A0A087YA19_POEFO Loading...

Integrin subunit alpha 4

AlphaFold DB , UniProt , Accession A0A087YA19, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,024 aa.

						>A0A087YA19_POEFO|A0A087YA19
LTGPTGIRIRLNEIQVLVLVLVCPAAGYNLDQEHSMVFKGPHSSMFGYSVLLHRHNSEKWLLVGAPVAHSSRHLTQSPGAVFRCNIMDEERRCDRLSAGQKISSCGKTCEPESDHQWLGVSLSRQPGENGGRVLACAHRWKNVYYSRKDGQNNKLPNGACFRYESDLVSYQHFIPCRHNHQRKFGEDYGSCQAGISNFLTQELIIVGAPGSSYWTGSVVVYNTSSNSIFKFNCPDALIYNSKRNTYAEGYAVGAGHFQSPSSIEVVGGAPQYNQKGKAFIFSTENSKMLQVVSEVTGHELGSYFGSSLCVVDLNADGLSDLLVGAPMATGTSREEGRVHVYINQGEAQLKEAEFKLTGSDAYAARFGETIADLGDLDDDGYPDVAVGAPQEDDLRGAVYIYNGRKEGISPKPSQRITGSSLGHDLKMFGQSLNSGIDIDDNGYNDVAVGAFLSDSAVVLRTRPVVQVKASLILPEHIDQQGAQCQDHKTQTVCINVTICFSVTFKHHRGAIELQYNLTSDLLHKPSFPHRFYFHGNGSSNSTRGHMKARHGHPSCATHVAYQRKDVKDIYTPVQFEVSYGLSEKRSHKTPSRKLAFIKPILQHSAGHHNTITNQTRFARSCSMANCSTNMQLSSELVLPQQQKFFALGSGQIVLKTSLLNSGDDAFLPRVTLRFPNNIHYIKVLHNYEQEANVISCDVTEEHHIDCALSAYWLRTSHSSKVNISFLLDVSQNSTPGDIHININTSSSDNYETDEFLRDNTMTLVLPLKHGVGINIHGFVTPKSFVFDDEDLIPADCYPEKFNYTFKVLNSGPSKALNTVVQIALPKILAPYPHRLLQLIDWKSSHGSCSISDKTISVNEDCNVPQASFIKQIIFFFSPTTTRTMFCGRVDNLCEQLVCRLGNLDAGRDATIQLEISLNPAVLLEDAHTVLIKDQPALVKYLKTIDPSPMLNTVVVEAVFSQKPSMAVKIFIIAVSLVLGLTILTALIWCLWKCGFFKRNFKKQEELNRDSWDYVPKLNKRESSI
					

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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	L	33.2	Very low	32.1	Very low	219 Å²	219	156.5 Å²	156.5	100%	1.147	86%	0.859	S	S	*	*				0	111.1	0	-84.3	145.9	0	0	0	107.8
2	T	33.3	Very low	31.8	Very low	135 Å²	135	155.4 Å²	155.4	83%	0.828	85%	0.851	S	S	*	*			trans	45.7	104.9	153	57.5	0	0	0	0	118.3
3	G	31.4	Very low	31.8	Very low	76 Å²	76	157.6 Å²	157.6	78%	0.784	85%	0.852	S	S	*	*				90.1	156.4	68.6	0	0	0	0	0	111.3
4	P	52.1	Low	31.8	Very low	114 Å²	114	156.9 Å²	156.9	74%	0.74	85%	0.845	S	S	*	*			cis	-146.9	176.9	14	41.8	-20.1	0	0	0	118.8
5	T	33.2	Very low	31.6	Very low	139 Å²	139	158.5 Å²	158.5	85%	0.853	85%	0.845	S	S	*	*			trans	63.8	130.2	147.7	54	0	0	0	0	120.7
6	G	28.1	Very low	31.4	Very low	73 Å²	73	155.4 Å²	155.4	75%	0.753	83%	0.834	S	S	*	*			cis	121.6	103.7	7.8	0	0	0	0	0	112.1
7	I	28	Very low	31.2	Very low	169 Å²	169	154.8 Å²	154.8	87%	0.867	83%	0.829	S	S	*	*			trans	-140.6	124.4	157.6	-63	-177.3	0	0	0	109.3
8	R	28.1	Very low	31	Very low	239 Å²	239	152.1 Å²	152.1	90%	0.902	82%	0.819	S	S	*	*			trans	-95.9	137.9	172.9	-85	175.8	166.4	174.6	-4.8	109.6
9	I	28.3	Very low	30.8	Very low	161 Å²	161	150.7 Å²	150.7	83%	0.826	81%	0.81	S	S	*	*			trans	-129.8	129.9	150.4	-63.9	-179.6	0	0	0	107.9
10	R	28.9	Very low	30.6	Very low	222 Å²	222	148.4 Å²	148.4	84%	0.838	80%	0.802	S	S	*	*			trans	-74.8	140	-178.7	-66.7	177.2	177.6	-178.3	-1.5	110.7
11	L	28	Very low	30.5	Very low	174 Å²	174	148.3 Å²	148.3	91%	0.911	80%	0.8	S	S	*	*			trans	-124.1	123.1	150.7	-103.7	123.1	0	0	0	107.7
12	N	28.4	Very low	30.2	Very low	144 Å²	144	143 Å²	143	77%	0.77	78%	0.776	S	S	*	*			trans	-63.1	144	-179.5	-85.9	-14.9	0	0	0	111.4	I14	N12-I14 PolarHBondContact O-N 2.81Å
13	E	31.8	Very low	29.7	Very low	184 Å²	184	141.6 Å²	141.6	86%	0.86	77%	0.771	S	S	*	*			trans	-56.4	115.5	169.7	-64.6	-179.1	152.3	0	0	111.1
14	I	31.9	Very low	29.6	Very low	148 Å²	148	143.1 Å²	143.1	76%	0.759	77%	0.767	S	S	*	*			trans	-99.9	102.6	154.8	-63.9	175.4	0	0	0	104.7	N12 V16	N12-I14 PolarHBondContact O-N 2.81Å; I14-V16 VanDerWaalsContact C-N 3.25Å; I14-V16 HydrophobicContact CG2-CG2 3.93Å; I14-V16 PolarHBondContact O-N 3.16Å
15	Q	29.5	Very low	28.7	Very low	181 Å²	181	140.8 Å²	140.8	85%	0.846	76%	0.757	S	S	*	*			trans	-64.3	92	164.9	-83.3	-171.7	-18.1	0	0	108.1	L17	Q15-L17 VanDerWaalsContact C-N 3.34Å; Q15-L17 PolarHBondContact O-N 2.78Å; Q15-L17 VanDerWaalsContact O-N 3.11Å
16	V	28.5	Very low	28.9	Very low	108 Å²	108	138.1 Å²	138.1	66%	0.655	75%	0.75	S	S	*	*			trans	-73.5	97.4	161.4	-178	0	0	0	0	105.8	I14 V18	I14-V16 VanDerWaalsContact C-N 3.25Å; I14-V16 HydrophobicContact CG2-CG2 3.93Å; I14-V16 PolarHBondContact O-N 3.16Å; V16-V18 HydrophobicContact CG1-CG2 3.7Å; V16-V18 PolarHBondContact O-N 3.42Å
17	L	28	Very low	30	Very low	146 Å²	146	135.4 Å²	135.4	76%	0.764	72%	0.722	S	S	*	*			trans	-65.4	86.9	163.5	-167.5	82.3	0	0	0	106.5	Q15 L19	Q15-L17 VanDerWaalsContact C-N 3.34Å; Q15-L17 PolarHBondContact O-N 2.78Å; Q15-L17 VanDerWaalsContact O-N 3.11Å; L17-L19 HydrophobicContact CD2-CD1 3.58Å; L17-L19 HydrophobicContact CG-CD1 4.17Å; L17-L19 PolarHBondContact O-N 2.87Å
18	V	28	Very low	32	Very low	106 Å²	106	127.9 Å²	127.9	64%	0.642	68%	0.682	S	S	*	*			trans	-68.7	88.2	166.7	-177.5	0	0	0	0	105.6	V16 V20	V16-V18 HydrophobicContact CG1-CG2 3.7Å; V16-V18 PolarHBondContact O-N 3.42Å; V18-V20 HydrophobicContact CG1-CG2 3.73Å; V18-V20 PolarHBondContact O-N 2Å
19	L	26.8	Very low	34.8	Very low	125 Å²	125	116.5 Å²	116.5	65%	0.654	64%	0.639	S	S	*	*			trans	-63.2	91.1	156.5	-121.9	96.6	0	0	0	105	L17 L21	L17-L19 HydrophobicContact CD2-CD1 3.58Å; L17-L19 HydrophobicContact CG-CD1 4.17Å; L17-L19 PolarHBondContact O-N 2.87Å; L19-L21 PolarHBondContact O-N 3.12Å
20	V	27.2	Very low	37.8	Very low	105 Å²	105	109 Å²	109	64%	0.636	60%	0.601	S	S	*	*			trans	-62	97.2	160.2	-177.3	0	0	0	0	104.1	V18 V22	V18-V20 HydrophobicContact CG1-CG2 3.73Å; V18-V20 PolarHBondContact O-N 2Å; V20-V22 HydrophobicContact CB-CG2 4.42Å; V20-V22 HydrophobicContact CG1-CG2 3.62Å; V20-V22 PolarHBondContact O-N 3.39Å
21	L	27.6	Very low	40.8	Very low	147 Å²	147	98.9 Å²	98.9	77%	0.77	56%	0.564	S	S	*	*			trans	-62.6	76.3	158.8	-89	153.2	0	0	0	106.1	L19 C23	L19-L21 PolarHBondContact O-N 3.12Å; L21-C23 PolarHBondContact O-N 2.91Å
22	V	26.1	Very low	43.7	Very low	106 Å²	106	92.6 Å²	92.6	64%	0.642	53%	0.529	S	S	*	.			trans	-60.9	103.2	151.9	-179.3	0	0	0	0	102.5	V20 P24	V20-V22 HydrophobicContact CB-CG2 4.42Å; V20-V22 HydrophobicContact CG1-CG2 3.62Å; V20-V22 PolarHBondContact O-N 3.39Å; V22-P24 WeakPolarHBondContact O-CD 3.46Å
23	C	23	Very low	46.4	Very low	107 Å²	107	92.7 Å²	92.7	72%	0.723	53%	0.525	S	S	*	.			trans	-53.6	110.6	159.2	-86.8	0	0	0	0	104.5	L21 A25	L21-C23 PolarHBondContact O-N 2.91Å; C23-A25 PolarHBondContact O-N 2.91Å
24	P	29.3	Very low	49.1	Very low	108 Å²	108	87.2 Å²	87.2	70%	0.701	50%	0.499	S	S	*	.			trans	-57.8	122	164.3	27.2	-28.8	0	0	0	103.3	V22 A26	V22-P24 WeakPolarHBondContact O-CD 3.46Å; P24-A26 PolarHBondContact O-N 3.09Å
25	A	33.1	Very low	51.8	Low	64 Å²	64	80.9 Å²	80.9	53%	0.529	47%	0.468	S	S	.	.			trans	-56.6	98.1	166	0	0	0	0	0	104.8	C23 G27	C23-A25 PolarHBondContact O-N 2.91Å; A25-G27 PolarHBondContact O-N 3.17Å; A25-G27 VanDerWaalsContact O-N 3.13Å
26	A	38.6	Very low	54.8	Low	84 Å²	84	72.8 Å²	72.8	69%	0.694	43%	0.431	S	S	*	.			trans	-58.9	121.5	-179.4	0	0	0	0	0	105.5	P24 Y28	P24-A26 PolarHBondContact O-N 3.09Å; A26-Y28 PolarHBondContact O-N 3.32Å; A26-Y28 VanDerWaalsContact O-N 3.08Å
27	G	51.3	Low	57.8	Low	16 Å²	16	68.2 Å²	68.2	17%	0.165	40%	0.403	C	S	.	.			trans	-54	119.1	-177.8	0	0	0	0	0	109.9	A25 Q414	A25-G27 PolarHBondContact O-N 3.17Å; A25-G27 VanDerWaalsContact O-N 3.13Å; G27-Q414 VanDerWaalsContact CA-NE2 3.26Å
28	Y	70.4	Confident	61	Low	10 Å²	10	61.3 Å²	61.3	4%	0.039	37%	0.367	C	S	.	.	S	Bend	trans	-65.9	-52.5	-171.1	173.4	-135.9	0	0	0	111.5	A26 D377 Q414 I600 H603	A26-Y28 PolarHBondContact O-N 3.32Å; A26-Y28 VanDerWaalsContact O-N 3.08Å; Y28-D377 HydrophobicContact CE1-CB 3.55Å; Y28-D377 VanDerWaalsContact CE1-OD2 3.3Å; Y28-D377 WeakPolarHBondContact CE1-OD2 3.39Å; Y28-D377 WeakPolarHBondContact OH-CB 3.44Å; Y28-D377 VanDerWaalsContact OH-CG 3.31Å; Y28-D377 PolarHBondContact OH-OD2 2.86Å; Y28-Q414 VanDerWaalsContact N-OE1 3.13Å; Y28-I600 WeakPolarHBondContact O-CD1 3.48Å; Y28-I600 WeakPolarHBondContact O-CG2 3.36Å; Y28-H603 HydrophobicContact CD2-CB 3.54Å; Y28-H603 HydrophobicContact CE2-CB 3.09Å; Y28-H603 PolarHBondContact OH-N 2.98Å; Y28-H603 PolarHBondContact OH-O 2.88Å
29	N	86.1	Confident	64.1	Low	0 Å²	0	63.4 Å²	63.4	0%	0	37%	0.367	C	S	.	.	S	Bend	trans	-148.2	-15.5	180	56.8	-9.8	0	0	0	113.9	L376 T461 R462 V464 I600	N29-L376 VanDerWaalsContact ND2-CB 3.33Å; N29-L376 WeakPolarHBondContact ND2-CB 3.27Å; N29-L376 WeakPolarHBondContact ND2-CD2 3.35Å; N29-L376 WeakPolarHBondContact ND2-CG 3.42Å; N29-L376 PolarHBondContact ND2-O 3.37Å; N29-L376 WeakPolarHBondContact OD1-CD2 3.18Å; N29-T461 HydrophobicContact CB-CG2 4.44Å; N29-T461 CarbonylContact O-C 3.58Å; N29-R462 VanDerWaalsContact O-CB 3.3Å; N29-R462 WeakPolarHBondContact O-CB 3.37Å; N29-R462 VanDerWaalsContact O-CG 3.24Å; N29-R462 WeakPolarHBondContact O-CG 3.41Å; N29-R462 PolarHBondContact O-N 2.87Å; N29-V464 HydrophobicContact CB-CG2 4.33Å; N29-I600 HydrophobicContact CB-CG2 4.5Å
30	L	91.6	Very high	67.2	Low	3 Å²	3	58.6 Å²	58.6	2%	0.016	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-84.1	124.5	169.2	-68	174.5	0	0	0	111.4	Q32 L376 I400 Q414 I416 V446 L459 T461	L30-Q32 PolarHBondContact O-N 3.09Å; L30-L376 HydrophobicContact CD1-CD2 4.32Å; L30-L376 HydrophobicContact CD2-CD1 4.49Å; L30-L376 HydrophobicContact CD2-CD2 4Å; L30-L376 HydrophobicContact CG-CD2 3.89Å; L30-I400 HydrophobicContact CD1-CD1 3.64Å; L30-I400 HydrophobicContact CD1-CG1 3.97Å; L30-Q414 PolarHBondContact O-NE2 2.61Å; L30-I416 HydrophobicContact CB-CD1 4.03Å; L30-I416 HydrophobicContact CD1-CD1 3.8Å; L30-V446 HydrophobicContact CD1-CB 4.48Å; L30-V446 HydrophobicContact CD1-CG2 4.15Å; L30-V446 HydrophobicContact CD2-CB 4.32Å; L30-V446 HydrophobicContact CD2-CG2 3.8Å; L30-L459 HydrophobicContact CD2-CB 4.42Å; L30-T461 WeakPolarHBondContact CD2-OG1 3.43Å
31	D	90.6	Very high	70.4	Confident	11 Å²	11	56.5 Å²	56.5	6%	0.059	34%	0.336	C	S	.	.			trans	-74.7	118	-179.2	-172.1	65.4	0	0	0	111.8	H34 R460 R462 I597	D31-H34 IonicContact OD1-ND1 3.29Å; D31-H34 WeakPolarHBondContact OD2-CA 3.46Å; D31-H34 WeakPolarHBondContact OD2-CB 3Å; D31-H34 IonicContact OD2-CG 3.1Å; D31-H34 PolarHBondContact OD2-N 2.84Å; D31-H34 IonicContact OD2-ND1 2.64Å; D31-H34 PolarHBondContact OD2-ND1 2.84Å; D31-R460 WeakPolarHBondContact CB-O 3.26Å; D31-R460 PolarHBondContact N-O 3.31Å; D31-R462 HydrophobicContact CB-CG 3.94Å; D31-I597 HydrophobicContact CB-CG2 4.3Å
32	Q	89.2	Confident	73.4	Confident	41 Å²	41	57.3 Å²	57.3	19%	0.192	34%	0.336	C	S	.	.	S	Bend	trans	-92.4	-27.9	177	-65.9	-179.9	66.6	0	0	112.2	L30 I416 S420 L421	L30-Q32 PolarHBondContact O-N 3.09Å; Q32-I416 HydrophobicContact CG-CG1 4.24Å; Q32-I416 HydrophobicContact CG-CG2 4.33Å; Q32-S420 PolarHBondContact OE1-OG 2.96Å; Q32-L421 HydrophobicContact CB-CD2 3.91Å; Q32-L421 HydrophobicContact CG-CD2 4.07Å
33	E	86.3	Confident	76.6	Confident	147 Å²	147	55.8 Å²	55.8	69%	0.687	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-38.3	-174.8	-68.9	-174.9	175.3	0	0	112.6
34	H	87.3	Confident	80	Confident	68 Å²	68	50.8 Å²	50.8	32%	0.315	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	37.6	-177.3	-46.5	84.7	0	0	0	112.1	D31	D31-H34 IonicContact OD1-ND1 3.29Å; D31-H34 WeakPolarHBondContact OD2-CA 3.46Å; D31-H34 WeakPolarHBondContact OD2-CB 3Å; D31-H34 IonicContact OD2-CG 3.1Å; D31-H34 PolarHBondContact OD2-N 2.84Å; D31-H34 IonicContact OD2-ND1 2.64Å; D31-H34 PolarHBondContact OD2-ND1 2.84Å
35	S	89.8	Confident	83.2	Confident	15 Å²	15	48.3 Å²	48.3	11%	0.105	28%	0.276	C	S	.	.			trans	-60.6	143.8	176.3	64.6	0	0	0	0	112.3
36	M	91.2	Very high	86.3	Confident	11 Å²	11	45.3 Å²	45.3	5%	0.054	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	107.4	-180	-58.8	-175.5	-153.4	0	0	110.4	F38 I86 I438 V457 V458 R460 L594	M36-F38 HydrophobicContact CB-CE2 3.86Å; M36-F38 HydrophobicContact CB-CZ 4.4Å; M36-I86 HydrophobicContact CE-CG2 4.49Å; M36-I86 HydrophobicContact SD-CG2 3.81Å; M36-I438 HydrophobicContact CE-CD1 4.25Å; M36-V457 CarbonylContact O-C 3.55Å; M36-V457 VanDerWaalsContact O-CA 3.28Å; M36-V457 WeakPolarHBondContact O-CA 3.42Å; M36-V458 HydrophobicContact CB-CB 4.34Å; M36-V458 PolarHBondContact N-O 3.33Å; M36-V458 PolarHBondContact O-N 3.13Å; M36-R460 VanDerWaalsContact CE-CD 3.48Å; M36-R460 HydrophobicContact CE-CG 4.13Å; M36-R460 VanDerWaalsContact CE-NE 3.27Å; M36-L594 HydrophobicContact CE-CD2 3.38Å; M36-L594 HydrophobicContact SD-CD2 4.27Å
37	V	92.7	Very high	89.1	Confident	12 Å²	12	41.3 Å²	41.3	7%	0.073	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	127.8	179	-172.8	0	0	0	0	110.7	R91 H423 L425 V457	V37-R91 WeakPolarHBondContact O-CD 3.49Å; V37-R91 PolarHBondContact O-NH1 2.83Å; V37-R91 VanDerWaalsContact O-NH1 3.15Å; V37-H423 VanDerWaalsContact CG2-CD2 3.43Å; V37-H423 WeakPolarHBondContact CG2-CD2 2.98Å; V37-L425 HydrophobicContact CG1-CD2 4.35Å; V37-V457 HydrophobicContact CG1-CG2 4.4Å; V37-V457 HydrophobicContact CG2-CG1 4.38Å; V37-V457 HydrophobicContact CG2-CG2 4.02Å
38	F	94.4	Very high	91.3	Very high	1 Å²	1	43.4 Å²	43.4	0%	0.004	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	139.6	176.5	-61.1	-95.2	0	0	0	109.5	M36 F46 L61 C84 I86 R91 S455 A456 V458	M36-F38 HydrophobicContact CB-CE2 3.86Å; M36-F38 HydrophobicContact CB-CZ 4.4Å; F38-F46 HydrophobicContact CB-CE1 4.31Å; F38-F46 HydrophobicContact CB-CZ 4.47Å; F38-L61 HydrophobicContact CB-CD2 4.24Å; F38-L61 HydrophobicContact CD2-CD2 3.41Å; F38-L61 VanDerWaalsContact CD2-CD2 3.41Å; F38-L61 HydrophobicContact CE2-CD2 3.83Å; F38-L61 HydrophobicContact CG-CD2 3.8Å; F38-C84 HydrophobicContact CD1-CB 3.55Å; F38-C84 HydrophobicContact CE1-CB 3.79Å; F38-C84 HydrophobicContact CG-CB 4.31Å; F38-I86 HydrophobicContact CZ-CG1 4.38Å; F38-R91 HydrophobicContact CD1-CB 3.73Å; F38-R91 HydrophobicContact CD1-CG 4.43Å; F38-R91 HydrophobicContact CE1-CB 3.75Å; F38-R91 HydrophobicContact CE1-CG 4.09Å; F38-S455 VanDerWaalsContact O-CA 3.26Å; F38-S455 WeakPolarHBondContact O-CA 3.48Å; F38-A456 PolarHBondContact N-O 2.84Å; F38-A456 PolarHBondContact O-N 2.88Å; F38-V458 HydrophobicContact CD2-CG2 4.45Å; F38-V458 HydrophobicContact CE2-CB 4.44Å; F38-V458 HydrophobicContact CE2-CG2 3.88Å
39	K	93.1	Very high	92.6	Very high	151 Å²	151	43.4 Å²	43.4	66%	0.657	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-119.9	136.1	-179.1	-67.9	-172.3	175.8	-175.7	0	111
40	G	93	Very high	93.2	Very high	23 Å²	23	43.7 Å²	43.7	24%	0.237	22%	0.224	C	C	.	.			trans	-99.3	-174.3	175.5	0	0	0	0	0	113.9	F46 D454	G40-F46 VanDerWaalsContact CA-CD2 3.5Å; G40-F46 VanDerWaalsContact CA-CG 3.44Å; G40-D454 PolarHBondContact N-O 3.09Å
41	P	93.1	Very high	93.4	Very high	62 Å²	62	43.6 Å²	43.6	40%	0.403	22%	0.224	S	C	.	.	S	Bend	trans	-61.1	145.6	171.4	-19.4	31.9	0	0	0	111.9	S44 F82	P41-S44 VanDerWaalsContact O-CB 3.27Å; P41-S44 WeakPolarHBondContact O-CB 3Å; P41-S44 PolarHBondContact O-N 3.27Å; P41-S44 PolarHBondContact O-OG 3.26Å; P41-F82 HydrophobicContact CG-CE1 4.16Å; P41-F82 HydrophobicContact CG-CE2 4.42Å; P41-F82 HydrophobicContact CG-CZ 3.67Å
42	H	92	Very high	93.6	Very high	163 Å²	163	43.1 Å²	43.1	76%	0.755	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	136.4	-179.5	-172.7	-81.6	0	0	0	112.4	S44	H42-S44 PolarHBondContact O-N 2.84Å
43	S	92.6	Very high	93.8	Very high	74 Å²	74	41.2 Å²	41.2	52%	0.517	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	32.6	-179.2	-54.4	0	0	0	0	113.9	V67 D454	S43-V67 WeakPolarHBondContact O-CG2 3.23Å; S43-D454 PolarHBondContact N-OD2 3.45Å
44	S	94.4	Very high	94	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.014	19%	0.191	C	C	.	.	S	Bend	trans	-96	-7.2	177.1	68.7	0	0	0	0	113.2	P41 H42 F46 A65 V67 D454	P41-S44 VanDerWaalsContact O-CB 3.27Å; P41-S44 WeakPolarHBondContact O-CB 3Å; P41-S44 PolarHBondContact O-N 3.27Å; P41-S44 PolarHBondContact O-OG 3.26Å; H42-S44 PolarHBondContact O-N 2.84Å; S44-F46 WeakPolarHBondContact OG-CB 3.46Å; S44-F46 PolarHBondContact OG-N 2.87Å; S44-A65 CarbonylContact O-C 3.52Å; S44-A65 VanDerWaalsContact O-C 3.27Å; S44-A65 WeakPolarHBondContact O-CA 3.43Å; S44-V67 VanDerWaalsContact O-CG2 3.26Å; S44-V67 WeakPolarHBondContact O-CG2 3.44Å; S44-V67 PolarHBondContact O-N 3.43Å; S44-D454 PolarHBondContact N-OD1 2.83Å; S44-D454 PolarHBondContact OG-OD1 2.83Å
45	M	96.8	Very high	94.1	Very high	57 Å²	57	36.3 Å²	36.3	28%	0.281	19%	0.186	S	C	.	.			trans	57.7	37.5	-167.7	-61.3	179.1	172.4	0	0	111.3	G47 Y48 P66 V67 F451 D454	M45-G47 PolarHBondContact O-N 2.87Å; M45-Y48 WeakPolarHBondContact O-CB 3.28Å; M45-Y48 PolarHBondContact O-N 2.84Å; M45-Y48 VanDerWaalsContact O-N 3.1Å; M45-P66 HydrophobicContact CB-CG 4.15Å; M45-P66 HydrophobicContact SD-CG 4.45Å; M45-V67 HydrophobicContact CB-CG2 3.94Å; M45-V67 HydrophobicContact CE-CG2 4.48Å; M45-V67 HydrophobicContact CG-CG2 3.52Å; M45-V67 HydrophobicContact SD-CG1 4.09Å; M45-V67 HydrophobicContact SD-CG2 3.86Å; M45-F451 HydrophobicContact CB-CB 4.33Å; M45-F451 HydrophobicContact CB-CD2 3.92Å; M45-F451 HydrophobicContact CE-CE2 4.46Å; M45-F451 HydrophobicContact CG-CD2 3.83Å; M45-F451 HydrophobicContact CG-CE2 4.39Å; M45-F451 HydrophobicContact SD-CD2 4.28Å; M45-F451 HydrophobicContact SD-CE2 4.39Å; M45-D454 WeakPolarHBondContact CA-OD1 3.22Å; M45-D454 PolarHBondContact N-OD1 2.82Å
46	F	97.6	Very high	93.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	123.3	177	178.9	-83.5	0	0	0	109.8	F38 G40 S44 V63 A65 F82 C93 F451 D454 S455 A456	F38-F46 HydrophobicContact CB-CE1 4.31Å; F38-F46 HydrophobicContact CB-CZ 4.47Å; G40-F46 VanDerWaalsContact CA-CD2 3.5Å; G40-F46 VanDerWaalsContact CA-CG 3.44Å; S44-F46 WeakPolarHBondContact OG-CB 3.46Å; S44-F46 PolarHBondContact OG-N 2.87Å; F46-V63 HydrophobicContact CD1-CG1 3.69Å; F46-V63 HydrophobicContact CD2-CB 4.13Å; F46-V63 HydrophobicContact CD2-CG1 3.79Å; F46-V63 HydrophobicContact CE1-CB 4.04Å; F46-V63 HydrophobicContact CE1-CG1 3.61Å; F46-V63 HydrophobicContact CE1-CG2 3.96Å; F46-V63 HydrophobicContact CE2-CB 3.61Å; F46-V63 HydrophobicContact CE2-CG1 3.72Å; F46-V63 HydrophobicContact CE2-CG2 4.12Å; F46-V63 HydrophobicContact CG-CG1 3.78Å; F46-V63 HydrophobicContact CZ-CB 3.55Å; F46-V63 HydrophobicContact CZ-CG1 3.63Å; F46-V63 HydrophobicContact CZ-CG2 3.54Å; F46-A65 HydrophobicContact CB-CB 4.23Å; F46-A65 HydrophobicContact CD2-CB 4.45Å; F46-F82 HydrophobicContact CD2-CB 4.45Å; F46-F82 AromaticContact CD2-CD2 3.81Å; F46-F82 HydrophobicContact CD2-CD2 3.81Å; F46-F82 HydrophobicContact CD2-CE2 4.32Å; F46-F82 HydrophobicContact CD2-CG 4.18Å; F46-F82 HydrophobicContact CE2-CB 3.75Å; F46-F82 AromaticContact CE2-CD2 3.98Å; F46-F82 HydrophobicContact CE2-CD2 3.98Å; F46-F82 AromaticContact CE2-CG 3.87Å; F46-F82 HydrophobicContact CE2-CG 3.87Å; F46-C93 HydrophobicContact CE2-CB 4.39Å; F46-C93 HydrophobicContact CZ-CB 4.48Å; F46-F451 WeakPolarHBondContact O-CA 3.01Å; F46-D454 HydrophobicContact CB-CB 4.13Å; F46-D454 VanDerWaalsContact CD1-O 3.3Å; F46-D454 WeakPolarHBondContact CD1-O 3.48Å; F46-D454 PolarHBondContact N-OD1 2.99Å; F46-D454 CarbonylContact O-C 3.25Å; F46-D454 VanDerWaalsContact O-CA 3.25Å; F46-D454 WeakPolarHBondContact O-CA 3.06Å; F46-S455 PolarHBondContact O-N 3.1Å; F46-A456 HydrophobicContact CE1-CB 3.95Å
47	G	97.1	Very high	93.4	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	102.3	9	-172.6	0	0	0	0	0	113.1	M45 S49 G64 S431 G449	M45-G47 PolarHBondContact O-N 2.87Å; G47-S49 VanDerWaalsContact C-N 3.32Å; G47-G64 PolarHBondContact N-O 2.8Å; G47-G64 VanDerWaalsContact N-O 3.14Å; G47-S431 PolarHBondContact O-OG 2.92Å; G47-G449 CarbonylContact O-C 3.2Å; G47-G449 WeakPolarHBondContact O-CA 3.43Å
48	Y	98	Very high	93.2	Very high	61 Å²	61	49.3 Å²	49.3	24%	0.239	26%	0.26	C	S	.	.	S	Bend	trans	-63.6	-40.7	173.9	-172.4	-88.3	0	0	0	111.6	M45 G64 P66 W117 V120 S431 F451	M45-Y48 WeakPolarHBondContact O-CB 3.28Å; M45-Y48 PolarHBondContact O-N 2.84Å; M45-Y48 VanDerWaalsContact O-N 3.1Å; Y48-G64 PolarHBondContact N-O 2.96Å; Y48-P66 HydrophobicContact CD1-CG 4.09Å; Y48-P66 HydrophobicContact CD2-CG 4.18Å; Y48-P66 HydrophobicContact CG-CG 3.75Å; Y48-W117 HydrophobicContact CE2-CZ3 4.42Å; Y48-V120 HydrophobicContact CD1-CG2 4.25Å; Y48-V120 WeakPolarHBondContact CD1-O 3.43Å; Y48-V120 HydrophobicContact CE1-CB 4.33Å; Y48-V120 HydrophobicContact CE1-CG2 3.48Å; Y48-V120 VanDerWaalsContact CE1-CG2 3.48Å; Y48-V120 VanDerWaalsContact CE1-O 3.31Å; Y48-V120 WeakPolarHBondContact CE1-O 3.45Å; Y48-S431 VanDerWaalsContact O-CB 3.28Å; Y48-S431 WeakPolarHBondContact O-CB 3.33Å; Y48-S431 PolarHBondContact O-OG 2.96Å; Y48-F451 HydrophobicContact CD2-CD2 4.33Å; Y48-F451 HydrophobicContact CD2-CG 4.21Å
49	S	98.1	Very high	92.9	Very high	9 Å²	9	49.8 Å²	49.8	6%	0.063	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	144.8	167.8	61.5	0	0	0	0	109.6	G47 G64 G119 L122 S431	G47-S49 VanDerWaalsContact C-N 3.32Å; S49-G64 PolarHBondContact O-N 3.4Å; S49-G119 PolarHBondContact OG-O 3.13Å; S49-L122 WeakPolarHBondContact OG-CD1 3.38Å; S49-L122 WeakPolarHBondContact OG-CG 3.46Å; S49-S431 WeakPolarHBondContact CA-OG 3.5Å
50	V	98	Very high	92.9	Very high	7 Å²	7	43.9 Å²	43.9	4%	0.042	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	147.9	179.4	-63.4	0	0	0	0	110.1	L61 L62 V63 S431 N433 A447 A456	V50-L61 HydrophobicContact CB-CD1 4.44Å; V50-L62 WeakPolarHBondContact CA-O 3.45Å; V50-V63 HydrophobicContact CG1-CG1 4.46Å; V50-S431 PolarHBondContact N-OG 2.93Å; V50-N433 HydrophobicContact CG2-CB 4.44Å; V50-N433 WeakPolarHBondContact O-CB 3Å; V50-A447 HydrophobicContact CB-CB 4.16Å; V50-A447 HydrophobicContact CG2-CB 3.95Å; V50-A456 HydrophobicContact CG1-CB 3.89Å
51	L	96.4	Very high	93	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	126.9	-179.2	178.7	66.4	0	0	0	110	L62 L122 R124 V133 N433	L51-L62 HydrophobicContact CB-CB 4.23Å; L51-L62 HydrophobicContact CD2-CD1 4.25Å; L51-L62 PolarHBondContact N-O 2.86Å; L51-L62 PolarHBondContact O-N 3.03Å; L51-L122 HydrophobicContact CB-CB 4.06Å; L51-L122 HydrophobicContact CB-CD1 4.17Å; L51-L122 HydrophobicContact CD2-CB 4.04Å; L51-R124 HydrophobicContact CD1-CB 3.73Å; L51-R124 HydrophobicContact CD2-CB 3.99Å; L51-R124 HydrophobicContact CG-CB 4.22Å; L51-V133 HydrophobicContact CD2-CG1 3.7Å; L51-V133 HydrophobicContact CD2-CG2 4.2Å; L51-N433 WeakPolarHBondContact CD1-OD1 3.32Å
52	L	94.8	Very high	93.2	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	135.3	170.6	-66.5	175.8	0	0	0	110.1	L61 I86 R124 N433 I436 I438 D445 A447 V458	L52-L61 HydrophobicContact CD2-CD1 3.99Å; L52-I86 HydrophobicContact CD2-CD1 4.08Å; L52-R124 WeakPolarHBondContact O-CD 3.32Å; L52-R124 PolarHBondContact O-NE 2.91Å; L52-N433 PolarHBondContact N-OD1 2.04Å; L52-I436 HydrophobicContact CB-CB 3.92Å; L52-I436 HydrophobicContact CB-CG1 4.03Å; L52-I438 HydrophobicContact CD1-CG2 4.3Å; L52-I438 HydrophobicContact CD2-CG2 4.31Å; L52-D445 HydrophobicContact CD1-CB 4.41Å; L52-D445 VanDerWaalsContact CD1-O 3.26Å; L52-D445 WeakPolarHBondContact CD1-O 3.31Å; L52-A447 HydrophobicContact CD1-CB 4.32Å; L52-A447 HydrophobicContact CD2-CB 4.01Å; L52-A447 HydrophobicContact CG-CB 3.84Å; L52-V458 HydrophobicContact CD2-CG1 4.37Å; L52-V458 HydrophobicContact CD2-CG2 4.15Å
53	H	93.6	Very high	93.4	Very high	1 Å²	1	32 Å²	32	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	143.7	-177.4	-174.4	64.5	0	0	0	111.2	K59 W60 L62 G130 G131 S165	H53-K59 WeakPolarHBondContact O-CA 3.44Å; H53-W60 HydrophobicContact CB-CB 4.48Å; H53-W60 PolarHBondContact N-O 2.91Å; H53-W60 PolarHBondContact O-N 2.7Å; H53-L62 HydrophobicContact CB-CD1 4.07Å; H53-L62 HydrophobicContact CB-CG 4.2Å; H53-G130 PolarHBondContact CE1-O 3.28Å; H53-G131 PolarHBondContact CE1-O 3.44Å; H53-G131 VanDerWaalsContact CE1-O 3.26Å; H53-S165 PolarHBondContact NE2-O 3.44Å
54	R	90	Very high	93.7	Very high	66 Å²	66	28.5 Å²	28.5	25%	0.249	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138.1	174.5	179.5	168.3	77.5	179.1	4.8	108.6	N56 E58 K59 E128 N129 G130 I436	R54-N56 WeakPolarHBondContact CG-O 3.49Å; R54-E58 CarbonylContact C-O 3.58Å; R54-E58 WeakPolarHBondContact CA-O 3.39Å; R54-K59 HydrophobicContact CG-CG 4.39Å; R54-E128 VanDerWaalsContact CZ-O 3.25Å; R54-E128 PolarHBondContact NE-O 2.9Å; R54-E128 PolarHBondContact NH2-O 3.12Å; R54-N129 CarbonylContact O-C 3.5Å; R54-G130 WeakPolarHBondContact O-CA 3.38Å; R54-G130 PolarHBondContact O-N 3.26Å; R54-I436 HydrophobicContact CB-CD1 3.98Å; R54-I436 HydrophobicContact CB-CG2 4.23Å
55	H	88.6	Confident	93.8	Very high	46 Å²	46	28.4 Å²	28.4	21%	0.213	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	114.2	167.4	178.5	-120.5	0	0	0	108	S57 E58 S165	H55-S57 PolarHBondContact O-N 2.81Å; H55-E58 PolarHBondContact N-O 3.33Å; H55-E58 PolarHBondContact O-N 3.01Å; H55-S165 WeakPolarHBondContact CB-O 3.2Å
56	N	84.9	Confident	93.7	Very high	102 Å²	102	25.7 Å²	25.7	55%	0.545	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	-123.7	-168.3	-53.1	-46.7	0	0	0	110.7	R54	R54-N56 WeakPolarHBondContact CG-O 3.49Å
57	S	82.9	Confident	93.6	Very high	108 Å²	108	26.9 Å²	26.9	76%	0.755	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-7.2	176.6	58.3	0	0	0	0	114.2	H55	H55-S57 PolarHBondContact O-N 2.81Å
58	E	86.9	Confident	93.4	Very high	101 Å²	101	27 Å²	27	47%	0.472	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	137.4	-177.7	-59.4	-173.2	144	0	0	110.8	R54 H55 W60	R54-E58 CarbonylContact C-O 3.58Å; R54-E58 WeakPolarHBondContact CA-O 3.39Å; H55-E58 PolarHBondContact N-O 3.33Å; H55-E58 PolarHBondContact O-N 3.01Å; E58-W60 HydrophobicContact CB-CZ2 3.95Å; E58-W60 VanDerWaalsContact CB-NE1 3.35Å; E58-W60 HydrophobicContact CG-CZ2 4.31Å; E58-W60 WeakPolarHBondContact OE2-CZ2 3.46Å
59	K	89.2	Confident	92.9	Very high	11 Å²	11	30.4 Å²	30.4	5%	0.048	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	127.4	-176	-52.2	-171.1	-163.7	176.9	0	109.1	H53 R54 I86 D437 I438 D440	H53-K59 WeakPolarHBondContact O-CA 3.44Å; R54-K59 HydrophobicContact CG-CG 4.39Å; K59-I86 HydrophobicContact CB-CD1 4.44Å; K59-D437 WeakPolarHBondContact CE-O 3.27Å; K59-D437 PolarHBondContact NZ-O 2.86Å; K59-I438 HydrophobicContact CD-CB 4.32Å; K59-I438 VanDerWaalsContact CD-O 3.24Å; K59-I438 WeakPolarHBondContact CD-O 3.39Å; K59-I438 WeakPolarHBondContact CE-O 3.37Å; K59-I438 PolarHBondContact NZ-O 3.27Å; K59-D440 IonicContact NZ-OD1 3.99Å; K59-D440 PolarHBondContact NZ-OD1 2.95Å; K59-D440 IonicContact NZ-OD2 2.77Å; K59-D440 PolarHBondContact NZ-OD2 3.36Å
60	W	92.1	Very high	91.9	Very high	27 Å²	27	30.8 Å²	30.8	10%	0.102	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	138.1	-166.9	-56.1	101.3	0	0	0	109.9	H53 E58 L62 C84 N85	H53-W60 HydrophobicContact CB-CB 4.48Å; H53-W60 PolarHBondContact N-O 2.91Å; H53-W60 PolarHBondContact O-N 2.7Å; E58-W60 HydrophobicContact CB-CZ2 3.95Å; E58-W60 VanDerWaalsContact CB-NE1 3.35Å; E58-W60 HydrophobicContact CG-CZ2 4.31Å; E58-W60 WeakPolarHBondContact OE2-CZ2 3.46Å; W60-L62 HydrophobicContact CB-CD2 4.4Å; W60-C84 WeakPolarHBondContact CA-O 3.43Å; W60-N85 HydrophobicContact CE3-CB 4.06Å; W60-N85 HydrophobicContact CH2-CB 4.26Å; W60-N85 HydrophobicContact CZ3-CB 3.5Å; W60-N85 VanDerWaalsContact CZ3-CB 3.5Å
61	L	95.7	Very high	90.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	118.4	160.9	173.5	69.7	0	0	0	107.8	F38 V50 L52 V63 C84 I86 A447 A456 V458	F38-L61 HydrophobicContact CB-CD2 4.24Å; F38-L61 HydrophobicContact CD2-CD2 3.41Å; F38-L61 VanDerWaalsContact CD2-CD2 3.41Å; F38-L61 HydrophobicContact CE2-CD2 3.83Å; F38-L61 HydrophobicContact CG-CD2 3.8Å; V50-L61 HydrophobicContact CB-CD1 4.44Å; L52-L61 HydrophobicContact CD2-CD1 3.99Å; L61-V63 HydrophobicContact CD1-CG2 4.32Å; L61-V63 HydrophobicContact CD2-CG2 3.72Å; L61-V63 HydrophobicContact CG-CG2 3.63Å; L61-C84 HydrophobicContact CB-CB 4.22Å; L61-C84 PolarHBondContact N-O 2.92Å; L61-C84 PolarHBondContact O-N 2.91Å; L61-I86 HydrophobicContact CB-CD1 4.4Å; L61-I86 HydrophobicContact CB-CG1 4.26Å; L61-A447 HydrophobicContact CD1-CB 3.71Å; L61-A456 HydrophobicContact CD2-CB 4Å; L61-V458 HydrophobicContact CB-CG2 4.37Å; L61-V458 HydrophobicContact CD1-CG2 3.99Å; L61-V458 HydrophobicContact CD2-CG2 3.89Å; L61-V458 HydrophobicContact CG-CG2 4.3Å
62	L	96.6	Very high	88.4	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	131.9	170.9	-56.5	-175.8	0	0	0	109.5	V50 L51 H53 W60 F82 R83 L122 V133 L167	V50-L62 WeakPolarHBondContact CA-O 3.45Å; L51-L62 HydrophobicContact CB-CB 4.23Å; L51-L62 HydrophobicContact CD2-CD1 4.25Å; L51-L62 PolarHBondContact N-O 2.86Å; L51-L62 PolarHBondContact O-N 3.03Å; H53-L62 HydrophobicContact CB-CD1 4.07Å; H53-L62 HydrophobicContact CB-CG 4.2Å; W60-L62 HydrophobicContact CB-CD2 4.4Å; L62-F82 CarbonylContact C-O 3.58Å; L62-F82 VanDerWaalsContact CA-O 3.29Å; L62-F82 WeakPolarHBondContact CA-O 3.35Å; L62-R83 HydrophobicContact CD2-CB 3.56Å; L62-L122 HydrophobicContact CB-CD1 4.49Å; L62-V133 HydrophobicContact CD1-CB 4.42Å; L62-V133 HydrophobicContact CD1-CG1 3.89Å; L62-V133 HydrophobicContact CD1-CG2 3.95Å; L62-L167 HydrophobicContact CD1-CD1 4.2Å; L62-L167 HydrophobicContact CD1-CD2 4.02Å; L62-L167 HydrophobicContact CD2-CD1 3.72Å; L62-L167 HydrophobicContact CG-CD1 4.5Å
63	V	98.1	Very high	86.7	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	123.8	-175.9	-170.4	0	0	0	0	110.8	F46 V50 L61 V81 F82 A456	F46-V63 HydrophobicContact CD1-CG1 3.69Å; F46-V63 HydrophobicContact CD2-CB 4.13Å; F46-V63 HydrophobicContact CD2-CG1 3.79Å; F46-V63 HydrophobicContact CE1-CB 4.04Å; F46-V63 HydrophobicContact CE1-CG1 3.61Å; F46-V63 HydrophobicContact CE1-CG2 3.96Å; F46-V63 HydrophobicContact CE2-CB 3.61Å; F46-V63 HydrophobicContact CE2-CG1 3.72Å; F46-V63 HydrophobicContact CE2-CG2 4.12Å; F46-V63 HydrophobicContact CG-CG1 3.78Å; F46-V63 HydrophobicContact CZ-CB 3.55Å; F46-V63 HydrophobicContact CZ-CG1 3.63Å; F46-V63 HydrophobicContact CZ-CG2 3.54Å; V50-V63 HydrophobicContact CG1-CG1 4.46Å; L61-V63 HydrophobicContact CD1-CG2 4.32Å; L61-V63 HydrophobicContact CD2-CG2 3.72Å; L61-V63 HydrophobicContact CG-CG2 3.63Å; V63-V81 WeakPolarHBondContact O-CA 3.37Å; V63-F82 PolarHBondContact N-O 3.42Å; V63-F82 PolarHBondContact O-N 3.3Å; V63-A456 HydrophobicContact CG1-CB 4.19Å; V63-A456 HydrophobicContact CG2-CB 3.92Å
64	G	97.6	Very high	85.4	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	136.5	172.2	0	0	0	0	0	112	G47 Y48 S49 G119	G47-G64 PolarHBondContact N-O 2.8Å; G47-G64 VanDerWaalsContact N-O 3.14Å; Y48-G64 PolarHBondContact N-O 2.96Å; S49-G64 PolarHBondContact O-N 3.4Å; G64-G119 WeakPolarHBondContact CA-O 3.46Å
65	A	97	Very high	84.7	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	80.2	176.6	0	0	0	0	0	108.7	S44 F46 V67 A68 G79 A80 F82	S44-A65 CarbonylContact O-C 3.52Å; S44-A65 VanDerWaalsContact O-C 3.27Å; S44-A65 WeakPolarHBondContact O-CA 3.43Å; F46-A65 HydrophobicContact CB-CB 4.23Å; F46-A65 HydrophobicContact CD2-CB 4.45Å; A65-V67 PolarHBondContact O-N 2.96Å; A65-V67 VanDerWaalsContact O-N 3.1Å; A65-A68 HydrophobicContact CB-CB 3.97Å; A65-A68 VanDerWaalsContact O-CB 3.32Å; A65-A68 WeakPolarHBondContact O-CB 3.05Å; A65-A68 PolarHBondContact O-N 2.96Å; A65-A68 VanDerWaalsContact O-N 3.12Å; A65-G79 VanDerWaalsContact O-CA 3.28Å; A65-G79 WeakPolarHBondContact O-CA 3.48Å; A65-A80 PolarHBondContact N-O 2.79Å; A65-A80 PolarHBondContact O-N 3.14Å; A65-F82 HydrophobicContact CB-CD2 3.98Å; A65-F82 HydrophobicContact CB-CE2 3.69Å
66	P	95.5	Very high	84.5	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-20.2	-165.9	23.2	-34	0	0	0	114.7	M45 Y48 G79 W117 L118	M45-P66 HydrophobicContact CB-CG 4.15Å; M45-P66 HydrophobicContact SD-CG 4.45Å; Y48-P66 HydrophobicContact CD1-CG 4.09Å; Y48-P66 HydrophobicContact CD2-CG 4.18Å; Y48-P66 HydrophobicContact CG-CG 3.75Å; P66-G79 WeakPolarHBondContact O-CA 3.34Å; P66-G79 PolarHBondContact O-N 2.89Å; P66-W117 HydrophobicContact CB-CB 3.94Å; P66-W117 HydrophobicContact CB-CD2 3.96Å; P66-W117 HydrophobicContact CB-CE3 3.83Å; P66-W117 HydrophobicContact CB-CG 4.03Å; P66-W117 HydrophobicContact CG-CE3 4.22Å; P66-W117 WeakPolarHBondContact O-CA 3.18Å; P66-L118 WeakPolarHBondContact CA-O 3.45Å
67	V	94.7	Very high	84.6	Confident	25 Å²	25	56.7 Å²	56.7	15%	0.152	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	12.2	179.5	-60.1	0	0	0	0	113.3	S43 S44 M45 A65 H69 S77 W117	S43-V67 WeakPolarHBondContact O-CG2 3.23Å; S44-V67 VanDerWaalsContact O-CG2 3.26Å; S44-V67 WeakPolarHBondContact O-CG2 3.44Å; S44-V67 PolarHBondContact O-N 3.43Å; M45-V67 HydrophobicContact CB-CG2 3.94Å; M45-V67 HydrophobicContact CE-CG2 4.48Å; M45-V67 HydrophobicContact CG-CG2 3.52Å; M45-V67 HydrophobicContact SD-CG1 4.09Å; M45-V67 HydrophobicContact SD-CG2 3.86Å; A65-V67 PolarHBondContact O-N 2.96Å; A65-V67 VanDerWaalsContact O-N 3.1Å; V67-H69 PolarHBondContact O-N 2.72Å; V67-S77 WeakPolarHBondContact O-CB 3.08Å; V67-W117 HydrophobicContact CG1-CZ2 4.17Å
68	A	92.2	Very high	84.9	Confident	3 Å²	3	51.7 Å²	51.7	3%	0.025	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-55.6	130.2	176.7	0	0	0	0	0	112.7	A65 G79 A80 F82	A65-A68 HydrophobicContact CB-CB 3.97Å; A65-A68 VanDerWaalsContact O-CB 3.32Å; A65-A68 WeakPolarHBondContact O-CB 3.05Å; A65-A68 PolarHBondContact O-N 2.96Å; A65-A68 VanDerWaalsContact O-N 3.12Å; A68-G79 PolarHBondContact O-N 2.95Å; A68-A80 HydrophobicContact CB-CB 3.83Å; A68-F82 HydrophobicContact CB-CE2 4.34Å
69	H	87.2	Confident	85.2	Confident	132 Å²	132	46.9 Å²	46.9	61%	0.611	24%	0.236	S	C	*	.	P	Polyproline II helix	trans	-68.1	151.7	175	-73	-82.4	0	0	0	111.9	V67 S77 R95	V67-H69 PolarHBondContact O-N 2.72Å; H69-S77 PolarHBondContact CE1-OG 3.25Å; H69-S77 PolarHBondContact ND1-OG 3.06Å; H69-R95 PolarHBondContact O-NH1 3.2Å
70	S	77.4	Confident	85.4	Confident	17 Å²	17	46.4 Å²	46.4	12%	0.119	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-99.6	121.7	170.8	-175.2	0	0	0	0	109.3	R72	S70-R72 VanDerWaalsContact C-N 3.3Å
71	S	64	Low	85.6	Confident	122 Å²	122	45.3 Å²	45.3	85%	0.853	23%	0.23	S	C	*	.	S	Bend	trans	-79.4	-11.7	177.5	51.3	0	0	0	0	113.6
72	R	58.5	Low	85.5	Confident	196 Å²	196	46 Å²	46	74%	0.74	23%	0.233	S	C	*	.	S	Bend	trans	-110.6	-9.2	-170	-67	-176	178.6	175.2	-0.1	114.9	S70	S70-R72 VanDerWaalsContact C-N 3.3Å
73	H	58.3	Low	85.4	Confident	92 Å²	92	49.6 Å²	49.6	43%	0.426	25%	0.247	S	C	.	.	S	Bend	trans	-141.4	155.8	-173.2	-63.5	-44.8	0	0	0	113.1	T75	H73-T75 PolarHBondContact O-N 2.91Å
74	L	66.8	Low	85.2	Confident	186 Å²	186	49.6 Å²	49.6	97%	0.974	25%	0.247	S	C	*	.	S	Bend	trans	-64.9	4.9	173.4	-73.3	157.2	0	0	0	114.3
75	T	74.4	Confident	84.8	Confident	34 Å²	34	52 Å²	52	21%	0.209	26%	0.26	C	S	.	.			trans	-81.6	126.3	-175.1	-36.9	0	0	0	0	110.8	H73 S77 P78 D114	H73-T75 PolarHBondContact O-N 2.91Å; T75-S77 PolarHBondContact O-N 2.82Å; T75-P78 HydrophobicContact CG2-CB 4.14Å; T75-P78 HydrophobicContact CG2-CG 4.37Å; T75-D114 WeakPolarHBondContact CA-OD1 3.21Å; T75-D114 WeakPolarHBondContact CG2-OD1 3.31Å
76	Q	84.3	Confident	84.4	Confident	122 Å²	122	52.3 Å²	52.3	57%	0.57	26%	0.261	S	S	*	.			trans	-82.7	116.5	-175.2	-64.3	-176.1	-2.6	0	0	111	D114 H115	Q76-D114 PolarHBondContact N-OD1 3.26Å; Q76-D114 WeakPolarHBondContact O-CA 3.48Å; Q76-H115 PolarHBondContact O-N 2.92Å
77	S	87.4	Confident	83.6	Confident	14 Å²	14	55.6 Å²	55.6	10%	0.098	28%	0.277	C	S	.	.			trans	37	60.8	175.3	-57.1	0	0	0	0	114.8	V67 H69 T75 G79 H115	V67-S77 WeakPolarHBondContact O-CB 3.08Å; H69-S77 PolarHBondContact CE1-OG 3.25Å; H69-S77 PolarHBondContact ND1-OG 3.06Å; T75-S77 PolarHBondContact O-N 2.82Å; S77-G79 PolarHBondContact O-N 2.86Å; S77-H115 WeakPolarHBondContact O-CA 3.31Å
78	P	89.9	Confident	82.9	Confident	4 Å²	4	56.9 Å²	56.9	3%	0.026	28%	0.283	C	S	.	.			trans	-70.2	-10.5	-177.9	29.2	-35.8	0	0	0	113.8	T75 S113 Q116 L118	T75-P78 HydrophobicContact CG2-CB 4.14Å; T75-P78 HydrophobicContact CG2-CG 4.37Å; P78-S113 WeakPolarHBondContact CB-O 3.46Å; P78-Q116 HydrophobicContact CB-CG 4.26Å; P78-Q116 WeakPolarHBondContact O-CG 3.35Å; P78-Q116 PolarHBondContact O-NE2 3.22Å; P78-L118 WeakPolarHBondContact O-CB 3.4Å; P78-L118 PolarHBondContact O-N 3.24Å; P78-L118 VanDerWaalsContact O-N 3.17Å
79	G	92.8	Very high	82	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	79.4	168.4	-171.3	0	0	0	0	0	112.9	A65 P66 A68 S77 R95 L118	A65-G79 VanDerWaalsContact O-CA 3.28Å; A65-G79 WeakPolarHBondContact O-CA 3.48Å; P66-G79 WeakPolarHBondContact O-CA 3.34Å; P66-G79 PolarHBondContact O-N 2.89Å; A68-G79 PolarHBondContact O-N 2.95Å; S77-G79 PolarHBondContact O-N 2.86Å; G79-R95 PolarHBondContact O-NH2 3.28Å; G79-L118 CarbonylContact C-O 3.57Å
80	A	93.3	Very high	81.4	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.008	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	159.6	-177.4	0	0	0	0	0	112	A65 A68 F82 R95 L118	A65-A80 PolarHBondContact N-O 2.79Å; A65-A80 PolarHBondContact O-N 3.14Å; A68-A80 HydrophobicContact CB-CB 3.83Å; A80-F82 HydrophobicContact CB-CD2 4.3Å; A80-F82 HydrophobicContact CB-CE2 3.75Å; A80-F82 HydrophobicContact CB-CZ 4.26Å; A80-R95 HydrophobicContact CB-CG 4.16Å; A80-R95 VanDerWaalsContact CB-CZ 3.5Å; A80-L118 PolarHBondContact N-O 2.81Å; A80-L118 VanDerWaalsContact N-O 3.09Å
81	V	95.2	Very high	81.8	Confident	3 Å²	3	68.7 Å²	68.7	2%	0.018	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	133.3	161.9	-175.8	0	0	0	0	107.7	V63 L96 L118 L122 A135	V63-V81 WeakPolarHBondContact O-CA 3.37Å; V81-L96 HydrophobicContact CB-CD1 4.11Å; V81-L96 HydrophobicContact CG1-CD1 3.8Å; V81-L96 WeakPolarHBondContact O-CB 3.31Å; V81-L96 PolarHBondContact O-N 3.16Å; V81-L118 HydrophobicContact CG2-CG 4.46Å; V81-L122 HydrophobicContact CG1-CD2 4.19Å; V81-L122 HydrophobicContact CG2-CD2 4.04Å; V81-A135 HydrophobicContact CG2-CB 3.76Å
82	F	95.1	Very high	82.8	Confident	16 Å²	16	70 Å²	70	7%	0.07	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	146.7	175.9	-69	-94.9	0	0	0	109.8	P41 F46 L62 V63 A65 A68 A80 C93 D94 R95	P41-F82 HydrophobicContact CG-CE1 4.16Å; P41-F82 HydrophobicContact CG-CE2 4.42Å; P41-F82 HydrophobicContact CG-CZ 3.67Å; F46-F82 HydrophobicContact CD2-CB 4.45Å; F46-F82 AromaticContact CD2-CD2 3.81Å; F46-F82 HydrophobicContact CD2-CD2 3.81Å; F46-F82 HydrophobicContact CD2-CE2 4.32Å; F46-F82 HydrophobicContact CD2-CG 4.18Å; F46-F82 HydrophobicContact CE2-CB 3.75Å; F46-F82 AromaticContact CE2-CD2 3.98Å; F46-F82 HydrophobicContact CE2-CD2 3.98Å; F46-F82 AromaticContact CE2-CG 3.87Å; F46-F82 HydrophobicContact CE2-CG 3.87Å; L62-F82 CarbonylContact C-O 3.58Å; L62-F82 VanDerWaalsContact CA-O 3.29Å; L62-F82 WeakPolarHBondContact CA-O 3.35Å; V63-F82 PolarHBondContact N-O 3.42Å; V63-F82 PolarHBondContact O-N 3.3Å; A65-F82 HydrophobicContact CB-CD2 3.98Å; A65-F82 HydrophobicContact CB-CE2 3.69Å; A68-F82 HydrophobicContact CB-CE2 4.34Å; A80-F82 HydrophobicContact CB-CD2 4.3Å; A80-F82 HydrophobicContact CB-CE2 3.75Å; A80-F82 HydrophobicContact CB-CZ 4.26Å; F82-C93 HydrophobicContact CB-CB 4.31Å; F82-C93 HydrophobicContact CD1-CB 4.4Å; F82-D94 CarbonylContact C-O 3.58Å; F82-D94 VanDerWaalsContact CA-O 3.25Å; F82-D94 WeakPolarHBondContact CA-O 3.48Å; F82-R95 HydrophobicContact CD1-CB 4.14Å; F82-R95 HydrophobicContact CE1-CB 3.89Å; F82-R95 HydrophobicContact CZ-CB 4.49Å
83	R	93.9	Very high	84.4	Confident	74 Å²	74	62.1 Å²	62.1	28%	0.279	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	127.2	166.5	64.5	172.7	-172.3	-177.6	6.3	108.8	L62 C93 D94 L96	L62-R83 HydrophobicContact CD2-CB 3.56Å; R83-C93 CarbonylContact O-C 3.45Å; R83-C93 WeakPolarHBondContact O-CA 3.3Å; R83-D94 HydrophobicContact CG-CB 4.1Å; R83-D94 PolarHBondContact N-O 3.11Å; R83-D94 PolarHBondContact O-N 3.12Å; R83-L96 HydrophobicContact CB-CD2 4.06Å; R83-L96 HydrophobicContact CB-CG 4.46Å; R83-L96 HydrophobicContact CG-CD2 3.81Å
84	C	94	Very high	86	Confident	0 Å²	0	62 Å²	62	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	129.5	179.2	-50.1	0	0	0	0	109	F38 W60 L61 I86 R92 C93	F38-C84 HydrophobicContact CD1-CB 3.55Å; F38-C84 HydrophobicContact CE1-CB 3.79Å; F38-C84 HydrophobicContact CG-CB 4.31Å; W60-C84 WeakPolarHBondContact CA-O 3.43Å; L61-C84 HydrophobicContact CB-CB 4.22Å; L61-C84 PolarHBondContact N-O 2.92Å; L61-C84 PolarHBondContact O-N 2.91Å; C84-I86 PolarHBondContact O-N 3.05Å; C84-R92 WeakPolarHBondContact CA-O 3.1Å; C84-C93 HydrophobicContact CB-CB 4.09Å; C84-C93 WeakPolarHBondContact CB-SG 3.39Å; C84-C93 WeakPolarHBondContact SG-CB 3.29Å; C84-C93 CovalentContact SG-SG 2.04Å; C84-C93 PolarHBondContact SG-SG 2.93Å
85	N	88.6	Confident	87.2	Confident	51 Å²	51	56.2 Å²	56.2	27%	0.273	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	119.7	176.1	-166.2	-23.4	0	0	0	109.3	W60 M87 D88 R92	W60-N85 HydrophobicContact CE3-CB 4.06Å; W60-N85 HydrophobicContact CH2-CB 4.26Å; W60-N85 HydrophobicContact CZ3-CB 3.5Å; W60-N85 VanDerWaalsContact CZ3-CB 3.5Å; N85-M87 VanDerWaalsContact C-N 3.26Å; N85-M87 PolarHBondContact O-N 2.85Å; N85-M87 PolarHBondContact OD1-N 2.92Å; N85-D88 HydrophobicContact CB-CB 3.79Å; N85-R92 PolarHBondContact N-O 2.75Å
86	I	88	Confident	87.9	Confident	6 Å²	6	55 Å²	55	3%	0.031	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-27.3	-179.9	-60.6	176.1	0	0	0	111.1	M36 F38 L52 K59 L61 C84 I438	M36-I86 HydrophobicContact CE-CG2 4.49Å; M36-I86 HydrophobicContact SD-CG2 3.81Å; F38-I86 HydrophobicContact CZ-CG1 4.38Å; L52-I86 HydrophobicContact CD2-CD1 4.08Å; K59-I86 HydrophobicContact CB-CD1 4.44Å; L61-I86 HydrophobicContact CB-CD1 4.4Å; L61-I86 HydrophobicContact CB-CG1 4.26Å; C84-I86 PolarHBondContact O-N 3.05Å; I86-I438 HydrophobicContact CD1-CB 4.24Å; I86-I438 HydrophobicContact CD1-CG2 3.88Å; I86-I438 HydrophobicContact CG2-CB 4.44Å; I86-I438 HydrophobicContact CG2-CD1 3.99Å; I86-I438 HydrophobicContact CG2-CG1 4.28Å
87	M	80.4	Confident	87.4	Confident	69 Å²	69	53.5 Å²	53.5	34%	0.34	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-1	-177.3	-58.1	-58.8	-68.5	0	0	113.8	N85 K593 L594	N85-M87 VanDerWaalsContact C-N 3.26Å; N85-M87 PolarHBondContact O-N 2.85Å; N85-M87 PolarHBondContact OD1-N 2.92Å; M87-K593 HydrophobicContact CE-CB 3.98Å; M87-K593 HydrophobicContact CE-CD 4.21Å; M87-L594 HydrophobicContact CE-CD1 4.07Å; M87-L594 HydrophobicContact CE-CG 4.16Å; M87-L594 HydrophobicContact SD-CD1 3.67Å; M87-L594 HydrophobicContact SD-CG 4.08Å
88	D	79.5	Confident	86.3	Confident	53 Å²	53	52.9 Å²	52.9	28%	0.283	25%	0.251	S	S	.	.			trans	-88.3	125.4	178.2	-177.9	18.1	0	0	0	110.6	N85 E90 R91 R92	N85-D88 HydrophobicContact CB-CB 3.79Å; D88-E90 PolarHBondContact O-N 3.07Å; D88-E90 PolarHBondContact OD1-N 2.81Å; D88-R91 PolarHBondContact O-N 2.91Å; D88-R92 WeakPolarHBondContact OD2-CB 3.16Å; D88-R92 PolarHBondContact OD2-N 3.47Å
89	E	73	Confident	84.6	Confident	172 Å²	172	52.9 Å²	52.9	80%	0.804	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-31.8	180	-68.7	-172.4	179.3	0	0	112	R91	E89-R91 PolarHBondContact O-N 3.49Å
90	E	75.3	Confident	82.9	Confident	130 Å²	130	55 Å²	55	61%	0.607	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-6.4	176.7	-68.3	-164.9	-152.1	0	0	113.2	D88 R92	D88-E90 PolarHBondContact O-N 3.07Å; D88-E90 PolarHBondContact OD1-N 2.81Å; E90-R92 HydrophobicContact CB-CG 3.88Å; E90-R92 VanDerWaalsContact CD-NH2 3.26Å; E90-R92 PolarHBondContact O-N 2.7Å; E90-R92 IonicContact OE1-CZ 3.28Å; E90-R92 IonicContact OE1-NH2 2.78Å; E90-R92 PolarHBondContact OE1-NH2 2.83Å; E90-R92 IonicContact OE2-CZ 3.77Å; E90-R92 IonicContact OE2-NE 3.19Å; E90-R92 PolarHBondContact OE2-NE 3.09Å; E90-R92 IonicContact OE2-NH2 3.96Å; E90-R92 PolarHBondContact OE2-NH2 3.07Å
91	R	84.8	Confident	81.4	Confident	97 Å²	97	62.7 Å²	62.7	37%	0.366	30%	0.295	S	S	.	.			trans	50.9	39	178.8	-58.8	-180	-174.3	166.8	-1.3	112.4	V37 F38 D88 E89	V37-R91 WeakPolarHBondContact O-CD 3.49Å; V37-R91 PolarHBondContact O-NH1 2.83Å; V37-R91 VanDerWaalsContact O-NH1 3.15Å; F38-R91 HydrophobicContact CD1-CB 3.73Å; F38-R91 HydrophobicContact CD1-CG 4.43Å; F38-R91 HydrophobicContact CE1-CB 3.75Å; F38-R91 HydrophobicContact CE1-CG 4.09Å; D88-R91 PolarHBondContact O-N 2.91Å; E89-R91 PolarHBondContact O-N 3.49Å
92	R	85.3	Confident	80.2	Confident	151 Å²	151	63 Å²	63	57%	0.57	30%	0.297	S	S	*	.			trans	-68.2	142.2	-177.3	-67.7	-178.9	179.1	178.7	6.1	111	C84 N85 D88 E90	C84-R92 WeakPolarHBondContact CA-O 3.1Å; N85-R92 PolarHBondContact N-O 2.75Å; D88-R92 WeakPolarHBondContact OD2-CB 3.16Å; D88-R92 PolarHBondContact OD2-N 3.47Å; E90-R92 HydrophobicContact CB-CG 3.88Å; E90-R92 VanDerWaalsContact CD-NH2 3.26Å; E90-R92 PolarHBondContact O-N 2.7Å; E90-R92 IonicContact OE1-CZ 3.28Å; E90-R92 IonicContact OE1-NH2 2.78Å; E90-R92 PolarHBondContact OE1-NH2 2.83Å; E90-R92 IonicContact OE2-CZ 3.77Å; E90-R92 IonicContact OE2-NE 3.19Å; E90-R92 PolarHBondContact OE2-NE 3.09Å; E90-R92 IonicContact OE2-NH2 3.96Å; E90-R92 PolarHBondContact OE2-NH2 3.07Å
93	C	92.6	Very high	78.7	Confident	30 Å²	30	67.8 Å²	67.8	20%	0.203	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	118.9	178.8	-63.1	0	0	0	0	110.4	F46 F82 R83 C84	F46-C93 HydrophobicContact CE2-CB 4.39Å; F46-C93 HydrophobicContact CZ-CB 4.48Å; F82-C93 HydrophobicContact CB-CB 4.31Å; F82-C93 HydrophobicContact CD1-CB 4.4Å; R83-C93 CarbonylContact O-C 3.45Å; R83-C93 WeakPolarHBondContact O-CA 3.3Å; C84-C93 HydrophobicContact CB-CB 4.09Å; C84-C93 WeakPolarHBondContact CB-SG 3.39Å; C84-C93 WeakPolarHBondContact SG-CB 3.29Å; C84-C93 CovalentContact SG-SG 2.04Å; C84-C93 PolarHBondContact SG-SG 2.93Å
94	D	91.8	Very high	77.7	Confident	88 Å²	88	68.2 Å²	68.2	47%	0.471	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	139.8	177.8	-68.3	-36.6	0	0	0	110.9	F82 R83	F82-D94 CarbonylContact C-O 3.58Å; F82-D94 VanDerWaalsContact CA-O 3.25Å; F82-D94 WeakPolarHBondContact CA-O 3.48Å; R83-D94 HydrophobicContact CG-CB 4.1Å; R83-D94 PolarHBondContact N-O 3.11Å; R83-D94 PolarHBondContact O-N 3.12Å
95	R	90.8	Very high	76.8	Confident	66 Å²	66	68.7 Å²	68.7	25%	0.249	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	129.6	173.5	-177.6	174.8	-175.5	144.4	3.6	110.6	H69 G79 A80 F82	H69-R95 PolarHBondContact O-NH1 3.2Å; G79-R95 PolarHBondContact O-NH2 3.28Å; A80-R95 HydrophobicContact CB-CG 4.16Å; A80-R95 VanDerWaalsContact CB-CZ 3.5Å; F82-R95 HydrophobicContact CD1-CB 4.14Å; F82-R95 HydrophobicContact CE1-CB 3.89Å; F82-R95 HydrophobicContact CZ-CB 4.49Å
96	L	89.3	Confident	76.4	Confident	8 Å²	8	68 Å²	68	4%	0.042	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-70	145.4	170.4	-65.7	-178.1	0	0	0	111.2	V81 R83 A98 Y163 L167	V81-L96 HydrophobicContact CB-CD1 4.11Å; V81-L96 HydrophobicContact CG1-CD1 3.8Å; V81-L96 WeakPolarHBondContact O-CB 3.31Å; V81-L96 PolarHBondContact O-N 3.16Å; R83-L96 HydrophobicContact CB-CD2 4.06Å; R83-L96 HydrophobicContact CB-CG 4.46Å; R83-L96 HydrophobicContact CG-CD2 3.81Å; L96-A98 VanDerWaalsContact C-N 3.29Å; L96-A98 PolarHBondContact O-N 2.93Å; L96-Y163 HydrophobicContact CB-CE1 4.28Å; L96-Y163 HydrophobicContact CD1-CE1 4.1Å; L96-L167 HydrophobicContact CD2-CB 4.19Å
97	S	75.3	Confident	76	Confident	90 Å²	90	77.2 Å²	77.2	63%	0.629	39%	0.394	S	S	*	.	S	Bend	trans	-72.9	-11.9	-171.6	-60.2	0	0	0	0	114.8
98	A	62.9	Low	76.1	Confident	1 Å²	1	75.2 Å²	75.2	1%	0.008	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	158.6	-173.1	0	0	0	0	0	114.6	L96 L118 F161 Y163 Y170	L96-A98 VanDerWaalsContact C-N 3.29Å; L96-A98 PolarHBondContact O-N 2.93Å; A98-L118 WeakPolarHBondContact O-CD2 3.19Å; A98-F161 HydrophobicContact CB-CD1 4.37Å; A98-Y163 HydrophobicContact CB-CE1 3.55Å; A98-Y163 HydrophobicContact CB-CE2 4.36Å; A98-Y163 WeakPolarHBondContact CB-OH 3.33Å; A98-Y170 HydrophobicContact CB-CD1 3.51Å; A98-Y170 HydrophobicContact CB-CD2 3.71Å; A98-Y170 HydrophobicContact CB-CE1 3.58Å; A98-Y170 HydrophobicContact CB-CE2 3.79Å; A98-Y170 HydrophobicContact CB-CG 3.57Å
99	G	54.9	Low	76.3	Confident	4 Å²	4	73.3 Å²	73.3	4%	0.041	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	4.1	173.8	0	0	0	0	0	116.1	Q116	G99-Q116 PolarHBondContact O-NE2 3.42Å
100	Q	56.3	Low	77.1	Confident	46 Å²	46	67.4 Å²	67.4	22%	0.215	35%	0.349	C	S	.	.	S	Bend	trans	-76.5	-30.1	177.9	-73.5	-179.9	-0.7	0	0	113.4
101	K	62.1	Low	77.7	Confident	162 Å²	162	63.4 Å²	63.4	70%	0.704	34%	0.335	S	S	*	.			trans	-161.9	119.2	171.6	-146.4	170.7	-176.7	178.1	0	111.5	S103	K101-S103 PolarHBondContact O-N 2.99Å
102	I	70.1	Confident	77.8	Confident	8 Å²	8	59.6 Å²	59.6	4%	0.041	32%	0.321	C	S	.	.			trans	-76.3	106.4	161.6	-59.3	-179.1	0	0	0	105.6	C105 P111 W140 A159 F161 I174	I102-C105 HydrophobicContact CG2-CB 3.87Å; I102-P111 HydrophobicContact CB-CB 4.3Å; I102-P111 WeakPolarHBondContact O-CG 3.39Å; I102-W140 HydrophobicContact CD1-CZ2 4.02Å; I102-A159 HydrophobicContact CD1-CB 4.24Å; I102-F161 HydrophobicContact CD1-CE1 4.39Å; I102-F161 HydrophobicContact CD1-CZ 4.17Å; I102-F161 HydrophobicContact CG1-CE1 4.18Å; I102-F161 HydrophobicContact CG1-CZ 4.25Å; I102-I174 HydrophobicContact CD1-CD1 4.23Å
103	S	64.9	Low	78	Confident	117 Å²	117	53 Å²	53	82%	0.818	30%	0.298	S	S	*	.			trans	-72.4	-30.2	-171.9	52	0	0	0	0	113.4	K101	K101-S103 PolarHBondContact O-N 2.99Å
104	S	71.1	Confident	77.8	Confident	84 Å²	84	53.8 Å²	53.8	59%	0.587	30%	0.3	S	S	*	.			trans	-153.4	129.3	175.1	179.1	0	0	0	0	109.6
105	C	76.4	Confident	77.8	Confident	10 Å²	10	53.1 Å²	53.1	7%	0.068	29%	0.294	C	S	.	.			trans	-125.4	16.7	179.3	53.3	0	0	0	0	113.3	I102 C109 I174 R177	I102-C105 HydrophobicContact CG2-CB 3.87Å; C105-C109 HydrophobicContact CB-CB 3.84Å; C105-C109 WeakPolarHBondContact CB-SG 3.33Å; C105-C109 VanDerWaalsContact O-CB 3.3Å; C105-C109 WeakPolarHBondContact O-CB 3.3Å; C105-C109 WeakPolarHBondContact SG-CB 3.44Å; C105-C109 CovalentContact SG-SG 2.02Å; C105-C109 PolarHBondContact SG-SG 2.87Å; C105-I174 HydrophobicContact CB-CD1 3.95Å; C105-R177 WeakPolarHBondContact O-CD 3.34Å; C105-R177 PolarHBondContact O-NE 3.28Å; C105-R177 VanDerWaalsContact O-NE 3.12Å
106	G	79.3	Confident	77.8	Confident	35 Å²	35	50 Å²	50	36%	0.361	28%	0.282	S	S	.	.			trans	112.5	174.9	177.9	0	0	0	0	0	114.3	T108 C109	G106-T108 PolarHBondContact O-N 2.9Å; G106-C109 PolarHBondContact O-N 2.84Å
107	K	79.1	Confident	78.1	Confident	200 Å²	200	51.9 Å²	51.9	87%	0.87	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-33.1	-172.1	-66.8	-175.9	179.1	-179.4	0	114.4	Y144	K107-Y144 WeakPolarHBondContact O-CE2 3.31Å
108	T	83.3	Confident	79	Confident	27 Å²	27	47.7 Å²	47.7	17%	0.166	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	35.2	-180	55.6	0	0	0	0	111.9	G106 N142 Y144 N179	G106-T108 PolarHBondContact O-N 2.9Å; T108-N142 PolarHBondContact O-ND2 2.75Å; T108-N142 VanDerWaalsContact O-ND2 3.11Å; T108-Y144 VanDerWaalsContact C-CG 3.44Å; T108-Y144 HydrophobicContact CG2-CE1 4.32Å; T108-Y144 WeakPolarHBondContact O-CB 3.44Å; T108-N179 PolarHBondContact OG1-OD1 2.85Å
109	C	84.6	Confident	80.5	Confident	14 Å²	14	47.6 Å²	47.6	10%	0.095	26%	0.259	C	S	.	.			trans	-133.2	125.6	-174.6	-171.3	0	0	0	0	111.4	C105 G106 N142	C105-C109 HydrophobicContact CB-CB 3.84Å; C105-C109 WeakPolarHBondContact CB-SG 3.33Å; C105-C109 VanDerWaalsContact O-CB 3.3Å; C105-C109 WeakPolarHBondContact O-CB 3.3Å; C105-C109 WeakPolarHBondContact SG-CB 3.44Å; C105-C109 CovalentContact SG-SG 2.02Å; C105-C109 PolarHBondContact SG-SG 2.87Å; G106-C109 PolarHBondContact O-N 2.84Å; C109-N142 WeakPolarHBondContact CA-OD1 3.35Å
110	E	88.3	Confident	82.5	Confident	48 Å²	48	47.8 Å²	47.8	22%	0.224	26%	0.259	C	S	.	.			trans	-127.1	110.3	172.3	-167.6	171.9	167.2	0	0	108.1	N142 V143 Y144 R147	E110-N142 PolarHBondContact N-OD1 2.73Å; E110-N142 PolarHBondContact O-OD1 3.4Å; E110-V143 HydrophobicContact CB-CG2 4.19Å; E110-V143 HydrophobicContact CG-CG2 4.2Å; E110-V143 WeakPolarHBondContact O-CG2 3.48Å; E110-V143 PolarHBondContact O-N 2.74Å; E110-Y144 HydrophobicContact CB-CD2 4.46Å; E110-R147 VanDerWaalsContact CD-CD 3.45Å; E110-R147 WeakPolarHBondContact OE1-CD 2.86Å; E110-R147 IonicContact OE1-CZ 3.86Å; E110-R147 IonicContact OE1-NE 3.75Å; E110-R147 IonicContact OE1-NH1 3.79Å; E110-R147 PolarHBondContact OE1-NH1 2.77Å; E110-R147 WeakPolarHBondContact OE2-CD 3.32Å
111	P	88.1	Confident	84.5	Confident	46 Å²	46	46.2 Å²	46.2	30%	0.299	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	130.9	-171.5	28.8	-33.5	0	0	0	111.8	I102 W140	I102-P111 HydrophobicContact CB-CB 4.3Å; I102-P111 WeakPolarHBondContact O-CG 3.39Å; P111-W140 HydrophobicContact CB-CZ2 3.73Å
