85.9	Confident	79.6	Confident	92 Å²	92	100.9 Å²	100.9	56%	0.558	53%	0.53	S	S	*	.	H	α-helix	trans	-63.6	-39.8	175.3	169.4	0	0	0	0	111.4	L627 I628 L634 L635	L627-V631 WeakPolarHBondContact O-CG2 3.29Å; L627-V631 PolarHBondContact O-N 2.97Å; I628-V631 PolarHBondContact O-N 3.02Å; V631-L634 PolarHBondContact O-N 3Å; V631-L635 WeakPolarHBondContact O-CB 3.41Å; V631-L635 PolarHBondContact O-N 2.87Å
632	L	83.8	Confident	78.8	Confident	93 Å²	93	106 Å²	106	49%	0.487	54%	0.544	S	S	.	.	H	α-helix	trans	-70.1	-39.2	-179.7	-154.6	156.4	0	0	0	111.4	I628 L629 I630 L635 I636	I628-L632 VanDerWaalsContact O-CB 3.3Å; I628-L632 WeakPolarHBondContact O-CB 3.07Å; I628-L632 PolarHBondContact O-N 3.42Å; L629-L632 PolarHBondContact O-N 2.99Å; I630-L632 VanDerWaalsContact C-N 3.34Å; I630-L632 PolarHBondContact O-N 2.88Å; L632-L635 PolarHBondContact O-N 2.94Å; L632-I636 HydrophobicContact CD2-CD1 3.66Å; L632-I636 HydrophobicContact CD2-CG1 4.25Å; L632-I636 WeakPolarHBondContact O-CG1 2.78Å; L632-I636 PolarHBondContact O-N 2.91Å
633	V	84.3	Confident	77.5	Confident	79 Å²	79	112.3 Å²	112.3	48%	0.479	56%	0.561	S	S	.	*	H	α-helix	trans	-63.2	-44.1	170.4	169.3	0	0	0	0	111.4	L629 I630 L635 I636 L637	L629-V633 WeakPolarHBondContact O-CB 3.47Å; L629-V633 WeakPolarHBondContact O-CG2 3.02Å; L629-V633 PolarHBondContact O-N 3.47Å; I630-V633 PolarHBondContact O-N 2.99Å; V633-L635 VanDerWaalsContact C-N 3.29Å; V633-L635 PolarHBondContact O-N 2.86Å; V633-I636 PolarHBondContact O-N 2.71Å; V633-L637 HydrophobicContact CG1-CD1 4Å; V633-L637 WeakPolarHBondContact O-CB 3.4Å; V633-L637 VanDerWaalsContact O-CG 3.3Å; V633-L637 WeakPolarHBondContact O-CG 3.36Å; V633-L637 PolarHBondContact O-N 2.82Å
634	L	82.4	Confident	75.6	Confident	99 Å²	99	116.3 Å²	116.3	52%	0.518	57%	0.573	S	S	.	*	H	α-helix	trans	-63.9	-33.5	174.9	-73.5	169.4	0	0	0	112.6	I630 V631 L637 T638	I630-L634 HydrophobicContact CG2-CD1 4Å; I630-L634 WeakPolarHBondContact O-CB 3.2Å; I630-L634 VanDerWaalsContact O-CG 3.27Å; I630-L634 WeakPolarHBondContact O-CG 2.92Å; I630-L634 PolarHBondContact O-N 2.89Å; V631-L634 PolarHBondContact O-N 3Å; L634-L637 PolarHBondContact O-N 2.96Å; L634-T638 WeakPolarHBondContact O-CG2 3.18Å; L634-T638 PolarHBondContact O-N 2.86Å; L634-T638 PolarHBondContact O-OG1 2.81Å; L634-T638 VanDerWaalsContact O-OG1 3.08Å
635	L	80.3	Confident	73.6	Confident	98 Å²	98	115.9 Å²	115.9	51%	0.513	58%	0.584	S	S	.	*	H	α-helix	trans	-71.3	-41	175.1	-169.2	126.1	0	0	0	111.6	V631 L632 V633 L637 T638 L639	V631-L635 WeakPolarHBondContact O-CB 3.41Å; V631-L635 PolarHBondContact O-N 2.87Å; L632-L635 PolarHBondContact O-N 2.94Å; V633-L635 VanDerWaalsContact C-N 3.29Å; V633-L635 PolarHBondContact O-N 2.86Å; L635-L637 VanDerWaalsContact C-N 3.33Å; L635-L637 PolarHBondContact O-N 2.87Å; L635-T638 WeakPolarHBondContact CA-OG1 3.11Å; L635-T638 PolarHBondContact O-N 2.97Å; L635-T638 PolarHBondContact O-OG1 2.9Å; L635-T638 VanDerWaalsContact O-OG1 3.12Å; L635-L639 HydrophobicContact CD2-CD1 3.72Å; L635-L639 HydrophobicContact CG-CD1 4.34Å; L635-L639 WeakPolarHBondContact O-CB 3.31Å; L635-L639 VanDerWaalsContact O-CG 3.28Å; L635-L639 WeakPolarHBondContact O-CG 3.33Å; L635-L639 PolarHBondContact O-N 2.91Å
636	I	79.4	Confident	71.7	Confident	91 Å²	91	121.3 Å²	121.3	47%	0.467	60%	0.602	S	S	.	*	H	α-helix	trans	-60.5	-43.1	170.4	-71.2	167.2	0	0	0	110.7	L632 V633 L639 K640	L632-I636 HydrophobicContact CD2-CD1 3.66Å; L632-I636 HydrophobicContact CD2-CG1 4.25Å; L632-I636 WeakPolarHBondContact O-CG1 2.78Å; L632-I636 PolarHBondContact O-N 2.91Å; V633-I636 PolarHBondContact O-N 2.71Å; I636-L639 PolarHBondContact O-N 2.91Å; I636-K640 VanDerWaalsContact O-CB 3.23Å; I636-K640 WeakPolarHBondContact O-CB 3.27Å; I636-K640 PolarHBondContact O-N 2.75Å
637	L	77	Confident	69.2	Low	99 Å²	99	127.6 Å²	127.6	52%	0.518	62%	0.62	S	S	.	*	H	α-helix	trans	-67.1	-38.7	178.9	-72.5	169.7	0	0	0	112.7	V633 L634 L635 R641	V633-L637 HydrophobicContact CG1-CD1 4Å; V633-L637 WeakPolarHBondContact O-CB 3.4Å; V633-L637 VanDerWaalsContact O-CG 3.3Å; V633-L637 WeakPolarHBondContact O-CG 3.36Å; V633-L637 PolarHBondContact O-N 2.82Å; L634-L637 PolarHBondContact O-N 2.96Å; L635-L637 VanDerWaalsContact C-N 3.33Å; L635-L637 PolarHBondContact O-N 2.87Å; L637-R641 VanDerWaalsContact O-CB 3.29Å; L637-R641 WeakPolarHBondContact O-CB 3.48Å; L637-R641 PolarHBondContact O-N 3.34Å
638	T	73.4	Confident	66.6	Low	82 Å²	82	132 Å²	132	50%	0.503	64%	0.64	S	S	.	*	H	α-helix	trans	-70.9	-38.7	175.2	51.1	0	0	0	0	112.3	L634 L635 R641 H642	L634-T638 WeakPolarHBondContact O-CG2 3.18Å; L634-T638 PolarHBondContact O-N 2.86Å; L634-T638 PolarHBondContact O-OG1 2.81Å; L634-T638 VanDerWaalsContact O-OG1 3.08Å; L635-T638 WeakPolarHBondContact CA-OG1 3.11Å; L635-T638 PolarHBondContact O-N 2.97Å; L635-T638 PolarHBondContact O-OG1 2.9Å; L635-T638 VanDerWaalsContact O-OG1 3.12Å; T638-R641 PolarHBondContact O-N 3.35Å; T638-H642 PolarHBondContact O-N 3.41Å
639	L	70	Confident	64	Low	106 Å²	106	130.8 Å²	130.8	56%	0.555	65%	0.645	S	S	*	*	H	α-helix	trans	-63.7	-43.1	172	-72.3	170.4	0	0	0	112.3	L635 I636 R641 H642 R643	L635-L639 HydrophobicContact CD2-CD1 3.72Å; L635-L639 HydrophobicContact CG-CD1 4.34Å; L635-L639 WeakPolarHBondContact O-CB 3.31Å; L635-L639 VanDerWaalsContact O-CG 3.28Å; L635-L639 WeakPolarHBondContact O-CG 3.33Å; L635-L639 PolarHBondContact O-N 2.91Å; I636-L639 PolarHBondContact O-N 2.91Å; L639-R641 VanDerWaalsContact C-N 3.32Å; L639-R641 PolarHBondContact O-N 3.37Å; L639-H642 PolarHBondContact O-N 3.13Å; L639-R643 PolarHBondContact O-N 3.14Å