112	E	88.3	Confident	86.1	Confident	16 Å²	16	39.6 Å²	39.6	8%	0.075	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	112.8	167.1	-173.8	-177.6	125.4	0	0	110	D114 K141 V143 K154	E112-D114 HydrophobicContact CG-CB 4.4Å; E112-K141 HydrophobicContact CB-CB 4.24Å; E112-K141 PolarHBondContact N-O 2.87Å; E112-K141 PolarHBondContact O-N 3.03Å; E112-K141 IonicContact OE1-NZ 2.66Å; E112-K141 PolarHBondContact OE1-NZ 3.04Å; E112-V143 HydrophobicContact CB-CG1 3.89Å; E112-V143 HydrophobicContact CB-CG2 4.09Å; E112-V143 VanDerWaalsContact OE2-CG1 3.29Å; E112-V143 WeakPolarHBondContact OE2-CG1 3.47Å; E112-K154 VanDerWaalsContact CD-NZ 3.28Å; E112-K154 IonicContact OE1-NZ 2.69Å; E112-K154 PolarHBondContact OE1-NZ 3.33Å; E112-K154 IonicContact OE2-NZ 3.75Å; E112-K154 PolarHBondContact OE2-NZ 2.66Å
113	S	87.9	Confident	87.3	Confident	13 Å²	13	39.7 Å²	39.7	9%	0.091	23%	0.227	C	C	.	.			trans	-96.5	-0.2	-175.5	-72.8	0	0	0	0	114.4	P78 H115 Q116	P78-S113 WeakPolarHBondContact CB-O 3.46Å; S113-H115 PolarHBondContact O-N 2.76Å; S113-Q116 WeakPolarHBondContact O-CB 3.49Å; S113-Q116 VanDerWaalsContact O-CG 3.27Å; S113-Q116 WeakPolarHBondContact O-CG 3.45Å; S113-Q116 PolarHBondContact O-N 2.94Å; S113-Q116 PolarHBondContact OG-OE1 3Å
114	D	88.8	Confident	88.7	Confident	47 Å²	47	36 Å²	36	25%	0.251	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	126.5	177.2	-65.4	-29.7	0	0	0	110.5	T75 Q76 E112 Q116 K141	T75-D114 WeakPolarHBondContact CA-OD1 3.21Å; T75-D114 WeakPolarHBondContact CG2-OD1 3.31Å; Q76-D114 PolarHBondContact N-OD1 3.26Å; Q76-D114 WeakPolarHBondContact O-CA 3.48Å; E112-D114 HydrophobicContact CG-CB 4.4Å; D114-Q116 PolarHBondContact O-N 3.31Å; D114-K141 VanDerWaalsContact O-CE 3.31Å; D114-K141 WeakPolarHBondContact O-CE 3.48Å; D114-K141 PolarHBondContact O-NZ 3.01Å
115	H	91.6	Very high	89.7	Confident	74 Å²	74	33.9 Å²	33.9	34%	0.343	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	35.2	-176.9	-52.1	-68.6	0	0	0	114.1	Q76 S77 S113 W117 R139	Q76-H115 PolarHBondContact O-N 2.92Å; S77-H115 WeakPolarHBondContact O-CA 3.31Å; S113-H115 PolarHBondContact O-N 2.76Å; H115-W117 VanDerWaalsContact O-CD1 3.27Å; H115-W117 PolarHBondContact O-N 2.81Å; H115-R139 WeakPolarHBondContact O-CB 3.23Å
116	Q	91.7	Very high	90.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.191	C	C	.	.			trans	-70.4	-15.1	-179.6	67.9	-176.4	-2.6	0	0	114.3	P78 G99 S113 D114 L118 A137 R139 W140	P78-Q116 HydrophobicContact CB-CG 4.26Å; P78-Q116 WeakPolarHBondContact O-CG 3.35Å; P78-Q116 PolarHBondContact O-NE2 3.22Å; G99-Q116 PolarHBondContact O-NE2 3.42Å; S113-Q116 WeakPolarHBondContact O-CB 3.49Å; S113-Q116 VanDerWaalsContact O-CG 3.27Å; S113-Q116 WeakPolarHBondContact O-CG 3.45Å; S113-Q116 PolarHBondContact O-N 2.94Å; S113-Q116 PolarHBondContact OG-OE1 3Å; D114-Q116 PolarHBondContact O-N 3.31Å; Q116-L118 HydrophobicContact CG-CB 4.45Å; Q116-A137 HydrophobicContact CB-CB 4.15Å; Q116-A137 HydrophobicContact CG-CB 4.01Å; Q116-A137 CarbonylContact O-C 3.56Å; Q116-A137 WeakPolarHBondContact O-CA 3.3Å; Q116-A137 WeakPolarHBondContact O-CB 3.31Å; Q116-R139 PolarHBondContact O-N 2.75Å; Q116-R139 VanDerWaalsContact O-N 3.08Å; Q116-W140 HydrophobicContact CB-CB 4.08Å
117	W	95	Very high	89.9	Confident	48 Å²	48	36.7 Å²	36.7	18%	0.182	20%	0.195	C	C	.	.			trans	62	49.3	180	-76.5	41.7	0	0	0	114	Y48 P66 V67 H115 G119 V120 H138 R139	Y48-W117 HydrophobicContact CE2-CZ3 4.42Å; P66-W117 HydrophobicContact CB-CB 3.94Å; P66-W117 HydrophobicContact CB-CD2 3.96Å; P66-W117 HydrophobicContact CB-CE3 3.83Å; P66-W117 HydrophobicContact CB-CG 4.03Å; P66-W117 HydrophobicContact CG-CE3 4.22Å; P66-W117 WeakPolarHBondContact O-CA 3.18Å; V67-W117 HydrophobicContact CG1-CZ2 4.17Å; H115-W117 VanDerWaalsContact O-CD1 3.27Å; H115-W117 PolarHBondContact O-N 2.81Å; W117-G119 PolarHBondContact O-N 2.9Å; W117-V120 HydrophobicContact CE3-CG2 4.19Å; W117-V120 WeakPolarHBondContact O-CB 3.43Å; W117-V120 PolarHBondContact O-N 2.94Å; W117-H138 AromaticContact CD2-CE1 3.96Å; W117-H138 AromaticContact CE3-CE1 3.69Å; W117-H138 AromaticContact CG-CE1 3.99Å; W117-R139 VanDerWaalsContact NE1-NH1 3.14Å
118	L	94.7	Very high	89	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	127.4	174.3	177.5	63.3	0	0	0	111.1	P66 P78 G79 A80 V81 A98 Q116 A135 C136 A137 F161	P66-L118 WeakPolarHBondContact CA-O 3.45Å; P78-L118 WeakPolarHBondContact O-CB 3.4Å; P78-L118 PolarHBondContact O-N 3.24Å; P78-L118 VanDerWaalsContact O-N 3.17Å; G79-L118 CarbonylContact C-O 3.57Å; A80-L118 PolarHBondContact N-O 2.81Å; A80-L118 VanDerWaalsContact N-O 3.09Å; V81-L118 HydrophobicContact CG2-CG 4.46Å; A98-L118 WeakPolarHBondContact O-CD2 3.19Å; Q116-L118 HydrophobicContact CG-CB 4.45Å; L118-A135 HydrophobicContact CD1-CB 4.48Å; L118-C136 WeakPolarHBondContact CA-O 3.21Å; L118-A137 HydrophobicContact CB-CB 4.09Å; L118-A137 HydrophobicContact CD1-CB 4.18Å; L118-F161 HydrophobicContact CD1-CD2 3.48Å; L118-F161 VanDerWaalsContact CD1-CD2 3.48Å; L118-F161 HydrophobicContact CD1-CE2 3.7Å
119	G	94.9	Very high	88.1	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	93.6	16.1	-175.6	0	0	0	0	0	113.2	S49 G64 W117 S121 C136	S49-G119 PolarHBondContact OG-O 3.13Å; G64-G119 WeakPolarHBondContact CA-O 3.46Å; W117-G119 PolarHBondContact O-N 2.9Å; G119-S121 VanDerWaalsContact C-N 3.28Å; G119-C136 PolarHBondContact N-O 2.87Å
120	V	96.6	Very high	87.3	Confident	8 Å²	8	38 Å²	38	5%	0.048	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	-35.6	171.9	70.3	0	0	0	0	111.7	Y48 W117 C136 H138 G194	Y48-V120 HydrophobicContact CD1-CG2 4.25Å; Y48-V120 WeakPolarHBondContact CD1-O 3.43Å; Y48-V120 HydrophobicContact CE1-CB 4.33Å; Y48-V120 HydrophobicContact CE1-CG2 3.48Å; Y48-V120 VanDerWaalsContact CE1-CG2 3.48Å; Y48-V120 VanDerWaalsContact CE1-O 3.31Å; Y48-V120 WeakPolarHBondContact CE1-O 3.45Å; W117-V120 HydrophobicContact CE3-CG2 4.19Å; W117-V120 WeakPolarHBondContact O-CB 3.43Å; W117-V120 PolarHBondContact O-N 2.94Å; V120-C136 PolarHBondContact N-O 2.82Å; V120-H138 HydrophobicContact CG1-CB 4.26Å; V120-H138 WeakPolarHBondContact CG1-ND1 3.47Å; V120-G194 WeakPolarHBondContact CG1-O 3.35Å
121	S	97.1	Very high	87.2	Confident	12 Å²	12	36.3 Å²	36.3	8%	0.084	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	142.3	-178.5	59.2	0	0	0	0	110.1	G119 C136 G194 I195 N197	G119-S121 VanDerWaalsContact C-N 3.28Å; S121-C136 PolarHBondContact O-N 3.29Å; S121-C136 WeakPolarHBondContact OG-CB 3.34Å; S121-G194 PolarHBondContact OG-O 3.45Å; S121-I195 WeakPolarHBondContact CB-O 3.19Å; S121-N197 VanDerWaalsContact CB-ND2 3.34Å; S121-N197 WeakPolarHBondContact CB-ND2 3.01Å; S121-N197 PolarHBondContact O-ND2 3.24Å; S121-N197 PolarHBondContact OG-ND2 2.79Å
122	L	96.9	Very high	87.4	Confident	24 Å²	24	37.8 Å²	37.8	13%	0.126	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	138.8	-178.5	-66.7	175.6	0	0	0	109.1	S49 L51 L62 V81 L134 A135	S49-L122 WeakPolarHBondContact OG-CD1 3.38Å; S49-L122 WeakPolarHBondContact OG-CG 3.46Å; L51-L122 HydrophobicContact CB-CB 4.06Å; L51-L122 HydrophobicContact CB-CD1 4.17Å; L51-L122 HydrophobicContact CD2-CB 4.04Å; L62-L122 HydrophobicContact CB-CD1 4.49Å; V81-L122 HydrophobicContact CG1-CD2 4.19Å; V81-L122 HydrophobicContact CG2-CD2 4.04Å; L122-L134 WeakPolarHBondContact CA-O 3.49Å; L122-A135 HydrophobicContact CD2-CB 3.5Å
123	S	95.7	Very high	87.7	Confident	10 Å²	10	37.1 Å²	37.1	7%	0.07	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	158.3	165.9	60.8	0	0	0	0	110.8	V133 L134 N197 L199	S123-V133 WeakPolarHBondContact O-CA 3.48Å; S123-L134 PolarHBondContact N-O 2.93Å; S123-L134 VanDerWaalsContact N-O 3.11Å; S123-L134 PolarHBondContact O-N 3.04Å; S123-N197 WeakPolarHBondContact CB-OD1 3.39Å; S123-N197 PolarHBondContact N-OD1 2.77Å; S123-N197 PolarHBondContact OG-OD1 3.09Å; S123-L199 WeakPolarHBondContact OG-CG 3.48Å
124	R	94.1	Very high	88	Confident	40 Å²	40	36.5 Å²	36.5	15%	0.151	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	137.7	178.7	-179.5	-177.7	63	89.7	-7.9	109	L51 L52 V133 G435	L51-R124 HydrophobicContact CD1-CB 3.73Å; L51-R124 HydrophobicContact CD2-CB 3.99Å; L51-R124 HydrophobicContact CG-CB 4.22Å; L52-R124 WeakPolarHBondContact O-CD 3.32Å; L52-R124 PolarHBondContact O-NE 2.91Å; R124-V133 HydrophobicContact CG-CG2 4.46Å; R124-G435 PolarHBondContact NH2-O 2.76Å; R124-G435 VanDerWaalsContact NH2-O 3.09Å
125	Q	91.8	Very high	88.4	Confident	38 Å²	38	34.3 Å²	34.3	18%	0.178	18%	0.18	C	C	.	.			trans	-66	129	169.1	-177.1	177.3	12.8	0	0	109.9	G131 R132 L199 Q201	Q125-G131 PolarHBondContact O-N 3.48Å; Q125-R132 HydrophobicContact CB-CB 4.5Å; Q125-R132 WeakPolarHBondContact CB-O 3.48Å; Q125-R132 PolarHBondContact N-O 3.36Å; Q125-L199 HydrophobicContact CB-CB 4.39Å; Q125-L199 HydrophobicContact CB-CD1 4.26Å; Q125-Q201 PolarHBondContact NE2-O 3.39Å
126	P	85.6	Confident	88.6	Confident	62 Å²	62	30.8 Å²	30.8	40%	0.403	16%	0.164	S	C	.	.			trans	-62.3	144.8	177.5	25.5	-33.4	0	0	0	110.8	L199 Q201	P126-L199 WeakPolarHBondContact CD-O 3.35Å; P126-Q201 HydrophobicContact CG-CG 4.19Å
127	G	74.1	Confident	88.8	Confident	43 Å²	43	30.8 Å²	30.8	44%	0.443	16%	0.164	S	C	.	.	S	Bend	trans	154.7	155.1	179.8	0	0	0	0	0	113.8	N129 G130	G127-N129 PolarHBondContact O-N 3.03Å; G127-G130 PolarHBondContact O-N 2.74Å
128	E	59.8	Low	88.8	Confident	162 Å²	162	29.2 Å²	29.2	76%	0.757	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-38.4	-172.6	-66.2	-173	161.6	0	0	113.3	R54 G130	R54-E128 VanDerWaalsContact CZ-O 3.25Å; R54-E128 PolarHBondContact NE-O 2.9Å; R54-E128 PolarHBondContact NH2-O 3.12Å; E128-G130 VanDerWaalsContact C-N 3.27Å; E128-G130 PolarHBondContact O-N 3.39Å
129	N	65.2	Low	88.7	Confident	106 Å²	106	34.1 Å²	34.1	57%	0.567	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.8	18.9	-179.9	-69.3	-25.8	0	0	0	114.1	R54 G127	R54-N129 CarbonylContact O-C 3.5Å; G127-N129 PolarHBondContact O-N 3.03Å
130	G	68.1	Low	88.7	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.177	C	C	.	.			trans	55	94.2	-172.9	0	0	0	0	0	112.7	H53 R54 G127 E128 S165	H53-G130 PolarHBondContact CE1-O 3.28Å; R54-G130 WeakPolarHBondContact O-CA 3.38Å; R54-G130 PolarHBondContact O-N 3.26Å; G127-G130 PolarHBondContact O-N 2.74Å; E128-G130 VanDerWaalsContact C-N 3.27Å; E128-G130 PolarHBondContact O-N 3.39Å; G130-S165 WeakPolarHBondContact O-CB 3.09Å; G130-S165 PolarHBondContact O-OG 2.94Å
131	G	85.5	Confident	88.4	Confident	12 Å²	12	35.4 Å²	35.4	12%	0.124	18%	0.182	C	C	.	.			trans	-61.6	-167.3	-175	0	0	0	0	0	114.9	H53 Q125 S165	H53-G131 PolarHBondContact CE1-O 3.44Å; H53-G131 VanDerWaalsContact CE1-O 3.26Å; Q125-G131 PolarHBondContact O-N 3.48Å; G131-S165 WeakPolarHBondContact CA-OG 3.47Å
132	R	92.3	Very high	88	Confident	78 Å²	78	35.1 Å²	35.1	29%	0.294	18%	0.18	S	C	.	.			trans	-60.4	152.5	-178.2	-62.2	177.2	177.9	134.3	0.6	111.9	Q125 R162 Y163 E164 L199	Q125-R132 HydrophobicContact CB-CB 4.5Å; Q125-R132 WeakPolarHBondContact CB-O 3.48Å; Q125-R132 PolarHBondContact N-O 3.36Å; R132-R162 HydrophobicContact CB-CG 4.48Å; R132-R162 VanDerWaalsContact CD-NH1 3.25Å; R132-R162 VanDerWaalsContact CZ-NH1 3.29Å; R132-R162 VanDerWaalsContact NH1-NH1 3.12Å; R132-Y163 WeakPolarHBondContact CA-O 3.3Å; R132-Y163 VanDerWaalsContact CB-O 3.3Å; R132-Y163 WeakPolarHBondContact CB-O 3.48Å; R132-E164 IonicContact CZ-OE2 2.67Å; R132-E164 IonicContact NE-OE1 3.53Å; R132-E164 PolarHBondContact NE-OE1 3.27Å; R132-E164 IonicContact NE-OE2 2.8Å; R132-E164 PolarHBondContact NE-OE2 3.34Å; R132-E164 IonicContact NH2-OE2 3.69Å; R132-L199 WeakPolarHBondContact O-CD1 3.19Å
133	V	94.5	Very high	87.6	Confident	2 Å²	2	34 Å²	34	1%	0.012	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	136.4	177.7	173.9	0	0	0	0	109.8	L51 L62 S123 R124 R162 Y163 L167	L51-V133 HydrophobicContact CD2-CG1 3.7Å; L51-V133 HydrophobicContact CD2-CG2 4.2Å; L62-V133 HydrophobicContact CD1-CB 4.42Å; L62-V133 HydrophobicContact CD1-CG1 3.89Å; L62-V133 HydrophobicContact CD1-CG2 3.95Å; S123-V133 WeakPolarHBondContact O-CA 3.48Å; R124-V133 HydrophobicContact CG-CG2 4.46Å; V133-R162 CarbonylContact O-C 3.37Å; V133-R162 WeakPolarHBondContact O-CA 3.24Å; V133-Y163 PolarHBondContact N-O 3.33Å; V133-Y163 PolarHBondContact O-N 3.19Å; V133-L167 HydrophobicContact CB-CD2 4.12Å; V133-L167 HydrophobicContact CG2-CD2 3.9Å
134	L	95.3	Very high	87.2	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	125.7	174.1	-171.5	72.4	0	0	0	110	L122 S123 C160 R162 N197 L199 I204 V206	L122-L134 WeakPolarHBondContact CA-O 3.49Å; S123-L134 PolarHBondContact N-O 2.93Å; S123-L134 VanDerWaalsContact N-O 3.11Å; S123-L134 PolarHBondContact O-N 3.04Å; L134-C160 HydrophobicContact CD1-CB 3.79Å; L134-C160 HydrophobicContact CG-CB 4.24Å; L134-R162 HydrophobicContact CD1-CB 3.98Å; L134-N197 HydrophobicContact CD2-CB 3.88Å; L134-L199 HydrophobicContact CB-CD1 3.75Å; L134-L199 HydrophobicContact CB-CD2 4.35Å; L134-L199 HydrophobicContact CB-CG 4.07Å; L134-L199 HydrophobicContact CD2-CD2 4.32Å; L134-I204 HydrophobicContact CD2-CG2 3.72Å; L134-V206 HydrophobicContact CD2-CG2 4.42Å
135	A	96	Very high	86.6	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.6	173.3	0	0	0	0	0	110.6	V81 L118 L122 C160 F161 Y163	V81-A135 HydrophobicContact CG2-CB 3.76Å; L118-A135 HydrophobicContact CD1-CB 4.48Å; L122-A135 HydrophobicContact CD2-CB 3.5Å; A135-C160 CarbonylContact O-C 3.57Å; A135-C160 WeakPolarHBondContact O-CA 3.48Å; A135-F161 PolarHBondContact N-O 2.92Å; A135-F161 PolarHBondContact O-N 3.29Å; A135-Y163 HydrophobicContact CB-CE2 3.99Å
136	C	96	Very high	86.2	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	158.9	-176.4	-59.9	0	0	0	0	114.2	L118 G119 V120 S121 A159 C160 G194 N197	L118-C136 WeakPolarHBondContact CA-O 3.21Å; G119-C136 PolarHBondContact N-O 2.87Å; V120-C136 PolarHBondContact N-O 2.82Å; S121-C136 PolarHBondContact O-N 3.29Å; S121-C136 WeakPolarHBondContact OG-CB 3.34Å; C136-A159 CarbonylContact C-O 2.63Å; C136-A159 WeakPolarHBondContact CA-O 3.41Å; C136-C160 HydrophobicContact CB-CB 4.07Å; C136-C160 WeakPolarHBondContact CB-SG 3.12Å; C136-C160 WeakPolarHBondContact SG-CB 3.45Å; C136-C160 CovalentContact SG-SG 2.05Å; C136-C160 PolarHBondContact SG-SG 2.72Å; C136-G194 WeakPolarHBondContact CB-O 3.34Å; C136-N197 PolarHBondContact SG-ND2 3.11Å; C136-N197 VanDerWaalsContact SG-ND2 3.43Å
137	A	95.3	Very high	86.1	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	76.4	177.5	0	0	0	0	0	108.1	Q116 L118 R139 W140 A159 F161	Q116-A137 HydrophobicContact CB-CB 4.15Å; Q116-A137 HydrophobicContact CG-CB 4.01Å; Q116-A137 CarbonylContact O-C 3.56Å; Q116-A137 WeakPolarHBondContact O-CA 3.3Å; Q116-A137 WeakPolarHBondContact O-CB 3.31Å; L118-A137 HydrophobicContact CB-CB 4.09Å; L118-A137 HydrophobicContact CD1-CB 4.18Å; A137-R139 PolarHBondContact O-N 3.1Å; A137-R139 VanDerWaalsContact O-N 3.09Å; A137-W140 HydrophobicContact CB-CB 4.4Å; A137-W140 VanDerWaalsContact O-CB 3.27Å; A137-W140 WeakPolarHBondContact O-CB 3.27Å; A137-W140 PolarHBondContact O-N 2.99Å; A137-A159 WeakPolarHBondContact CA-O 3.43Å; A137-A159 PolarHBondContact N-O 2.91Å; A137-A159 PolarHBondContact O-N 2.8Å; A137-A159 VanDerWaalsContact O-N 3.11Å; A137-F161 HydrophobicContact CB-CE2 4.26Å
138	H	95.2	Very high	86.2	Confident	16 Å²	16	42.3 Å²	42.3	7%	0.074	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.8	-172	74.6	-59.6	0	0	0	114.8	W117 V120 Q192 A193 I195	W117-H138 AromaticContact CD2-CE1 3.96Å; W117-H138 AromaticContact CE3-CE1 3.69Å; W117-H138 AromaticContact CG-CE1 3.99Å; V120-H138 HydrophobicContact CG1-CB 4.26Å; V120-H138 WeakPolarHBondContact CG1-ND1 3.47Å; H138-Q192 VanDerWaalsContact O-CA 3.26Å; H138-Q192 WeakPolarHBondContact O-CA 3.25Å; H138-Q192 WeakPolarHBondContact O-CB 3.36Å; H138-A193 WeakPolarHBondContact CA-O 3.39Å; H138-I195 HydrophobicContact CB-CB 4.28Å
139	R	93.9	Very high	86.7	Confident	103 Å²	103	38.2 Å²	38.2	39%	0.389	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	10.3	177.8	-64.3	177.8	69.1	178.3	3.4	113.2	H115 Q116 W117 A137 K141	H115-R139 WeakPolarHBondContact O-CB 3.23Å; Q116-R139 PolarHBondContact O-N 2.75Å; Q116-R139 VanDerWaalsContact O-N 3.08Å; W117-R139 VanDerWaalsContact NE1-NH1 3.14Å; A137-R139 PolarHBondContact O-N 3.1Å; A137-R139 VanDerWaalsContact O-N 3.09Å; R139-K141 PolarHBondContact O-N 2.77Å
140	W	93.2	Very high	86.6	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.178	C	C	.	.			trans	-60.4	135.3	172.1	-179.6	86.5	0	0	0	110.8	I102 P111 Q116 A137 N142 P156 N157 G158 A159 I174	I102-W140 HydrophobicContact CD1-CZ2 4.02Å; P111-W140 HydrophobicContact CB-CZ2 3.73Å; Q116-W140 HydrophobicContact CB-CB 4.08Å; A137-W140 HydrophobicContact CB-CB 4.4Å; A137-W140 VanDerWaalsContact O-CB 3.27Å; A137-W140 WeakPolarHBondContact O-CB 3.27Å; A137-W140 PolarHBondContact O-N 2.99Å; W140-N142 HydrophobicContact CH2-CB 4.23Å; W140-N142 HydrophobicContact CZ3-CB 4.23Å; W140-P156 CarbonylContact O-C 3.55Å; W140-P156 WeakPolarHBondContact O-CA 3.4Å; W140-N157 HydrophobicContact CE3-CB 4.34Å; W140-N157 HydrophobicContact CZ3-CB 4.12Å; W140-N157 PolarHBondContact O-N 3.43Å; W140-G158 PolarHBondContact O-N 3.12Å; W140-G158 VanDerWaalsContact O-N 3.08Å; W140-A159 HydrophobicContact CB-CB 3.88Å; W140-A159 HydrophobicContact CD2-CB 3.9Å; W140-A159 HydrophobicContact CE3-CB 4.16Å; W140-A159 HydrophobicContact CG-CB 3.77Å; W140-I174 HydrophobicContact CE3-CG2 4.39Å; W140-I174 HydrophobicContact CH2-CD1 3.8Å; W140-I174 HydrophobicContact CZ2-CD1 4.18Å; W140-I174 HydrophobicContact CZ3-CD1 4.11Å; W140-I174 HydrophobicContact CZ3-CG2 3.86Å
141	K	90.4	Very high	86.5	Confident	35 Å²	35	39.5 Å²	39.5	15%	0.152	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139.9	-171.3	-68.9	155.8	-74.5	174.1	0	112	E112 D114 R139 V143 K154 L155 P156	E112-K141 HydrophobicContact CB-CB 4.24Å; E112-K141 PolarHBondContact N-O 2.87Å; E112-K141 PolarHBondContact O-N 3.03Å; E112-K141 IonicContact OE1-NZ 2.66Å; E112-K141 PolarHBondContact OE1-NZ 3.04Å; D114-K141 VanDerWaalsContact O-CE 3.31Å; D114-K141 WeakPolarHBondContact O-CE 3.48Å; D114-K141 PolarHBondContact O-NZ 3.01Å; R139-K141 PolarHBondContact O-N 2.77Å; K141-V143 HydrophobicContact CB-CG1 4.22Å; K141-K154 HydrophobicContact CD-CD 4.42Å; K141-L155 CarbonylContact C-O 3.57Å; K141-L155 WeakPolarHBondContact CA-O 3.32Å; K141-P156 HydrophobicContact CG-CB 4.28Å
142	N	89.5	Confident	85.7	Confident	6 Å²	6	46.3 Å²	46.3	3%	0.032	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	121	159.8	-178.9	10.2	0	0	0	109.5	T108 C109 E110 W140 Y144 L155 N157	T108-N142 PolarHBondContact O-ND2 2.75Å; T108-N142 VanDerWaalsContact O-ND2 3.11Å; C109-N142 WeakPolarHBondContact CA-OD1 3.35Å; E110-N142 PolarHBondContact N-OD1 2.73Å; E110-N142 PolarHBondContact O-OD1 3.4Å; W140-N142 HydrophobicContact CH2-CB 4.23Å; W140-N142 HydrophobicContact CZ3-CB 4.23Å; N142-Y144 WeakPolarHBondContact OD1-CB 2.9Å; N142-Y144 PolarHBondContact OD1-N 3.18Å; N142-Y144 VanDerWaalsContact OD1-N 3.15Å; N142-L155 HydrophobicContact CB-CB 4.46Å; N142-L155 PolarHBondContact N-O 2.81Å; N142-L155 PolarHBondContact O-N 3.05Å; N142-N157 WeakPolarHBondContact CB-OD1 3.27Å
143	V	89.2	Confident	85	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.226	C	C	.	.			trans	-113.2	12.5	-177.2	-61	0	0	0	0	114.2	E110 E112 K141 Y145 S146 R147 K154	E110-V143 HydrophobicContact CB-CG2 4.19Å; E110-V143 HydrophobicContact CG-CG2 4.2Å; E110-V143 WeakPolarHBondContact O-CG2 3.48Å; E110-V143 PolarHBondContact O-N 2.74Å; E112-V143 HydrophobicContact CB-CG1 3.89Å; E112-V143 HydrophobicContact CB-CG2 4.09Å; E112-V143 VanDerWaalsContact OE2-CG1 3.29Å; E112-V143 WeakPolarHBondContact OE2-CG1 3.47Å; K141-V143 HydrophobicContact CB-CG1 4.22Å; V143-Y145 PolarHBondContact O-N 2.91Å; V143-S146 WeakPolarHBondContact O-CB 3.48Å; V143-S146 PolarHBondContact O-N 2.86Å; V143-R147 PolarHBondContact O-N 2.83Å; V143-K154 HydrophobicContact CG1-CB 4.09Å; V143-K154 HydrophobicContact CG1-CD 3.8Å; V143-K154 HydrophobicContact CG1-CG 3.74Å
144	Y	86.8	Confident	84.7	Confident	45 Å²	45	49.4 Å²	49.4	18%	0.176	24%	0.244	C	C	.	.	H	α-helix	trans	-51.1	-55.1	-177.4	-177.8	-88.9	0	0	0	113	K107 T108 E110 N142 S146 R147 K148	K107-Y144 WeakPolarHBondContact O-CE2 3.31Å; T108-Y144 VanDerWaalsContact C-CG 3.44Å; T108-Y144 HydrophobicContact CG2-CE1 4.32Å; T108-Y144 WeakPolarHBondContact O-CB 3.44Å; E110-Y144 HydrophobicContact CB-CD2 4.46Å; N142-Y144 WeakPolarHBondContact OD1-CB 2.9Å; N142-Y144 PolarHBondContact OD1-N 3.18Å; N142-Y144 VanDerWaalsContact OD1-N 3.15Å; Y144-S146 PolarHBondContact O-N 3.2Å; Y144-R147 PolarHBondContact O-N 3.22Å; Y144-K148 HydrophobicContact CD2-CD 4.25Å; Y144-K148 HydrophobicContact CE1-CD 4.26Å; Y144-K148 HydrophobicContact CE2-CD 3.67Å; Y144-K148 WeakPolarHBondContact O-CB 3.38Å; Y144-K148 PolarHBondContact O-N 3.28Å
145	Y	81.7	Confident	84.5	Confident	8 Å²	8	49.5 Å²	49.5	3%	0.031	25%	0.245	C	C	.	.	H	α-helix	trans	-69	-25.9	-179.1	-63.1	-69.3	0	0	0	112.6	V143 D149 L155 N179 Q181 R182	V143-Y145 PolarHBondContact O-N 2.91Å; Y145-D149 WeakPolarHBondContact CD1-OD2 3.15Å; Y145-D149 WeakPolarHBondContact O-CB 3.19Å; Y145-D149 PolarHBondContact O-N 2.64Å; Y145-D149 VanDerWaalsContact O-N 3.11Å; Y145-L155 HydrophobicContact CD2-CD1 4.2Å; Y145-N179 PolarHBondContact OH-O 3.01Å; Y145-Q181 WeakPolarHBondContact CE2-O 3.22Å; Y145-R182 HydrophobicContact CD1-CG 4.05Å; Y145-R182 HydrophobicContact CD2-CG 4.37Å; Y145-R182 HydrophobicContact CE1-CG 3.81Å; Y145-R182 HydrophobicContact CE2-CG 4.15Å; Y145-R182 HydrophobicContact CG-CG 4.32Å
146	S	83.3	Confident	84.3	Confident	30 Å²	30	50.4 Å²	50.4	21%	0.21	25%	0.251	C	S	.	.	H	α-helix	trans	-71.7	-38.5	177.5	-179	0	0	0	0	113	V143 Y144 Q151	V143-S146 WeakPolarHBondContact O-CB 3.48Å; V143-S146 PolarHBondContact O-N 2.86Å; Y144-S146 PolarHBondContact O-N 3.2Å; S146-Q151 WeakPolarHBondContact CA-O 2.99Å; S146-Q151 PolarHBondContact OG-O 2.72Å
147	R	82	Confident	84.1	Confident	157 Å²	157	50.6 Å²	50.6	59%	0.592	25%	0.251	S	S	*	.	H	α-helix	trans	-85.2	-34.4	180	-70.8	-179.5	176.8	-172.1	1.6	113.4	E110 V143 Y144	E110-R147 VanDerWaalsContact CD-CD 3.45Å; E110-R147 WeakPolarHBondContact OE1-CD 2.86Å; E110-R147 IonicContact OE1-CZ 3.86Å; E110-R147 IonicContact OE1-NE 3.75Å; E110-R147 IonicContact OE1-NH1 3.79Å; E110-R147 PolarHBondContact OE1-NH1 2.77Å; E110-R147 WeakPolarHBondContact OE2-CD 3.32Å; V143-R147 PolarHBondContact O-N 2.83Å; Y144-R147 PolarHBondContact O-N 3.22Å
148	K	77.8	Confident	84	Confident	128 Å²	128	50.6 Å²	50.6	56%	0.557	25%	0.251	S	S	*	.	H	α-helix	trans	-97.2	-33.1	-173.2	-63.7	-158.3	-175.1	-176.6	0	115.3	Y144	Y144-K148 HydrophobicContact CD2-CD 4.25Å; Y144-K148 HydrophobicContact CE1-CD 4.26Å; Y144-K148 HydrophobicContact CE2-CD 3.67Å; Y144-K148 WeakPolarHBondContact O-CB 3.38Å; Y144-K148 PolarHBondContact O-N 3.28Å
149	D	69.2	Low	83.9	Confident	76 Å²	76	49.8 Å²	49.8	41%	0.406	25%	0.248	S	C	.	.	S	Bend	trans	-106.4	5.1	-174	-71.9	5.5	0	0	0	112.8	Y145 Q151 R182	Y145-D149 WeakPolarHBondContact CD1-OD2 3.15Å; Y145-D149 WeakPolarHBondContact O-CB 3.19Å; Y145-D149 PolarHBondContact O-N 2.64Å; Y145-D149 VanDerWaalsContact O-N 3.11Å; D149-Q151 HydrophobicContact CB-CG 4.44Å; D149-Q151 PolarHBondContact O-N 3.37Å; D149-Q151 VanDerWaalsContact O-N 3.09Å; D149-R182 IonicContact OD2-NH1 3.37Å
150	G	64.5	Low	83.9	Confident	66 Å²	66	44.9 Å²	44.9	68%	0.68	23%	0.229	S	C	*	.			trans	65.9	8.7	179.1	0	0	0	0	0	115.1
151	Q	66.1	Low	83.9	Confident	68 Å²	68	45 Å²	45	32%	0.318	23%	0.23	S	C	.	.			trans	-77.7	143	174.2	-62.4	-169.4	2.9	0	0	110	S146 D149 N153	S146-Q151 WeakPolarHBondContact CA-O 2.99Å; S146-Q151 PolarHBondContact OG-O 2.72Å; D149-Q151 HydrophobicContact CB-CG 4.44Å; D149-Q151 PolarHBondContact O-N 3.37Å; D149-Q151 VanDerWaalsContact O-N 3.09Å; Q151-N153 PolarHBondContact O-N 3.34Å; Q151-N153 VanDerWaalsContact O-N 3.14Å
152	N	68	Low	84	Confident	155 Å²	155	45.1 Å²	45.1	83%	0.829	23%	0.229	S	C	*	.			trans	-81.4	15	178.4	-78.7	-10.6	0	0	0	114.3	K154	N152-K154 PolarHBondContact O-N 1.98Å
153	N	78.1	Confident	84.1	Confident	53 Å²	53	45 Å²	45	28%	0.283	23%	0.228	S	C	.	.			trans	-91.9	105.4	-173	-63.4	-25.9	0	0	0	111.6	Q151 L155	Q151-N153 PolarHBondContact O-N 3.34Å; Q151-N153 VanDerWaalsContact O-N 3.14Å; N153-L155 HydrophobicContact CB-CD2 4.47Å
154	K	87.6	Confident	84.2	Confident	91 Å²	91	47.2 Å²	47.2	40%	0.396	24%	0.239	S	C	.	.			trans	-84.8	130	161.7	-61.4	-168.2	178.1	-163.7	0	108.8	E112 K141 V143 N152 P156	E112-K154 VanDerWaalsContact CD-NZ 3.28Å; E112-K154 IonicContact OE1-NZ 2.69Å; E112-K154 PolarHBondContact OE1-NZ 3.33Å; E112-K154 IonicContact OE2-NZ 3.75Å; E112-K154 PolarHBondContact OE2-NZ 2.66Å; K141-K154 HydrophobicContact CD-CD 4.42Å; V143-K154 HydrophobicContact CG1-CB 4.09Å; V143-K154 HydrophobicContact CG1-CD 3.8Å; V143-K154 HydrophobicContact CG1-CG 3.74Å; N152-K154 PolarHBondContact O-N 1.98Å; K154-P156 VanDerWaalsContact O-CD 3.27Å; K154-P156 WeakPolarHBondContact O-CD 3.44Å
155	L	90.3	Very high	84.3	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.016	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-101.1	105.3	-175.8	-57.2	-178.8	0	0	0	110.2	K141 N142 Y145 N153 N157 K183 G189	K141-L155 CarbonylContact C-O 3.57Å; K141-L155 WeakPolarHBondContact CA-O 3.32Å; N142-L155 HydrophobicContact CB-CB 4.46Å; N142-L155 PolarHBondContact N-O 2.81Å; N142-L155 PolarHBondContact O-N 3.05Å; Y145-L155 HydrophobicContact CD2-CD1 4.2Å; N153-L155 HydrophobicContact CB-CD2 4.47Å; L155-N157 VanDerWaalsContact C-N 3.27Å; L155-N157 PolarHBondContact O-N 3.44Å; L155-N157 PolarHBondContact O-OD1 3.48Å; L155-N157 VanDerWaalsContact O-OD1 3.13Å; L155-K183 WeakPolarHBondContact CD2-O 3.24Å; L155-G189 WeakPolarHBondContact CA-O 3.49Å; L155-G189 WeakPolarHBondContact CB-O 3.4Å
156	P	91.9	Very high	84.6	Confident	19 Å²	19	49.2 Å²	49.2	12%	0.123	26%	0.256	C	S	.	.			trans	-79.3	76.9	176.3	32.8	-33.8	0	0	0	110.2	W140 K141 K154 G158 F184 G189 S190 Q192	W140-P156 CarbonylContact O-C 3.55Å; W140-P156 WeakPolarHBondContact O-CA 3.4Å; K141-P156 HydrophobicContact CG-CB 4.28Å; K154-P156 VanDerWaalsContact O-CD 3.27Å; K154-P156 WeakPolarHBondContact O-CD 3.44Å; P156-G158 VanDerWaalsContact C-N 3.26Å; P156-G158 PolarHBondContact O-N 3.1Å; P156-F184 HydrophobicContact CG-CD2 4.46Å; P156-F184 HydrophobicContact CG-CE2 3.77Å; P156-G189 WeakPolarHBondContact CD-O 3.12Å; P156-S190 CarbonylContact O-C 3.35Å; P156-Q192 HydrophobicContact CB-CG 4.27Å; P156-Q192 HydrophobicContact CG-CG 4.41Å; P156-Q192 PolarHBondContact O-N 2.98Å
157	N	91.8	Very high	84.9	Confident	3 Å²	3	48.2 Å²	48.2	2%	0.016	25%	0.248	C	C	.	.			trans	-66.9	-29	178.7	-62.4	92.3	0	0	0	112.3	W140 N142 L155 I174 C176 A193	W140-N157 HydrophobicContact CE3-CB 4.34Å; W140-N157 HydrophobicContact CZ3-CB 4.12Å; W140-N157 PolarHBondContact O-N 3.43Å; N142-N157 WeakPolarHBondContact CB-OD1 3.27Å; L155-N157 VanDerWaalsContact C-N 3.27Å; L155-N157 PolarHBondContact O-N 3.44Å; L155-N157 PolarHBondContact O-OD1 3.48Å; L155-N157 VanDerWaalsContact O-OD1 3.13Å; N157-I174 HydrophobicContact CB-CG2 4.28Å; N157-C176 HydrophobicContact CB-CB 4.42Å; N157-C176 PolarHBondContact ND2-O 3.5Å; N157-A193 WeakPolarHBondContact O-CB 3.12Å; N157-A193 PolarHBondContact O-N 3.27Å; N157-A193 VanDerWaalsContact O-N 3.08Å
158	G	93.7	Very high	85.1	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.249	C	C	.	.			trans	75.9	151.8	-168.8	0	0	0	0	0	112.5	W140 P156 I174	W140-G158 PolarHBondContact O-N 3.12Å; W140-G158 VanDerWaalsContact O-N 3.08Å; P156-G158 VanDerWaalsContact C-N 3.26Å; P156-G158 PolarHBondContact O-N 3.1Å; G158-I174 WeakPolarHBondContact O-CG2 3.21Å
159	A	93.3	Very high	85.6	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	146	179.5	0	0	0	0	0	110.8	I102 C136 A137 W140 I174	I102-A159 HydrophobicContact CD1-CB 4.24Å; C136-A159 CarbonylContact C-O 2.63Å; C136-A159 WeakPolarHBondContact CA-O 3.41Å; A137-A159 WeakPolarHBondContact CA-O 3.43Å; A137-A159 PolarHBondContact N-O 2.91Å; A137-A159 PolarHBondContact O-N 2.8Å; A137-A159 VanDerWaalsContact O-N 3.11Å; W140-A159 HydrophobicContact CB-CB 3.88Å; W140-A159 HydrophobicContact CD2-CB 3.9Å; W140-A159 HydrophobicContact CE3-CB 4.16Å; W140-A159 HydrophobicContact CG-CB 3.77Å; A159-I174 HydrophobicContact CB-CG1 4.12Å
160	C	94	Very high	86.6	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	152.8	174.5	-61	0	0	0	0	111.1	L134 A135 C136 H172 F173	L134-C160 HydrophobicContact CD1-CB 3.79Å; L134-C160 HydrophobicContact CG-CB 4.24Å; A135-C160 CarbonylContact O-C 3.57Å; A135-C160 WeakPolarHBondContact O-CA 3.48Å; C136-C160 HydrophobicContact CB-CB 4.07Å; C136-C160 WeakPolarHBondContact CB-SG 3.12Å; C136-C160 WeakPolarHBondContact SG-CB 3.45Å; C136-C160 CovalentContact SG-SG 2.05Å; C136-C160 PolarHBondContact SG-SG 2.72Å; C160-H172 CarbonylContact O-C 3.25Å; C160-H172 WeakPolarHBondContact O-CA 3.27Å; C160-F173 HydrophobicContact CB-CD1 4.45Å; C160-F173 PolarHBondContact N-O 3.12Å; C160-F173 PolarHBondContact O-N 2.69Å
161	F	93.2	Very high	87.7	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.009	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	113.6	-178.6	-58.3	-89.6	0	0	0	107.7	A98 I102 L118 A135 A137 Y163 Y170 Q171 H172	A98-F161 HydrophobicContact CB-CD1 4.37Å; I102-F161 HydrophobicContact CD1-CE1 4.39Å; I102-F161 HydrophobicContact CD1-CZ 4.17Å; I102-F161 HydrophobicContact CG1-CE1 4.18Å; I102-F161 HydrophobicContact CG1-CZ 4.25Å; L118-F161 HydrophobicContact CD1-CD2 3.48Å; L118-F161 VanDerWaalsContact CD1-CD2 3.48Å; L118-F161 HydrophobicContact CD1-CE2 3.7Å; A135-F161 PolarHBondContact N-O 2.92Å; A135-F161 PolarHBondContact O-N 3.29Å; A137-F161 HydrophobicContact CB-CE2 4.26Å; F161-Y163 HydrophobicContact CB-CE2 4.12Å; F161-Y170 HydrophobicContact CD1-CD2 4.05Å; F161-Y170 HydrophobicContact CD1-CE2 4.15Å; F161-Q171 CarbonylContact C-O 3.56Å; F161-Q171 WeakPolarHBondContact CA-O 3.48Å; F161-H172 HydrophobicContact CD1-CB 4.01Å; F161-H172 HydrophobicContact CE1-CB 4Å
162	R	92.8	Very high	88.8	Confident	38 Å²	38	45.5 Å²	45.5	14%	0.143	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	110.2	177.5	-173.4	178.6	71.3	118.9	9.3	108.3	R132 V133 L134 E164 Y170 Q171	R132-R162 HydrophobicContact CB-CG 4.48Å; R132-R162 VanDerWaalsContact CD-NH1 3.25Å; R132-R162 VanDerWaalsContact CZ-NH1 3.29Å; R132-R162 VanDerWaalsContact NH1-NH1 3.12Å; V133-R162 CarbonylContact O-C 3.37Å; V133-R162 WeakPolarHBondContact O-CA 3.24Å; L134-R162 HydrophobicContact CD1-CB 3.98Å; R162-E164 IonicContact CZ-OE1 3.56Å; R162-E164 IonicContact NH2-OE1 3.61Å; R162-Y170 CarbonylContact O-C 3.56Å; R162-Y170 VanDerWaalsContact O-CA 3.23Å; R162-Y170 WeakPolarHBondContact O-CA 3.45Å; R162-Q171 PolarHBondContact N-O 2.88Å; R162-Q171 PolarHBondContact O-N 2.83Å
163	Y	91.9	Very high	89.6	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.008	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	142.4	174.1	-64.5	-95.1	0	0	0	110.1	L96 A98 R132 V133 A135 F161 S169 Y170	L96-Y163 HydrophobicContact CB-CE1 4.28Å; L96-Y163 HydrophobicContact CD1-CE1 4.1Å; A98-Y163 HydrophobicContact CB-CE1 3.55Å; A98-Y163 HydrophobicContact CB-CE2 4.36Å; A98-Y163 WeakPolarHBondContact CB-OH 3.33Å; R132-Y163 WeakPolarHBondContact CA-O 3.3Å; R132-Y163 VanDerWaalsContact CB-O 3.3Å; R132-Y163 WeakPolarHBondContact CB-O 3.48Å; V133-Y163 PolarHBondContact N-O 3.33Å; V133-Y163 PolarHBondContact O-N 3.19Å; A135-Y163 HydrophobicContact CB-CE2 3.99Å; F161-Y163 HydrophobicContact CB-CE2 4.12Å; Y163-S169 WeakPolarHBondContact CA-O 3.38Å; Y163-Y170 HydrophobicContact CE1-CD1 4.47Å; Y163-Y170 HydrophobicContact CE1-CG 4.47Å
164	E	90.8	Very high	90.2	Very high	47 Å²	47	38.4 Å²	38.4	22%	0.22	19%	0.193	C	C	.	.			trans	-71.1	168	165.9	-61.2	-59.9	150	0	0	110.4	R132 R162 D166 L167 S169	R132-E164 IonicContact CZ-OE2 2.67Å; R132-E164 IonicContact NE-OE1 3.53Å; R132-E164 PolarHBondContact NE-OE1 3.27Å; R132-E164 IonicContact NE-OE2 2.8Å; R132-E164 PolarHBondContact NE-OE2 3.34Å; R132-E164 IonicContact NH2-OE2 3.69Å; R162-E164 IonicContact CZ-OE1 3.56Å; R162-E164 IonicContact NH2-OE1 3.61Å; E164-D166 PolarHBondContact O-N 3.46Å; E164-L167 PolarHBondContact O-N 3.41Å; E164-S169 WeakPolarHBondContact CB-OG 2.98Å; E164-S169 WeakPolarHBondContact CG-OG 3.37Å; E164-S169 PolarHBondContact N-O 2.88Å
165	S	88.8	Confident	90.2	Very high	30 Å²	30	34.4 Å²	34.4	21%	0.21	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-25.7	-175	-69.5	0	0	0	0	114.5	H53 H55 G130 G131 L167	H53-S165 PolarHBondContact NE2-O 3.44Å; H55-S165 WeakPolarHBondContact CB-O 3.2Å; G130-S165 WeakPolarHBondContact O-CB 3.09Å; G130-S165 PolarHBondContact O-OG 2.94Å; G131-S165 WeakPolarHBondContact CA-OG 3.47Å; S165-L167 VanDerWaalsContact C-N 3.3Å
166	D	87.9	Confident	90	Very high	66 Å²	66	34.3 Å²	34.3	35%	0.353	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-10.8	177.1	69.9	-0.7	0	0	0	114.2	E164 V168 S169	E164-D166 PolarHBondContact O-N 3.46Å; D166-V168 HydrophobicContact CB-CG2 4.37Å; D166-V168 PolarHBondContact O-N 2.95Å; D166-V168 VanDerWaalsContact O-N 3.13Å; D166-V168 PolarHBondContact OD1-N 2.91Å; D166-S169 PolarHBondContact OD1-N 3.06Å
167	L	89.8	Confident	89.7	Confident	8 Å²	8	36.9 Å²	36.9	4%	0.042	18%	0.184	C	C	.	.	S	Bend	trans	60.5	12	-176	-50.2	171.7	0	0	0	114.7	L62 L96 V133 E164 S165	L62-L167 HydrophobicContact CD1-CD1 4.2Å; L62-L167 HydrophobicContact CD1-CD2 4.02Å; L62-L167 HydrophobicContact CD2-CD1 3.72Å; L62-L167 HydrophobicContact CG-CD1 4.5Å; L96-L167 HydrophobicContact CD2-CB 4.19Å; V133-L167 HydrophobicContact CB-CD2 4.12Å; V133-L167 HydrophobicContact CG2-CD2 3.9Å; E164-L167 PolarHBondContact O-N 3.41Å; S165-L167 VanDerWaalsContact C-N 3.3Å
168	V	86.9	Confident	89.3	Confident	103 Å²	103	39.6 Å²	39.6	62%	0.624	20%	0.196	S	C	*	.	S	Bend	trans	-93.2	-48.6	179.8	-179.3	0	0	0	0	110.1	D166	D166-V168 HydrophobicContact CB-CG2 4.37Å; D166-V168 PolarHBondContact O-N 2.95Å; D166-V168 VanDerWaalsContact O-N 3.13Å; D166-V168 PolarHBondContact OD1-N 2.91Å
169	S	87.6	Confident	88.4	Confident	55 Å²	55	44.3 Å²	44.3	39%	0.385	22%	0.221	S	C	.	.			trans	-94	143.8	-179.4	64.6	0	0	0	0	111.5	Y163 E164 D166	Y163-S169 WeakPolarHBondContact CA-O 3.38Å; E164-S169 WeakPolarHBondContact CB-OG 2.98Å; E164-S169 WeakPolarHBondContact CG-OG 3.37Å; E164-S169 PolarHBondContact N-O 2.88Å; D166-S169 PolarHBondContact OD1-N 3.06Å
170	Y	89.6	Confident	87.5	Confident	88 Å²	88	50.6 Å²	50.6	35%	0.345	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	154.1	179.9	70.4	-90.4	0	0	0	112.7	A98 F161 R162 Y163	A98-Y170 HydrophobicContact CB-CD1 3.51Å; A98-Y170 HydrophobicContact CB-CD2 3.71Å; A98-Y170 HydrophobicContact CB-CE1 3.58Å; A98-Y170 HydrophobicContact CB-CE2 3.79Å; A98-Y170 HydrophobicContact CB-CG 3.57Å; F161-Y170 HydrophobicContact CD1-CD2 4.05Å; F161-Y170 HydrophobicContact CD1-CE2 4.15Å; R162-Y170 CarbonylContact O-C 3.56Å; R162-Y170 VanDerWaalsContact O-CA 3.23Å; R162-Y170 WeakPolarHBondContact O-CA 3.45Å; Y163-Y170 HydrophobicContact CE1-CD1 4.47Å; Y163-Y170 HydrophobicContact CE1-CG 4.47Å
171	Q	88.6	Confident	86.7	Confident	109 Å²	109	50.9 Å²	50.9	51%	0.509	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	142.5	171.5	-66.8	178.3	-12.3	0	0	109.6	F161 R162	F161-Q171 CarbonylContact C-O 3.56Å; F161-Q171 WeakPolarHBondContact CA-O 3.48Å; R162-Q171 PolarHBondContact N-O 2.88Å; R162-Q171 PolarHBondContact O-N 2.83Å
172	H	87.8	Confident	86	Confident	83 Å²	83	56.7 Å²	56.7	38%	0.384	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	148.1	175.8	66.4	-88.6	0	0	0	110.8	C160 F161	C160-H172 CarbonylContact O-C 3.25Å; C160-H172 WeakPolarHBondContact O-CA 3.27Å; F161-H172 HydrophobicContact CD1-CB 4.01Å; F161-H172 HydrophobicContact CE1-CB 4Å
173	F	85.9	Confident	85.4	Confident	36 Å²	36	60.1 Å²	60.1	16%	0.158	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	123.3	-176.4	177.4	-114.5	0	0	0	108.9	C160 P175 I204 V206 Y221	C160-F173 HydrophobicContact CB-CD1 4.45Å; C160-F173 PolarHBondContact N-O 3.12Å; C160-F173 PolarHBondContact O-N 2.69Å; F173-P175 HydrophobicContact CD1-CB 4.4Å; F173-P175 HydrophobicContact CD1-CG 4.14Å; F173-P175 HydrophobicContact CE1-CB 3.59Å; F173-P175 HydrophobicContact CE1-CG 3.69Å; F173-P175 HydrophobicContact CE2-CB 4.48Å; F173-P175 HydrophobicContact CZ-CB 3.64Å; F173-P175 HydrophobicContact CZ-CG 4.25Å; F173-I204 HydrophobicContact CE1-CG2 4.49Å; F173-V206 HydrophobicContact CE1-CG2 4.19Å; F173-Y221 HydrophobicContact CE2-CG 4.24Å; F173-Y221 HydrophobicContact CZ-CG 4.28Å
174	I	90.3	Very high	84.9	Confident	23 Å²	23	64.1 Å²	64.1	12%	0.118	31%	0.307	C	S	.	.			trans	-127	80.2	-176.2	-49.4	174.3	0	0	0	108	I102 C105 W140 N157 G158 A159 C176 R177	I102-I174 HydrophobicContact CD1-CD1 4.23Å; C105-I174 HydrophobicContact CB-CD1 3.95Å; W140-I174 HydrophobicContact CE3-CG2 4.39Å; W140-I174 HydrophobicContact CH2-CD1 3.8Å; W140-I174 HydrophobicContact CZ2-CD1 4.18Å; W140-I174 HydrophobicContact CZ3-CD1 4.11Å; W140-I174 HydrophobicContact CZ3-CG2 3.86Å; N157-I174 HydrophobicContact CB-CG2 4.28Å; G158-I174 WeakPolarHBondContact O-CG2 3.21Å; A159-I174 HydrophobicContact CB-CG1 4.12Å; I174-C176 PolarHBondContact O-N 2.82Å; I174-R177 HydrophobicContact CB-CB 4.33Å; I174-R177 HydrophobicContact CG2-CB 3.72Å; I174-R177 PolarHBondContact O-N 2.71Å
175	P	86.6	Confident	84.2	Confident	8 Å²	8	62 Å²	62	5%	0.052	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-24.9	-166.5	21.1	-30.7	0	0	0	114.5	F173 A193 V206 V219 K230	F173-P175 HydrophobicContact CD1-CB 4.4Å; F173-P175 HydrophobicContact CD1-CG 4.14Å; F173-P175 HydrophobicContact CE1-CB 3.59Å; F173-P175 HydrophobicContact CE1-CG 3.69Å; F173-P175 HydrophobicContact CE2-CB 4.48Å; F173-P175 HydrophobicContact CZ-CB 3.64Å; F173-P175 HydrophobicContact CZ-CG 4.25Å; P175-A193 HydrophobicContact CG-CB 3.48Å; P175-A193 VanDerWaalsContact CG-CB 3.48Å; P175-V206 HydrophobicContact CG-CG1 4.44Å; P175-V219 HydrophobicContact CB-CB 4.32Å; P175-V219 HydrophobicContact CB-CG1 3.81Å; P175-K230 PolarHBondContact O-NZ 3.21Å
176	C	87.1	Confident	83.8	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	9.6	-172.3	-80.4	0	0	0	0	113.9	N157 I174 Y188 C191	N157-C176 HydrophobicContact CB-CB 4.42Å; N157-C176 PolarHBondContact ND2-O 3.5Å; I174-C176 PolarHBondContact O-N 2.82Å; C176-Y188 HydrophobicContact CB-CD1 4.46Å; C176-Y188 HydrophobicContact CB-CG 4.46Å; C176-Y188 WeakPolarHBondContact O-CB 3.11Å; C176-Y188 VanDerWaalsContact SG-CD1 3.57Å; C176-C191 HydrophobicContact CB-CB 3.33Å; C176-C191 WeakPolarHBondContact CB-SG 3.45Å; C176-C191 WeakPolarHBondContact SG-CB 3.32Å; C176-C191 CovalentContact SG-SG 2.01Å; C176-C191 PolarHBondContact SG-SG 3.49Å
177	R	86.4	Confident	83.6	Confident	74 Å²	74	64.2 Å²	64.2	28%	0.279	31%	0.305	S	S	.	.			trans	-86.8	118.5	-179.2	-171.2	-170.7	70.5	76.9	2.8	111.4	C105 I174 N179	C105-R177 WeakPolarHBondContact O-CD 3.34Å; C105-R177 PolarHBondContact O-NE 3.28Å; C105-R177 VanDerWaalsContact O-NE 3.12Å; I174-R177 HydrophobicContact CB-CB 4.33Å; I174-R177 HydrophobicContact CG2-CB 3.72Å; I174-R177 PolarHBondContact O-N 2.71Å; R177-N179 PolarHBondContact NH1-OD1 3.13Å
178	H	81.5	Confident	83.3	Confident	60 Å²	60	64.9 Å²	64.9	28%	0.278	31%	0.307	S	S	.	.			trans	-121.8	148.3	171.5	-70	-70.8	0	0	0	112.1	Q181 Y188 K230	H178-Q181 HydrophobicContact CB-CB 4.16Å; H178-Y188 AromaticContact CD2-CD2 3.54Å; H178-Y188 AromaticContact NE2-CD2 3.36Å; H178-Y188 WeakPolarHBondContact NE2-CD2 3.32Å; H178-Y188 AromaticContact NE2-CE2 3.78Å; H178-K230 PolarHBondContact NE2-NZ 3.24Å
179	N	75.4	Confident	83.2	Confident	99 Å²	99	60 Å²	60	53%	0.529	28%	0.277	S	S	.	.	S	Bend	trans	-77.4	-19.8	-175.8	-64.9	-20.8	0	0	0	114	T108 Y145 R177	T108-N179 PolarHBondContact OG1-OD1 2.85Å; Y145-N179 PolarHBondContact OH-O 3.01Å; R177-N179 PolarHBondContact NH1-OD1 3.13Å
180	H	74.8	Confident	83.3	Confident	131 Å²	131	57.4 Å²	57.4	61%	0.606	26%	0.259	S	S	*	.	S	Bend	trans	-98.2	-5.5	-176.7	56.8	-89.9	0	0	0	113.3
181	Q	77	Confident	83.3	Confident	7 Å²	7	53.2 Å²	53.2	3%	0.033	24%	0.243	C	C	.	.			trans	-87.5	120.5	-171.1	-179.7	158	48.4	0	0	112.1	Y145 H178 E186 G189	Y145-Q181 WeakPolarHBondContact CE2-O 3.22Å; H178-Q181 HydrophobicContact CB-CB 4.16Å; Q181-E186 PolarHBondContact NE2-O 3.42Å; Q181-G189 VanDerWaalsContact CD-CA 3.49Å; Q181-G189 VanDerWaalsContact CD-N 3.28Å
182	R	78.4	Confident	83.5	Confident	123 Å²	123	50.4 Å²	50.4	46%	0.464	23%	0.23	S	C	.	.			trans	-125.3	-20.7	-172.9	-57.1	-173	-173.7	-166.5	2.8	114.4	Y145 D149	Y145-R182 HydrophobicContact CD1-CG 4.05Å; Y145-R182 HydrophobicContact CD2-CG 4.37Å; Y145-R182 HydrophobicContact CE1-CG 3.81Å; Y145-R182 HydrophobicContact CE2-CG 4.15Å; Y145-R182 HydrophobicContact CG-CG 4.32Å; D149-R182 IonicContact OD2-NH1 3.37Å
183	K	80.8	Confident	83.8	Confident	111 Å²	111	46.5 Å²	46.5	48%	0.483	21%	0.211	S	C	.	.	S	Bend	trans	-100.3	146.5	-177.6	-61.6	-174.3	-167.5	157.5	0	111.6	L155 E186	L155-K183 WeakPolarHBondContact CD2-O 3.24Å; K183-E186 HydrophobicContact CB-CB 4.07Å; K183-E186 WeakPolarHBondContact CB-OE2 3.3Å; K183-E186 WeakPolarHBondContact CD-OE2 3.16Å
184	F	81.7	Confident	84.3	Confident	86 Å²	86	44.8 Å²	44.8	38%	0.377	20%	0.204	S	C	.	.	S	Bend	trans	-70.3	143.4	167.5	-174.4	-98.8	0	0	0	109.8	P156 E186 W214	P156-F184 HydrophobicContact CG-CD2 4.46Å; P156-F184 HydrophobicContact CG-CE2 3.77Å; F184-E186 PolarHBondContact O-N 3.3Å; F184-E186 VanDerWaalsContact O-N 3.11Å; F184-W214 HydrophobicContact CD1-CH2 4.09Å; F184-W214 AromaticContact CE1-CH2 3.38Å; F184-W214 HydrophobicContact CE1-CH2 3.38Å; F184-W214 AromaticContact CE1-CZ2 3.48Å; F184-W214 HydrophobicContact CE1-CZ2 3.48Å; F184-W214 VanDerWaalsContact CE1-CZ2 3.48Å; F184-W214 HydrophobicContact CZ-CH2 4.17Å; F184-W214 AromaticContact CZ-CZ2 3.78Å; F184-W214 HydrophobicContact CZ-CZ2 3.78Å
185	G	76.1	Confident	84.5	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.01	21%	0.208	C	C	.	.	S	Bend	trans	84.3	-49	-179.2	0	0	0	0	0	114.4	D187 S190 S212 Y213	G185-D187 PolarHBondContact O-N 3Å; G185-S190 WeakPolarHBondContact CA-OG 3.28Å; G185-S190 PolarHBondContact N-OG 2.73Å; G185-S212 CarbonylContact O-C 3.59Å; G185-Y213 PolarHBondContact O-N 2.89Å
186	E	80.6	Confident	85	Confident	67 Å²	67	45.9 Å²	45.9	31%	0.313	21%	0.211	S	C	.	.	S	Bend	trans	-59.9	131	-178.4	-171.2	172.4	-137.2	0	0	111.6	Q181 K183 F184 Y188 G189 Y213	Q181-E186 PolarHBondContact NE2-O 3.42Å; K183-E186 HydrophobicContact CB-CB 4.07Å; K183-E186 WeakPolarHBondContact CB-OE2 3.3Å; K183-E186 WeakPolarHBondContact CD-OE2 3.16Å; F184-E186 PolarHBondContact O-N 3.3Å; F184-E186 VanDerWaalsContact O-N 3.11Å; E186-Y188 PolarHBondContact O-N 3.47Å; E186-G189 PolarHBondContact O-N 3.07Å; E186-Y213 HydrophobicContact CB-CE2 4.31Å
187	D	82.2	Confident	85.4	Confident	77 Å²	77	46.6 Å²	46.6	41%	0.412	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	40.5	-127.7	-174.6	-53.7	-32.9	0	0	0	112.2	G185 G189 S211 S212	G185-D187 PolarHBondContact O-N 3Å; D187-G189 VanDerWaalsContact C-N 3.29Å; D187-G189 PolarHBondContact O-N 2.96Å; D187-S211 CarbonylContact O-C 3.56Å; D187-S211 WeakPolarHBondContact O-CA 3.39Å; D187-S212 PolarHBondContact O-N 3.48Å
188	Y	84.6	Confident	85.9	Confident	22 Å²	22	46.7 Å²	46.7	9%	0.086	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-79.2	17.3	178.5	-55.5	-75.8	0	0	0	117.4	C176 H178 E186 S190 C191 K230 N232	C176-Y188 HydrophobicContact CB-CD1 4.46Å; C176-Y188 HydrophobicContact CB-CG 4.46Å; C176-Y188 WeakPolarHBondContact O-CB 3.11Å; C176-Y188 VanDerWaalsContact SG-CD1 3.57Å; H178-Y188 AromaticContact CD2-CD2 3.54Å; H178-Y188 AromaticContact NE2-CD2 3.36Å; H178-Y188 WeakPolarHBondContact NE2-CD2 3.32Å; H178-Y188 AromaticContact NE2-CE2 3.78Å; E186-Y188 PolarHBondContact O-N 3.47Å; Y188-S190 VanDerWaalsContact C-N 3.32Å; Y188-S190 PolarHBondContact O-N 2.7Å; Y188-C191 HydrophobicContact CD1-CB 4.46Å; Y188-C191 WeakPolarHBondContact O-CB 3.33Å; Y188-C191 PolarHBondContact O-N 3.34Å; Y188-K230 HydrophobicContact CE1-CD 4.11Å; Y188-K230 HydrophobicContact CE2-CD 4.16Å; Y188-K230 WeakPolarHBondContact OH-CD 3.43Å; Y188-N232 PolarHBondContact OH-OD1 2.9Å
189	G	84.9	Confident	86.4	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-73.6	-26.9	-166.9	0	0	0	0	0	113.1	L155 P156 Q181 E186 D187	L155-G189 WeakPolarHBondContact CA-O 3.49Å; L155-G189 WeakPolarHBondContact CB-O 3.4Å; P156-G189 WeakPolarHBondContact CD-O 3.12Å; Q181-G189 VanDerWaalsContact CD-CA 3.49Å; Q181-G189 VanDerWaalsContact CD-N 3.28Å; E186-G189 PolarHBondContact O-N 3.07Å; D187-G189 VanDerWaalsContact C-N 3.29Å; D187-G189 PolarHBondContact O-N 2.96Å
190	S	89.1	Confident	87.2	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.007	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-118.8	24.4	172.9	48.6	0	0	0	0	112.8	P156 G185 Y188 Q192 G210	P156-S190 CarbonylContact O-C 3.35Å; G185-S190 WeakPolarHBondContact CA-OG 3.28Å; G185-S190 PolarHBondContact N-OG 2.73Å; Y188-S190 VanDerWaalsContact C-N 3.32Å; Y188-S190 PolarHBondContact O-N 2.7Å; S190-Q192 VanDerWaalsContact C-N 3.27Å; S190-Q192 WeakPolarHBondContact O-CG 3.39Å; S190-Q192 PolarHBondContact O-N 3.23Å; S190-G210 CarbonylContact C-O 3.51Å; S190-G210 VanDerWaalsContact C-O 3.25Å; S190-G210 CarbonylContact O-C 3.59Å; S190-G210 VanDerWaalsContact O-C 3.3Å; S190-G210 WeakPolarHBondContact O-CA 3.36Å; S190-G210 VanDerWaalsContact O-O 3.14Å; S190-G210 PolarHBondContact OG-O 2.82Å
191	C	89.1	Confident	87.9	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.187	C	C	.	.			trans	-49.9	-37.3	-168.5	158.8	0	0	0	0	115.9	C176 Y188 A193 A208 G210	C176-C191 HydrophobicContact CB-CB 3.33Å; C176-C191 WeakPolarHBondContact CB-SG 3.45Å; C176-C191 WeakPolarHBondContact SG-CB 3.32Å; C176-C191 CovalentContact SG-SG 2.01Å; C176-C191 PolarHBondContact SG-SG 3.49Å; Y188-C191 HydrophobicContact CD1-CB 4.46Å; Y188-C191 WeakPolarHBondContact O-CB 3.33Å; Y188-C191 PolarHBondContact O-N 3.34Å; C191-A193 VanDerWaalsContact C-N 3.28Å; C191-A193 PolarHBondContact O-N 2.85Å; C191-A193 VanDerWaalsContact SG-CB 3.54Å; C191-A193 PolarHBondContact SG-N 3.32Å; C191-A193 VanDerWaalsContact SG-N 3.44Å; C191-A208 CarbonylContact O-C 3.48Å; C191-A208 WeakPolarHBondContact O-CA 3.17Å; C191-A208 WeakPolarHBondContact SG-CB 3.41Å; C191-G210 PolarHBondContact O-N 3.35Å; C191-G210 VanDerWaalsContact O-N 3.1Å
192	Q	93.6	Very high	88.4	Confident	50 Å²	50	44.9 Å²	44.9	23%	0.234	21%	0.207	C	C	.	.			trans	51.8	44.8	-174.5	-62.4	-174.6	-88.6	0	0	113.3	H138 P156 S190 G194	H138-Q192 VanDerWaalsContact O-CA 3.26Å; H138-Q192 WeakPolarHBondContact O-CA 3.25Å; H138-Q192 WeakPolarHBondContact O-CB 3.36Å; P156-Q192 HydrophobicContact CB-CG 4.27Å; P156-Q192 HydrophobicContact CG-CG 4.41Å; P156-Q192 PolarHBondContact O-N 2.98Å; S190-Q192 VanDerWaalsContact C-N 3.27Å; S190-Q192 WeakPolarHBondContact O-CG 3.39Å; S190-Q192 PolarHBondContact O-N 3.23Å; Q192-G194 PolarHBondContact O-N 3.17Å
193	A	94.8	Very high	89.1	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	131.6	-179.2	0	0	0	0	0	111.8	H138 N157 P175 C191 V206 G207	H138-A193 WeakPolarHBondContact CA-O 3.39Å; N157-A193 WeakPolarHBondContact O-CB 3.12Å; N157-A193 PolarHBondContact O-N 3.27Å; N157-A193 VanDerWaalsContact O-N 3.08Å; P175-A193 HydrophobicContact CG-CB 3.48Å; P175-A193 VanDerWaalsContact CG-CB 3.48Å; C191-A193 VanDerWaalsContact C-N 3.28Å; C191-A193 PolarHBondContact O-N 2.85Å; C191-A193 VanDerWaalsContact SG-CB 3.54Å; C191-A193 PolarHBondContact SG-N 3.32Å; C191-A193 VanDerWaalsContact SG-N 3.44Å; A193-V206 HydrophobicContact CB-CG1 3.94Å; A193-G207 WeakPolarHBondContact CA-O 3.41Å
194	G	94.5	Very high	89.8	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.4	19.3	175.5	0	0	0	0	0	113.9	V120 S121 C136 Q192 G207	V120-G194 WeakPolarHBondContact CG1-O 3.35Å; S121-G194 PolarHBondContact OG-O 3.45Å; C136-G194 WeakPolarHBondContact CB-O 3.34Å; Q192-G194 PolarHBondContact O-N 3.17Å; G194-G207 PolarHBondContact N-O 2.77Å
195	I	95	Very high	90.4	Very high	39 Å²	39	30.3 Å²	30.3	20%	0.2	15%	0.147	C	C	.	.	S	Bend	trans	-58.5	-40.9	164.3	-166.6	169	0	0	0	110.3	S121 H138 P209 G249 Y250	S121-I195 WeakPolarHBondContact CB-O 3.19Å; H138-I195 HydrophobicContact CB-CB 4.28Å; I195-P209 HydrophobicContact CB-CG 4.47Å; I195-P209 HydrophobicContact CD1-CG 4.19Å; I195-P209 VanDerWaalsContact CG2-CD 3.5Å; I195-P209 HydrophobicContact CG2-CG 3.76Å; I195-G249 WeakPolarHBondContact CG2-O 3.36Å; I195-Y250 HydrophobicContact CD1-CD2 4.21Å; I195-Y250 HydrophobicContact CD1-CE2 4.05Å
196	S	96.6	Very high	91.4	Very high	16 Å²	16	30.2 Å²	30.2	11%	0.112	15%	0.147	C	C	.	.	S	Bend	trans	-131.2	151.1	170.7	56.1	0	0	0	0	108.9	G207 G249 Y250	S196-G207 PolarHBondContact O-N 3.47Å; S196-G249 PolarHBondContact OG-O 3.06Å; S196-G249 VanDerWaalsContact OG-O 3.11Å; S196-Y250 WeakPolarHBondContact CB-O 3.43Å; S196-Y250 PolarHBondContact OG-O 3.22Å
197	N	96.5	Very high	92.1	Very high	14 Å²	14	27 Å²	27	8%	0.075	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	155	177.9	72.9	59	0	0	0	110.7	S121 S123 L134 C136 I205	S121-N197 VanDerWaalsContact CB-ND2 3.34Å; S121-N197 WeakPolarHBondContact CB-ND2 3.01Å; S121-N197 PolarHBondContact O-ND2 3.24Å; S121-N197 PolarHBondContact OG-ND2 2.79Å; S123-N197 WeakPolarHBondContact CB-OD1 3.39Å; S123-N197 PolarHBondContact N-OD1 2.77Å; S123-N197 PolarHBondContact OG-OD1 3.09Å; L134-N197 HydrophobicContact CD2-CB 3.88Å; C136-N197 PolarHBondContact SG-ND2 3.11Å; C136-N197 VanDerWaalsContact SG-ND2 3.43Å; N197-I205 CarbonylContact C-O 3.56Å; N197-I205 VanDerWaalsContact CA-O 3.25Å; N197-I205 WeakPolarHBondContact CA-O 3.37Å
198	F	95.9	Very high	92.6	Very high	77 Å²	77	23.4 Å²	23.4	34%	0.338	11%	0.112	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	144.3	176.3	-164.1	-95	0	0	0	109.6	T200 I205 V252 A254	F198-T200 HydrophobicContact CD1-CG2 4.11Å; F198-T200 HydrophobicContact CE1-CG2 4.06Å; F198-I205 HydrophobicContact CB-CB 4.28Å; F198-I205 HydrophobicContact CD1-CD1 4.28Å; F198-I205 PolarHBondContact N-O 2.89Å; F198-I205 PolarHBondContact O-N 3.17Å; F198-V252 HydrophobicContact CB-CG2 4.17Å; F198-A254 HydrophobicContact CD1-CB 3.95Å; F198-A254 HydrophobicContact CE1-CB 3.92Å
199	L	94	Very high	93	Very high	10 Å²	10	22.8 Å²	22.8	5%	0.052	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	125.9	179.3	-77.2	178.3	0	0	0	110.1	S123 Q125 P126 R132 L134 I204	S123-L199 WeakPolarHBondContact OG-CG 3.48Å; Q125-L199 HydrophobicContact CB-CB 4.39Å; Q125-L199 HydrophobicContact CB-CD1 4.26Å; P126-L199 WeakPolarHBondContact CD-O 3.35Å; R132-L199 WeakPolarHBondContact O-CD1 3.19Å; L134-L199 HydrophobicContact CB-CD1 3.75Å; L134-L199 HydrophobicContact CB-CD2 4.35Å; L134-L199 HydrophobicContact CB-CG 4.07Å; L134-L199 HydrophobicContact CD2-CD2 4.32Å; L199-I204 HydrophobicContact CD2-CB 4.15Å; L199-I204 HydrophobicContact CD2-CD1 4.44Å; L199-I204 HydrophobicContact CD2-CG1 3.69Å; L199-I204 HydrophobicContact CD2-CG2 4.17Å
200	T	92.3	Very high	93.2	Very high	15 Å²	15	22.8 Å²	22.8	9%	0.092	11%	0.111	C	C	.	.			trans	-102.8	-175.3	164.6	77.8	0	0	0	0	109.6	F198 E202 L203 I205 A254 I263	F198-T200 HydrophobicContact CD1-CG2 4.11Å; F198-T200 HydrophobicContact CE1-CG2 4.06Å; T200-E202 PolarHBondContact O-N 2.81Å; T200-E202 PolarHBondContact OG1-N 3.39Å; T200-L203 HydrophobicContact CG2-CB 4.4Å; T200-L203 PolarHBondContact N-O 3.25Å; T200-L203 VanDerWaalsContact OG1-CB 3.27Å; T200-L203 WeakPolarHBondContact OG1-CB 3.06Å; T200-L203 PolarHBondContact OG1-N 3.33Å; T200-I205 HydrophobicContact CG2-CD1 4.27Å; T200-A254 HydrophobicContact CG2-CB 3.79Å; T200-I263 HydrophobicContact CG2-CG2 4.3Å
201	Q	88.4	Confident	93.2	Very high	136 Å²	136	22.8 Å²	22.8	64%	0.636	11%	0.111	S	C	*	.	S	Bend	trans	-58.8	-34.3	175.8	-68.5	-177.3	-8.5	0	0	112.6	Q125 P126	Q125-Q201 PolarHBondContact NE2-O 3.39Å; P126-Q201 HydrophobicContact CG-CG 4.19Å
202	E	88.1	Confident	93	Very high	97 Å²	97	24.6 Å²	24.6	45%	0.453	12%	0.124	S	C	.	.	S	Bend	trans	-121.8	-20.7	-175	-56.9	-165.7	158.5	0	0	114.3	T200 T223	T200-E202 PolarHBondContact O-N 2.81Å; T200-E202 PolarHBondContact OG1-N 3.39Å; E202-T223 WeakPolarHBondContact O-CB 3.33Å; E202-T223 PolarHBondContact O-N 2.91Å; E202-T223 PolarHBondContact O-OG1 2.95Å