640	K	63.5	Low	61.7	Low	158 Å²	158	134.4 Å²	134.4	69%	0.687	66%	0.66	S	S	*	*	H	α-helix	trans	-65.8	-34.4	176.4	-163.6	169.3	-173.7	175.1	0	111.6	I636 K644	I636-K640 VanDerWaalsContact O-CB 3.23Å; I636-K640 WeakPolarHBondContact O-CB 3.27Å; I636-K640 PolarHBondContact O-N 2.75Å; K640-K644 PolarHBondContact O-N 2.68Å
641	R	63.3	Low	59.3	Low	209 Å²	209	137.3 Å²	137.3	79%	0.789	68%	0.676	S	S	*	*	H	α-helix	trans	-68.5	-38.8	171.4	-176.4	172.5	173.7	169.4	-2.5	112.5	L637 T638 L639 K644	L637-R641 VanDerWaalsContact O-CB 3.29Å; L637-R641 WeakPolarHBondContact O-CB 3.48Å; L637-R641 PolarHBondContact O-N 3.34Å; T638-R641 PolarHBondContact O-N 3.35Å; L639-R641 VanDerWaalsContact C-N 3.32Å; L639-R641 PolarHBondContact O-N 3.37Å; R641-K644 PolarHBondContact O-N 2.73Å
642	H	56.9	Low	56.9	Low	165 Å²	165	142.1 Å²	142.1	76%	0.764	69%	0.692	S	S	*	*	H	α-helix	trans	-69.9	-35	175.9	-109	-75.5	0	0	0	113.2	T638 L639 K644 G645	T638-H642 PolarHBondContact O-N 3.41Å; L639-H642 PolarHBondContact O-N 3.13Å; H642-K644 VanDerWaalsContact C-N 3.28Å; H642-K644 PolarHBondContact O-N 2.97Å; H642-G645 PolarHBondContact O-N 3.34Å
643	R	53.4	Low	54.5	Low	233 Å²	233	147.1 Å²	147.1	88%	0.879	71%	0.713	S	S	*	*	H	α-helix	trans	-68.4	-21	173.7	-82.5	-170.7	171.4	-172	-2.3	114.1	L639 G645	L639-R643 PolarHBondContact O-N 3.14Å; R643-G645 VanDerWaalsContact C-N 3.26Å; R643-G645 PolarHBondContact O-N 2.83Å
644	K	41.5	Very low	52.2	Low	196 Å²	196	150.3 Å²	150.3	85%	0.852	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	9.6	176.8	-120.1	-169.1	-179.9	-162.8	0	114.5	K640 R641 H642	K640-K644 PolarHBondContact O-N 2.68Å; R641-K644 PolarHBondContact O-N 2.73Å; H642-K644 VanDerWaalsContact C-N 3.28Å; H642-K644 PolarHBondContact O-N 2.97Å
645	G	43.6	Very low	49.8	Very low	64 Å²	64	153.2 Å²	153.2	66%	0.66	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-6.2	-178	0	0	0	0	0	116.6	H642 R643	H642-G645 PolarHBondContact O-N 3.34Å; R643-G645 VanDerWaalsContact C-N 3.26Å; R643-G645 PolarHBondContact O-N 2.83Å
646	Q	40.2	Very low	47.5	Very low	183 Å²	183	156.9 Å²	156.9	86%	0.855	75%	0.748	S	S	*	*	S	Bend	trans	-141.1	78.6	-179.8	-77	-169.5	-53.5	0	0	112.9
647	R	32.6	Very low	45.3	Very low	246 Å²	246	157.8 Å²	157.8	93%	0.928	75%	0.753	S	S	*	*			trans	-171.5	133	132.5	-103.1	167	-176.4	-177.5	-0.9	108.4
648	M	30.8	Very low	43	Very low	188 Å²	188	159.6 Å²	159.6	93%	0.926	76%	0.764	S	S	*	*			trans	-102.5	-179.4	164	-75.2	-167.2	69.5	0	0	108.5
649	A	32.5	Very low	41.1	Very low	77 Å²	77	161.7 Å²	161.7	64%	0.636	78%	0.776	S	S	*	*			trans	91.4	117.4	175	0	0	0	0	0	115.3
650	E	35.9	Very low	39.6	Very low	171 Å²	171	164.4 Å²	164.4	80%	0.799	79%	0.79	S	S	*	*			trans	70.8	127.1	150.4	-75.5	109.2	-128.4	0	0	122.4
651	D	35	Very low	38.1	Very low	154 Å²	154	165.8 Å²	165.8	82%	0.824	80%	0.795	S	S	*	*			trans	74.9	87.9	147.3	-53	-7.2	0	0	0	119.9
652	E	34.6	Very low	36.7	Very low	193 Å²	193	166.2 Å²	166.2	90%	0.902	80%	0.799	S	S	*	*			trans	-80.1	128.1	149.1	-60.6	-178.7	124.5	0	0	109.5
653	E	33.9	Very low	35.6	Very low	198 Å²	198	164.6 Å²	164.6	93%	0.925	80%	0.795	S	S	*	*			trans	-168.2	109.6	132.8	-112.2	173.6	-152.9	0	0	111.7
654	D	35.4	Very low	34.7	Very low	146 Å²	146	160.1 Å²	160.1	78%	0.781	79%	0.789	S	S	*	*				177	123.8	113.1	-177.6	7.6	0	0	0	108.8	R656	D654-R656 PolarHBondContact OD1-N 2.81Å
655	M	33.6	Very low	34.8	Very low	161 Å²	161	160.8 Å²	160.8	79%	0.793	80%	0.795	S	S	*	*			trans	-157.9	110.4	137	-107	-157.1	-74.2	0	0	112
656	R	31.4	Very low	34.6	Very low	175 Å²	175	161.9 Å²	161.9	66%	0.66	81%	0.807	S	S	*	*				95.6	132.5	124.2	-81.5	-178	174.1	-70.3	-12.9	122.2	D654	D654-R656 PolarHBondContact OD1-N 2.81Å
657	D	32.5	Very low	34.6	Very low	109 Å²	109	156.8 Å²	156.8	58%	0.583	80%	0.803	S	S	*	*			trans	63.3	119.4	134.8	-54.5	-17.2	0	0	0	116.4
658	N	29.8	Very low	35.2	Very low	138 Å²	138	149.3 Å²	149.3	74%	0.738	80%	0.803	S	S	*	*			cis	-176.4	157.6	46.3	-117.6	-42.2	0	0	0	112.4
659	V	33.4	Very low	36.2	Very low	125 Å²	125	147.9 Å²	147.9	76%	0.758	79%	0.794	S	S	*	*			trans	64.9	123.7	149.3	171.5	0	0	0	0	116
660	I	38.3	Very low	36.5	Very low	164 Å²	164	151.4 Å²	151.4	84%	0.841	80%	0.797	S	S	*	*				-136.5	166.5	50.3	-62.4	171.9	0	0	0	111.2
661	K	32.4	Very low	36.7	Very low	186 Å²	186	151 Å²	151	81%	0.809	80%	0.8	S	S	*	*			trans	-81	145.3	175.4	-67.5	-177.8	175.7	-176.2	0	113.7
662	Y	33	Very low	36.9	Very low	219 Å²	219	148.2 Å²	148.2	86%	0.859	79%	0.789	S	S	*	*			trans	16.1	114	146.2	-74.1	-97.8	0	0	0	117.9
663	N	33.5	Very low	37	Very low	130 Å²	130	147.9 Å²	147.9	70%	0.695	79%	0.788	S	S	*	*				-163.3	164	103	-125.4	45.1	0	0	0	112.2
664	D	35	Very low	36.9	Very low	140 Å²	140	142.5 Å²	142.5	75%	0.749	78%	0.777	S	S	*	*			trans	55.7	87.5	153.8	-50.2	-34.2	0	0	0	120.3
665	E	42.8	Very low	36.9	Very low	209 Å²	209	146.9 Å²	146.9	98%	0.977	79%	0.785	S	S	*	*			trans	-143.3	101.7	142	-147.5	174.2	-121	0	0	109.4
666	G	40.1	Very low	37.1	Very low	88 Å²	88	145.3 Å²	145.3	91%	0.907	78%	0.779	S	S	*	*	S	Bend	trans	159.6	84.4	-174.4	0	0	0	0	0	114
667	G	40.5	Very low	37.7	Very low	76 Å²	76	143.7 Å²	143.7	78%	0.784	78%	0.781	S	S	*	*			trans	140.3	81.6	179.2	0	0	0	0	0	112.2	E669	G667-E669 VanDerWaalsContact C-N 3.32Å; G667-E669 PolarHBondContact O-N 2.95Å
668	G	45.6	Very low	38.1	Very low	89 Å²	89	142.5 Å²	142.5	92%	0.918	78%	0.781	S	S	*	*			trans	-79.1	75.2	176.6	0	0	0	0	0	112.4
669	E	50.7	Low	38.6	Very low	158 Å²	158	140.5 Å²	140.5	74%	0.738	78%	0.784	S	S	*	*			trans	-134.3	139.2	170.6	-85.5	-160.3	-147.2	0	0	112.3	G667	G667-E669 VanDerWaalsContact C-N 3.32Å; G667-E669 PolarHBondContact O-N 2.95Å
670	Q	39.4	Very low	38.9	Very low	150 Å²	150	141.3 Å²	141.3	70%	0.701	78%	0.783	S	S	*	*			trans	70	83.6	160.6	-60.8	167.8	52	0	0	118.8