203	L	92.7	Very high	92.6	Very high	8 Å²	8	28.4 Å²	28.4	4%	0.042	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	134.3	-171.1	-51.6	179.4	0	0	0	111.9	T200 I205 V220 Y221 N222 I263 V265 T283	T200-L203 HydrophobicContact CG2-CB 4.4Å; T200-L203 PolarHBondContact N-O 3.25Å; T200-L203 VanDerWaalsContact OG1-CB 3.27Å; T200-L203 WeakPolarHBondContact OG1-CB 3.06Å; T200-L203 PolarHBondContact OG1-N 3.33Å; L203-I205 HydrophobicContact CB-CG1 4.22Å; L203-V220 HydrophobicContact CB-CG1 4.18Å; L203-V220 HydrophobicContact CD1-CG1 4.23Å; L203-V220 HydrophobicContact CD2-CG1 4.15Å; L203-V220 HydrophobicContact CG-CG1 4.42Å; L203-Y221 WeakPolarHBondContact CA-O 3.35Å; L203-N222 HydrophobicContact CD2-CB 3.71Å; L203-I263 HydrophobicContact CD1-CG2 4.21Å; L203-V265 HydrophobicContact CD1-CG2 4.49Å; L203-T283 HydrophobicContact CD1-CG2 4.48Å
204	I	94.6	Very high	92.1	Very high	6 Å²	6	32.8 Å²	32.8	3%	0.031	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	113.5	164.9	-55.5	-173.8	0	0	0	107.9	L134 F173 L199 V206 V220 Y221 T223	L134-I204 HydrophobicContact CD2-CG2 3.72Å; F173-I204 HydrophobicContact CE1-CG2 4.49Å; L199-I204 HydrophobicContact CD2-CB 4.15Å; L199-I204 HydrophobicContact CD2-CD1 4.44Å; L199-I204 HydrophobicContact CD2-CG1 3.69Å; L199-I204 HydrophobicContact CD2-CG2 4.17Å; I204-V206 HydrophobicContact CG2-CG2 4Å; I204-V220 CarbonylContact O-C 3.59Å; I204-V220 WeakPolarHBondContact O-CA 3.17Å; I204-Y221 HydrophobicContact CB-CD1 4.33Å; I204-Y221 HydrophobicContact CD1-CD1 3.9Å; I204-Y221 HydrophobicContact CD1-CE1 4.42Å; I204-Y221 HydrophobicContact CG1-CD1 4.18Å; I204-Y221 PolarHBondContact N-O 2.91Å; I204-Y221 PolarHBondContact O-N 3.02Å; I204-T223 HydrophobicContact CD1-CG2 3.94Å; I204-T223 HydrophobicContact CG1-CG2 3.89Å
205	I	95.6	Very high	91.6	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	126.7	-176.6	-55.9	164.7	0	0	0	108.1	N197 F198 T200 L203 V218 V220 V252 A254 V265	N197-I205 CarbonylContact C-O 3.56Å; N197-I205 VanDerWaalsContact CA-O 3.25Å; N197-I205 WeakPolarHBondContact CA-O 3.37Å; F198-I205 HydrophobicContact CB-CB 4.28Å; F198-I205 HydrophobicContact CD1-CD1 4.28Å; F198-I205 PolarHBondContact N-O 2.89Å; F198-I205 PolarHBondContact O-N 3.17Å; T200-I205 HydrophobicContact CG2-CD1 4.27Å; L203-I205 HydrophobicContact CB-CG1 4.22Å; I205-V218 HydrophobicContact CG2-CG1 3.79Å; I205-V220 HydrophobicContact CG1-CG1 4.25Å; I205-V220 HydrophobicContact CG1-CG2 4.25Å; I205-V220 HydrophobicContact CG2-CG2 4.35Å; I205-V252 HydrophobicContact CG2-CB 3.91Å; I205-V252 HydrophobicContact CG2-CG1 4.24Å; I205-V252 HydrophobicContact CG2-CG2 4.11Å; I205-A254 HydrophobicContact CD1-CB 3.6Å; I205-V265 HydrophobicContact CD1-CB 4.46Å; I205-V265 HydrophobicContact CD1-CG1 4.09Å; I205-V265 HydrophobicContact CD1-CG2 3.72Å; I205-V265 HydrophobicContact CG1-CG1 4.41Å; I205-V265 HydrophobicContact CG1-CG2 4.21Å; I205-V265 HydrophobicContact CG2-CG1 3.7Å
206	V	96	Very high	91.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	125.8	-175.5	-177.4	0	0	0	0	110	L134 F173 P175 A193 I204 V219	L134-V206 HydrophobicContact CD2-CG2 4.42Å; F173-V206 HydrophobicContact CE1-CG2 4.19Å; P175-V206 HydrophobicContact CG-CG1 4.44Å; A193-V206 HydrophobicContact CB-CG1 3.94Å; I204-V206 HydrophobicContact CG2-CG2 4Å; V206-V219 PolarHBondContact N-O 3.43Å; V206-V219 PolarHBondContact O-N 2.83Å
207	G	95.2	Very high	90.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	138	173.6	0	0	0	0	0	112.5	A193 G194 S196 G249	A193-G207 WeakPolarHBondContact CA-O 3.41Å; G194-G207 PolarHBondContact N-O 2.77Å; S196-G207 PolarHBondContact O-N 3.47Å; G207-G249 CarbonylContact C-O 3.54Å; G207-G249 WeakPolarHBondContact CA-O 3.45Å
208	A	93.9	Very high	90.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.146	C	C	.	.			trans	-138.3	61.4	-172.6	0	0	0	0	0	112.3	C191 G210 S211 G216 S217 V219	C191-A208 CarbonylContact O-C 3.48Å; C191-A208 WeakPolarHBondContact O-CA 3.17Å; C191-A208 WeakPolarHBondContact SG-CB 3.41Å; A208-G210 VanDerWaalsContact C-N 3.26Å; A208-G210 PolarHBondContact O-N 2.77Å; A208-S211 WeakPolarHBondContact O-CB 3.3Å; A208-S211 PolarHBondContact O-N 3.35Å; A208-S211 PolarHBondContact O-OG 3.11Å; A208-G216 WeakPolarHBondContact O-CA 3.35Å; A208-S217 WeakPolarHBondContact CA-O 3.36Å; A208-S217 WeakPolarHBondContact CB-O 3.2Å; A208-S217 PolarHBondContact N-O 3.18Å; A208-S217 PolarHBondContact O-N 2.98Å; A208-S217 VanDerWaalsContact O-N 3.16Å; A208-V219 HydrophobicContact CB-CG2 4.32Å
209	P	92.6	Very high	90.5	Very high	9 Å²	9	27.5 Å²	27.5	6%	0.058	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-20.2	-168.1	31.3	-40.8	0	0	0	114.8	I195 S211 W214 G216 A247 E248	I195-P209 HydrophobicContact CB-CG 4.47Å; I195-P209 HydrophobicContact CD1-CG 4.19Å; I195-P209 VanDerWaalsContact CG2-CD 3.5Å; I195-P209 HydrophobicContact CG2-CG 3.76Å; P209-S211 VanDerWaalsContact C-N 3.3Å; P209-S211 PolarHBondContact O-N 2.82Å; P209-W214 WeakPolarHBondContact O-CA 3.48Å; P209-G216 WeakPolarHBondContact O-CA 3.26Å; P209-G216 PolarHBondContact O-N 2.64Å; P209-A247 HydrophobicContact CB-CB 4.19Å; P209-E248 VanDerWaalsContact CA-O 3.24Å; P209-E248 WeakPolarHBondContact CA-O 3.39Å
210	G	88.9	Confident	90.5	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	8.5	-179.3	0	0	0	0	0	114.2	S190 C191 A208	S190-G210 CarbonylContact C-O 3.51Å; S190-G210 VanDerWaalsContact C-O 3.25Å; S190-G210 CarbonylContact O-C 3.59Å; S190-G210 VanDerWaalsContact O-C 3.3Å; S190-G210 WeakPolarHBondContact O-CA 3.36Å; S190-G210 VanDerWaalsContact O-O 3.14Å; S190-G210 PolarHBondContact OG-O 2.82Å; C191-G210 PolarHBondContact O-N 3.35Å; C191-G210 VanDerWaalsContact O-N 3.1Å; A208-G210 VanDerWaalsContact C-N 3.26Å; A208-G210 PolarHBondContact O-N 2.77Å
211	S	88.7	Confident	90.5	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.007	13%	0.132	C	C	.	.	H	α-helix	trans	-71.3	148.2	177.1	-52.7	0	0	0	0	111.3	D187 A208 P209 Y213 W214 T215 G216	D187-S211 CarbonylContact O-C 3.56Å; D187-S211 WeakPolarHBondContact O-CA 3.39Å; A208-S211 WeakPolarHBondContact O-CB 3.3Å; A208-S211 PolarHBondContact O-N 3.35Å; A208-S211 PolarHBondContact O-OG 3.11Å; P209-S211 VanDerWaalsContact C-N 3.3Å; P209-S211 PolarHBondContact O-N 2.82Å; S211-Y213 PolarHBondContact O-N 2.64Å; S211-W214 CarbonylContact O-C 3.53Å; S211-W214 WeakPolarHBondContact O-CA 3.48Å; S211-W214 PolarHBondContact O-N 2.69Å; S211-T215 PolarHBondContact O-N 3.17Å; S211-T215 PolarHBondContact O-OG1 3.16Å; S211-G216 PolarHBondContact O-N 2.81Å
212	S	85.6	Confident	90.6	Very high	38 Å²	38	23.3 Å²	23.3	27%	0.266	11%	0.108	S	C	.	.	H	α-helix	trans	49.3	57.2	173.2	-64.6	0	0	0	0	113.5	G185 D187 T215	G185-S212 CarbonylContact O-C 3.59Å; D187-S212 PolarHBondContact O-N 3.48Å; S212-T215 WeakPolarHBondContact CB-OG1 3.36Å; S212-T215 VanDerWaalsContact O-CG2 3.31Å; S212-T215 WeakPolarHBondContact O-CG2 3.44Å; S212-T215 PolarHBondContact O-N 3.02Å; S212-T215 PolarHBondContact O-OG1 3.47Å; S212-T215 VanDerWaalsContact O-OG1 3.11Å
213	Y	84.2	Confident	90.6	Very high	130 Å²	130	20.7 Å²	20.7	51%	0.51	10%	0.099	S	C	.	.	H	α-helix	trans	57.2	47.8	-174.4	-58.8	-82.5	0	0	0	112.4	G185 E186 S211 T215	G185-Y213 PolarHBondContact O-N 2.89Å; E186-Y213 HydrophobicContact CB-CE2 4.31Å; S211-Y213 PolarHBondContact O-N 2.64Å; Y213-T215 PolarHBondContact O-N 3.42Å
214	W	85.6	Confident	90.3	Very high	93 Å²	93	24.1 Å²	24.1	35%	0.352	12%	0.124	S	C	.	.	H	α-helix	trans	58.2	30.9	-179.5	-54.2	-98.2	0	0	0	113.7	F184 P209 S211 T245 Y246	F184-W214 HydrophobicContact CD1-CH2 4.09Å; F184-W214 AromaticContact CE1-CH2 3.38Å; F184-W214 HydrophobicContact CE1-CH2 3.38Å; F184-W214 AromaticContact CE1-CZ2 3.48Å; F184-W214 HydrophobicContact CE1-CZ2 3.48Å; F184-W214 VanDerWaalsContact CE1-CZ2 3.48Å; F184-W214 HydrophobicContact CZ-CH2 4.17Å; F184-W214 AromaticContact CZ-CZ2 3.78Å; F184-W214 HydrophobicContact CZ-CZ2 3.78Å; P209-W214 WeakPolarHBondContact O-CA 3.48Å; S211-W214 CarbonylContact O-C 3.53Å; S211-W214 WeakPolarHBondContact O-CA 3.48Å; S211-W214 PolarHBondContact O-N 2.69Å; W214-T245 HydrophobicContact CB-CG2 3.4Å; W214-T245 VanDerWaalsContact CB-CG2 3.4Å; W214-T245 HydrophobicContact CG-CG2 4.2Å; W214-T245 CarbonylContact O-C 3.52Å; W214-T245 VanDerWaalsContact O-C 3.25Å; W214-T245 WeakPolarHBondContact O-CA 3.47Å; W214-Y246 CarbonylContact C-O 3.55Å; W214-Y246 CarbonylContact O-C 3.51Å; W214-Y246 PolarHBondContact O-N 2.89Å
215	T	83.5	Confident	89.8	Confident	26 Å²	26	27.1 Å²	27.1	16%	0.16	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-8.8	159.9	64.1	0	0	0	0	112.8	S211 S212 Y213 Y246	S211-T215 PolarHBondContact O-N 3.17Å; S211-T215 PolarHBondContact O-OG1 3.16Å; S212-T215 WeakPolarHBondContact CB-OG1 3.36Å; S212-T215 VanDerWaalsContact O-CG2 3.31Å; S212-T215 WeakPolarHBondContact O-CG2 3.44Å; S212-T215 PolarHBondContact O-N 3.02Å; S212-T215 PolarHBondContact O-OG1 3.47Å; S212-T215 VanDerWaalsContact O-OG1 3.11Å; Y213-T215 PolarHBondContact O-N 3.42Å; T215-Y246 CarbonylContact C-O 3.58Å; T215-Y246 WeakPolarHBondContact CA-O 3.44Å; T215-Y246 HydrophobicContact CG2-CD2 3.77Å; T215-Y246 HydrophobicContact CG2-CE2 4.47Å; T215-Y246 WeakPolarHBondContact O-CB 3.27Å
216	G	88.2	Confident	89.3	Confident	5 Å²	5	32.7 Å²	32.7	5%	0.052	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	71.1	170.3	171	0	0	0	0	0	113.6	A208 P209 S211 Y246 E248	A208-G216 WeakPolarHBondContact O-CA 3.35Å; P209-G216 WeakPolarHBondContact O-CA 3.26Å; P209-G216 PolarHBondContact O-N 2.64Å; S211-G216 PolarHBondContact O-N 2.81Å; G216-Y246 PolarHBondContact N-O 3.15Å; G216-Y246 VanDerWaalsContact N-O 3.08Å; G216-E248 WeakPolarHBondContact CA-O 3.43Å
217	S	88.9	Confident	88.9	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.014	19%	0.185	C	C	.	.			trans	-167.5	159.7	178.3	-168.7	0	0	0	0	109.6	A208 F231 E248	A208-S217 WeakPolarHBondContact CA-O 3.36Å; A208-S217 WeakPolarHBondContact CB-O 3.2Å; A208-S217 PolarHBondContact N-O 3.18Å; A208-S217 PolarHBondContact O-N 2.98Å; A208-S217 VanDerWaalsContact O-N 3.16Å; S217-F231 PolarHBondContact OG-O 3Å; S217-E248 PolarHBondContact N-O 2.78Å
218	V	92.2	Very high	88.4	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128.2	166.3	-178	0	0	0	0	107.9	I205 V220 F231 V252 V265 F281 L289	I205-V218 HydrophobicContact CG2-CG1 3.79Å; V218-V220 HydrophobicContact CG1-CG2 4.13Å; V218-F231 PolarHBondContact O-N 2.62Å; V218-V252 HydrophobicContact CG1-CG1 4.16Å; V218-V252 HydrophobicContact CG2-CG1 4.19Å; V218-V265 HydrophobicContact CG1-CG1 3.91Å; V218-F281 HydrophobicContact CG2-CE2 4.17Å; V218-L289 HydrophobicContact CB-CD1 4.12Å; V218-L289 HydrophobicContact CG1-CD1 4.37Å; V218-L289 WeakPolarHBondContact O-CD1 3.25Å
219	V	92.1	Very high	88.1	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.006	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	121.5	176.5	-175.2	0	0	0	0	109	P175 V206 A208 I228 K230	P175-V219 HydrophobicContact CB-CB 4.32Å; P175-V219 HydrophobicContact CB-CG1 3.81Å; V206-V219 PolarHBondContact N-O 3.43Å; V206-V219 PolarHBondContact O-N 2.83Å; A208-V219 HydrophobicContact CB-CG2 4.32Å; V219-I228 HydrophobicContact CG1-CG2 3.79Å; V219-K230 HydrophobicContact CG1-CG 4.33Å; V219-K230 HydrophobicContact CG2-CG 4.4Å
220	V	93.6	Very high	87.7	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	124.1	179.5	-177.6	0	0	0	0	108.3	L203 I204 I205 V218 I228 F229 V265 T283 L289	L203-V220 HydrophobicContact CB-CG1 4.18Å; L203-V220 HydrophobicContact CD1-CG1 4.23Å; L203-V220 HydrophobicContact CD2-CG1 4.15Å; L203-V220 HydrophobicContact CG-CG1 4.42Å; I204-V220 CarbonylContact O-C 3.59Å; I204-V220 WeakPolarHBondContact O-CA 3.17Å; I205-V220 HydrophobicContact CG1-CG1 4.25Å; I205-V220 HydrophobicContact CG1-CG2 4.25Å; I205-V220 HydrophobicContact CG2-CG2 4.35Å; V218-V220 HydrophobicContact CG1-CG2 4.13Å; V220-I228 CarbonylContact O-C 3.51Å; V220-I228 WeakPolarHBondContact O-CA 3.16Å; V220-F229 HydrophobicContact CB-CB 4.29Å; V220-F229 HydrophobicContact CB-CD2 4.47Å; V220-F229 HydrophobicContact CG1-CD2 4.42Å; V220-F229 PolarHBondContact N-O 3.38Å; V220-F229 PolarHBondContact O-N 3.4Å; V220-V265 HydrophobicContact CG2-CB 4.46Å; V220-V265 HydrophobicContact CG2-CG1 4.1Å; V220-V265 HydrophobicContact CG2-CG2 3.99Å; V220-T283 HydrophobicContact CG1-CG2 4.33Å; V220-L289 HydrophobicContact CG2-CD1 3.96Å; V220-L289 HydrophobicContact CG2-CD2 4.03Å
221	Y	91.9	Very high	87.2	Confident	48 Å²	48	40.1 Å²	40.1	19%	0.188	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	116.9	175.1	172.5	-107.3	0	0	0	109.7	F173 L203 I204 T223 N226 S227 I228	F173-Y221 HydrophobicContact CE2-CG 4.24Å; F173-Y221 HydrophobicContact CZ-CG 4.28Å; L203-Y221 WeakPolarHBondContact CA-O 3.35Å; I204-Y221 HydrophobicContact CB-CD1 4.33Å; I204-Y221 HydrophobicContact CD1-CD1 3.9Å; I204-Y221 HydrophobicContact CD1-CE1 4.42Å; I204-Y221 HydrophobicContact CG1-CD1 4.18Å; I204-Y221 PolarHBondContact N-O 2.91Å; I204-Y221 PolarHBondContact O-N 3.02Å; Y221-T223 HydrophobicContact CD1-CG2 3.95Å; Y221-T223 HydrophobicContact CE1-CG2 3.79Å; Y221-N226 WeakPolarHBondContact CE2-OD1 3.2Å; Y221-N226 PolarHBondContact OH-OD1 3.13Å; Y221-S227 WeakPolarHBondContact CA-O 3.45Å; Y221-S227 WeakPolarHBondContact CD2-O 3.37Å; Y221-I228 HydrophobicContact CD2-CD1 4.4Å; Y221-I228 HydrophobicContact CD2-CG1 3.61Å; Y221-I228 HydrophobicContact CE2-CG1 4.35Å
222	N	90.8	Very high	86.2	Confident	24 Å²	24	44.6 Å²	44.6	13%	0.128	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	116.7	174.9	-177.7	-39.4	0	0	0	109.1	L203 S224 S225 N226 S227 F229	L203-N222 HydrophobicContact CD2-CB 3.71Å; N222-S224 WeakPolarHBondContact OD1-CB 3.03Å; N222-S224 PolarHBondContact OD1-N 2.85Å; N222-S225 WeakPolarHBondContact CB-OG 3.4Å; N222-S225 PolarHBondContact ND2-OG 3.49Å; N222-S225 PolarHBondContact OD1-N 2.8Å; N222-S225 PolarHBondContact OD1-OG 2.8Å; N222-N226 VanDerWaalsContact O-CA 3.25Å; N222-N226 WeakPolarHBondContact O-CA 3.42Å; N222-N226 PolarHBondContact O-N 2.85Å; N222-S227 PolarHBondContact N-O 3.26Å; N222-S227 PolarHBondContact O-N 2.91Å; N222-F229 HydrophobicContact CB-CE2 4.05Å
223	T	87.2	Confident	85.1	Confident	42 Å²	42	44 Å²	44	26%	0.258	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-28.7	-176	57.1	0	0	0	0	113.2	E202 I204 Y221	E202-T223 WeakPolarHBondContact O-CB 3.33Å; E202-T223 PolarHBondContact O-N 2.91Å; E202-T223 PolarHBondContact O-OG1 2.95Å; I204-T223 HydrophobicContact CD1-CG2 3.94Å; I204-T223 HydrophobicContact CG1-CG2 3.89Å; Y221-T223 HydrophobicContact CD1-CG2 3.95Å; Y221-T223 HydrophobicContact CE1-CG2 3.79Å
224	S	86.6	Confident	83.7	Confident	81 Å²	81	41.5 Å²	41.5	57%	0.566	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-44.7	179.5	-57.6	0	0	0	0	111.8	N222	N222-S224 WeakPolarHBondContact OD1-CB 3.03Å; N222-S224 PolarHBondContact OD1-N 2.85Å
225	S	85.3	Confident	81.8	Confident	69 Å²	69	43 Å²	43	48%	0.483	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-6.6	-179.1	59.7	0	0	0	0	114.4	N222 S227	N222-S225 WeakPolarHBondContact CB-OG 3.4Å; N222-S225 PolarHBondContact ND2-OG 3.49Å; N222-S225 PolarHBondContact OD1-N 2.8Å; N222-S225 PolarHBondContact OD1-OG 2.8Å; S225-S227 PolarHBondContact O-N 2.97Å; S225-S227 PolarHBondContact OG-OG 3.06Å
226	N	85.2	Confident	79.8	Confident	117 Å²	117	45.7 Å²	45.7	63%	0.626	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	37.7	-174.3	-166.9	19.3	0	0	0	112.4	Y221 N222	Y221-N226 WeakPolarHBondContact CE2-OD1 3.2Å; Y221-N226 PolarHBondContact OH-OD1 3.13Å; N222-N226 VanDerWaalsContact O-CA 3.25Å; N222-N226 WeakPolarHBondContact O-CA 3.42Å; N222-N226 PolarHBondContact O-N 2.85Å
227	S	85.9	Confident	77.9	Confident	30 Å²	30	49.1 Å²	49.1	21%	0.21	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	147.7	-179.2	62.8	0	0	0	0	111.1	Y221 N222 S225 F229	Y221-S227 WeakPolarHBondContact CA-O 3.45Å; Y221-S227 WeakPolarHBondContact CD2-O 3.37Å; N222-S227 PolarHBondContact N-O 3.26Å; N222-S227 PolarHBondContact O-N 2.91Å; S225-S227 PolarHBondContact O-N 2.97Å; S225-S227 PolarHBondContact OG-OG 3.06Å; S227-F229 WeakPolarHBondContact OG-CE2 3.3Å; S227-F229 WeakPolarHBondContact OG-CZ 3.44Å
228	I	86.4	Confident	75.9	Confident	75 Å²	75	53.4 Å²	53.4	39%	0.385	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	122.9	177.1	-62	168.4	0	0	0	108	V219 V220 Y221 K230	V219-I228 HydrophobicContact CG1-CG2 3.79Å; V220-I228 CarbonylContact O-C 3.51Å; V220-I228 WeakPolarHBondContact O-CA 3.16Å; Y221-I228 HydrophobicContact CD2-CD1 4.4Å; Y221-I228 HydrophobicContact CD2-CG1 3.61Å; Y221-I228 HydrophobicContact CE2-CG1 4.35Å; I228-K230 HydrophobicContact CG2-CD 4.43Å; I228-K230 HydrophobicContact CG2-CG 3.99Å
229	F	85.7	Confident	73.5	Confident	15 Å²	15	63.6 Å²	63.6	7%	0.066	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	139.5	171.4	-49.2	-92.5	0	0	0	108.9	V220 N222 S227 N285 L289	V220-F229 HydrophobicContact CB-CB 4.29Å; V220-F229 HydrophobicContact CB-CD2 4.47Å; V220-F229 HydrophobicContact CG1-CD2 4.42Å; V220-F229 PolarHBondContact N-O 3.38Å; V220-F229 PolarHBondContact O-N 3.4Å; N222-F229 HydrophobicContact CB-CE2 4.05Å; S227-F229 WeakPolarHBondContact OG-CE2 3.3Å; S227-F229 WeakPolarHBondContact OG-CZ 3.44Å; F229-N285 WeakPolarHBondContact CD1-O 3.31Å; F229-N285 VanDerWaalsContact CE1-O 3.29Å; F229-N285 WeakPolarHBondContact CE1-O 3.06Å; F229-L289 HydrophobicContact CB-CD2 3.83Å; F229-L289 HydrophobicContact CB-CG 4.05Å
230	K	84.4	Confident	71	Confident	30 Å²	30	70.9 Å²	70.9	13%	0.13	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	147.1	177.2	-55.9	-171.1	-178.9	-173.2	0	109	P175 H178 Y188 V219 I228 M288 L289	P175-K230 PolarHBondContact O-NZ 3.21Å; H178-K230 PolarHBondContact NE2-NZ 3.24Å; Y188-K230 HydrophobicContact CE1-CD 4.11Å; Y188-K230 HydrophobicContact CE2-CD 4.16Å; Y188-K230 WeakPolarHBondContact OH-CD 3.43Å; V219-K230 HydrophobicContact CG1-CG 4.33Å; V219-K230 HydrophobicContact CG2-CG 4.4Å; I228-K230 HydrophobicContact CG2-CD 4.43Å; I228-K230 HydrophobicContact CG2-CG 3.99Å; K230-M288 WeakPolarHBondContact O-CA 3.4Å; K230-L289 PolarHBondContact O-N 2.78Å; K230-L289 VanDerWaalsContact O-N 3.1Å
231	F	79.4	Confident	68.6	Low	15 Å²	15	72.6 Å²	72.6	7%	0.066	40%	0.401	C	S	.	.			trans	-87.1	126.1	167.6	-177.2	-112.7	0	0	0	109.5	S217 V218 C233 E248 F281 L289 V291	S217-F231 PolarHBondContact OG-O 3Å; V218-F231 PolarHBondContact O-N 2.62Å; F231-C233 HydrophobicContact CE1-CB 4.05Å; F231-E248 WeakPolarHBondContact CD1-OE2 3.43Å; F231-E248 WeakPolarHBondContact CE1-OE2 3.12Å; F231-F281 HydrophobicContact CB-CE1 4.29Å; F231-F281 HydrophobicContact CB-CZ 4.49Å; F231-F281 HydrophobicContact CD1-CE1 4.22Å; F231-F281 HydrophobicContact CD1-CZ 4.28Å; F231-F281 HydrophobicContact CD2-CD1 4.03Å; F231-F281 AromaticContact CD2-CE1 3.42Å; F231-F281 HydrophobicContact CD2-CE1 3.42Å; F231-F281 VanDerWaalsContact CD2-CE1 3.42Å; F231-F281 HydrophobicContact CD2-CZ 4.24Å; F231-F281 HydrophobicContact CE1-CE1 4.43Å; F231-F281 HydrophobicContact CE2-CD1 4.45Å; F231-F281 AromaticContact CE2-CE1 3.69Å; F231-F281 HydrophobicContact CE2-CE1 3.69Å; F231-F281 AromaticContact CG-CE1 3.7Å; F231-F281 HydrophobicContact CG-CE1 3.7Å; F231-F281 HydrophobicContact CG-CZ 4.07Å; F231-F281 HydrophobicContact CZ-CE1 4.18Å; F231-L289 HydrophobicContact CB-CB 4.1Å; F231-L289 HydrophobicContact CB-CD1 4.05Å; F231-L289 HydrophobicContact CD2-CB 4.38Å; F231-V291 HydrophobicContact CE2-CG2 3.74Å; F231-V291 HydrophobicContact CZ-CG2 4.12Å
232	N	68.3	Low	66.2	Low	94 Å²	94	80 Å²	80	50%	0.503	44%	0.435	S	S	.	.			trans	-113.2	117.6	168.2	-80.9	1.8	0	0	0	107.6	Y188	Y188-N232 PolarHBondContact OH-OD1 2.9Å
233	C	61.5	Low	64	Low	27 Å²	27	90.5 Å²	90.5	18%	0.182	47%	0.472	C	S	.	.			trans	-65.5	127.8	175.1	-165.9	0	0	0	0	109.2	F231	F231-C233 HydrophobicContact CE1-CB 4.05Å
234	P	55.4	Low	62.2	Low	77 Å²	77	91.4 Å²	91.4	50%	0.5	48%	0.476	S	S	.	.			trans	-65.6	136.1	-176.6	20.2	-28.2	0	0	0	112.4	A236 L237	P234-A236 PolarHBondContact O-N 2.98Å; P234-L237 PolarHBondContact O-N 3.43Å; P234-L237 VanDerWaalsContact O-N 3.15Å
235	D	44.6	Very low	60.7	Low	125 Å²	125	91 Å²	91	67%	0.668	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-53.3	-21.2	-174.1	-68.9	-41.1	0	0	0	115.2	L237 I238	D235-L237 PolarHBondContact O-N 3.41Å; D235-I238 WeakPolarHBondContact O-CB 3.33Å; D235-I238 PolarHBondContact O-N 3.09Å; D235-I238 VanDerWaalsContact O-N 3.1Å
236	A	41.6	Very low	59.7	Low	82 Å²	82	88.4 Å²	88.4	68%	0.678	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-63.4	-23.2	178.7	0	0	0	0	0	114.1	P234	P234-A236 PolarHBondContact O-N 2.98Å
237	L	48	Very low	58.8	Low	76 Å²	76	83.4 Å²	83.4	40%	0.398	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-85	-16.8	175.9	-71.9	166.1	0	0	0	113.1	P234 D235 S241	P234-L237 PolarHBondContact O-N 3.43Å; P234-L237 VanDerWaalsContact O-N 3.15Å; D235-L237 PolarHBondContact O-N 3.41Å; L237-S241 PolarHBondContact O-OG 2.83Å
238	I	47.3	Very low	58.4	Low	92 Å²	92	82.2 Å²	82.2	47%	0.472	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-31.5	-175.1	-55	-179.6	0	0	0	111.3	D235	D235-I238 WeakPolarHBondContact O-CB 3.33Å; D235-I238 PolarHBondContact O-N 3.09Å; D235-I238 VanDerWaalsContact O-N 3.1Å
239	Y	41.5	Very low	58.3	Low	215 Å²	215	78.6 Å²	78.6	84%	0.843	40%	0.397	S	S	*	.	S	Bend	trans	-79.7	-23.8	-173.5	-106.8	-89.6	0	0	0	115
240	N	41.2	Very low	58.8	Low	155 Å²	155	81.3 Å²	81.3	83%	0.829	41%	0.407	S	S	*	.	S	Bend	trans	-101.2	-6.9	-174.8	-80.7	-21.3	0	0	0	114.9
241	S	43.1	Very low	59.3	Low	36 Å²	36	80.3 Å²	80.3	25%	0.252	41%	0.405	S	S	.	.	S	Bend	trans	-123.9	113.2	178.3	71.5	0	0	0	0	111.2	L237 R243 Y246	L237-S241 PolarHBondContact O-OG 2.83Å; S241-R243 PolarHBondContact O-N 3.15Å; S241-R243 VanDerWaalsContact O-N 3.07Å; S241-Y246 PolarHBondContact OG-OH 3.11Å; S241-Y246 VanDerWaalsContact OG-OH 3.1Å
242	K	40.3	Very low	60.2	Low	204 Å²	204	80.3 Å²	80.3	89%	0.887	41%	0.406	S	S	*	.	S	Bend	trans	-59.4	112.5	170	-72.4	174.9	176.8	174.2	0	108.6
243	R	45.8	Very low	61.5	Low	243 Å²	243	76.1 Å²	76.1	92%	0.917	39%	0.385	S	S	*	.	S	Bend	trans	44.6	72.4	163.4	-65.8	-176.7	-177.8	171.1	0.5	115.9	S241	S241-R243 PolarHBondContact O-N 3.15Å; S241-R243 VanDerWaalsContact O-N 3.07Å
244	N	48.8	Very low	63.1	Low	61 Å²	61	75.3 Å²	75.3	33%	0.326	38%	0.38	S	S	.	.			trans	-113.1	122.3	165.1	-77.9	-16.4	0	0	0	111.5	Y246	N244-Y246 HydrophobicContact CB-CE1 4.29Å; N244-Y246 HydrophobicContact CB-CE2 4.48Å; N244-Y246 VanDerWaalsContact O-CD2 3.3Å; N244-Y246 WeakPolarHBondContact O-CD2 3.3Å; N244-Y246 VanDerWaalsContact O-CE2 3.31Å; N244-Y246 WeakPolarHBondContact O-CE2 3.42Å; N244-Y246 PolarHBondContact O-N 2.84Å
245	T	54.6	Low	65	Low	73 Å²	73	72 Å²	72	45%	0.448	36%	0.36	S	S	.	.			trans	-66.3	99.7	173.5	-50.3	0	0	0	0	109.7	W214 A247 Q271	W214-T245 HydrophobicContact CB-CG2 3.4Å; W214-T245 VanDerWaalsContact CB-CG2 3.4Å; W214-T245 HydrophobicContact CG-CG2 4.2Å; W214-T245 CarbonylContact O-C 3.52Å; W214-T245 VanDerWaalsContact O-C 3.25Å; W214-T245 WeakPolarHBondContact O-CA 3.47Å; T245-A247 PolarHBondContact O-N 2.81Å; T245-Q271 WeakPolarHBondContact O-CB 3.12Å
246	Y	64.4	Low	67.4	Low	15 Å²	15	69.1 Å²	69.1	6%	0.059	34%	0.342	C	S	.	.			trans	-86.9	95.5	171.4	-50.8	-74.4	0	0	0	109.1	W214 T215 G216 S241 N244 E248 Y272	W214-Y246 CarbonylContact C-O 3.55Å; W214-Y246 CarbonylContact O-C 3.51Å; W214-Y246 PolarHBondContact O-N 2.89Å; T215-Y246 CarbonylContact C-O 3.58Å; T215-Y246 WeakPolarHBondContact CA-O 3.44Å; T215-Y246 HydrophobicContact CG2-CD2 3.77Å; T215-Y246 HydrophobicContact CG2-CE2 4.47Å; T215-Y246 WeakPolarHBondContact O-CB 3.27Å; G216-Y246 PolarHBondContact N-O 3.15Å; G216-Y246 VanDerWaalsContact N-O 3.08Å; S241-Y246 PolarHBondContact OG-OH 3.11Å; S241-Y246 VanDerWaalsContact OG-OH 3.1Å; N244-Y246 HydrophobicContact CB-CE1 4.29Å; N244-Y246 HydrophobicContact CB-CE2 4.48Å; N244-Y246 VanDerWaalsContact O-CD2 3.3Å; N244-Y246 WeakPolarHBondContact O-CD2 3.3Å; N244-Y246 VanDerWaalsContact O-CE2 3.31Å; N244-Y246 WeakPolarHBondContact O-CE2 3.42Å; N244-Y246 PolarHBondContact O-N 2.84Å; Y246-E248 PolarHBondContact O-N 3.35Å; Y246-Y272 AromaticContact CD1-CD2 3.24Å; Y246-Y272 HydrophobicContact CD1-CD2 3.24Å; Y246-Y272 AromaticContact CD1-CE2 3.69Å; Y246-Y272 HydrophobicContact CD1-CE2 3.69Å; Y246-Y272 AromaticContact CD1-CG 3.9Å; Y246-Y272 HydrophobicContact CD1-CG 3.9Å; Y246-Y272 AromaticContact CE1-CD2 3.66Å; Y246-Y272 HydrophobicContact CE1-CD2 3.66Å; Y246-Y272 AromaticContact CE1-CE2 3.7Å; Y246-Y272 HydrophobicContact CE1-CE2 3.7Å; Y246-Y272 HydrophobicContact CE1-CG 4.22Å; Y246-Y272 HydrophobicContact CG-CD2 4.16Å
247	A	67.3	Low	70	Confident	12 Å²	12	65.2 Å²	65.2	10%	0.099	31%	0.31	C	S	.	.			trans	-76.2	52.2	-178.7	0	0	0	0	0	112.9	P209 T245 Y250 Q271	P209-A247 HydrophobicContact CB-CB 4.19Å; T245-A247 PolarHBondContact O-N 2.81Å; A247-Y250 WeakPolarHBondContact O-CB 3.25Å; A247-Y250 PolarHBondContact O-N 3.27Å; A247-Q271 HydrophobicContact CB-CB 4.32Å; A247-Q271 HydrophobicContact CB-CG 4.25Å
248	E	77.6	Confident	72.2	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.019	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-61.8	136.5	178.3	-74.4	175.3	-167.7	0	0	112.2	P209 G216 S217 F231 Y246 A269 F279	P209-E248 VanDerWaalsContact CA-O 3.24Å; P209-E248 WeakPolarHBondContact CA-O 3.39Å; G216-E248 WeakPolarHBondContact CA-O 3.43Å; S217-E248 PolarHBondContact N-O 2.78Å; F231-E248 WeakPolarHBondContact CD1-OE2 3.43Å; F231-E248 WeakPolarHBondContact CE1-OE2 3.12Å; Y246-E248 PolarHBondContact O-N 3.35Å; E248-A269 HydrophobicContact CB-CB 4.32Å; E248-A269 HydrophobicContact CG-CB 3.54Å; E248-F279 HydrophobicContact CG-CD2 4.43Å; E248-F279 HydrophobicContact CG-CE2 4.01Å; E248-F279 WeakPolarHBondContact OE1-CE2 3.49Å
249	G	84.1	Confident	74.3	Confident	0 Å²	0	62 Å²	62	0%	0	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	21.1	-172.8	0	0	0	0	0	112.6	I195 S196 G207 G268	I195-G249 WeakPolarHBondContact CG2-O 3.36Å; S196-G249 PolarHBondContact OG-O 3.06Å; S196-G249 VanDerWaalsContact OG-O 3.11Å; G207-G249 CarbonylContact C-O 3.54Å; G207-G249 WeakPolarHBondContact CA-O 3.45Å; G249-G268 PolarHBondContact N-O 2.8Å
250	Y	94.9	Very high	76.6	Confident	71 Å²	71	55.9 Å²	55.9	28%	0.278	28%	0.282	S	S	.	.	S	Bend	trans	-62.7	-47.3	167.6	-165.8	-86	0	0	0	110.3	I195 S196 A247 G268 P270 Y303	I195-Y250 HydrophobicContact CD1-CD2 4.21Å; I195-Y250 HydrophobicContact CD1-CE2 4.05Å; S196-Y250 WeakPolarHBondContact CB-O 3.43Å; S196-Y250 PolarHBondContact OG-O 3.22Å; A247-Y250 WeakPolarHBondContact O-CB 3.25Å; A247-Y250 PolarHBondContact O-N 3.27Å; Y250-G268 PolarHBondContact N-O 3.02Å; Y250-P270 HydrophobicContact CD1-CG 4.18Å; Y250-P270 HydrophobicContact CD2-CG 4.21Å; Y250-P270 HydrophobicContact CG-CG 3.81Å; Y250-Y303 HydrophobicContact CE1-CE1 4.04Å; Y250-Y303 HydrophobicContact CE2-CE1 4.39Å; Y250-Y303 WeakPolarHBondContact CE2-OH 3.2Å; Y250-Y303 AromaticContact CZ-CE1 3.89Å
251	A	96.6	Very high	78.8	Confident	10 Å²	10	53.8 Å²	53.8	8%	0.083	28%	0.279	C	S	.	.	S	Bend	trans	-118	150.9	167.3	0	0	0	0	0	110.4	G268 S306 L308	A251-G268 PolarHBondContact O-N 2.6Å; A251-S306 WeakPolarHBondContact CB-O 3.48Å; A251-L308 HydrophobicContact CB-CB 4.46Å; A251-L308 HydrophobicContact CB-CD1 4Å; A251-L308 HydrophobicContact CB-CG 3.95Å
252	V	96.9	Very high	81.1	Confident	15 Å²	15	52.9 Å²	52.9	9%	0.091	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	151.5	176.5	-63.2	0	0	0	0	110.8	F198 I205 V218 V266	F198-V252 HydrophobicContact CB-CG2 4.17Å; I205-V252 HydrophobicContact CG2-CB 3.91Å; I205-V252 HydrophobicContact CG2-CG1 4.24Å; I205-V252 HydrophobicContact CG2-CG2 4.11Å; V218-V252 HydrophobicContact CG1-CG1 4.16Å; V218-V252 HydrophobicContact CG2-CG1 4.19Å; V252-V266 VanDerWaalsContact CA-O 3.26Å; V252-V266 WeakPolarHBondContact CA-O 3.03Å
253	G	96	Very high	83.6	Confident	5 Å²	5	46.1 Å²	46.1	5%	0.052	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	179.9	173.9	0	0	0	0	0	110.8	V266	G253-V266 PolarHBondContact N-O 3.44Å; G253-V266 PolarHBondContact O-N 2.93Å
254	A	95.9	Very high	85.9	Confident	10 Å²	10	34.7 Å²	34.7	8%	0.083	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	153.2	172.5	0	0	0	0	0	111	F198 T200 I205 I263 E264	F198-A254 HydrophobicContact CD1-CB 3.95Å; F198-A254 HydrophobicContact CE1-CB 3.92Å; T200-A254 HydrophobicContact CG2-CB 3.79Å; I205-A254 HydrophobicContact CD1-CB 3.6Å; A254-I263 HydrophobicContact CB-CG2 4.08Å; A254-E264 VanDerWaalsContact CA-O 3.23Å; A254-E264 WeakPolarHBondContact CA-O 3.05Å; A254-E264 WeakPolarHBondContact CB-O 3.43Å
255	G	95	Very high	88.1	Confident	7 Å²	7	31.8 Å²	31.8	7%	0.072	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.7	-164.3	177.2	0	0	0	0	0	112	I263 E264	G255-I263 WeakPolarHBondContact O-CA 3.3Å; G255-E264 PolarHBondContact N-O 2.99Å; G255-E264 VanDerWaalsContact N-O 3.07Å; G255-E264 PolarHBondContact O-N 3.34Å
256	H	95.1	Very high	90.1	Very high	65 Å²	65	28.3 Å²	28.3	30%	0.301	17%	0.166	S	C	.	.			trans	-107.4	88.1	-170.9	-58.6	-67	0	0	0	110.2	P260 S262 L318 S319	H256-P260 PolarHBondContact ND1-O 3.16Å; H256-S262 PolarHBondContact ND1-O 2.78Å; H256-L318 CarbonylContact O-C 3.54Å; H256-L318 WeakPolarHBondContact O-CA 3.4Å; H256-S319 PolarHBondContact N-OG 2.92Å; H256-S319 PolarHBondContact O-N 2.86Å
257	F	95.6	Very high	91.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	-97	-42.6	-175.9	-69.3	-85.4	0	0	0	113.1	E264 V266 I280 V310 S319 L321 N343 A347 L349	F257-E264 WeakPolarHBondContact CA-OE2 3.29Å; F257-E264 WeakPolarHBondContact CB-OE2 3.44Å; F257-E264 HydrophobicContact CD2-CB 4.04Å; F257-E264 PolarHBondContact N-OE2 3.11Å; F257-V266 HydrophobicContact CD2-CG2 4.43Å; F257-V266 HydrophobicContact CE2-CG2 3.38Å; F257-V266 HydrophobicContact CZ-CG2 3.63Å; F257-I280 HydrophobicContact CB-CG2 4.31Å; F257-I280 HydrophobicContact CD1-CD1 3.58Å; F257-I280 HydrophobicContact CD2-CD1 4.36Å; F257-I280 HydrophobicContact CD2-CG2 3.99Å; F257-I280 HydrophobicContact CE1-CD1 3.64Å; F257-I280 HydrophobicContact CE2-CD1 4.39Å; F257-I280 HydrophobicContact CG-CD1 3.94Å; F257-I280 HydrophobicContact CG-CG2 4.12Å; F257-I280 HydrophobicContact CZ-CD1 4.04Å; F257-V310 HydrophobicContact CE2-CG1 3.66Å; F257-V310 HydrophobicContact CE2-CG2 4.36Å; F257-V310 HydrophobicContact CZ-CB 4.43Å; F257-V310 HydrophobicContact CZ-CG1 3.55Å; F257-V310 HydrophobicContact CZ-CG2 4.06Å; F257-S319 WeakPolarHBondContact CD1-O 3.31Å; F257-S319 WeakPolarHBondContact CE1-O 3.35Å; F257-L321 HydrophobicContact CE1-CB 4.13Å; F257-L321 HydrophobicContact CZ-CB 4.42Å; F257-N343 WeakPolarHBondContact CA-ND2 3.3Å; F257-N343 PolarHBondContact O-ND2 3.27Å; F257-A347 HydrophobicContact CB-CB 3.83Å; F257-A347 PolarHBondContact O-N 2.87Å; F257-L349 HydrophobicContact CD1-CD2 4.21Å; F257-L349 HydrophobicContact CE1-CD2 4.23Å
258	Q	93.5	Very high	92.9	Very high	65 Å²	65	27.1 Å²	27.1	30%	0.304	16%	0.159	S	C	.	.	S	Bend	trans	-83.3	-44.8	-178.8	-68.7	-173.5	-29.6	0	0	112.1	E264 V292 A347	Q258-E264 HydrophobicContact CG-CG 4.28Å; Q258-E264 PolarHBondContact N-OE2 3.06Å; Q258-V292 HydrophobicContact CG-CG1 4.04Å; Q258-A347 HydrophobicContact CG-CB 4.24Å
259	S	92.1	Very high	93.7	Very high	35 Å²	35	26.9 Å²	26.9	25%	0.245	16%	0.158	C	C	.	.			trans	-149.8	157.9	179.1	74.4	0	0	0	0	110.9	S261 S262	S259-S261 PolarHBondContact O-N 2.83Å; S259-S261 PolarHBondContact OG-N 2.59Å; S259-S261 PolarHBondContact OG-OG 3.01Å; S259-S261 VanDerWaalsContact OG-OG 3.11Å; S259-S262 PolarHBondContact N-OG 3.46Å; S259-S262 PolarHBondContact O-N 3.08Å; S259-S262 PolarHBondContact O-OG 2.83Å; S259-S262 VanDerWaalsContact OG-CB 3.27Å; S259-S262 WeakPolarHBondContact OG-CB 3.3Å; S259-S262 PolarHBondContact OG-N 3.36Å; S259-S262 VanDerWaalsContact OG-N 3.08Å; S259-S262 PolarHBondContact OG-OG 3.33Å
260	P	90.1	Very high	94.2	Very high	88 Å²	88	27 Å²	27	57%	0.571	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-16.1	175.1	-24.4	35	0	0	0	114.4	H256 L318	H256-P260 PolarHBondContact ND1-O 3.16Å; P260-L318 HydrophobicContact CG-CD2 4.29Å
261	S	87.9	Confident	93.9	Very high	110 Å²	110	27.4 Å²	27.4	77%	0.769	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-17.4	-179.4	51.1	0	0	0	0	114.5	S259	S259-S261 PolarHBondContact O-N 2.83Å; S259-S261 PolarHBondContact OG-N 2.59Å; S259-S261 PolarHBondContact OG-OG 3.01Å; S259-S261 VanDerWaalsContact OG-OG 3.11Å
262	S	90.5	Very high	93.5	Very high	18 Å²	18	28.1 Å²	28.1	13%	0.126	16%	0.164	C	C	.	.			trans	-97.7	148.1	-177.4	64.8	0	0	0	0	110.2	H256 S259 E264	H256-S262 PolarHBondContact ND1-O 2.78Å; S259-S262 PolarHBondContact N-OG 3.46Å; S259-S262 PolarHBondContact O-N 3.08Å; S259-S262 PolarHBondContact O-OG 2.83Å; S259-S262 VanDerWaalsContact OG-CB 3.27Å; S259-S262 WeakPolarHBondContact OG-CB 3.3Å; S259-S262 PolarHBondContact OG-N 3.36Å; S259-S262 VanDerWaalsContact OG-N 3.08Å; S259-S262 PolarHBondContact OG-OG 3.33Å; S262-E264 WeakPolarHBondContact CB-OE1 3.44Å; S262-E264 PolarHBondContact OG-OE1 2.77Å
263	I	92.1	Very high	92.9	Very high	62 Å²	62	31.3 Å²	31.3	32%	0.318	18%	0.18	S	C	.	.			trans	-116.9	115.8	178	-62.5	175.3	0	0	0	107.9	T200 L203 A254 G255	T200-I263 HydrophobicContact CG2-CG2 4.3Å; L203-I263 HydrophobicContact CD1-CG2 4.21Å; A254-I263 HydrophobicContact CB-CG2 4.08Å; G255-I263 WeakPolarHBondContact O-CA 3.3Å
264	E	94.6	Very high	92.4	Very high	3 Å²	3	36.5 Å²	36.5	1%	0.014	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	151.6	173.2	-63.4	76.2	-132.7	0	0	110.6	A254 G255 F257 Q258 S262 I280 F281	A254-E264 VanDerWaalsContact CA-O 3.23Å; A254-E264 WeakPolarHBondContact CA-O 3.05Å; A254-E264 WeakPolarHBondContact CB-O 3.43Å; G255-E264 PolarHBondContact N-O 2.99Å; G255-E264 VanDerWaalsContact N-O 3.07Å; G255-E264 PolarHBondContact O-N 3.34Å; F257-E264 WeakPolarHBondContact CA-OE2 3.29Å; F257-E264 WeakPolarHBondContact CB-OE2 3.44Å; F257-E264 HydrophobicContact CD2-CB 4.04Å; F257-E264 PolarHBondContact N-OE2 3.11Å; Q258-E264 HydrophobicContact CG-CG 4.28Å; Q258-E264 PolarHBondContact N-OE2 3.06Å; S262-E264 WeakPolarHBondContact CB-OE1 3.44Å; S262-E264 PolarHBondContact OG-OE1 2.77Å; E264-I280 HydrophobicContact CB-CG2 3.75Å; E264-I280 HydrophobicContact CG-CG2 4.38Å; E264-F281 CarbonylContact C-O 3.48Å; E264-F281 WeakPolarHBondContact CA-O 3.41Å; E264-F281 WeakPolarHBondContact CB-O 3.25Å
265	V	95.6	Very high	92.1	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	135.4	-176.1	176.1	0	0	0	0	109.3	L203 I205 V218 V220 I280 F281 T283	L203-V265 HydrophobicContact CD1-CG2 4.49Å; I205-V265 HydrophobicContact CD1-CB 4.46Å; I205-V265 HydrophobicContact CD1-CG1 4.09Å; I205-V265 HydrophobicContact CD1-CG2 3.72Å; I205-V265 HydrophobicContact CG1-CG1 4.41Å; I205-V265 HydrophobicContact CG1-CG2 4.21Å; I205-V265 HydrophobicContact CG2-CG1 3.7Å; V218-V265 HydrophobicContact CG1-CG1 3.91Å; V220-V265 HydrophobicContact CG2-CB 4.46Å; V220-V265 HydrophobicContact CG2-CG1 4.1Å; V220-V265 HydrophobicContact CG2-CG2 3.99Å; V265-I280 CarbonylContact O-C 3.48Å; V265-I280 WeakPolarHBondContact O-CA 3.31Å; V265-F281 HydrophobicContact CB-CB 4.39Å; V265-F281 PolarHBondContact N-O 3.43Å; V265-F281 WeakPolarHBondContact O-CD2 3.43Å; V265-F281 PolarHBondContact O-N 3.05Å; V265-T283 HydrophobicContact CG2-CG2 4.05Å
266	V	95.9	Very high	92	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135.9	177.8	-164.8	0	0	0	0	109.8	V252 G253 F257 F279 I280 L308 V310 L321	V252-V266 VanDerWaalsContact CA-O 3.26Å; V252-V266 WeakPolarHBondContact CA-O 3.03Å; G253-V266 PolarHBondContact N-O 3.44Å; G253-V266 PolarHBondContact O-N 2.93Å; F257-V266 HydrophobicContact CD2-CG2 4.43Å; F257-V266 HydrophobicContact CE2-CG2 3.38Å; F257-V266 HydrophobicContact CZ-CG2 3.63Å; V266-F279 CarbonylContact C-O 3.13Å; V266-F279 VanDerWaalsContact CA-O 3.26Å; V266-F279 WeakPolarHBondContact CA-O 3.28Å; V266-F279 WeakPolarHBondContact CG1-O 3.23Å; V266-I280 HydrophobicContact CG1-CG1 4.34Å; V266-I280 HydrophobicContact CG2-CG1 4.21Å; V266-L308 HydrophobicContact CB-CD1 4.34Å; V266-L308 HydrophobicContact CG1-CD1 3.79Å; V266-V310 HydrophobicContact CB-CG2 4.33Å; V266-V310 HydrophobicContact CG2-CG2 3.72Å; V266-L321 HydrophobicContact CG1-CD1 4.01Å; V266-L321 HydrophobicContact CG1-CD2 4.4Å
267	G	95.7	Very high	91.9	Very high	1 Å²	1	37 Å²	37	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	129.5	176.1	0	0	0	0	0	112.2	A278 F279	G267-A278 WeakPolarHBondContact O-CA 3.39Å; G267-F279 PolarHBondContact N-O 2.95Å; G267-F279 PolarHBondContact O-N 2.04Å
268	G	95.6	Very high	91.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	140.7	178.8	0	0	0	0	0	112.5	G249 Y250 A251 G305	G249-G268 PolarHBondContact N-O 2.8Å; Y250-G268 PolarHBondContact N-O 3.02Å; A251-G268 PolarHBondContact O-N 2.6Å; G268-G305 CarbonylContact C-O 3.58Å; G268-G305 VanDerWaalsContact CA-O 3.23Å; G268-G305 WeakPolarHBondContact CA-O 3.5Å
269	A	94.3	Very high	91.9	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	73.2	-174.9	0	0	0	0	0	110.9	E248 Q271 Y272 G276 K277 F279	E248-A269 HydrophobicContact CB-CB 4.32Å; E248-A269 HydrophobicContact CG-CB 3.54Å; A269-Q271 PolarHBondContact O-N 3.04Å; A269-Q271 VanDerWaalsContact O-N 3.14Å; A269-Y272 VanDerWaalsContact O-CB 3.31Å; A269-Y272 WeakPolarHBondContact O-CB 3.43Å; A269-Y272 PolarHBondContact O-N 3.2Å; A269-Y272 VanDerWaalsContact O-N 3.08Å; A269-G276 WeakPolarHBondContact O-CA 3.4Å; A269-K277 WeakPolarHBondContact CA-O 3.01Å; A269-K277 HydrophobicContact CB-CB 4.48Å; A269-K277 PolarHBondContact N-O 3.42Å; A269-K277 PolarHBondContact O-N 3.3Å; A269-K277 VanDerWaalsContact O-N 3.07Å; A269-F279 HydrophobicContact CB-CD2 4.43Å; A269-F279 HydrophobicContact CB-CE2 4Å
270	P	93.6	Very high	92	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.006	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-19.3	-167.1	26.7	-35.6	0	0	0	115.4	Y250 G276 Y303 F304	Y250-P270 HydrophobicContact CD1-CG 4.18Å; Y250-P270 HydrophobicContact CD2-CG 4.21Å; Y250-P270 HydrophobicContact CG-CG 3.81Å; P270-G276 WeakPolarHBondContact O-CA 3.48Å; P270-Y303 HydrophobicContact CB-CD1 4.01Å; P270-Y303 HydrophobicContact CB-CD2 3.71Å; P270-Y303 HydrophobicContact CB-CE1 4.09Å; P270-Y303 HydrophobicContact CB-CE2 3.79Å; P270-Y303 HydrophobicContact CB-CG 3.79Å; P270-Y303 HydrophobicContact CG-CD1 4.47Å; P270-Y303 HydrophobicContact CG-CD2 4.38Å; P270-Y303 HydrophobicContact CG-CE1 4.06Å; P270-Y303 HydrophobicContact CG-CE2 3.96Å; P270-F304 VanDerWaalsContact CA-O 3.27Å; P270-F304 WeakPolarHBondContact CA-O 3.42Å
271	Q	89.8	Confident	92.2	Very high	80 Å²	80	28.7 Å²	28.7	37%	0.374	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-1.4	177.8	-68.3	-72.9	3.7	0	0	113.5	T245 A247 A269 N273 Q274 Y303	T245-Q271 WeakPolarHBondContact O-CB 3.12Å; A247-Q271 HydrophobicContact CB-CB 4.32Å; A247-Q271 HydrophobicContact CB-CG 4.25Å; A269-Q271 PolarHBondContact O-N 3.04Å; A269-Q271 VanDerWaalsContact O-N 3.14Å; Q271-N273 PolarHBondContact O-N 3.05Å; Q271-N273 VanDerWaalsContact O-N 3.12Å; Q271-Q274 PolarHBondContact O-N 3.17Å; Q271-Y303 HydrophobicContact CG-CE2 4.13Å
272	Y	87.4	Confident	92.3	Very high	26 Å²	26	23.8 Å²	23.8	10%	0.102	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-60.8	117.8	-177.5	-170.5	-79.7	0	0	0	111.1	Y246 A269 Q274 K275 G276 K277 F279	Y246-Y272 AromaticContact CD1-CD2 3.24Å; Y246-Y272 HydrophobicContact CD1-CD2 3.24Å; Y246-Y272 AromaticContact CD1-CE2 3.69Å; Y246-Y272 HydrophobicContact CD1-CE2 3.69Å; Y246-Y272 AromaticContact CD1-CG 3.9Å; Y246-Y272 HydrophobicContact CD1-CG 3.9Å; Y246-Y272 AromaticContact CE1-CD2 3.66Å; Y246-Y272 HydrophobicContact CE1-CD2 3.66Å; Y246-Y272 AromaticContact CE1-CE2 3.7Å; Y246-Y272 HydrophobicContact CE1-CE2 3.7Å; Y246-Y272 HydrophobicContact CE1-CG 4.22Å; Y246-Y272 HydrophobicContact CG-CD2 4.16Å; A269-Y272 VanDerWaalsContact O-CB 3.31Å; A269-Y272 WeakPolarHBondContact O-CB 3.43Å; A269-Y272 PolarHBondContact O-N 3.2Å; A269-Y272 VanDerWaalsContact O-N 3.08Å; Y272-Q274 PolarHBondContact O-N 2.81Å; Y272-K275 PolarHBondContact O-N 3.03Å; Y272-G276 PolarHBondContact O-N 3.48Å; Y272-K277 HydrophobicContact CD1-CB 4.02Å; Y272-K277 HydrophobicContact CD1-CD 3.79Å; Y272-K277 HydrophobicContact CD2-CD 4.35Å; Y272-K277 HydrophobicContact CE1-CD 3.78Å; Y272-K277 HydrophobicContact CE2-CD 4.36Å; Y272-K277 HydrophobicContact CG-CB 3.89Å; Y272-K277 HydrophobicContact CG-CD 4.11Å; Y272-F279 HydrophobicContact CD2-CZ 4.3Å; Y272-F279 HydrophobicContact CE2-CZ 4.22Å
273	N	85.3	Confident	92	Very high	82 Å²	82	24.4 Å²	24.4	44%	0.439	12%	0.119	S	C	.	.	G	3₁₀ helix	trans	48.3	27.1	-173.6	-71	-12.6	0	0	0	114.3	Q271 K275	Q271-N273 PolarHBondContact O-N 3.05Å; Q271-N273 VanDerWaalsContact O-N 3.12Å; N273-K275 PolarHBondContact O-N 3.25Å
274	Q	84.9	Confident	91.2	Very high	114 Å²	114	28.5 Å²	28.5	53%	0.533	14%	0.137	S	C	.	.	G	3₁₀ helix	trans	56.6	5.5	-172.2	-54.8	177.6	10.9	0	0	115.1	Q271 Y272 L300 G301	Q271-Q274 PolarHBondContact O-N 3.17Å; Y272-Q274 PolarHBondContact O-N 2.81Å; Q274-L300 HydrophobicContact CB-CD2 4.07Å; Q274-L300 CarbonylContact O-C 3.57Å; Q274-L300 WeakPolarHBondContact O-CA 3.41Å; Q274-G301 PolarHBondContact O-N 2.82Å
275	K	89.4	Confident	89.9	Confident	82 Å²	82	32 Å²	32	36%	0.357	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-25.1	176.1	-64.6	-173.1	178.2	-170	0	112.4	Y272 N273 G297 L300 S302 F304	Y272-K275 PolarHBondContact O-N 3.03Å; N273-K275 PolarHBondContact O-N 3.25Å; K275-G297 WeakPolarHBondContact CB-O 3.45Å; K275-L300 HydrophobicContact CD-CD2 4.38Å; K275-L300 HydrophobicContact CG-CD2 3.58Å; K275-L300 HydrophobicContact CG-CG 4.14Å; K275-S302 PolarHBondContact O-OG 2.71Å; K275-F304 WeakPolarHBondContact O-CB 3.27Å
276	G	92.6	Very high	88.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	89	154.8	-176.7	0	0	0	0	0	113.1	A269 P270 Y272 G297 F304	A269-G276 WeakPolarHBondContact O-CA 3.4Å; P270-G276 WeakPolarHBondContact O-CA 3.48Å; Y272-G276 PolarHBondContact O-N 3.48Å; G276-G297 PolarHBondContact O-N 2.84Å; G276-F304 CarbonylContact C-O 3.54Å; G276-F304 WeakPolarHBondContact CA-O 3.37Å
277	K	93.1	Very high	87.1	Confident	11 Å²	11	45 Å²	45	5%	0.048	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	155	-179.1	-159.2	168	-179	-173.7	0	110.3	A269 Y272 F279 E294 V295 F304	A269-K277 WeakPolarHBondContact CA-O 3.01Å; A269-K277 HydrophobicContact CB-CB 4.48Å; A269-K277 PolarHBondContact N-O 3.42Å; A269-K277 PolarHBondContact O-N 3.3Å; A269-K277 VanDerWaalsContact O-N 3.07Å; Y272-K277 HydrophobicContact CD1-CB 4.02Å; Y272-K277 HydrophobicContact CD1-CD 3.79Å; Y272-K277 HydrophobicContact CD2-CD 4.35Å; Y272-K277 HydrophobicContact CE1-CD 3.78Å; Y272-K277 HydrophobicContact CE2-CD 4.36Å; Y272-K277 HydrophobicContact CG-CB 3.89Å; Y272-K277 HydrophobicContact CG-CD 4.11Å; K277-F279 HydrophobicContact CB-CE2 4.31Å; K277-F279 HydrophobicContact CD-CE1 3.79Å; K277-F279 HydrophobicContact CD-CE2 4.13Å; K277-F279 HydrophobicContact CD-CZ 3.52Å; K277-F279 HydrophobicContact CG-CE1 4.38Å; K277-F279 HydrophobicContact CG-CE2 4.23Å; K277-F279 HydrophobicContact CG-CZ 4.08Å; K277-E294 VanDerWaalsContact CE-OE1 3.29Å; K277-E294 WeakPolarHBondContact CE-OE1 3.2Å; K277-E294 WeakPolarHBondContact CE-OE2 3.43Å; K277-E294 IonicContact NZ-OE1 2.86Å; K277-E294 PolarHBondContact NZ-OE1 2.88Å; K277-E294 IonicContact NZ-OE2 3.84Å; K277-E294 PolarHBondContact NZ-OE2 3.06Å; K277-V295 CarbonylContact C-O 3.6Å; K277-V295 WeakPolarHBondContact CA-O 3.37Å; K277-V295 WeakPolarHBondContact CG-O 3.37Å; K277-F304 PolarHBondContact N-O 2.92Å
278	A	95.4	Very high	86.4	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.008	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	140.2	166.4	0	0	0	0	0	110	G267 E294 V295 L308 V323	G267-A278 WeakPolarHBondContact O-CA 3.39Å; A278-E294 WeakPolarHBondContact O-CA 2.95Å; A278-V295 HydrophobicContact CB-CG2 3.75Å; A278-V295 PolarHBondContact N-O 3.5Å; A278-V295 PolarHBondContact O-N 2.79Å; A278-L308 HydrophobicContact CB-CD2 3.9Å; A278-V323 HydrophobicContact CB-CG2 4.42Å
279	F	93.8	Very high	86	Confident	9 Å²	9	50.7 Å²	50.7	4%	0.039	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	142.4	-175.6	-62.2	-84.5	0	0	0	110.4	E248 V266 G267 A269 Y272 K277 F281 V291 E294	E248-F279 HydrophobicContact CG-CD2 4.43Å; E248-F279 HydrophobicContact CG-CE2 4.01Å; E248-F279 WeakPolarHBondContact OE1-CE2 3.49Å; V266-F279 CarbonylContact C-O 3.13Å; V266-F279 VanDerWaalsContact CA-O 3.26Å; V266-F279 WeakPolarHBondContact CA-O 3.28Å; V266-F279 WeakPolarHBondContact CG1-O 3.23Å; G267-F279 PolarHBondContact N-O 2.95Å; G267-F279 PolarHBondContact O-N 2.04Å; A269-F279 HydrophobicContact CB-CD2 4.43Å; A269-F279 HydrophobicContact CB-CE2 4Å; Y272-F279 HydrophobicContact CD2-CZ 4.3Å; Y272-F279 HydrophobicContact CE2-CZ 4.22Å; K277-F279 HydrophobicContact CB-CE2 4.31Å; K277-F279 HydrophobicContact CD-CE1 3.79Å; K277-F279 HydrophobicContact CD-CE2 4.13Å; K277-F279 HydrophobicContact CD-CZ 3.52Å; K277-F279 HydrophobicContact CG-CE1 4.38Å; K277-F279 HydrophobicContact CG-CE2 4.23Å; K277-F279 HydrophobicContact CG-CZ 4.08Å; F279-F281 HydrophobicContact CB-CD2 4.39Å; F279-F281 HydrophobicContact CB-CE1 3.96Å; F279-F281 HydrophobicContact CB-CE2 3.62Å; F279-F281 HydrophobicContact CB-CZ 3.37Å; F279-F281 HydrophobicContact CD2-CZ 4.4Å; F279-F281 HydrophobicContact CG-CZ 4.02Å; F279-V291 HydrophobicContact CD1-CG1 4.13Å; F279-V291 HydrophobicContact CD1-CG2 4.26Å; F279-E294 HydrophobicContact CD1-CB 3.99Å; F279-E294 HydrophobicContact CE1-CB 4.42Å; F279-E294 WeakPolarHBondContact CE1-OE2 3.5Å
280	I	95.1	Very high	85.6	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	128.6	171.7	-59.8	175.6	0	0	0	108.1	F257 E264 V265 V266 V291 V292 S293 L349	F257-I280 HydrophobicContact CB-CG2 4.31Å; F257-I280 HydrophobicContact CD1-CD1 3.58Å; F257-I280 HydrophobicContact CD2-CD1 4.36Å; F257-I280 HydrophobicContact CD2-CG2 3.99Å; F257-I280 HydrophobicContact CE1-CD1 3.64Å; F257-I280 HydrophobicContact CE2-CD1 4.39Å; F257-I280 HydrophobicContact CG-CD1 3.94Å; F257-I280 HydrophobicContact CG-CG2 4.12Å; F257-I280 HydrophobicContact CZ-CD1 4.04Å; E264-I280 HydrophobicContact CB-CG2 3.75Å; E264-I280 HydrophobicContact CG-CG2 4.38Å; V265-I280 CarbonylContact O-C 3.48Å; V265-I280 WeakPolarHBondContact O-CA 3.31Å; V266-I280 HydrophobicContact CG1-CG1 4.34Å; V266-I280 HydrophobicContact CG2-CG1 4.21Å; I280-V291 WeakPolarHBondContact O-CA 3.3Å; I280-V292 PolarHBondContact O-N 3.09Å; I280-S293 PolarHBondContact N-O 2.81Å; I280-L349 HydrophobicContact CD1-CD1 3.57Å; I280-L349 HydrophobicContact CD1-CG 4.24Å
281	F	92.8	Very high	85.4	Confident	1 Å²	1	58.4 Å²	58.4	0%	0.004	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	135.9	-173.1	-56.3	-77.3	0	0	0	112.2	V218 F231 E264 V265 F279 L289 Q290 V291	V218-F281 HydrophobicContact CG2-CE2 4.17Å; F231-F281 HydrophobicContact CB-CE1 4.29Å; F231-F281 HydrophobicContact CB-CZ 4.49Å; F231-F281 HydrophobicContact CD1-CE1 4.22Å; F231-F281 HydrophobicContact CD1-CZ 4.28Å; F231-F281 HydrophobicContact CD2-CD1 4.03Å; F231-F281 AromaticContact CD2-CE1 3.42Å; F231-F281 HydrophobicContact CD2-CE1 3.42Å; F231-F281 VanDerWaalsContact CD2-CE1 3.42Å; F231-F281 HydrophobicContact CD2-CZ 4.24Å; F231-F281 HydrophobicContact CE1-CE1 4.43Å; F231-F281 HydrophobicContact CE2-CD1 4.45Å; F231-F281 AromaticContact CE2-CE1 3.69Å; F231-F281 HydrophobicContact CE2-CE1 3.69Å; F231-F281 AromaticContact CG-CE1 3.7Å; F231-F281 HydrophobicContact CG-CE1 3.7Å; F231-F281 HydrophobicContact CG-CZ 4.07Å; F231-F281 HydrophobicContact CZ-CE1 4.18Å; E264-F281 CarbonylContact C-O 3.48Å; E264-F281 WeakPolarHBondContact CA-O 3.41Å; E264-F281 WeakPolarHBondContact CB-O 3.25Å; V265-F281 HydrophobicContact CB-CB 4.39Å; V265-F281 PolarHBondContact N-O 3.43Å; V265-F281 WeakPolarHBondContact O-CD2 3.43Å; V265-F281 PolarHBondContact O-N 3.05Å; F279-F281 HydrophobicContact CB-CD2 4.39Å; F279-F281 HydrophobicContact CB-CE1 3.96Å; F279-F281 HydrophobicContact CB-CE2 3.62Å; F279-F281 HydrophobicContact CB-CZ 3.37Å; F279-F281 HydrophobicContact CD2-CZ 4.4Å; F279-F281 HydrophobicContact CG-CZ 4.02Å; F281-L289 HydrophobicContact CB-CB 4.1Å; F281-L289 HydrophobicContact CB-CD2 4.26Å; F281-L289 HydrophobicContact CD1-CB 4Å; F281-L289 HydrophobicContact CG-CB 4.19Å; F281-L289 HydrophobicContact CG-CD1 4.44Å; F281-Q290 CarbonylContact C-O 3.57Å; F281-Q290 WeakPolarHBondContact CA-O 3.4Å; F281-V291 HydrophobicContact CD1-CG2 3.94Å; F281-V291 HydrophobicContact CE1-CG2 3.61Å
282	S	90.9	Very high	85.5	Confident	7 Å²	7	56.9 Å²	56.9	5%	0.049	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	148	167.2	174.2	0	0	0	0	111.4	E284 Q290	S282-E284 PolarHBondContact OG-N 3.27Å; S282-Q290 PolarHBondContact N-O 2.76Å; S282-Q290 PolarHBondContact O-N 2.8Å
283	T	84.8	Confident	85.8	Confident	31 Å²	31	56.8 Å²	56.8	19%	0.19	29%	0.292	C	S	.	.			trans	-106.8	6.7	179.8	60.3	0	0	0	0	113.7	L203 V220 V265 N285 L289	L203-T283 HydrophobicContact CD1-CG2 4.48Å; V220-T283 HydrophobicContact CG1-CG2 4.33Å; V265-T283 HydrophobicContact CG2-CG2 4.05Å; T283-N285 VanDerWaalsContact C-N 3.33Å; T283-N285 PolarHBondContact O-N 3.38Å; T283-L289 HydrophobicContact CG2-CD2 3.86Å
284	E	75.1	Confident	86.2	Confident	149 Å²	149	57.5 Å²	57.5	70%	0.696	29%	0.293	S	S	*	.			trans	-70.6	-23.8	-173.3	-67.2	-176.6	161.2	0	0	114.3	S282	S282-E284 PolarHBondContact OG-N 3.27Å
285	N	66.6	Low	86.7	Confident	77 Å²	77	52.6 Å²	52.6	41%	0.412	27%	0.271	S	S	.	.	S	Bend	trans	-92.8	138.4	-175.3	-98.8	-41.6	0	0	0	113.6	F229 T283 K287 Q290	F229-N285 WeakPolarHBondContact CD1-O 3.31Å; F229-N285 VanDerWaalsContact CE1-O 3.29Å; F229-N285 WeakPolarHBondContact CE1-O 3.06Å; T283-N285 VanDerWaalsContact C-N 3.33Å; T283-N285 PolarHBondContact O-N 3.38Å; N285-K287 PolarHBondContact O-N 2.85Å; N285-Q290 PolarHBondContact ND2-NE2 2.87Å; N285-Q290 VanDerWaalsContact ND2-NE2 3.1Å; N285-Q290 PolarHBondContact ND2-OE1 2.88Å
286	S	60.8	Low	86.9	Confident	106 Å²	106	51.6 Å²	51.6	74%	0.741	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-16.8	-154.4	-53.8	0	0	0	0	118.9
287	K	72.4	Confident	86.9	Confident	165 Å²	165	51.7 Å²	51.7	72%	0.717	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-157.2	-5.8	178.8	-65.4	-168.1	180	172.7	0	116.5	N285	N285-K287 PolarHBondContact O-N 2.85Å
288	M	81.3	Confident	86.7	Confident	113 Å²	113	56.8 Å²	56.8	56%	0.557	30%	0.297	S	S	*	.	B	Isolated β-bridge	trans	-130.2	142.4	-175.5	-66.7	-159.8	-61.8	0	0	111.2	K230	K230-M288 WeakPolarHBondContact O-CA 3.4Å
289	L	85.6	Confident	86.5	Confident	8 Å²	8	60 Å²	60	4%	0.042	31%	0.312	C	S	.	.			trans	-74.3	130.3	173.1	-66.8	176.4	0	0	0	109.9	V218 V220 F229 K230 F231 F281 T283	V218-L289 HydrophobicContact CB-CD1 4.12Å; V218-L289 HydrophobicContact CG1-CD1 4.37Å; V218-L289 WeakPolarHBondContact O-CD1 3.25Å; V220-L289 HydrophobicContact CG2-CD1 3.96Å; V220-L289 HydrophobicContact CG2-CD2 4.03Å; F229-L289 HydrophobicContact CB-CD2 3.83Å; F229-L289 HydrophobicContact CB-CG 4.05Å; K230-L289 PolarHBondContact O-N 2.78Å; K230-L289 VanDerWaalsContact O-N 3.1Å; F231-L289 HydrophobicContact CB-CB 4.1Å; F231-L289 HydrophobicContact CB-CD1 4.05Å; F231-L289 HydrophobicContact CD2-CB 4.38Å; F281-L289 HydrophobicContact CB-CB 4.1Å; F281-L289 HydrophobicContact CB-CD2 4.26Å; F281-L289 HydrophobicContact CD1-CB 4Å; F281-L289 HydrophobicContact CG-CB 4.19Å; F281-L289 HydrophobicContact CG-CD1 4.44Å; T283-L289 HydrophobicContact CG2-CD2 3.86Å
290	Q	87.2	Confident	86.4	Confident	102 Å²	102	64.8 Å²	64.8	48%	0.477	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	131.7	176.6	-71.2	-171.5	-32.1	0	0	110.5	F281 S282 N285 V292	F281-Q290 CarbonylContact C-O 3.57Å; F281-Q290 WeakPolarHBondContact CA-O 3.4Å; S282-Q290 PolarHBondContact N-O 2.76Å; S282-Q290 PolarHBondContact O-N 2.8Å; N285-Q290 PolarHBondContact ND2-NE2 2.87Å; N285-Q290 VanDerWaalsContact ND2-NE2 3.1Å; N285-Q290 PolarHBondContact ND2-OE1 2.88Å; Q290-V292 PolarHBondContact O-N 2.93Å
291	V	89.3	Confident	86.2	Confident	61 Å²	61	67 Å²	67	37%	0.37	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	120.5	175.2	-178.3	0	0	0	0	108.7	F231 F279 I280 F281	F231-V291 HydrophobicContact CE2-CG2 3.74Å; F231-V291 HydrophobicContact CZ-CG2 4.12Å; F279-V291 HydrophobicContact CD1-CG1 4.13Å; F279-V291 HydrophobicContact CD1-CG2 4.26Å; I280-V291 WeakPolarHBondContact O-CA 3.3Å; F281-V291 HydrophobicContact CD1-CG2 3.94Å; F281-V291 HydrophobicContact CE1-CG2 3.61Å
292	V	91.4	Very high	86.2	Confident	49 Å²	49	67.1 Å²	67.1	30%	0.297	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-44.3	175	177.1	0	0	0	0	110.2	Q258 I280 Q290 A347	Q258-V292 HydrophobicContact CG-CG1 4.04Å; I280-V292 PolarHBondContact O-N 3.09Å; Q290-V292 PolarHBondContact O-N 2.93Å; V292-A347 HydrophobicContact CG1-CB 3.7Å
293	S	93.4	Very high	86.4	Confident	23 Å²	23	68.6 Å²	68.6	16%	0.161	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	158.9	-174.5	-170.6	0	0	0	0	109.9	I280 A347	I280-S293 PolarHBondContact N-O 2.81Å; S293-A347 WeakPolarHBondContact CB-O 3.27Å; S293-A347 PolarHBondContact OG-O 2.8Å
294	E	93.3	Very high	87	Confident	97 Å²	97	67.1 Å²	67.1	45%	0.453	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	145.2	-178.1	56.3	176.7	-132.1	0	0	112	K277 A278 F279	K277-E294 VanDerWaalsContact CE-OE1 3.29Å; K277-E294 WeakPolarHBondContact CE-OE1 3.2Å; K277-E294 WeakPolarHBondContact CE-OE2 3.43Å; K277-E294 IonicContact NZ-OE1 2.86Å; K277-E294 PolarHBondContact NZ-OE1 2.88Å; K277-E294 IonicContact NZ-OE2 3.84Å; K277-E294 PolarHBondContact NZ-OE2 3.06Å; A278-E294 WeakPolarHBondContact O-CA 2.95Å; F279-E294 HydrophobicContact CD1-CB 3.99Å; F279-E294 HydrophobicContact CE1-CB 4.42Å; F279-E294 WeakPolarHBondContact CE1-OE2 3.5Å
295	V	95.6	Very high	88	Confident	12 Å²	12	60 Å²	60	7%	0.073	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138.4	175.3	-63.9	0	0	0	0	109.8	K277 A278 F304 L321 V323 Y341 L349	K277-V295 CarbonylContact C-O 3.6Å; K277-V295 WeakPolarHBondContact CA-O 3.37Å; K277-V295 WeakPolarHBondContact CG-O 3.37Å; A278-V295 HydrophobicContact CB-CG2 3.75Å; A278-V295 PolarHBondContact N-O 3.5Å; A278-V295 PolarHBondContact O-N 2.79Å; V295-F304 HydrophobicContact CG2-CE1 4.16Å; V295-F304 HydrophobicContact CG2-CZ 4.1Å; V295-L321 HydrophobicContact CG2-CD2 4Å; V295-V323 HydrophobicContact CG2-CG2 4.13Å; V295-Y341 HydrophobicContact CB-CE1 4.06Å; V295-Y341 HydrophobicContact CB-CE2 4.21Å; V295-Y341 HydrophobicContact CG1-CD1 3.81Å; V295-Y341 HydrophobicContact CG1-CD2 4.43Å; V295-Y341 HydrophobicContact CG1-CE1 3.77Å; V295-Y341 HydrophobicContact CG1-CE2 4.39Å; V295-Y341 HydrophobicContact CG1-CG 4.17Å; V295-Y341 HydrophobicContact CG2-CE2 4.17Å; V295-L349 HydrophobicContact CG1-CB 4.22Å; V295-L349 HydrophobicContact CG1-CD1 3.67Å
296	T	93.4	Very high	89.4	Confident	61 Å²	61	56.9 Å²	56.9	37%	0.374	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	132.9	-170.7	-56.3	0	0	0	0	111.1
297	G	92.7	Very high	91.1	Very high	2 Å²	2	52.3 Å²	52.3	2%	0.021	28%	0.276	C	S	.	.			trans	-67.2	146.5	174.6	0	0	0	0	0	112.3	K275 G276	K275-G297 WeakPolarHBondContact CB-O 3.45Å; G276-G297 PolarHBondContact O-N 2.84Å
298	H	90	Very high	92.3	Very high	117 Å²	117	45.5 Å²	45.5	54%	0.542	25%	0.247	S	C	.	.			trans	-93.3	-31.1	-178.5	-60.7	-60.7	0	0	0	113.3	E351	H298-E351 IonicContact NE2-OE2 2.68Å
299	E	91.6	Very high	93.1	Very high	69 Å²	69	40.5 Å²	40.5	32%	0.322	22%	0.223	S	C	.	.	S	Bend	trans	-98.9	131.7	-171.7	-173.5	-174.3	179.4	0	0	112	S302 A328 T329	E299-S302 WeakPolarHBondContact O-CB 3.31Å; E299-S302 PolarHBondContact O-OG 3.01Å; E299-A328 WeakPolarHBondContact OE2-CA 3.39Å; E299-A328 WeakPolarHBondContact OE2-CB 3.45Å; E299-T329 WeakPolarHBondContact OE1-CB 3.41Å; E299-T329 PolarHBondContact OE1-N 3.35Å; E299-T329 PolarHBondContact OE2-N 2.92Å
300	L	91.6	Very high	93.6	Very high	110 Å²	110	41.2 Å²	41.2	58%	0.576	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	133.9	176.9	-71.1	165.8	0	0	0	110.8	Q274 K275 S302	Q274-L300 HydrophobicContact CB-CD2 4.07Å; Q274-L300 CarbonylContact O-C 3.57Å; Q274-L300 WeakPolarHBondContact O-CA 3.41Å; K275-L300 HydrophobicContact CD-CD2 4.38Å; K275-L300 HydrophobicContact CG-CD2 3.58Å; K275-L300 HydrophobicContact CG-CG 4.14Å; L300-S302 PolarHBondContact O-N 3.13Å
301	G	89.6	Confident	94.1	Very high	48 Å²	48	36.7 Å²	36.7	50%	0.495	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	1.6	178.4	0	0	0	0	0	114.7	Q274 Y303 M327	Q274-G301 PolarHBondContact O-N 2.82Å; G301-Y303 PolarHBondContact O-N 2.87Å; G301-M327 VanDerWaalsContact O-CB 3.3Å; G301-M327 WeakPolarHBondContact O-CB 3.47Å
302	S	93.9	Very high	94.4	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.021	20%	0.198	C	C	.	.	S	Bend	trans	-68.1	-14.9	-177.5	63.6	0	0	0	0	114.4	K275 E299 L300 F304 A325 M327	K275-S302 PolarHBondContact O-OG 2.71Å; E299-S302 WeakPolarHBondContact O-CB 3.31Å; E299-S302 PolarHBondContact O-OG 3.01Å; L300-S302 PolarHBondContact O-N 3.13Å; S302-F304 PolarHBondContact O-N 3.08Å; S302-A325 CarbonylContact O-C 3.6Å; S302-A325 VanDerWaalsContact O-C 3.25Å; S302-A325 WeakPolarHBondContact O-CA 3.3Å; S302-M327 PolarHBondContact O-N 3.37Å; S302-M327 VanDerWaalsContact O-N 3.13Å
303	Y	95.1	Very high	94.7	Very high	37 Å²	37	33.1 Å²	33.1	15%	0.145	18%	0.184	C	C	.	.			trans	61.9	32.2	-179.1	-142	-121.9	0	0	0	112.9	Y250 P270 Q271 G301 G305 S306 M327	Y250-Y303 HydrophobicContact CE1-CE1 4.04Å; Y250-Y303 HydrophobicContact CE2-CE1 4.39Å; Y250-Y303 WeakPolarHBondContact CE2-OH 3.2Å; Y250-Y303 AromaticContact CZ-CE1 3.89Å; P270-Y303 HydrophobicContact CB-CD1 4.01Å; P270-Y303 HydrophobicContact CB-CD2 3.71Å; P270-Y303 HydrophobicContact CB-CE1 4.09Å; P270-Y303 HydrophobicContact CB-CE2 3.79Å; P270-Y303 HydrophobicContact CB-CG 3.79Å; P270-Y303 HydrophobicContact CG-CD1 4.47Å; P270-Y303 HydrophobicContact CG-CD2 4.38Å; P270-Y303 HydrophobicContact CG-CE1 4.06Å; P270-Y303 HydrophobicContact CG-CE2 3.96Å; Q271-Y303 HydrophobicContact CG-CE2 4.13Å; G301-Y303 PolarHBondContact O-N 2.87Å; Y303-G305 PolarHBondContact O-N 2.76Å; Y303-S306 VanDerWaalsContact O-CB 3.24Å; Y303-S306 WeakPolarHBondContact O-CB 3.42Å; Y303-S306 PolarHBondContact O-N 2.89Å; Y303-S306 PolarHBondContact O-OG 3.46Å; Y303-M327 HydrophobicContact CD1-CE 4.36Å; Y303-M327 HydrophobicContact CG-CE 4.39Å; Y303-M327 HydrophobicContact CG-SD 4.29Å
304	F	97.1	Very high	94.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-57.2	126.3	178.5	177.7	-84.8	0	0	0	112.2	P270 K275 G276 K277 V295 S302 V323 G324 A325 H339 Y341	P270-F304 VanDerWaalsContact CA-O 3.27Å; P270-F304 WeakPolarHBondContact CA-O 3.42Å; K275-F304 WeakPolarHBondContact O-CB 3.27Å; G276-F304 CarbonylContact C-O 3.54Å; G276-F304 WeakPolarHBondContact CA-O 3.37Å; K277-F304 PolarHBondContact N-O 2.92Å; V295-F304 HydrophobicContact CG2-CE1 4.16Å; V295-F304 HydrophobicContact CG2-CZ 4.1Å; S302-F304 PolarHBondContact O-N 3.08Å; F304-V323 HydrophobicContact CD1-CG1 3.85Å; F304-V323 HydrophobicContact CD2-CB 4.44Å; F304-V323 HydrophobicContact CD2-CG1 3.92Å; F304-V323 HydrophobicContact CE1-CB 4.29Å; F304-V323 HydrophobicContact CE1-CG1 3.59Å; F304-V323 HydrophobicContact CE2-CB 3.8Å; F304-V323 HydrophobicContact CE2-CG1 3.66Å; F304-V323 HydrophobicContact CG-CG1 4.01Å; F304-V323 HydrophobicContact CZ-CB 3.71Å; F304-V323 HydrophobicContact CZ-CG1 3.49Å; F304-V323 VanDerWaalsContact CZ-CG1 3.49Å; F304-V323 HydrophobicContact CZ-CG2 4.04Å; F304-G324 CarbonylContact C-O 3.49Å; F304-G324 WeakPolarHBondContact CA-O 3.4Å; F304-A325 HydrophobicContact CB-CB 4.1Å; F304-A325 HydrophobicContact CD2-CB 4.26Å; F304-H339 AromaticContact CD2-CD2 3.79Å; F304-H339 HydrophobicContact CE2-CB 3.88Å; F304-H339 AromaticContact CE2-CD2 3.73Å; F304-H339 AromaticContact CE2-CG 3.68Å; F304-Y341 HydrophobicContact CE2-CE2 4.33Å; F304-Y341 AromaticContact CZ-CE2 3.98Å; F304-Y341 HydrophobicContact CZ-CE2 3.98Å
305	G	95.9	Very high	94.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	92	16.9	-175.3	0	0	0	0	0	113.6	G268 Y303 V323 G324	G268-G305 CarbonylContact C-O 3.58Å; G268-G305 VanDerWaalsContact CA-O 3.23Å; G268-G305 WeakPolarHBondContact CA-O 3.5Å; Y303-G305 PolarHBondContact O-N 2.76Å; G305-V323 VanDerWaalsContact N-CG1 3.33Å; G305-G324 PolarHBondContact N-O 2.93Å
306	S	95.3	Very high	94.8	Very high	12 Å²	12	34.3 Å²	34.3	8%	0.084	20%	0.199	C	C	.	.	S	Bend	trans	-81.8	-23.9	172.5	50.2	0	0	0	0	113.5	A251 Y303 P326	A251-S306 WeakPolarHBondContact CB-O 3.48Å; Y303-S306 VanDerWaalsContact O-CB 3.24Å; Y303-S306 WeakPolarHBondContact O-CB 3.42Å; Y303-S306 PolarHBondContact O-N 2.89Å; Y303-S306 PolarHBondContact O-OG 3.46Å; S306-P326 WeakPolarHBondContact OG-CD 3.35Å; S306-P326 WeakPolarHBondContact OG-CG 3.4Å
307	S	97.2	Very high	94.8	Very high	10 Å²	10	33 Å²	33	7%	0.07	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	148.8	169	71.5	0	0	0	0	109	G324 G367 E368	S307-G324 PolarHBondContact O-N 3.04Å; S307-G324 WeakPolarHBondContact OG-CA 3.5Å; S307-G367 PolarHBondContact OG-O 2.95Å; S307-E368 WeakPolarHBondContact CB-O 3.3Å
308	L	97.6	Very high	95	Very high	22 Å²	22	34 Å²	34	12%	0.115	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	140.4	-177.6	-62.4	171.7	0	0	0	108.9	A251 V266 A278 L321 L322 V323	A251-L308 HydrophobicContact CB-CB 4.46Å; A251-L308 HydrophobicContact CB-CD1 4Å; A251-L308 HydrophobicContact CB-CG 3.95Å; V266-L308 HydrophobicContact CB-CD1 4.34Å; V266-L308 HydrophobicContact CG1-CD1 3.79Å; A278-L308 HydrophobicContact CB-CD2 3.9Å; L308-L321 HydrophobicContact CD2-CD1 4.3Å; L308-L322 WeakPolarHBondContact CA-O 3.46Å; L308-V323 HydrophobicContact CD2-CB 4.33Å; L308-V323 HydrophobicContact CD2-CG1 3.94Å; L308-V323 HydrophobicContact CD2-CG2 3.94Å
309	C	97.7	Very high	95.3	Very high	8 Å²	8	28.9 Å²	28.9	5%	0.054	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	128.4	167.9	-176.3	0	0	0	0	109	L322 I370 D372	C309-L322 HydrophobicContact CB-CB 4.23Å; C309-L322 PolarHBondContact N-O 3.26Å; C309-L322 PolarHBondContact O-N 2.69Å; C309-I370 HydrophobicContact CB-CB 3.77Å; C309-I370 HydrophobicContact CB-CG2 3.31Å; C309-D372 PolarHBondContact SG-N 3.16Å
310	V	97.3	Very high	95.6	Very high	23 Å²	23	25.6 Å²	25.6	14%	0.139	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	113.7	-179.3	-177.8	0	0	0	0	106.8	F257 V266 S319 D320 L321	F257-V310 HydrophobicContact CE2-CG1 3.66Å; F257-V310 HydrophobicContact CE2-CG2 4.36Å; F257-V310 HydrophobicContact CZ-CB 4.43Å; F257-V310 HydrophobicContact CZ-CG1 3.55Å; F257-V310 HydrophobicContact CZ-CG2 4.06Å; V266-V310 HydrophobicContact CB-CG2 4.33Å; V266-V310 HydrophobicContact CG2-CG2 3.72Å; V310-S319 VanDerWaalsContact CG1-CB 3.45Å; V310-D320 WeakPolarHBondContact CA-O 3.39Å; V310-L321 HydrophobicContact CG2-CD1 4.01Å
311	V	96.6	Very high	95.9	Very high	6 Å²	6	20.4 Å²	20.4	4%	0.036	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	141.8	-170.1	55.9	0	0	0	0	109	L313 D320 L322 D372 P382 V384	V311-L313 HydrophobicContact CG1-CD2 3.62Å; V311-L313 HydrophobicContact CG1-CG 3.95Å; V311-L313 HydrophobicContact CG2-CD2 4.41Å; V311-L313 PolarHBondContact O-N 3.33Å; V311-D320 PolarHBondContact N-O 2.73Å; V311-D320 VanDerWaalsContact N-O 3.16Å; V311-D320 CarbonylContact O-C 3.58Å; V311-D320 VanDerWaalsContact O-CA 3.31Å; V311-D320 WeakPolarHBondContact O-CA 2.94Å; V311-D320 WeakPolarHBondContact O-CB 3.27Å; V311-D320 PolarHBondContact O-N 2.85Å; V311-L322 HydrophobicContact CG1-CD1 3.64Å; V311-D372 HydrophobicContact CB-CB 4.42Å; V311-D372 HydrophobicContact CG2-CB 4.48Å; V311-P382 HydrophobicContact CG2-CB 3.56Å; V311-P382 HydrophobicContact CG2-CG 4.35Å; V311-V384 HydrophobicContact CG1-CG1 3.85Å
312	D	97.1	Very high	96.3	Very high	35 Å²	35	18.1 Å²	18.1	19%	0.187	11%	0.113	C	C	.	.			trans	-84.5	93.3	175.7	175.9	0.4	0	0	0	108.7	N314 A315 D316 G317 L318 P382	D312-N314 PolarHBondContact OD1-OD1 2.78Å; D312-N314 VanDerWaalsContact OD1-OD1 3.08Å; D312-A315 WeakPolarHBondContact OD1-CA 3.24Å; D312-A315 PolarHBondContact OD1-N 2.84Å; D312-A315 WeakPolarHBondContact OD2-CA 3.44Å; D312-D316 PolarHBondContact OD1-N 3Å; D312-D316 PolarHBondContact OD2-N 2.87Å; D312-G317 VanDerWaalsContact OD2-CA 3.3Å; D312-G317 WeakPolarHBondContact OD2-CA 3.3Å; D312-G317 PolarHBondContact OD2-N 3.31Å; D312-L318 WeakPolarHBondContact CA-O 3.49Å; D312-L318 WeakPolarHBondContact CB-O 3.38Å; D312-P382 WeakPolarHBondContact O-CD 3.4Å; D312-P382 WeakPolarHBondContact O-CG 3.35Å
313	L	96.4	Very high	96.5	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.112	C	C	.	.	S	Bend	trans	-76.7	-28.1	-169.7	-62.3	163.4	0	0	0	112.4	V311 D320 L322 V340 I342 V384 R404 G407 I408	V311-L313 HydrophobicContact CG1-CD2 3.62Å; V311-L313 HydrophobicContact CG1-CG 3.95Å; V311-L313 HydrophobicContact CG2-CD2 4.41Å; V311-L313 PolarHBondContact O-N 3.33Å; L313-D320 VanDerWaalsContact CB-OD2 3.27Å; L313-D320 WeakPolarHBondContact CB-OD2 3.42Å; L313-D320 HydrophobicContact CD1-CB 3.9Å; L313-D320 HydrophobicContact CG-CB 4.15Å; L313-D320 PolarHBondContact N-OD2 3.27Å; L313-L322 HydrophobicContact CD1-CD1 3.83Å; L313-L322 HydrophobicContact CD2-CD1 4.26Å; L313-L322 HydrophobicContact CG-CD1 4.36Å; L313-V340 HydrophobicContact CD1-CG1 3.92Å; L313-I342 HydrophobicContact CD1-CD1 3.94Å; L313-V384 HydrophobicContact CD2-CG1 3.93Å; L313-R404 PolarHBondContact O-N 3.36Å; L313-G407 WeakPolarHBondContact CB-O 3.43Å; L313-I408 HydrophobicContact CD1-CB 4.19Å; L313-I408 HydrophobicContact CD1-CG2 4.45Å; L313-I408 HydrophobicContact CD2-CB 4.45Å; L313-I408 HydrophobicContact CD2-CD1 4.18Å
314	N	94.6	Very high	96.7	Very high	29 Å²	29	16.2 Å²	16.2	16%	0.155	11%	0.106	C	C	.	.	S	Bend	trans	-103.9	6.3	-177.2	66	-17.7	0	0	0	113.6	D312 D316 Y381 R404 K405	D312-N314 PolarHBondContact OD1-OD1 2.78Å; D312-N314 VanDerWaalsContact OD1-OD1 3.08Å; N314-D316 VanDerWaalsContact C-N 3.29Å; N314-D316 PolarHBondContact ND2-OD2 3.31Å; N314-D316 PolarHBondContact O-N 2.94Å; N314-D316 VanDerWaalsContact OD1-CG 3.27Å; N314-D316 PolarHBondContact OD1-OD2 3.39Å; N314-Y381 WeakPolarHBondContact O-CE1 3.33Å; N314-R404 WeakPolarHBondContact CA-O 3.32Å; N314-K405 WeakPolarHBondContact CB-O 3.26Å
315	A	95.3	Very high	96.7	Very high	51 Å²	51	16.2 Å²	16.2	42%	0.421	11%	0.106	S	C	.	.			trans	55	38	177.4	0	0	0	0	0	113.8	D312 Y381	D312-A315 WeakPolarHBondContact OD1-CA 3.24Å; D312-A315 PolarHBondContact OD1-N 2.84Å; D312-A315 WeakPolarHBondContact OD2-CA 3.44Å; A315-Y381 HydrophobicContact CB-CD1 3.86Å; A315-Y381 HydrophobicContact CB-CE1 4.03Å
316	D	94.2	Very high	96.7	Very high	78 Å²	78	16.2 Å²	16.2	42%	0.417	11%	0.106	S	C	.	.	S	Bend	trans	-93.3	-2.5	-179.7	74.7	13.7	0	0	0	114	D312 N314 L318	D312-D316 PolarHBondContact OD1-N 3Å; D312-D316 PolarHBondContact OD2-N 2.87Å; N314-D316 VanDerWaalsContact C-N 3.29Å; N314-D316 PolarHBondContact ND2-OD2 3.31Å; N314-D316 PolarHBondContact O-N 2.94Å; N314-D316 VanDerWaalsContact OD1-CG 3.27Å; N314-D316 PolarHBondContact OD1-OD2 3.39Å; D316-L318 WeakPolarHBondContact OD1-CA 3.46Å; D316-L318 WeakPolarHBondContact OD1-CB 3.42Å; D316-L318 PolarHBondContact OD1-N 2.92Å
317	G	93.9	Very high	96.7	Very high	33 Å²	33	18.2 Å²	18.2	34%	0.34	11%	0.114	S	C	.	.	S	Bend	trans	90.9	-1.9	-179.4	0	0	0	0	0	114.1	D312	D312-G317 VanDerWaalsContact OD2-CA 3.3Å; D312-G317 WeakPolarHBondContact OD2-CA 3.3Å; D312-G317 PolarHBondContact OD2-N 3.31Å
318	L	96.2	Very high	96.6	Very high	22 Å²	22	17.8 Å²	17.8	12%	0.115	11%	0.111	C	C	.	.	S	Bend	trans	-109.2	145.5	172	-61.2	175.6	0	0	0	110.2	H256 P260 D312 D316 N343	H256-L318 CarbonylContact O-C 3.54Å; H256-L318 WeakPolarHBondContact O-CA 3.4Å; P260-L318 HydrophobicContact CG-CD2 4.29Å; D312-L318 WeakPolarHBondContact CA-O 3.49Å; D312-L318 WeakPolarHBondContact CB-O 3.38Å; D316-L318 WeakPolarHBondContact OD1-CA 3.46Å; D316-L318 WeakPolarHBondContact OD1-CB 3.42Å; D316-L318 PolarHBondContact OD1-N 2.92Å; L318-N343 HydrophobicContact CB-CB 4.42Å
319	S	97.1	Very high	96.2	Very high	11 Å²	11	19.9 Å²	19.9	8%	0.077	13%	0.125	C	C	.	.			trans	-80.6	133.2	176.4	-56	0	0	0	0	111.4	H256 F257 V310 N343	H256-S319 PolarHBondContact N-OG 2.92Å; H256-S319 PolarHBondContact O-N 2.86Å; F257-S319 WeakPolarHBondContact CD1-O 3.31Å; F257-S319 WeakPolarHBondContact CE1-O 3.35Å; V310-S319 VanDerWaalsContact CG1-CB 3.45Å; S319-N343 WeakPolarHBondContact O-CB 3.44Å; S319-N343 PolarHBondContact O-ND2 2.95Å
320	D	97.8	Very high	95.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	168.3	165.7	-57.1	-47.6	0	0	0	110.7	V310 V311 L313 Y341 I342 N343	V310-D320 WeakPolarHBondContact CA-O 3.39Å; V311-D320 PolarHBondContact N-O 2.73Å; V311-D320 VanDerWaalsContact N-O 3.16Å; V311-D320 CarbonylContact O-C 3.58Å; V311-D320 VanDerWaalsContact O-CA 3.31Å; V311-D320 WeakPolarHBondContact O-CA 2.94Å; V311-D320 WeakPolarHBondContact O-CB 3.27Å; V311-D320 PolarHBondContact O-N 2.85Å; L313-D320 VanDerWaalsContact CB-OD2 3.27Å; L313-D320 WeakPolarHBondContact CB-OD2 3.42Å; L313-D320 HydrophobicContact CD1-CB 3.9Å; L313-D320 HydrophobicContact CG-CB 4.15Å; L313-D320 PolarHBondContact N-OD2 3.27Å; D320-Y341 WeakPolarHBondContact CB-O 3.41Å; D320-I342 HydrophobicContact CB-CD1 4.35Å; D320-I342 VanDerWaalsContact OD1-CA 3.25Å; D320-I342 WeakPolarHBondContact OD1-CA 3.39Å; D320-N343 PolarHBondContact OD1-N 2.91Å
321	L	98.2	Very high	94.5	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	122.5	-177.8	-178.9	66.3	0	0	0	111.5	F257 V266 V295 L308 V310 V323 Y341 L349	F257-L321 HydrophobicContact CE1-CB 4.13Å; F257-L321 HydrophobicContact CZ-CB 4.42Å; V266-L321 HydrophobicContact CG1-CD1 4.01Å; V266-L321 HydrophobicContact CG1-CD2 4.4Å; V295-L321 HydrophobicContact CG2-CD2 4Å; L308-L321 HydrophobicContact CD2-CD1 4.3Å; V310-L321 HydrophobicContact CG2-CD1 4.01Å; L321-V323 HydrophobicContact CD1-CG2 4.38Å; L321-V323 HydrophobicContact CD2-CG2 3.81Å; L321-V323 HydrophobicContact CG-CG2 3.74Å; L321-Y341 PolarHBondContact N-O 3.47Å; L321-Y341 WeakPolarHBondContact O-CB 3.37Å; L321-Y341 PolarHBondContact O-N 3.18Å; L321-L349 HydrophobicContact CB-CD1 4.22Å; L321-L349 HydrophobicContact CD2-CD1 3.83Å
322	L	98.5	Very high	93.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	133.4	164.9	-64.7	80.1	0	0	0	109.9	L308 C309 V311 L313 V338 H339 V340 L356 I370 V384 I408	L308-L322 WeakPolarHBondContact CA-O 3.46Å; C309-L322 HydrophobicContact CB-CB 4.23Å; C309-L322 PolarHBondContact N-O 3.26Å; C309-L322 PolarHBondContact O-N 2.69Å; V311-L322 HydrophobicContact CG1-CD1 3.64Å; L313-L322 HydrophobicContact CD1-CD1 3.83Å; L313-L322 HydrophobicContact CD2-CD1 4.26Å; L313-L322 HydrophobicContact CG-CD1 4.36Å; L322-V338 HydrophobicContact CB-CG1 3.87Å; L322-V338 HydrophobicContact CD2-CG1 4.04Å; L322-V338 HydrophobicContact CG-CG1 4.38Å; L322-H339 CarbonylContact C-O 3.56Å; L322-H339 VanDerWaalsContact CA-O 3.3Å; L322-H339 WeakPolarHBondContact CA-O 3.36Å; L322-V340 HydrophobicContact CD2-CG2 4.48Å; L322-V340 HydrophobicContact CG-CG2 4.39Å; L322-L356 HydrophobicContact CD2-CD1 4Å; L322-I370 HydrophobicContact CB-CD1 4.19Å; L322-I370 HydrophobicContact CB-CG2 4.38Å; L322-I370 HydrophobicContact CD2-CG2 4.21Å; L322-V384 HydrophobicContact CD2-CG1 4.42Å; L322-V384 HydrophobicContact CD2-CG2 4.04Å; L322-I408 HydrophobicContact CD2-CD1 4.31Å
323	V	98.6	Very high	93.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	121.2	-179.1	-171.2	0	0	0	0	110.6	A278 V295 F304 G305 L308 L321 V338 H339 Y341	A278-V323 HydrophobicContact CB-CG2 4.42Å; V295-V323 HydrophobicContact CG2-CG2 4.13Å; F304-V323 HydrophobicContact CD1-CG1 3.85Å; F304-V323 HydrophobicContact CD2-CB 4.44Å; F304-V323 HydrophobicContact CD2-CG1 3.92Å; F304-V323 HydrophobicContact CE1-CB 4.29Å; F304-V323 HydrophobicContact CE1-CG1 3.59Å; F304-V323 HydrophobicContact CE2-CB 3.8Å; F304-V323 HydrophobicContact CE2-CG1 3.66Å; F304-V323 HydrophobicContact CG-CG1 4.01Å; F304-V323 HydrophobicContact CZ-CB 3.71Å; F304-V323 HydrophobicContact CZ-CG1 3.49Å; F304-V323 VanDerWaalsContact CZ-CG1 3.49Å; F304-V323 HydrophobicContact CZ-CG2 4.04Å; G305-V323 VanDerWaalsContact N-CG1 3.33Å; L308-V323 HydrophobicContact CD2-CB 4.33Å; L308-V323 HydrophobicContact CD2-CG1 3.94Å; L308-V323 HydrophobicContact CD2-CG2 3.94Å; L321-V323 HydrophobicContact CD1-CG2 4.38Å; L321-V323 HydrophobicContact CD2-CG2 3.81Å; L321-V323 HydrophobicContact CG-CG2 3.74Å; V323-V338 WeakPolarHBondContact O-CA 3.37Å; V323-H339 PolarHBondContact N-O 2.99Å; V323-H339 PolarHBondContact O-N 3.22Å; V323-Y341 HydrophobicContact CB-CE2 4.39Å; V323-Y341 HydrophobicContact CG2-CD2 4.08Å; V323-Y341 HydrophobicContact CG2-CE2 3.95Å
324	G	97.9	Very high	93	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	139.2	178.2	0	0	0	0	0	113.2	F304 G305 S307	F304-G324 CarbonylContact C-O 3.49Å; F304-G324 WeakPolarHBondContact CA-O 3.4Å; G305-G324 PolarHBondContact N-O 2.93Å; S307-G324 PolarHBondContact O-N 3.04Å; S307-G324 WeakPolarHBondContact OG-CA 3.5Å
325	A	97.3	Very high	92.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	72	172.2	0	0	0	0	0	108.8	S302 F304 M327 A328 G336 R337	S302-A325 CarbonylContact O-C 3.6Å; S302-A325 VanDerWaalsContact O-C 3.25Å; S302-A325 WeakPolarHBondContact O-CA 3.3Å; F304-A325 HydrophobicContact CB-CB 4.1Å; F304-A325 HydrophobicContact CD2-CB 4.26Å; A325-M327 PolarHBondContact O-N 2.91Å; A325-M327 VanDerWaalsContact O-N 3.17Å; A325-A328 HydrophobicContact CB-CB 4.09Å; A325-A328 WeakPolarHBondContact O-CB 3.45Å; A325-A328 PolarHBondContact O-N 2.78Å; A325-G336 WeakPolarHBondContact O-CA 3.26Å; A325-R337 PolarHBondContact N-O 2.86Å; A325-R337 PolarHBondContact O-N 3.39Å
326	P	96.4	Very high	92.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-19.8	-171.1	24.4	-33.4	0	0	0	114	S306 G336 R365 F366 E368	S306-P326 WeakPolarHBondContact OG-CD 3.35Å; S306-P326 WeakPolarHBondContact OG-CG 3.4Å; P326-G336 WeakPolarHBondContact O-CA 3.39Å; P326-R365 HydrophobicContact CB-CB 4.04Å; P326-R365 WeakPolarHBondContact O-CA 3.4Å; P326-F366 WeakPolarHBondContact CA-O 3.26Å; P326-E368 HydrophobicContact CB-CB 4.25Å; P326-E368 WeakPolarHBondContact CB-OE2 3.45Å
327	M	95.1	Very high	93	Very high	54 Å²	54	29.1 Å²	29.1	27%	0.266	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98	6.6	177.7	-58.3	-173.7	-174.3	0	0	112.7	G301 S302 Y303 A325	G301-M327 VanDerWaalsContact O-CB 3.3Å; G301-M327 WeakPolarHBondContact O-CB 3.47Å; S302-M327 PolarHBondContact O-N 3.37Å; S302-M327 VanDerWaalsContact O-N 3.13Å; Y303-M327 HydrophobicContact CD1-CE 4.36Å; Y303-M327 HydrophobicContact CG-CE 4.39Å; Y303-M327 HydrophobicContact CG-SD 4.29Å; A325-M327 PolarHBondContact O-N 2.91Å; A325-M327 VanDerWaalsContact O-N 3.17Å
328	A	94.4	Very high	93.2	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.008	15%	0.153	C	C	.	.			trans	-59.6	142	175.5	0	0	0	0	0	111.5	E299 A325 E335 G336 R337	E299-A328 WeakPolarHBondContact OE2-CA 3.39Å; E299-A328 WeakPolarHBondContact OE2-CB 3.45Å; A325-A328 HydrophobicContact CB-CB 4.09Å; A325-A328 WeakPolarHBondContact O-CB 3.45Å; A325-A328 PolarHBondContact O-N 2.78Å; A328-E335 PolarHBondContact O-N 3.08Å; A328-G336 PolarHBondContact O-N 2.86Å; A328-G336 VanDerWaalsContact O-N 3.1Å; A328-R337 HydrophobicContact CB-CB 3.91Å; A328-R337 HydrophobicContact CB-CG 3.71Å
329	T	90.4	Very high	93.3	Very high	65 Å²	65	27 Å²	27	40%	0.399	15%	0.149	S	C	.	.			trans	-118.2	124.1	-178.2	-64.4	0	0	0	0	110	E299 E334	E299-T329 WeakPolarHBondContact OE1-CB 3.41Å; E299-T329 PolarHBondContact OE1-N 3.35Å; E299-T329 PolarHBondContact OE2-N 2.92Å; T329-E334 PolarHBondContact OG1-N 2.86Å
330	G	81.1	Confident	93.3	Very high	47 Å²	47	26.5 Å²	26.5	49%	0.485	15%	0.146	S	C	.	.	S	Bend	trans	-120.5	-95.3	170.3	0	0	0	0	0	110.4	E335	G330-E335 WeakPolarHBondContact CA-OE1 3.47Å; G330-E335 PolarHBondContact N-OE1 2.75Å
331	T	78.1	Confident	93.3	Very high	116 Å²	116	26.9 Å²	26.9	71%	0.712	15%	0.148	S	C	*	.	S	Bend	trans	-80.3	-42.1	-179.1	62.2	0	0	0	0	112.2	E335	T331-E335 PolarHBondContact N-OE1 3.08Å; T331-E335 PolarHBondContact N-OE2 3.22Å; T331-E335 PolarHBondContact OG1-OE2 2.76Å
332	S	82.9	Confident	93.3	Very high	38 Å²	38	27.8 Å²	27.8	27%	0.266	15%	0.152	S	C	.	.	S	Bend	trans	-111.4	154.6	174.3	-63.6	0	0	0	0	109.6	E335 D360	S332-E335 PolarHBondContact N-OE2 2.8Å; S332-E335 WeakPolarHBondContact O-CG 3.17Å; S332-D360 WeakPolarHBondContact CB-O 3.34Å; S332-D360 PolarHBondContact OG-O 2.88Å; S332-D360 VanDerWaalsContact OG-O 3.13Å
333	R	86.3	Confident	93.2	Very high	150 Å²	150	27.8 Å²	27.8	57%	0.566	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	133.9	175.3	178.2	175.5	171.1	176.2	0.2	110.7	E335 Y362 A363	R333-E335 PolarHBondContact O-N 3.45Å; R333-Y362 HydrophobicContact CB-CD2 4.16Å; R333-Y362 HydrophobicContact CB-CE2 3.9Å; R333-Y362 HydrophobicContact CG-CE2 4.43Å; R333-A363 PolarHBondContact O-N 2.97Å
334	E	88.5	Confident	93	Very high	37 Å²	37	33.3 Å²	33.3	17%	0.173	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	34.4	173.4	-65.6	168.4	-142.4	0	0	113.8	T329 G336 A363 A364 R365	T329-E334 PolarHBondContact OG1-N 2.86Å; E334-G336 VanDerWaalsContact C-N 3.3Å; E334-A363 HydrophobicContact CB-CB 4.47Å; E334-A363 CarbonylContact O-C 3.49Å; E334-A363 WeakPolarHBondContact O-CA 3.44Å; E334-A364 PolarHBondContact O-N 3.16Å; E334-R365 PolarHBondContact O-N 2.89Å
335	E	92.9	Very high	92.7	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.009	19%	0.186	C	C	.	.			trans	-67.1	-32.5	174.1	55	-171.3	-163.7	0	0	112.2	A328 G330 T331 S332 R333 R337 F366	A328-E335 PolarHBondContact O-N 3.08Å; G330-E335 WeakPolarHBondContact CA-OE1 3.47Å; G330-E335 PolarHBondContact N-OE1 2.75Å; T331-E335 PolarHBondContact N-OE1 3.08Å; T331-E335 PolarHBondContact N-OE2 3.22Å; T331-E335 PolarHBondContact OG1-OE2 2.76Å; S332-E335 PolarHBondContact N-OE2 2.8Å; S332-E335 WeakPolarHBondContact O-CG 3.17Å; R333-E335 PolarHBondContact O-N 3.45Å; E335-R337 IonicContact OE1-CZ 3.03Å; E335-R337 IonicContact OE1-NE 2.69Å; E335-R337 IonicContact OE1-NH1 3.39Å; E335-R337 PolarHBondContact OE1-NH1 3.08Å; E335-R337 IonicContact OE1-NH2 2.64Å; E335-R337 PolarHBondContact OE1-NH2 3.49Å; E335-F366 VanDerWaalsContact O-CB 3.22Å; E335-F366 WeakPolarHBondContact O-CB 3.48Å; E335-F366 PolarHBondContact O-N 3.26Å
336	G	95.3	Very high	92.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.22	C	C	.	.			trans	86	153.1	177.9	0	0	0	0	0	113.9	A325 P326 A328 E334 F366	A325-G336 WeakPolarHBondContact O-CA 3.26Å; P326-G336 WeakPolarHBondContact O-CA 3.39Å; A328-G336 PolarHBondContact O-N 2.86Å; A328-G336 VanDerWaalsContact O-N 3.1Å; E334-G336 VanDerWaalsContact C-N 3.3Å; G336-F366 CarbonylContact C-O 3.55Å; G336-F366 VanDerWaalsContact C-O 3.3Å; G336-F366 VanDerWaalsContact CA-O 3.23Å; G336-F366 WeakPolarHBondContact CA-O 3.45Å
337	R	96.1	Very high	92.1	Very high	35 Å²	35	41.5 Å²	41.5	13%	0.132	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	151.9	-177.2	-66.2	-64.7	-179.2	-112.6	17.1	111	A325 A328 E335 T357 D360 F366	A325-R337 PolarHBondContact N-O 2.86Å; A325-R337 PolarHBondContact O-N 3.39Å; A328-R337 HydrophobicContact CB-CB 3.91Å; A328-R337 HydrophobicContact CB-CG 3.71Å; E335-R337 IonicContact OE1-CZ 3.03Å; E335-R337 IonicContact OE1-NE 2.69Å; E335-R337 IonicContact OE1-NH1 3.39Å; E335-R337 PolarHBondContact OE1-NH1 3.08Å; E335-R337 IonicContact OE1-NH2 2.64Å; E335-R337 PolarHBondContact OE1-NH2 3.49Å; R337-T357 VanDerWaalsContact CZ-CG2 3.49Å; R337-D360 IonicContact CZ-OD1 2.66Å; R337-D360 IonicContact NH1-OD1 3Å; R337-D360 PolarHBondContact NH1-OD1 2.8Å; R337-D360 IonicContact NH2-OD1 3.9Å; R337-D360 PolarHBondContact NH2-OD1 3.11Å; R337-D360 VanDerWaalsContact NH2-OD1 3.11Å; R337-F366 PolarHBondContact N-O 3.14Å
338	V	98	Very high	92.1	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	126.6	165.6	177.8	0	0	0	0	109.1	L322 V323 L356 F366 I370 V386	L322-V338 HydrophobicContact CB-CG1 3.87Å; L322-V338 HydrophobicContact CD2-CG1 4.04Å; L322-V338 HydrophobicContact CG-CG1 4.38Å; V323-V338 WeakPolarHBondContact O-CA 3.37Å; V338-L356 HydrophobicContact CB-CB 4.14Å; V338-L356 HydrophobicContact CB-CD1 4.29Å; V338-L356 HydrophobicContact CB-CG 4.49Å; V338-L356 HydrophobicContact CG1-CD1 4.17Å; V338-L356 PolarHBondContact N-O 2.78Å; V338-L356 PolarHBondContact O-N 3.01Å; V338-F366 HydrophobicContact CB-CE1 4.21Å; V338-F366 HydrophobicContact CG2-CD1 4.2Å; V338-F366 HydrophobicContact CG2-CE1 3.74Å; V338-I370 HydrophobicContact CB-CD1 4.38Å; V338-I370 HydrophobicContact CG1-CD1 3.62Å; V338-I370 HydrophobicContact CG2-CD1 3.82Å; V338-I370 HydrophobicContact CG2-CG1 4.14Å; V338-V386 HydrophobicContact CG2-CG1 3.8Å; V338-V386 HydrophobicContact CG2-CG2 4.41Å
339	H	97.8	Very high	92.2	Very high	9 Å²	9	46.3 Å²	46.3	4%	0.042	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	139	174.9	-70	-111.8	0	0	0	109.5	F304 L322 V323 Y341 E351 K355	F304-H339 AromaticContact CD2-CD2 3.79Å; F304-H339 HydrophobicContact CE2-CB 3.88Å; F304-H339 AromaticContact CE2-CD2 3.73Å; F304-H339 AromaticContact CE2-CG 3.68Å; L322-H339 CarbonylContact C-O 3.56Å; L322-H339 VanDerWaalsContact CA-O 3.3Å; L322-H339 WeakPolarHBondContact CA-O 3.36Å; V323-H339 PolarHBondContact N-O 2.99Å; V323-H339 PolarHBondContact O-N 3.22Å; H339-Y341 HydrophobicContact CB-CD2 4.46Å; H339-Y341 HydrophobicContact CB-CE2 3.67Å; H339-E351 IonicContact CE1-OE1 2.65Å; H339-E351 IonicContact CG-OE1 3.87Å; H339-E351 IonicContact ND1-OE1 2.81Å; H339-E351 PolarHBondContact ND1-OE1 3.08Å; H339-K355 WeakPolarHBondContact CE1-CE 3.41Å; H339-K355 PolarHBondContact CE1-NZ 2.85Å
340	V	98.1	Very high	92.4	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	127.5	-178	-176.5	0	0	0	0	108.4	L313 L322 I342 E351 A352 L356 I408	L313-V340 HydrophobicContact CD1-CG1 3.92Å; L322-V340 HydrophobicContact CD2-CG2 4.48Å; L322-V340 HydrophobicContact CG-CG2 4.39Å; V340-I342 HydrophobicContact CG1-CD1 3.92Å; V340-E351 WeakPolarHBondContact O-CA 3.28Å; V340-A352 HydrophobicContact CB-CB 4.06Å; V340-A352 HydrophobicContact CG1-CB 4.48Å; V340-A352 PolarHBondContact O-N 3.3Å; V340-L356 HydrophobicContact CG2-CD1 4.02Å; V340-L356 HydrophobicContact CG2-CD2 4.28Å; V340-L356 HydrophobicContact CG2-CG 3.85Å; V340-I408 HydrophobicContact CB-CG2 4.45Å; V340-I408 HydrophobicContact CG1-CG2 3.85Å; V340-I408 HydrophobicContact CG2-CG2 3.97Å
341	Y	97.9	Very high	93.1	Very high	9 Å²	9	49.9 Å²	49.9	4%	0.035	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	112.4	177.9	-64	-87.7	0	0	0	109.5	V295 F304 D320 L321 V323 H339 L349 K350 E351	V295-Y341 HydrophobicContact CB-CE1 4.06Å; V295-Y341 HydrophobicContact CB-CE2 4.21Å; V295-Y341 HydrophobicContact CG1-CD1 3.81Å; V295-Y341 HydrophobicContact CG1-CD2 4.43Å; V295-Y341 HydrophobicContact CG1-CE1 3.77Å; V295-Y341 HydrophobicContact CG1-CE2 4.39Å; V295-Y341 HydrophobicContact CG1-CG 4.17Å; V295-Y341 HydrophobicContact CG2-CE2 4.17Å; F304-Y341 HydrophobicContact CE2-CE2 4.33Å; F304-Y341 AromaticContact CZ-CE2 3.98Å; F304-Y341 HydrophobicContact CZ-CE2 3.98Å; D320-Y341 WeakPolarHBondContact CB-O 3.41Å; L321-Y341 PolarHBondContact N-O 3.47Å; L321-Y341 WeakPolarHBondContact O-CB 3.37Å; L321-Y341 PolarHBondContact O-N 3.18Å; V323-Y341 HydrophobicContact CB-CE2 4.39Å; V323-Y341 HydrophobicContact CG2-CD2 4.08Å; V323-Y341 HydrophobicContact CG2-CE2 3.95Å; H339-Y341 HydrophobicContact CB-CD2 4.46Å; H339-Y341 HydrophobicContact CB-CE2 3.67Å; Y341-L349 HydrophobicContact CD1-CB 4.38Å; Y341-K350 CarbonylContact C-O 3.51Å; Y341-K350 WeakPolarHBondContact CA-O 3.44Å; Y341-E351 HydrophobicContact CD1-CB 3.74Å; Y341-E351 HydrophobicContact CD1-CG 4.04Å; Y341-E351 HydrophobicContact CE1-CB 3.53Å; Y341-E351 HydrophobicContact CE1-CG 3.58Å; Y341-E351 PolarHBondContact OH-OE2 2.81Å
342	I	97.3	Very high	93.9	Very high	19 Å²	19	45.3 Å²	45.3	10%	0.097	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	127.7	177.2	-53	-57.8	0	0	0	109.2	L313 D320 V340 K350	L313-I342 HydrophobicContact CD1-CD1 3.94Å; D320-I342 HydrophobicContact CB-CD1 4.35Å; D320-I342 VanDerWaalsContact OD1-CA 3.25Å; D320-I342 WeakPolarHBondContact OD1-CA 3.39Å; V340-I342 HydrophobicContact CG1-CD1 3.92Å; I342-K350 PolarHBondContact N-O 2.92Å; I342-K350 PolarHBondContact O-N 3.29Å
343	N	96.4	Very high	94.3	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	125.9	179.4	-169.9	-2.2	0	0	0	110.5	F257 L318 S319 D320 G345 L349	F257-N343 WeakPolarHBondContact CA-ND2 3.3Å; F257-N343 PolarHBondContact O-ND2 3.27Å; L318-N343 HydrophobicContact CB-CB 4.42Å; S319-N343 WeakPolarHBondContact O-CB 3.44Å; S319-N343 PolarHBondContact O-ND2 2.95Å; D320-N343 PolarHBondContact OD1-N 2.91Å; N343-G345 PolarHBondContact OD1-N 2.94Å; N343-L349 HydrophobicContact CB-CD2 4.03Å
344	Q	94.4	Very high	94.7	Very high	115 Å²	115	49.3 Å²	49.3	54%	0.537	24%	0.235	S	C	.	.			trans	-97	6.8	178.4	-56.3	-61.4	-67.8	0	0	112.5	Q348 K350	Q344-Q348 HydrophobicContact CB-CB 4.45Å; Q344-Q348 PolarHBondContact N-O 2.79Å; Q344-K350 HydrophobicContact CG-CB 3.79Å; Q344-K350 HydrophobicContact CG-CD 4.47Å
345	G	91.1	Very high	94.9	Very high	17 Å²	17	51.8 Å²	51.8	18%	0.175	25%	0.246	C	C	.	.	S	Bend	trans	108.8	151.5	-174.4	0	0	0	0	0	112.9	N343 A347 Q348	N343-G345 PolarHBondContact OD1-N 2.94Å; G345-A347 PolarHBondContact O-N 3.42Å; G345-A347 VanDerWaalsContact O-N 3.14Å; G345-Q348 VanDerWaalsContact O-CB 3.27Å; G345-Q348 WeakPolarHBondContact O-CB 3.28Å; G345-Q348 WeakPolarHBondContact O-CG 3.46Å; G345-Q348 PolarHBondContact O-N 2.76Å
346	E	89.8	Confident	95.1	Very high	153 Å²	153	51.7 Å²	51.7	72%	0.715	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.6	35.8	177.5	-58.7	-177.4	175.4	0	0	113.8	Q348	E346-Q348 PolarHBondContact O-N 2.94Å
347	A	92.4	Very high	95	Very high	2 Å²	2	53.9 Å²	53.9	2%	0.017	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	23.7	-174.6	0	0	0	0	0	115.3	F257 Q258 V292 S293 G345 L349	F257-A347 HydrophobicContact CB-CB 3.83Å; F257-A347 PolarHBondContact O-N 2.87Å; Q258-A347 HydrophobicContact CG-CB 4.24Å; V292-A347 HydrophobicContact CG1-CB 3.7Å; S293-A347 WeakPolarHBondContact CB-O 3.27Å; S293-A347 PolarHBondContact OG-O 2.8Å; G345-A347 PolarHBondContact O-N 3.42Å; G345-A347 VanDerWaalsContact O-N 3.14Å; A347-L349 PolarHBondContact O-N 2.99Å
348	Q	94.8	Very high	94.7	Very high	125 Å²	125	52.9 Å²	52.9	58%	0.584	26%	0.26	S	S	*	.			trans	-80.2	98.5	171.6	-64.5	-171	4.7	0	0	110.6	Q344 G345 E346	Q344-Q348 HydrophobicContact CB-CB 4.45Å; Q344-Q348 PolarHBondContact N-O 2.79Å; G345-Q348 VanDerWaalsContact O-CB 3.27Å; G345-Q348 WeakPolarHBondContact O-CB 3.28Å; G345-Q348 WeakPolarHBondContact O-CG 3.46Å; G345-Q348 PolarHBondContact O-N 2.76Å; E346-Q348 PolarHBondContact O-N 2.94Å
349	L	95.7	Very high	94.3	Very high	32 Å²	32	55.6 Å²	55.6	17%	0.168	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	119.1	-177.9	-69.4	-174.1	0	0	0	112	F257 I280 V295 L321 Y341 N343 A347	F257-L349 HydrophobicContact CD1-CD2 4.21Å; F257-L349 HydrophobicContact CE1-CD2 4.23Å; I280-L349 HydrophobicContact CD1-CD1 3.57Å; I280-L349 HydrophobicContact CD1-CG 4.24Å; V295-L349 HydrophobicContact CG1-CB 4.22Å; V295-L349 HydrophobicContact CG1-CD1 3.67Å; L321-L349 HydrophobicContact CB-CD1 4.22Å; L321-L349 HydrophobicContact CD2-CD1 3.83Å; Y341-L349 HydrophobicContact CD1-CB 4.38Å; N343-L349 HydrophobicContact CB-CD2 4.03Å; A347-L349 PolarHBondContact O-N 2.99Å
350	K	95.8	Very high	93.8	Very high	126 Å²	126	57.6 Å²	57.6	55%	0.548	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	119.8	173.2	-175.6	-176.8	177.1	-171.2	0	110.1	Y341 I342 Q344	Y341-K350 CarbonylContact C-O 3.51Å; Y341-K350 WeakPolarHBondContact CA-O 3.44Å; I342-K350 PolarHBondContact N-O 2.92Å; I342-K350 PolarHBondContact O-N 3.29Å; Q344-K350 HydrophobicContact CG-CB 3.79Å; Q344-K350 HydrophobicContact CG-CD 4.47Å
351	E	96.2	Very high	93.3	Very high	60 Å²	60	58.9 Å²	58.9	28%	0.28	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	136.2	175	-161.3	169.2	171.3	0	0	111	H298 H339 V340 Y341	H298-E351 IonicContact NE2-OE2 2.68Å; H339-E351 IonicContact CE1-OE1 2.65Å; H339-E351 IonicContact CG-OE1 3.87Å; H339-E351 IonicContact ND1-OE1 2.81Å; H339-E351 PolarHBondContact ND1-OE1 3.08Å; V340-E351 WeakPolarHBondContact O-CA 3.28Å; Y341-E351 HydrophobicContact CD1-CB 3.74Å; Y341-E351 HydrophobicContact CD1-CG 4.04Å; Y341-E351 HydrophobicContact CE1-CB 3.53Å; Y341-E351 HydrophobicContact CE1-CG 3.58Å; Y341-E351 PolarHBondContact OH-OE2 2.81Å
352	A	94.6	Very high	92.9	Very high	21 Å²	21	65.8 Å²	65.8	17%	0.174	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-65.8	150.4	172.1	0	0	0	0	0	110.9	V340 F354	V340-A352 HydrophobicContact CB-CB 4.06Å; V340-A352 HydrophobicContact CG1-CB 4.48Å; V340-A352 PolarHBondContact O-N 3.3Å; A352-F354 HydrophobicContact CB-CD1 4.31Å; A352-F354 HydrophobicContact CB-CE1 4.12Å; A352-F354 HydrophobicContact CB-CZ 4.36Å; A352-F354 PolarHBondContact O-N 2.87Å
353	E	91.9	Very high	92.7	Very high	201 Å²	201	65.7 Å²	65.7	94%	0.939	33%	0.33	S	S	*	.	S	Bend	trans	-69	-13.7	-180	-62.3	-174.2	172.4	0	0	113.2
354	F	92.9	Very high	92.6	Very high	70 Å²	70	65.8 Å²	65.8	31%	0.307	33%	0.33	S	S	.	.	S	Bend	trans	-118.3	165	177.2	65.4	-90.5	0	0	0	111.4	A352 L356 I408 P410	A352-F354 HydrophobicContact CB-CD1 4.31Å; A352-F354 HydrophobicContact CB-CE1 4.12Å; A352-F354 HydrophobicContact CB-CZ 4.36Å; A352-F354 PolarHBondContact O-N 2.87Å; F354-L356 HydrophobicContact CD2-CD2 4.26Å; F354-L356 HydrophobicContact CE2-CD2 3.74Å; F354-I408 HydrophobicContact CE2-CG2 4.11Å; F354-I408 HydrophobicContact CZ-CG2 3.94Å; F354-I408 WeakPolarHBondContact CZ-O 3.5Å; F354-P410 HydrophobicContact CD1-CB 4.42Å; F354-P410 HydrophobicContact CD2-CB 3.7Å; F354-P410 HydrophobicContact CE1-CB 4.49Å; F354-P410 HydrophobicContact CE2-CB 3.8Å; F354-P410 HydrophobicContact CG-CB 4.04Å; F354-P410 HydrophobicContact CZ-CB 4.21Å
355	K	94.3	Very high	92.6	Very high	90 Å²	90	63 Å²	63	39%	0.391	32%	0.315	S	S	.	.			trans	-117.9	148.1	171.3	-58.6	176.5	-172.4	-178.3	0	108.2	H339	H339-K355 WeakPolarHBondContact CE1-CE 3.41Å; H339-K355 PolarHBondContact CE1-NZ 2.85Å
356	L	96.1	Very high	92.9	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-75	138.1	172.6	-48.8	176.6	0	0	0	109.3	L322 V338 V340 F354 F366 Y401 I408	L322-L356 HydrophobicContact CD2-CD1 4Å; V338-L356 HydrophobicContact CB-CB 4.14Å; V338-L356 HydrophobicContact CB-CD1 4.29Å; V338-L356 HydrophobicContact CB-CG 4.49Å; V338-L356 HydrophobicContact CG1-CD1 4.17Å; V338-L356 PolarHBondContact N-O 2.78Å; V338-L356 PolarHBondContact O-N 3.01Å; V340-L356 HydrophobicContact CG2-CD1 4.02Å; V340-L356 HydrophobicContact CG2-CD2 4.28Å; V340-L356 HydrophobicContact CG2-CG 3.85Å; F354-L356 HydrophobicContact CD2-CD2 4.26Å; F354-L356 HydrophobicContact CE2-CD2 3.74Å; L356-F366 HydrophobicContact CB-CE1 4.03Å; L356-F366 HydrophobicContact CB-CZ 4.15Å; L356-F366 VanDerWaalsContact O-CE1 3.29Å; L356-F366 WeakPolarHBondContact O-CE1 3.25Å; L356-Y401 HydrophobicContact CB-CE1 4.14Å; L356-Y401 HydrophobicContact CD1-CD1 4.38Å; L356-Y401 HydrophobicContact CD1-CD2 4.36Å; L356-Y401 HydrophobicContact CD1-CG 4.27Å; L356-Y401 HydrophobicContact CD2-CD1 3.82Å; L356-Y401 HydrophobicContact CD2-CE1 3.88Å; L356-Y401 HydrophobicContact CD2-CG 4.48Å; L356-Y401 HydrophobicContact CG-CE1 4.42Å; L356-I408 HydrophobicContact CD1-CD1 3.98Å; L356-I408 HydrophobicContact CD2-CG2 4.33Å
357	T	93.8	Very high	93.3	Very high	45 Å²	45	55 Å²	55	28%	0.276	27%	0.273	S	S	.	.			trans	-133.3	139.5	-177.8	60.9	0	0	0	0	110.7	R337 Y401	R337-T357 VanDerWaalsContact CZ-CG2 3.49Å; T357-Y401 PolarHBondContact O-OH 2.62Å
358	G	89.9	Confident	93.5	Very high	15 Å²	15	56.7 Å²	56.7	16%	0.155	28%	0.28	C	S	.	.			trans	-79.9	-133	173.1	0	0	0	0	0	112.5	D360	G358-D360 VanDerWaalsContact C-N 3.32Å
359	S	88.9	Confident	93.6	Very high	56 Å²	56	51.7 Å²	51.7	39%	0.392	26%	0.258	S	S	.	.			trans	-85.5	1.1	176.6	58.1	0	0	0	0	114.7	A361 E391 Y399	S359-A361 PolarHBondContact O-N 3.22Å; S359-A361 VanDerWaalsContact O-N 3.12Å; S359-A361 WeakPolarHBondContact OG-CB 3.42Å; S359-A361 PolarHBondContact OG-N 3.01Å; S359-E391 WeakPolarHBondContact CB-OE1 3.43Å; S359-E391 PolarHBondContact OG-OE1 2.87Å; S359-Y399 VanDerWaalsContact CB-OH 3.3Å; S359-Y399 WeakPolarHBondContact CB-OH 3.42Å; S359-Y399 PolarHBondContact N-OH 3.16Å; S359-Y399 PolarHBondContact OG-OH 2.6Å
360	D	86.9	Confident	93.7	Very high	51 Å²	51	51 Å²	51	27%	0.273	26%	0.255	S	S	.	.			trans	54.3	24.6	-171.4	-62.7	-42.4	0	0	0	113.9	S332 R337 G358	S332-D360 WeakPolarHBondContact CB-O 3.34Å; S332-D360 PolarHBondContact OG-O 2.88Å; S332-D360 VanDerWaalsContact OG-O 3.13Å; R337-D360 IonicContact CZ-OD1 2.66Å; R337-D360 IonicContact NH1-OD1 3Å; R337-D360 PolarHBondContact NH1-OD1 2.8Å; R337-D360 IonicContact NH2-OD1 3.9Å; R337-D360 PolarHBondContact NH2-OD1 3.11Å; R337-D360 VanDerWaalsContact NH2-OD1 3.11Å; G358-D360 VanDerWaalsContact C-N 3.32Å
361	A	89.1	Confident	93.8	Very high	29 Å²	29	45.5 Å²	45.5	24%	0.24	23%	0.233	C	C	.	.			trans	-68	145.2	175.2	0	0	0	0	0	111.5	S359 A363 A364 E391	S359-A361 PolarHBondContact O-N 3.22Å; S359-A361 VanDerWaalsContact O-N 3.12Å; S359-A361 WeakPolarHBondContact OG-CB 3.42Å; S359-A361 PolarHBondContact OG-N 3.01Å; A361-A363 PolarHBondContact O-N 2.96Å; A361-A364 HydrophobicContact CB-CB 4.12Å; A361-A364 WeakPolarHBondContact O-CB 3.34Å; A361-A364 PolarHBondContact O-N 3.3Å; A361-E391 HydrophobicContact CB-CG 4.15Å
362	Y	89.3	Confident	93.8	Very high	154 Å²	154	46.2 Å²	46.2	60%	0.604	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	129.8	176.9	174.4	-94.9	0	0	0	111.4	R333 A364	R333-Y362 HydrophobicContact CB-CD2 4.16Å; R333-Y362 HydrophobicContact CB-CE2 3.9Å; R333-Y362 HydrophobicContact CG-CE2 4.43Å; Y362-A364 PolarHBondContact O-N 3.29Å; Y362-A364 VanDerWaalsContact O-N 3.09Å
363	A	91.7	Very high	93.8	Very high	17 Å²	17	45.3 Å²	45.3	14%	0.14	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	26.9	178.1	0	0	0	0	0	114.5	R333 E334 A361 R365 Q390	R333-A363 PolarHBondContact O-N 2.97Å; E334-A363 HydrophobicContact CB-CB 4.47Å; E334-A363 CarbonylContact O-C 3.49Å; E334-A363 WeakPolarHBondContact O-CA 3.44Å; A361-A363 PolarHBondContact O-N 2.96Å; A363-R365 PolarHBondContact O-N 2.84Å; A363-Q390 WeakPolarHBondContact O-CB 3.33Å
364	A	94.1	Very high	93.8	Very high	2 Å²	2	36.5 Å²	36.5	2%	0.017	19%	0.194	C	C	.	.			trans	-65.2	-26.8	-179.8	0	0	0	0	0	113.2	E334 A361 Y362 F366 A388 Q390 E391	E334-A364 PolarHBondContact O-N 3.16Å; A361-A364 HydrophobicContact CB-CB 4.12Å; A361-A364 WeakPolarHBondContact O-CB 3.34Å; A361-A364 PolarHBondContact O-N 3.3Å; Y362-A364 PolarHBondContact O-N 3.29Å; Y362-A364 VanDerWaalsContact O-N 3.09Å; A364-F366 VanDerWaalsContact C-N 3.34Å; A364-F366 PolarHBondContact O-N 2.83Å; A364-A388 CarbonylContact O-C 3.27Å; A364-A388 WeakPolarHBondContact O-CA 3.36Å; A364-Q390 PolarHBondContact O-N 2.84Å; A364-E391 HydrophobicContact CB-CB 3.96Å; A364-E391 HydrophobicContact CB-CG 4.13Å
365	R	95.4	Very high	93.8	Very high	57 Å²	57	35.1 Å²	35.1	22%	0.215	19%	0.19	C	C	.	.			trans	54.4	46.5	-176.1	-59.7	-166.1	-177.4	-167.1	-5.3	113.3	P326 E334 A363 G367 E368 Q390	P326-R365 HydrophobicContact CB-CB 4.04Å; P326-R365 WeakPolarHBondContact O-CA 3.4Å; E334-R365 PolarHBondContact O-N 2.89Å; A363-R365 PolarHBondContact O-N 2.84Å; R365-G367 PolarHBondContact O-N 2.84Å; R365-E368 WeakPolarHBondContact O-CB 3.06Å; R365-E368 PolarHBondContact O-N 2.89Å; R365-E368 VanDerWaalsContact O-N 3.17Å; R365-Q390 VanDerWaalsContact CD-CD 3.47Å; R365-Q390 HydrophobicContact CG-CB 4.47Å; R365-Q390 HydrophobicContact CG-CG 4.47Å; R365-Q390 VanDerWaalsContact NE-OE1 3.14Å
366	F	97.6	Very high	93.5	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.009	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	130.1	173.3	178.1	-91.7	0	0	0	110.6	P326 E335 G336 R337 V338 L356 A364 V386 A388 Y399 Y401	P326-F366 WeakPolarHBondContact CA-O 3.26Å; E335-F366 VanDerWaalsContact O-CB 3.22Å; E335-F366 WeakPolarHBondContact O-CB 3.48Å; E335-F366 PolarHBondContact O-N 3.26Å; G336-F366 CarbonylContact C-O 3.55Å; G336-F366 VanDerWaalsContact C-O 3.3Å; G336-F366 VanDerWaalsContact CA-O 3.23Å; G336-F366 WeakPolarHBondContact CA-O 3.45Å; R337-F366 PolarHBondContact N-O 3.14Å; V338-F366 HydrophobicContact CB-CE1 4.21Å; V338-F366 HydrophobicContact CG2-CD1 4.2Å; V338-F366 HydrophobicContact CG2-CE1 3.74Å; L356-F366 HydrophobicContact CB-CE1 4.03Å; L356-F366 HydrophobicContact CB-CZ 4.15Å; L356-F366 VanDerWaalsContact O-CE1 3.29Å; L356-F366 WeakPolarHBondContact O-CE1 3.25Å; A364-F366 VanDerWaalsContact C-N 3.34Å; A364-F366 PolarHBondContact O-N 2.83Å; F366-V386 HydrophobicContact CD1-CG1 4.2Å; F366-V386 HydrophobicContact CD2-CG1 3.91Å; F366-V386 HydrophobicContact CE1-CG1 3.81Å; F366-V386 HydrophobicContact CE2-CB 3.76Å; F366-V386 HydrophobicContact CE2-CG1 3.5Å; F366-V386 HydrophobicContact CG-CG1 4.25Å; F366-V386 HydrophobicContact CZ-CB 3.76Å; F366-V386 HydrophobicContact CZ-CG1 3.44Å; F366-V386 VanDerWaalsContact CZ-CG1 3.44Å; F366-V386 HydrophobicContact CZ-CG2 4.11Å; F366-A388 HydrophobicContact CB-CB 4.21Å; F366-A388 HydrophobicContact CD2-CB 4.28Å; F366-Y399 AromaticContact CD2-CD2 3.89Å; F366-Y399 HydrophobicContact CD2-CD2 3.89Å; F366-Y399 HydrophobicContact CD2-CE2 4.12Å; F366-Y399 HydrophobicContact CD2-CG 4.47Å; F366-Y399 AromaticContact CE2-CD2 3.74Å; F366-Y399 HydrophobicContact CE2-CD2 3.74Å; F366-Y399 HydrophobicContact CE2-CE2 4.34Å; F366-Y399 AromaticContact CE2-CG 3.9Å; F366-Y399 HydrophobicContact CE2-CG 3.9Å; F366-Y401 HydrophobicContact CE2-CE2 4.1Å; F366-Y401 AromaticContact CZ-CE2 3.75Å; F366-Y401 HydrophobicContact CZ-CE2 3.75Å; F366-Y401 AromaticContact CZ-CZ 3.86Å; F366-Y401 VanDerWaalsContact CZ-OH 3.26Å; F366-Y401 WeakPolarHBondContact CZ-OH 3.46Å
367	G	97.2	Very high	93.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.5	10.7	-174.8	0	0	0	0	0	114.2	S307 R365 T369 G387	S307-G367 PolarHBondContact OG-O 2.95Å; R365-G367 PolarHBondContact O-N 2.84Å; G367-T369 PolarHBondContact O-N 2.97Å; G367-G387 PolarHBondContact N-O 3.2Å
368	E	96.8	Very high	92.8	Very high	37 Å²	37	30.7 Å²	30.7	17%	0.173	17%	0.169	C	C	.	.	S	Bend	trans	-62.1	-35.6	170.3	-172.7	74.8	-160.5	0	0	110.8	S307 P326 R365 P389	S307-E368 WeakPolarHBondContact CB-O 3.3Å; P326-E368 HydrophobicContact CB-CB 4.25Å; P326-E368 WeakPolarHBondContact CB-OE2 3.45Å; R365-E368 WeakPolarHBondContact O-CB 3.06Å; R365-E368 PolarHBondContact O-N 2.89Å; R365-E368 VanDerWaalsContact O-N 3.17Å; E368-P389 HydrophobicContact CB-CG 3.94Å; E368-P389 HydrophobicContact CG-CG 3.94Å
369	T	97.5	Very high	92.6	Very high	20 Å²	20	31.8 Å²	31.8	12%	0.123	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	146.6	171	59.8	0	0	0	0	111.4	G367 V386 G387 G429 Q430 L432	G367-T369 PolarHBondContact O-N 2.97Å; T369-V386 WeakPolarHBondContact O-CA 3.02Å; T369-G387 PolarHBondContact O-N 3.11Å; T369-G387 WeakPolarHBondContact OG1-CA 3.39Å; T369-G429 PolarHBondContact OG1-O 2.74Å; T369-Q430 WeakPolarHBondContact CG2-O 3.47Å; T369-L432 WeakPolarHBondContact OG1-CD1 3.32Å
370	I	98.3	Very high	92.6	Very high	18 Å²	18	31.2 Å²	31.2	9%	0.092	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	132.9	174.3	-48.4	166.8	0	0	0	106.3	C309 L322 V338 A385 V386	C309-I370 HydrophobicContact CB-CB 3.77Å; C309-I370 HydrophobicContact CB-CG2 3.31Å; L322-I370 HydrophobicContact CB-CD1 4.19Å; L322-I370 HydrophobicContact CB-CG2 4.38Å; L322-I370 HydrophobicContact CD2-CG2 4.21Å; V338-I370 HydrophobicContact CB-CD1 4.38Å; V338-I370 HydrophobicContact CG1-CD1 3.62Å; V338-I370 HydrophobicContact CG2-CD1 3.82Å; V338-I370 HydrophobicContact CG2-CG1 4.14Å; I370-A385 CarbonylContact C-O 3.57Å; I370-A385 VanDerWaalsContact CA-O 3.3Å; I370-A385 WeakPolarHBondContact CA-O 3.37Å; I370-V386 HydrophobicContact CG1-CG1 4.48Å; I370-V386 HydrophobicContact CG2-CG2 4.32Å
371	A	97	Very high	92.9	Very high	11 Å²	11	31.4 Å²	31.4	9%	0.091	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	136.8	179.5	0	0	0	0	0	111.3	V384 A385 L432	A371-V384 WeakPolarHBondContact O-CA 3.25Å; A371-A385 PolarHBondContact N-O 3.45Å; A371-A385 PolarHBondContact O-N 2.82Å; A371-L432 HydrophobicContact CB-CB 3.6Å
372	D	95.9	Very high	93.2	Very high	75 Å²	75	31.4 Å²	31.4	40%	0.401	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	126.2	166	174.2	17.8	0	0	0	109.4	C309 V311 G374 S434	C309-D372 PolarHBondContact SG-N 3.16Å; V311-D372 HydrophobicContact CB-CB 4.42Å; V311-D372 HydrophobicContact CG2-CB 4.48Å; D372-G374 PolarHBondContact OD1-N 3.17Å; D372-S434 WeakPolarHBondContact O-CB 3.13Å
373	L	94.8	Very high	93.4	Very high	1 Å²	1	24 Å²	24	1%	0.005	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-11.9	178.4	-55.3	-177	0	0	0	112.8	L376 D383 A385 I400 S434 V446	L373-L376 HydrophobicContact CD1-CD2 4.14Å; L373-D383 HydrophobicContact CB-CB 4.35Å; L373-D383 WeakPolarHBondContact CB-O 3.4Å; L373-D383 PolarHBondContact N-O 3.13Å; L373-A385 HydrophobicContact CD1-CB 3.82Å; L373-A385 HydrophobicContact CD2-CB 3.74Å; L373-A385 HydrophobicContact CG-CB 4.01Å; L373-I400 HydrophobicContact CD1-CD1 3.82Å; L373-I400 HydrophobicContact CD1-CG2 3.99Å; L373-S434 PolarHBondContact O-OG 3.34Å; L373-V446 HydrophobicContact CD2-CG1 4.25Å; L373-V446 HydrophobicContact CD2-CG2 3.81Å
374	G	92.5	Very high	93.7	Very high	16 Å²	16	23.2 Å²	23.2	17%	0.165	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	66.5	-171.7	-158.9	0	0	0	0	0	111.7	D372 L376 D383	D372-G374 PolarHBondContact OD1-N 3.17Å; G374-L376 PolarHBondContact O-N 2.86Å; G374-L376 VanDerWaalsContact O-N 3.15Å; G374-D383 WeakPolarHBondContact O-CB 3.17Å; G374-D383 PolarHBondContact O-N 3.13Å
375	D	92	Very high	93.9	Very high	42 Å²	42	23.1 Å²	23.1	23%	0.225	13%	0.132	C	C	.	.			trans	-74	102.5	176.5	-179.7	-1.8	0	0	0	110.1	D377 D378 D379 G380	D375-D377 PolarHBondContact OD1-N 3.44Å; D375-D378 WeakPolarHBondContact OD1-CA 3.33Å; D375-D378 PolarHBondContact OD1-N 2.86Å; D375-D378 WeakPolarHBondContact OD2-CA 3.33Å; D375-D379 PolarHBondContact OD1-N 3.02Å; D375-D379 PolarHBondContact OD2-N 2.9Å; D375-G380 WeakPolarHBondContact OD2-CA 3.47Å; D375-G380 PolarHBondContact OD2-N 2.77Å
376	L	89.6	Confident	94	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.005	12%	0.122	C	C	.	.	S	Bend	trans	-89.5	-22.2	-174	-154.9	73.3	0	0	0	111.3	N29 L30 L373 G374 D383 I400 N444 T461	N29-L376 VanDerWaalsContact ND2-CB 3.33Å; N29-L376 WeakPolarHBondContact ND2-CB 3.27Å; N29-L376 WeakPolarHBondContact ND2-CD2 3.35Å; N29-L376 WeakPolarHBondContact ND2-CG 3.42Å; N29-L376 PolarHBondContact ND2-O 3.37Å; N29-L376 WeakPolarHBondContact OD1-CD2 3.18Å; L30-L376 HydrophobicContact CD1-CD2 4.32Å; L30-L376 HydrophobicContact CD2-CD1 4.49Å; L30-L376 HydrophobicContact CD2-CD2 4Å; L30-L376 HydrophobicContact CG-CD2 3.89Å; L373-L376 HydrophobicContact CD1-CD2 4.14Å; G374-L376 PolarHBondContact O-N 2.86Å; G374-L376 VanDerWaalsContact O-N 3.15Å; L376-D383 WeakPolarHBondContact CA-OD2 3.45Å; L376-D383 HydrophobicContact CB-CB 4.28Å; L376-D383 WeakPolarHBondContact CB-OD2 3.42Å; L376-D383 PolarHBondContact N-OD2 2.7Å; L376-I400 HydrophobicContact CD2-CG2 4.39Å; L376-N444 WeakPolarHBondContact CD1-O 3.35Å; L376-T461 HydrophobicContact CD1-CG2 3.77Å; L376-T461 VanDerWaalsContact CD1-OG1 3.27Å; L376-T461 WeakPolarHBondContact CD1-OG1 3.3Å; L376-T461 HydrophobicContact CG-CG2 3.74Å
377	D	86.6	Confident	94	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.122	C	C	.	.	S	Bend	trans	-112.4	8.3	-178.1	77.1	-7.9	0	0	0	115.8	Y28 D375 D379 R404 V464 Q602	Y28-D377 HydrophobicContact CE1-CB 3.55Å; Y28-D377 VanDerWaalsContact CE1-OD2 3.3Å; Y28-D377 WeakPolarHBondContact CE1-OD2 3.39Å; Y28-D377 WeakPolarHBondContact OH-CB 3.44Å; Y28-D377 VanDerWaalsContact OH-CG 3.31Å; Y28-D377 PolarHBondContact OH-OD2 2.86Å; D375-D377 PolarHBondContact OD1-N 3.44Å; D377-D379 PolarHBondContact O-N 3.18Å; D377-D379 VanDerWaalsContact OD1-CB 3.3Å; D377-D379 WeakPolarHBondContact OD1-CB 3.29Å; D377-D379 PolarHBondContact OD1-N 2.75Å; D377-R404 IonicContact OD2-NH1 2.92Å; D377-V464 HydrophobicContact CB-CG2 4.46Å; D377-V464 WeakPolarHBondContact O-CG1 3.23Å; D377-Q602 PolarHBondContact O-NE2 2.86Å; D377-Q602 VanDerWaalsContact O-NE2 3.07Å
378	D	86.8	Confident	94	Very high	41 Å²	41	20.3 Å²	20.3	22%	0.219	12%	0.122	C	C	.	.	S	Bend	trans	57.4	31.8	177	-147.7	45	0	0	0	112.2	D375 Y443 Q466 K505	D375-D378 WeakPolarHBondContact OD1-CA 3.33Å; D375-D378 PolarHBondContact OD1-N 2.86Å; D375-D378 WeakPolarHBondContact OD2-CA 3.33Å; D378-Y443 HydrophobicContact CB-CE1 4.06Å; D378-Q466 PolarHBondContact O-NE2 3.39Å; D378-K505 IonicContact OD1-NZ 3.85Å; D378-K505 PolarHBondContact OD1-NZ 3.01Å