671	D	38.8	Very low	38.9	Very low	162 Å²	162	143.8 Å²	143.8	87%	0.866	78%	0.782	S	S	*	*				-133.3	122.3	127.2	-92.9	-29.7	0	0	0	105.2
672	T	40.2	Very low	39.1	Very low	96 Å²	96	142 Å²	142	59%	0.589	78%	0.781	S	S	*	*			cis	53	119.1	21.9	82.8	0	0	0	0	113.2
673	Q	37.5	Very low	39.1	Very low	186 Å²	186	138.7 Å²	138.7	87%	0.869	78%	0.778	S	S	*	*			cis	-145.6	140.8	20.4	-57.9	167.1	10.7	0	0	110.8
674	A	31.8	Very low	39.1	Very low	86 Å²	86	143 Å²	143	71%	0.711	79%	0.786	S	S	*	*			trans	-160.9	51.6	167.6	0	0	0	0	0	115.4
675	Y	34.6	Very low	38.8	Very low	238 Å²	238	142 Å²	142	93%	0.933	78%	0.781	S	S	*	*			trans	-156	141.2	150.5	-87.2	-58.2	0	0	0	111.4
676	D	38.5	Very low	38.2	Very low	128 Å²	128	141 Å²	141	68%	0.684	77%	0.773	S	S	*	*			trans	-89.5	128.5	-178.7	178.6	17.8	0	0	0	111.4	S678	D676-S678 VanDerWaalsContact OD1-CB 3.23Å; D676-S678 WeakPolarHBondContact OD1-CB 3.13Å; D676-S678 PolarHBondContact OD1-N 2.9Å; D676-S678 PolarHBondContact OD1-OG 2.68Å; D676-S678 WeakPolarHBondContact OD2-CB 3.34Å; D676-S678 PolarHBondContact OD2-OG 2.64Å
677	M	42.9	Very low	37.8	Very low	141 Å²	141	142.4 Å²	142.4	70%	0.695	77%	0.766	S	S	*	*			trans	-106.4	18.2	178.3	-64.9	-172	69.9	0	0	113.5	A679 L680	M677-A679 PolarHBondContact O-N 3.16Å; M677-L680 HydrophobicContact CE-CD1 3.76Å; M677-L680 PolarHBondContact O-N 2.77Å; M677-L680 VanDerWaalsContact O-N 3.11Å
678	S	40.8	Very low	37.3	Very low	83 Å²	83	147.5 Å²	147.5	58%	0.58	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-52.1	-22.4	176.4	59.5	0	0	0	0	114.6	D676 L680	D676-S678 VanDerWaalsContact OD1-CB 3.23Å; D676-S678 WeakPolarHBondContact OD1-CB 3.13Å; D676-S678 PolarHBondContact OD1-N 2.9Å; D676-S678 PolarHBondContact OD1-OG 2.68Å; D676-S678 WeakPolarHBondContact OD2-CB 3.34Å; D676-S678 PolarHBondContact OD2-OG 2.64Å; S678-L680 VanDerWaalsContact C-N 3.33Å; S678-L680 PolarHBondContact O-N 3.25Å
679	A	41.5	Very low	36.5	Very low	97 Å²	97	148.2 Å²	148.2	80%	0.802	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-68	-17.9	176.8	0	0	0	0	0	115.9	M677	M677-A679 PolarHBondContact O-N 3.16Å
680	L	39	Very low	35.4	Very low	141 Å²	141	149.5 Å²	149.5	74%	0.738	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-99.2	-2.1	-176.4	-80	169.2	0	0	0	114.9	M677 S678 N682	M677-L680 HydrophobicContact CE-CD1 3.76Å; M677-L680 PolarHBondContact O-N 2.77Å; M677-L680 VanDerWaalsContact O-N 3.11Å; S678-L680 VanDerWaalsContact C-N 3.33Å; S678-L680 PolarHBondContact O-N 3.25Å; L680-N682 PolarHBondContact O-N 2.79Å
681	R	38.9	Very low	34.8	Very low	216 Å²	216	147.2 Å²	147.2	82%	0.815	77%	0.771	S	S	*	*			trans	-95.3	73.4	-177.8	-167.7	174.8	-178.5	142.9	1.6	112.1
682	N	35.8	Very low	34.3	Very low	149 Å²	149	145.3 Å²	145.3	80%	0.797	77%	0.768	S	S	*	*			trans	-149.8	47.5	171.3	-132.5	-25.1	0	0	0	115.6	L680	L680-N682 PolarHBondContact O-N 2.79Å
683	L	33.7	Very low	34.1	Very low	150 Å²	150	148.5 Å²	148.5	79%	0.785	78%	0.782	S	S	*	*	S	Bend	trans	-141.1	140.6	151	-98.1	114.5	0	0	0	107.8
684	Y	32.8	Very low	34	Very low	220 Å²	220	145.1 Å²	145.1	86%	0.863	78%	0.779	S	S	*	*			trans	72.3	64.7	-175.9	-51.2	-75	0	0	0	117.5
685	D	28.9	Very low	34.6	Very low	120 Å²	120	144.6 Å²	144.6	64%	0.642	78%	0.782	S	S	*	*				-97.6	155.2	128.1	-79.3	-48.9	0	0	0	106.9
686	F	29.3	Very low	34.6	Very low	188 Å²	188	139.2 Å²	139.2	83%	0.825	78%	0.776	S	S	*	*			cis	-150.8	-177.9	28.3	-70.7	-92	0	0	0	109.7
687	P	31.6	Very low	34.6	Very low	116 Å²	116	139.1 Å²	139.1	75%	0.753	78%	0.776	S	S	*	*			cis	-129.2	-173.9	-47.7	37.2	-20.9	0	0	0	112
688	E	31.1	Very low	34.7	Very low	184 Å²	184	139 Å²	139	86%	0.86	78%	0.776	S	S	*	*			trans	-66.6	147.6	176.6	-56.9	175.8	98.9	0	0	115.3
689	A	28.8	Very low	35	Very low	104 Å²	104	145.7 Å²	145.7	86%	0.86	79%	0.789	S	S	*	*			trans	-147.4	151.6	153.1	0	0	0	0	0	110.2
690	K	26.8	Very low	35.2	Very low	184 Å²	184	146.3 Å²	146.3	80%	0.8	79%	0.787	S	S	*	*			trans	-102.3	148.4	-165.3	-68	176.9	178.1	174.2	0	114.5
691	S	26.5	Very low	35.3	Very low	103 Å²	103	144.8 Å²	144.8	72%	0.72	78%	0.779	S	S	*	*			trans	58.4	126.2	143	61.5	0	0	0	0	121.3
692	C	28.1	Very low	35.6	Very low	121 Å²	121	138.1 Å²	138.1	82%	0.818	76%	0.764	S	S	*	*			trans	72.3	115.4	142.9	-63.6	0	0	0	0	120.5
693	D	36.3	Very low	36.1	Very low	163 Å²	163	138.9 Å²	138.9	87%	0.872	76%	0.763	S	S	*	*				67	61.3	129.7	-150.8	22	0	0	0	118.6
694	S	36.1	Very low	36.6	Very low	115 Å²	115	141.5 Å²	141.5	80%	0.804	76%	0.762	S	S	*	*			trans	-162.6	145.6	137.6	20.9	0	0	0	0	110.2
695	G	45	Very low	37.3	Very low	75 Å²	75	135.5 Å²	135.5	77%	0.773	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-71.1	137.4	-176	0	0	0	0	0	113
696	P	34.8	Very low	38.1	Very low	125 Å²	125	134.7 Å²	134.7	81%	0.812	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-75.3	149.1	-177	30.2	-35.2	0	0	0	113.6
697	D	38.5	Very low	38.8	Very low	127 Å²	127	129.9 Å²	129.9	68%	0.679	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-76.9	143.7	-173.8	-164.3	-4.6	0	0	0	113.2	R699	D697-R699 PolarHBondContact O-N 3.13Å
698	I	44.2	Very low	39.5	Very low	138 Å²	138	131.6 Å²	131.6	71%	0.708	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	42.8	-161.1	-49.6	176.9	0	0	0	111.1
699	R	46.1	Very low	40.2	Very low	224 Å²	224	134.3 Å²	134.3	85%	0.845	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.6	8.3	-170	-65.3	-169.6	176.6	-170.6	0.1	116.9	D697	D697-R699 PolarHBondContact O-N 3.13Å
700	S	46.2	Very low	40.6	Very low	109 Å²	109	136.5 Å²	136.5	76%	0.762	74%	0.739	S	S	*	*	S	Bend	trans	-128.4	20.4	-177	58	0	0	0	0	115.5
701	L	41.8	Very low	40.9	Very low	110 Å²	110	131.6 Å²	131.6	58%	0.576	74%	0.741	S	S	*	*	S	Bend	trans	-110.5	141.7	178.6	-77.8	169.6	0	0	0	113
702	P	44.6	Very low	41.3	Very low	76 Å²	76	130.8 Å²	130.8	49%	0.494	75%	0.748	S	S	.	*			trans	-61.5	145.4	173.2	-24.1	35.1	0	0	0	113.6	W704 I705	P702-W704 VanDerWaalsContact C-N 3.26Å; P702-W704 PolarHBondContact O-N 3.02Å; P702-W704 VanDerWaalsContact O-N 3.09Å; P702-I705 PolarHBondContact O-N 3.16Å
703	Q	47.2	Very low	41.4	Very low	164 Å²	164	128.4 Å²	128.4	77%	0.766	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-62.6	-23.2	-166.7	-67.3	178.8	-68.7	0	0	115.4	I705 Q706	Q703-I705 PolarHBondContact O-N 3.07Å; Q703-Q706 PolarHBondContact O-N 2.97Å; Q703-Q706 VanDerWaalsContact O-N 3.1Å
704	W	44.7	Very low	41.5	Very low	206 Å²	206	126.8 Å²	126.8	78%	0.78	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-68.1	-14.5	-177.9	65	-92.2	0	0	0	114.3	P702	P702-W704 VanDerWaalsContact C-N 3.26Å; P702-W704 PolarHBondContact O-N 3.02Å; P702-W704 VanDerWaalsContact O-N 3.09Å
705	I	46.9	Very low	41.3	Very low	93 Å²	93	128.9 Å²	128.9	48%	0.477	74%	0.743	S	S	.	*	G	3₁₀ helix	trans	-91	-22.2	173.6	-64.8	177.7	0	0	0	112	P702 Q703	P702-I705 PolarHBondContact O-N 3.16Å; Q703-I705 PolarHBondContact O-N 3.07Å
706	Q	45.5	Very low	40.7	Very low	103 Å²	103	128.9 Å²	128.9	48%	0.481	74%	0.743	S	S	.	*	G	3₁₀ helix	trans	-81.4	-18	-176.4	-69.9	-173.8	-28.2	0	0	114.1	Q703 N708	Q703-Q706 PolarHBondContact O-N 2.97Å; Q703-Q706 VanDerWaalsContact O-N 3.1Å; Q706-N708 VanDerWaalsContact C-N 3.33Å; Q706-N708 PolarHBondContact O-N 2.65Å
707	A	44.3	Very low	40.7	Very low	88 Å²	88	127.9 Å²	127.9	73%	0.727	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-75.2	-11.7	-170.3	0	0	0	0	0	115.7
708	N	45.1	Very low	40.6	Very low	151 Å²	151	130.9 Å²	130.9	81%	0.807	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-118.1	21.8	-160.3	-135.5	5.4	0	0	0	115.5	Q706	Q706-N708 VanDerWaalsContact C-N 3.33Å; Q706-N708 PolarHBondContact O-N 2.65Å
709	R	47.3	Very low	40.1	Very low	241 Å²	241	129.4 Å²	129.4	91%	0.909	77%	0.766	S	S	*	*	S	Bend	trans	-144.4	38.1	-179.2	-78.4	-162.1	174.6	-177.5	-0.4	116.3
710	V	36.3	Very low	39.6	Very low	151 Å²	151	123.6 Å²	123.6	92%	0.915	77%	0.765	S	S	*	*	S	Bend	trans	-140.9	127.6	160.9	-174.4	0	0	0	0	110.1
711	G	33.5	Very low	39.3	Very low	81 Å²	81	123.2 Å²	123.2	84%	0.835	77%	0.769	S	S	*	*			trans	108.2	110.3	174.3	0	0	0	0	0	113.2
712	G	33.8	Very low	39.4	Very low	85 Å²	85	123.8 Å²	123.8	88%	0.876	78%	0.777	S	S	*	*			trans	-127.2	140.8	166.7	0	0	0	0	0	109.6
713	G	30.7	Very low	39.5	Very low	72 Å²	72	125.9 Å²	125.9	74%	0.742	78%	0.784	S	S	*	*			trans	163	105.3	177.9	0	0	0	0	0	113.5
714	V	38.4	Very low	39.5	Very low	128 Å²	128	125.2 Å²	125.2	78%	0.776	78%	0.779	S	S	*	*			trans	46	121.3	144.8	-172.2	0	0	0	0	119.1
715	D	32.4	Very low	39.8	Very low	159 Å²	159	118.4 Å²	118.4	85%	0.85	76%	0.763	S	S	*	*			trans	62	125.6	159.8	-58.1	-15.6	0	0	0	120.4
716	G	31.7	Very low	40.1	Very low	75 Å²	75	121 Å²	121	77%	0.773	78%	0.777	S	S	*	*			trans	107.2	97.7	142.3	0	0	0	0	0	119.6
717	A	35.8	Very low	40.1	Very low	104 Å²	104	122.1 Å²	122.1	86%	0.86	78%	0.78	S	S	*	*			trans	66.5	163.5	146.5	0	0	0	0	0	121
718	M	35.6	Very low	40.5	Very low	190 Å²	190	125.9 Å²	125.9	94%	0.936	78%	0.78	S	S	*	*			trans	54.4	101.6	176.6	-74.8	-164.9	164.6	0	0	118.4
719	A	33.9	Very low	41.1	Very low	108 Å²	108	120.7 Å²	120.7	89%	0.893	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-74.4	131.1	152.1	0	0	0	0	0	109.7
720	A	36.3	Very low	41.4	Very low	101 Å²	101	116.4 Å²	116.4	84%	0.835	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-79.5	138.2	179	0	0	0	0	0	111.7
721	A	40	Very low	42	Very low	102 Å²	102	113.3 Å²	113.3	84%	0.843	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-71.3	136.6	178	0	0	0	0	0	112.1
722	T	44.2	Very low	43.2	Very low	122 Å²	122	117.6 Å²	117.6	75%	0.748	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-76.5	119.5	168.8	37	0	0	0	0	110.1	F724	T722-F724 PolarHBondContact O-N 3.43Å; T722-F724 VanDerWaalsContact O-N 3.14Å
723	D	45.7	Very low	44.2	Very low	119 Å²	119	120.1 Å²	120.1	64%	0.636	70%	0.703	S	S	*	*			trans	-74.6	106.7	-173.5	-177.1	16.7	0	0	0	113	S725	D723-S725 PolarHBondContact O-N 3.25Å; D723-S725 WeakPolarHBondContact OD1-CB 3.1Å; D723-S725 PolarHBondContact OD1-N 2.86Å; D723-S725 PolarHBondContact OD1-OG 2.96Å; D723-S725 WeakPolarHBondContact OD2-CB 3.32Å; D723-S725 PolarHBondContact OD2-OG 2.75Å
724	F	46.7	Very low	45.6	Very low	151 Å²	151	122 Å²	122	66%	0.662	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-5.5	175.5	-99.4	-96	0	0	0	114.6	T722 L726 F727 K728	T722-F724 PolarHBondContact O-N 3.43Å; T722-F724 VanDerWaalsContact O-N 3.14Å; F724-L726 VanDerWaalsContact C-N 3.29Å; F724-L726 PolarHBondContact O-N 3.46Å; F724-F727 HydrophobicContact CD1-CB 4.45Å; F724-F727 PolarHBondContact O-N 3.25Å; F724-F727 VanDerWaalsContact O-N 3.17Å; F724-K728 PolarHBondContact O-N 3.25Å
725	S	52.6	Low	46.8	Very low	62 Å²	62	119.4 Å²	119.4	43%	0.434	68%	0.675	S	S	.	*	H	α-helix	trans	-54.8	-41.6	-176	72.7	0	0	0	0	113.3	D723 F727 K728 G729	D723-S725 PolarHBondContact O-N 3.25Å; D723-S725 WeakPolarHBondContact OD1-CB 3.1Å; D723-S725 PolarHBondContact OD1-N 2.86Å; D723-S725 PolarHBondContact OD1-OG 2.96Å; D723-S725 WeakPolarHBondContact OD2-CB 3.32Å; D723-S725 PolarHBondContact OD2-OG 2.75Å; S725-F727 PolarHBondContact O-N 2.94Å; S725-K728 PolarHBondContact O-N 3.45Å; S725-G729 PolarHBondContact O-N 3.42Å; S725-G729 VanDerWaalsContact O-N 3.09Å
726	L	52.4	Low	48.1	Very low	148 Å²	148	116.9 Å²	116.9	78%	0.775	66%	0.658	S	S	*	*	H	α-helix	trans	-64.2	-37.9	-178.9	-73	165.4	0	0	0	112.5	F724 G729 Y730	F724-L726 VanDerWaalsContact C-N 3.29Å; F724-L726 PolarHBondContact O-N 3.46Å; L726-G729 PolarHBondContact O-N 3.43Å; L726-Y730 PolarHBondContact O-N 2.65Å