379	D	86.3	Confident	94	Very high	37 Å²	37	18.6 Å²	18.6	20%	0.198	11%	0.113	C	C	.	.	S	Bend	trans	-88.6	-6.9	179.8	86.7	-18.8	0	0	0	113.8	D375 D377 Y381 R404	D375-D379 PolarHBondContact OD1-N 3.02Å; D375-D379 PolarHBondContact OD2-N 2.9Å; D377-D379 PolarHBondContact O-N 3.18Å; D377-D379 VanDerWaalsContact OD1-CB 3.3Å; D377-D379 WeakPolarHBondContact OD1-CB 3.29Å; D377-D379 PolarHBondContact OD1-N 2.75Å; D379-Y381 WeakPolarHBondContact OD1-CB 3.04Å; D379-Y381 PolarHBondContact OD1-N 2.8Å; D379-R404 IonicContact OD2-CZ 3.41Å; D379-R404 IonicContact OD2-NH1 3.83Å; D379-R404 PolarHBondContact OD2-NH1 2.78Å
380	G	89.5	Confident	93.9	Very high	44 Å²	44	19.5 Å²	19.5	45%	0.454	12%	0.116	S	C	.	.	S	Bend	trans	98.5	-3.2	-179	0	0	0	0	0	114.6	D375	D375-G380 WeakPolarHBondContact OD2-CA 3.47Å; D375-G380 PolarHBondContact OD2-N 2.77Å
381	Y	93.3	Very high	93.7	Very high	56 Å²	56	18.7 Å²	18.7	22%	0.22	11%	0.112	C	C	.	.	S	Bend	trans	-118.6	133.8	-177.9	-58.7	-76.4	0	0	0	111.2	N314 A315 D379 G403 K405	N314-Y381 WeakPolarHBondContact O-CE1 3.33Å; A315-Y381 HydrophobicContact CB-CD1 3.86Å; A315-Y381 HydrophobicContact CB-CE1 4.03Å; D379-Y381 WeakPolarHBondContact OD1-CB 3.04Å; D379-Y381 PolarHBondContact OD1-N 2.8Å; Y381-G403 VanDerWaalsContact CB-C 3.44Å; Y381-K405 HydrophobicContact CE1-CB 4.22Å; Y381-K405 WeakPolarHBondContact OH-CB 3.33Å
382	P	94.3	Very high	93.4	Very high	28 Å²	28	21.5 Å²	21.5	18%	0.182	13%	0.125	C	C	.	.			trans	-62.8	139.7	173.9	-27.3	37.3	0	0	0	114	V311 D312 G403	V311-P382 HydrophobicContact CG2-CB 3.56Å; V311-P382 HydrophobicContact CG2-CG 4.35Å; D312-P382 WeakPolarHBondContact O-CD 3.4Å; D312-P382 WeakPolarHBondContact O-CG 3.35Å; P382-G403 VanDerWaalsContact O-CA 3.3Å; P382-G403 WeakPolarHBondContact O-CA 3.42Å; P382-G403 PolarHBondContact O-N 2.91Å
383	D	94.8	Very high	93.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	159.7	178.7	-58.3	-43.5	0	0	0	111.9	L373 G374 L376 N402 G403	L373-D383 HydrophobicContact CB-CB 4.35Å; L373-D383 WeakPolarHBondContact CB-O 3.4Å; L373-D383 PolarHBondContact N-O 3.13Å; G374-D383 WeakPolarHBondContact O-CB 3.17Å; G374-D383 PolarHBondContact O-N 3.13Å; L376-D383 WeakPolarHBondContact CA-OD2 3.45Å; L376-D383 HydrophobicContact CB-CB 4.28Å; L376-D383 WeakPolarHBondContact CB-OD2 3.42Å; L376-D383 PolarHBondContact N-OD2 2.7Å; D383-N402 WeakPolarHBondContact OD1-CA 3.38Å; D383-N402 VanDerWaalsContact OD1-CB 3.31Å; D383-N402 WeakPolarHBondContact OD1-CB 3.41Å; D383-N402 PolarHBondContact OD1-ND2 2.71Å; D383-N402 PolarHBondContact OD2-ND2 2.95Å; D383-N402 VanDerWaalsContact OD2-ND2 3.11Å; D383-G403 PolarHBondContact OD1-N 2.74Å; D383-G403 VanDerWaalsContact OD1-N 3.16Å
384	V	97.2	Very high	93.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	145.1	179.6	-57.6	0	0	0	0	112.4	V311 L313 L322 A371 I400 Y401 I408	V311-V384 HydrophobicContact CG1-CG1 3.85Å; L313-V384 HydrophobicContact CD2-CG1 3.93Å; L322-V384 HydrophobicContact CD2-CG1 4.42Å; L322-V384 HydrophobicContact CD2-CG2 4.04Å; A371-V384 WeakPolarHBondContact O-CA 3.25Å; V384-I400 WeakPolarHBondContact O-CA 2.74Å; V384-Y401 PolarHBondContact N-O 3.31Å; V384-Y401 PolarHBondContact O-N 3.43Å; V384-I408 HydrophobicContact CG2-CD1 3.47Å; V384-I408 VanDerWaalsContact CG2-CD1 3.47Å
385	A	97.7	Very high	93.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	139.1	167.6	0	0	0	0	0	110.8	I370 A371 L373 V398 Y399 I400 L432	I370-A385 CarbonylContact C-O 3.57Å; I370-A385 VanDerWaalsContact CA-O 3.3Å; I370-A385 WeakPolarHBondContact CA-O 3.37Å; A371-A385 PolarHBondContact N-O 3.45Å; A371-A385 PolarHBondContact O-N 2.82Å; L373-A385 HydrophobicContact CD1-CB 3.82Å; L373-A385 HydrophobicContact CD2-CB 3.74Å; L373-A385 HydrophobicContact CG-CB 4.01Å; A385-V398 HydrophobicContact CB-CG1 4Å; A385-Y399 CarbonylContact C-O 3.53Å; A385-Y399 VanDerWaalsContact CA-O 3.26Å; A385-Y399 WeakPolarHBondContact CA-O 3.44Å; A385-I400 HydrophobicContact CB-CD1 3.84Å; A385-L432 HydrophobicContact CB-CD1 3.9Å
386	V	98.5	Very high	93.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	128.2	173.8	-173.3	0	0	0	0	110	V338 F366 T369 I370 V398 Y399 Y401	V338-V386 HydrophobicContact CG2-CG1 3.8Å; V338-V386 HydrophobicContact CG2-CG2 4.41Å; F366-V386 HydrophobicContact CD1-CG1 4.2Å; F366-V386 HydrophobicContact CD2-CG1 3.91Å; F366-V386 HydrophobicContact CE1-CG1 3.81Å; F366-V386 HydrophobicContact CE2-CB 3.76Å; F366-V386 HydrophobicContact CE2-CG1 3.5Å; F366-V386 HydrophobicContact CG-CG1 4.25Å; F366-V386 HydrophobicContact CZ-CB 3.76Å; F366-V386 HydrophobicContact CZ-CG1 3.44Å; F366-V386 VanDerWaalsContact CZ-CG1 3.44Å; F366-V386 HydrophobicContact CZ-CG2 4.11Å; T369-V386 WeakPolarHBondContact O-CA 3.02Å; I370-V386 HydrophobicContact CG1-CG1 4.48Å; I370-V386 HydrophobicContact CG2-CG2 4.32Å; V386-V398 WeakPolarHBondContact O-CA 3.39Å; V386-Y399 PolarHBondContact N-O 2.96Å; V386-Y399 PolarHBondContact O-N 3.07Å; V386-Y401 HydrophobicContact CB-CE2 4.33Å; V386-Y401 HydrophobicContact CG2-CD2 4.02Å; V386-Y401 HydrophobicContact CG2-CE2 4.03Å
387	G	97.9	Very high	93.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	142.1	177.2	0	0	0	0	0	113.3	G367 T369	G367-G387 PolarHBondContact N-O 3.2Å; T369-G387 PolarHBondContact O-N 3.11Å; T369-G387 WeakPolarHBondContact OG1-CA 3.39Å
388	A	97.4	Very high	94.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	71.3	169	0	0	0	0	0	108.8	A364 F366 Q390 E391 G396 A397 Y399	A364-A388 CarbonylContact O-C 3.27Å; A364-A388 WeakPolarHBondContact O-CA 3.36Å; F366-A388 HydrophobicContact CB-CB 4.21Å; F366-A388 HydrophobicContact CD2-CB 4.28Å; A388-Q390 PolarHBondContact O-N 2.81Å; A388-Q390 VanDerWaalsContact O-N 3.13Å; A388-E391 HydrophobicContact CB-CB 4.19Å; A388-E391 WeakPolarHBondContact CB-OE2 3.27Å; A388-E391 WeakPolarHBondContact O-CB 3.46Å; A388-E391 PolarHBondContact O-N 3.29Å; A388-G396 VanDerWaalsContact O-CA 3.31Å; A388-G396 WeakPolarHBondContact O-CA 3.03Å; A388-A397 PolarHBondContact N-O 2.87Å; A388-A397 PolarHBondContact O-N 2.9Å; A388-Y399 HydrophobicContact CB-CE2 4.11Å
389	P	96.7	Very high	94.5	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-19.9	-166.7	23.8	-33.1	0	0	0	114.7	E368 G396 M427 F428 Q430	E368-P389 HydrophobicContact CB-CG 3.94Å; E368-P389 HydrophobicContact CG-CG 3.94Å; P389-G396 VanDerWaalsContact O-CA 3.25Å; P389-G396 WeakPolarHBondContact O-CA 3.35Å; P389-G396 PolarHBondContact O-N 2.88Å; P389-M427 HydrophobicContact CB-CB 4.37Å; P389-M427 HydrophobicContact CB-SD 4.19Å; P389-M427 WeakPolarHBondContact O-CA 3.28Å; P389-F428 WeakPolarHBondContact CA-O 3.36Å; P389-Q430 HydrophobicContact CB-CB 4.28Å
390	Q	95.3	Very high	95	Very high	39 Å²	39	26.9 Å²	26.9	18%	0.182	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-3.5	-176.8	-64.5	-167.9	15.8	0	0	113.6	A363 A364 R365 A388 L394 M427	A363-Q390 WeakPolarHBondContact O-CB 3.33Å; A364-Q390 PolarHBondContact O-N 2.84Å; R365-Q390 VanDerWaalsContact CD-CD 3.47Å; R365-Q390 HydrophobicContact CG-CB 4.47Å; R365-Q390 HydrophobicContact CG-CG 4.47Å; R365-Q390 VanDerWaalsContact NE-OE1 3.14Å; A388-Q390 PolarHBondContact O-N 2.81Å; A388-Q390 VanDerWaalsContact O-N 3.13Å; Q390-L394 HydrophobicContact CB-CD2 3.9Å; Q390-L394 HydrophobicContact CG-CD2 3.84Å; Q390-L394 PolarHBondContact O-N 2.82Å; Q390-L394 VanDerWaalsContact O-N 3.12Å; Q390-M427 HydrophobicContact CG-CE 3.96Å; Q390-M427 HydrophobicContact CG-SD 3.83Å
391	E	94.1	Very high	95.2	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-59.2	152.4	177.2	-164.9	172.7	161	0	0	112.6	S359 A361 A364 A388 D393 L394 R395 G396 A397 Y399 R415	S359-E391 WeakPolarHBondContact CB-OE1 3.43Å; S359-E391 PolarHBondContact OG-OE1 2.87Å; A361-E391 HydrophobicContact CB-CG 4.15Å; A364-E391 HydrophobicContact CB-CB 3.96Å; A364-E391 HydrophobicContact CB-CG 4.13Å; A388-E391 HydrophobicContact CB-CB 4.19Å; A388-E391 WeakPolarHBondContact CB-OE2 3.27Å; A388-E391 WeakPolarHBondContact O-CB 3.46Å; A388-E391 PolarHBondContact O-N 3.29Å; E391-D393 VanDerWaalsContact C-N 3.33Å; E391-D393 PolarHBondContact O-N 2.9Å; E391-L394 PolarHBondContact O-N 2.81Å; E391-R395 PolarHBondContact O-N 2.92Å; E391-R395 VanDerWaalsContact O-N 3.09Å; E391-G396 PolarHBondContact O-N 3.33Å; E391-A397 HydrophobicContact CB-CB 4.47Å; E391-A397 WeakPolarHBondContact OE2-CB 3.43Å; E391-Y399 PolarHBondContact OE1-OH 2.92Å; E391-Y399 WeakPolarHBondContact OE2-CE2 3.4Å; E391-Y399 PolarHBondContact OE2-OH 2.55Å; E391-Y399 VanDerWaalsContact OE2-OH 3.05Å; E391-R415 IonicContact OE1-CZ 2.91Å; E391-R415 IonicContact OE1-NE 3.24Å; E391-R415 PolarHBondContact OE1-NE 2.83Å; E391-R415 IonicContact OE1-NH2 3.22Å; E391-R415 PolarHBondContact OE1-NH2 3.28Å
392	D	90.7	Very high	95.2	Very high	70 Å²	70	22.2 Å²	22.2	37%	0.374	11%	0.109	S	C	.	.	H	α-helix	trans	54.7	42.6	177	-65.5	-30.3	0	0	0	113.8	R395 R415	D392-R395 HydrophobicContact CB-CB 4.17Å; D392-R395 WeakPolarHBondContact O-CD 3.33Å; D392-R395 VanDerWaalsContact O-CG 3.26Å; D392-R395 WeakPolarHBondContact O-CG 3.28Å; D392-R395 PolarHBondContact O-NE 2.84Å; D392-R415 IonicContact OD2-NH2 2.75Å; D392-R415 PolarHBondContact OD2-NH2 2.9Å
393	D	90.3	Very high	95.1	Very high	139 Å²	139	20.9 Å²	20.9	74%	0.743	10%	0.101	S	C	*	.	H	α-helix	trans	62.9	58.7	-177.4	-171.2	36.1	0	0	0	112.4	E391 R395	E391-D393 VanDerWaalsContact C-N 3.33Å; E391-D393 PolarHBondContact O-N 2.9Å; D393-R395 PolarHBondContact O-N 2.89Å; D393-R395 VanDerWaalsContact O-N 3.14Å
394	L	93.4	Very high	94.9	Very high	58 Å²	58	22.8 Å²	22.8	30%	0.304	11%	0.108	S	C	.	.	H	α-helix	trans	63.2	13.8	-179.7	-45.8	-178.6	0	0	0	114.8	Q390 E391 K426 M427 L452	Q390-L394 HydrophobicContact CB-CD2 3.9Å; Q390-L394 HydrophobicContact CG-CD2 3.84Å; Q390-L394 PolarHBondContact O-N 2.82Å; Q390-L394 VanDerWaalsContact O-N 3.12Å; E391-L394 PolarHBondContact O-N 2.81Å; L394-K426 CarbonylContact O-C 3.52Å; L394-K426 WeakPolarHBondContact O-CA 3.5Å; L394-K426 WeakPolarHBondContact O-CB 3.39Å; L394-M427 HydrophobicContact CB-CE 4.38Å; L394-M427 HydrophobicContact CD1-CE 4.11Å; L394-M427 HydrophobicContact CD2-CE 3.6Å; L394-M427 HydrophobicContact CG-CE 4.24Å; L394-M427 PolarHBondContact O-N 2.89Å; L394-L452 HydrophobicContact CD1-CD2 4.24Å
395	R	93.4	Very high	94.5	Very high	122 Å²	122	29.7 Å²	29.7	46%	0.46	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-38.5	172.1	-69.2	179.2	-133.9	-171.2	-0.2	110.6	E391 D392 D393 L425 F428	E391-R395 PolarHBondContact O-N 2.92Å; E391-R395 VanDerWaalsContact O-N 3.09Å; D392-R395 HydrophobicContact CB-CB 4.17Å; D392-R395 WeakPolarHBondContact O-CD 3.33Å; D392-R395 VanDerWaalsContact O-CG 3.26Å; D392-R395 WeakPolarHBondContact O-CG 3.28Å; D392-R395 PolarHBondContact O-NE 2.84Å; D393-R395 PolarHBondContact O-N 2.89Å; D393-R395 VanDerWaalsContact O-N 3.14Å; R395-L425 WeakPolarHBondContact CA-O 3.41Å; R395-F428 WeakPolarHBondContact O-CB 3.37Å; R395-F428 PolarHBondContact O-N 2.9Å
396	G	95.1	Very high	94.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.173	C	C	.	.			trans	80.1	155.9	175	0	0	0	0	0	114.3	A388 P389 E391 G418 F428	A388-G396 VanDerWaalsContact O-CA 3.31Å; A388-G396 WeakPolarHBondContact O-CA 3.03Å; P389-G396 VanDerWaalsContact O-CA 3.25Å; P389-G396 WeakPolarHBondContact O-CA 3.35Å; P389-G396 PolarHBondContact O-N 2.88Å; E391-G396 PolarHBondContact O-N 3.33Å; G396-G418 PolarHBondContact O-N 3.14Å; G396-G418 VanDerWaalsContact O-N 3.13Å; G396-F428 CarbonylContact C-O 3.53Å; G396-F428 WeakPolarHBondContact CA-O 3.28Å
397	A	95.8	Very high	93.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	159.9	178.8	0	0	0	0	0	112.1	A388 E391 Y399 I416 T417 F428	A388-A397 PolarHBondContact N-O 2.87Å; A388-A397 PolarHBondContact O-N 2.9Å; E391-A397 HydrophobicContact CB-CB 4.47Å; E391-A397 WeakPolarHBondContact OE2-CB 3.43Å; A397-Y399 HydrophobicContact CB-CE2 3.94Å; A397-I416 CarbonylContact C-O 3.57Å; A397-I416 VanDerWaalsContact CA-O 3.28Å; A397-I416 WeakPolarHBondContact CA-O 3.5Å; A397-T417 HydrophobicContact CB-CG2 4.21Å; A397-F428 PolarHBondContact N-O 2.92Å
398	V	97.1	Very high	93.6	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.012	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	135.1	172.5	-179.8	0	0	0	0	108.8	A385 V386 I400 R415 I416 F428 L432 V448	A385-V398 HydrophobicContact CB-CG1 4Å; V386-V398 WeakPolarHBondContact O-CA 3.39Å; V398-I400 HydrophobicContact CG1-CD1 4.18Å; V398-R415 WeakPolarHBondContact O-CA 3.43Å; V398-I416 PolarHBondContact N-O 3.34Å; V398-I416 PolarHBondContact O-N 2.74Å; V398-F428 HydrophobicContact CB-CE1 4.27Å; V398-F428 HydrophobicContact CG2-CD1 4.02Å; V398-F428 HydrophobicContact CG2-CE1 3.64Å; V398-F428 HydrophobicContact CG2-CZ 4.32Å; V398-L432 HydrophobicContact CG1-CD1 4.27Å; V398-L432 HydrophobicContact CG1-CD2 4.03Å; V398-L432 HydrophobicContact CG2-CD2 3.87Å; V398-V448 HydrophobicContact CG2-CG1 3.84Å; V398-V448 HydrophobicContact CG2-CG2 4.49Å
399	Y	96.9	Very high	93.3	Very high	6 Å²	6	39.1 Å²	39.1	2%	0.024	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	133.8	-179.4	-67.5	-99.4	0	0	0	109.9	S359 F366 A385 V386 A388 E391 A397 P412 Q414 R415	S359-Y399 VanDerWaalsContact CB-OH 3.3Å; S359-Y399 WeakPolarHBondContact CB-OH 3.42Å; S359-Y399 PolarHBondContact N-OH 3.16Å; S359-Y399 PolarHBondContact OG-OH 2.6Å; F366-Y399 AromaticContact CD2-CD2 3.89Å; F366-Y399 HydrophobicContact CD2-CD2 3.89Å; F366-Y399 HydrophobicContact CD2-CE2 4.12Å; F366-Y399 HydrophobicContact CD2-CG 4.47Å; F366-Y399 AromaticContact CE2-CD2 3.74Å; F366-Y399 HydrophobicContact CE2-CD2 3.74Å; F366-Y399 HydrophobicContact CE2-CE2 4.34Å; F366-Y399 AromaticContact CE2-CG 3.9Å; F366-Y399 HydrophobicContact CE2-CG 3.9Å; A385-Y399 CarbonylContact C-O 3.53Å; A385-Y399 VanDerWaalsContact CA-O 3.26Å; A385-Y399 WeakPolarHBondContact CA-O 3.44Å; V386-Y399 PolarHBondContact N-O 2.96Å; V386-Y399 PolarHBondContact O-N 3.07Å; A388-Y399 HydrophobicContact CB-CE2 4.11Å; E391-Y399 PolarHBondContact OE1-OH 2.92Å; E391-Y399 WeakPolarHBondContact OE2-CE2 3.4Å; E391-Y399 PolarHBondContact OE2-OH 2.55Å; E391-Y399 VanDerWaalsContact OE2-OH 3.05Å; A397-Y399 HydrophobicContact CB-CE2 3.94Å; Y399-P412 HydrophobicContact CD1-CB 4.01Å; Y399-P412 HydrophobicContact CD1-CG 3.93Å; Y399-Q414 WeakPolarHBondContact CA-O 3.35Å; Y399-R415 HydrophobicContact CD1-CB 4.12Å; Y399-R415 HydrophobicContact CD1-CG 4.08Å; Y399-R415 HydrophobicContact CE1-CB 4.09Å; Y399-R415 HydrophobicContact CE1-CG 3.69Å; Y399-R415 HydrophobicContact CE2-CG 4.41Å; Y399-R415 WeakPolarHBondContact OH-CD 3.15Å; Y399-R415 PolarHBondContact OH-NE 3.05Å
400	I	95.5	Very high	93	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	126.9	176.6	-47.3	-58	0	0	0	108.4	L30 L373 L376 V384 A385 V398 P412 S413 Q414	L30-I400 HydrophobicContact CD1-CD1 3.64Å; L30-I400 HydrophobicContact CD1-CG1 3.97Å; L373-I400 HydrophobicContact CD1-CD1 3.82Å; L373-I400 HydrophobicContact CD1-CG2 3.99Å; L376-I400 HydrophobicContact CD2-CG2 4.39Å; V384-I400 WeakPolarHBondContact O-CA 2.74Å; A385-I400 HydrophobicContact CB-CD1 3.84Å; V398-I400 HydrophobicContact CG1-CD1 4.18Å; I400-P412 CarbonylContact O-C 3.56Å; I400-P412 WeakPolarHBondContact O-CA 3.2Å; I400-P412 WeakPolarHBondContact O-CB 3.32Å; I400-S413 PolarHBondContact O-N 2.95Å; I400-S413 PolarHBondContact O-OG 2.94Å; I400-Q414 HydrophobicContact CB-CB 4.14Å; I400-Q414 HydrophobicContact CG1-CB 4.03Å; I400-Q414 PolarHBondContact N-O 3.36Å
401	Y	94.9	Very high	92.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	131.7	175.4	-66.5	-97.2	0	0	0	108.9	L356 T357 F366 V384 V386 S409 P412	L356-Y401 HydrophobicContact CB-CE1 4.14Å; L356-Y401 HydrophobicContact CD1-CD1 4.38Å; L356-Y401 HydrophobicContact CD1-CD2 4.36Å; L356-Y401 HydrophobicContact CD1-CG 4.27Å; L356-Y401 HydrophobicContact CD2-CD1 3.82Å; L356-Y401 HydrophobicContact CD2-CE1 3.88Å; L356-Y401 HydrophobicContact CD2-CG 4.48Å; L356-Y401 HydrophobicContact CG-CE1 4.42Å; T357-Y401 PolarHBondContact O-OH 2.62Å; F366-Y401 HydrophobicContact CE2-CE2 4.1Å; F366-Y401 AromaticContact CZ-CE2 3.75Å; F366-Y401 HydrophobicContact CZ-CE2 3.75Å; F366-Y401 AromaticContact CZ-CZ 3.86Å; F366-Y401 VanDerWaalsContact CZ-OH 3.26Å; F366-Y401 WeakPolarHBondContact CZ-OH 3.46Å; V384-Y401 PolarHBondContact N-O 3.31Å; V384-Y401 PolarHBondContact O-N 3.43Å; V386-Y401 HydrophobicContact CB-CE2 4.33Å; V386-Y401 HydrophobicContact CG2-CD2 4.02Å; V386-Y401 HydrophobicContact CG2-CE2 4.03Å; Y401-S409 WeakPolarHBondContact CD1-O 3.29Å; Y401-P412 HydrophobicContact CD1-CB 4.23Å; Y401-P412 HydrophobicContact CD2-CB 4.48Å; Y401-P412 HydrophobicContact CE1-CB 3.88Å; Y401-P412 HydrophobicContact CE1-CG 4.25Å; Y401-P412 HydrophobicContact CE2-CB 4.14Å
402	N	92.3	Very high	92.7	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.011	25%	0.247	C	C	.	.			trans	-90.2	138.7	-178.6	-62.8	105.1	0	0	0	112.8	D383 I408 S409 S413	D383-N402 WeakPolarHBondContact OD1-CA 3.38Å; D383-N402 VanDerWaalsContact OD1-CB 3.31Å; D383-N402 WeakPolarHBondContact OD1-CB 3.41Å; D383-N402 PolarHBondContact OD1-ND2 2.71Å; D383-N402 PolarHBondContact OD2-ND2 2.95Å; D383-N402 VanDerWaalsContact OD2-ND2 3.11Å; N402-I408 WeakPolarHBondContact O-CG1 3.3Å; N402-S409 PolarHBondContact O-N 2.88Å; N402-S413 WeakPolarHBondContact OD1-CB 3.25Å; N402-S413 PolarHBondContact OD1-OG 2.78Å
403	G	92.6	Very high	92.7	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	156.9	167.4	0	0	0	0	0	111	Y381 P382 D383 G407	Y381-G403 VanDerWaalsContact CB-C 3.44Å; P382-G403 VanDerWaalsContact O-CA 3.3Å; P382-G403 WeakPolarHBondContact O-CA 3.42Å; P382-G403 PolarHBondContact O-N 2.91Å; D383-G403 PolarHBondContact OD1-N 2.74Å; D383-G403 VanDerWaalsContact OD1-N 3.16Å; G403-G407 CarbonylContact C-O 3.52Å; G403-G407 WeakPolarHBondContact CA-O 3.27Å
404	R	90	Very high	92.7	Very high	39 Å²	39	42.3 Å²	42.3	15%	0.147	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	167.3	178.1	-61.8	-63.1	175.8	-142.6	-4.4	108.8	L313 N314 D377 D379 E406 G407	L313-R404 PolarHBondContact O-N 3.36Å; N314-R404 WeakPolarHBondContact CA-O 3.32Å; D377-R404 IonicContact OD2-NH1 2.92Å; D379-R404 IonicContact OD2-CZ 3.41Å; D379-R404 IonicContact OD2-NH1 3.83Å; D379-R404 PolarHBondContact OD2-NH1 2.78Å; R404-E406 PolarHBondContact O-N 2.88Å; R404-E406 VanDerWaalsContact O-N 3.08Å; R404-G407 PolarHBondContact N-O 3Å; R404-G407 CarbonylContact O-C 3.3Å; R404-G407 WeakPolarHBondContact O-CA 3.41Å; R404-G407 PolarHBondContact O-N 2.87Å
405	K	90.2	Very high	92.7	Very high	146 Å²	146	43.3 Å²	43.3	64%	0.635	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-34.7	175.3	-168.5	179.2	177.3	-176	0	113.8	N314 Y381 G407	N314-K405 WeakPolarHBondContact CB-O 3.26Å; Y381-K405 HydrophobicContact CE1-CB 4.22Å; Y381-K405 WeakPolarHBondContact OH-CB 3.33Å; K405-G407 VanDerWaalsContact C-N 3.31Å
406	E	88	Confident	92.7	Very high	157 Å²	157	37.5 Å²	37.5	73%	0.734	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	3.8	179.5	-59.3	73.1	-155.1	0	0	113.6	R404	R404-E406 PolarHBondContact O-N 2.88Å; R404-E406 VanDerWaalsContact O-N 3.08Å
407	G	91.7	Very high	92.6	Very high	1 Å²	1	38 Å²	38	1%	0.01	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	121.5	-99.9	-176.4	0	0	0	0	0	111.2	L313 G403 R404 K405	L313-G407 WeakPolarHBondContact CB-O 3.43Å; G403-G407 CarbonylContact C-O 3.52Å; G403-G407 WeakPolarHBondContact CA-O 3.27Å; R404-G407 PolarHBondContact N-O 3Å; R404-G407 CarbonylContact O-C 3.3Å; R404-G407 WeakPolarHBondContact O-CA 3.41Å; R404-G407 PolarHBondContact O-N 2.87Å; K405-G407 VanDerWaalsContact C-N 3.31Å
408	I	93.6	Very high	92.1	Very high	11 Å²	11	38 Å²	38	6%	0.056	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	148	-175.1	-167.1	173.9	0	0	0	111.6	L313 L322 V340 F354 L356 V384 N402	L313-I408 HydrophobicContact CD1-CB 4.19Å; L313-I408 HydrophobicContact CD1-CG2 4.45Å; L313-I408 HydrophobicContact CD2-CB 4.45Å; L313-I408 HydrophobicContact CD2-CD1 4.18Å; L322-I408 HydrophobicContact CD2-CD1 4.31Å; V340-I408 HydrophobicContact CB-CG2 4.45Å; V340-I408 HydrophobicContact CG1-CG2 3.85Å; V340-I408 HydrophobicContact CG2-CG2 3.97Å; F354-I408 HydrophobicContact CE2-CG2 4.11Å; F354-I408 HydrophobicContact CZ-CG2 3.94Å; F354-I408 WeakPolarHBondContact CZ-O 3.5Å; L356-I408 HydrophobicContact CD1-CD1 3.98Å; L356-I408 HydrophobicContact CD2-CG2 4.33Å; V384-I408 HydrophobicContact CG2-CD1 3.47Å; V384-I408 VanDerWaalsContact CG2-CD1 3.47Å; N402-I408 WeakPolarHBondContact O-CG1 3.3Å
409	S	91.1	Very high	91.6	Very high	29 Å²	29	40.5 Å²	40.5	20%	0.203	20%	0.204	C	C	.	.			trans	-67.7	134.6	174.2	-165.8	0	0	0	0	111.5	Y401 N402 K411	Y401-S409 WeakPolarHBondContact CD1-O 3.29Å; N402-S409 PolarHBondContact O-N 2.88Å; S409-K411 PolarHBondContact O-N 2.94Å
410	P	91.1	Very high	91.1	Very high	67 Å²	67	43 Å²	43	44%	0.435	22%	0.222	S	C	.	.	S	Bend	trans	-71.1	-18.4	177.6	28	-35.2	0	0	0	113.2	F354	F354-P410 HydrophobicContact CD1-CB 4.42Å; F354-P410 HydrophobicContact CD2-CB 3.7Å; F354-P410 HydrophobicContact CE1-CB 4.49Å; F354-P410 HydrophobicContact CE2-CB 3.8Å; F354-P410 HydrophobicContact CG-CB 4.04Å; F354-P410 HydrophobicContact CZ-CB 4.21Å
411	K	90.4	Very high	90.6	Very high	163 Å²	163	43.6 Å²	43.6	71%	0.709	23%	0.225	S	C	*	.	S	Bend	trans	-107.3	136.1	-179.8	-68.6	-177.2	-179.5	176.5	0	110.2	S409	S409-K411 PolarHBondContact O-N 2.94Å
412	P	92.3	Very high	89.3	Confident	50 Å²	50	46.7 Å²	46.7	33%	0.325	26%	0.257	S	S	.	.			trans	-68.4	139.9	175.7	29.3	-33.8	0	0	0	110.3	Y399 I400 Y401	Y399-P412 HydrophobicContact CD1-CB 4.01Å; Y399-P412 HydrophobicContact CD1-CG 3.93Å; I400-P412 CarbonylContact O-C 3.56Å; I400-P412 WeakPolarHBondContact O-CA 3.2Å; I400-P412 WeakPolarHBondContact O-CB 3.32Å; Y401-P412 HydrophobicContact CD1-CB 4.23Å; Y401-P412 HydrophobicContact CD2-CB 4.48Å; Y401-P412 HydrophobicContact CE1-CB 3.88Å; Y401-P412 HydrophobicContact CE1-CG 4.25Å; Y401-P412 HydrophobicContact CE2-CB 4.14Å
413	S	90.4	Very high	88.4	Confident	33 Å²	33	50.2 Å²	50.2	23%	0.231	27%	0.273	C	S	.	.	S	Bend	trans	-81	-26.2	174.3	55.5	0	0	0	0	112.6	I400 N402	I400-S413 PolarHBondContact O-N 2.95Å; I400-S413 PolarHBondContact O-OG 2.94Å; N402-S413 WeakPolarHBondContact OD1-CB 3.25Å; N402-S413 PolarHBondContact OD1-OG 2.78Å
414	Q	91.4	Very high	88	Confident	3 Å²	3	57.7 Å²	57.7	1%	0.014	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	138.7	179.3	-176.9	169.2	1.5	0	0	111.3	G27 Y28 L30 Y399 I400 I416	G27-Q414 VanDerWaalsContact CA-NE2 3.26Å; Y28-Q414 VanDerWaalsContact N-OE1 3.13Å; L30-Q414 PolarHBondContact O-NE2 2.61Å; Y399-Q414 WeakPolarHBondContact CA-O 3.35Å; I400-Q414 HydrophobicContact CB-CB 4.14Å; I400-Q414 HydrophobicContact CG1-CB 4.03Å; I400-Q414 PolarHBondContact N-O 3.36Å; Q414-I416 HydrophobicContact CG-CD1 4.15Å; Q414-I416 HydrophobicContact CG-CG1 3.94Å
415	R	93.9	Very high	88.1	Confident	78 Å²	78	56 Å²	56	29%	0.294	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.9	168.8	179.3	-177.5	175.7	-93.4	-0.2	108.8	E391 D392 V398 Y399	E391-R415 IonicContact OE1-CZ 2.91Å; E391-R415 IonicContact OE1-NE 3.24Å; E391-R415 PolarHBondContact OE1-NE 2.83Å; E391-R415 IonicContact OE1-NH2 3.22Å; E391-R415 PolarHBondContact OE1-NH2 3.28Å; D392-R415 IonicContact OD2-NH2 2.75Å; D392-R415 PolarHBondContact OD2-NH2 2.9Å; V398-R415 WeakPolarHBondContact O-CA 3.43Å; Y399-R415 HydrophobicContact CD1-CB 4.12Å; Y399-R415 HydrophobicContact CD1-CG 4.08Å; Y399-R415 HydrophobicContact CE1-CB 4.09Å; Y399-R415 HydrophobicContact CE1-CG 3.69Å; Y399-R415 HydrophobicContact CE2-CG 4.41Å; Y399-R415 WeakPolarHBondContact OH-CD 3.15Å; Y399-R415 PolarHBondContact OH-NE 3.05Å
416	I	93.6	Very high	88.4	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	124.6	-179.9	-59.8	150	0	0	0	108	L30 Q32 A397 V398 Q414 L421 F428 L459	L30-I416 HydrophobicContact CB-CD1 4.03Å; L30-I416 HydrophobicContact CD1-CD1 3.8Å; Q32-I416 HydrophobicContact CG-CG1 4.24Å; Q32-I416 HydrophobicContact CG-CG2 4.33Å; A397-I416 CarbonylContact C-O 3.57Å; A397-I416 VanDerWaalsContact CA-O 3.28Å; A397-I416 WeakPolarHBondContact CA-O 3.5Å; V398-I416 PolarHBondContact N-O 3.34Å; V398-I416 PolarHBondContact O-N 2.74Å; Q414-I416 HydrophobicContact CG-CD1 4.15Å; Q414-I416 HydrophobicContact CG-CG1 3.94Å; I416-L421 HydrophobicContact CG2-CD1 4.43Å; I416-L421 HydrophobicContact CG2-CD2 4.16Å; I416-L421 HydrophobicContact CG2-CG 4.35Å; I416-F428 HydrophobicContact CG2-CE1 4.05Å; I416-F428 HydrophobicContact CG2-CZ 4.17Å; I416-L459 HydrophobicContact CD1-CD1 3.89Å; I416-L459 HydrophobicContact CG2-CD1 4.34Å
417	T	92.1	Very high	88.8	Confident	11 Å²	11	47.4 Å²	47.4	7%	0.067	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	153.4	176.6	60.7	0	0	0	0	110.8	A397 S419 S420	A397-T417 HydrophobicContact CB-CG2 4.21Å; T417-S419 PolarHBondContact O-N 3.3Å; T417-S419 PolarHBondContact OG1-OG 2.92Å; T417-S420 PolarHBondContact N-OG 2.99Å; T417-S420 PolarHBondContact O-N 2.91Å; T417-S420 VanDerWaalsContact O-N 3.16Å; T417-S420 PolarHBondContact O-OG 2.96Å; T417-S420 WeakPolarHBondContact OG1-CB 3.4Å; T417-S420 PolarHBondContact OG1-N 2.98Å; T417-S420 VanDerWaalsContact OG1-N 3.13Å
418	G	86.1	Confident	89	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-54.8	-35.6	172.3	0	0	0	0	0	112.6	G396	G396-G418 PolarHBondContact O-N 3.14Å; G396-G418 VanDerWaalsContact O-N 3.13Å
419	S	84.6	Confident	89.2	Confident	55 Å²	55	46.8 Å²	46.8	39%	0.385	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-71.2	-31.3	179.4	55.5	0	0	0	0	114.7	T417 L421 G422	T417-S419 PolarHBondContact O-N 3.3Å; T417-S419 PolarHBondContact OG1-OG 2.92Å; S419-L421 PolarHBondContact O-N 2.96Å; S419-G422 PolarHBondContact O-N 3.09Å; S419-G422 VanDerWaalsContact O-N 3.16Å
420	S	86.6	Confident	89.4	Confident	59 Å²	59	46.8 Å²	46.8	41%	0.413	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-69.2	-21.4	-179.1	68.7	0	0	0	0	112.3	Q32 T417 G422	Q32-S420 PolarHBondContact OE1-OG 2.96Å; T417-S420 PolarHBondContact N-OG 2.99Å; T417-S420 PolarHBondContact O-N 2.91Å; T417-S420 VanDerWaalsContact O-N 3.16Å; T417-S420 PolarHBondContact O-OG 2.96Å; T417-S420 WeakPolarHBondContact OG1-CB 3.4Å; T417-S420 PolarHBondContact OG1-N 2.98Å; T417-S420 VanDerWaalsContact OG1-N 3.13Å; S420-G422 PolarHBondContact O-N 2.83Å
421	L	84.9	Confident	89.7	Confident	12 Å²	12	44.3 Å²	44.3	6%	0.063	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-80.6	1.6	176.4	-55	-179.7	0	0	0	113.2	Q32 I416 S419 H423 L425 F428 V457 L459	Q32-L421 HydrophobicContact CB-CD2 3.91Å; Q32-L421 HydrophobicContact CG-CD2 4.07Å; I416-L421 HydrophobicContact CG2-CD1 4.43Å; I416-L421 HydrophobicContact CG2-CD2 4.16Å; I416-L421 HydrophobicContact CG2-CG 4.35Å; S419-L421 PolarHBondContact O-N 2.96Å; L421-H423 PolarHBondContact O-CD2 2.85Å; L421-L425 HydrophobicContact CD1-CD1 4.12Å; L421-F428 HydrophobicContact CD1-CE2 3.88Å; L421-F428 HydrophobicContact CD1-CZ 3.83Å; L421-V457 HydrophobicContact CD1-CG1 3.99Å; L421-V457 HydrophobicContact CD1-CG2 4.47Å; L421-L459 HydrophobicContact CD1-CD2 4.26Å; L421-L459 HydrophobicContact CD2-CD2 4.1Å
422	G	67.8	Low	90.1	Very high	65 Å²	65	37.6 Å²	37.6	67%	0.67	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.4	18.9	177.3	0	0	0	0	0	114.6	S419 S420	S419-G422 PolarHBondContact O-N 3.09Å; S419-G422 VanDerWaalsContact O-N 3.16Å; S420-G422 PolarHBondContact O-N 2.83Å
423	H	73.1	Confident	90.3	Very high	76 Å²	76	37 Å²	37	35%	0.352	21%	0.211	S	C	.	.	S	Bend	trans	-132.2	144.1	-176.3	-64	-63.6	0	0	0	111.2	V37 L421 L425	V37-H423 VanDerWaalsContact CG2-CD2 3.43Å; V37-H423 WeakPolarHBondContact CG2-CD2 2.98Å; L421-H423 PolarHBondContact O-CD2 2.85Å; H423-L425 HydrophobicContact CB-CD1 4.3Å; H423-L425 HydrophobicContact CB-CD2 4.34Å; H423-L425 HydrophobicContact CB-CG 3.86Å; H423-L425 PolarHBondContact O-N 2.04Å
424	D	84.5	Confident	90.4	Very high	157 Å²	157	35.8 Å²	35.8	84%	0.84	20%	0.203	S	C	*	.			trans	-76.4	57.8	173.4	-76.7	-26.7	0	0	0	111.3
425	L	93.7	Very high	90.3	Very high	4 Å²	4	37 Å²	37	2%	0.021	22%	0.217	C	C	.	.			trans	-69.9	141.8	176	-62.7	171.5	0	0	0	109.8	V37 R395 L421 H423 F428 A450 V457	V37-L425 HydrophobicContact CG1-CD2 4.35Å; R395-L425 WeakPolarHBondContact CA-O 3.41Å; L421-L425 HydrophobicContact CD1-CD1 4.12Å; H423-L425 HydrophobicContact CB-CD1 4.3Å; H423-L425 HydrophobicContact CB-CD2 4.34Å; H423-L425 HydrophobicContact CB-CG 3.86Å; H423-L425 PolarHBondContact O-N 2.04Å; L425-F428 HydrophobicContact CB-CB 4.36Å; L425-F428 HydrophobicContact CD1-CD2 3.83Å; L425-F428 HydrophobicContact CD1-CE2 4.15Å; L425-A450 HydrophobicContact CB-CB 4.14Å; L425-A450 HydrophobicContact CD2-CB 4.08Å; L425-V457 HydrophobicContact CD1-CG2 3.68Å; L425-V457 HydrophobicContact CD2-CG2 4.42Å
426	K	95.3	Very high	90.1	Very high	102 Å²	102	33.7 Å²	33.7	44%	0.443	21%	0.205	S	C	.	.	S	Bend	trans	-129.2	142.3	177.4	-64.6	-169.6	-180	-170.5	0	111.5	L394 F428 A450 L452 S453	L394-K426 CarbonylContact O-C 3.52Å; L394-K426 WeakPolarHBondContact O-CA 3.5Å; L394-K426 WeakPolarHBondContact O-CB 3.39Å; K426-F428 PolarHBondContact O-N 2.87Å; K426-A450 CarbonylContact O-C 3.55Å; K426-A450 WeakPolarHBondContact O-CA 3.3Å; K426-A450 WeakPolarHBondContact O-CB 3.34Å; K426-L452 HydrophobicContact CB-CB 3.83Å; K426-L452 HydrophobicContact CB-CD2 4.15Å; K426-L452 HydrophobicContact CB-CG 4.26Å; K426-L452 HydrophobicContact CD-CD2 4.23Å; K426-S453 PolarHBondContact N-OG 3.05Å
427	M	95.8	Very high	90	Very high	19 Å²	19	34.7 Å²	34.7	9%	0.094	21%	0.21	C	C	.	.	S	Bend	trans	57.5	34.1	-169.9	-63.4	-79.8	178.6	0	0	112.1	P389 Q390 L394 G429 Q430 F451 L452	P389-M427 HydrophobicContact CB-CB 4.37Å; P389-M427 HydrophobicContact CB-SD 4.19Å; P389-M427 WeakPolarHBondContact O-CA 3.28Å; Q390-M427 HydrophobicContact CG-CE 3.96Å; Q390-M427 HydrophobicContact CG-SD 3.83Å; L394-M427 HydrophobicContact CB-CE 4.38Å; L394-M427 HydrophobicContact CD1-CE 4.11Å; L394-M427 HydrophobicContact CD2-CE 3.6Å; L394-M427 HydrophobicContact CG-CE 4.24Å; L394-M427 PolarHBondContact O-N 2.89Å; M427-G429 PolarHBondContact O-N 2.85Å; M427-Q430 HydrophobicContact CB-CB 4.43Å; M427-Q430 VanDerWaalsContact O-CB 3.32Å; M427-Q430 WeakPolarHBondContact O-CB 3.11Å; M427-Q430 PolarHBondContact O-N 2.87Å; M427-Q430 VanDerWaalsContact O-N 3.13Å; M427-F451 HydrophobicContact CB-CD1 3.55Å; M427-F451 HydrophobicContact CB-CE1 3.36Å; M427-F451 HydrophobicContact CB-CZ 4.2Å; M427-F451 HydrophobicContact CG-CD1 4.09Å; M427-F451 HydrophobicContact CG-CE1 3.43Å; M427-F451 VanDerWaalsContact CG-CE1 3.43Å; M427-F451 HydrophobicContact CG-CZ 3.79Å; M427-F451 HydrophobicContact SD-CE1 4.02Å; M427-F451 HydrophobicContact SD-CZ 4.32Å; M427-L452 HydrophobicContact CB-CB 4.18Å; M427-L452 HydrophobicContact CE-CD2 4.43Å; M427-L452 HydrophobicContact CG-CB 3.74Å; M427-L452 HydrophobicContact CG-CD2 4.13Å
428	F	97.4	Very high	89.8	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	122.8	178.8	-179.3	-101.4	0	0	0	110.2	P389 R395 G396 A397 V398 I416 L421 L425 K426 V448 G449 A450 V457	P389-F428 WeakPolarHBondContact CA-O 3.36Å; R395-F428 WeakPolarHBondContact O-CB 3.37Å; R395-F428 PolarHBondContact O-N 2.9Å; G396-F428 CarbonylContact C-O 3.53Å; G396-F428 WeakPolarHBondContact CA-O 3.28Å; A397-F428 PolarHBondContact N-O 2.92Å; V398-F428 HydrophobicContact CB-CE1 4.27Å; V398-F428 HydrophobicContact CG2-CD1 4.02Å; V398-F428 HydrophobicContact CG2-CE1 3.64Å; V398-F428 HydrophobicContact CG2-CZ 4.32Å; I416-F428 HydrophobicContact CG2-CE1 4.05Å; I416-F428 HydrophobicContact CG2-CZ 4.17Å; L421-F428 HydrophobicContact CD1-CE2 3.88Å; L421-F428 HydrophobicContact CD1-CZ 3.83Å; L425-F428 HydrophobicContact CB-CB 4.36Å; L425-F428 HydrophobicContact CD1-CD2 3.83Å; L425-F428 HydrophobicContact CD1-CE2 4.15Å; K426-F428 PolarHBondContact O-N 2.87Å; F428-V448 HydrophobicContact CD1-CG1 4.31Å; F428-V448 HydrophobicContact CD2-CB 4.36Å; F428-V448 HydrophobicContact CD2-CG1 3.69Å; F428-V448 HydrophobicContact CE1-CG1 4.06Å; F428-V448 HydrophobicContact CE2-CB 3.68Å; F428-V448 HydrophobicContact CE2-CG1 3.4Å; F428-V448 VanDerWaalsContact CE2-CG1 3.4Å; F428-V448 HydrophobicContact CE2-CG2 4.29Å; F428-V448 HydrophobicContact CG-CG1 4.15Å; F428-V448 HydrophobicContact CZ-CB 3.94Å; F428-V448 HydrophobicContact CZ-CG1 3.61Å; F428-V448 HydrophobicContact CZ-CG2 4.07Å; F428-G449 WeakPolarHBondContact CA-O 3.19Å; F428-A450 HydrophobicContact CB-CB 4.32Å; F428-A450 HydrophobicContact CD2-CB 4.3Å; F428-V457 HydrophobicContact CD2-CG2 4.41Å; F428-V457 HydrophobicContact CE2-CB 4.15Å; F428-V457 HydrophobicContact CE2-CG2 3.93Å
429	G	96.8	Very high	89.8	Confident	0 Å²	0	36 Å²	36	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	99.3	8.2	-172.3	0	0	0	0	0	113.9	T369 M427 S431 G449	T369-G429 PolarHBondContact OG1-O 2.74Å; M427-G429 PolarHBondContact O-N 2.85Å; G429-S431 PolarHBondContact O-N 3.45Å; G429-G449 PolarHBondContact N-O 2.77Å
430	Q	96.2	Very high	90	Very high	29 Å²	29	38 Å²	38	14%	0.136	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	-26.7	174.5	178.4	62.9	54.8	0	0	113.1	T369 P389 M427 G449 F451	T369-Q430 WeakPolarHBondContact CG2-O 3.47Å; P389-Q430 HydrophobicContact CB-CB 4.28Å; M427-Q430 HydrophobicContact CB-CB 4.43Å; M427-Q430 VanDerWaalsContact O-CB 3.32Å; M427-Q430 WeakPolarHBondContact O-CB 3.11Å; M427-Q430 PolarHBondContact O-N 2.87Å; M427-Q430 VanDerWaalsContact O-N 3.13Å; Q430-G449 PolarHBondContact N-O 3.04Å; Q430-F451 HydrophobicContact CB-CD1 3.73Å; Q430-F451 HydrophobicContact CB-CE1 4.05Å; Q430-F451 HydrophobicContact CG-CD1 3.48Å; Q430-F451 VanDerWaalsContact CG-CD1 3.48Å; Q430-F451 HydrophobicContact CG-CE1 3.62Å
431	S	97.8	Very high	89.8	Confident	14 Å²	14	36 Å²	36	10%	0.098	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	144.3	173.3	55.1	0	0	0	0	109.7	G47 Y48 S49 V50 G429 V448 G449	G47-S431 PolarHBondContact O-OG 2.92Å; Y48-S431 VanDerWaalsContact O-CB 3.28Å; Y48-S431 WeakPolarHBondContact O-CB 3.33Å; Y48-S431 PolarHBondContact O-OG 2.96Å; S49-S431 WeakPolarHBondContact CA-OG 3.5Å; V50-S431 PolarHBondContact N-OG 2.93Å; G429-S431 PolarHBondContact O-N 3.45Å; S431-V448 WeakPolarHBondContact O-CA 3.36Å; S431-G449 PolarHBondContact O-N 3.45Å
432	L	97.6	Very high	89.9	Confident	22 Å²	22	36.8 Å²	36.8	12%	0.115	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	139.3	-174.7	-67.4	170.7	0	0	0	108.9	T369 A371 A385 V398 A447 V448	T369-L432 WeakPolarHBondContact OG1-CD1 3.32Å; A371-L432 HydrophobicContact CB-CB 3.6Å; A385-L432 HydrophobicContact CB-CD1 3.9Å; V398-L432 HydrophobicContact CG1-CD1 4.27Å; V398-L432 HydrophobicContact CG1-CD2 4.03Å; V398-L432 HydrophobicContact CG2-CD2 3.87Å; L432-A447 WeakPolarHBondContact CA-O 3.35Å; L432-V448 HydrophobicContact CD2-CB 4.12Å; L432-V448 HydrophobicContact CD2-CG1 3.79Å; L432-V448 HydrophobicContact CD2-CG2 3.72Å
433	N	96.2	Very high	91	Very high	37 Å²	37	33.9 Å²	33.9	20%	0.198	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	143.4	172.8	-178.7	-106.2	0	0	0	111.6	V50 L51 L52 A447	V50-N433 HydrophobicContact CG2-CB 4.44Å; V50-N433 WeakPolarHBondContact O-CB 3Å; L51-N433 WeakPolarHBondContact CD1-OD1 3.32Å; L52-N433 PolarHBondContact N-OD1 2.04Å; N433-A447 PolarHBondContact N-O 3.37Å; N433-A447 PolarHBondContact O-N 3.03Å
434	S	93.5	Very high	91.8	Very high	9 Å²	9	32.8 Å²	32.8	6%	0.063	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	-171.1	176.3	-170.7	0	0	0	0	110.7	D372 L373 D445	D372-S434 WeakPolarHBondContact O-CB 3.13Å; L373-S434 PolarHBondContact O-OG 3.34Å; S434-D445 WeakPolarHBondContact CA-O 3.37Å; S434-D445 PolarHBondContact OG-O 3.3Å
435	G	88.4	Confident	92.2	Very high	29 Å²	29	25.3 Å²	25.3	30%	0.299	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	101.2	14.1	171.5	0	0	0	0	0	114.7	R124	R124-G435 PolarHBondContact NH2-O 2.76Å; R124-G435 VanDerWaalsContact NH2-O 3.09Å
436	I	90.9	Very high	92.4	Very high	8 Å²	8	25.1 Å²	25.1	4%	0.041	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	128.2	170.7	-62.3	-66.6	0	0	0	108.6	L52 R54 I438 D445	L52-I436 HydrophobicContact CB-CB 3.92Å; L52-I436 HydrophobicContact CB-CG1 4.03Å; R54-I436 HydrophobicContact CB-CD1 3.98Å; R54-I436 HydrophobicContact CB-CG2 4.23Å; I436-I438 HydrophobicContact CG2-CG2 4.31Å; I436-D445 PolarHBondContact O-N 3.27Å
437	D	90.7	Very high	92.5	Very high	21 Å²	21	20.3 Å²	20.3	11%	0.112	12%	0.122	C	C	.	.			trans	-82.4	111.3	166.8	177.8	-6.4	0	0	0	109.7	K59 D439 D440 N441 G442 Y443	K59-D437 WeakPolarHBondContact CE-O 3.27Å; K59-D437 PolarHBondContact NZ-O 2.86Å; D437-D439 PolarHBondContact OD1-N 3.34Å; D437-D439 VanDerWaalsContact OD1-N 3.12Å; D437-D440 VanDerWaalsContact OD1-CA 3.31Å; D437-D440 WeakPolarHBondContact OD1-CA 3.31Å; D437-D440 PolarHBondContact OD1-N 3.11Å; D437-D440 VanDerWaalsContact OD2-C 3.28Å; D437-D440 WeakPolarHBondContact OD2-CA 3.33Å; D437-N441 PolarHBondContact OD1-N 3.22Å; D437-N441 PolarHBondContact OD2-N 3.12Å; D437-G442 WeakPolarHBondContact OD2-CA 3.34Å; D437-G442 PolarHBondContact OD2-N 2.65Å; D437-Y443 WeakPolarHBondContact CA-O 3.33Å; D437-Y443 WeakPolarHBondContact CB-O 3.5Å
438	I	88.9	Confident	92.6	Very high	2 Å²	2	19.4 Å²	19.4	1%	0.01	12%	0.118	C	C	.	.	S	Bend	trans	-85.4	-22.3	-175.2	86.5	-163.3	0	0	0	112.9	M36 L52 K59 I86 I436 D445 V458 R460	M36-I438 HydrophobicContact CE-CD1 4.25Å; L52-I438 HydrophobicContact CD1-CG2 4.3Å; L52-I438 HydrophobicContact CD2-CG2 4.31Å; K59-I438 HydrophobicContact CD-CB 4.32Å; K59-I438 VanDerWaalsContact CD-O 3.24Å; K59-I438 WeakPolarHBondContact CD-O 3.39Å; K59-I438 WeakPolarHBondContact CE-O 3.37Å; K59-I438 PolarHBondContact NZ-O 3.27Å; I86-I438 HydrophobicContact CD1-CB 4.24Å; I86-I438 HydrophobicContact CD1-CG2 3.88Å; I86-I438 HydrophobicContact CG2-CB 4.44Å; I86-I438 HydrophobicContact CG2-CD1 3.99Å; I86-I438 HydrophobicContact CG2-CG1 4.28Å; I436-I438 HydrophobicContact CG2-CG2 4.31Å; I438-D445 WeakPolarHBondContact CA-OD2 2.95Å; I438-D445 WeakPolarHBondContact CB-OD2 3.4Å; I438-D445 HydrophobicContact CD1-CB 4.19Å; I438-D445 HydrophobicContact CG1-CB 4.45Å; I438-D445 WeakPolarHBondContact CG1-OD2 3.41Å; I438-D445 HydrophobicContact CG2-CB 4.11Å; I438-D445 PolarHBondContact N-OD2 2.89Å; I438-V458 HydrophobicContact CD1-CB 4.49Å; I438-V458 HydrophobicContact CD1-CG1 3.35Å; I438-R460 HydrophobicContact CD1-CG 3.49Å; I438-R460 VanDerWaalsContact CD1-CG 3.49Å; I438-R460 HydrophobicContact CG1-CG 4.01Å
439	D	86.1	Confident	92.6	Very high	37 Å²	37	19.4 Å²	19.4	20%	0.198	12%	0.118	C	C	.	.	S	Bend	trans	-118	10.1	-177.5	74.5	-2.7	0	0	0	115	D437 N441 R460 L594 I597	D437-D439 PolarHBondContact OD1-N 3.34Å; D437-D439 VanDerWaalsContact OD1-N 3.12Å; D439-N441 PolarHBondContact O-N 2.75Å; D439-N441 VanDerWaalsContact OD1-CB 3.23Å; D439-N441 WeakPolarHBondContact OD1-CB 3.34Å; D439-N441 PolarHBondContact OD1-ND2 2.84Å; D439-R460 WeakPolarHBondContact OD2-CD 3.29Å; D439-R460 IonicContact OD2-CZ 2.74Å; D439-R460 IonicContact OD2-NE 3.2Å; D439-R460 IonicContact OD2-NH1 3.4Å; D439-R460 PolarHBondContact OD2-NH1 2.77Å; D439-L594 HydrophobicContact CB-CD1 3.7Å; D439-I597 WeakPolarHBondContact OD2-CD1 3.25Å
440	D	86.9	Confident	92.6	Very high	97 Å²	97	19.4 Å²	19.4	52%	0.519	12%	0.118	S	C	.	.	S	Bend	trans	56.7	37.3	177.5	-57.4	-54.1	0	0	0	112.2	K59 D437	K59-D440 IonicContact NZ-OD1 3.99Å; K59-D440 PolarHBondContact NZ-OD1 2.95Å; K59-D440 IonicContact NZ-OD2 2.77Å; K59-D440 PolarHBondContact NZ-OD2 3.36Å; D437-D440 VanDerWaalsContact OD1-CA 3.31Å; D437-D440 WeakPolarHBondContact OD1-CA 3.31Å; D437-D440 PolarHBondContact OD1-N 3.11Å; D437-D440 VanDerWaalsContact OD2-C 3.28Å; D437-D440 WeakPolarHBondContact OD2-CA 3.33Å
441	N	84.5	Confident	92.6	Very high	17 Å²	17	19.1 Å²	19.1	9%	0.091	12%	0.116	C	C	.	.	S	Bend	trans	-92.5	-1.4	179.3	77.8	18.4	0	0	0	113.8	D437 D439 Y443 T461 P463 H506	D437-N441 PolarHBondContact OD1-N 3.22Å; D437-N441 PolarHBondContact OD2-N 3.12Å; D439-N441 PolarHBondContact O-N 2.75Å; D439-N441 VanDerWaalsContact OD1-CB 3.23Å; D439-N441 WeakPolarHBondContact OD1-CB 3.34Å; D439-N441 PolarHBondContact OD1-ND2 2.84Å; N441-Y443 WeakPolarHBondContact O-CD2 3.49Å; N441-Y443 WeakPolarHBondContact OD1-CB 3.44Å; N441-Y443 WeakPolarHBondContact OD1-CD2 3.47Å; N441-Y443 PolarHBondContact OD1-N 3.43Å; N441-T461 PolarHBondContact ND2-O 3.5Å; N441-P463 HydrophobicContact CB-CG 4.46Å; N441-H506 VanDerWaalsContact O-CB 3.3Å; N441-H506 WeakPolarHBondContact O-CB 3.22Å
442	G	86.7	Confident	92.5	Very high	28 Å²	28	22.4 Å²	22.4	29%	0.289	13%	0.132	S	C	.	.	S	Bend	trans	92.6	2.3	178.6	0	0	0	0	0	115.1	D437 K505	D437-G442 WeakPolarHBondContact OD2-CA 3.34Å; D437-G442 PolarHBondContact OD2-N 2.65Å; G442-K505 PolarHBondContact O-NZ 3Å
443	Y	89.1	Confident	92.4	Very high	4 Å²	4	22.8 Å²	22.8	2%	0.016	14%	0.136	C	C	.	.	S	Bend	trans	-122.4	141.9	-179.7	-61.8	-96.3	0	0	0	110.5	D378 D437 N441 T461 P463 V464	D378-Y443 HydrophobicContact CB-CE1 4.06Å; D437-Y443 WeakPolarHBondContact CA-O 3.33Å; D437-Y443 WeakPolarHBondContact CB-O 3.5Å; N441-Y443 WeakPolarHBondContact O-CD2 3.49Å; N441-Y443 WeakPolarHBondContact OD1-CB 3.44Å; N441-Y443 WeakPolarHBondContact OD1-CD2 3.47Å; N441-Y443 PolarHBondContact OD1-N 3.43Å; Y443-T461 HydrophobicContact CD1-CG2 4.07Å; Y443-T461 HydrophobicContact CG-CG2 4.04Å; Y443-P463 HydrophobicContact CE2-CB 4.01Å; Y443-V464 HydrophobicContact CE1-CB 4.31Å; Y443-V464 HydrophobicContact CE1-CG2 4.24Å; Y443-V464 PolarHBondContact OH-N 2.95Å; Y443-V464 PolarHBondContact OH-O 3.39Å
444	N	90.9	Very high	92.4	Very high	52 Å²	52	21.9 Å²	21.9	28%	0.278	13%	0.132	S	C	.	.			trans	-71.3	144.3	175.2	-67.7	-32.2	0	0	0	110.3	L376 T461	L376-N444 WeakPolarHBondContact CD1-O 3.35Å; N444-T461 WeakPolarHBondContact O-CB 3.26Å; N444-T461 PolarHBondContact O-OG1 3.49Å
445	D	93.8	Very high	92.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	165.4	176.9	-57.8	-58.2	0	0	0	111.7	L52 S434 I436 I438 L459 R460 T461	L52-D445 HydrophobicContact CD1-CB 4.41Å; L52-D445 VanDerWaalsContact CD1-O 3.26Å; L52-D445 WeakPolarHBondContact CD1-O 3.31Å; S434-D445 WeakPolarHBondContact CA-O 3.37Å; S434-D445 PolarHBondContact OG-O 3.3Å; I436-D445 PolarHBondContact O-N 3.27Å; I438-D445 WeakPolarHBondContact CA-OD2 2.95Å; I438-D445 WeakPolarHBondContact CB-OD2 3.4Å; I438-D445 HydrophobicContact CD1-CB 4.19Å; I438-D445 HydrophobicContact CG1-CB 4.45Å; I438-D445 WeakPolarHBondContact CG1-OD2 3.41Å; I438-D445 HydrophobicContact CG2-CB 4.11Å; I438-D445 PolarHBondContact N-OD2 2.89Å; D445-L459 WeakPolarHBondContact CB-O 3.5Å; D445-R460 WeakPolarHBondContact OD1-CA 3.31Å; D445-T461 PolarHBondContact OD1-N 2.88Å
446	V	96.3	Very high	92.9	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.006	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	127.5	-170.4	-175.7	0	0	0	0	111	L30 L373 V448 V458 L459	L30-V446 HydrophobicContact CD1-CB 4.48Å; L30-V446 HydrophobicContact CD1-CG2 4.15Å; L30-V446 HydrophobicContact CD2-CB 4.32Å; L30-V446 HydrophobicContact CD2-CG2 3.8Å; L373-V446 HydrophobicContact CD2-CG1 4.25Å; L373-V446 HydrophobicContact CD2-CG2 3.81Å; V446-V448 HydrophobicContact CG1-CG2 4.18Å; V446-V458 WeakPolarHBondContact O-CA 3.14Å; V446-L459 PolarHBondContact N-O 3.32Å; V446-L459 PolarHBondContact O-N 3.45Å
447	A	97.3	Very high	93.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	137.4	168.7	0	0	0	0	0	111.1	V50 L52 L61 L432 N433 V457 V458	V50-A447 HydrophobicContact CB-CB 4.16Å; V50-A447 HydrophobicContact CG2-CB 3.95Å; L52-A447 HydrophobicContact CD1-CB 4.32Å; L52-A447 HydrophobicContact CD2-CB 4.01Å; L52-A447 HydrophobicContact CG-CB 3.84Å; L61-A447 HydrophobicContact CD1-CB 3.71Å; L432-A447 WeakPolarHBondContact CA-O 3.35Å; N433-A447 PolarHBondContact N-O 3.37Å; N433-A447 PolarHBondContact O-N 3.03Å; A447-V457 CarbonylContact C-O 3.6Å; A447-V457 VanDerWaalsContact CA-O 3.31Å; A447-V457 WeakPolarHBondContact CA-O 3.3Å; A447-V458 HydrophobicContact CB-CG2 4.43Å
448	V	98.1	Very high	93.3	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	128.5	-178.9	-170.2	0	0	0	0	110.6	V398 F428 S431 L432 V446 A456 V457 L459	V398-V448 HydrophobicContact CG2-CG1 3.84Å; V398-V448 HydrophobicContact CG2-CG2 4.49Å; F428-V448 HydrophobicContact CD1-CG1 4.31Å; F428-V448 HydrophobicContact CD2-CB 4.36Å; F428-V448 HydrophobicContact CD2-CG1 3.69Å; F428-V448 HydrophobicContact CE1-CG1 4.06Å; F428-V448 HydrophobicContact CE2-CB 3.68Å; F428-V448 HydrophobicContact CE2-CG1 3.4Å; F428-V448 VanDerWaalsContact CE2-CG1 3.4Å; F428-V448 HydrophobicContact CE2-CG2 4.29Å; F428-V448 HydrophobicContact CG-CG1 4.15Å; F428-V448 HydrophobicContact CZ-CB 3.94Å; F428-V448 HydrophobicContact CZ-CG1 3.61Å; F428-V448 HydrophobicContact CZ-CG2 4.07Å; S431-V448 WeakPolarHBondContact O-CA 3.36Å; L432-V448 HydrophobicContact CD2-CB 4.12Å; L432-V448 HydrophobicContact CD2-CG1 3.79Å; L432-V448 HydrophobicContact CD2-CG2 3.72Å; V446-V448 HydrophobicContact CG1-CG2 4.18Å; V448-A456 CarbonylContact O-C 3.6Å; V448-A456 WeakPolarHBondContact O-CA 3.47Å; V448-V457 PolarHBondContact N-O 3.02Å; V448-V457 PolarHBondContact O-N 3.45Å; V448-L459 HydrophobicContact CG2-CD1 4.15Å
449	G	97.8	Very high	93.6	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	142.3	175.7	0	0	0	0	0	113.7	G47 F428 G429 Q430 S431	G47-G449 CarbonylContact O-C 3.2Å; G47-G449 WeakPolarHBondContact O-CA 3.43Å; F428-G449 WeakPolarHBondContact CA-O 3.19Å; G429-G449 PolarHBondContact N-O 2.77Å; Q430-G449 PolarHBondContact N-O 3.04Å; S431-G449 PolarHBondContact O-N 3.45Å
450	A	97.2	Very high	93.9	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	67.3	175.5	0	0	0	0	0	110.2	L425 K426 F428 L452 S453 D454 S455	L425-A450 HydrophobicContact CB-CB 4.14Å; L425-A450 HydrophobicContact CD2-CB 4.08Å; K426-A450 CarbonylContact O-C 3.55Å; K426-A450 WeakPolarHBondContact O-CA 3.3Å; K426-A450 WeakPolarHBondContact O-CB 3.34Å; F428-A450 HydrophobicContact CB-CB 4.32Å; F428-A450 HydrophobicContact CD2-CB 4.3Å; A450-L452 VanDerWaalsContact C-N 3.33Å; A450-L452 PolarHBondContact O-N 2.87Å; A450-S453 WeakPolarHBondContact CB-OG 3.11Å; A450-S453 PolarHBondContact O-N 2.86Å; A450-S453 VanDerWaalsContact O-N 3.12Å; A450-S453 PolarHBondContact O-OG 3.2Å; A450-D454 PolarHBondContact O-N 3.17Å; A450-S455 CarbonylContact C-O 3.51Å; A450-S455 WeakPolarHBondContact CA-O 3.43Å; A450-S455 PolarHBondContact N-O 3.19Å; A450-S455 PolarHBondContact O-N 3.34Å
451	F	96.4	Very high	94.2	Very high	23 Å²	23	12.8 Å²	12.8	10%	0.101	8%	0.075	C	C	.	.	G	3₁₀ helix	trans	-65.5	-29.7	-162.6	79.4	-87.2	0	0	0	115.2	M45 F46 Y48 M427 Q430 S453 D454	M45-F451 HydrophobicContact CB-CB 4.33Å; M45-F451 HydrophobicContact CB-CD2 3.92Å; M45-F451 HydrophobicContact CE-CE2 4.46Å; M45-F451 HydrophobicContact CG-CD2 3.83Å; M45-F451 HydrophobicContact CG-CE2 4.39Å; M45-F451 HydrophobicContact SD-CD2 4.28Å; M45-F451 HydrophobicContact SD-CE2 4.39Å; F46-F451 WeakPolarHBondContact O-CA 3.01Å; Y48-F451 HydrophobicContact CD2-CD2 4.33Å; Y48-F451 HydrophobicContact CD2-CG 4.21Å; M427-F451 HydrophobicContact CB-CD1 3.55Å; M427-F451 HydrophobicContact CB-CE1 3.36Å; M427-F451 HydrophobicContact CB-CZ 4.2Å; M427-F451 HydrophobicContact CG-CD1 4.09Å; M427-F451 HydrophobicContact CG-CE1 3.43Å; M427-F451 VanDerWaalsContact CG-CE1 3.43Å; M427-F451 HydrophobicContact CG-CZ 3.79Å; M427-F451 HydrophobicContact SD-CE1 4.02Å; M427-F451 HydrophobicContact SD-CZ 4.32Å; Q430-F451 HydrophobicContact CB-CD1 3.73Å; Q430-F451 HydrophobicContact CB-CE1 4.05Å; Q430-F451 HydrophobicContact CG-CD1 3.48Å; Q430-F451 VanDerWaalsContact CG-CD1 3.48Å; Q430-F451 HydrophobicContact CG-CE1 3.62Å; F451-S453 PolarHBondContact O-N 3.12Å; F451-D454 PolarHBondContact O-N 2.88Å
452	L	95.6	Very high	94.4	Very high	84 Å²	84	14.3 Å²	14.3	44%	0.44	8%	0.08	S	C	.	.	G	3₁₀ helix	trans	-73.9	-18	-178.7	-166.2	66.9	0	0	0	111.7	L394 K426 M427 A450	L394-L452 HydrophobicContact CD1-CD2 4.24Å; K426-L452 HydrophobicContact CB-CB 3.83Å; K426-L452 HydrophobicContact CB-CD2 4.15Å; K426-L452 HydrophobicContact CB-CG 4.26Å; K426-L452 HydrophobicContact CD-CD2 4.23Å; M427-L452 HydrophobicContact CB-CB 4.18Å; M427-L452 HydrophobicContact CE-CD2 4.43Å; M427-L452 HydrophobicContact CG-CB 3.74Å; M427-L452 HydrophobicContact CG-CD2 4.13Å; A450-L452 VanDerWaalsContact C-N 3.33Å; A450-L452 PolarHBondContact O-N 2.87Å
453	S	95.1	Very high	94.5	Very high	29 Å²	29	14 Å²	14	20%	0.203	7%	0.072	C	C	.	.	G	3₁₀ helix	trans	-98.4	11.6	168.6	49	0	0	0	0	113.5	K426 A450 F451 S455	K426-S453 PolarHBondContact N-OG 3.05Å; A450-S453 WeakPolarHBondContact CB-OG 3.11Å; A450-S453 PolarHBondContact O-N 2.86Å; A450-S453 VanDerWaalsContact O-N 3.12Å; A450-S453 PolarHBondContact O-OG 3.2Å; F451-S453 PolarHBondContact O-N 3.12Å; S453-S455 PolarHBondContact O-N 3.1Å; S453-S455 VanDerWaalsContact O-N 3.11Å; S453-S455 PolarHBondContact O-OG 3.26Å
454	D	96	Very high	94.5	Very high	19 Å²	19	13.8 Å²	13.8	10%	0.102	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.9	40	-175	-63.2	-65.2	0	0	0	112.7	G40 S43 S44 M45 F46 A450 F451	G40-D454 PolarHBondContact N-O 3.09Å; S43-D454 PolarHBondContact N-OD2 3.45Å; S44-D454 PolarHBondContact N-OD1 2.83Å; S44-D454 PolarHBondContact OG-OD1 2.83Å; M45-D454 WeakPolarHBondContact CA-OD1 3.22Å; M45-D454 PolarHBondContact N-OD1 2.82Å; F46-D454 HydrophobicContact CB-CB 4.13Å; F46-D454 VanDerWaalsContact CD1-O 3.3Å; F46-D454 WeakPolarHBondContact CD1-O 3.48Å; F46-D454 PolarHBondContact N-OD1 2.99Å; F46-D454 CarbonylContact O-C 3.25Å; F46-D454 VanDerWaalsContact O-CA 3.25Å; F46-D454 WeakPolarHBondContact O-CA 3.06Å; A450-D454 PolarHBondContact O-N 3.17Å; F451-D454 PolarHBondContact O-N 2.88Å
455	S	95.6	Very high	94.4	Very high	4 Å²	4	11.5 Å²	11.5	3%	0.028	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	152	-171.1	-62.6	0	0	0	0	112.7	F38 F46 A450 S453	F38-S455 VanDerWaalsContact O-CA 3.26Å; F38-S455 WeakPolarHBondContact O-CA 3.48Å; F46-S455 PolarHBondContact O-N 3.1Å; A450-S455 CarbonylContact C-O 3.51Å; A450-S455 WeakPolarHBondContact CA-O 3.43Å; A450-S455 PolarHBondContact N-O 3.19Å; A450-S455 PolarHBondContact O-N 3.34Å; S453-S455 PolarHBondContact O-N 3.1Å; S453-S455 VanDerWaalsContact O-N 3.11Å; S453-S455 PolarHBondContact O-OG 3.26Å
456	A	96.6	Very high	94.1	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	147.2	169.8	0	0	0	0	0	109.4	F38 F46 V50 L61 V63 V448	F38-A456 PolarHBondContact N-O 2.84Å; F38-A456 PolarHBondContact O-N 2.88Å; F46-A456 HydrophobicContact CE1-CB 3.95Å; V50-A456 HydrophobicContact CG1-CB 3.89Å; L61-A456 HydrophobicContact CD2-CB 4Å; V63-A456 HydrophobicContact CG1-CB 4.19Å; V63-A456 HydrophobicContact CG2-CB 3.92Å; V448-A456 CarbonylContact O-C 3.6Å; V448-A456 WeakPolarHBondContact O-CA 3.47Å
457	V	95.9	Very high	93.7	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.5	-175.6	-175.1	0	0	0	0	109.6	M36 V37 L421 L425 F428 A447 V448 L459	M36-V457 CarbonylContact O-C 3.55Å; M36-V457 VanDerWaalsContact O-CA 3.28Å; M36-V457 WeakPolarHBondContact O-CA 3.42Å; V37-V457 HydrophobicContact CG1-CG2 4.4Å; V37-V457 HydrophobicContact CG2-CG1 4.38Å; V37-V457 HydrophobicContact CG2-CG2 4.02Å; L421-V457 HydrophobicContact CD1-CG1 3.99Å; L421-V457 HydrophobicContact CD1-CG2 4.47Å; L425-V457 HydrophobicContact CD1-CG2 3.68Å; L425-V457 HydrophobicContact CD2-CG2 4.42Å; F428-V457 HydrophobicContact CD2-CG2 4.41Å; F428-V457 HydrophobicContact CE2-CB 4.15Å; F428-V457 HydrophobicContact CE2-CG2 3.93Å; A447-V457 CarbonylContact C-O 3.6Å; A447-V457 VanDerWaalsContact CA-O 3.31Å; A447-V457 WeakPolarHBondContact CA-O 3.3Å; V448-V457 PolarHBondContact N-O 3.02Å; V448-V457 PolarHBondContact O-N 3.45Å; V457-L459 HydrophobicContact CG1-CD2 3.84Å; V457-L459 HydrophobicContact CG1-CG 4.17Å
458	V	95.3	Very high	93.3	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	125.6	165.8	-175.1	0	0	0	0	108.9	M36 F38 L52 L61 I438 V446 A447	M36-V458 HydrophobicContact CB-CB 4.34Å; M36-V458 PolarHBondContact N-O 3.33Å; M36-V458 PolarHBondContact O-N 3.13Å; F38-V458 HydrophobicContact CD2-CG2 4.45Å; F38-V458 HydrophobicContact CE2-CB 4.44Å; F38-V458 HydrophobicContact CE2-CG2 3.88Å; L52-V458 HydrophobicContact CD2-CG1 4.37Å; L52-V458 HydrophobicContact CD2-CG2 4.15Å; L61-V458 HydrophobicContact CB-CG2 4.37Å; L61-V458 HydrophobicContact CD1-CG2 3.99Å; L61-V458 HydrophobicContact CD2-CG2 3.89Å; L61-V458 HydrophobicContact CG-CG2 4.3Å; I438-V458 HydrophobicContact CD1-CB 4.49Å; I438-V458 HydrophobicContact CD1-CG1 3.35Å; V446-V458 WeakPolarHBondContact O-CA 3.14Å; A447-V458 HydrophobicContact CB-CG2 4.43Å