727	F	45.2	Very low	49.4	Very low	127 Å²	127	118.3 Å²	118.3	56%	0.557	65%	0.645	S	S	*	*	H	α-helix	trans	-69.2	-41.4	177.5	-167.4	-103.7	0	0	0	111.2	F724 S725 G729 Y730 I731	F724-F727 HydrophobicContact CD1-CB 4.45Å; F724-F727 PolarHBondContact O-N 3.25Å; F724-F727 VanDerWaalsContact O-N 3.17Å; S725-F727 PolarHBondContact O-N 2.94Å; F727-G729 VanDerWaalsContact C-N 3.29Å; F727-G729 PolarHBondContact O-N 2.73Å; F727-Y730 WeakPolarHBondContact O-CB 3.22Å; F727-Y730 PolarHBondContact O-N 2.86Å; F727-Y730 VanDerWaalsContact O-N 3.13Å; F727-I731 HydrophobicContact CD1-CG1 4.31Å; F727-I731 HydrophobicContact CE1-CD1 4.22Å; F727-I731 HydrophobicContact CE1-CG1 4.12Å; F727-I731 HydrophobicContact CZ-CD1 4.35Å; F727-I731 PolarHBondContact O-N 2.75Å; F727-I731 VanDerWaalsContact O-N 3.16Å
728	K	53	Low	50.2	Low	166 Å²	166	116.3 Å²	116.3	72%	0.722	63%	0.628	S	S	*	*	H	α-helix	trans	-61.7	-35.8	176.4	-162	169.3	-172.4	170.3	0	112.4	F724 S725 R732	F724-K728 PolarHBondContact O-N 3.25Å; S725-K728 PolarHBondContact O-N 3.45Å; K728-R732 PolarHBondContact O-N 2.97Å
729	G	57.2	Low	50.9	Low	43 Å²	43	113.6 Å²	113.6	44%	0.443	62%	0.617	S	S	.	*	H	α-helix	trans	-66	-36.8	173.3	0	0	0	0	0	114	S725 L726 F727 K733	S725-G729 PolarHBondContact O-N 3.42Å; S725-G729 VanDerWaalsContact O-N 3.09Å; L726-G729 PolarHBondContact O-N 3.43Å; F727-G729 VanDerWaalsContact C-N 3.29Å; F727-G729 PolarHBondContact O-N 2.73Å; G729-K733 PolarHBondContact O-N 2.75Å
730	Y	53.4	Low	51.9	Low	150 Å²	150	112 Å²	112	59%	0.588	60%	0.604	S	S	*	*	H	α-helix	trans	-67	-47	176.7	179.5	-100.4	0	0	0	112.2	L726 F727 K733 K734	L726-Y730 PolarHBondContact O-N 2.65Å; F727-Y730 WeakPolarHBondContact O-CB 3.22Å; F727-Y730 PolarHBondContact O-N 2.86Å; F727-Y730 VanDerWaalsContact O-N 3.13Å; Y730-K733 PolarHBondContact O-N 3.27Å; Y730-K734 PolarHBondContact O-N 2.59Å
731	I	49.9	Very low	53	Low	87 Å²	87	111 Å²	111	45%	0.446	59%	0.585	S	S	.	*	H	α-helix	trans	-58.4	-50.1	177.7	-62.9	-67.4	0	0	0	110.9	F727 K733 K734 V735	F727-I731 HydrophobicContact CD1-CG1 4.31Å; F727-I731 HydrophobicContact CE1-CD1 4.22Å; F727-I731 HydrophobicContact CE1-CG1 4.12Å; F727-I731 HydrophobicContact CZ-CD1 4.35Å; F727-I731 PolarHBondContact O-N 2.75Å; F727-I731 VanDerWaalsContact O-N 3.16Å; I731-K733 VanDerWaalsContact C-N 3.33Å; I731-K733 PolarHBondContact O-N 3.45Å; I731-K734 WeakPolarHBondContact O-CB 3.42Å; I731-K734 PolarHBondContact O-N 3.19Å; I731-V735 PolarHBondContact O-N 2.76Å; I731-V735 VanDerWaalsContact O-N 3.16Å
732	R	58.1	Low	53.6	Low	170 Å²	170	114.9 Å²	114.9	64%	0.642	59%	0.591	S	S	*	*	H	α-helix	trans	-57.6	-44.8	-178.2	-175.2	175.8	-174.7	132.2	13.1	112.4	K728 K734 V735 E736	K728-R732 PolarHBondContact O-N 2.97Å; R732-K734 PolarHBondContact O-N 2.89Å; R732-V735 PolarHBondContact O-N 3.26Å; R732-E736 HydrophobicContact CG-CG 4.46Å; R732-E736 WeakPolarHBondContact CG-OE1 3.43Å; R732-E736 IonicContact CZ-OE1 3.62Å; R732-E736 IonicContact NE-OE1 3.95Å; R732-E736 PolarHBondContact NE-OE1 2.97Å; R732-E736 IonicContact NH2-OE1 2.61Å; R732-E736 WeakPolarHBondContact O-CG 3.42Å; R732-E736 PolarHBondContact O-N 2.85Å
733	K	56	Low	54	Low	139 Å²	139	113.7 Å²	113.7	60%	0.604	59%	0.587	S	S	*	*	H	α-helix	trans	-64.9	-17.3	177.6	-171.3	173	-179.3	179.7	0	113.5	G729 Y730 I731 Q737	G729-K733 PolarHBondContact O-N 2.75Å; Y730-K733 PolarHBondContact O-N 3.27Å; I731-K733 VanDerWaalsContact C-N 3.33Å; I731-K733 PolarHBondContact O-N 3.45Å; K733-Q737 VanDerWaalsContact O-CG 3.24Å; K733-Q737 WeakPolarHBondContact O-CG 3.17Å
734	K	59.8	Low	54.2	Low	110 Å²	110	112.6 Å²	112.6	48%	0.478	59%	0.585	S	S	.	*	H	α-helix	trans	-87.8	-35.9	173.9	-84.2	-74.4	164.9	-155.2	0	113.2	Y730 I731 R732 Q737 A738	Y730-K734 PolarHBondContact O-N 2.59Å; I731-K734 WeakPolarHBondContact O-CB 3.42Å; I731-K734 PolarHBondContact O-N 3.19Å; R732-K734 PolarHBondContact O-N 2.89Å; K734-Q737 PolarHBondContact O-N 3.34Å; K734-A738 PolarHBondContact O-N 2.9Å
735	V	62.3	Low	54	Low	74 Å²	74	110.2 Å²	110.2	45%	0.448	59%	0.585	S	S	.	*	H	α-helix	trans	-64.1	-50	171.6	178.8	0	0	0	0	110.2	I731 R732 Q737 A738 D739	I731-V735 PolarHBondContact O-N 2.76Å; I731-V735 VanDerWaalsContact O-N 3.16Å; R732-V735 PolarHBondContact O-N 3.26Å; V735-Q737 PolarHBondContact O-N 3.17Å; V735-A738 PolarHBondContact O-N 2.89Å; V735-D739 WeakPolarHBondContact CG1-OD2 3.41Å; V735-D739 PolarHBondContact O-N 2.85Å
736	E	60.4	Low	53.4	Low	106 Å²	106	113.2 Å²	113.2	50%	0.495	60%	0.602	S	S	.	*	H	α-helix	trans	-62.8	-9.1	176.2	-67	169.2	179.8	0	0	113.9	R732	R732-E736 HydrophobicContact CG-CG 4.46Å; R732-E736 WeakPolarHBondContact CG-OE1 3.43Å; R732-E736 IonicContact CZ-OE1 3.62Å; R732-E736 IonicContact NE-OE1 3.95Å; R732-E736 PolarHBondContact NE-OE1 2.97Å; R732-E736 IonicContact NH2-OE1 2.61Å; R732-E736 WeakPolarHBondContact O-CG 3.42Å; R732-E736 PolarHBondContact O-N 2.85Å
737	Q	58	Low	52.7	Low	105 Å²	105	117.1 Å²	117.1	49%	0.491	61%	0.608	S	S	.	*	H	α-helix	trans	-95.4	-22.5	170.7	-81.9	-177.6	-15.1	0	0	113.8	K733 K734 V735	K733-Q737 VanDerWaalsContact O-CG 3.24Å; K733-Q737 WeakPolarHBondContact O-CG 3.17Å; K734-Q737 PolarHBondContact O-N 3.34Å; V735-Q737 PolarHBondContact O-N 3.17Å
738	A	52.6	Low	52.3	Low	63 Å²	63	118.5 Å²	118.5	52%	0.521	62%	0.622	S	S	.	*	H	α-helix	trans	-85.7	-42.9	176.1	0	0	0	0	0	111.1	K734 V735 A740 D741	K734-A738 PolarHBondContact O-N 2.9Å; V735-A738 PolarHBondContact O-N 2.89Å; A738-A740 PolarHBondContact O-N 2.8Å; A738-D741 PolarHBondContact O-N 3.14Å
739	D	51.8	Low	51.2	Low	132 Å²	132	116 Å²	116	71%	0.706	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-12.8	177.8	-57.8	-21.6	0	0	0	113.4	V735	V735-D739 WeakPolarHBondContact CG1-OD2 3.41Å; V735-D739 PolarHBondContact O-N 2.85Å