459	L	94.6	Very high	93	Very high	1 Å²	1	23 Å²	23	1%	0.005	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	126.9	177.9	-60.1	176.8	0	0	0	108	L30 I416 L421 D445 V446 V448 V457	L30-L459 HydrophobicContact CD2-CB 4.42Å; I416-L459 HydrophobicContact CD1-CD1 3.89Å; I416-L459 HydrophobicContact CG2-CD1 4.34Å; L421-L459 HydrophobicContact CD1-CD2 4.26Å; L421-L459 HydrophobicContact CD2-CD2 4.1Å; D445-L459 WeakPolarHBondContact CB-O 3.5Å; V446-L459 PolarHBondContact N-O 3.32Å; V446-L459 PolarHBondContact O-N 3.45Å; V448-L459 HydrophobicContact CG2-CD1 4.15Å; V457-L459 HydrophobicContact CG1-CD2 3.84Å; V457-L459 HydrophobicContact CG1-CG 4.17Å
460	R	92.8	Very high	92.7	Very high	6 Å²	6	25.7 Å²	25.7	2%	0.023	14%	0.135	C	C	.	.	P	Polyproline II helix	trans	-93.2	145	-179.4	-69.2	-176.6	-67.7	152.7	0.4	111.8	D31 M36 I438 D439 D445 A595 I597	D31-R460 WeakPolarHBondContact CB-O 3.26Å; D31-R460 PolarHBondContact N-O 3.31Å; M36-R460 VanDerWaalsContact CE-CD 3.48Å; M36-R460 HydrophobicContact CE-CG 4.13Å; M36-R460 VanDerWaalsContact CE-NE 3.27Å; I438-R460 HydrophobicContact CD1-CG 3.49Å; I438-R460 VanDerWaalsContact CD1-CG 3.49Å; I438-R460 HydrophobicContact CG1-CG 4.01Å; D439-R460 WeakPolarHBondContact OD2-CD 3.29Å; D439-R460 IonicContact OD2-CZ 2.74Å; D439-R460 IonicContact OD2-NE 3.2Å; D439-R460 IonicContact OD2-NH1 3.4Å; D439-R460 PolarHBondContact OD2-NH1 2.77Å; D445-R460 WeakPolarHBondContact OD1-CA 3.31Å; R460-A595 PolarHBondContact NH1-O 3.05Å; R460-A595 PolarHBondContact NH2-O 2.78Å; R460-A595 VanDerWaalsContact NH2-O 3.16Å; R460-I597 HydrophobicContact CB-CD1 3.32Å; R460-I597 HydrophobicContact CG-CD1 4.23Å
461	T	92.5	Very high	92.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	-86.1	131.2	179.5	-57.3	0	0	0	0	110.6	N29 L30 L376 N441 Y443 N444 D445	N29-T461 HydrophobicContact CB-CG2 4.44Å; N29-T461 CarbonylContact O-C 3.58Å; L30-T461 WeakPolarHBondContact CD2-OG1 3.43Å; L376-T461 HydrophobicContact CD1-CG2 3.77Å; L376-T461 VanDerWaalsContact CD1-OG1 3.27Å; L376-T461 WeakPolarHBondContact CD1-OG1 3.3Å; L376-T461 HydrophobicContact CG-CG2 3.74Å; N441-T461 PolarHBondContact ND2-O 3.5Å; Y443-T461 HydrophobicContact CD1-CG2 4.07Å; Y443-T461 HydrophobicContact CG-CG2 4.04Å; N444-T461 WeakPolarHBondContact O-CB 3.26Å; N444-T461 PolarHBondContact O-OG1 3.49Å; D445-T461 PolarHBondContact OD1-N 2.88Å
462	R	89.6	Confident	92.4	Very high	50 Å²	50	29.7 Å²	29.7	19%	0.189	16%	0.157	C	C	.	.	P	Polyproline II helix	trans	-77.7	132.9	178.9	-60.1	174.8	62.3	-171.9	-3.8	108.9	N29 D31 V464 I597 K598 P599 I600	N29-R462 VanDerWaalsContact O-CB 3.3Å; N29-R462 WeakPolarHBondContact O-CB 3.37Å; N29-R462 VanDerWaalsContact O-CG 3.24Å; N29-R462 WeakPolarHBondContact O-CG 3.41Å; N29-R462 PolarHBondContact O-N 2.87Å; D31-R462 HydrophobicContact CB-CG 3.94Å; R462-V464 PolarHBondContact O-N 3.49Å; R462-I597 HydrophobicContact CB-CG2 3.94Å; R462-I597 HydrophobicContact CG-CG2 3.47Å; R462-I597 VanDerWaalsContact CG-CG2 3.47Å; R462-K598 PolarHBondContact NE-O 3.18Å; R462-K598 PolarHBondContact NH2-O 3.49Å; R462-P599 PolarHBondContact NH2-O 3.31Å; R462-I600 HydrophobicContact CB-CG2 4.12Å
463	P	88.3	Confident	92.2	Very high	20 Å²	20	27 Å²	27	13%	0.13	14%	0.142	C	C	.	.	P	Polyproline II helix	trans	-58.2	130	175.4	-26	34.5	0	0	0	112	N441 Y443 P599 I600	N441-P463 HydrophobicContact CB-CG 4.46Å; Y443-P463 HydrophobicContact CE2-CB 4.01Å; P463-P599 CarbonylContact O-C 3.34Å; P463-P599 WeakPolarHBondContact O-CA 3.23Å; P463-P599 WeakPolarHBondContact O-CB 3.36Å; P463-I600 PolarHBondContact O-N 2.73Å
464	V	88.9	Confident	91.9	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.006	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	136.5	-177.8	-178.1	0	0	0	0	110.9	N29 D377 Y443 R462 I600 Q602	N29-V464 HydrophobicContact CB-CG2 4.33Å; D377-V464 HydrophobicContact CB-CG2 4.46Å; D377-V464 WeakPolarHBondContact O-CG1 3.23Å; Y443-V464 HydrophobicContact CE1-CB 4.31Å; Y443-V464 HydrophobicContact CE1-CG2 4.24Å; Y443-V464 PolarHBondContact OH-N 2.95Å; Y443-V464 PolarHBondContact OH-O 3.39Å; R462-V464 PolarHBondContact O-N 3.49Å; V464-I600 CarbonylContact C-O 3.47Å; V464-I600 WeakPolarHBondContact CA-O 3.23Å; V464-I600 HydrophobicContact CG2-CG2 4.08Å; V464-Q602 HydrophobicContact CG1-CB 3.53Å; V464-Q602 HydrophobicContact CG1-CG 3.91Å
465	V	87.9	Confident	91.2	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.018	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	116.5	179.7	-176.9	0	0	0	0	108.4	V467 V502 I511 P599 I600 L601 Q602	V465-V467 HydrophobicContact CG1-CG2 4.15Å; V465-V502 HydrophobicContact CG1-CB 4.45Å; V465-I511 HydrophobicContact CB-CD1 4.14Å; V465-I511 HydrophobicContact CG1-CD1 3.47Å; V465-I511 VanDerWaalsContact CG1-CD1 3.47Å; V465-I511 HydrophobicContact CG1-CG2 4.49Å; V465-I511 HydrophobicContact CG2-CD1 3.5Å; V465-P599 HydrophobicContact CG2-CB 3.79Å; V465-I600 PolarHBondContact N-O 3.18Å; V465-L601 HydrophobicContact CB-CD2 4.26Å; V465-L601 HydrophobicContact CG1-CD2 4.38Å; V465-L601 WeakPolarHBondContact O-CA 3.21Å; V465-Q602 PolarHBondContact O-N 3.29Å
466	Q	87.8	Confident	90.5	Very high	48 Å²	48	39.5 Å²	39.5	22%	0.224	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	131.4	175.6	-57.3	-179.4	-14.1	0	0	109	D378 V502 T503 Q602	D378-Q466 PolarHBondContact O-NE2 3.39Å; Q466-V502 CarbonylContact O-C 3.55Å; Q466-V502 VanDerWaalsContact O-CA 3.29Å; Q466-V502 WeakPolarHBondContact O-CA 3.38Å; Q466-T503 VanDerWaalsContact CB-OG1 3.3Å; Q466-T503 WeakPolarHBondContact CB-OG1 3.32Å; Q466-T503 PolarHBondContact N-O 2.91Å; Q466-T503 PolarHBondContact O-N 2.69Å; Q466-T503 PolarHBondContact OE1-OG1 2.87Å; Q466-T503 VanDerWaalsContact OE1-OG1 3.07Å; Q466-Q602 HydrophobicContact CG-CB 4.28Å
467	V	88.1	Confident	89.9	Confident	12 Å²	12	39.6 Å²	39.6	7%	0.073	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	120.4	-177.3	-175.5	0	0	0	0	109.3	V465 F500 S501 V502 L513 Y579 L601	V465-V467 HydrophobicContact CG1-CG2 4.15Å; V467-F500 HydrophobicContact CG1-CD1 3.79Å; V467-S501 WeakPolarHBondContact CA-O 3.4Å; V467-V502 HydrophobicContact CG1-CG1 4.41Å; V467-V502 HydrophobicContact CG2-CG1 4.07Å; V467-L513 HydrophobicContact CG1-CD1 4.08Å; V467-L513 HydrophobicContact CG2-CD1 4.43Å; V467-L513 HydrophobicContact CG2-CD2 4.34Å; V467-Y579 HydrophobicContact CB-CE2 3.83Å; V467-Y579 HydrophobicContact CG1-CD2 4.24Å; V467-Y579 HydrophobicContact CG1-CE2 3.78Å; V467-Y579 HydrophobicContact CG2-CE2 4.25Å; V467-L601 HydrophobicContact CG2-CD2 3.57Å
468	K	89.9	Confident	89	Confident	156 Å²	156	43.2 Å²	43.2	68%	0.678	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	114	167.3	-67.4	-176.5	179.3	-179.5	0	108.4	F500 S501	K468-F500 CarbonylContact O-C 3.21Å; K468-F500 WeakPolarHBondContact O-CA 3.33Å; K468-S501 PolarHBondContact N-O 2.87Å; K468-S501 PolarHBondContact O-N 2.98Å
469	A	90.6	Very high	88	Confident	27 Å²	27	47.2 Å²	47.2	22%	0.223	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	141.1	-178.4	0	0	0	0	0	110.8	C499 F500 Y579 I611	A469-C499 CarbonylContact C-O 3.53Å; A469-C499 WeakPolarHBondContact CA-O 3.36Å; A469-F500 HydrophobicContact CB-CD1 3.56Å; A469-F500 HydrophobicContact CB-CE1 3.56Å; A469-Y579 HydrophobicContact CB-CD1 4.44Å; A469-Y579 HydrophobicContact CB-CE1 3.97Å; A469-I611 HydrophobicContact CB-CD1 3.74Å; A469-I611 HydrophobicContact CB-CG1 4.35Å; A469-I611 HydrophobicContact CB-CG2 3.91Å
470	S	92.1	Very high	86.8	Confident	56 Å²	56	55.5 Å²	55.5	39%	0.392	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	142	175.4	64.4	0	0	0	0	111.5	C499	S470-C499 PolarHBondContact N-O 3.21Å; S470-C499 PolarHBondContact O-N 3.4Å; S470-C499 WeakPolarHBondContact OG-CB 3.47Å
471	L	93.4	Very high	85.5	Confident	14 Å²	14	56.3 Å²	56.3	7%	0.073	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	117.2	179.9	-178.9	64.5	0	0	0	109.8	L473 V496 I498 L517 F575 V577 I611 N613	L471-L473 HydrophobicContact CG-CD2 4.45Å; L471-L473 HydrophobicContact CG-CG 4.38Å; L471-V496 HydrophobicContact CD1-CG1 3.63Å; L471-I498 HydrophobicContact CD1-CG1 3.86Å; L471-L517 HydrophobicContact CD1-CD1 4.37Å; L471-F575 HydrophobicContact CD2-CB 3.74Å; L471-F575 WeakPolarHBondContact CD2-O 3.39Å; L471-V577 HydrophobicContact CD1-CG2 3.95Å; L471-V577 HydrophobicContact CD2-CG2 4.43Å; L471-I611 HydrophobicContact CB-CD1 3.81Å; L471-N613 HydrophobicContact CB-CB 4.06Å; L471-N613 HydrophobicContact CD2-CB 3.69Å; L471-N613 HydrophobicContact CG-CB 3.96Å; L471-N613 PolarHBondContact O-ND2 2.92Å
472	I	93.9	Very high	83.9	Confident	94 Å²	94	59.9 Å²	59.9	48%	0.482	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	121.7	-175.8	-55.2	168.9	0	0	0	108.6	T497	I472-T497 PolarHBondContact N-O 2.99Å; I472-T497 PolarHBondContact O-N 2.91Å
473	L	91.9	Very high	83	Confident	27 Å²	27	62.5 Å²	62.5	14%	0.141	33%	0.332	C	S	.	.			trans	-124.3	157.2	-178.9	-61.2	176.8	0	0	0	110.1	L471 V496 F575 N613 T615	L471-L473 HydrophobicContact CG-CD2 4.45Å; L471-L473 HydrophobicContact CG-CG 4.38Å; L473-V496 HydrophobicContact CD2-CB 4.2Å; L473-V496 HydrophobicContact CD2-CG1 3.75Å; L473-V496 HydrophobicContact CD2-CG2 3.85Å; L473-F575 HydrophobicContact CD1-CB 4.4Å; L473-F575 HydrophobicContact CD1-CD2 3.82Å; L473-F575 HydrophobicContact CD1-CG 4.48Å; L473-F575 HydrophobicContact CD2-CB 4.36Å; L473-F575 HydrophobicContact CD2-CD2 3.71Å; L473-F575 HydrophobicContact CD2-CE2 4.18Å; L473-F575 HydrophobicContact CD2-CG 4.05Å; L473-F575 HydrophobicContact CG-CD2 4.45Å; L473-N613 VanDerWaalsContact CD1-C 3.47Å; L473-N613 HydrophobicContact CD1-CB 3.75Å; L473-N613 HydrophobicContact CG-CB 4.35Å; L473-T615 HydrophobicContact CD1-CG2 4.46Å
474	P	87.9	Confident	82.3	Confident	45 Å²	45	63.2 Å²	63.2	29%	0.292	34%	0.336	S	S	.	.			trans	-65.7	150.3	169	29.2	-35.3	0	0	0	111.2	I494 T615	P474-I494 HydrophobicContact CG-CB 4.01Å; P474-I494 HydrophobicContact CG-CD1 4.37Å; P474-I494 HydrophobicContact CG-CG2 4.02Å; P474-T615 VanDerWaalsContact O-CB 3.31Å; P474-T615 WeakPolarHBondContact O-CB 3.31Å; P474-T615 PolarHBondContact O-OG1 2.77Å
475	E	81.4	Confident	81.3	Confident	162 Å²	162	70.9 Å²	70.9	76%	0.757	37%	0.372	S	S	*	.	S	Bend	trans	-64.5	-43	-179.9	-166.2	176.4	-174	0	0	112.2
476	H	81.6	Confident	80	Confident	108 Å²	108	71.9 Å²	71.9	50%	0.5	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	146.3	177.6	-59.4	-69.6	0	0	0	111.8	R616	H476-R616 CarbonylContact C-O 3.55Å; H476-R616 WeakPolarHBondContact CA-O 3.49Å
477	I	83.4	Confident	78.5	Confident	1 Å²	1	77.8 Å²	77.8	1%	0.005	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	103.7	169.9	-57.1	163.1	0	0	0	107.5	V492 I494 F531 V573 T615 R616 F617 A618	I477-V492 HydrophobicContact CG2-CG1 4.42Å; I477-I494 HydrophobicContact CG1-CD1 4.5Å; I477-I494 HydrophobicContact CG1-CG2 4.31Å; I477-F531 HydrophobicContact CD1-CE2 3.87Å; I477-F531 HydrophobicContact CD1-CZ 3.71Å; I477-F531 HydrophobicContact CG1-CZ 4.43Å; I477-F531 HydrophobicContact CG2-CZ 4.13Å; I477-V573 HydrophobicContact CD1-CB 4.3Å; I477-V573 HydrophobicContact CD1-CG2 3.82Å; I477-T615 HydrophobicContact CD1-CG2 3.63Å; I477-T615 HydrophobicContact CG1-CG2 3.94Å; I477-R616 PolarHBondContact N-O 3.27Å; I477-F617 HydrophobicContact CB-CD1 3.84Å; I477-F617 HydrophobicContact CB-CE1 4.14Å; I477-F617 HydrophobicContact CB-CG 4.41Å; I477-F617 HydrophobicContact CD1-CE1 4.3Å; I477-F617 HydrophobicContact CD1-CZ 4.3Å; I477-F617 HydrophobicContact CG2-CD1 3.7Å; I477-F617 HydrophobicContact CG2-CE1 3.63Å; I477-F617 WeakPolarHBondContact O-CA 3.48Å; I477-A618 PolarHBondContact O-N 3.3Å; I477-A618 VanDerWaalsContact O-N 3.09Å
478	D	77.8	Confident	77	Confident	76 Å²	76	86.6 Å²	86.6	41%	0.406	44%	0.442	S	S	.	.			trans	-82.9	118.9	171.1	-176.3	6.6	0	0	0	110.2	Q480 G481	D478-Q480 PolarHBondContact O-N 2.86Å; D478-Q480 WeakPolarHBondContact OD1-CB 3.26Å; D478-Q480 PolarHBondContact OD1-N 3.05Å; D478-G481 PolarHBondContact O-N 3.05Å; D478-G481 PolarHBondContact OD2-N 2.66Å
479	Q	73.9	Confident	75.6	Confident	84 Å²	84	81.7 Å²	81.7	39%	0.393	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-15.5	177.1	-62.1	-166.9	-30.7	0	0	112.9	V492 F617	Q479-V492 WeakPolarHBondContact O-CG2 3.47Å; Q479-F617 HydrophobicContact CG-CD1 3.86Å; Q479-F617 HydrophobicContact CG-CE1 4.28Å
480	Q	70.2	Confident	74.8	Confident	175 Å²	175	87.1 Å²	87.1	82%	0.818	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	-4.3	176.1	-58.4	169.4	17.3	0	0	111.8	D478	D478-Q480 PolarHBondContact O-N 2.86Å; D478-Q480 WeakPolarHBondContact OD1-CB 3.26Å; D478-Q480 PolarHBondContact OD1-N 3.05Å
481	G	64.6	Low	74.1	Confident	23 Å²	23	85.3 Å²	85.3	24%	0.237	43%	0.433	C	S	.	.	S	Bend	trans	-82.7	-154.7	-174.4	0	0	0	0	0	114.9	D478 Q483	D478-G481 PolarHBondContact O-N 3.05Å; D478-G481 PolarHBondContact OD2-N 2.66Å; G481-Q483 WeakPolarHBondContact O-CG 3.47Å; G481-Q483 PolarHBondContact O-N 3Å; G481-Q483 VanDerWaalsContact O-N 3.09Å
482	A	59.6	Low	73.6	Confident	75 Å²	75	85.6 Å²	85.6	62%	0.62	44%	0.435	S	S	*	.			trans	-49.1	112.4	-167.4	0	0	0	0	0	114	C493	A482-C493 PolarHBondContact O-N 3.28Å
483	Q	69.1	Low	73.3	Confident	106 Å²	106	81.7 Å²	81.7	50%	0.495	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	114.2	177.9	-62.4	-171.9	-8.7	0	0	110	G481 Q490	G481-Q483 WeakPolarHBondContact O-CG 3.47Å; G481-Q483 PolarHBondContact O-N 3Å; G481-Q483 VanDerWaalsContact O-N 3.09Å; Q483-Q490 HydrophobicContact CB-CB 4.44Å
484	C	75.3	Confident	73.2	Confident	34 Å²	34	81 Å²	81	23%	0.23	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	148.1	168.7	-72.2	0	0	0	0	110.5	T491 C493 Y561	C484-T491 PolarHBondContact N-O 3.04Å; C484-T491 PolarHBondContact O-N 2.93Å; C484-T491 VanDerWaalsContact O-N 3.12Å; C484-C493 HydrophobicContact CB-CB 3.58Å; C484-C493 WeakPolarHBondContact CB-SG 3.39Å; C484-C493 PolarHBondContact N-SG 2.55Å; C484-C493 VanDerWaalsContact N-SG 3.39Å; C484-C493 WeakPolarHBondContact SG-CB 3.19Å; C484-C493 CovalentContact SG-SG 2Å; C484-C493 PolarHBondContact SG-SG 3.12Å; C484-Y561 HydrophobicContact CB-CD1 4.23Å; C484-Y561 HydrophobicContact CB-CE1 3.78Å
485	Q	66.6	Low	73.3	Confident	162 Å²	162	83.5 Å²	83.5	76%	0.757	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	106.4	174.6	-164.3	173.6	23.4	0	0	109.4
486	D	60.8	Low	73.9	Confident	25 Å²	25	75.8 Å²	75.8	13%	0.134	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	117.4	172	178.5	46.6	0	0	0	109.9	K488 T489 G535 Y561	D486-K488 PolarHBondContact O-N 2.68Å; D486-T489 PolarHBondContact N-O 2.82Å; D486-T489 VanDerWaalsContact N-O 3.16Å; D486-T489 PolarHBondContact O-N 2.05Å; D486-G535 VanDerWaalsContact CG-CA 3.48Å; D486-G535 VanDerWaalsContact OD1-CA 3.27Å; D486-G535 WeakPolarHBondContact OD1-CA 3.45Å; D486-G535 WeakPolarHBondContact OD2-CA 3.46Å; D486-Y561 HydrophobicContact CB-CD1 4.32Å; D486-Y561 HydrophobicContact CB-CE1 4.23Å
487	H	56.9	Low	74.5	Confident	172 Å²	172	72 Å²	72	80%	0.796	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	33.3	43.7	175.3	-68.2	-72.7	0	0	0	116.4
488	K	55.6	Low	75	Confident	196 Å²	196	71.9 Å²	71.9	85%	0.852	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.6	8	-179.7	-51.7	175.2	179.5	178.2	0	118	D486	D486-K488 PolarHBondContact O-N 2.68Å
489	T	61.6	Low	75.8	Confident	53 Å²	53	68.9 Å²	68.9	33%	0.325	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	133.5	170.1	64.6	0	0	0	0	111.5	D486 K564	D486-T489 PolarHBondContact N-O 2.82Å; D486-T489 VanDerWaalsContact N-O 3.16Å; D486-T489 PolarHBondContact O-N 2.05Å; T489-K564 VanDerWaalsContact CB-NZ 3.3Å; T489-K564 VanDerWaalsContact CG2-NZ 3.3Å; T489-K564 PolarHBondContact OG1-NZ 3.44Å
490	Q	72.5	Confident	76.7	Confident	141 Å²	141	64.9 Å²	64.9	66%	0.659	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	125.9	173.5	-78.5	176.3	-41.8	0	0	109.3	Q483	Q483-Q490 HydrophobicContact CB-CB 4.44Å
491	T	77.9	Confident	77.7	Confident	18 Å²	18	57.9 Å²	57.9	11%	0.11	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	146.2	177.1	53.8	0	0	0	0	109.7	C484 K564	C484-T491 PolarHBondContact N-O 3.04Å; C484-T491 PolarHBondContact O-N 2.93Å; C484-T491 VanDerWaalsContact O-N 3.12Å; T491-K564 HydrophobicContact CG2-CG 4.44Å
492	V	84.1	Confident	78.9	Confident	20 Å²	20	56.8 Å²	56.8	12%	0.121	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	137.7	172.7	179.1	0	0	0	0	109.2	I477 Q479 Q562	I477-V492 HydrophobicContact CG2-CG1 4.42Å; Q479-V492 WeakPolarHBondContact O-CG2 3.47Å; V492-Q562 HydrophobicContact CB-CB 4.09Å; V492-Q562 VanDerWaalsContact CB-OE1 3.29Å; V492-Q562 VanDerWaalsContact O-CB 3.31Å; V492-Q562 WeakPolarHBondContact O-CB 3.42Å; V492-Q562 PolarHBondContact O-N 3.13Å
493	C	86.4	Confident	80.2	Confident	13 Å²	13	55.3 Å²	55.3	9%	0.088	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	153.9	-178.8	57.9	0	0	0	0	111.4	A482 C484 V559 A560 Y561	A482-C493 PolarHBondContact O-N 3.28Å; C484-C493 HydrophobicContact CB-CB 3.58Å; C484-C493 WeakPolarHBondContact CB-SG 3.39Å; C484-C493 PolarHBondContact N-SG 2.55Å; C484-C493 VanDerWaalsContact N-SG 3.39Å; C484-C493 WeakPolarHBondContact SG-CB 3.19Å; C484-C493 CovalentContact SG-SG 2Å; C484-C493 PolarHBondContact SG-SG 3.12Å; C493-V559 HydrophobicContact CB-CG1 3.89Å; C493-A560 CarbonylContact C-O 3.54Å; C493-A560 VanDerWaalsContact CA-O 3.23Å; C493-A560 WeakPolarHBondContact CA-O 3.38Å; C493-Y561 HydrophobicContact CB-CD1 4.27Å
494	I	89.3	Confident	80.9	Confident	13 Å²	13	51.4 Å²	51.4	7%	0.067	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	148.9	176.5	63.2	175	0	0	0	111.4	P474 I477 V496 F531 A560 F575 T615	P474-I494 HydrophobicContact CG-CB 4.01Å; P474-I494 HydrophobicContact CG-CD1 4.37Å; P474-I494 HydrophobicContact CG-CG2 4.02Å; I477-I494 HydrophobicContact CG1-CD1 4.5Å; I477-I494 HydrophobicContact CG1-CG2 4.31Å; I494-V496 HydrophobicContact CD1-CG2 4.49Å; I494-V496 HydrophobicContact CG1-CG2 4.36Å; I494-F531 HydrophobicContact CD1-CD1 4.28Å; I494-F531 HydrophobicContact CD1-CE1 3.86Å; I494-F531 HydrophobicContact CD1-CZ 4.26Å; I494-F531 HydrophobicContact CG1-CD1 4.23Å; I494-F531 HydrophobicContact CG1-CE1 3.86Å; I494-F531 HydrophobicContact CG2-CE1 4.46Å; I494-A560 HydrophobicContact CG1-CB 3.96Å; I494-A560 PolarHBondContact N-O 3.08Å; I494-A560 PolarHBondContact O-N 3.09Å; I494-F575 HydrophobicContact CD1-CE2 3.91Å; I494-F575 HydrophobicContact CD1-CZ 3.8Å; I494-T615 HydrophobicContact CD1-CG2 4.23Å
495	N	90.8	Very high	81	Confident	96 Å²	96	55.5 Å²	55.5	51%	0.513	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	125.6	174	-70.3	-19.8	0	0	0	109.8	T557	N495-T557 HydrophobicContact CB-CG2 3.94Å
496	V	93.1	Very high	81.2	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	111	176.5	-179.5	0	0	0	0	107.7	L471 L473 I494 L517 F533 T557 H558 A560 F575	L471-V496 HydrophobicContact CD1-CG1 3.63Å; L473-V496 HydrophobicContact CD2-CB 4.2Å; L473-V496 HydrophobicContact CD2-CG1 3.75Å; L473-V496 HydrophobicContact CD2-CG2 3.85Å; I494-V496 HydrophobicContact CD1-CG2 4.49Å; I494-V496 HydrophobicContact CG1-CG2 4.36Å; V496-L517 HydrophobicContact CB-CD2 4.47Å; V496-L517 HydrophobicContact CG1-CD1 4.07Å; V496-L517 HydrophobicContact CG1-CD2 3.94Å; V496-F533 HydrophobicContact CG2-CE1 4.4Å; V496-T557 WeakPolarHBondContact O-CA 3.37Å; V496-H558 PolarHBondContact N-O 3.11Å; V496-H558 PolarHBondContact O-N 3.05Å; V496-A560 HydrophobicContact CG2-CB 4.16Å; V496-F575 HydrophobicContact CG1-CD1 4.31Å; V496-F575 HydrophobicContact CG2-CD1 4.11Å; V496-F575 HydrophobicContact CG2-CE1 3.75Å; V496-F575 HydrophobicContact CG2-CE2 4.5Å; V496-F575 HydrophobicContact CG2-CZ 3.98Å
497	T	94.5	Very high	81.5	Confident	28 Å²	28	54.8 Å²	54.8	17%	0.172	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127	-177.4	-57.3	0	0	0	0	110.9	I472 C555 A556 T557	I472-T497 PolarHBondContact N-O 2.99Å; I472-T497 PolarHBondContact O-N 2.91Å; T497-C555 HydrophobicContact CG2-CB 4.16Å; T497-A556 WeakPolarHBondContact CA-O 3.38Å; T497-T557 WeakPolarHBondContact OG1-CG2 3.39Å; T497-T557 PolarHBondContact OG1-OG1 2.94Å
498	I	94.8	Very high	81.9	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	132	177.7	-51.1	168.6	0	0	0	107.8	L471 F500 Y515 L517 C555 A556 V577	L471-I498 HydrophobicContact CD1-CG1 3.86Å; I498-F500 HydrophobicContact CG2-CD2 4.36Å; I498-F500 HydrophobicContact CG2-CE1 4.4Å; I498-F500 HydrophobicContact CG2-CE2 3.72Å; I498-F500 HydrophobicContact CG2-CZ 3.74Å; I498-Y515 HydrophobicContact CD1-CD2 3.77Å; I498-Y515 HydrophobicContact CD1-CE2 3.56Å; I498-L517 HydrophobicContact CD1-CB 3.94Å; I498-L517 HydrophobicContact CD1-CD1 4.08Å; I498-L517 HydrophobicContact CD1-CD2 3.94Å; I498-L517 HydrophobicContact CD1-CG 4.18Å; I498-C555 CarbonylContact O-C 3.54Å; I498-C555 WeakPolarHBondContact O-CA 3.41Å; I498-A556 PolarHBondContact N-O 3.33Å; I498-A556 PolarHBondContact O-N 2.94Å; I498-V577 HydrophobicContact CD1-CG1 4.18Å; I498-V577 HydrophobicContact CD1-CG2 3.52Å; I498-V577 HydrophobicContact CG1-CG2 3.74Å; I498-V577 HydrophobicContact CG2-CG1 4.11Å; I498-V577 HydrophobicContact CG2-CG2 4.14Å
499	C	93.4	Very high	82.8	Confident	12 Å²	12	51 Å²	51	8%	0.081	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	138.7	173.5	-58.7	0	0	0	0	111.2	A469 S470 S554 C555	A469-C499 CarbonylContact C-O 3.53Å; A469-C499 WeakPolarHBondContact CA-O 3.36Å; S470-C499 PolarHBondContact N-O 3.21Å; S470-C499 PolarHBondContact O-N 3.4Å; S470-C499 WeakPolarHBondContact OG-CB 3.47Å; C499-S554 CarbonylContact C-O 3.59Å; C499-S554 VanDerWaalsContact CA-O 3.27Å; C499-S554 WeakPolarHBondContact CA-O 3.42Å; C499-C555 HydrophobicContact CB-CB 4.1Å; C499-C555 WeakPolarHBondContact CB-SG 3.26Å; C499-C555 WeakPolarHBondContact SG-CB 3.48Å; C499-C555 CovalentContact SG-SG 2.04Å; C499-C555 PolarHBondContact SG-SG 3.33Å
500	F	93.4	Very high	83.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	132.8	172.2	-63.6	-68.4	0	0	0	110	V467 K468 A469 I498 L513 Y515 M546 P553 S554 V577 Y579	V467-F500 HydrophobicContact CG1-CD1 3.79Å; K468-F500 CarbonylContact O-C 3.21Å; K468-F500 WeakPolarHBondContact O-CA 3.33Å; A469-F500 HydrophobicContact CB-CD1 3.56Å; A469-F500 HydrophobicContact CB-CE1 3.56Å; I498-F500 HydrophobicContact CG2-CD2 4.36Å; I498-F500 HydrophobicContact CG2-CE1 4.4Å; I498-F500 HydrophobicContact CG2-CE2 3.72Å; I498-F500 HydrophobicContact CG2-CZ 3.74Å; F500-L513 HydrophobicContact CB-CD1 3.9Å; F500-L513 HydrophobicContact CD1-CD1 4.21Å; F500-L513 HydrophobicContact CD2-CD1 4.29Å; F500-L513 HydrophobicContact CG-CD1 3.88Å; F500-Y515 AromaticContact CE2-CD1 3.63Å; F500-Y515 HydrophobicContact CE2-CD1 3.63Å; F500-Y515 HydrophobicContact CE2-CE1 4.26Å; F500-Y515 AromaticContact CE2-CG 3.94Å; F500-Y515 HydrophobicContact CE2-CG 3.94Å; F500-Y515 HydrophobicContact CZ-CD1 4.31Å; F500-Y515 HydrophobicContact CZ-CG 4.2Å; F500-M546 HydrophobicContact CB-SD 4.19Å; F500-M546 HydrophobicContact CD2-CB 4.47Å; F500-M546 HydrophobicContact CD2-CE 3.9Å; F500-M546 HydrophobicContact CD2-SD 3.64Å; F500-M546 HydrophobicContact CE2-CE 4.38Å; F500-M546 HydrophobicContact CG-SD 4.4Å; F500-P553 WeakPolarHBondContact O-CA 3.35Å; F500-S554 PolarHBondContact N-O 3.12Å; F500-S554 PolarHBondContact O-N 3.09Å; F500-V577 HydrophobicContact CZ-CG1 3.93Å; F500-Y579 AromaticContact CE1-CD1 3.75Å; F500-Y579 HydrophobicContact CE1-CD1 3.75Å; F500-Y579 HydrophobicContact CE1-CD2 4.38Å; F500-Y579 HydrophobicContact CE1-CE1 4.4Å; F500-Y579 AromaticContact CE1-CG 3.74Å; F500-Y579 HydrophobicContact CE1-CG 3.74Å; F500-Y579 HydrophobicContact CZ-CD1 4.36Å; F500-Y579 HydrophobicContact CZ-CG 4.21Å
501	S	90.6	Very high	84.3	Confident	29 Å²	29	44.4 Å²	44.4	20%	0.203	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	131.7	166.6	-177.5	0	0	0	0	108.3	V467 K468	V467-S501 WeakPolarHBondContact CA-O 3.4Å; K468-S501 PolarHBondContact N-O 2.87Å; K468-S501 PolarHBondContact O-N 2.98Å
502	V	90.1	Very high	84.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	138.2	-176.3	-59.2	0	0	0	0	111.6	V465 Q466 V467 F504 L513 A548 H550 G551	V465-V502 HydrophobicContact CG1-CB 4.45Å; Q466-V502 CarbonylContact O-C 3.55Å; Q466-V502 VanDerWaalsContact O-CA 3.29Å; Q466-V502 WeakPolarHBondContact O-CA 3.38Å; V467-V502 HydrophobicContact CG1-CG1 4.41Å; V467-V502 HydrophobicContact CG2-CG1 4.07Å; V502-F504 HydrophobicContact CG2-CD1 4.45Å; V502-F504 HydrophobicContact CG2-CE1 4.18Å; V502-L513 HydrophobicContact CG1-CD1 3.86Å; V502-A548 HydrophobicContact CB-CB 4.21Å; V502-A548 HydrophobicContact CG1-CB 3.55Å; V502-A548 HydrophobicContact CG2-CB 3.56Å; V502-H550 WeakPolarHBondContact O-CA 3Å; V502-G551 PolarHBondContact O-N 3.11Å
503	T	87.8	Confident	85.1	Confident	43 Å²	43	44.6 Å²	44.6	26%	0.264	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	141.6	173.3	42.6	0	0	0	0	109.8	Q466	Q466-T503 VanDerWaalsContact CB-OG1 3.3Å; Q466-T503 WeakPolarHBondContact CB-OG1 3.32Å; Q466-T503 PolarHBondContact N-O 2.91Å; Q466-T503 PolarHBondContact O-N 2.69Å; Q466-T503 PolarHBondContact OE1-OG1 2.87Å; Q466-T503 VanDerWaalsContact OE1-OG1 3.07Å
504	F	83.7	Confident	85.5	Confident	24 Å²	24	47.5 Å²	47.5	11%	0.105	24%	0.243	C	C	.	.			trans	-160.1	147.4	-179.1	51.3	-100.9	0	0	0	109.5	V502 H507 I511 H550	V502-F504 HydrophobicContact CG2-CD1 4.45Å; V502-F504 HydrophobicContact CG2-CE1 4.18Å; F504-H507 HydrophobicContact CD2-CB 3.52Å; F504-H507 HydrophobicContact CE2-CB 3.55Å; F504-H507 VanDerWaalsContact CE2-O 3.31Å; F504-H507 WeakPolarHBondContact CE2-O 3.1Å; F504-H507 HydrophobicContact CG-CB 4.19Å; F504-H507 HydrophobicContact CZ-CB 4.19Å; F504-I511 HydrophobicContact CD1-CD1 3.39Å; F504-I511 HydrophobicContact CD1-CG1 4.23Å; F504-I511 HydrophobicContact CE1-CD1 3.66Å; F504-I511 HydrophobicContact CE1-CG1 3.99Å; F504-I511 HydrophobicContact CG-CD1 4.17Å; F504-H550 AromaticContact CD1-ND1 3.97Å; F504-H550 AromaticContact CD2-ND1 3.88Å; F504-H550 HydrophobicContact CE1-CB 3.89Å; F504-H550 HydrophobicContact CE2-CB 4.16Å; F504-H550 AromaticContact CE2-ND1 3.91Å; F504-H550 AromaticContact CG-ND1 3.93Å; F504-H550 HydrophobicContact CZ-CB 3.64Å; F504-H550 PolarHBondContact N-ND1 3.29Å; F504-H550 PolarHBondContact O-CE1 2.91Å; F504-H550 PolarHBondContact O-ND1 3.21Å
505	K	78.1	Confident	85.7	Confident	121 Å²	121	47.3 Å²	47.3	53%	0.526	24%	0.242	S	C	.	.	S	Bend	trans	-76.5	-47.8	-175.8	-163.8	174.8	-168.6	167.4	0	113.6	D378 G442	D378-K505 IonicContact OD1-NZ 3.85Å; D378-K505 PolarHBondContact OD1-NZ 3.01Å; G442-K505 PolarHBondContact O-NZ 3Å
506	H	69.6	Low	85.8	Confident	103 Å²	103	45 Å²	45	48%	0.477	23%	0.23	S	C	.	.	S	Bend	trans	-140.4	96.6	-176.9	-158	81.3	0	0	0	112.3	N441	N441-H506 VanDerWaalsContact O-CB 3.3Å; N441-H506 WeakPolarHBondContact O-CB 3.22Å
507	H	68.2	Low	85.9	Confident	68 Å²	68	45 Å²	45	32%	0.315	23%	0.23	S	C	.	.			trans	-152.7	138.7	169.3	-170.1	75.6	0	0	0	110.5	F504	F504-H507 HydrophobicContact CD2-CB 3.52Å; F504-H507 HydrophobicContact CE2-CB 3.55Å; F504-H507 VanDerWaalsContact CE2-O 3.31Å; F504-H507 WeakPolarHBondContact CE2-O 3.1Å; F504-H507 HydrophobicContact CG-CB 4.19Å; F504-H507 HydrophobicContact CZ-CB 4.19Å
508	R	64.1	Low	85.8	Confident	238 Å²	238	44.7 Å²	44.7	90%	0.898	23%	0.228	S	C	*	.	S	Bend	trans	-100.6	100	176.1	-67.7	-171.8	-176	-172.6	1.3	109.5
509	G	73.9	Confident	85.6	Confident	50 Å²	50	44.7 Å²	44.7	52%	0.515	23%	0.228	S	C	.	.	S	Bend	trans	137.1	-173.5	174	0	0	0	0	0	113.7
510	A	80.3	Confident	85.1	Confident	47 Å²	47	44.1 Å²	44.1	39%	0.388	22%	0.224	S	C	.	.			trans	-91.1	141.7	171.5	0	0	0	0	0	109.8	K547 A548 R549	A510-K547 HydrophobicContact CB-CB 4.27Å; A510-A548 WeakPolarHBondContact CA-O 3.18Å; A510-A548 WeakPolarHBondContact CB-O 3.39Å; A510-R549 HydrophobicContact CB-CG 4.29Å
511	I	85.6	Confident	84.5	Confident	9 Å²	9	47.6 Å²	47.6	5%	0.046	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	132.6	175.8	-63.5	-179	0	0	0	108.4	V465 F504 L513 K547 A548 L581	V465-I511 HydrophobicContact CB-CD1 4.14Å; V465-I511 HydrophobicContact CG1-CD1 3.47Å; V465-I511 VanDerWaalsContact CG1-CD1 3.47Å; V465-I511 HydrophobicContact CG1-CG2 4.49Å; V465-I511 HydrophobicContact CG2-CD1 3.5Å; F504-I511 HydrophobicContact CD1-CD1 3.39Å; F504-I511 HydrophobicContact CD1-CG1 4.23Å; F504-I511 HydrophobicContact CE1-CD1 3.66Å; F504-I511 HydrophobicContact CE1-CG1 3.99Å; F504-I511 HydrophobicContact CG-CD1 4.17Å; I511-L513 HydrophobicContact CG2-CD2 4.36Å; I511-K547 CarbonylContact O-C 3.58Å; I511-K547 WeakPolarHBondContact O-CA 3.41Å; I511-A548 PolarHBondContact N-O 2.9Å; I511-A548 PolarHBondContact O-N 2.99Å; I511-L581 HydrophobicContact CG2-CD2 3.44Å; I511-L581 VanDerWaalsContact CG2-CD2 3.44Å
512	E	89.4	Confident	83.6	Confident	43 Å²	43	50.3 Å²	50.3	20%	0.201	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	113.2	177.7	-168.6	161.8	-147.6	0	0	110	M546 K547 S582 K584	E512-M546 WeakPolarHBondContact CA-O 3.44Å; E512-K547 HydrophobicContact CG-CG 4.41Å; E512-S582 WeakPolarHBondContact O-CB 3.35Å; E512-S582 PolarHBondContact O-N 2.93Å; E512-K584 WeakPolarHBondContact OE2-CE 3.24Å; E512-K584 IonicContact OE2-NZ 2.61Å; E512-K584 PolarHBondContact OE2-NZ 3.35Å
513	L	90.8	Very high	82.6	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	137.1	175.5	-64.2	172.8	0	0	0	109.4	V467 F500 V502 I511 H545 M546 A548 G580 L581 L601	V467-L513 HydrophobicContact CG1-CD1 4.08Å; V467-L513 HydrophobicContact CG2-CD1 4.43Å; V467-L513 HydrophobicContact CG2-CD2 4.34Å; F500-L513 HydrophobicContact CB-CD1 3.9Å; F500-L513 HydrophobicContact CD1-CD1 4.21Å; F500-L513 HydrophobicContact CD2-CD1 4.29Å; F500-L513 HydrophobicContact CG-CD1 3.88Å; V502-L513 HydrophobicContact CG1-CD1 3.86Å; I511-L513 HydrophobicContact CG2-CD2 4.36Å; L513-H545 CarbonylContact O-C 3.56Å; L513-H545 WeakPolarHBondContact O-CA 3.22Å; L513-M546 PolarHBondContact N-O 3.22Å; L513-M546 PolarHBondContact O-N 2.96Å; L513-A548 HydrophobicContact CD1-CB 4.38Å; L513-G580 CarbonylContact C-O 3.53Å; L513-G580 WeakPolarHBondContact CA-O 3.24Å; L513-L581 HydrophobicContact CD2-CD2 4.01Å; L513-L601 HydrophobicContact CD2-CD2 4.33Å
514	Q	93.3	Very high	81.5	Confident	73 Å²	73	55.8 Å²	55.8	34%	0.341	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	136	166.3	179.6	177.9	-3.1	0	0	108.2	Y579 G580	Q514-Y579 CarbonylContact O-C 3.52Å; Q514-Y579 WeakPolarHBondContact O-CA 3.38Å; Q514-G580 PolarHBondContact N-O 2.95Å; Q514-G580 PolarHBondContact O-N 2.01Å
515	Y	93.6	Very high	80.4	Confident	9 Å²	9	61.1 Å²	61.1	4%	0.035	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	153.7	176	64.6	-90.3	0	0	0	111.9	I498 F500 R543 G544 M546 A556 H558 V577 S578	I498-Y515 HydrophobicContact CD1-CD2 3.77Å; I498-Y515 HydrophobicContact CD1-CE2 3.56Å; F500-Y515 AromaticContact CE2-CD1 3.63Å; F500-Y515 HydrophobicContact CE2-CD1 3.63Å; F500-Y515 HydrophobicContact CE2-CE1 4.26Å; F500-Y515 AromaticContact CE2-CG 3.94Å; F500-Y515 HydrophobicContact CE2-CG 3.94Å; F500-Y515 HydrophobicContact CZ-CD1 4.31Å; F500-Y515 HydrophobicContact CZ-CG 4.2Å; Y515-R543 WeakPolarHBondContact O-CA 3.33Å; Y515-G544 WeakPolarHBondContact CD1-O 3.38Å; Y515-G544 PolarHBondContact N-O 3.46Å; Y515-G544 PolarHBondContact O-N 2.84Å; Y515-M546 HydrophobicContact CE1-CB 4.27Å; Y515-M546 HydrophobicContact CE1-CE 4.37Å; Y515-A556 WeakPolarHBondContact OH-CB 3.4Å; Y515-H558 AromaticContact CE2-NE2 3.58Å; Y515-H558 AromaticContact CZ-NE2 3.67Å; Y515-H558 PolarHBondContact OH-NE2 2.81Å; Y515-V577 HydrophobicContact CD2-CG1 4.33Å; Y515-V577 HydrophobicContact CG-CG1 4.44Å; Y515-S578 CarbonylContact C-O 3.53Å; Y515-S578 WeakPolarHBondContact CA-O 3.16Å; Y515-S578 WeakPolarHBondContact CB-O 3.42Å
516	N	94.3	Very high	79.8	Confident	49 Å²	49	60.7 Å²	60.7	26%	0.262	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	114.9	173.1	-175.2	30	0	0	0	108.6	T542 R543 V577 S578	N516-T542 WeakPolarHBondContact CA-O 3.47Å; N516-T542 PolarHBondContact OD1-O 2.89Å; N516-R543 HydrophobicContact CB-CG 4.11Å; N516-V577 WeakPolarHBondContact O-CA 3.1Å; N516-S578 PolarHBondContact N-O 3.44Å; N516-S578 PolarHBondContact O-N 2.88Å; N516-S578 PolarHBondContact O-OG 3.08Å
517	L	93.4	Very high	79.8	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122	178.3	170.6	67.9	0	0	0	108.5	L471 V496 I498 F533 S541 T542 H558 F575 E576 V577	L471-L517 HydrophobicContact CD1-CD1 4.37Å; V496-L517 HydrophobicContact CB-CD2 4.47Å; V496-L517 HydrophobicContact CG1-CD1 4.07Å; V496-L517 HydrophobicContact CG1-CD2 3.94Å; I498-L517 HydrophobicContact CD1-CB 3.94Å; I498-L517 HydrophobicContact CD1-CD1 4.08Å; I498-L517 HydrophobicContact CD1-CD2 3.94Å; I498-L517 HydrophobicContact CD1-CG 4.18Å; L517-F533 HydrophobicContact CD1-CZ 4.18Å; L517-F533 HydrophobicContact CD2-CD1 4.21Å; L517-F533 HydrophobicContact CD2-CE1 3.37Å; L517-F533 HydrophobicContact CD2-CE2 3.98Å; L517-F533 HydrophobicContact CD2-CZ 3.23Å; L517-F533 HydrophobicContact CG-CE1 4.11Å; L517-F533 HydrophobicContact CG-CE2 3.8Å; L517-F533 HydrophobicContact CG-CZ 3.43Å; L517-F533 VanDerWaalsContact CG-CZ 3.43Å; L517-S541 CarbonylContact O-C 3.54Å; L517-S541 WeakPolarHBondContact O-CA 3.33Å; L517-T542 HydrophobicContact CB-CG2 3.91Å; L517-T542 HydrophobicContact CD2-CG2 3.94Å; L517-T542 HydrophobicContact CG-CG2 4.3Å; L517-T542 PolarHBondContact N-O 3.28Å; L517-T542 PolarHBondContact O-N 3.23Å; L517-H558 HydrophobicContact CD2-CB 4.01Å; L517-F575 HydrophobicContact CD1-CB 4.49Å; L517-F575 HydrophobicContact CD1-CD1 4.41Å; L517-E576 CarbonylContact C-O 3.3Å; L517-E576 WeakPolarHBondContact CA-O 3.32Å; L517-V577 HydrophobicContact CB-CG2 4.43Å; L517-V577 HydrophobicContact CD1-CG2 3.54Å
518	T	92.4	Very high	80	Confident	21 Å²	21	61.1 Å²	61.1	13%	0.129	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	137.4	179.9	-50.7	0	0	0	0	109.7	L521 N540 F575 E576	T518-L521 HydrophobicContact CG2-CD2 4.12Å; T518-L521 HydrophobicContact CG2-CG 4.32Å; T518-N540 WeakPolarHBondContact CA-O 3.27Å; T518-F575 WeakPolarHBondContact O-CA 3.47Å; T518-E576 PolarHBondContact N-O 3.45Å; T518-E576 PolarHBondContact O-N 3.12Å
519	S	90.5	Very high	80.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	148.3	178	62	0	0	0	0	112.8	F531 N540	S519-F531 PolarHBondContact OG-O 2.92Å; S519-F531 VanDerWaalsContact OG-O 3.05Å; S519-N540 PolarHBondContact N-O 2.81Å; S519-N540 PolarHBondContact OG-O 2.86Å; S519-N540 VanDerWaalsContact OG-O 3.12Å
520	D	84.4	Confident	81.6	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.275	C	S	.	.			trans	64.1	55.3	166.5	-155.9	24.5	0	0	0	114.4	H529 R530 V573 Q574	D520-H529 HydrophobicContact CB-CB 4.43Å; D520-H529 PolarHBondContact O-ND1 2.82Å; D520-R530 IonicContact OD1-CZ 3.37Å; D520-R530 IonicContact OD1-NE 2.66Å; D520-R530 PolarHBondContact OD1-NE 2.84Å; D520-R530 IonicContact OD1-NH2 3.84Å; D520-R530 PolarHBondContact OD1-NH2 2.83Å; D520-R530 VanDerWaalsContact OD2-CB 3.25Å; D520-R530 WeakPolarHBondContact OD2-CB 3.48Å; D520-R530 VanDerWaalsContact OD2-CG 3.31Å; D520-R530 WeakPolarHBondContact OD2-CG 3.44Å; D520-R530 PolarHBondContact OD2-N 2.87Å; D520-R530 IonicContact OD2-NE 2.87Å; D520-R530 PolarHBondContact OD2-NE 3.18Å; D520-R530 VanDerWaalsContact OD2-NE 3.1Å; D520-V573 HydrophobicContact CB-CG1 4.31Å; D520-Q574 WeakPolarHBondContact CA-O 3.48Å; D520-Q574 PolarHBondContact N-O 2.72Å
521	L	79.8	Confident	81.9	Confident	72 Å²	72	48 Å²	48	38%	0.377	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-28.6	-177.2	-75.9	159.1	0	0	0	115	T518 H523 Q574 E576	T518-L521 HydrophobicContact CG2-CD2 4.12Å; T518-L521 HydrophobicContact CG2-CG 4.32Å; L521-H523 PolarHBondContact O-N 3.1Å; L521-Q574 PolarHBondContact N-O 2.77Å; L521-E576 HydrophobicContact CD1-CB 3.19Å; L521-E576 HydrophobicContact CD1-CG 4.12Å; L521-E576 WeakPolarHBondContact CD1-OE1 3.1Å
522	L	71.3	Confident	82	Confident	87 Å²	87	49 Å²	49	46%	0.455	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-5.3	178.2	-67	176.2	0	0	0	113.2	T571 Q574	L522-T571 HydrophobicContact CB-CG2 4.32Å; L522-Q574 HydrophobicContact CD1-CB 3.87Å; L522-Q574 HydrophobicContact CG-CB 3.83Å
523	H	70.5	Confident	81.9	Confident	27 Å²	27	47.9 Å²	47.9	13%	0.125	26%	0.255	C	S	.	.	S	Bend	trans	-82.5	145.6	-177.9	-156.8	58.3	0	0	0	111.8	L521 F527 D568	L521-H523 PolarHBondContact O-N 3.1Å; H523-F527 WeakPolarHBondContact NE2-CB 3.49Å; H523-F527 AromaticContact NE2-CG 3.9Å; H523-D568 IonicContact CE1-OD2 3.39Å; H523-D568 PolarHBondContact CE1-OD2 2.02Å; H523-D568 VanDerWaalsContact CE1-OD2 3.22Å; H523-D568 IonicContact ND1-OD2 3.11Å; H523-D568 PolarHBondContact ND1-OD2 3.41Å
524	K	63.4	Low	81.3	Confident	130 Å²	130	52.2 Å²	52.2	57%	0.565	28%	0.275	S	S	*	.			trans	-60.9	133.4	-178.3	-78.5	-178.5	-179	176.9	0	110.4	S526 F527	K524-S526 PolarHBondContact O-N 2.91Å; K524-F527 HydrophobicContact CB-CD2 3.87Å; K524-F527 HydrophobicContact CD-CE2 4.39Å; K524-F527 PolarHBondContact O-N 3.34Å
525	P	62.1	Low	79.7	Confident	137 Å²	137	49.9 Å²	49.9	89%	0.89	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-24.7	-177.4	-24.1	31	0	0	0	114.7	F527	P525-F527 PolarHBondContact O-N 3.39Å
526	S	65.3	Low	78.2	Confident	111 Å²	111	56.5 Å²	56.5	78%	0.776	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-9.2	179.3	-45.7	0	0	0	0	113.9	K524	K524-S526 PolarHBondContact O-N 2.91Å
527	F	68.8	Low	76.9	Confident	122 Å²	122	55.8 Å²	55.8	54%	0.535	31%	0.31	S	S	.	.	S	Bend	trans	-113.2	144.5	179.9	-71.6	-90.7	0	0	0	111.1	H523 K524 P525	H523-F527 WeakPolarHBondContact NE2-CB 3.49Å; H523-F527 AromaticContact NE2-CG 3.9Å; K524-F527 HydrophobicContact CB-CD2 3.87Å; K524-F527 HydrophobicContact CD-CE2 4.39Å; K524-F527 PolarHBondContact O-N 3.34Å; P525-F527 PolarHBondContact O-N 3.39Å
528	P	73.3	Confident	75.7	Confident	58 Å²	58	59.7 Å²	59.7	38%	0.377	34%	0.338	S	S	.	.			trans	-67.2	138.7	177.5	25.9	-33	0	0	0	111.5	R563	P528-R563 VanDerWaalsContact CB-NH1 3.27Å
529	H	83.1	Confident	75.2	Confident	57 Å²	57	60 Å²	60	26%	0.264	34%	0.341	S	S	.	.			trans	-55.8	146.7	178.7	-63	-76.6	0	0	0	112.1	D520 Y532 N540	D520-H529 HydrophobicContact CB-CB 4.43Å; D520-H529 PolarHBondContact O-ND1 2.82Å; H529-Y532 HydrophobicContact CB-CE1 4.16Å; H529-Y532 PolarHBondContact N-OH 3.19Å; H529-Y532 WeakPolarHBondContact O-CE2 3.27Å; H529-Y532 PolarHBondContact O-OH 3.13Å; H529-N540 HydrophobicContact CB-CB 4.16Å; H529-N540 PolarHBondContact CD2-ND2 2.81Å; H529-N540 PolarHBondContact CE1-ND2 2.87Å; H529-N540 VanDerWaalsContact CE1-ND2 3.26Å; H529-N540 PolarHBondContact NE2-ND2 3Å
530	R	87.5	Confident	75	Confident	4 Å²	4	61.8 Å²	61.8	2%	0.015	35%	0.35	C	S	.	.	S	Bend	trans	-84.3	-23.4	-178.1	-61.3	175.7	-69.3	173.3	0.2	112.9	D520 Q562 R563 V566 D568 T571 P572	D520-R530 IonicContact OD1-CZ 3.37Å; D520-R530 IonicContact OD1-NE 2.66Å; D520-R530 PolarHBondContact OD1-NE 2.84Å; D520-R530 IonicContact OD1-NH2 3.84Å; D520-R530 PolarHBondContact OD1-NH2 2.83Å; D520-R530 VanDerWaalsContact OD2-CB 3.25Å; D520-R530 WeakPolarHBondContact OD2-CB 3.48Å; D520-R530 VanDerWaalsContact OD2-CG 3.31Å; D520-R530 WeakPolarHBondContact OD2-CG 3.44Å; D520-R530 PolarHBondContact OD2-N 2.87Å; D520-R530 IonicContact OD2-NE 2.87Å; D520-R530 PolarHBondContact OD2-NE 3.18Å; D520-R530 VanDerWaalsContact OD2-NE 3.1Å; R530-Q562 CarbonylContact O-C 3.58Å; R530-Q562 WeakPolarHBondContact O-CA 3.22Å; R530-R563 PolarHBondContact O-N 3.33Å; R530-V566 HydrophobicContact CB-CG1 4.39Å; R530-V566 HydrophobicContact CB-CG2 3.89Å; R530-V566 HydrophobicContact CG-CG1 3.98Å; R530-V566 HydrophobicContact CG-CG2 4.02Å; R530-D568 VanDerWaalsContact CD-O 3.27Å; R530-D568 WeakPolarHBondContact CD-O 3.39Å; R530-D568 PolarHBondContact NH1-O 3.4Å; R530-T571 PolarHBondContact NH1-O 2.86Å; R530-T571 PolarHBondContact NH2-O 3.1Å; R530-P572 PolarHBondContact NH2-O 2.85Å
531	F	88	Confident	75.2	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	144.9	179.7	-76.8	-93.3	0	0	0	111.9	I477 I494 S519 A560 Y561 Q562 V573 F575 F617	I477-F531 HydrophobicContact CD1-CE2 3.87Å; I477-F531 HydrophobicContact CD1-CZ 3.71Å; I477-F531 HydrophobicContact CG1-CZ 4.43Å; I477-F531 HydrophobicContact CG2-CZ 4.13Å; I494-F531 HydrophobicContact CD1-CD1 4.28Å; I494-F531 HydrophobicContact CD1-CE1 3.86Å; I494-F531 HydrophobicContact CD1-CZ 4.26Å; I494-F531 HydrophobicContact CG1-CD1 4.23Å; I494-F531 HydrophobicContact CG1-CE1 3.86Å; I494-F531 HydrophobicContact CG2-CE1 4.46Å; S519-F531 PolarHBondContact OG-O 2.92Å; S519-F531 VanDerWaalsContact OG-O 3.05Å; F531-A560 HydrophobicContact CB-CB 4.48Å; F531-A560 HydrophobicContact CD1-CB 3.95Å; F531-Y561 CarbonylContact C-O 3.45Å; F531-Y561 VanDerWaalsContact CA-O 3.31Å; F531-Y561 WeakPolarHBondContact CA-O 3.26Å; F531-Q562 HydrophobicContact CD1-CB 4.33Å; F531-Q562 HydrophobicContact CE1-CB 3.83Å; F531-Q562 HydrophobicContact CE1-CG 4.34Å; F531-Q562 HydrophobicContact CE2-CG 4.28Å; F531-Q562 HydrophobicContact CZ-CB 4Å; F531-Q562 HydrophobicContact CZ-CG 4Å; F531-V573 HydrophobicContact CD2-CB 4.49Å; F531-V573 HydrophobicContact CD2-CG1 3.65Å; F531-V573 HydrophobicContact CD2-CG2 4.08Å; F531-V573 HydrophobicContact CE2-CB 4.46Å; F531-V573 HydrophobicContact CE2-CG1 4.06Å; F531-V573 HydrophobicContact CE2-CG2 3.76Å; F531-V573 HydrophobicContact CG-CG1 4.42Å; F531-F575 HydrophobicContact CB-CZ 4.46Å; F531-F575 HydrophobicContact CG-CZ 4.44Å; F531-F617 AromaticContact CE2-CZ 3.99Å; F531-F617 HydrophobicContact CE2-CZ 3.99Å; F531-F617 HydrophobicContact CZ-CZ 4.48Å
532	Y	87.7	Confident	75.7	Confident	30 Å²	30	61.1 Å²	61.1	12%	0.118	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	147	177.7	-59.1	-87	0	0	0	110.8	H529 G537 Y561 R563	H529-Y532 HydrophobicContact CB-CE1 4.16Å; H529-Y532 PolarHBondContact N-OH 3.19Å; H529-Y532 WeakPolarHBondContact O-CE2 3.27Å; H529-Y532 PolarHBondContact O-OH 3.13Å; Y532-G537 WeakPolarHBondContact CD1-O 3.42Å; Y532-G537 WeakPolarHBondContact CE1-O 3.35Å; Y532-Y561 PolarHBondContact N-O 3.26Å; Y532-Y561 PolarHBondContact O-N 3.36Å; Y532-R563 HydrophobicContact CE2-CB 4.11Å; Y532-R563 HydrophobicContact CE2-CG 4.12Å
533	F	86.6	Confident	76.7	Confident	19 Å²	19	65.8 Å²	65.8	8%	0.083	36%	0.362	C	S	.	.	S	Bend	trans	-91.8	-16.9	178.2	-69.2	-70.3	0	0	0	113.8	V496 L517 S539 N540 T542 H558 A560 F575	V496-F533 HydrophobicContact CG2-CE1 4.4Å; L517-F533 HydrophobicContact CD1-CZ 4.18Å; L517-F533 HydrophobicContact CD2-CD1 4.21Å; L517-F533 HydrophobicContact CD2-CE1 3.37Å; L517-F533 HydrophobicContact CD2-CE2 3.98Å; L517-F533 HydrophobicContact CD2-CZ 3.23Å; L517-F533 HydrophobicContact CG-CE1 4.11Å; L517-F533 HydrophobicContact CG-CE2 3.8Å; L517-F533 HydrophobicContact CG-CZ 3.43Å; L517-F533 VanDerWaalsContact CG-CZ 3.43Å; F533-S539 PolarHBondContact N-O 2.79Å; F533-S539 VanDerWaalsContact N-O 3.14Å; F533-N540 WeakPolarHBondContact CE2-O 3.07Å; F533-T542 HydrophobicContact CB-CG2 4.06Å; F533-T542 HydrophobicContact CD1-CG2 4.05Å; F533-T542 HydrophobicContact CD2-CG2 3.91Å; F533-T542 HydrophobicContact CE2-CG2 4.38Å; F533-T542 HydrophobicContact CG-CG2 3.73Å; F533-H558 HydrophobicContact CD1-CB 4.1Å; F533-H558 HydrophobicContact CE1-CB 4.12Å; F533-A560 HydrophobicContact CD1-CB 4.11Å; F533-A560 HydrophobicContact CE1-CB 3.79Å; F533-A560 HydrophobicContact CZ-CB 4.44Å; F533-F575 HydrophobicContact CE1-CE1 4.3Å; F533-F575 AromaticContact CZ-CD1 3.84Å; F533-F575 HydrophobicContact CZ-CD1 3.84Å; F533-F575 AromaticContact CZ-CE1 3.68Å; F533-F575 HydrophobicContact CZ-CE1 3.68Å
534	H	77.4	Confident	77.7	Confident	91 Å²	91	64.9 Å²	64.9	42%	0.421	36%	0.361	S	S	.	.	S	Bend	trans	-106.6	129.7	175.1	-66.7	73.6	0	0	0	108.8	N536 G537	H534-N536 PolarHBondContact O-N 2.88Å; H534-N536 VanDerWaalsContact O-N 3.09Å; H534-G537 PolarHBondContact O-N 3.06Å
535	G	60.4	Low	79	Confident	24 Å²	24	64 Å²	64	25%	0.247	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-36.7	-175.2	0	0	0	0	0	114.3	D486 G537	D486-G535 VanDerWaalsContact CG-CA 3.48Å; D486-G535 VanDerWaalsContact OD1-CA 3.27Å; D486-G535 WeakPolarHBondContact OD1-CA 3.45Å; D486-G535 WeakPolarHBondContact OD2-CA 3.46Å; G535-G537 PolarHBondContact O-N 3.46Å
536	N	62.4	Low	80.4	Confident	147 Å²	147	58.1 Å²	58.1	79%	0.786	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	4.7	177.2	-158.3	24.1	0	0	0	115.3	H534 S538	H534-N536 PolarHBondContact O-N 2.88Å; H534-N536 VanDerWaalsContact O-N 3.09Å; N536-S538 PolarHBondContact O-N 2.78Å
537	G	66.4	Low	81.6	Confident	34 Å²	34	59.2 Å²	59.2	35%	0.351	31%	0.31	S	S	.	.	S	Bend	trans	66.7	19.9	-178.3	0	0	0	0	0	114.1	Y532 H534 G535	Y532-G537 WeakPolarHBondContact CD1-O 3.42Å; Y532-G537 WeakPolarHBondContact CE1-O 3.35Å; H534-G537 PolarHBondContact O-N 3.06Å; G535-G537 PolarHBondContact O-N 3.46Å
538	S	69.3	Low	82.5	Confident	82 Å²	82	53.4 Å²	53.4	57%	0.573	28%	0.284	S	S	*	.			trans	-88	-19.5	-167.1	55.7	0	0	0	0	114.8	N536	N536-S538 PolarHBondContact O-N 2.78Å
539	S	80.8	Confident	83.1	Confident	29 Å²	29	59.1 Å²	59.1	20%	0.203	30%	0.299	C	S	.	.			trans	-149.7	129.3	-179.7	-175.2	0	0	0	0	112	F533 S541	F533-S539 PolarHBondContact N-O 2.79Å; F533-S539 VanDerWaalsContact N-O 3.14Å; S539-S541 PolarHBondContact OG-N 2.74Å; S539-S541 PolarHBondContact OG-O 3.03Å; S539-S541 PolarHBondContact OG-OG 2.87Å
540	N	86.4	Confident	83.4	Confident	36 Å²	36	60.9 Å²	60.9	19%	0.193	31%	0.306	C	S	.	.	S	Bend	trans	-81.2	1.2	168.3	67.8	-31.3	0	0	0	112.5	T518 S519 H529 F533	T518-N540 WeakPolarHBondContact CA-O 3.27Å; S519-N540 PolarHBondContact N-O 2.81Å; S519-N540 PolarHBondContact OG-O 2.86Å; S519-N540 VanDerWaalsContact OG-O 3.12Å; H529-N540 HydrophobicContact CB-CB 4.16Å; H529-N540 PolarHBondContact CD2-ND2 2.81Å; H529-N540 PolarHBondContact CE1-ND2 2.87Å; H529-N540 VanDerWaalsContact CE1-ND2 3.26Å; H529-N540 PolarHBondContact NE2-ND2 3Å; F533-N540 WeakPolarHBondContact CE2-O 3.07Å
541	S	88.9	Confident	83.2	Confident	36 Å²	36	62.7 Å²	62.7	25%	0.252	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	147.3	177.6	63.4	0	0	0	0	112.5	L517 S539	L517-S541 CarbonylContact O-C 3.54Å; L517-S541 WeakPolarHBondContact O-CA 3.33Å; S539-S541 PolarHBondContact OG-N 2.74Å; S539-S541 PolarHBondContact OG-O 3.03Å; S539-S541 PolarHBondContact OG-OG 2.87Å
542	T	90.9	Very high	83.2	Confident	22 Å²	22	68.7 Å²	68.7	14%	0.135	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.5	173.3	-171.7	0	0	0	0	110.7	N516 L517 F533	N516-T542 WeakPolarHBondContact CA-O 3.47Å; N516-T542 PolarHBondContact OD1-O 2.89Å; L517-T542 HydrophobicContact CB-CG2 3.91Å; L517-T542 HydrophobicContact CD2-CG2 3.94Å; L517-T542 HydrophobicContact CG-CG2 4.3Å; L517-T542 PolarHBondContact N-O 3.28Å; L517-T542 PolarHBondContact O-N 3.23Å; F533-T542 HydrophobicContact CB-CG2 4.06Å; F533-T542 HydrophobicContact CD1-CG2 4.05Å; F533-T542 HydrophobicContact CD2-CG2 3.91Å; F533-T542 HydrophobicContact CE2-CG2 4.38Å; F533-T542 HydrophobicContact CG-CG2 3.73Å
543	R	91.6	Very high	83.3	Confident	185 Å²	185	71.9 Å²	71.9	70%	0.698	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.1	136.1	179.4	-73.4	-177.5	-78.2	-168	-5.2	110	Y515 N516	Y515-R543 WeakPolarHBondContact O-CA 3.33Å; N516-R543 HydrophobicContact CB-CG 4.11Å
544	G	90.7	Very high	83.7	Confident	9 Å²	9	72.2 Å²	72.2	9%	0.093	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	163.9	178	0	0	0	0	0	112.4	Y515	Y515-G544 WeakPolarHBondContact CD1-O 3.38Å; Y515-G544 PolarHBondContact N-O 3.46Å; Y515-G544 PolarHBondContact O-N 2.84Å
545	H	92.6	Very high	84.5	Confident	110 Å²	110	71.5 Å²	71.5	51%	0.509	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	143.4	173.2	-61.9	77.5	0	0	0	108.6	L513	L513-H545 CarbonylContact O-C 3.56Å; L513-H545 WeakPolarHBondContact O-CA 3.22Å
546	M	90.4	Very high	86.1	Confident	14 Å²	14	71.5 Å²	71.5	7%	0.069	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	131.6	179.2	-166.3	179.4	-67.6	0	0	110.9	F500 E512 L513 Y515 S554 A556	F500-M546 HydrophobicContact CB-SD 4.19Å; F500-M546 HydrophobicContact CD2-CB 4.47Å; F500-M546 HydrophobicContact CD2-CE 3.9Å; F500-M546 HydrophobicContact CD2-SD 3.64Å; F500-M546 HydrophobicContact CE2-CE 4.38Å; F500-M546 HydrophobicContact CG-SD 4.4Å; E512-M546 WeakPolarHBondContact CA-O 3.44Å; L513-M546 PolarHBondContact N-O 3.22Å; L513-M546 PolarHBondContact O-N 2.96Å; Y515-M546 HydrophobicContact CE1-CB 4.27Å; Y515-M546 HydrophobicContact CE1-CE 4.37Å; M546-S554 WeakPolarHBondContact SD-CB 3.43Å; M546-A556 HydrophobicContact CE-CB 3.57Å
547	K	90.2	Very high	87.6	Confident	135 Å²	135	68.5 Å²	68.5	59%	0.587	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	103.4	171.6	-68.8	-178.7	-177.5	174.2	0	108.9	A510 I511 E512	A510-K547 HydrophobicContact CB-CB 4.27Å; I511-K547 CarbonylContact O-C 3.58Å; I511-K547 WeakPolarHBondContact O-CA 3.41Å; E512-K547 HydrophobicContact CG-CG 4.41Å
548	A	88.4	Confident	88.8	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	135.5	179.1	0	0	0	0	0	110.8	V502 A510 I511 L513	V502-A548 HydrophobicContact CB-CB 4.21Å; V502-A548 HydrophobicContact CG1-CB 3.55Å; V502-A548 HydrophobicContact CG2-CB 3.56Å; A510-A548 WeakPolarHBondContact CA-O 3.18Å; A510-A548 WeakPolarHBondContact CB-O 3.39Å; I511-A548 PolarHBondContact N-O 2.9Å; I511-A548 PolarHBondContact O-N 2.99Å; L513-A548 HydrophobicContact CD1-CB 4.38Å
549	R	86.3	Confident	89.7	Confident	178 Å²	178	67 Å²	67	67%	0.672	35%	0.351	S	S	*	.	B	Isolated β-bridge	trans	-100	152.1	176.1	-65.4	-174.9	-177.9	-162.6	1.5	110.1	A510 G551 H552	A510-R549 HydrophobicContact CB-CG 4.29Å; R549-G551 PolarHBondContact O-N 3.14Å; R549-H552 HydrophobicContact CB-CB 4.46Å; R549-H552 PolarHBondContact O-N 2.85Å
550	H	87.7	Confident	90.2	Very high	93 Å²	93	65.6 Å²	65.6	43%	0.431	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-53.7	125.5	178.2	-172.7	86.6	0	0	0	111.7	V502 F504 H552	V502-H550 WeakPolarHBondContact O-CA 3Å; F504-H550 AromaticContact CD1-ND1 3.97Å; F504-H550 AromaticContact CD2-ND1 3.88Å; F504-H550 HydrophobicContact CE1-CB 3.89Å; F504-H550 HydrophobicContact CE2-CB 4.16Å; F504-H550 AromaticContact CE2-ND1 3.91Å; F504-H550 AromaticContact CG-ND1 3.93Å; F504-H550 HydrophobicContact CZ-CB 3.64Å; F504-H550 PolarHBondContact N-ND1 3.29Å; F504-H550 PolarHBondContact O-CE1 2.91Å; F504-H550 PolarHBondContact O-ND1 3.21Å; H550-H552 PolarHBondContact O-N 3.33Å; H550-H552 VanDerWaalsContact O-N 3.13Å; H550-H552 PolarHBondContact O-ND1 3.32Å
551	G	84.4	Confident	90.2	Very high	43 Å²	43	66.4 Å²	66.4	44%	0.443	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	3.1	174.5	0	0	0	0	0	116.3	V502 R549	V502-G551 PolarHBondContact O-N 3.11Å; R549-G551 PolarHBondContact O-N 3.14Å
552	H	88.3	Confident	90.1	Very high	126 Å²	126	65.6 Å²	65.6	58%	0.583	33%	0.334	S	S	*	.	B	Isolated β-bridge	trans	-117.2	128.5	-178.1	-68.1	75.4	0	0	0	111.2	R549 H550 S554	R549-H552 HydrophobicContact CB-CB 4.46Å; R549-H552 PolarHBondContact O-N 2.85Å; H550-H552 PolarHBondContact O-N 3.33Å; H550-H552 VanDerWaalsContact O-N 3.13Å; H550-H552 PolarHBondContact O-ND1 3.32Å; H552-S554 PolarHBondContact O-N 3.43Å
553	P	90.4	Very high	89.7	Confident	96 Å²	96	68.3 Å²	68.3	62%	0.623	34%	0.342	S	S	*	.			trans	-70.1	129.2	176.4	29.3	-33.3	0	0	0	110.4	F500	F500-P553 WeakPolarHBondContact O-CA 3.35Å
554	S	93.7	Very high	88.9	Confident	27 Å²	27	66.1 Å²	66.1	19%	0.189	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	131.3	171.4	-58.9	0	0	0	0	107.9	C499 F500 M546 H552	C499-S554 CarbonylContact C-O 3.59Å; C499-S554 VanDerWaalsContact CA-O 3.27Å; C499-S554 WeakPolarHBondContact CA-O 3.42Å; F500-S554 PolarHBondContact N-O 3.12Å; F500-S554 PolarHBondContact O-N 3.09Å; M546-S554 WeakPolarHBondContact SD-CB 3.43Å; H552-S554 PolarHBondContact O-N 3.43Å
555	C	94.3	Very high	88.1	Confident	75 Å²	75	70.6 Å²	70.6	51%	0.507	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	150.4	-175	-57.3	0	0	0	0	112.1	T497 I498 C499	T497-C555 HydrophobicContact CG2-CB 4.16Å; I498-C555 CarbonylContact O-C 3.54Å; I498-C555 WeakPolarHBondContact O-CA 3.41Å; C499-C555 HydrophobicContact CB-CB 4.1Å; C499-C555 WeakPolarHBondContact CB-SG 3.26Å; C499-C555 WeakPolarHBondContact SG-CB 3.48Å; C499-C555 CovalentContact SG-SG 2.04Å; C499-C555 PolarHBondContact SG-SG 3.33Å
556	A	94.1	Very high	87.4	Confident	25 Å²	25	66.4 Å²	66.4	21%	0.207	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	134.9	171.5	0	0	0	0	0	110	T497 I498 Y515 M546	T497-A556 WeakPolarHBondContact CA-O 3.38Å; I498-A556 PolarHBondContact N-O 3.33Å; I498-A556 PolarHBondContact O-N 2.94Å; Y515-A556 WeakPolarHBondContact OH-CB 3.4Å; M546-A556 HydrophobicContact CE-CB 3.57Å
557	T	93.4	Very high	86.5	Confident	84 Å²	84	74.9 Å²	74.9	52%	0.515	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	130.5	179.2	-55.3	0	0	0	0	110.1	N495 V496 T497	N495-T557 HydrophobicContact CB-CG2 3.94Å; V496-T557 WeakPolarHBondContact O-CA 3.37Å; T497-T557 WeakPolarHBondContact OG1-CG2 3.39Å; T497-T557 PolarHBondContact OG1-OG1 2.94Å
558	H	91.6	Very high	85.7	Confident	36 Å²	36	70.3 Å²	70.3	17%	0.167	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	142.7	175.3	-65.7	-89.3	0	0	0	109.7	V496 Y515 L517 F533	V496-H558 PolarHBondContact N-O 3.11Å; V496-H558 PolarHBondContact O-N 3.05Å; Y515-H558 AromaticContact CE2-NE2 3.58Å; Y515-H558 AromaticContact CZ-NE2 3.67Å; Y515-H558 PolarHBondContact OH-NE2 2.81Å; L517-H558 HydrophobicContact CD2-CB 4.01Å; F533-H558 HydrophobicContact CD1-CB 4.1Å; F533-H558 HydrophobicContact CE1-CB 4.12Å
559	V	89.7	Confident	85.1	Confident	48 Å²	48	72.7 Å²	72.7	29%	0.291	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	124.4	175.1	-175.9	0	0	0	0	108.6	C493 Y561	C493-V559 HydrophobicContact CB-CG1 3.89Å; V559-Y561 HydrophobicContact CB-CE2 4.34Å; V559-Y561 HydrophobicContact CG1-CE1 4.21Å; V559-Y561 HydrophobicContact CG1-CE2 4.1Å
560	A	90.2	Very high	84.2	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.8	174.4	0	0	0	0	0	109.9	C493 I494 V496 F531 F533 F575	C493-A560 CarbonylContact C-O 3.54Å; C493-A560 VanDerWaalsContact CA-O 3.23Å; C493-A560 WeakPolarHBondContact CA-O 3.38Å; I494-A560 HydrophobicContact CG1-CB 3.96Å; I494-A560 PolarHBondContact N-O 3.08Å; I494-A560 PolarHBondContact O-N 3.09Å; V496-A560 HydrophobicContact CG2-CB 4.16Å; F531-A560 HydrophobicContact CB-CB 4.48Å; F531-A560 HydrophobicContact CD1-CB 3.95Å; F533-A560 HydrophobicContact CD1-CB 4.11Å; F533-A560 HydrophobicContact CE1-CB 3.79Å; F533-A560 HydrophobicContact CZ-CB 4.44Å; A560-F575 HydrophobicContact CB-CE1 4.14Å; A560-F575 HydrophobicContact CB-CZ 4.24Å
561	Y	87.4	Confident	83.6	Confident	53 Å²	53	68.2 Å²	68.2	21%	0.208	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.8	-177.9	-59.7	-90.8	0	0	0	110.8	C484 D486 C493 F531 Y532 V559	C484-Y561 HydrophobicContact CB-CD1 4.23Å; C484-Y561 HydrophobicContact CB-CE1 3.78Å; D486-Y561 HydrophobicContact CB-CD1 4.32Å; D486-Y561 HydrophobicContact CB-CE1 4.23Å; C493-Y561 HydrophobicContact CB-CD1 4.27Å; F531-Y561 CarbonylContact C-O 3.45Å; F531-Y561 VanDerWaalsContact CA-O 3.31Å; F531-Y561 WeakPolarHBondContact CA-O 3.26Å; Y532-Y561 PolarHBondContact N-O 3.26Å; Y532-Y561 PolarHBondContact O-N 3.36Å; V559-Y561 HydrophobicContact CB-CE2 4.34Å; V559-Y561 HydrophobicContact CG1-CE1 4.21Å; V559-Y561 HydrophobicContact CG1-CE2 4.1Å
562	Q	86	Confident	83.4	Confident	18 Å²	18	67.2 Å²	67.2	8%	0.084	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	138.7	176.7	-168	-173.3	-11.2	0	0	111.1	V492 R530 F531 V566	V492-Q562 HydrophobicContact CB-CB 4.09Å; V492-Q562 VanDerWaalsContact CB-OE1 3.29Å; V492-Q562 VanDerWaalsContact O-CB 3.31Å; V492-Q562 WeakPolarHBondContact O-CB 3.42Å; V492-Q562 PolarHBondContact O-N 3.13Å; R530-Q562 CarbonylContact O-C 3.58Å; R530-Q562 WeakPolarHBondContact O-CA 3.22Å; F531-Q562 HydrophobicContact CD1-CB 4.33Å; F531-Q562 HydrophobicContact CE1-CB 3.83Å; F531-Q562 HydrophobicContact CE1-CG 4.34Å; F531-Q562 HydrophobicContact CE2-CG 4.28Å; F531-Q562 HydrophobicContact CZ-CB 4Å; F531-Q562 HydrophobicContact CZ-CG 4Å; Q562-V566 HydrophobicContact CG-CG2 3.92Å
563	R	82.4	Confident	83.3	Confident	80 Å²	80	61.2 Å²	61.2	30%	0.302	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-66.1	147.8	171.8	-154.1	176.3	79.6	134.3	3.7	111.3	P528 R530 Y532 D565 V566	P528-R563 VanDerWaalsContact CB-NH1 3.27Å; R530-R563 PolarHBondContact O-N 3.33Å; Y532-R563 HydrophobicContact CE2-CB 4.11Å; Y532-R563 HydrophobicContact CE2-CG 4.12Å; R563-D565 IonicContact CZ-OD2 2.59Å; R563-D565 PolarHBondContact NH2-O 3.49Å; R563-D565 IonicContact NH2-OD2 3.71Å; R563-D565 PolarHBondContact O-N 3.48Å; R563-V566 HydrophobicContact CB-CG2 3.99Å; R563-V566 WeakPolarHBondContact O-CG2 3.42Å
564	K	74.3	Confident	83.3	Confident	138 Å²	138	58.5 Å²	58.5	60%	0.6	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-34.8	-179.7	-68.7	-178.2	-177.8	171.5	0	113.8	T489 T491 V566	T489-K564 VanDerWaalsContact CB-NZ 3.3Å; T489-K564 VanDerWaalsContact CG2-NZ 3.3Å; T489-K564 PolarHBondContact OG1-NZ 3.44Å; T491-K564 HydrophobicContact CG2-CG 4.44Å; K564-V566 PolarHBondContact O-N 3.24Å
565	D	75.1	Confident	83.2	Confident	103 Å²	103	57.2 Å²	57.2	55%	0.551	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	54.4	-173.7	-4.5	-58.4	0	0	0	111.3	R563 K567	R563-D565 IonicContact CZ-OD2 2.59Å; R563-D565 PolarHBondContact NH2-O 3.49Å; R563-D565 IonicContact NH2-OD2 3.71Å; R563-D565 PolarHBondContact O-N 3.48Å; D565-K567 PolarHBondContact O-N 3.45Å
566	V	76.6	Confident	83.1	Confident	22 Å²	22	56.1 Å²	56.1	13%	0.133	27%	0.273	C	S	.	.			trans	-84.2	106.6	173.3	176.4	0	0	0	0	109	R530 Q562 R563 K564 D568 I569 F617	R530-V566 HydrophobicContact CB-CG1 4.39Å; R530-V566 HydrophobicContact CB-CG2 3.89Å; R530-V566 HydrophobicContact CG-CG1 3.98Å; R530-V566 HydrophobicContact CG-CG2 4.02Å; Q562-V566 HydrophobicContact CG-CG2 3.92Å; R563-V566 HydrophobicContact CB-CG2 3.99Å; R563-V566 WeakPolarHBondContact O-CG2 3.42Å; K564-V566 PolarHBondContact O-N 3.24Å; V566-D568 WeakPolarHBondContact CG1-O 3Å; V566-I569 HydrophobicContact CG1-CG2 4.28Å; V566-F617 HydrophobicContact CG1-CZ 4.1Å
567	K	72.8	Confident	83.1	Confident	192 Å²	192	55 Å²	55	84%	0.835	26%	0.263	S	S	*	.			trans	-92.8	-30.5	173.6	-64.7	-174.7	179.1	-177.5	0	112.7	D565 I569	D565-K567 PolarHBondContact O-N 3.45Å; K567-I569 PolarHBondContact O-N 3.42Å
568	D	73.1	Confident	83.1	Confident	40 Å²	40	52.6 Å²	52.6	21%	0.214	25%	0.25	C	C	.	.			trans	-86.5	92.2	177.4	-178.7	9.7	0	0	0	110.3	H523 R530 V566 Y570 T571	H523-D568 IonicContact CE1-OD2 3.39Å; H523-D568 PolarHBondContact CE1-OD2 2.02Å; H523-D568 VanDerWaalsContact CE1-OD2 3.22Å; H523-D568 IonicContact ND1-OD2 3.11Å; H523-D568 PolarHBondContact ND1-OD2 3.41Å; R530-D568 VanDerWaalsContact CD-O 3.27Å; R530-D568 WeakPolarHBondContact CD-O 3.39Å; R530-D568 PolarHBondContact NH1-O 3.4Å; V566-D568 WeakPolarHBondContact CG1-O 3Å; D568-Y570 PolarHBondContact OD1-N 3.32Å; D568-T571 PolarHBondContact OD1-N 3.17Å; D568-T571 VanDerWaalsContact OD1-N 3.09Å; D568-T571 PolarHBondContact OD1-OG1 2.97Å; D568-T571 VanDerWaalsContact OD1-OG1 3.11Å; D568-T571 WeakPolarHBondContact OD2-CB 3.32Å; D568-T571 PolarHBondContact OD2-OG1 3.08Å
569	I	74.9	Confident	83.1	Confident	49 Å²	49	51.8 Å²	51.8	25%	0.251	25%	0.245	S	C	.	.			trans	-99.9	0.5	175.4	63.9	172.6	0	0	0	112.4	V566 K567 F617	V566-I569 HydrophobicContact CG1-CG2 4.28Å; K567-I569 PolarHBondContact O-N 3.42Å; I569-F617 HydrophobicContact CB-CB 4.28Å; I569-F617 HydrophobicContact CB-CD2 4.11Å; I569-F617 HydrophobicContact CB-CG 4.16Å; I569-F617 HydrophobicContact CG2-CG 4.49Å; I569-F617 WeakPolarHBondContact O-CD2 3.46Å
570	Y	68.5	Low	83.2	Confident	132 Å²	132	50.6 Å²	50.6	52%	0.518	24%	0.243	S	C	.	.	S	Bend	trans	-96.3	-38.7	-172.6	-61	-80.3	0	0	0	111.5	D568	D568-Y570 PolarHBondContact OD1-N 3.32Å
571	T	74.8	Confident	83.1	Confident	45 Å²	45	53 Å²	53	28%	0.276	26%	0.255	S	S	.	.	S	Bend	trans	-70.8	132.8	177.4	-48.5	0	0	0	0	110.7	L522 R530 D568	L522-T571 HydrophobicContact CB-CG2 4.32Å; R530-T571 PolarHBondContact NH1-O 2.86Å; R530-T571 PolarHBondContact NH2-O 3.1Å; D568-T571 PolarHBondContact OD1-N 3.17Å; D568-T571 VanDerWaalsContact OD1-N 3.09Å; D568-T571 PolarHBondContact OD1-OG1 2.97Å; D568-T571 VanDerWaalsContact OD1-OG1 3.11Å; D568-T571 WeakPolarHBondContact OD2-CB 3.32Å; D568-T571 PolarHBondContact OD2-OG1 3.08Å
572	P	79.8	Confident	82.9	Confident	22 Å²	22	52 Å²	52	14%	0.143	26%	0.256	C	S	.	.			trans	-57	149.2	172.4	-22.7	32.3	0	0	0	112.1	R530 Q614 R616	R530-P572 PolarHBondContact NH2-O 2.85Å; P572-Q614 HydrophobicContact CB-CB 4.35Å; P572-R616 HydrophobicContact CB-CG 4.36Å
573	V	86.1	Confident	82	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	103.9	174.3	-174.2	0	0	0	0	107.9	I477 D520 F531 F575 Q614 T615 F617	I477-V573 HydrophobicContact CD1-CB 4.3Å; I477-V573 HydrophobicContact CD1-CG2 3.82Å; D520-V573 HydrophobicContact CB-CG1 4.31Å; F531-V573 HydrophobicContact CD2-CB 4.49Å; F531-V573 HydrophobicContact CD2-CG1 3.65Å; F531-V573 HydrophobicContact CD2-CG2 4.08Å; F531-V573 HydrophobicContact CE2-CB 4.46Å; F531-V573 HydrophobicContact CE2-CG1 4.06Å; F531-V573 HydrophobicContact CE2-CG2 3.76Å; F531-V573 HydrophobicContact CG-CG1 4.42Å; V573-F575 HydrophobicContact CB-CE2 4.35Å; V573-F575 HydrophobicContact CG1-CD2 4.26Å; V573-F575 HydrophobicContact CG1-CE2 3.56Å; V573-F575 HydrophobicContact CG1-CZ 4Å; V573-Q614 WeakPolarHBondContact O-CA 3.02Å; V573-T615 HydrophobicContact CB-CG2 4.27Å; V573-T615 PolarHBondContact N-O 2.88Å; V573-T615 PolarHBondContact O-N 3.37Å; V573-F617 HydrophobicContact CG2-CE2 3.85Å; V573-F617 HydrophobicContact CG2-CZ 4.3Å
574	Q	89.9	Confident	80.9	Confident	39 Å²	39	62.5 Å²	62.5	18%	0.182	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	133.7	178.1	-170.9	-177.6	39.4	0	0	111	D520 L521 L522 Q614	D520-Q574 WeakPolarHBondContact CA-O 3.48Å; D520-Q574 PolarHBondContact N-O 2.72Å; L521-Q574 PolarHBondContact N-O 2.77Å; L522-Q574 HydrophobicContact CD1-CB 3.87Å; L522-Q574 HydrophobicContact CG-CB 3.83Å; Q574-Q614 HydrophobicContact CB-CB 4.38Å
575	F	92	Very high	79.7	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	138.9	172.1	-71.4	-93.4	0	0	0	109.4	L471 L473 I494 V496 L517 T518 F531 F533 A560 V573 T612 N613 T615	L471-F575 HydrophobicContact CD2-CB 3.74Å; L471-F575 WeakPolarHBondContact CD2-O 3.39Å; L473-F575 HydrophobicContact CD1-CB 4.4Å; L473-F575 HydrophobicContact CD1-CD2 3.82Å; L473-F575 HydrophobicContact CD1-CG 4.48Å; L473-F575 HydrophobicContact CD2-CB 4.36Å; L473-F575 HydrophobicContact CD2-CD2 3.71Å; L473-F575 HydrophobicContact CD2-CE2 4.18Å; L473-F575 HydrophobicContact CD2-CG 4.05Å; L473-F575 HydrophobicContact CG-CD2 4.45Å; I494-F575 HydrophobicContact CD1-CE2 3.91Å; I494-F575 HydrophobicContact CD1-CZ 3.8Å; V496-F575 HydrophobicContact CG1-CD1 4.31Å; V496-F575 HydrophobicContact CG2-CD1 4.11Å; V496-F575 HydrophobicContact CG2-CE1 3.75Å; V496-F575 HydrophobicContact CG2-CE2 4.5Å; V496-F575 HydrophobicContact CG2-CZ 3.98Å; L517-F575 HydrophobicContact CD1-CB 4.49Å; L517-F575 HydrophobicContact CD1-CD1 4.41Å; T518-F575 WeakPolarHBondContact O-CA 3.47Å; F531-F575 HydrophobicContact CB-CZ 4.46Å; F531-F575 HydrophobicContact CG-CZ 4.44Å; F533-F575 HydrophobicContact CE1-CE1 4.3Å; F533-F575 AromaticContact CZ-CD1 3.84Å; F533-F575 HydrophobicContact CZ-CD1 3.84Å; F533-F575 AromaticContact CZ-CE1 3.68Å; F533-F575 HydrophobicContact CZ-CE1 3.68Å; A560-F575 HydrophobicContact CB-CE1 4.14Å; A560-F575 HydrophobicContact CB-CZ 4.24Å; V573-F575 HydrophobicContact CB-CE2 4.35Å; V573-F575 HydrophobicContact CG1-CD2 4.26Å; V573-F575 HydrophobicContact CG1-CE2 3.56Å; V573-F575 HydrophobicContact CG1-CZ 4Å; F575-T612 VanDerWaalsContact O-CA 3.27Å; F575-T612 WeakPolarHBondContact O-CA 3.5Å; F575-N613 PolarHBondContact N-O 2.89Å; F575-N613 PolarHBondContact O-N 2.78Å; F575-T615 HydrophobicContact CE2-CG2 4.17Å
576	E	93.3	Very high	78.2	Confident	53 Å²	53	66.8 Å²	66.8	25%	0.248	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138.1	177	-177.6	-173.8	-53.8	0	0	110.3	L517 T518 L521 I611 T612	L517-E576 CarbonylContact C-O 3.3Å; L517-E576 WeakPolarHBondContact CA-O 3.32Å; T518-E576 PolarHBondContact N-O 3.45Å; T518-E576 PolarHBondContact O-N 3.12Å; L521-E576 HydrophobicContact CD1-CB 3.19Å; L521-E576 HydrophobicContact CD1-CG 4.12Å; L521-E576 WeakPolarHBondContact CD1-OE1 3.1Å; E576-I611 CarbonylContact C-O 3.46Å; E576-I611 VanDerWaalsContact CA-O 3.3Å; E576-I611 WeakPolarHBondContact CA-O 3.46Å; E576-T612 HydrophobicContact CB-CG2 3.9Å; E576-T612 HydrophobicContact CG-CG2 3.81Å
577	V	93.6	Very high	76.5	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	117.1	169.2	-179.2	0	0	0	0	108.4	L471 I498 F500 Y515 N516 L517 T610 I611	L471-V577 HydrophobicContact CD1-CG2 3.95Å; L471-V577 HydrophobicContact CD2-CG2 4.43Å; I498-V577 HydrophobicContact CD1-CG1 4.18Å; I498-V577 HydrophobicContact CD1-CG2 3.52Å; I498-V577 HydrophobicContact CG1-CG2 3.74Å; I498-V577 HydrophobicContact CG2-CG1 4.11Å; I498-V577 HydrophobicContact CG2-CG2 4.14Å; F500-V577 HydrophobicContact CZ-CG1 3.93Å; Y515-V577 HydrophobicContact CD2-CG1 4.33Å; Y515-V577 HydrophobicContact CG-CG1 4.44Å; N516-V577 WeakPolarHBondContact O-CA 3.1Å; L517-V577 HydrophobicContact CB-CG2 4.43Å; L517-V577 HydrophobicContact CD1-CG2 3.54Å; V577-T610 CarbonylContact O-C 3.56Å; V577-T610 WeakPolarHBondContact O-CA 3.45Å; V577-I611 HydrophobicContact CB-CD1 4.31Å; V577-I611 HydrophobicContact CB-CG1 3.76Å; V577-I611 HydrophobicContact CG2-CG1 4.33Å; V577-I611 PolarHBondContact N-O 2.91Å; V577-I611 PolarHBondContact O-N 2.95Å
578	S	93.1	Very high	75	Confident	34 Å²	34	74.7 Å²	74.7	24%	0.238	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	136.2	165	56.9	0	0	0	0	109.6	Y515 N516 N609	Y515-S578 CarbonylContact C-O 3.53Å; Y515-S578 WeakPolarHBondContact CA-O 3.16Å; Y515-S578 WeakPolarHBondContact CB-O 3.42Å; N516-S578 PolarHBondContact N-O 3.44Å; N516-S578 PolarHBondContact O-N 2.88Å; N516-S578 PolarHBondContact O-OG 3.08Å; S578-N609 CarbonylContact C-O 3.51Å; S578-N609 WeakPolarHBondContact CA-O 3.43Å
579	Y	92	Very high	73.3	Confident	20 Å²	20	78.4 Å²	78.4	8%	0.078	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	158.1	-177.4	63	-89.7	0	0	0	112.9	V467 A469 F500 Q514 L601 N609	V467-Y579 HydrophobicContact CB-CE2 3.83Å; V467-Y579 HydrophobicContact CG1-CD2 4.24Å; V467-Y579 HydrophobicContact CG1-CE2 3.78Å; V467-Y579 HydrophobicContact CG2-CE2 4.25Å; A469-Y579 HydrophobicContact CB-CD1 4.44Å; A469-Y579 HydrophobicContact CB-CE1 3.97Å; F500-Y579 AromaticContact CE1-CD1 3.75Å; F500-Y579 HydrophobicContact CE1-CD1 3.75Å; F500-Y579 HydrophobicContact CE1-CD2 4.38Å; F500-Y579 HydrophobicContact CE1-CE1 4.4Å; F500-Y579 AromaticContact CE1-CG 3.74Å; F500-Y579 HydrophobicContact CE1-CG 3.74Å; F500-Y579 HydrophobicContact CZ-CD1 4.36Å; F500-Y579 HydrophobicContact CZ-CG 4.21Å; Q514-Y579 CarbonylContact O-C 3.52Å; Q514-Y579 WeakPolarHBondContact O-CA 3.38Å; Y579-L601 HydrophobicContact CD2-CD1 4.12Å; Y579-L601 HydrophobicContact CE2-CD1 4.15Å; Y579-N609 WeakPolarHBondContact CD1-O 3.36Å; Y579-N609 HydrophobicContact CD2-CB 4.47Å; Y579-N609 VanDerWaalsContact CE1-C 3.47Å; Y579-N609 HydrophobicContact CE2-CB 4.26Å; Y579-N609 PolarHBondContact N-O 3.37Å; Y579-N609 WeakPolarHBondContact O-CB 3.04Å
580	G	90.7	Very high	71.8	Confident	23 Å²	23	81.5 Å²	81.5	24%	0.237	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	164.6	-177.9	0	0	0	0	0	111.5	L513 Q514	L513-G580 CarbonylContact C-O 3.53Å; L513-G580 WeakPolarHBondContact CA-O 3.24Å; Q514-G580 PolarHBondContact N-O 2.95Å; Q514-G580 PolarHBondContact O-N 2.01Å
581	L	88.4	Confident	70.7	Confident	50 Å²	50	81.2 Å²	81.2	26%	0.262	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	137.7	170.4	-69.7	166.3	0	0	0	109.8	I511 L513 P599 L601	I511-L581 HydrophobicContact CG2-CD2 3.44Å; I511-L581 VanDerWaalsContact CG2-CD2 3.44Å; L513-L581 HydrophobicContact CD2-CD2 4.01Å; L581-P599 HydrophobicContact CD1-CB 4.26Å; L581-P599 WeakPolarHBondContact CD1-O 3.4Å; L581-L601 HydrophobicContact CD1-CD2 4.18Å; L581-L601 HydrophobicContact CD1-CG 4.11Å; L581-L601 HydrophobicContact CD2-CD2 4.03Å; L581-L601 HydrophobicContact CG-CD2 3.78Å; L581-L601 HydrophobicContact CG-CG 3.91Å
582	S	83.1	Confident	69.7	Low	33 Å²	33	89.1 Å²	89.1	23%	0.231	45%	0.449	C	S	.	.			trans	-73.4	128.4	177.6	-173.4	0	0	0	0	111.2	E512 K584	E512-S582 WeakPolarHBondContact O-CB 3.35Å; E512-S582 PolarHBondContact O-N 2.93Å; S582-K584 PolarHBondContact O-N 2.95Å
583	E	67.8	Low	68.8	Low	182 Å²	182	95.6 Å²	95.6	85%	0.85	48%	0.475	S	S	*	.			trans	-75.5	83.1	174.2	-69.1	-168.8	168.8	0	0	111.2	R585	E583-R585 PolarHBondContact O-N 2.67Å
584	K	58.7	Low	68.1	Low	136 Å²	136	97.1 Å²	97.1	59%	0.591	48%	0.483	S	S	*	.			trans	-74.9	121.3	160.4	-84.5	179.3	167.4	162.3	0	109.1	E512 S582 S586	E512-K584 WeakPolarHBondContact OE2-CE 3.24Å; E512-K584 IonicContact OE2-NZ 2.61Å; E512-K584 PolarHBondContact OE2-NZ 3.35Å; S582-K584 PolarHBondContact O-N 2.95Å; K584-S586 VanDerWaalsContact C-N 3.29Å; K584-S586 PolarHBondContact O-N 2.8Å
585	R	48.8	Very low	67.4	Low	245 Å²	245	97.6 Å²	97.6	93%	0.925	49%	0.493	S	S	*	.			trans	-56.8	99.9	157.4	-77.5	-176.7	177.8	-176.4	-0.5	106.4	E583 H587	E583-R585 PolarHBondContact O-N 2.67Å; R585-H587 PolarHBondContact O-N 3.22Å
586	S	44	Very low	66.5	Low	85 Å²	85	102.8 Å²	102.8	59%	0.594	52%	0.516	S	S	*	.			trans	-56.4	118.2	174.8	-165	0	0	0	0	107.1	K584 K588	K584-S586 VanDerWaalsContact C-N 3.29Å; K584-S586 PolarHBondContact O-N 2.8Å; S586-K588 PolarHBondContact O-N 3.21Å
587	H	42.1	Very low	66	Low	172 Å²	172	100.6 Å²	100.6	80%	0.796	51%	0.506	S	S	*	.			trans	-51.8	130.5	166.2	-86	-79.9	0	0	0	106.6	R585 T589	R585-H587 PolarHBondContact O-N 3.22Å; H587-T589 VanDerWaalsContact C-N 3.25Å; H587-T589 PolarHBondContact O-N 2.82Å
588	K	39.8	Very low	65.5	Low	209 Å²	209	106.1 Å²	106.1	91%	0.909	53%	0.53	S	S	*	.			trans	-50.6	94.8	169.2	-71.5	-178.7	176.5	-177.5	0	107.9	S586 P590	S586-K588 PolarHBondContact O-N 3.21Å; K588-P590 VanDerWaalsContact O-CD 3.28Å; K588-P590 WeakPolarHBondContact O-CD 3.49Å
589	T	38.4	Very low	65.2	Low	117 Å²	117	105.8 Å²	105.8	72%	0.718	53%	0.527	S	S	*	.			trans	-74.6	112.5	163.7	14.4	0	0	0	0	105.2	H587	H587-T589 VanDerWaalsContact C-N 3.25Å; H587-T589 PolarHBondContact O-N 2.82Å
590	P	43.2	Very low	65	Low	114 Å²	114	106.2 Å²	106.2	74%	0.74	53%	0.531	S	S	*	.	S	Bend	trans	-70.8	141.6	171.1	23.8	-15.5	0	0	0	107.7	K588	K588-P590 VanDerWaalsContact O-CD 3.28Å; K588-P590 WeakPolarHBondContact O-CD 3.49Å
591	S	45.5	Very low	64.8	Low	127 Å²	127	105.9 Å²	105.9	89%	0.888	52%	0.523	S	S	*	.			trans	95.8	40.5	170	80.1	0	0	0	0	120.5
592	R	53.8	Low	64.6	Low	211 Å²	211	105.1 Å²	105.1	80%	0.796	52%	0.518	S	S	*	.			trans	-117.2	132	151.6	-87.9	-174.8	162.7	-175	-8.8	110.3	L594	R592-L594 PolarHBondContact O-N 3.28Å
593	K	60.4	Low	64.1	Low	157 Å²	157	109.1 Å²	109.1	68%	0.683	53%	0.533	S	S	*	.	S	Bend	trans	-61.3	-24.6	177.1	-73.7	-172.8	175.6	-172.7	0	112.9	M87	M87-K593 HydrophobicContact CE-CB 3.98Å; M87-K593 HydrophobicContact CE-CD 4.21Å
594	L	72.3	Confident	63.9	Low	33 Å²	33	101.6 Å²	101.6	17%	0.173	50%	0.5	C	S	.	.	S	Bend	trans	-115.4	139.7	176.8	-70.6	174.7	0	0	0	110.8	M36 M87 D439 R592	M36-L594 HydrophobicContact CE-CD2 3.38Å; M36-L594 HydrophobicContact SD-CD2 4.27Å; M87-L594 HydrophobicContact CE-CD1 4.07Å; M87-L594 HydrophobicContact CE-CG 4.16Å; M87-L594 HydrophobicContact SD-CD1 3.67Å; M87-L594 HydrophobicContact SD-CG 4.08Å; D439-L594 HydrophobicContact CB-CD1 3.7Å; R592-L594 PolarHBondContact O-N 3.28Å
595	A	73.9	Confident	63.8	Low	49 Å²	49	99.3 Å²	99.3	41%	0.405	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-64.7	138.7	176.8	0	0	0	0	0	111	R460 I597	R460-A595 PolarHBondContact NH1-O 3.05Å; R460-A595 PolarHBondContact NH2-O 2.78Å; R460-A595 VanDerWaalsContact NH2-O 3.16Å; A595-I597 PolarHBondContact O-N 3.11Å
596	F	74.6	Confident	64	Low	108 Å²	108	90.8 Å²	90.8	47%	0.474	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-66.9	125.3	175.6	176.2	-96	0	0	0	110.6
597	I	82.1	Confident	64.8	Low	8 Å²	8	91.5 Å²	91.5	4%	0.041	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-89.1	131	177.8	-56.2	178.3	0	0	0	109.5	D31 D439 R460 R462 A595	D31-I597 HydrophobicContact CB-CG2 4.3Å; D439-I597 WeakPolarHBondContact OD2-CD1 3.25Å; R460-I597 HydrophobicContact CB-CD1 3.32Å; R460-I597 HydrophobicContact CG-CD1 4.23Å; R462-I597 HydrophobicContact CB-CG2 3.94Å; R462-I597 HydrophobicContact CG-CG2 3.47Å; R462-I597 VanDerWaalsContact CG-CG2 3.47Å; A595-I597 PolarHBondContact O-N 3.11Å
598	K	82.6	Confident	66.1	Low	115 Å²	115	89.6 Å²	89.6	50%	0.5	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-71.9	133	177.2	-65.5	175.7	-173.6	164.9	0	110.1	R462	R462-K598 PolarHBondContact NE-O 3.18Å; R462-K598 PolarHBondContact NH2-O 3.49Å
599	P	86.6	Confident	68.3	Low	27 Å²	27	82.7 Å²	82.7	18%	0.175	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-59.4	164.1	172.7	-17.4	28.5	0	0	0	112	R462 P463 V465 L581	R462-P599 PolarHBondContact NH2-O 3.31Å; P463-P599 CarbonylContact O-C 3.34Å; P463-P599 WeakPolarHBondContact O-CA 3.23Å; P463-P599 WeakPolarHBondContact O-CB 3.36Å; V465-P599 HydrophobicContact CG2-CB 3.79Å; L581-P599 HydrophobicContact CD1-CB 4.26Å; L581-P599 WeakPolarHBondContact CD1-O 3.4Å
600	I	87.6	Confident	70.7	Confident	30 Å²	30	80 Å²	80	15%	0.154	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	151.9	173.4	-169	146.1	0	0	0	110.6	Y28 N29 R462 P463 V464 V465	Y28-I600 WeakPolarHBondContact O-CD1 3.48Å; Y28-I600 WeakPolarHBondContact O-CG2 3.36Å; N29-I600 HydrophobicContact CB-CG2 4.5Å; R462-I600 HydrophobicContact CB-CG2 4.12Å; P463-I600 PolarHBondContact O-N 2.73Å; V464-I600 CarbonylContact C-O 3.47Å; V464-I600 WeakPolarHBondContact CA-O 3.23Å; V464-I600 HydrophobicContact CG2-CG2 4.08Å; V465-I600 PolarHBondContact N-O 3.18Å
601	L	87.2	Confident	72.9	Confident	16 Å²	16	76.1 Å²	76.1	8%	0.084	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	140.3	171.2	-63.6	179.6	0	0	0	109.5	V465 V467 L513 Y579 L581	V465-L601 HydrophobicContact CB-CD2 4.26Å; V465-L601 HydrophobicContact CG1-CD2 4.38Å; V465-L601 WeakPolarHBondContact O-CA 3.21Å; V467-L601 HydrophobicContact CG2-CD2 3.57Å; L513-L601 HydrophobicContact CD2-CD2 4.33Å; Y579-L601 HydrophobicContact CD2-CD1 4.12Å; Y579-L601 HydrophobicContact CE2-CD1 4.15Å; L581-L601 HydrophobicContact CD1-CD2 4.18Å; L581-L601 HydrophobicContact CD1-CG 4.11Å; L581-L601 HydrophobicContact CD2-CD2 4.03Å; L581-L601 HydrophobicContact CG-CD2 3.78Å; L581-L601 HydrophobicContact CG-CG 3.91Å
602	Q	84.8	Confident	75.1	Confident	34 Å²	34	73.7 Å²	73.7	16%	0.159	39%	0.389	C	S	.	.			trans	-59.6	141.8	173.8	-164.8	179.9	42.3	0	0	110.6	D377 V464 V465 Q466	D377-Q602 PolarHBondContact O-NE2 2.86Å; D377-Q602 VanDerWaalsContact O-NE2 3.07Å; V464-Q602 HydrophobicContact CG1-CB 3.53Å; V464-Q602 HydrophobicContact CG1-CG 3.91Å; V465-Q602 PolarHBondContact O-N 3.29Å; Q466-Q602 HydrophobicContact CG-CB 4.28Å
603	H	72.7	Confident	76.8	Confident	117 Å²	117	66.7 Å²	66.7	54%	0.542	37%	0.368	S	S	.	.			trans	-124	87.9	-179.2	-171.6	-80.1	0	0	0	108.8	Y28	Y28-H603 HydrophobicContact CD2-CB 3.54Å; Y28-H603 HydrophobicContact CE2-CB 3.09Å; Y28-H603 PolarHBondContact OH-N 2.98Å; Y28-H603 PolarHBondContact OH-O 2.88Å
604	S	63.6	Low	78.2	Confident	23 Å²	23	63.4 Å²	63.4	16%	0.161	36%	0.355	C	S	.	.			trans	-98.4	153.5	173.4	60.6	0	0	0	0	111.3	G606 H607	S604-G606 PolarHBondContact O-N 3.27Å; S604-G606 VanDerWaalsContact O-N 3.08Å; S604-H607 PolarHBondContact O-N 2.93Å; S604-H607 WeakPolarHBondContact OG-CB 3.35Å; S604-H607 VanDerWaalsContact OG-CG 3.31Å; S604-H607 PolarHBondContact OG-ND1 3Å
605	A	55.7	Low	78.9	Confident	88 Å²	88	62 Å²	62	73%	0.727	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	115.2	175.3	0	0	0	0	0	109.5
606	G	53.4	Low	79.3	Confident	66 Å²	66	63.8 Å²	63.8	68%	0.68	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.1	-13.7	-176.3	0	0	0	0	0	115.4	S604 H608	S604-G606 PolarHBondContact O-N 3.27Å; S604-G606 VanDerWaalsContact O-N 3.08Å; G606-H608 PolarHBondContact O-N 2.9Å
607	H	60.9	Low	79.5	Confident	101 Å²	101	59.1 Å²	59.1	47%	0.468	32%	0.323	S	S	.	.			trans	-89.8	92.7	168	-83	68.9	0	0	0	109.9	S604	S604-H607 PolarHBondContact O-N 2.93Å; S604-H607 WeakPolarHBondContact OG-CB 3.35Å; S604-H607 VanDerWaalsContact OG-CG 3.31Å; S604-H607 PolarHBondContact OG-ND1 3Å
608	H	68.5	Low	79.1	Confident	132 Å²	132	61.3 Å²	61.3	61%	0.611	34%	0.342	S	S	*	.			trans	-77.6	146.4	158.6	-62.7	-73	0	0	0	108.1	G606 T610	G606-H608 PolarHBondContact O-N 2.9Å; H608-T610 VanDerWaalsContact CB-OG1 3.27Å; H608-T610 WeakPolarHBondContact CB-OG1 3.41Å; H608-T610 PolarHBondContact O-N 3.34Å
609	N	85.8	Confident	78.4	Confident	63 Å²	63	59.8 Å²	59.8	34%	0.337	33%	0.334	S	S	.	.	S	Bend	trans	-70	34.1	170.7	-64.4	-30.9	0	0	0	111.5	S578 Y579	S578-N609 CarbonylContact C-O 3.51Å; S578-N609 WeakPolarHBondContact CA-O 3.43Å; Y579-N609 WeakPolarHBondContact CD1-O 3.36Å; Y579-N609 HydrophobicContact CD2-CB 4.47Å; Y579-N609 VanDerWaalsContact CE1-C 3.47Å; Y579-N609 HydrophobicContact CE2-CB 4.26Å; Y579-N609 PolarHBondContact N-O 3.37Å; Y579-N609 WeakPolarHBondContact O-CB 3.04Å
610	T	88.8	Confident	77	Confident	60 Å²	60	64.6 Å²	64.6	37%	0.368	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	138.5	-178.9	57.9	0	0	0	0	109.3	V577 H608	V577-T610 CarbonylContact O-C 3.56Å; V577-T610 WeakPolarHBondContact O-CA 3.45Å; H608-T610 VanDerWaalsContact CB-OG1 3.27Å; H608-T610 WeakPolarHBondContact CB-OG1 3.41Å; H608-T610 PolarHBondContact O-N 3.34Å
611	I	90.8	Very high	75.9	Confident	33 Å²	33	66.1 Å²	66.1	17%	0.169	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.2	169.1	58.2	166.6	0	0	0	109	A469 L471 E576 V577	A469-I611 HydrophobicContact CB-CD1 3.74Å; A469-I611 HydrophobicContact CB-CG1 4.35Å; A469-I611 HydrophobicContact CB-CG2 3.91Å; L471-I611 HydrophobicContact CB-CD1 3.81Å; E576-I611 CarbonylContact C-O 3.46Å; E576-I611 VanDerWaalsContact CA-O 3.3Å; E576-I611 WeakPolarHBondContact CA-O 3.46Å; V577-I611 HydrophobicContact CB-CD1 4.31Å; V577-I611 HydrophobicContact CB-CG1 3.76Å; V577-I611 HydrophobicContact CG2-CG1 4.33Å; V577-I611 PolarHBondContact N-O 2.91Å; V577-I611 PolarHBondContact O-N 2.95Å
612	T	90.9	Very high	74.5	Confident	76 Å²	76	70.3 Å²	70.3	47%	0.466	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	147.4	176.3	62.6	0	0	0	0	111	F575 E576	F575-T612 VanDerWaalsContact O-CA 3.27Å; F575-T612 WeakPolarHBondContact O-CA 3.5Å; E576-T612 HydrophobicContact CB-CG2 3.9Å; E576-T612 HydrophobicContact CG-CG2 3.81Å
613	N	90.6	Very high	73.2	Confident	64 Å²	64	72.8 Å²	72.8	34%	0.342	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	159.9	169.3	-162.8	0.4	0	0	0	108.5	L471 L473 F575	L471-N613 HydrophobicContact CB-CB 4.06Å; L471-N613 HydrophobicContact CD2-CB 3.69Å; L471-N613 HydrophobicContact CG-CB 3.96Å; L471-N613 PolarHBondContact O-ND2 2.92Å; L473-N613 VanDerWaalsContact CD1-C 3.47Å; L473-N613 HydrophobicContact CD1-CB 3.75Å; L473-N613 HydrophobicContact CG-CB 4.35Å; F575-N613 PolarHBondContact N-O 2.89Å; F575-N613 PolarHBondContact O-N 2.78Å
614	Q	89.1	Confident	72.4	Confident	88 Å²	88	71.7 Å²	71.7	41%	0.411	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	152.1	-175.2	61.2	-175.8	-14.6	0	0	112.8	P572 V573 Q574	P572-Q614 HydrophobicContact CB-CB 4.35Å; V573-Q614 WeakPolarHBondContact O-CA 3.02Å; Q574-Q614 HydrophobicContact CB-CB 4.38Å
615	T	86.2	Confident	72.2	Confident	3 Å²	3	76.2 Å²	76.2	2%	0.018	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	161.6	174.9	-177.6	0	0	0	0	110.5	L473 P474 I477 I494 V573 F575	L473-T615 HydrophobicContact CD1-CG2 4.46Å; P474-T615 VanDerWaalsContact O-CB 3.31Å; P474-T615 WeakPolarHBondContact O-CB 3.31Å; P474-T615 PolarHBondContact O-OG1 2.77Å; I477-T615 HydrophobicContact CD1-CG2 3.63Å; I477-T615 HydrophobicContact CG1-CG2 3.94Å; I494-T615 HydrophobicContact CD1-CG2 4.23Å; V573-T615 HydrophobicContact CB-CG2 4.27Å; V573-T615 PolarHBondContact N-O 2.88Å; V573-T615 PolarHBondContact O-N 3.37Å; F575-T615 HydrophobicContact CE2-CG2 4.17Å
616	R	82.8	Confident	72.7	Confident	87 Å²	87	73.6 Å²	73.6	33%	0.328	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	154	-169.7	-57.9	178.9	-179.1	-151.7	-4.1	111.8	H476 I477 P572 S747 D748	H476-R616 CarbonylContact C-O 3.55Å; H476-R616 WeakPolarHBondContact CA-O 3.49Å; I477-R616 PolarHBondContact N-O 3.27Å; P572-R616 HydrophobicContact CB-CG 4.36Å; R616-S747 PolarHBondContact NH1-O 2.73Å; R616-D748 IonicContact CZ-OD1 2.9Å; R616-D748 VanDerWaalsContact CZ-OD1 3.29Å; R616-D748 IonicContact NH1-OD1 2.75Å; R616-D748 PolarHBondContact NH1-OD1 3.28Å; R616-D748 IonicContact NH2-OD1 3.18Å; R616-D748 PolarHBondContact NH2-OD1 2.96Å
617	F	80.2	Confident	73.5	Confident	10 Å²	10	70.7 Å²	70.7	4%	0.044	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	147.8	173.2	-67.5	-84.5	0	0	0	112	I477 Q479 F531 V566 I569 V573	I477-F617 HydrophobicContact CB-CD1 3.84Å; I477-F617 HydrophobicContact CB-CE1 4.14Å; I477-F617 HydrophobicContact CB-CG 4.41Å; I477-F617 HydrophobicContact CD1-CE1 4.3Å; I477-F617 HydrophobicContact CD1-CZ 4.3Å; I477-F617 HydrophobicContact CG2-CD1 3.7Å; I477-F617 HydrophobicContact CG2-CE1 3.63Å; I477-F617 WeakPolarHBondContact O-CA 3.48Å; Q479-F617 HydrophobicContact CG-CD1 3.86Å; Q479-F617 HydrophobicContact CG-CE1 4.28Å; F531-F617 AromaticContact CE2-CZ 3.99Å; F531-F617 HydrophobicContact CE2-CZ 3.99Å; F531-F617 HydrophobicContact CZ-CZ 4.48Å; V566-F617 HydrophobicContact CG1-CZ 4.1Å; I569-F617 HydrophobicContact CB-CB 4.28Å; I569-F617 HydrophobicContact CB-CD2 4.11Å; I569-F617 HydrophobicContact CB-CG 4.16Å; I569-F617 HydrophobicContact CG2-CG 4.49Å; I569-F617 WeakPolarHBondContact O-CD2 3.46Å; V573-F617 HydrophobicContact CG2-CE2 3.85Å; V573-F617 HydrophobicContact CG2-CZ 4.3Å
618	A	72.2	Confident	74.3	Confident	54 Å²	54	66 Å²	66	45%	0.446	38%	0.381	S	S	.	.			trans	-69.2	145.9	172.3	0	0	0	0	0	112.2	I477	I477-A618 PolarHBondContact O-N 3.3Å; I477-A618 VanDerWaalsContact O-N 3.09Å
619	R	68.6	Low	74.9	Confident	84 Å²	84	60.6 Å²	60.6	32%	0.317	36%	0.356	S	S	.	.			trans	-122.7	156.1	-174.4	-62.4	-176.5	-179.6	170.8	3	113.2	D748	R619-D748 IonicContact CZ-OD2 3.44Å; R619-D748 PolarHBondContact NH1-O 2.89Å; R619-D748 IonicContact NH1-OD2 3.81Å; R619-D748 IonicContact NH2-OD2 2.73Å; R619-D748 PolarHBondContact NH2-OD2 2.98Å
620	S	57.8	Low	74.8	Confident	127 Å²	127	57.6 Å²	57.6	89%	0.888	34%	0.34	S	S	*	.			trans	-111.6	127.1	176.7	-55	0	0	0	0	111.6
621	C	62.6	Low	74.7	Confident	62 Å²	62	57.8 Å²	57.8	42%	0.419	34%	0.337	S	S	.	.			trans	-138.7	163.9	-169.1	-52.8	0	0	0	0	115.3	C626	C621-C626 HydrophobicContact CB-CB 3.47Å; C621-C626 VanDerWaalsContact CB-CB 3.47Å; C621-C626 WeakPolarHBondContact CB-SG 3.39Å; C621-C626 WeakPolarHBondContact SG-CB 3.31Å; C621-C626 CovalentContact SG-SG 1.98Å; C621-C626 PolarHBondContact SG-SG 3.01Å
622	S	58.6	Low	74.6	Confident	105 Å²	105	57.4 Å²	57.4	73%	0.734	34%	0.335	S	S	*	.	S	Bend	trans	-84	-41.9	-176.5	19.3	0	0	0	0	114.6	D663	S622-D663 VanDerWaalsContact OG-CG 3.22Å; S622-D663 PolarHBondContact OG-OD1 3.13Å; S622-D663 PolarHBondContact OG-OD2 2.97Å; S622-D663 VanDerWaalsContact OG-OD2 3.1Å
623	M	58.2	Low	74.5	Confident	86 Å²	86	56.5 Å²	56.5	42%	0.424	33%	0.332	S	S	.	.	S	Bend	trans	-84.6	152.6	170.3	-62.2	-171	-160.8	0	0	110.9	N625 C626 D663	M623-N625 PolarHBondContact O-N 2.78Å; M623-N625 VanDerWaalsContact O-N 3.11Å; M623-C626 PolarHBondContact O-N 3.49Å; M623-D663 PolarHBondContact N-OD2 3Å; M623-D663 VanDerWaalsContact N-OD2 3.12Å
624	A	55.5	Low	74.5	Confident	93 Å²	93	54.5 Å²	54.5	77%	0.769	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	121	168.8	0	0	0	0	0	108.5
625	N	60.1	Low	74.6	Confident	119 Å²	119	56.1 Å²	56.1	64%	0.636	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.1	19.2	-176.4	-51	-20.2	0	0	0	117.3	M623 S627 Y750	M623-N625 PolarHBondContact O-N 2.78Å; M623-N625 VanDerWaalsContact O-N 3.11Å; N625-S627 PolarHBondContact O-N 2.87Å; N625-Y750 HydrophobicContact CB-CD1 4.1Å
626	C	64.8	Low	74.7	Confident	33 Å²	33	57.5 Å²	57.5	22%	0.223	34%	0.338	C	S	.	.			trans	61.3	42.9	172.8	-45.6	0	0	0	0	115	C621 M623	C621-C626 HydrophobicContact CB-CB 3.47Å; C621-C626 VanDerWaalsContact CB-CB 3.47Å; C621-C626 WeakPolarHBondContact CB-SG 3.39Å; C621-C626 WeakPolarHBondContact SG-CB 3.31Å; C621-C626 CovalentContact SG-SG 1.98Å; C621-C626 PolarHBondContact SG-SG 3.01Å; M623-C626 PolarHBondContact O-N 3.49Å
627	S	71.3	Confident	75	Confident	5 Å²	5	55.9 Å²	55.9	4%	0.035	34%	0.338	C	S	.	.			trans	-74.5	129.3	-170.5	-166.7	0	0	0	0	114.4	N625 D663 Y750 T752	N625-S627 PolarHBondContact O-N 2.87Å; S627-D663 PolarHBondContact O-N 2.8Å; S627-D663 VanDerWaalsContact O-N 3.16Å; S627-Y750 CarbonylContact C-O 3.51Å; S627-Y750 WeakPolarHBondContact CA-O 3.13Å; S627-T752 PolarHBondContact OG-N 3.18Å
628	T	76.6	Confident	75.2	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.006	34%	0.343	C	S	.	.			trans	-85.7	165.7	165.6	45.9	0	0	0	0	111.8	D663 A665 N749 Y750 E751	T628-D663 WeakPolarHBondContact CG2-O 3.38Å; T628-A665 HydrophobicContact CG2-CB 3.71Å; T628-N749 HydrophobicContact CG2-CB 3.42Å; T628-N749 VanDerWaalsContact CG2-CB 3.42Å; T628-N749 WeakPolarHBondContact CG2-ND2 3.3Å; T628-Y750 PolarHBondContact N-O 3.37Å; T628-Y750 PolarHBondContact OG1-O 2.81Å; T628-E751 WeakPolarHBondContact O-CG 3.41Å
629	N	82.6	Confident	75.3	Confident	19 Å²	19	56.5 Å²	56.5	10%	0.102	34%	0.336	C	S	.	.			trans	-137.4	98.1	168.8	177	-23.8	0	0	0	109	Q631 N660 S661 E751 F755	N629-Q631 PolarHBondContact OD1-NE2 2.79Å; N629-N660 PolarHBondContact N-OD1 3.45Å; N629-N660 CarbonylContact O-C 3.59Å; N629-N660 VanDerWaalsContact O-CA 3.3Å; N629-N660 WeakPolarHBondContact O-CA 3.39Å; N629-N660 PolarHBondContact O-OD1 3.06Å; N629-S661 PolarHBondContact O-N 2.64Å; N629-E751 WeakPolarHBondContact CA-OE1 3.31Å; N629-F755 HydrophobicContact CB-CD2 4.09Å; N629-F755 HydrophobicContact CB-CG 4.31Å
630	M	83.3	Confident	75.4	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	140.7	-177.8	-63.4	-62.2	-60	0	0	110.7	L658 L659 N660 A665 P668 T744 E751 N759	M630-L658 HydrophobicContact CE-CD1 3.53Å; M630-L658 HydrophobicContact CE-CD2 3.44Å; M630-L658 VanDerWaalsContact CE-CD2 3.44Å; M630-L658 HydrophobicContact CE-CG 3.44Å; M630-L658 VanDerWaalsContact CE-CG 3.44Å; M630-L659 CarbonylContact C-O 3.59Å; M630-N660 HydrophobicContact SD-CB 3.81Å; M630-A665 HydrophobicContact SD-CB 3.54Å; M630-A665 VanDerWaalsContact SD-CB 3.54Å; M630-P668 HydrophobicContact CE-CB 3.97Å; M630-T744 HydrophobicContact CB-CG2 3.87Å; M630-E751 PolarHBondContact N-OE1 2.61Å; M630-N759 VanDerWaalsContact CB-OD1 3.3Å; M630-N759 WeakPolarHBondContact CB-OD1 3.41Å; M630-N759 PolarHBondContact O-OD1 3.08Å
631	Q	86.5	Confident	75.8	Confident	65 Å²	65	63.4 Å²	63.4	30%	0.304	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	128.2	-178.6	-58.9	-171.1	-9.7	0	0	110.7	N629 L659 D758	N629-Q631 PolarHBondContact OD1-NE2 2.79Å; Q631-L659 HydrophobicContact CB-CB 4.28Å; Q631-L659 PolarHBondContact N-O 3.31Å; Q631-L659 PolarHBondContact O-N 3.31Å; Q631-D758 WeakPolarHBondContact CG-OD2 3.47Å
632	L	88.4	Confident	76.2	Confident	24 Å²	24	64 Å²	64	13%	0.126	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	135	-175.9	-173.3	71.2	0	0	0	111.7	T656 L658 I742 T744 D758 N759 M761	L632-T656 HydrophobicContact CD1-CG2 3.52Å; L632-L658 HydrophobicContact CD1-CD1 4.39Å; L632-I742 HydrophobicContact CD1-CG2 4.15Å; L632-I742 HydrophobicContact CD2-CB 3.89Å; L632-I742 HydrophobicContact CD2-CG2 3.62Å; L632-I742 WeakPolarHBondContact CD2-O 3.5Å; L632-I742 HydrophobicContact CG-CG2 4.41Å; L632-T744 HydrophobicContact CB-CG2 4.18Å; L632-D758 WeakPolarHBondContact CB-O 3.05Å; L632-D758 PolarHBondContact N-O 2.81Å; L632-N759 WeakPolarHBondContact CD2-O 3.45Å; L632-M761 HydrophobicContact CD2-CB 3.86Å; L632-M761 HydrophobicContact CG-CB 4.49Å
633	S	89.3	Confident	77.1	Confident	58 Å²	58	68.4 Å²	68.4	41%	0.406	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	137.2	167.6	56.6	0	0	0	0	110.1	T656 S657	S633-T656 CarbonylContact O-C 3.52Å; S633-T656 WeakPolarHBondContact O-CA 3.18Å; S633-S657 PolarHBondContact N-O 3.09Å; S633-S657 PolarHBondContact O-N 2.93Å; S633-S657 VanDerWaalsContact OG-CB 3.29Å; S633-S657 WeakPolarHBondContact OG-CB 3.21Å; S633-S657 PolarHBondContact OG-OG 3.24Å
634	S	89.6	Confident	78.2	Confident	21 Å²	21	67.5 Å²	67.5	15%	0.147	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	150.1	-177.8	-62.9	0	0	0	0	113.2	K655 T656 I742	S634-K655 CarbonylContact C-O 3.58Å; S634-K655 WeakPolarHBondContact CA-O 3.35Å; S634-T656 WeakPolarHBondContact OG-CB 3.47Å; S634-T656 WeakPolarHBondContact OG-CG2 3.32Å; S634-T656 PolarHBondContact OG-OG1 2.86Å; S634-I742 VanDerWaalsContact CB-CD1 3.49Å; S634-I742 WeakPolarHBondContact OG-CD1 3.27Å
635	E	91.3	Very high	79.6	Confident	123 Å²	123	63.1 Å²	63.1	58%	0.575	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.1	139.5	179.2	-175.1	-172.8	175.1	0	0	110.8	K655	E635-K655 PolarHBondContact N-O 3.49Å; E635-K655 PolarHBondContact O-N 2.83Å
636	L	88.9	Confident	80.7	Confident	31 Å²	31	57.8 Å²	57.8	16%	0.162	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	125.7	176.9	-162.5	78.1	0	0	0	111.5	L638 I652 L654 I740 L763 L765	L636-L638 HydrophobicContact CD2-CD2 3.99Å; L636-I652 HydrophobicContact CD1-CD1 4.1Å; L636-L654 HydrophobicContact CD1-CB 4.22Å; L636-L654 HydrophobicContact CD1-CD1 4.21Å; L636-I740 HydrophobicContact CD1-CD1 4.24Å; L636-L763 HydrophobicContact CB-CD1 4.39Å; L636-L765 HydrophobicContact CD2-CB 3.94Å; L636-L765 HydrophobicContact CD2-CD1 3.57Å; L636-L765 HydrophobicContact CD2-CG 4.18Å
637	V	87.9	Confident	81.4	Confident	54 Å²	54	56.5 Å²	56.5	33%	0.327	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	116.4	178.5	-175.9	0	0	0	0	109.9	V653 K655	V637-V653 HydrophobicContact CB-CB 4.34Å; V637-V653 PolarHBondContact N-O 3.43Å; V637-V653 PolarHBondContact O-N 2.92Å; V637-K655 HydrophobicContact CG2-CD 4.05Å; V637-K655 HydrophobicContact CG2-CG 4.37Å
638	L	84.7	Confident	81.5	Confident	30 Å²	30	57.2 Å²	57.2	16%	0.157	29%	0.289	C	S	.	.			trans	-91.1	149.1	-179.4	-62.4	177.9	0	0	0	112.7	L636 Q641 Q642 F645 I652 L765	L636-L638 HydrophobicContact CD2-CD2 3.99Å; L638-Q641 PolarHBondContact O-N 2.82Å; L638-Q642 VanDerWaalsContact CD1-O 3.26Å; L638-Q642 WeakPolarHBondContact CD1-O 3.45Å; L638-F645 HydrophobicContact CD2-CB 4.16Å; L638-F645 HydrophobicContact CD2-CD2 4.21Å; L638-I652 HydrophobicContact CD2-CG2 4.14Å; L638-L765 HydrophobicContact CD2-CD1 3.46Å; L638-L765 VanDerWaalsContact CD2-CD1 3.46Å
639	P	75.3	Confident	81.5	Confident	46 Å²	46	59.7 Å²	59.7	30%	0.299	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-56.4	139.3	171.6	-22.5	32.8	0	0	0	111.7	Q641 Q642 F645 Q651	P639-Q641 PolarHBondContact O-N 3.24Å; P639-Q641 VanDerWaalsContact O-N 3.14Å; P639-Q642 PolarHBondContact O-N 3.16Å; P639-F645 HydrophobicContact CG-CD2 4.38Å; P639-F645 HydrophobicContact CG-CE2 4.01Å; P639-Q651 VanDerWaalsContact CG-O 3.25Å; P639-Q651 WeakPolarHBondContact CG-O 3.29Å
640	Q	70.2	Confident	81.3	Confident	166 Å²	166	59.9 Å²	59.9	78%	0.776	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	59.7	19.8	175.7	-53.9	-179.4	-3.9	0	0	115.8	Q642	Q640-Q642 HydrophobicContact CB-CG 4.13Å; Q640-Q642 PolarHBondContact O-N 3.48Å; Q640-Q642 VanDerWaalsContact O-N 3.08Å
641	Q	65.9	Low	81.5	Confident	191 Å²	191	64.4 Å²	64.4	89%	0.893	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	55	24.5	-179	-63.2	179	-12.3	0	0	114.2	L638 P639	L638-Q641 PolarHBondContact O-N 2.82Å; P639-Q641 PolarHBondContact O-N 3.24Å; P639-Q641 VanDerWaalsContact O-N 3.14Å
642	Q	71.8	Confident	81.7	Confident	73 Å²	73	61.4 Å²	61.4	34%	0.341	32%	0.32	S	S	.	.			trans	-71.2	153.1	177.5	-63.6	-175.7	5.5	0	0	110.7	L638 P639 Q640 F644	L638-Q642 VanDerWaalsContact CD1-O 3.26Å; L638-Q642 WeakPolarHBondContact CD1-O 3.45Å; P639-Q642 PolarHBondContact O-N 3.16Å; Q640-Q642 HydrophobicContact CB-CG 4.13Å; Q640-Q642 PolarHBondContact O-N 3.48Å; Q640-Q642 VanDerWaalsContact O-N 3.08Å; Q642-F644 PolarHBondContact O-N 2.86Å
643	K	76.6	Confident	81.8	Confident	198 Å²	198	61.9 Å²	61.9	86%	0.861	32%	0.324	S	S	*	.	S	Bend	trans	-74	-9.2	177	-67.2	-175.6	178.8	-179.1	0	113.7
644	F	82.3	Confident	81.8	Confident	67 Å²	67	59.1 Å²	59.1	29%	0.294	31%	0.305	S	S	.	.	S	Bend	trans	-145.1	159.3	-178.3	64.6	-91.5	0	0	0	110.6	Q642 A646 P766 K768	Q642-F644 PolarHBondContact O-N 2.86Å; F644-A646 HydrophobicContact CE2-CB 4.46Å; F644-P766 HydrophobicContact CB-CB 4.49Å; F644-P766 HydrophobicContact CB-CG 4.31Å; F644-P766 WeakPolarHBondContact CB-O 3.42Å; F644-K768 HydrophobicContact CB-CD 4.11Å; F644-K768 HydrophobicContact CB-CG 4.23Å; F644-K768 HydrophobicContact CD1-CD 4.21Å; F644-K768 HydrophobicContact CD2-CB 3.66Å; F644-K768 HydrophobicContact CD2-CD 4.09Å; F644-K768 HydrophobicContact CD2-CG 4.08Å; F644-K768 HydrophobicContact CE2-CB 4.03Å; F644-K768 HydrophobicContact CG-CB 4.28Å; F644-K768 HydrophobicContact CG-CD 3.87Å; F644-K768 HydrophobicContact CG-CG 4.2Å
645	F	84.5	Confident	81.8	Confident	2 Å²	2	63 Å²	63	1%	0.009	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	121.2	176	-172.3	-94.5	0	0	0	110	L638 P639 G650 I652 V729 L765 P766 L767 K768	L638-F645 HydrophobicContact CD2-CB 4.16Å; L638-F645 HydrophobicContact CD2-CD2 4.21Å; P639-F645 HydrophobicContact CG-CD2 4.38Å; P639-F645 HydrophobicContact CG-CE2 4.01Å; F645-G650 WeakPolarHBondContact CZ-O 3.5Å; F645-I652 HydrophobicContact CD2-CG2 3.39Å; F645-I652 HydrophobicContact CE2-CG2 3.33Å; F645-I652 HydrophobicContact CG-CG2 4.31Å; F645-I652 HydrophobicContact CZ-CG2 4.23Å; F645-V729 HydrophobicContact CD1-CB 4.25Å; F645-V729 HydrophobicContact CD1-CG1 4.2Å; F645-V729 HydrophobicContact CD1-CG2 4.2Å; F645-V729 HydrophobicContact CE1-CB 3.52Å; F645-V729 HydrophobicContact CE1-CG1 3.81Å; F645-V729 HydrophobicContact CE1-CG2 3.77Å; F645-V729 HydrophobicContact CE2-CG2 4.45Å; F645-V729 HydrophobicContact CZ-CB 3.89Å; F645-V729 HydrophobicContact CZ-CG2 3.91Å; F645-L765 HydrophobicContact CB-CD1 3.6Å; F645-L765 HydrophobicContact CB-CG 4.38Å; F645-L765 HydrophobicContact CG-CD1 4.34Å; F645-P766 PolarHBondContact N-O 3.14Å; F645-L767 HydrophobicContact CD1-CG 4.45Å; F645-L767 WeakPolarHBondContact O-CA 3.27Å; F645-K768 PolarHBondContact O-N 3.11Å
646	A	82.5	Confident	81.7	Confident	6 Å²	6	57.3 Å²	57.3	5%	0.05	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	127.5	174.5	0	0	0	0	0	110.3	F644 G648 S649 K768 P812	F644-A646 HydrophobicContact CE2-CB 4.46Å; A646-G648 PolarHBondContact O-N 2.92Å; A646-S649 VanDerWaalsContact CB-OG 3.3Å; A646-S649 WeakPolarHBondContact CB-OG 3.08Å; A646-S649 WeakPolarHBondContact O-CB 3.46Å; A646-S649 PolarHBondContact O-N 2.79Å; A646-S649 PolarHBondContact O-OG 3.15Å; A646-K768 WeakPolarHBondContact CA-O 3.37Å; A646-P812 HydrophobicContact CB-CG 4.32Å
647	L	80.8	Confident	81.6	Confident	6 Å²	6	56.1 Å²	56.1	3%	0.031	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	127.1	178.3	-73	164.4	0	0	0	110.6	S733 P735 L767 K768 P812 S813	L647-S733 WeakPolarHBondContact CD2-O 3.26Å; L647-P735 HydrophobicContact CD1-CB 4.34Å; L647-L767 HydrophobicContact CD2-CB 4.41Å; L647-L767 HydrophobicContact CD2-CD2 3.65Å; L647-L767 HydrophobicContact CD2-CG 4.44Å; L647-K768 PolarHBondContact N-O 2.67Å; L647-P812 CarbonylContact O-C 3.54Å; L647-P812 VanDerWaalsContact O-C 3.27Å; L647-S813 WeakPolarHBondContact CB-OG 3.25Å; L647-S813 PolarHBondContact N-OG 2.86Å; L647-S813 PolarHBondContact O-N 2.8Å; L647-S813 PolarHBondContact O-OG 3.1Å
648	G	73.5	Confident	81.4	Confident	20 Å²	20	53.6 Å²	53.6	21%	0.206	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	3.3	-176.7	0	0	0	0	0	115.4	A646 G650	A646-G648 PolarHBondContact O-N 2.92Å; G648-G650 PolarHBondContact O-N 2.75Å
649	S	76.1	Confident	81.3	Confident	54 Å²	54	54.4 Å²	54.4	38%	0.378	28%	0.276	S	S	.	.			trans	-77.7	0.6	174.3	-66.5	0	0	0	0	114.9	A646	A646-S649 VanDerWaalsContact CB-OG 3.3Å; A646-S649 WeakPolarHBondContact CB-OG 3.08Å; A646-S649 WeakPolarHBondContact O-CB 3.46Å; A646-S649 PolarHBondContact O-N 2.79Å; A646-S649 PolarHBondContact O-OG 3.15Å
650	G	78.7	Confident	81.6	Confident	22 Å²	22	52.6 Å²	52.6	23%	0.227	26%	0.263	C	S	.	.			trans	92.1	-117.7	170.7	0	0	0	0	0	114.9	F645 G648 D728 V729	F645-G650 WeakPolarHBondContact CZ-O 3.5Å; G648-G650 PolarHBondContact O-N 2.75Å; G650-D728 VanDerWaalsContact C-OD1 3.24Å; G650-V729 PolarHBondContact O-N 3.31Å
651	Q	87.8	Confident	82	Confident	96 Å²	96	47.5 Å²	47.5	45%	0.449	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	150.3	-162.5	-59.9	172.7	-4.3	0	0	113.4	P639 I681 L726 L727 D728	P639-Q651 VanDerWaalsContact CG-O 3.25Å; P639-Q651 WeakPolarHBondContact CG-O 3.29Å; Q651-I681 HydrophobicContact CB-CD1 4.49Å; Q651-I681 VanDerWaalsContact CD-CD1 3.4Å; Q651-I681 HydrophobicContact CG-CD1 3.58Å; Q651-L726 HydrophobicContact CB-CD1 3.98Å; Q651-L727 CarbonylContact C-O 3.5Å; Q651-L727 WeakPolarHBondContact CA-O 3.21Å; Q651-L727 WeakPolarHBondContact CB-O 3.42Å; Q651-D728 HydrophobicContact CG-CB 4.45Å
652	I	89.5	Confident	82.4	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	153.6	173.3	64.5	-175.9	0	0	0	110.2	L636 L638 F645 L727 V729 I740 L765	L636-I652 HydrophobicContact CD1-CD1 4.1Å; L638-I652 HydrophobicContact CD2-CG2 4.14Å; F645-I652 HydrophobicContact CD2-CG2 3.39Å; F645-I652 HydrophobicContact CE2-CG2 3.33Å; F645-I652 HydrophobicContact CG-CG2 4.31Å; F645-I652 HydrophobicContact CZ-CG2 4.23Å; I652-L727 HydrophobicContact CD1-CB 4.25Å; I652-L727 HydrophobicContact CD1-CD1 4.37Å; I652-L727 HydrophobicContact CG1-CB 3.74Å; I652-L727 HydrophobicContact CG1-CD1 4.43Å; I652-L727 PolarHBondContact N-O 3.37Å; I652-L727 PolarHBondContact O-N 3.04Å; I652-V729 HydrophobicContact CD1-CG2 3.97Å; I652-V729 HydrophobicContact CG1-CG2 4.43Å; I652-V729 HydrophobicContact CG2-CG2 4.24Å; I652-I740 HydrophobicContact CD1-CD1 4.48Å; I652-L765 HydrophobicContact CD1-CD2 3.59Å
653	V	90.2	Very high	82.5	Confident	35 Å²	35	36.3 Å²	36.3	21%	0.212	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	123.8	177.5	-179.6	0	0	0	0	109.9	V637 K655 L684 F725 L726	V637-V653 HydrophobicContact CB-CB 4.34Å; V637-V653 PolarHBondContact N-O 3.43Å; V637-V653 PolarHBondContact O-N 2.92Å; V653-K655 HydrophobicContact CG1-CG 4.41Å; V653-L684 HydrophobicContact CG1-CD1 4.18Å; V653-L684 HydrophobicContact CG2-CD1 4.31Å; V653-F725 CarbonylContact C-O 3.11Å; V653-F725 WeakPolarHBondContact CA-O 3.49Å; V653-L726 HydrophobicContact CG2-CD1 3.85Å
654	L	90.3	Very high	82.2	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	117.8	173.3	172.4	65.2	0	0	0	109.3	L636 L672 S724 F725 L727 I742 L763	L636-L654 HydrophobicContact CD1-CB 4.22Å; L636-L654 HydrophobicContact CD1-CD1 4.21Å; L654-L672 HydrophobicContact CD2-CD2 3.45Å; L654-L672 VanDerWaalsContact CD2-CD2 3.45Å; L654-S724 CarbonylContact O-C 3.51Å; L654-S724 WeakPolarHBondContact O-CA 3.31Å; L654-F725 HydrophobicContact CB-CB 4.25Å; L654-F725 HydrophobicContact CD2-CD2 4.11Å; L654-F725 HydrophobicContact CG-CD2 4.23Å; L654-F725 PolarHBondContact N-O 3.35Å; L654-F725 PolarHBondContact O-N 3.03Å; L654-L727 HydrophobicContact CB-CD1 4.23Å; L654-L727 HydrophobicContact CD2-CD1 4.45Å; L654-I742 HydrophobicContact CD1-CD1 3.86Å; L654-I742 HydrophobicContact CD2-CD1 3.85Å; L654-I742 HydrophobicContact CD2-CG1 4.42Å; L654-I742 HydrophobicContact CG-CD1 4.38Å; L654-L763 HydrophobicContact CD1-CD1 3.31Å
655	K	89.7	Confident	81.7	Confident	102 Å²	102	26.4 Å²	26.4	44%	0.443	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	123	174.5	-66.6	-179.3	178.7	175.3	0	108.9	S634 E635 V637 V653	S634-K655 CarbonylContact C-O 3.58Å; S634-K655 WeakPolarHBondContact CA-O 3.35Å; E635-K655 PolarHBondContact N-O 3.49Å; E635-K655 PolarHBondContact O-N 2.83Å; V637-K655 HydrophobicContact CG2-CD 4.05Å; V637-K655 HydrophobicContact CG2-CG 4.37Å; V653-K655 HydrophobicContact CG1-CG 4.41Å
656	T	88.6	Confident	80.9	Confident	3 Å²	3	28.2 Å²	28.2	2%	0.018	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	143.1	-179.2	-64	0	0	0	0	109.7	L632 S633 S634 V670 N722 I723 I742	L632-T656 HydrophobicContact CD1-CG2 3.52Å; S633-T656 CarbonylContact O-C 3.52Å; S633-T656 WeakPolarHBondContact O-CA 3.18Å; S634-T656 WeakPolarHBondContact OG-CB 3.47Å; S634-T656 WeakPolarHBondContact OG-CG2 3.32Å; S634-T656 PolarHBondContact OG-OG1 2.86Å; T656-V670 HydrophobicContact CG2-CG1 4.41Å; T656-N722 CarbonylContact O-C 3.25Å; T656-N722 WeakPolarHBondContact O-CA 3.4Å; T656-I723 PolarHBondContact N-O 3.36Å; T656-I723 PolarHBondContact O-N 2.97Å; T656-I723 VanDerWaalsContact O-O 3.1Å; T656-I742 HydrophobicContact CG2-CG2 4.47Å
657	S	86.4	Confident	80.3	Confident	7 Å²	7	31.2 Å²	31.2	5%	0.049	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	135.1	178.1	159.1	0	0	0	0	110.2	S633 K720 V721 N722	S633-S657 PolarHBondContact N-O 3.09Å; S633-S657 PolarHBondContact O-N 2.93Å; S633-S657 VanDerWaalsContact OG-CB 3.29Å; S633-S657 WeakPolarHBondContact OG-CB 3.21Å; S633-S657 PolarHBondContact OG-OG 3.24Å; S657-K720 WeakPolarHBondContact OG-CE 3.36Å; S657-K720 WeakPolarHBondContact OG-CG 3.34Å; S657-V721 CarbonylContact C-O 3.4Å; S657-V721 VanDerWaalsContact CA-O 3.28Å; S657-V721 WeakPolarHBondContact CA-O 3.29Å; S657-N722 WeakPolarHBondContact CB-OD1 3.44Å
658	L	84.6	Confident	80.1	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	135.2	-178.7	-166.4	67.6	0	0	0	111.4	M630 L632 P668 V670 L708 K720 V721 T744	M630-L658 HydrophobicContact CE-CD1 3.53Å; M630-L658 HydrophobicContact CE-CD2 3.44Å; M630-L658 VanDerWaalsContact CE-CD2 3.44Å; M630-L658 HydrophobicContact CE-CG 3.44Å; M630-L658 VanDerWaalsContact CE-CG 3.44Å; L632-L658 HydrophobicContact CD1-CD1 4.39Å; L658-P668 HydrophobicContact CD2-CB 4.17Å; L658-V670 HydrophobicContact CD1-CG2 4.43Å; L658-V670 HydrophobicContact CD2-CG2 4.05Å; L658-L708 HydrophobicContact CD2-CD1 3.53Å; L658-K720 WeakPolarHBondContact O-CA 3.39Å; L658-V721 PolarHBondContact N-O 3.11Å; L658-V721 PolarHBondContact O-N 3.48Å; L658-T744 HydrophobicContact CD1-CG2 3.76Å; L658-T744 VanDerWaalsContact CD1-OG1 3.24Å; L658-T744 WeakPolarHBondContact CD1-OG1 3.48Å
659	L	82.9	Confident	80.4	Confident	47 Å²	47	34.3 Å²	34.3	25%	0.246	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	140	178.1	175.9	68.6	0	0	0	109.7	M630 Q631	M630-L659 CarbonylContact C-O 3.59Å; Q631-L659 HydrophobicContact CB-CB 4.28Å; Q631-L659 PolarHBondContact N-O 3.31Å; Q631-L659 PolarHBondContact O-N 3.31Å
660	N	80.5	Confident	80.8	Confident	8 Å²	8	31.8 Å²	31.8	4%	0.043	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.8	171.1	179.4	26.7	0	0	0	110	N629 M630 G662 D663 A665 L713	N629-N660 PolarHBondContact N-OD1 3.45Å; N629-N660 CarbonylContact O-C 3.59Å; N629-N660 VanDerWaalsContact O-CA 3.3Å; N629-N660 WeakPolarHBondContact O-CA 3.39Å; N629-N660 PolarHBondContact O-OD1 3.06Å; M630-N660 HydrophobicContact SD-CB 3.81Å; N660-G662 PolarHBondContact OD1-N 2.98Å; N660-G662 VanDerWaalsContact OD1-N 3.11Å; N660-D663 PolarHBondContact ND2-O 3.34Å; N660-A665 HydrophobicContact CB-CB 4.44Å; N660-A665 PolarHBondContact ND2-N 3.25Å; N660-A665 VanDerWaalsContact ND2-N 3.2Å; N660-L713 HydrophobicContact CB-CB 4.14Å; N660-L713 HydrophobicContact CB-CD2 3.48Å; N660-L713 VanDerWaalsContact CB-CD2 3.48Å; N660-L713 HydrophobicContact CB-CG 4.42Å; N660-L713 PolarHBondContact ND2-O 2.68Å
661	S	78.3	Confident	81.2	Confident	60 Å²	60	31.8 Å²	31.8	42%	0.42	16%	0.161	S	C	.	.			trans	-112.9	2.9	179.8	-59.2	0	0	0	0	113.4	N629	N629-S661 PolarHBondContact O-N 2.64Å
662	G	74.6	Confident	81.1	Confident	3 Å²	3	27.3 Å²	27.3	3%	0.031	14%	0.14	C	C	.	.	S	Bend	trans	-107.2	-152.7	-178.8	0	0	0	0	0	113.4	N660 T715	N660-G662 PolarHBondContact OD1-N 2.98Å; N660-G662 VanDerWaalsContact OD1-N 3.11Å; G662-T715 WeakPolarHBondContact O-CB 3.49Å; G662-T715 WeakPolarHBondContact O-CG2 3.36Å; G662-T715 PolarHBondContact O-OG1 3.35Å