740	A	53.9	Low	50.1	Low	74 Å²	74	123.4 Å²	123.4	61%	0.612	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-2.8	177.7	0	0	0	0	0	113.9	A738 L742	A738-A740 PolarHBondContact O-N 2.8Å; A740-L742 PolarHBondContact O-N 3.43Å
741	D	59.9	Low	48.9	Very low	82 Å²	82	124.8 Å²	124.8	44%	0.439	66%	0.657	S	S	.	*			trans	-86.8	100.5	-178.7	-164.1	-27.9	0	0	0	111.9	A738 S743 V744	A738-D741 PolarHBondContact O-N 3.14Å; D741-S743 PolarHBondContact O-N 2.95Å; D741-S743 VanDerWaalsContact OD1-CB 3.29Å; D741-S743 WeakPolarHBondContact OD1-CB 3.39Å; D741-S743 PolarHBondContact OD1-N 3.18Å; D741-S743 PolarHBondContact OD1-OG 3.02Å; D741-V744 HydrophobicContact CB-CG2 4.33Å; D741-V744 PolarHBondContact O-N 2.61Å
742	L	53.1	Low	47.9	Very low	183 Å²	183	126.8 Å²	126.8	96%	0.958	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-0.8	178.2	-67.3	169.9	0	0	0	114.6	A740	A740-L742 PolarHBondContact O-N 3.43Å
743	S	52.7	Low	46.5	Very low	97 Å²	97	129.8 Å²	129.8	68%	0.678	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-7.9	174.5	72.5	0	0	0	0	114.3	D741	D741-S743 PolarHBondContact O-N 2.95Å; D741-S743 VanDerWaalsContact OD1-CB 3.29Å; D741-S743 WeakPolarHBondContact OD1-CB 3.39Å; D741-S743 PolarHBondContact OD1-N 3.18Å; D741-S743 PolarHBondContact OD1-OG 3.02Å
744	V	49.4	Very low	45.2	Very low	95 Å²	95	128 Å²	128	58%	0.576	70%	0.698	S	S	*	*	S	Bend	trans	-108.5	128.5	-178.1	-170.6	0	0	0	0	110.5	D741	D741-V744 HydrophobicContact CB-CG2 4.33Å; D741-V744 PolarHBondContact O-N 2.61Å
745	P	41.5	Very low	43.9	Very low	102 Å²	102	132.4 Å²	132.4	66%	0.662	72%	0.717	S	S	*	*			trans	-74.1	144.6	177.3	30.4	-34.4	0	0	0	111.7
746	P	41.4	Very low	42.5	Very low	124 Å²	124	138.2 Å²	138.2	81%	0.805	74%	0.739	S	S	*	*			trans	-70.3	136.7	178.6	29	-34.6	0	0	0	111.8	D748	P746-D748 PolarHBondContact O-N 3.32Å
747	Y	37.6	Very low	41.1	Very low	230 Å²	230	136.3 Å²	136.3	90%	0.902	75%	0.748	S	S	*	*	S	Bend	trans	-78	96.5	175.4	-100.7	-98.3	0	0	0	111.3
748	D	35.8	Very low	40	Very low	157 Å²	157	138.1 Å²	138.1	84%	0.84	77%	0.767	S	S	*	*			trans	-169	102.8	139.8	-116.4	-22.1	0	0	0	112.1	P746	P746-D748 PolarHBondContact O-N 3.32Å
749	S	30.4	Very low	39.1	Very low	113 Å²	113	140.2 Å²	140.2	79%	0.79	78%	0.777	S	S	*	*			trans	-162.2	122.9	164.8	62.5	0	0	0	0	111.5
750	F	33.7	Very low	38.1	Very low	198 Å²	198	139.4 Å²	139.4	87%	0.868	78%	0.782	S	S	*	*			trans	-75.7	170.3	173	-99.4	-103.6	0	0	0	112.8
751	Q	28	Very low	37.7	Very low	180 Å²	180	141.7 Å²	141.7	84%	0.841	79%	0.791	S	S	*	*			trans	93.2	139.7	-174.4	-55.4	176.2	4.9	0	0	113.1
752	T	29.6	Very low	36.3	Very low	128 Å²	128	142.1 Å²	142.1	79%	0.785	81%	0.806	S	S	*	*			cis	-141.5	148.2	14.7	-31.3	0	0	0	0	111.3
753	Y	29.1	Very low	35.3	Very low	234 Å²	234	141.9 Å²	141.9	92%	0.918	81%	0.805	S	S	*	*			trans	-76.1	134.5	164	-79.7	-86.1	0	0	0	110.5
754	A	28.8	Very low	34.2	Very low	101 Å²	101	142.6 Å²	142.6	84%	0.835	81%	0.809	S	S	*	*			trans	-109.1	152.5	169.7	0	0	0	0	0	110.3
755	F	31.5	Very low	33.2	Very low	203 Å²	203	145 Å²	145	89%	0.89	82%	0.819	S	S	*	*			trans	-107.9	115.5	-167.2	175	-87.2	0	0	0	111.5
756	E	32.3	Very low	32.6	Very low	195 Å²	195	144.5 Å²	144.5	91%	0.911	82%	0.817	S	S	*	*			trans	-139.5	151.9	165.6	-63.9	-172.8	172	0	0	107.4
757	G	32.7	Very low	32	Very low	67 Å²	67	143.8 Å²	143.8	69%	0.691	82%	0.815	S	S	*	*			cis	165.5	120.5	-1.3	0	0	0	0	0	108.4
758	T	33.5	Very low	31.8	Very low	142 Å²	142	140.8 Å²	140.8	87%	0.871	81%	0.813	S	S	*	*			trans	-87.9	114.7	-166.7	52.6	0	0	0	0	113.8
759	S	33.6	Very low	31.5	Very low	107 Å²	107	141.6 Å²	141.6	75%	0.748	81%	0.811	S	S	*	*				157.5	120.1	127.2	51.2	0	0	0	0	115.4
760	S	31.1	Very low	31.5	Very low	116 Å²	116	142.8 Å²	142.8	81%	0.811	81%	0.814	S	S	*	*			trans	55.4	155.5	140.5	-57.6	0	0	0	0	122.7
761	P	45.6	Very low	31.5	Very low	121 Å²	121	141 Å²	141	79%	0.786	81%	0.813	S	S	*	*			cis	-139.2	-179.4	-35	39.6	-22.2	0	0	0	114.8
762	A	30.8	Very low	31.7	Very low	91 Å²	91	137.6 Å²	137.6	75%	0.752	81%	0.809	S	S	*	*			trans	77.9	95.6	153.9	0	0	0	0	0	122.3
763	L	33.2	Very low	32.2	Very low	179 Å²	179	137.8 Å²	137.8	94%	0.937	81%	0.81	S	S	*	*				39.1	117.2	125.4	-66.6	168.4	0	0	0	122.4
764	S	28.1	Very low	32.5	Very low	111 Å²	111	133 Å²	133	78%	0.776	81%	0.805	S	S	*	*			trans	176.9	139	144.8	-172.4	0	0	0	0	109.1
765	L	28.5	Very low	33.6	Very low	147 Å²	147	133.7 Å²	133.7	77%	0.77	80%	0.804	S	S	*	*			cis	-156.7	152.1	-8.5	-120.2	174.5	0	0	0	110.8
766	S	28.4	Very low	34.3	Very low	91 Å²	91	133 Å²	133	64%	0.636	80%	0.804	S	S	*	*			trans	39.3	131.5	149.8	61.2	0	0	0	0	124.5
767	S	30.6	Very low	35	Very low	108 Å²	108	130.3 Å²	130.3	76%	0.755	79%	0.794	S	S	*	*			trans	64.7	103.5	135.3	65	0	0	0	0	121.1
768	I	32.6	Very low	36.1	Very low	167 Å²	167	132.7 Å²	132.7	86%	0.856	79%	0.791	S	S	*	*			trans	-119.4	95.6	144.8	-61.2	178.9	0	0	0	107.8
769	H	29.5	Very low	37.4	Very low	175 Å²	175	128.5 Å²	128.5	81%	0.81	76%	0.761	S	S	*	*			trans	-160.2	84.3	162.3	-112.7	-70.2	0	0	0	109.6
770	T	31.5	Very low	38.8	Very low	138 Å²	138	126.3 Å²	126.3	85%	0.847	75%	0.746	S	S	*	*			trans	-132.3	87.6	169.1	29.8	0	0	0	0	108.9	S772	T770-S772 PolarHBondContact O-N 3.1Å
771	L	32.3	Very low	40.6	Very low	160 Å²	160	125.8 Å²	125.8	84%	0.838	73%	0.727	S	S	*	*			trans	-65.8	115.7	167.3	-77.8	158	0	0	0	108.6
772	S	33.6	Very low	41.5	Very low	109 Å²	109	121.3 Å²	121.3	76%	0.762	70%	0.696	S	S	*	*			trans	-107	113.5	170.3	-171.9	0	0	0	0	108.9	T770	T770-S772 PolarHBondContact O-N 3.1Å
773	T	38.8	Very low	43.3	Very low	131 Å²	131	119.2 Å²	119.2	80%	0.804	68%	0.676	S	S	*	*			trans	-98	92.3	-175.8	51.8	0	0	0	0	111.6
774	T	36.4	Very low	44.8	Very low	134 Å²	134	117.4 Å²	117.4	82%	0.822	67%	0.667	S	S	*	*			trans	-144	151.2	159.7	30.8	0	0	0	0	110.2
775	S	50.4	Low	46.3	Very low	116 Å²	116	120 Å²	120	81%	0.811	66%	0.66	S	S	*	*			trans	-92.7	108.7	-164.7	53.5	0	0	0	0	113.5
776	E	47.6	Very low	47.9	Very low	189 Å²	189	114 Å²	114	88%	0.883	63%	0.634	S	S	*	*			trans	-155.2	36.6	166.7	-139.6	165.6	-122.9	0	0	114.6
777	L	46.3	Very low	49.6	Very low	137 Å²	137	114.8 Å²	114.8	72%	0.717	64%	0.637	S	S	*	*			trans	-123.4	88.4	-179.1	-68.1	179.9	0	0	0	112.4	F779	L777-F779 HydrophobicContact CB-CD2 4.26Å; L777-F779 HydrophobicContact CB-CE2 3.69Å; L777-F779 HydrophobicContact CB-CZ 4.27Å; L777-F779 HydrophobicContact CD1-CE2 4.1Å; L777-F779 HydrophobicContact CD1-CZ 4.31Å; L777-F779 HydrophobicContact CD2-CE2 4.21Å; L777-F779 HydrophobicContact CD2-CZ 3.91Å; L777-F779 HydrophobicContact CG-CE2 4.22Å; L777-F779 HydrophobicContact CG-CZ 4.39Å
778	D	55	Low	50.4	Low	117 Å²	117	120.4 Å²	120.4	63%	0.626	64%	0.641	S	S	*	*			trans	-98.5	115.9	166.5	-177	-9.5	0	0	0	109.8	S780	D778-S780 WeakPolarHBondContact OD1-CB 3.32Å; D778-S780 PolarHBondContact OD1-N 3.14Å; D778-S780 PolarHBondContact OD1-OG 3.31Å; D778-S780 PolarHBondContact OD2-OG 2.89Å
779	F	62.4	Low	51.7	Low	55 Å²	55	116.7 Å²	116.7	24%	0.241	62%	0.619	C	S	.	*			trans	-106.4	11.2	-178.7	-68.5	-72.7	0	0	0	113.9	L777 Y781 L782 Y796	L777-F779 HydrophobicContact CB-CD2 4.26Å; L777-F779 HydrophobicContact CB-CE2 3.69Å; L777-F779 HydrophobicContact CB-CZ 4.27Å; L777-F779 HydrophobicContact CD1-CE2 4.1Å; L777-F779 HydrophobicContact CD1-CZ 4.31Å; L777-F779 HydrophobicContact CD2-CE2 4.21Å; L777-F779 HydrophobicContact CD2-CZ 3.91Å; L777-F779 HydrophobicContact CG-CE2 4.22Å; L777-F779 HydrophobicContact CG-CZ 4.39Å; F779-Y781 HydrophobicContact CD1-CE1 4.22Å; F779-Y781 PolarHBondContact O-N 3.18Å; F779-Y781 VanDerWaalsContact O-N 3.11Å; F779-L782 HydrophobicContact CB-CD1 4.06Å; F779-L782 HydrophobicContact CD1-CD1 4.25Å; F779-L782 WeakPolarHBondContact O-CB 3.42Å; F779-L782 WeakPolarHBondContact O-CG 3.43Å; F779-L782 PolarHBondContact O-N 3.36Å; F779-Y796 HydrophobicContact CD2-CD1 4.49Å; F779-Y796 HydrophobicContact CD2-CG 4.21Å
780	S	62.9	Low	53.3	Low	60 Å²	60	115.6 Å²	115.6	42%	0.42	61%	0.608	S	S	.	*	G	3₁₀ helix	trans	-53.5	-33.4	-178.2	54.5	0	0	0	0	114	D778 L782 S783	D778-S780 WeakPolarHBondContact OD1-CB 3.32Å; D778-S780 PolarHBondContact OD1-N 3.14Å; D778-S780 PolarHBondContact OD1-OG 3.31Å; D778-S780 PolarHBondContact OD2-OG 2.89Å; S780-L782 PolarHBondContact O-N 2.83Å; S780-L782 VanDerWaalsContact O-N 3.12Å; S780-S783 WeakPolarHBondContact O-CB 3.29Å; S780-S783 PolarHBondContact O-N 2.87Å; S780-S783 VanDerWaalsContact O-N 3.1Å; S780-S783 PolarHBondContact O-OG 2.86Å
781	Y	67.9	Low	54.7	Low	106 Å²	106	116.5 Å²	116.5	42%	0.416	60%	0.602	S	S	.	*	G	3₁₀ helix	trans	-60.2	-18.8	177.9	72.9	-93.3	0	0	0	114.6	F779 S783 D784 W785	F779-Y781 HydrophobicContact CD1-CE1 4.22Å; F779-Y781 PolarHBondContact O-N 3.18Å; F779-Y781 VanDerWaalsContact O-N 3.11Å; Y781-S783 PolarHBondContact O-N 3.31Å; Y781-D784 PolarHBondContact O-N 2.59Å; Y781-W785 HydrophobicContact CD2-CZ2 4.28Å; Y781-W785 AromaticContact CD2-NE1 3.76Å; Y781-W785 AromaticContact CE2-CZ2 3.95Å; Y781-W785 HydrophobicContact CE2-CZ2 3.95Å; Y781-W785 VanDerWaalsContact O-CD1 3.26Å
782	L	64.6	Low	55.8	Low	26 Å²	26	112.8 Å²	112.8	14%	0.136	58%	0.583	C	S	.	*	G	3₁₀ helix	trans	-64.8	-21.3	175.2	-66	178.3	0	0	0	112.3	F779 S780 D784 W785 F789 A793	F779-L782 HydrophobicContact CB-CD1 4.06Å; F779-L782 HydrophobicContact CD1-CD1 4.25Å; F779-L782 WeakPolarHBondContact O-CB 3.42Å; F779-L782 WeakPolarHBondContact O-CG 3.43Å; F779-L782 PolarHBondContact O-N 3.36Å; S780-L782 PolarHBondContact O-N 2.83Å; S780-L782 VanDerWaalsContact O-N 3.12Å; L782-D784 VanDerWaalsContact C-N 3.29Å; L782-D784 PolarHBondContact O-N 2.85Å; L782-W785 PolarHBondContact O-N 3.26Å; L782-F789 VanDerWaalsContact O-CB 3.25Å; L782-F789 WeakPolarHBondContact O-CB 3.46Å; L782-A793 HydrophobicContact CB-CB 3.99Å
783	S	68.1	Low	57.3	Low	47 Å²	47	108 Å²	108	33%	0.329	55%	0.55	S	S	.	*	G	3₁₀ helix	trans	-67.6	-27.3	177	64.9	0	0	0	0	113.7	S780 Y781	S780-S783 WeakPolarHBondContact O-CB 3.29Å; S780-S783 PolarHBondContact O-N 2.87Å; S780-S783 VanDerWaalsContact O-N 3.1Å; S780-S783 PolarHBondContact O-OG 2.86Å; Y781-S783 PolarHBondContact O-N 3.31Å
784	D	65.7	Low	58.5	Low	141 Å²	141	104.4 Å²	104.4	75%	0.754	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-78.5	-18.6	177.6	-70.5	-42.8	0	0	0	113.1	Y781 L782 G786	Y781-D784 PolarHBondContact O-N 2.59Å; L782-D784 VanDerWaalsContact C-N 3.29Å; L782-D784 PolarHBondContact O-N 2.85Å; D784-G786 PolarHBondContact O-N 2.71Å; D784-G786 VanDerWaalsContact O-N 3.13Å
785	W	59	Low	59.5	Low	165 Å²	165	106.9 Å²	106.9	63%	0.625	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-75.9	1.3	-175.5	-72.1	31.8	0	0	0	113.3	Y781 L782 F789	Y781-W785 HydrophobicContact CD2-CZ2 4.28Å; Y781-W785 AromaticContact CD2-NE1 3.76Å; Y781-W785 AromaticContact CE2-CZ2 3.95Å; Y781-W785 HydrophobicContact CE2-CZ2 3.95Å; Y781-W785 VanDerWaalsContact O-CD1 3.26Å; L782-W785 PolarHBondContact O-N 3.26Å; W785-F789 HydrophobicContact CB-CB 4.3Å; W785-F789 HydrophobicContact CB-CD2 3.77Å; W785-F789 HydrophobicContact CB-CE2 4.41Å; W785-F789 HydrophobicContact CB-CG 4.15Å; W785-F789 WeakPolarHBondContact O-CD2 3.43Å
786	G	63.1	Low	59.7	Low	21 Å²	21	108 Å²	108	22%	0.216	52%	0.522	C	S	.	.			trans	112	174.4	170.7	0	0	0	0	0	114	D784 R788 F789	D784-G786 PolarHBondContact O-N 2.71Å; D784-G786 VanDerWaalsContact O-N 3.13Å; G786-R788 VanDerWaalsContact C-N 3.25Å; G786-R788 PolarHBondContact O-N 2.73Å; G786-F789 PolarHBondContact O-N 2.9Å; G786-F789 VanDerWaalsContact O-N 3.08Å
787	P	62.3	Low	60	Low	108 Å²	108	101.3 Å²	101.3	70%	0.701	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-57.4	-30.9	-163.6	-28.5	36	0	0	0	115.6
788	R	48.9	Very low	60.1	Low	227 Å²	227	100.8 Å²	100.8	86%	0.857	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-72.7	-27	-178.6	-66.6	-172.5	177.5	-158.9	-1.5	113.9	G786 R790	G786-R788 VanDerWaalsContact C-N 3.25Å; G786-R788 PolarHBondContact O-N 2.73Å; R788-R790 VanDerWaalsContact C-N 3.34Å
789	F	58.6	Low	59.4	Low	88 Å²	88	98.9 Å²	98.9	39%	0.386	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-88.5	-5.2	-178.3	-60.4	-75.6	0	0	0	113	L782 W785 G786 Q791 L792 A793	L782-F789 VanDerWaalsContact O-CB 3.25Å; L782-F789 WeakPolarHBondContact O-CB 3.46Å; W785-F789 HydrophobicContact CB-CB 4.3Å; W785-F789 HydrophobicContact CB-CD2 3.77Å; W785-F789 HydrophobicContact CB-CE2 4.41Å; W785-F789 HydrophobicContact CB-CG 4.15Å; W785-F789 WeakPolarHBondContact O-CD2 3.43Å; G786-F789 PolarHBondContact O-N 2.9Å; G786-F789 VanDerWaalsContact O-N 3.08Å; F789-Q791 PolarHBondContact O-N 3.39Å; F789-L792 HydrophobicContact CD1-CD1 4.29Å; F789-L792 WeakPolarHBondContact O-CB 3.42Å; F789-L792 PolarHBondContact O-N 3.47Å; F789-A793 PolarHBondContact O-N 2.86Å
790	R	64.8	Low	58.2	Low	153 Å²	153	105.9 Å²	105.9	58%	0.577	54%	0.542	S	S	*	.	H	α-helix	trans	-69.7	-30.4	-175.8	-162.7	171	-67.8	155.4	-2.5	113.9	R788 G794	R788-R790 VanDerWaalsContact C-N 3.34Å; R790-G794 PolarHBondContact O-N 2.79Å
791	Q	59.8	Low	56.8	Low	156 Å²	156	109.3 Å²	109.3	73%	0.729	56%	0.561	S	S	*	*	H	α-helix	trans	-69.7	-44.7	169.5	-80.2	177.9	-55.5	0	0	111.4	F789 A793 G794 Y795	F789-Q791 PolarHBondContact O-N 3.39Å; Q791-A793 PolarHBondContact O-N 2.93Å; Q791-G794 WeakPolarHBondContact O-CA 3.24Å; Q791-G794 PolarHBondContact O-N 3.29Å; Q791-Y795 VanDerWaalsContact O-CD2 3.3Å; Q791-Y795 WeakPolarHBondContact O-CD2 3.45Å; Q791-Y795 PolarHBondContact O-N 2.81Å
792	L	56.4	Low	55.5	Low	83 Å²	83	113.9 Å²	113.9	44%	0.435	59%	0.586	S	S	.	*	H	α-helix	trans	-58.6	-44	175.9	-88	155.3	0	0	0	112.1	F789 G794 Y795 Y796	F789-L792 HydrophobicContact CD1-CD1 4.29Å; F789-L792 WeakPolarHBondContact O-CB 3.42Å; F789-L792 PolarHBondContact O-N 3.47Å; L792-G794 PolarHBondContact O-N 2.86Å; L792-Y795 PolarHBondContact O-N 2.91Å; L792-Y796 HydrophobicContact CD2-CE2 4.23Å; L792-Y796 WeakPolarHBondContact O-CD2 3.25Å
793	A	65.3	Low	54.5	Low	8 Å²	8	121.4 Å²	121.4	7%	0.066	62%	0.62	C	S	.	*	H	α-helix	trans	-58	-35.1	173.4	0	0	0	0	0	112.7	L782 F789 Q791 A797	L782-A793 HydrophobicContact CB-CB 3.99Å; F789-A793 PolarHBondContact O-N 2.86Å; Q791-A793 PolarHBondContact O-N 2.93Å; A793-A797 WeakPolarHBondContact O-CB 3.45Å; A793-A797 PolarHBondContact O-N 3.3Å
794	G	62.3	Low	53.1	Low	55 Å²	55	128.3 Å²	128.3	57%	0.567	65%	0.647	S	S	*	*	H	α-helix	trans	-70.4	-28.8	177.9	0	0	0	0	0	114.8	R790 Q791 L792	R790-G794 PolarHBondContact O-N 2.79Å; Q791-G794 WeakPolarHBondContact O-CA 3.24Å; Q791-G794 PolarHBondContact O-N 3.29Å; L792-G794 PolarHBondContact O-N 2.86Å
795	Y	57.6	Low	51.6	Low	187 Å²	187	126.8 Å²	126.8	73%	0.733	65%	0.654	S	S	*	*	H	α-helix	trans	-75.9	-24	177	-80	-73.2	0	0	0	113.9	Q791 L792	Q791-Y795 VanDerWaalsContact O-CD2 3.3Å; Q791-Y795 WeakPolarHBondContact O-CD2 3.45Å; Q791-Y795 PolarHBondContact O-N 2.81Å; L792-Y795 PolarHBondContact O-N 2.91Å
796	Y	54.3	Low	50.4	Low	140 Å²	140	128 Å²	128	55%	0.549	69%	0.688	S	S	.	*	H	α-helix	trans	-113.2	0.9	-173.5	-66.2	-71	0	0	0	114.6	F779 L792	F779-Y796 HydrophobicContact CD2-CD1 4.49Å; F779-Y796 HydrophobicContact CD2-CG 4.21Å; L792-Y796 HydrophobicContact CD2-CE2 4.23Å; L792-Y796 WeakPolarHBondContact O-CD2 3.25Å
797	A	54.9	Low	49.8	Very low	48 Å²	48	133.3 Å²	133.3	40%	0.397	71%	0.711	S	S	.	*	S	Bend	trans	-98.8	110.7	171.4	0	0	0	0	0	110	A793 G799	A793-A797 WeakPolarHBondContact O-CB 3.45Å; A793-A797 PolarHBondContact O-N 3.3Å; A797-G799 PolarHBondContact O-N 3.33Å
798	P	47.3	Very low	49.1	Very low	125 Å²	125	134.6 Å²	134.6	81%	0.812	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-63.6	123.5	175.8	25.9	-33	0	0	0	109.9	K800	P798-K800 PolarHBondContact O-N 3Å
799	G	41	Very low	49.1	Very low	78 Å²	78	129.5 Å²	129.5	80%	0.804	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-60.4	122.7	-168.3	0	0	0	0	0	113.6	A797	A797-G799 PolarHBondContact O-N 3.33Å
800	K	37.4	Very low	48.5	Very low	202 Å²	202	131.9 Å²	131.9	88%	0.878	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-78.5	130	156.6	-79.9	-174.4	174.7	179.3	0	108.6	P798	P798-K800 PolarHBondContact O-N 3Å
801	T	34.4	Very low	47.5	Very low	132 Å²	132	130.6 Å²	130.6	81%	0.81	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-60.8	147.3	176.6	43.3	0	0	0	0	112.2	E803	T801-E803 PolarHBondContact O-N 3.33Å
802	E	39.3	Very low	46.7	Very low	202 Å²	202	128.9 Å²	128.9	94%	0.944	73%	0.732	S	S	*	*			trans	-69.5	108.1	171	-62	178.8	125.9	0	0	110.5
803	E	43.9	Very low	46	Very low	183 Å²	183	132.2 Å²	132.2	86%	0.855	75%	0.753	S	S	*	*			trans	-157.1	83.9	161.5	-139.2	175.4	-155.6	0	0	111.3	T801	T801-E803 PolarHBondContact O-N 3.33Å
804	E	39.3	Very low	44.5	Very low	193 Å²	193	141.8 Å²	141.8	90%	0.902	81%	0.806	S	S	*	*	S	Bend	trans	170.6	119.4	141.4	-97.6	-174.8	170.5	0	0	112
805	A	33.8	Very low	43.1	Very low	108 Å²	108	149 Å²	149	89%	0.893	83%	0.825	S	S	*	*			trans	52	131.6	163.4	0	0	0	0	0	119.5
806	S	33.5	Very low	41.7	Very low	190 Å²	190	145.5 Å²	145.5	100%	1.329	83%	0.834	S	S	*	*			cis	-156.6	0	24.6	62.2	0	0	0	0	113.4

Retrieved 806 of 806 residues in 260 ms (Link to these results)

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