663	D	74.3	Confident	81	Confident	25 Å²	25	35.6 Å²	35.6	13%	0.134	17%	0.171	C	C	.	.	S	Bend	trans	-64.3	166.3	169	-81.8	-21.9	0	0	0	110.6	S622 M623 S627 T628 N660 A665	S622-D663 VanDerWaalsContact OG-CG 3.22Å; S622-D663 PolarHBondContact OG-OD1 3.13Å; S622-D663 PolarHBondContact OG-OD2 2.97Å; S622-D663 VanDerWaalsContact OG-OD2 3.1Å; M623-D663 PolarHBondContact N-OD2 3Å; M623-D663 VanDerWaalsContact N-OD2 3.12Å; S627-D663 PolarHBondContact O-N 2.8Å; S627-D663 VanDerWaalsContact O-N 3.16Å; T628-D663 WeakPolarHBondContact CG2-O 3.38Å; N660-D663 PolarHBondContact ND2-O 3.34Å; D663-A665 PolarHBondContact O-N 3.11Å
664	D	71.1	Confident	80.8	Confident	57 Å²	57	34.5 Å²	34.5	31%	0.305	16%	0.164	S	C	.	.			trans	-54.6	120.4	-176	-73.4	-17.3	0	0	0	112.4	F666 R714 T715 N749	D664-F666 HydrophobicContact CB-CE2 4.26Å; D664-F666 HydrophobicContact CB-CZ 4.1Å; D664-F666 WeakPolarHBondContact O-CD2 3.16Å; D664-F666 WeakPolarHBondContact O-CE2 3.43Å; D664-F666 PolarHBondContact O-N 3.35Å; D664-R714 WeakPolarHBondContact OD1-CA 3.42Å; D664-T715 PolarHBondContact OD1-N 2.96Å; D664-N749 PolarHBondContact O-ND2 3.15Å
665	A	70.5	Confident	80.6	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-83.3	114.1	178.6	0	0	0	0	0	111	T628 M630 N660 D663 W712 L713	T628-A665 HydrophobicContact CG2-CB 3.71Å; M630-A665 HydrophobicContact SD-CB 3.54Å; M630-A665 VanDerWaalsContact SD-CB 3.54Å; N660-A665 HydrophobicContact CB-CB 4.44Å; N660-A665 PolarHBondContact ND2-N 3.25Å; N660-A665 VanDerWaalsContact ND2-N 3.2Å; D663-A665 PolarHBondContact O-N 3.11Å; A665-W712 CarbonylContact O-C 3.52Å; A665-W712 VanDerWaalsContact O-CA 3.3Å; A665-W712 WeakPolarHBondContact O-CA 3.21Å; A665-L713 HydrophobicContact CB-CB 4.25Å; A665-L713 PolarHBondContact N-O 3.44Å; A665-L713 PolarHBondContact O-N 3.28Å
666	F	68.9	Low	80.2	Confident	41 Å²	41	37.5 Å²	37.5	18%	0.18	19%	0.187	C	C	.	.	S	Bend	trans	-89.3	136	178.5	-61.7	-78.2	0	0	0	110.4	D664 Y711 W712 S746 D748 N749	D664-F666 HydrophobicContact CB-CE2 4.26Å; D664-F666 HydrophobicContact CB-CZ 4.1Å; D664-F666 WeakPolarHBondContact O-CD2 3.16Å; D664-F666 WeakPolarHBondContact O-CE2 3.43Å; D664-F666 PolarHBondContact O-N 3.35Å; F666-Y711 WeakPolarHBondContact CD1-O 3.37Å; F666-W712 HydrophobicContact CD1-CB 4.09Å; F666-W712 HydrophobicContact CE1-CB 4.02Å; F666-W712 HydrophobicContact CE1-CE3 4.28Å; F666-S746 PolarHBondContact O-OG 3.25Å; F666-D748 HydrophobicContact CB-CB 3.96Å; F666-N749 WeakPolarHBondContact CB-OD1 3.41Å; F666-N749 VanDerWaalsContact CD2-OD1 3.28Å; F666-N749 WeakPolarHBondContact CD2-OD1 3.17Å; F666-N749 PolarHBondContact N-OD1 2.91Å; F666-N749 VanDerWaalsContact N-OD1 3.17Å
667	L	70.1	Confident	80	Confident	68 Å²	68	38.9 Å²	38.9	36%	0.356	19%	0.194	S	C	.	.	S	Bend	trans	44.2	59.3	-178.3	-64.9	169.6	0	0	0	112.7	R669 S747	L667-R669 PolarHBondContact O-N 3.13Å; L667-S747 VanDerWaalsContact CB-OG 3.25Å; L667-S747 WeakPolarHBondContact CB-OG 3.32Å; L667-S747 PolarHBondContact O-OG 3.04Å; L667-S747 VanDerWaalsContact O-OG 3.05Å
668	P	75.2	Confident	79.9	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	133.8	177.5	25.8	-29.7	0	0	0	109.9	M630 L658 L708 L713	M630-P668 HydrophobicContact CE-CB 3.97Å; L658-P668 HydrophobicContact CD2-CB 4.17Å; P668-L708 HydrophobicContact CB-CD1 4.31Å; P668-L708 HydrophobicContact CG-CB 4.14Å; P668-L708 HydrophobicContact CG-CD1 3.94Å; P668-L708 PolarHBondContact O-N 3.43Å; P668-L713 HydrophobicContact CG-CD1 3.98Å
669	R	79.3	Confident	80	Confident	92 Å²	92	42.5 Å²	42.5	35%	0.347	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	142.8	-178.5	-64.8	-174	-176.5	-157	3.6	110.8	L667 D705 C706 T744 S745	L667-R669 PolarHBondContact O-N 3.13Å; R669-D705 IonicContact CZ-OD2 2.95Å; R669-D705 IonicContact NE-OD2 3.71Å; R669-D705 IonicContact NH1-OD2 4Å; R669-D705 PolarHBondContact NH1-OD2 3.02Å; R669-C706 WeakPolarHBondContact CA-O 3.41Å; R669-T744 VanDerWaalsContact O-CA 3.3Å; R669-T744 WeakPolarHBondContact O-CA 3.43Å; R669-T744 PolarHBondContact O-OG1 3.44Å; R669-S745 PolarHBondContact N-O 2.92Å; R669-S745 PolarHBondContact O-N 2.81Å
670	V	85.3	Confident	80.2	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.7	169.2	179.5	0	0	0	0	107.5	T656 L658 C706 I723 I742	T656-V670 HydrophobicContact CG2-CG1 4.41Å; L658-V670 HydrophobicContact CD1-CG2 4.43Å; L658-V670 HydrophobicContact CD2-CG2 4.05Å; V670-C706 PolarHBondContact N-O 3.14Å; V670-C706 WeakPolarHBondContact O-CB 3.24Å; V670-C706 PolarHBondContact O-N 3.2Å; V670-I723 HydrophobicContact CG2-CD1 4.29Å; V670-I742 HydrophobicContact CG1-CG2 4.13Å
671	T	86.3	Confident	80.3	Confident	23 Å²	23	45.9 Å²	45.9	14%	0.141	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	129	179.2	55.6	0	0	0	0	109.6	I704 N743	T671-I704 WeakPolarHBondContact CA-O 3.19Å; T671-N743 PolarHBondContact N-O 3.06Å; T671-N743 PolarHBondContact O-N 3.37Å; T671-N743 WeakPolarHBondContact OG1-CB 3.42Å; T671-N743 PolarHBondContact OG1-O 3.11Å
672	L	87.4	Confident	80.6	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	124.4	177.6	-67.3	160.8	0	0	0	108.3	L654 F674 I704 F725 I742	L654-L672 HydrophobicContact CD2-CD2 3.45Å; L654-L672 VanDerWaalsContact CD2-CD2 3.45Å; L672-F674 HydrophobicContact CB-CD1 4.33Å; L672-F674 HydrophobicContact CB-CE1 4.12Å; L672-I704 HydrophobicContact CB-CB 4.23Å; L672-I704 HydrophobicContact CB-CD1 4.17Å; L672-I704 HydrophobicContact CD1-CD1 3.91Å; L672-I704 PolarHBondContact N-O 2.77Å; L672-I704 PolarHBondContact O-N 3.24Å; L672-I704 VanDerWaalsContact O-N 3.09Å; L672-F725 HydrophobicContact CD1-CD1 3.67Å; L672-F725 HydrophobicContact CD1-CD2 3.86Å; L672-F725 HydrophobicContact CD1-CE1 3.72Å; L672-F725 HydrophobicContact CD1-CE2 3.87Å; L672-F725 HydrophobicContact CD1-CG 3.74Å; L672-F725 HydrophobicContact CD1-CZ 3.79Å; L672-I742 HydrophobicContact CD2-CB 4.33Å; L672-I742 HydrophobicContact CD2-CD1 4.41Å; L672-I742 HydrophobicContact CD2-CG1 3.85Å; L672-I742 HydrophobicContact CD2-CG2 3.88Å
673	R	86.8	Confident	81.1	Confident	175 Å²	175	48.8 Å²	48.8	66%	0.66	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.6	175.1	-171.5	176.2	-175.4	178.9	3.3	109.7	N741	R673-N741 HydrophobicContact CB-CB 4.32Å; R673-N741 PolarHBondContact N-O 3.27Å; R673-N741 PolarHBondContact O-N 3.36Å
674	F	86.8	Confident	81.3	Confident	13 Å²	13	50.5 Å²	50.5	6%	0.057	24%	0.238	C	C	.	.			trans	-136.9	160.6	178.7	41.2	-93	0	0	0	109.5	L672 I678 H702 I704 I740	L672-F674 HydrophobicContact CB-CD1 4.33Å; L672-F674 HydrophobicContact CB-CE1 4.12Å; F674-I678 HydrophobicContact CB-CB 4.14Å; F674-I678 HydrophobicContact CB-CD1 4.34Å; F674-I678 HydrophobicContact CB-CG2 4.4Å; F674-I678 HydrophobicContact CD2-CB 3.76Å; F674-I678 HydrophobicContact CD2-CG2 3.95Å; F674-I678 WeakPolarHBondContact CD2-O 3.35Å; F674-I678 HydrophobicContact CE2-CG2 4.45Å; F674-I678 WeakPolarHBondContact CE2-O 3.35Å; F674-I678 HydrophobicContact CG-CB 4.13Å; F674-I678 HydrophobicContact CG-CG2 4.11Å; F674-H702 HydrophobicContact CD2-CB 4.05Å; F674-H702 HydrophobicContact CE2-CB 4.01Å; F674-H702 VanDerWaalsContact O-CB 3.28Å; F674-H702 WeakPolarHBondContact O-CB 3.27Å; F674-I704 HydrophobicContact CE1-CD1 3.42Å; F674-I704 VanDerWaalsContact CE1-CD1 3.42Å; F674-I704 HydrophobicContact CE1-CG1 3.73Å; F674-I704 HydrophobicContact CZ-CD1 3.64Å; F674-I704 HydrophobicContact CZ-CG1 3.72Å; F674-I740 HydrophobicContact CB-CG1 4.46Å
675	P	84.4	Confident	81.2	Confident	45 Å²	45	52.9 Å²	52.9	29%	0.292	25%	0.247	S	C	.	.			trans	-73.3	170.1	177.6	18.9	-19.2	0	0	0	112.6	N677 I678 I738	P675-N677 WeakPolarHBondContact CB-OD1 3.44Å; P675-N677 VanDerWaalsContact CG-OD1 3.24Å; P675-N677 WeakPolarHBondContact CG-OD1 3.16Å; P675-N677 PolarHBondContact O-N 3.17Å; P675-N677 PolarHBondContact O-OD1 3.05Å; P675-I678 PolarHBondContact O-N 3.1Å; P675-I738 HydrophobicContact CG-CG2 3.45Å; P675-I738 VanDerWaalsContact CG-CG2 3.45Å
676	N	81.8	Confident	80.5	Confident	120 Å²	120	59.6 Å²	59.6	64%	0.642	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-10.4	-168.6	-58.4	21.6	0	0	0	115.5	H702	N676-H702 WeakPolarHBondContact CA-CE1 3.31Å; N676-H702 WeakPolarHBondContact CA-NE2 3.38Å; N676-H702 WeakPolarHBondContact CB-NE2 3.46Å; N676-H702 VanDerWaalsContact CG-NE2 3.28Å; N676-H702 PolarHBondContact O-CE1 3.06Å; N676-H702 PolarHBondContact OD1-CD2 3.16Å
677	N	83.6	Confident	79.7	Confident	32 Å²	32	68.6 Å²	68.6	17%	0.171	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	2.6	-177.9	58.6	-11.1	0	0	0	114.1	P675 S730 S733 I738	P675-N677 WeakPolarHBondContact CB-OD1 3.44Å; P675-N677 VanDerWaalsContact CG-OD1 3.24Å; P675-N677 WeakPolarHBondContact CG-OD1 3.16Å; P675-N677 PolarHBondContact O-N 3.17Å; P675-N677 PolarHBondContact O-OD1 3.05Å; N677-S730 WeakPolarHBondContact O-CB 3.46Å; N677-S730 PolarHBondContact O-N 3.4Å; N677-S733 VanDerWaalsContact CB-OG 3.31Å; N677-S733 WeakPolarHBondContact CB-OG 3.41Å; N677-I738 WeakPolarHBondContact ND2-CD1 3.17Å
678	I	86.3	Confident	78.6	Confident	0 Å²	0	74 Å²	74	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	137	170.9	-60.2	-179.5	0	0	0	108.8	F674 P675 L727 D728 V729 I738 I740 L765	F674-I678 HydrophobicContact CB-CB 4.14Å; F674-I678 HydrophobicContact CB-CD1 4.34Å; F674-I678 HydrophobicContact CB-CG2 4.4Å; F674-I678 HydrophobicContact CD2-CB 3.76Å; F674-I678 HydrophobicContact CD2-CG2 3.95Å; F674-I678 WeakPolarHBondContact CD2-O 3.35Å; F674-I678 HydrophobicContact CE2-CG2 4.45Å; F674-I678 WeakPolarHBondContact CE2-O 3.35Å; F674-I678 HydrophobicContact CG-CB 4.13Å; F674-I678 HydrophobicContact CG-CG2 4.11Å; P675-I678 PolarHBondContact O-N 3.1Å; I678-L727 HydrophobicContact CG2-CB 3.91Å; I678-L727 HydrophobicContact CG2-CD1 4.23Å; I678-L727 HydrophobicContact CG2-CG 4.48Å; I678-D728 CarbonylContact C-O 3.57Å; I678-D728 WeakPolarHBondContact CA-O 3.49Å; I678-V729 HydrophobicContact CG1-CG2 4.46Å; I678-I738 HydrophobicContact CD1-CD1 4.48Å; I678-I738 HydrophobicContact CD1-CG2 3.77Å; I678-I740 HydrophobicContact CD1-CD1 3.92Å; I678-I740 HydrophobicContact CD1-CG1 4.04Å; I678-L765 HydrophobicContact CD1-CD2 4.19Å
679	H	85.2	Confident	77.1	Confident	82 Å²	82	82.3 Å²	82.3	38%	0.38	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	140.5	178.8	-59.5	-69.3	0	0	0	111	L727 D728	H679-L727 CarbonylContact O-C 3.55Å; H679-L727 VanDerWaalsContact O-CA 3.31Å; H679-L727 WeakPolarHBondContact O-CA 3.36Å; H679-D728 HydrophobicContact CB-CB 4.44Å; H679-D728 PolarHBondContact N-O 3.46Å; H679-D728 PolarHBondContact O-N 3.5Å
680	Y	86.6	Confident	75.6	Confident	59 Å²	59	85.6 Å²	85.6	23%	0.231	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	136	172.2	178.8	-118.7	0	0	0	111.1	V683 V698 I704 F725 L727	Y680-V683 VanDerWaalsContact OH-CG2 3.22Å; Y680-V683 WeakPolarHBondContact OH-CG2 2.91Å; Y680-V683 PolarHBondContact OH-N 3.42Å; Y680-V683 VanDerWaalsContact OH-N 3.13Å; Y680-V698 HydrophobicContact CD1-CG2 4.01Å; Y680-I704 VanDerWaalsContact CB-CD1 3.5Å; Y680-I704 HydrophobicContact CD1-CD1 4.25Å; Y680-I704 HydrophobicContact CD2-CD1 3.31Å; Y680-I704 HydrophobicContact CD2-CG1 4.43Å; Y680-I704 HydrophobicContact CE2-CD1 4.05Å; Y680-I704 HydrophobicContact CG-CD1 3.4Å; Y680-I704 VanDerWaalsContact CG-CD1 3.4Å; Y680-I704 HydrophobicContact CG-CG1 4.12Å; Y680-F725 HydrophobicContact CE2-CD1 4.21Å; Y680-L727 HydrophobicContact CD2-CD2 4.06Å
681	I	84.1	Confident	73.6	Confident	67 Å²	67	90.5 Å²	90.5	34%	0.344	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	-64.1	171.8	-58.6	165.5	0	0	0	110.8	Q651 L726 D728	Q651-I681 HydrophobicContact CB-CD1 4.49Å; Q651-I681 VanDerWaalsContact CD-CD1 3.4Å; Q651-I681 HydrophobicContact CG-CD1 3.58Å; I681-L726 HydrophobicContact CB-CB 4.43Å; I681-L726 HydrophobicContact CB-CD2 4.26Å; I681-L726 HydrophobicContact CB-CG 4.3Å; I681-L726 WeakPolarHBondContact CB-O 3.25Å; I681-L726 HydrophobicContact CD1-CD2 4.08Å; I681-L726 HydrophobicContact CD1-CG 3.93Å; I681-L726 HydrophobicContact CG2-CD2 4.13Å; I681-L726 PolarHBondContact N-O 3.19Å; I681-D728 HydrophobicContact CD1-CB 3.74Å; I681-D728 HydrophobicContact CG1-CB 4.08Å
682	K	84.1	Confident	72	Confident	111 Å²	111	92 Å²	92	48%	0.483	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	164.7	-175.6	65.1	-177.3	178.6	178.6	0	112.8	L684 L726	K682-L684 HydrophobicContact CG-CD2 4.48Å; K682-L726 HydrophobicContact CG-CB 4.26Å; K682-L726 HydrophobicContact CG-CD2 4.19Å; K682-L726 PolarHBondContact N-O 3.34Å; K682-L726 WeakPolarHBondContact O-CB 3.22Å; K682-L726 PolarHBondContact O-N 3.06Å
683	V	84.4	Confident	70.8	Confident	13 Å²	13	96.7 Å²	96.7	8%	0.079	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	131.3	162.6	-174.9	0	0	0	0	110.3	Y680 H685 C696 I723 S724 F725	Y680-V683 VanDerWaalsContact OH-CG2 3.22Å; Y680-V683 WeakPolarHBondContact OH-CG2 2.91Å; Y680-V683 PolarHBondContact OH-N 3.42Å; Y680-V683 VanDerWaalsContact OH-N 3.13Å; V683-H685 PolarHBondContact O-ND1 3.39Å; V683-C696 HydrophobicContact CG2-CB 4.32Å; V683-C696 WeakPolarHBondContact CG2-SG 3.36Å; V683-I723 HydrophobicContact CG1-CG2 3.76Å; V683-S724 CarbonylContact C-O 3.57Å; V683-S724 WeakPolarHBondContact CA-O 3.45Å; V683-F725 HydrophobicContact CG2-CD1 3.87Å; V683-F725 HydrophobicContact CG2-CE1 3.88Å
684	L	79.4	Confident	70	Confident	62 Å²	62	89.5 Å²	89.5	33%	0.325	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	116.5	172.3	-58.6	176.5	0	0	0	109.1	V653 K682 S724 L726	V653-L684 HydrophobicContact CG1-CD1 4.18Å; V653-L684 HydrophobicContact CG2-CD1 4.31Å; K682-L684 HydrophobicContact CG-CD2 4.48Å; L684-S724 PolarHBondContact N-O 3.17Å; L684-L726 HydrophobicContact CD2-CB 4.38Å; L684-L726 HydrophobicContact CD2-CD2 4.44Å; L684-L726 HydrophobicContact CG-CB 4.33Å
685	H	67.9	Low	69.4	Low	107 Å²	107	91.9 Å²	91.9	50%	0.495	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-91.8	125.6	177	-67.8	74.9	0	0	0	109.7	V683 Y687	V683-H685 PolarHBondContact O-ND1 3.39Å; H685-Y687 PolarHBondContact O-N 3.13Å
686	N	57.2	Low	68.9	Low	140 Å²	140	91 Å²	91	75%	0.749	46%	0.462	S	S	*	.			trans	-80.2	115	168.8	-79.5	-9.5	0	0	0	108.4	E688	N686-E688 PolarHBondContact O-N 3.1Å
687	Y	51.7	Low	68.5	Low	230 Å²	230	90.3 Å²	90.3	90%	0.902	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-3.7	-170.2	-108.6	-91.8	0	0	0	115.5	H685	H685-Y687 PolarHBondContact O-N 3.13Å
688	E	47.3	Very low	67.9	Low	183 Å²	183	93 Å²	93	86%	0.855	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	-15.2	-165	-71.6	-170.8	160	0	0	116.8	N686	N686-E688 PolarHBondContact O-N 3.1Å
689	Q	44.1	Very low	66.9	Low	173 Å²	173	96.5 Å²	96.5	81%	0.808	50%	0.497	S	S	*	.	S	Bend	trans	-148	125.2	176.6	-69	-174.3	-18.7	0	0	113.9
690	E	47.5	Very low	65.9	Low	162 Å²	162	99.1 Å²	99.1	76%	0.757	51%	0.509	S	S	*	.			trans	82.1	103.2	157.4	-62	-177.9	176.2	0	0	121.1	N692	E690-N692 PolarHBondContact O-N 2.66Å
691	A	43.3	Very low	64.5	Low	102 Å²	102	104.6 Å²	104.6	84%	0.843	54%	0.537	S	S	*	.				32.8	-2.4	124	0	0	0	0	0	124.3
692	N	52.7	Low	63.6	Low	54 Å²	54	103 Å²	103	29%	0.289	53%	0.528	S	S	.	.			trans	-111.3	103.7	-178.5	-65.1	-19.5	0	0	0	109.8	E690 I694 A710	E690-N692 PolarHBondContact O-N 2.66Å; N692-I694 PolarHBondContact O-N 3.21Å; N692-A710 WeakPolarHBondContact OD1-CB 3.2Å
693	V	62.2	Low	63.2	Low	100 Å²	100	100.2 Å²	100.2	61%	0.606	52%	0.517	S	S	*	.			trans	-74.5	112	174.1	-177.7	0	0	0	0	107.6	S709	V693-S709 WeakPolarHBondContact CA-OG 3.03Å; V693-S709 WeakPolarHBondContact CB-OG 3.44Å; V693-S709 PolarHBondContact N-OG 3.4Å; V693-S709 WeakPolarHBondContact O-CB 3.01Å; V693-S709 PolarHBondContact O-N 2.82Å; V693-S709 PolarHBondContact O-OG 3.41Å
694	I	70.6	Confident	62.9	Low	25 Å²	25	99.6 Å²	99.6	13%	0.128	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	119.5	177.3	-50.3	-171.5	0	0	0	107.4	N692 L708 I723	N692-I694 PolarHBondContact O-N 3.21Å; I694-L708 HydrophobicContact CB-CD2 4.49Å; I694-L708 HydrophobicContact CD1-CD2 3.87Å; I694-L708 HydrophobicContact CG1-CD2 3.77Å; I694-L708 HydrophobicContact CG2-CD2 4.23Å; I694-I723 HydrophobicContact CD1-CB 4.32Å; I694-I723 HydrophobicContact CD1-CD1 4.16Å; I694-I723 HydrophobicContact CD1-CG1 3.8Å; I694-I723 HydrophobicContact CD1-CG2 3.9Å
695	S	72.2	Confident	62.7	Low	62 Å²	62	98 Å²	98	43%	0.434	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	123	175.6	-165.9	0	0	0	0	109	C706 A707	S695-C706 CarbonylContact O-C 3.57Å; S695-C706 WeakPolarHBondContact O-CA 3.44Å; S695-A707 PolarHBondContact N-O 2.78Å; S695-A707 PolarHBondContact O-N 2.94Å
696	C	75.4	Confident	63	Low	26 Å²	26	92.9 Å²	92.9	18%	0.176	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	123.7	178.7	-70.2	0	0	0	0	109.8	V683 I704 C706	V683-C696 HydrophobicContact CG2-CB 4.32Å; V683-C696 WeakPolarHBondContact CG2-SG 3.36Å; C696-I704 HydrophobicContact CB-CG2 4.31Å; C696-C706 HydrophobicContact CB-CB 4.12Å; C696-C706 WeakPolarHBondContact CB-SG 3.47Å; C696-C706 WeakPolarHBondContact SG-CB 3.33Å; C696-C706 CovalentContact SG-SG 2.04Å; C696-C706 PolarHBondContact SG-SG 3.07Å
697	D	73.3	Confident	63.6	Low	107 Å²	107	87.9 Å²	87.9	57%	0.572	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.5	141.6	174.6	-71.3	-35.6	0	0	0	109.7	D705	D697-D705 PolarHBondContact N-O 3.08Å; D697-D705 PolarHBondContact O-N 2.99Å; D697-D705 VanDerWaalsContact O-O 3.12Å
698	V	71.5	Confident	64.4	Low	89 Å²	89	77.1 Å²	77.1	54%	0.539	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	112.7	173.5	-176.7	0	0	0	0	106.9	Y680 E700	Y680-V698 HydrophobicContact CD1-CG2 4.01Å; V698-E700 WeakPolarHBondContact CG1-O 3.45Å
699	T	63.5	Low	64.7	Low	72 Å²	72	70.7 Å²	70.7	44%	0.442	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-35.9	-172.4	50.3	0	0	0	0	112.5	H703 D705	T699-H703 PolarHBondContact N-O 2.9Å; T699-H703 PolarHBondContact OG1-ND1 3.08Å; T699-H703 PolarHBondContact OG1-O 3.38Å; T699-D705 HydrophobicContact CG2-CB 3.75Å
700	E	64.6	Low	65.2	Low	137 Å²	137	63.3 Å²	63.3	64%	0.64	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.8	163.2	171.9	-60.2	179.3	170.2	0	0	109	V698 H702 H703	V698-E700 WeakPolarHBondContact CG1-O 3.45Å; E700-H702 PolarHBondContact O-N 2.86Å; E700-H703 HydrophobicContact CB-CB 3.95Å; E700-H703 PolarHBondContact N-O 2.66Å; E700-H703 PolarHBondContact O-N 2.96Å
701	E	57	Low	65.3	Low	175 Å²	175	63.6 Å²	63.6	82%	0.818	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	112.8	170.2	-71.7	-174.4	165.8	0	0	108.3
702	H	64.9	Low	66	Low	34 Å²	34	64.2 Å²	64.2	16%	0.157	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	15.4	-177.6	-34.5	-65.7	0	0	0	117.2	F674 N676 E700	F674-H702 HydrophobicContact CD2-CB 4.05Å; F674-H702 HydrophobicContact CE2-CB 4.01Å; F674-H702 VanDerWaalsContact O-CB 3.28Å; F674-H702 WeakPolarHBondContact O-CB 3.27Å; N676-H702 WeakPolarHBondContact CA-CE1 3.31Å; N676-H702 WeakPolarHBondContact CA-NE2 3.38Å; N676-H702 WeakPolarHBondContact CB-NE2 3.46Å; N676-H702 VanDerWaalsContact CG-NE2 3.28Å; N676-H702 PolarHBondContact O-CE1 3.06Å; N676-H702 PolarHBondContact OD1-CD2 3.16Å; E700-H702 PolarHBondContact O-N 2.86Å
703	H	77.1	Confident	66.3	Low	52 Å²	52	61.9 Å²	61.9	24%	0.241	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	115.2	171	-170.7	-130	0	0	0	111.1	T699 E700	T699-H703 PolarHBondContact N-O 2.9Å; T699-H703 PolarHBondContact OG1-ND1 3.08Å; T699-H703 PolarHBondContact OG1-O 3.38Å; E700-H703 HydrophobicContact CB-CB 3.95Å; E700-H703 PolarHBondContact N-O 2.66Å; E700-H703 PolarHBondContact O-N 2.96Å
704	I	78.6	Confident	66.1	Low	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	129.8	176.3	-45.8	165.9	0	0	0	108.5	T671 L672 F674 Y680 C696	T671-I704 WeakPolarHBondContact CA-O 3.19Å; L672-I704 HydrophobicContact CB-CB 4.23Å; L672-I704 HydrophobicContact CB-CD1 4.17Å; L672-I704 HydrophobicContact CD1-CD1 3.91Å; L672-I704 PolarHBondContact N-O 2.77Å; L672-I704 PolarHBondContact O-N 3.24Å; L672-I704 VanDerWaalsContact O-N 3.09Å; F674-I704 HydrophobicContact CE1-CD1 3.42Å; F674-I704 VanDerWaalsContact CE1-CD1 3.42Å; F674-I704 HydrophobicContact CE1-CG1 3.73Å; F674-I704 HydrophobicContact CZ-CD1 3.64Å; F674-I704 HydrophobicContact CZ-CG1 3.72Å; Y680-I704 VanDerWaalsContact CB-CD1 3.5Å; Y680-I704 HydrophobicContact CD1-CD1 4.25Å; Y680-I704 HydrophobicContact CD2-CD1 3.31Å; Y680-I704 HydrophobicContact CD2-CG1 4.43Å; Y680-I704 HydrophobicContact CE2-CD1 4.05Å; Y680-I704 HydrophobicContact CG-CD1 3.4Å; Y680-I704 VanDerWaalsContact CG-CD1 3.4Å; Y680-I704 HydrophobicContact CG-CG1 4.12Å; C696-I704 HydrophobicContact CB-CG2 4.31Å
705	D	74.8	Confident	65.4	Low	27 Å²	27	65.2 Å²	65.2	14%	0.144	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	115.8	168.9	-168	2.7	0	0	0	109.1	R669 D697 T699	R669-D705 IonicContact CZ-OD2 2.95Å; R669-D705 IonicContact NE-OD2 3.71Å; R669-D705 IonicContact NH1-OD2 4Å; R669-D705 PolarHBondContact NH1-OD2 3.02Å; D697-D705 PolarHBondContact N-O 3.08Å; D697-D705 PolarHBondContact O-N 2.99Å; D697-D705 VanDerWaalsContact O-O 3.12Å; T699-D705 HydrophobicContact CG2-CB 3.75Å
706	C	73.9	Confident	64.4	Low	1 Å²	1	66.2 Å²	66.2	1%	0.007	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	114	178.9	-70.9	0	0	0	0	110.5	R669 V670 S695 C696 F725	R669-C706 WeakPolarHBondContact CA-O 3.41Å; V670-C706 PolarHBondContact N-O 3.14Å; V670-C706 WeakPolarHBondContact O-CB 3.24Å; V670-C706 PolarHBondContact O-N 3.2Å; S695-C706 CarbonylContact O-C 3.57Å; S695-C706 WeakPolarHBondContact O-CA 3.44Å; C696-C706 HydrophobicContact CB-CB 4.12Å; C696-C706 WeakPolarHBondContact CB-SG 3.47Å; C696-C706 WeakPolarHBondContact SG-CB 3.33Å; C696-C706 CovalentContact SG-SG 2.04Å; C696-C706 PolarHBondContact SG-SG 3.07Å; C706-F725 HydrophobicContact CB-CE1 4.5Å; C706-F725 VanDerWaalsContact SG-CE1 3.55Å
707	A	68.6	Low	63.1	Low	35 Å²	35	72.1 Å²	72.1	29%	0.289	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	128.6	173.1	0	0	0	0	0	110.8	S695	S695-A707 PolarHBondContact N-O 2.78Å; S695-A707 PolarHBondContact O-N 2.94Å
708	L	68.4	Low	62.1	Low	3 Å²	3	72.4 Å²	72.4	2%	0.016	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	123.8	171.2	-69.7	163.2	0	0	0	109.1	L658 P668 I694 A710 L713 V721 I723	L658-L708 HydrophobicContact CD2-CD1 3.53Å; P668-L708 HydrophobicContact CB-CD1 4.31Å; P668-L708 HydrophobicContact CG-CB 4.14Å; P668-L708 HydrophobicContact CG-CD1 3.94Å; P668-L708 PolarHBondContact O-N 3.43Å; I694-L708 HydrophobicContact CB-CD2 4.49Å; I694-L708 HydrophobicContact CD1-CD2 3.87Å; I694-L708 HydrophobicContact CG1-CD2 3.77Å; I694-L708 HydrophobicContact CG2-CD2 4.23Å; L708-A710 PolarHBondContact O-N 2.92Å; L708-L713 HydrophobicContact CD1-CD1 4.34Å; L708-V721 HydrophobicContact CD1-CG1 4.49Å; L708-V721 HydrophobicContact CD2-CG1 3.87Å; L708-I723 HydrophobicContact CD2-CD1 3.98Å
709	S	55.3	Low	61.8	Low	48 Å²	48	70.2 Å²	70.2	34%	0.336	36%	0.363	S	S	.	.			trans	-74.9	-2.3	-179.5	81.7	0	0	0	0	114.3	V693 Y711	V693-S709 WeakPolarHBondContact CA-OG 3.03Å; V693-S709 WeakPolarHBondContact CB-OG 3.44Å; V693-S709 PolarHBondContact N-OG 3.4Å; V693-S709 WeakPolarHBondContact O-CB 3.01Å; V693-S709 PolarHBondContact O-N 2.82Å; V693-S709 PolarHBondContact O-OG 3.41Å; S709-Y711 PolarHBondContact O-N 3.47Å; S709-Y711 VanDerWaalsContact O-N 3.08Å
710	A	53.1	Low	62.2	Low	19 Å²	19	72.6 Å²	72.6	16%	0.157	37%	0.367	C	S	.	.	S	Bend	trans	-66.8	107.6	169.5	0	0	0	0	0	106.6	N692 L708 W712	N692-A710 WeakPolarHBondContact OD1-CB 3.2Å; L708-A710 PolarHBondContact O-N 2.92Å; A710-W712 PolarHBondContact O-N 2.65Å
711	Y	51.1	Low	62.9	Low	167 Å²	167	66.9 Å²	66.9	66%	0.655	34%	0.341	S	S	*	.	S	Bend	trans	-55.8	-8.3	-174.2	-70.6	-88.7	0	0	0	114.5	F666 S709	F666-Y711 WeakPolarHBondContact CD1-O 3.37Å; S709-Y711 PolarHBondContact O-N 3.47Å; S709-Y711 VanDerWaalsContact O-N 3.08Å
712	W	56.8	Low	64.1	Low	115 Å²	115	63.7 Å²	63.7	44%	0.436	33%	0.33	S	S	.	.			trans	-160.8	153.5	170	47.9	64.5	0	0	0	110.2	A665 F666 A710 R714	A665-W712 CarbonylContact O-C 3.52Å; A665-W712 VanDerWaalsContact O-CA 3.3Å; A665-W712 WeakPolarHBondContact O-CA 3.21Å; F666-W712 HydrophobicContact CD1-CB 4.09Å; F666-W712 HydrophobicContact CE1-CB 4.02Å; F666-W712 HydrophobicContact CE1-CE3 4.28Å; A710-W712 PolarHBondContact O-N 2.65Å; W712-R714 VanDerWaalsContact CD1-CG 3.44Å; W712-R714 HydrophobicContact CG-CG 4.41Å; W712-R714 VanDerWaalsContact NE1-NE 3.19Å
713	L	59.6	Low	65	Low	6 Å²	6	62.2 Å²	62.2	3%	0.031	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-103	103.7	165.2	-136.6	119.3	0	0	0	108.5	N660 A665 P668 L708 S719 V721	N660-L713 HydrophobicContact CB-CB 4.14Å; N660-L713 HydrophobicContact CB-CD2 3.48Å; N660-L713 VanDerWaalsContact CB-CD2 3.48Å; N660-L713 HydrophobicContact CB-CG 4.42Å; N660-L713 PolarHBondContact ND2-O 2.68Å; A665-L713 HydrophobicContact CB-CB 4.25Å; A665-L713 PolarHBondContact N-O 3.44Å; A665-L713 PolarHBondContact O-N 3.28Å; P668-L713 HydrophobicContact CG-CD1 3.98Å; L708-L713 HydrophobicContact CD1-CD1 4.34Å; L713-S719 WeakPolarHBondContact CD2-O 3.46Å; L713-V721 HydrophobicContact CD1-CG2 3.95Å
714	R	58.7	Low	65.5	Low	131 Å²	131	60.8 Å²	60.8	49%	0.494	32%	0.319	S	S	.	.			trans	-72.9	137	-171.9	-71.1	-168.3	-176.3	174	0.9	112.6	D664 W712 S716 S719	D664-R714 WeakPolarHBondContact OD1-CA 3.42Å; W712-R714 VanDerWaalsContact CD1-CG 3.44Å; W712-R714 HydrophobicContact CG-CG 4.41Å; W712-R714 VanDerWaalsContact NE1-NE 3.19Å; R714-S716 PolarHBondContact O-N 3.22Å; R714-S719 PolarHBondContact O-OG 3.36Å; R714-S719 VanDerWaalsContact O-OG 3.05Å
715	T	54.4	Low	65.9	Low	64 Å²	64	60.8 Å²	60.8	39%	0.393	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-21.3	173.3	-32.7	0	0	0	0	113.4	G662 D664 H717	G662-T715 WeakPolarHBondContact O-CB 3.49Å; G662-T715 WeakPolarHBondContact O-CG2 3.36Å; G662-T715 PolarHBondContact O-OG1 3.35Å; D664-T715 PolarHBondContact OD1-N 2.96Å; T715-H717 VanDerWaalsContact C-N 3.34Å; T715-H717 PolarHBondContact O-N 3.48Å
716	S	51.4	Low	66.6	Low	82 Å²	82	60.4 Å²	60.4	57%	0.573	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-7.5	-163.4	68.5	0	0	0	0	116.3	R714	R714-S716 PolarHBondContact O-N 3.22Å
717	H	49.3	Very low	67.3	Low	151 Å²	151	60.4 Å²	60.4	70%	0.699	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.5	141.6	166.6	-68.9	-77.4	0	0	0	106.4	T715 S719	T715-H717 VanDerWaalsContact C-N 3.34Å; T715-H717 PolarHBondContact O-N 3.48Å; H717-S719 WeakPolarHBondContact O-CB 3.37Å; H717-S719 PolarHBondContact O-N 2.8Å; H717-S719 PolarHBondContact O-OG 2.91Å
718	S	52.5	Low	68.2	Low	112 Å²	112	61.3 Å²	61.3	78%	0.783	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	70.8	175.3	54.3	0	0	0	0	112.8	K720	S718-K720 PolarHBondContact O-N 3.34Å
719	S	63.7	Low	69.1	Low	44 Å²	44	61.3 Å²	61.3	31%	0.308	32%	0.317	S	S	.	.			trans	-85.2	73.4	-170.1	38.4	0	0	0	0	107.8	L713 R714 H717 V721	L713-S719 WeakPolarHBondContact CD2-O 3.46Å; R714-S719 PolarHBondContact O-OG 3.36Å; R714-S719 VanDerWaalsContact O-OG 3.05Å; H717-S719 WeakPolarHBondContact O-CB 3.37Å; H717-S719 PolarHBondContact O-N 2.8Å; H717-S719 PolarHBondContact O-OG 2.91Å; S719-V721 PolarHBondContact O-N 2.99Å
720	K	73.1	Confident	70.4	Confident	122 Å²	122	60.5 Å²	60.5	53%	0.53	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-71.5	117.3	175.3	-174.7	-177.1	-176.8	-179.9	0	109	S657 L658 S718 N722	S657-K720 WeakPolarHBondContact OG-CE 3.36Å; S657-K720 WeakPolarHBondContact OG-CG 3.34Å; L658-K720 WeakPolarHBondContact O-CA 3.39Å; S718-K720 PolarHBondContact O-N 3.34Å; K720-N722 WeakPolarHBondContact CE-OD1 3.21Å
721	V	78.4	Confident	71.3	Confident	17 Å²	17	67 Å²	67	10%	0.103	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	120	175.5	-179.7	0	0	0	0	109.2	S657 L658 L708 L713 S719 I723	S657-V721 CarbonylContact C-O 3.4Å; S657-V721 VanDerWaalsContact CA-O 3.28Å; S657-V721 WeakPolarHBondContact CA-O 3.29Å; L658-V721 PolarHBondContact N-O 3.11Å; L658-V721 PolarHBondContact O-N 3.48Å; L708-V721 HydrophobicContact CD1-CG1 4.49Å; L708-V721 HydrophobicContact CD2-CG1 3.87Å; L713-V721 HydrophobicContact CD1-CG2 3.95Å; S719-V721 PolarHBondContact O-N 2.99Å; V721-I723 HydrophobicContact CG1-CG1 4.11Å
722	N	81.9	Confident	72.3	Confident	108 Å²	108	66.4 Å²	66.4	58%	0.578	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	128.5	175.9	-59.5	-48.9	0	0	0	110.3	T656 S657 K720	T656-N722 CarbonylContact O-C 3.25Å; T656-N722 WeakPolarHBondContact O-CA 3.4Å; S657-N722 WeakPolarHBondContact CB-OD1 3.44Å; K720-N722 WeakPolarHBondContact CE-OD1 3.21Å
723	I	83.7	Confident	73.1	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.01	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	133.4	-178.6	-42.7	179.8	0	0	0	108.2	T656 V670 V683 I694 L708 V721 F725	T656-I723 PolarHBondContact N-O 3.36Å; T656-I723 PolarHBondContact O-N 2.97Å; T656-I723 VanDerWaalsContact O-O 3.1Å; V670-I723 HydrophobicContact CG2-CD1 4.29Å; V683-I723 HydrophobicContact CG1-CG2 3.76Å; I694-I723 HydrophobicContact CD1-CB 4.32Å; I694-I723 HydrophobicContact CD1-CD1 4.16Å; I694-I723 HydrophobicContact CD1-CG1 3.8Å; I694-I723 HydrophobicContact CD1-CG2 3.9Å; L708-I723 HydrophobicContact CD2-CD1 3.98Å; V721-I723 HydrophobicContact CG1-CG1 4.11Å; I723-F725 HydrophobicContact CB-CE2 3.99Å; I723-F725 HydrophobicContact CB-CZ 3.96Å; I723-F725 HydrophobicContact CD1-CZ 4.38Å; I723-F725 HydrophobicContact CG2-CD1 4.33Å; I723-F725 HydrophobicContact CG2-CD2 4.37Å; I723-F725 HydrophobicContact CG2-CE1 3.64Å; I723-F725 HydrophobicContact CG2-CE2 3.72Å; I723-F725 HydrophobicContact CG2-CZ 3.32Å
724	S	87.8	Confident	74	Confident	23 Å²	23	66.5 Å²	66.5	16%	0.161	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	117.3	176.9	-66.5	0	0	0	0	110.1	L654 V683 L684	L654-S724 CarbonylContact O-C 3.51Å; L654-S724 WeakPolarHBondContact O-CA 3.31Å; V683-S724 CarbonylContact C-O 3.57Å; V683-S724 WeakPolarHBondContact CA-O 3.45Å; L684-S724 PolarHBondContact N-O 3.17Å
725	F	88	Confident	75	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	132.2	179.8	-54.3	-81.4	0	0	0	110.5	V653 L654 L672 Y680 V683 C706 I723 L727	V653-F725 CarbonylContact C-O 3.11Å; V653-F725 WeakPolarHBondContact CA-O 3.49Å; L654-F725 HydrophobicContact CB-CB 4.25Å; L654-F725 HydrophobicContact CD2-CD2 4.11Å; L654-F725 HydrophobicContact CG-CD2 4.23Å; L654-F725 PolarHBondContact N-O 3.35Å; L654-F725 PolarHBondContact O-N 3.03Å; L672-F725 HydrophobicContact CD1-CD1 3.67Å; L672-F725 HydrophobicContact CD1-CD2 3.86Å; L672-F725 HydrophobicContact CD1-CE1 3.72Å; L672-F725 HydrophobicContact CD1-CE2 3.87Å; L672-F725 HydrophobicContact CD1-CG 3.74Å; L672-F725 HydrophobicContact CD1-CZ 3.79Å; Y680-F725 HydrophobicContact CE2-CD1 4.21Å; V683-F725 HydrophobicContact CG2-CD1 3.87Å; V683-F725 HydrophobicContact CG2-CE1 3.88Å; C706-F725 HydrophobicContact CB-CE1 4.5Å; C706-F725 VanDerWaalsContact SG-CE1 3.55Å; I723-F725 HydrophobicContact CB-CE2 3.99Å; I723-F725 HydrophobicContact CB-CZ 3.96Å; I723-F725 HydrophobicContact CD1-CZ 4.38Å; I723-F725 HydrophobicContact CG2-CD1 4.33Å; I723-F725 HydrophobicContact CG2-CD2 4.37Å; I723-F725 HydrophobicContact CG2-CE1 3.64Å; I723-F725 HydrophobicContact CG2-CE2 3.72Å; I723-F725 HydrophobicContact CG2-CZ 3.32Å; F725-L727 HydrophobicContact CB-CD2 4.49Å
726	L	88.6	Confident	76.4	Confident	18 Å²	18	62.1 Å²	62.1	9%	0.094	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	119.8	171	-172.5	67.7	0	0	0	108.8	Q651 V653 I681 K682 L684	Q651-L726 HydrophobicContact CB-CD1 3.98Å; V653-L726 HydrophobicContact CG2-CD1 3.85Å; I681-L726 HydrophobicContact CB-CB 4.43Å; I681-L726 HydrophobicContact CB-CD2 4.26Å; I681-L726 HydrophobicContact CB-CG 4.3Å; I681-L726 WeakPolarHBondContact CB-O 3.25Å; I681-L726 HydrophobicContact CD1-CD2 4.08Å; I681-L726 HydrophobicContact CD1-CG 3.93Å; I681-L726 HydrophobicContact CG2-CD2 4.13Å; I681-L726 PolarHBondContact N-O 3.19Å; K682-L726 HydrophobicContact CG-CB 4.26Å; K682-L726 HydrophobicContact CG-CD2 4.19Å; K682-L726 PolarHBondContact N-O 3.34Å; K682-L726 WeakPolarHBondContact O-CB 3.22Å; K682-L726 PolarHBondContact O-N 3.06Å; L684-L726 HydrophobicContact CD2-CB 4.38Å; L684-L726 HydrophobicContact CD2-CD2 4.44Å; L684-L726 HydrophobicContact CG-CB 4.33Å
727	L	89.1	Confident	78	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.005	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	148.4	-178.9	-52.2	173	0	0	0	109.5	Q651 I652 L654 I678 H679 Y680 F725	Q651-L727 CarbonylContact C-O 3.5Å; Q651-L727 WeakPolarHBondContact CA-O 3.21Å; Q651-L727 WeakPolarHBondContact CB-O 3.42Å; I652-L727 HydrophobicContact CD1-CB 4.25Å; I652-L727 HydrophobicContact CD1-CD1 4.37Å; I652-L727 HydrophobicContact CG1-CB 3.74Å; I652-L727 HydrophobicContact CG1-CD1 4.43Å; I652-L727 PolarHBondContact N-O 3.37Å; I652-L727 PolarHBondContact O-N 3.04Å; L654-L727 HydrophobicContact CB-CD1 4.23Å; L654-L727 HydrophobicContact CD2-CD1 4.45Å; I678-L727 HydrophobicContact CG2-CB 3.91Å; I678-L727 HydrophobicContact CG2-CD1 4.23Å; I678-L727 HydrophobicContact CG2-CG 4.48Å; H679-L727 CarbonylContact O-C 3.55Å; H679-L727 VanDerWaalsContact O-CA 3.31Å; H679-L727 WeakPolarHBondContact O-CA 3.36Å; Y680-L727 HydrophobicContact CD2-CD2 4.06Å; F725-L727 HydrophobicContact CB-CD2 4.49Å
728	D	87.4	Confident	79.8	Confident	55 Å²	55	56.8 Å²	56.8	29%	0.294	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	138.2	175.3	-161.7	32.9	0	0	0	110.4	G650 Q651 I678 H679 I681	G650-D728 VanDerWaalsContact C-OD1 3.24Å; Q651-D728 HydrophobicContact CG-CB 4.45Å; I678-D728 CarbonylContact C-O 3.57Å; I678-D728 WeakPolarHBondContact CA-O 3.49Å; H679-D728 HydrophobicContact CB-CB 4.44Å; H679-D728 PolarHBondContact N-O 3.46Å; H679-D728 PolarHBondContact O-N 3.5Å; I681-D728 HydrophobicContact CD1-CB 3.74Å; I681-D728 HydrophobicContact CG1-CB 4.08Å
729	V	86.6	Confident	81.5	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.012	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	124.1	179.3	-176.3	0	0	0	0	109.3	F645 G650 I652 I678 L765 L767	F645-V729 HydrophobicContact CD1-CB 4.25Å; F645-V729 HydrophobicContact CD1-CG1 4.2Å; F645-V729 HydrophobicContact CD1-CG2 4.2Å; F645-V729 HydrophobicContact CE1-CB 3.52Å; F645-V729 HydrophobicContact CE1-CG1 3.81Å; F645-V729 HydrophobicContact CE1-CG2 3.77Å; F645-V729 HydrophobicContact CE2-CG2 4.45Å; F645-V729 HydrophobicContact CZ-CB 3.89Å; F645-V729 HydrophobicContact CZ-CG2 3.91Å; G650-V729 PolarHBondContact O-N 3.31Å; I652-V729 HydrophobicContact CD1-CG2 3.97Å; I652-V729 HydrophobicContact CG1-CG2 4.43Å; I652-V729 HydrophobicContact CG2-CG2 4.24Å; I678-V729 HydrophobicContact CG1-CG2 4.46Å; V729-L765 HydrophobicContact CG2-CD2 4.16Å; V729-L767 HydrophobicContact CG1-CD2 3.87Å
730	S	82.4	Confident	82.6	Confident	32 Å²	32	54.5 Å²	54.5	22%	0.224	30%	0.299	C	S	.	.			trans	-58.7	138.9	-177.8	179.7	0	0	0	0	112.1	N677 N732 S733	N677-S730 WeakPolarHBondContact O-CB 3.46Å; N677-S730 PolarHBondContact O-N 3.4Å; S730-N732 PolarHBondContact O-N 2.91Å; S730-N732 PolarHBondContact OG-N 2.69Å; S730-S733 WeakPolarHBondContact O-CB 3.48Å; S730-S733 PolarHBondContact O-N 3.27Å; S730-S733 PolarHBondContact O-OG 3.3Å
731	Q	72.5	Confident	83.4	Confident	154 Å²	154	52 Å²	52	72%	0.72	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-23.7	180	-58.6	-171.9	-0.4	0	0	113	S733	Q731-S733 VanDerWaalsContact C-N 3.28Å; Q731-S733 PolarHBondContact O-N 3.31Å
732	N	71.7	Confident	83.9	Confident	156 Å²	156	51.3 Å²	51.3	83%	0.834	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	7.4	-179.6	-73.3	-12.3	0	0	0	113.6	S730	S730-N732 PolarHBondContact O-N 2.91Å; S730-N732 PolarHBondContact OG-N 2.69Å
733	S	75.2	Confident	84.1	Confident	12 Å²	12	49 Å²	49	8%	0.084	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-66.8	146.7	-177.9	-52.2	0	0	0	0	112.8	L647 N677 S730 Q731	L647-S733 WeakPolarHBondContact CD2-O 3.26Å; N677-S733 VanDerWaalsContact CB-OG 3.31Å; N677-S733 WeakPolarHBondContact CB-OG 3.41Å; S730-S733 WeakPolarHBondContact O-CB 3.48Å; S730-S733 PolarHBondContact O-N 3.27Å; S730-S733 PolarHBondContact O-OG 3.3Å; Q731-S733 VanDerWaalsContact C-N 3.28Å; Q731-S733 PolarHBondContact O-N 3.31Å
734	T	78.6	Confident	84.2	Confident	111 Å²	111	49 Å²	49	68%	0.681	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-80.5	144.2	171.1	52.1	0	0	0	0	111.4
735	P	79.6	Confident	83.7	Confident	69 Å²	69	50 Å²	50	45%	0.448	28%	0.282	S	S	.	.	S	Bend	trans	-64.7	137.7	173.4	29.4	-36.7	0	0	0	110.9	L647 H769	L647-P735 HydrophobicContact CD1-CB 4.34Å; P735-H769 WeakPolarHBondContact CG-NE2 3.44Å
736	G	83.1	Confident	82.8	Confident	34 Å²	34	50.7 Å²	50.7	35%	0.351	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	160	175.7	-175.1	0	0	0	0	0	112	L767	G736-L767 PolarHBondContact N-O 2.9Å; G736-L767 VanDerWaalsContact N-O 3.16Å; G736-L767 WeakPolarHBondContact O-CB 3.5Å; G736-L767 PolarHBondContact O-N 3.09Å
737	D	85.6	Confident	81.6	Confident	108 Å²	108	51.4 Å²	51.4	58%	0.578	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	118.2	175.6	-69.3	-16	0	0	0	109	V764 P766	D737-V764 HydrophobicContact CB-CG1 3.78Å; D737-P766 WeakPolarHBondContact OD1-CB 3.19Å
738	I	85.4	Confident	80.2	Confident	13 Å²	13	52.5 Å²	52.5	7%	0.067	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	133.6	175.9	-70.1	175.8	0	0	0	109.6	P675 N677 I678 I740 V764 L765 L767	P675-I738 HydrophobicContact CG-CG2 3.45Å; P675-I738 VanDerWaalsContact CG-CG2 3.45Å; N677-I738 WeakPolarHBondContact ND2-CD1 3.17Å; I678-I738 HydrophobicContact CD1-CD1 4.48Å; I678-I738 HydrophobicContact CD1-CG2 3.77Å; I738-I740 HydrophobicContact CG2-CG1 4.44Å; I738-V764 CarbonylContact O-C 3.53Å; I738-V764 WeakPolarHBondContact O-CA 3.12Å; I738-L765 HydrophobicContact CB-CB 4.31Å; I738-L765 PolarHBondContact N-O 3.43Å; I738-L765 PolarHBondContact O-N 2.74Å; I738-L767 HydrophobicContact CB-CD1 4.02Å; I738-L767 HydrophobicContact CD1-CD1 3.32Å; I738-L767 HydrophobicContact CD1-CD2 3.55Å; I738-L767 HydrophobicContact CD1-CG 4.1Å; I738-L767 HydrophobicContact CG1-CD1 3.64Å; I738-L767 HydrophobicContact CG1-CD2 4.5Å
739	H	88.1	Confident	79.1	Confident	106 Å²	106	51.1 Å²	51.1	49%	0.491	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	127	174.6	-59.6	-77.9	0	0	0	110.5	T762 L763	H739-T762 HydrophobicContact CB-CG2 4.08Å; H739-L763 WeakPolarHBondContact CA-O 3.4Å
740	I	88.3	Confident	78.2	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	115.8	171.9	-58.1	172.9	0	0	0	107	L636 I652 F674 I678 I738 I742 T762 L763	L636-I740 HydrophobicContact CD1-CD1 4.24Å; I652-I740 HydrophobicContact CD1-CD1 4.48Å; F674-I740 HydrophobicContact CB-CG1 4.46Å; I678-I740 HydrophobicContact CD1-CD1 3.92Å; I678-I740 HydrophobicContact CD1-CG1 4.04Å; I738-I740 HydrophobicContact CG2-CG1 4.44Å; I740-I742 HydrophobicContact CG2-CG1 4.27Å; I740-T762 WeakPolarHBondContact O-CA 3.09Å; I740-L763 PolarHBondContact N-O 3.44Å; I740-L763 PolarHBondContact O-N 2.7Å
741	N	88.7	Confident	77.8	Confident	70 Å²	70	56.1 Å²	56.1	37%	0.374	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129.7	-179.5	-66.2	-4	0	0	0	109.1	R673 T762	R673-N741 HydrophobicContact CB-CB 4.32Å; R673-N741 PolarHBondContact N-O 3.27Å; R673-N741 PolarHBondContact O-N 3.36Å; N741-T762 VanDerWaalsContact OD1-CG2 3.3Å; N741-T762 WeakPolarHBondContact OD1-CG2 3.3Å; N741-T762 PolarHBondContact OD1-OG1 3.49Å
742	I	88.9	Confident	77.9	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	125.6	-177.5	-45.8	170.8	0	0	0	106	L632 S634 L654 T656 V670 L672 I740 T760 M761 L763	L632-I742 HydrophobicContact CD1-CG2 4.15Å; L632-I742 HydrophobicContact CD2-CB 3.89Å; L632-I742 HydrophobicContact CD2-CG2 3.62Å; L632-I742 WeakPolarHBondContact CD2-O 3.5Å; L632-I742 HydrophobicContact CG-CG2 4.41Å; S634-I742 VanDerWaalsContact CB-CD1 3.49Å; S634-I742 WeakPolarHBondContact OG-CD1 3.27Å; L654-I742 HydrophobicContact CD1-CD1 3.86Å; L654-I742 HydrophobicContact CD2-CD1 3.85Å; L654-I742 HydrophobicContact CD2-CG1 4.42Å; L654-I742 HydrophobicContact CG-CD1 4.38Å; T656-I742 HydrophobicContact CG2-CG2 4.47Å; V670-I742 HydrophobicContact CG1-CG2 4.13Å; L672-I742 HydrophobicContact CD2-CB 4.33Å; L672-I742 HydrophobicContact CD2-CD1 4.41Å; L672-I742 HydrophobicContact CD2-CG1 3.85Å; L672-I742 HydrophobicContact CD2-CG2 3.88Å; I740-I742 HydrophobicContact CG2-CG1 4.27Å; I742-T760 WeakPolarHBondContact O-CA 3.37Å; I742-M761 PolarHBondContact N-O 2.94Å; I742-M761 PolarHBondContact O-N 3.32Å; I742-L763 HydrophobicContact CD1-CD1 3.82Å; I742-L763 HydrophobicContact CD1-CG 4.26Å
743	N	87.9	Confident	78.1	Confident	61 Å²	61	49.3 Å²	49.3	33%	0.326	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	140.3	180	-177.2	29.5	0	0	0	110	T671 N759 T760	T671-N743 PolarHBondContact N-O 3.06Å; T671-N743 PolarHBondContact O-N 3.37Å; T671-N743 WeakPolarHBondContact OG1-CB 3.42Å; T671-N743 PolarHBondContact OG1-O 3.11Å; N743-N759 CarbonylContact C-O 3.58Å; N743-N759 WeakPolarHBondContact CA-O 3.35Å; N743-N759 PolarHBondContact OD1-O 3.45Å; N743-T760 HydrophobicContact CB-CG2 4.22Å; N743-T760 VanDerWaalsContact OD1-CG2 3.31Å; N743-T760 WeakPolarHBondContact OD1-CG2 3.35Å
744	T	84.1	Confident	78.1	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.006	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	144.8	170.9	-170.9	0	0	0	0	111	M630 L632 L658 R669 N759	M630-T744 HydrophobicContact CB-CG2 3.87Å; L632-T744 HydrophobicContact CB-CG2 4.18Å; L658-T744 HydrophobicContact CD1-CG2 3.76Å; L658-T744 VanDerWaalsContact CD1-OG1 3.24Å; L658-T744 WeakPolarHBondContact CD1-OG1 3.48Å; R669-T744 VanDerWaalsContact O-CA 3.3Å; R669-T744 WeakPolarHBondContact O-CA 3.43Å; R669-T744 PolarHBondContact O-OG1 3.44Å; T744-N759 HydrophobicContact CG2-CB 4.01Å; T744-N759 PolarHBondContact N-O 3.42Å
745	S	77.9	Confident	78	Confident	44 Å²	44	54.6 Å²	54.6	31%	0.308	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	148.9	173.2	57.3	0	0	0	0	109.5	R669	R669-S745 PolarHBondContact N-O 2.92Å; R669-S745 PolarHBondContact O-N 2.81Å
746	S	69.7	Low	78	Confident	15 Å²	15	55 Å²	55	11%	0.105	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	126.3	160.2	176.1	0	0	0	0	108.1	F666 D748 N749	F666-S746 PolarHBondContact O-OG 3.25Å; S746-D748 PolarHBondContact O-N 3.12Å; S746-N749 WeakPolarHBondContact OG-CB 3.22Å; S746-N749 PolarHBondContact OG-N 2.75Å; S746-N749 PolarHBondContact OG-OD1 3.37Å
747	S	62.2	Low	77.8	Confident	33 Å²	33	63.7 Å²	63.7	23%	0.231	31%	0.312	C	S	.	.	S	Bend	trans	-74.4	-11.2	-178.2	54.5	0	0	0	0	114.2	R616 L667	R616-S747 PolarHBondContact NH1-O 2.73Å; L667-S747 VanDerWaalsContact CB-OG 3.25Å; L667-S747 WeakPolarHBondContact CB-OG 3.32Å; L667-S747 PolarHBondContact O-OG 3.04Å; L667-S747 VanDerWaalsContact O-OG 3.05Å
748	D	59.3	Low	77.6	Confident	24 Å²	24	61 Å²	61	13%	0.128	30%	0.298	C	S	.	.	S	Bend	trans	-131.6	-0	-166.9	-96.9	25.2	0	0	0	114.3	R616 R619 F666 S746	R616-D748 IonicContact CZ-OD1 2.9Å; R616-D748 VanDerWaalsContact CZ-OD1 3.29Å; R616-D748 IonicContact NH1-OD1 2.75Å; R616-D748 PolarHBondContact NH1-OD1 3.28Å; R616-D748 IonicContact NH2-OD1 3.18Å; R616-D748 PolarHBondContact NH2-OD1 2.96Å; R619-D748 IonicContact CZ-OD2 3.44Å; R619-D748 PolarHBondContact NH1-O 2.89Å; R619-D748 IonicContact NH1-OD2 3.81Å; R619-D748 IonicContact NH2-OD2 2.73Å; R619-D748 PolarHBondContact NH2-OD2 2.98Å; F666-D748 HydrophobicContact CB-CB 3.96Å; S746-D748 PolarHBondContact O-N 3.12Å
749	N	65.3	Low	77.6	Confident	26 Å²	26	60.7 Å²	60.7	14%	0.139	30%	0.296	C	S	.	.	S	Bend	trans	-126.1	145.5	-178.8	-63.2	52.1	0	0	0	110.4	T628 D664 F666 S746	T628-N749 HydrophobicContact CG2-CB 3.42Å; T628-N749 VanDerWaalsContact CG2-CB 3.42Å; T628-N749 WeakPolarHBondContact CG2-ND2 3.3Å; D664-N749 PolarHBondContact O-ND2 3.15Å; F666-N749 WeakPolarHBondContact CB-OD1 3.41Å; F666-N749 VanDerWaalsContact CD2-OD1 3.28Å; F666-N749 WeakPolarHBondContact CD2-OD1 3.17Å; F666-N749 PolarHBondContact N-OD1 2.91Å; F666-N749 VanDerWaalsContact N-OD1 3.17Å; S746-N749 WeakPolarHBondContact OG-CB 3.22Å; S746-N749 PolarHBondContact OG-N 2.75Å; S746-N749 PolarHBondContact OG-OD1 3.37Å
750	Y	68.4	Low	77.5	Confident	120 Å²	120	59.6 Å²	59.6	47%	0.471	30%	0.297	S	S	.	.			trans	-76.9	147.5	169.6	178.6	-101.7	0	0	0	109.1	N625 S627 T628 T752	N625-Y750 HydrophobicContact CB-CD1 4.1Å; S627-Y750 CarbonylContact C-O 3.51Å; S627-Y750 WeakPolarHBondContact CA-O 3.13Å; T628-Y750 PolarHBondContact N-O 3.37Å; T628-Y750 PolarHBondContact OG1-O 2.81Å; Y750-T752 HydrophobicContact CE1-CG2 4.05Å
751	E	73.8	Confident	77.5	Confident	19 Å²	19	63.1 Å²	63.1	9%	0.089	31%	0.314	C	S	.	.			trans	-133.8	130.7	173.9	-178.4	158.3	-148.5	0	0	108.3	T628 N629 M630 F755 L756 N759	T628-E751 WeakPolarHBondContact O-CG 3.41Å; N629-E751 WeakPolarHBondContact CA-OE1 3.31Å; M630-E751 PolarHBondContact N-OE1 2.61Å; E751-F755 HydrophobicContact CG-CB 3.97Å; E751-L756 HydrophobicContact CB-CD2 4.25Å; E751-L756 HydrophobicContact CG-CD2 4.1Å; E751-N759 PolarHBondContact OE2-ND2 3.47Å
752	T	73.1	Confident	77.5	Confident	44 Å²	44	63.2 Å²	63.2	27%	0.27	32%	0.317	S	S	.	.			trans	-67.5	143.5	-178.9	45.7	0	0	0	0	111.6	S627 Y750 E754 F755	S627-T752 PolarHBondContact OG-N 3.18Å; Y750-T752 HydrophobicContact CE1-CG2 4.05Å; T752-E754 PolarHBondContact O-N 3.39Å; T752-F755 PolarHBondContact O-N 2.97Å; T752-F755 WeakPolarHBondContact OG1-CD2 3.14Å; T752-F755 VanDerWaalsContact OG1-CE2 3.22Å; T752-F755 WeakPolarHBondContact OG1-CE2 3.38Å
753	D	76.1	Confident	77.6	Confident	123 Å²	123	64.1 Å²	64.1	66%	0.658	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-51.5	-26.9	-176.2	-67.9	-29.7	0	0	0	114.9	F755 L756	D753-F755 VanDerWaalsContact C-N 3.33Å; D753-F755 PolarHBondContact O-N 2.99Å; D753-L756 PolarHBondContact O-N 3.29Å
754	E	75.4	Confident	77.7	Confident	164 Å²	164	64.8 Å²	64.8	77%	0.766	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-66.5	-29.6	177.1	-62.9	-173.8	175.2	0	0	113.6	T752	T752-E754 PolarHBondContact O-N 3.39Å
755	F	77.2	Confident	77.9	Confident	69 Å²	69	64.7 Å²	64.7	30%	0.303	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-99.3	8	-178.7	-52	-41.8	0	0	0	113	N629 E751 T752 D753 R757 D758	N629-F755 HydrophobicContact CB-CD2 4.09Å; N629-F755 HydrophobicContact CB-CG 4.31Å; E751-F755 HydrophobicContact CG-CB 3.97Å; T752-F755 PolarHBondContact O-N 2.97Å; T752-F755 WeakPolarHBondContact OG1-CD2 3.14Å; T752-F755 VanDerWaalsContact OG1-CE2 3.22Å; T752-F755 WeakPolarHBondContact OG1-CE2 3.38Å; D753-F755 VanDerWaalsContact C-N 3.33Å; D753-F755 PolarHBondContact O-N 2.99Å; F755-R757 VanDerWaalsContact C-N 3.29Å; F755-R757 PolarHBondContact O-N 3.05Å; F755-D758 VanDerWaalsContact C-OD1 3.25Å
756	L	79.1	Confident	78.4	Confident	77 Å²	77	64.1 Å²	64.1	40%	0.403	32%	0.323	S	S	.	.	S	Bend	trans	-79.5	-12.2	177.4	-66.6	179.1	0	0	0	113.1	E751 D753	E751-L756 HydrophobicContact CB-CD2 4.25Å; E751-L756 HydrophobicContact CG-CD2 4.1Å; D753-L756 PolarHBondContact O-N 3.29Å
757	R	78.6	Confident	79.2	Confident	218 Å²	218	63.6 Å²	63.6	82%	0.823	32%	0.319	S	S	*	.	S	Bend	trans	-79.8	-34.1	-173.2	-67.5	-172.7	178.2	-169.5	1	113	F755 N759	F755-R757 VanDerWaalsContact C-N 3.29Å; F755-R757 PolarHBondContact O-N 3.05Å; R757-N759 VanDerWaalsContact C-N 3.26Å
758	D	81.8	Confident	80.2	Confident	52 Å²	52	66.9 Å²	66.9	28%	0.278	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-1.1	176.7	44.8	-22	0	0	0	113.7	Q631 L632 F755	Q631-D758 WeakPolarHBondContact CG-OD2 3.47Å; L632-D758 WeakPolarHBondContact CB-O 3.05Å; L632-D758 PolarHBondContact N-O 2.81Å; F755-D758 VanDerWaalsContact C-OD1 3.25Å
759	N	84.7	Confident	81.2	Confident	6 Å²	6	67.8 Å²	67.8	3%	0.032	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-20.3	172.4	-74.4	-14.1	0	0	0	114	M630 L632 N743 T744 E751 R757	M630-N759 VanDerWaalsContact CB-OD1 3.3Å; M630-N759 WeakPolarHBondContact CB-OD1 3.41Å; M630-N759 PolarHBondContact O-OD1 3.08Å; L632-N759 WeakPolarHBondContact CD2-O 3.45Å; N743-N759 CarbonylContact C-O 3.58Å; N743-N759 WeakPolarHBondContact CA-O 3.35Å; N743-N759 PolarHBondContact OD1-O 3.45Å; T744-N759 HydrophobicContact CG2-CB 4.01Å; T744-N759 PolarHBondContact N-O 3.42Å; E751-N759 PolarHBondContact OE2-ND2 3.47Å; R757-N759 VanDerWaalsContact C-N 3.26Å
760	T	86.4	Confident	81.7	Confident	82 Å²	82	67.3 Å²	67.3	50%	0.503	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	136.4	-173.1	62.9	0	0	0	0	112.4	I742 N743	I742-T760 WeakPolarHBondContact O-CA 3.37Å; N743-T760 HydrophobicContact CB-CG2 4.22Å; N743-T760 VanDerWaalsContact OD1-CG2 3.31Å; N743-T760 WeakPolarHBondContact OD1-CG2 3.35Å
761	M	89.3	Confident	82.3	Confident	76 Å²	76	62.7 Å²	62.7	37%	0.374	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	139.4	173.4	-175.5	62	-177.5	0	0	110	L632 I742 L763	L632-M761 HydrophobicContact CD2-CB 3.86Å; L632-M761 HydrophobicContact CG-CB 4.49Å; I742-M761 PolarHBondContact N-O 2.94Å; I742-M761 PolarHBondContact O-N 3.32Å; M761-L763 HydrophobicContact CE-CD2 3.9Å; M761-L763 HydrophobicContact CG-CD2 4.49Å
762	T	89.3	Confident	82.6	Confident	72 Å²	72	63 Å²	63	44%	0.442	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	126.1	174.8	-57.3	0	0	0	0	109.7	H739 I740 N741	H739-T762 HydrophobicContact CB-CG2 4.08Å; I740-T762 WeakPolarHBondContact O-CA 3.09Å; N741-T762 VanDerWaalsContact OD1-CG2 3.3Å; N741-T762 WeakPolarHBondContact OD1-CG2 3.3Å; N741-T762 PolarHBondContact OD1-OG1 3.49Å
763	L	90.3	Very high	82.9	Confident	21 Å²	21	61.8 Å²	61.8	11%	0.11	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	144.5	175.6	-64.5	177	0	0	0	110.6	L636 L654 H739 I740 I742 M761	L636-L763 HydrophobicContact CB-CD1 4.39Å; L654-L763 HydrophobicContact CD1-CD1 3.31Å; H739-L763 WeakPolarHBondContact CA-O 3.4Å; I740-L763 PolarHBondContact N-O 3.44Å; I740-L763 PolarHBondContact O-N 2.7Å; I742-L763 HydrophobicContact CD1-CD1 3.82Å; I742-L763 HydrophobicContact CD1-CG 4.26Å; M761-L763 HydrophobicContact CE-CD2 3.9Å; M761-L763 HydrophobicContact CG-CD2 4.49Å
764	V	89.8	Confident	83.1	Confident	74 Å²	74	58.2 Å²	58.2	45%	0.448	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	123.8	178.4	-175.8	0	0	0	0	109.9	D737 I738	D737-V764 HydrophobicContact CB-CG1 3.78Å; I738-V764 CarbonylContact O-C 3.53Å; I738-V764 WeakPolarHBondContact O-CA 3.12Å
765	L	88.4	Confident	83.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	107.9	172.6	176	55.6	0	0	0	109.1	L636 L638 F645 I652 I678 V729 I738 L767	L636-L765 HydrophobicContact CD2-CB 3.94Å; L636-L765 HydrophobicContact CD2-CD1 3.57Å; L636-L765 HydrophobicContact CD2-CG 4.18Å; L638-L765 HydrophobicContact CD2-CD1 3.46Å; L638-L765 VanDerWaalsContact CD2-CD1 3.46Å; F645-L765 HydrophobicContact CB-CD1 3.6Å; F645-L765 HydrophobicContact CB-CG 4.38Å; F645-L765 HydrophobicContact CG-CD1 4.34Å; I652-L765 HydrophobicContact CD1-CD2 3.59Å; I678-L765 HydrophobicContact CD1-CD2 4.19Å; V729-L765 HydrophobicContact CG2-CD2 4.16Å; I738-L765 HydrophobicContact CB-CB 4.31Å; I738-L765 PolarHBondContact N-O 3.43Å; I738-L765 PolarHBondContact O-N 2.74Å; L765-L767 HydrophobicContact CB-CD1 4.3Å; L765-L767 HydrophobicContact CD2-CD1 3.97Å; L765-L767 HydrophobicContact CG-CD1 3.62Å; L765-L767 WeakPolarHBondContact O-CD1 3.37Å; L765-L767 PolarHBondContact O-N 3.14Å
766	P	87.9	Confident	83.7	Confident	31 Å²	31	52.6 Å²	52.6	20%	0.201	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	114.7	178.6	27.2	-27.8	0	0	0	111.3	F644 F645 D737	F644-P766 HydrophobicContact CB-CB 4.49Å; F644-P766 HydrophobicContact CB-CG 4.31Å; F644-P766 WeakPolarHBondContact CB-O 3.42Å; F645-P766 PolarHBondContact N-O 3.14Å; D737-P766 WeakPolarHBondContact OD1-CB 3.19Å
767	L	86	Confident	83.8	Confident	4 Å²	4	49.9 Å²	49.9	2%	0.021	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129.6	-179.4	-76.7	74.1	0	0	0	110.8	F645 L647 V729 G736 I738 L765	F645-L767 HydrophobicContact CD1-CG 4.45Å; F645-L767 WeakPolarHBondContact O-CA 3.27Å; L647-L767 HydrophobicContact CD2-CB 4.41Å; L647-L767 HydrophobicContact CD2-CD2 3.65Å; L647-L767 HydrophobicContact CD2-CG 4.44Å; V729-L767 HydrophobicContact CG1-CD2 3.87Å; G736-L767 PolarHBondContact N-O 2.9Å; G736-L767 VanDerWaalsContact N-O 3.16Å; G736-L767 WeakPolarHBondContact O-CB 3.5Å; G736-L767 PolarHBondContact O-N 3.09Å; I738-L767 HydrophobicContact CB-CD1 4.02Å; I738-L767 HydrophobicContact CD1-CD1 3.32Å; I738-L767 HydrophobicContact CD1-CD2 3.55Å; I738-L767 HydrophobicContact CD1-CG 4.1Å; I738-L767 HydrophobicContact CG1-CD1 3.64Å; I738-L767 HydrophobicContact CG1-CD2 4.5Å; L765-L767 HydrophobicContact CB-CD1 4.3Å; L765-L767 HydrophobicContact CD2-CD1 3.97Å; L765-L767 HydrophobicContact CG-CD1 3.62Å; L765-L767 WeakPolarHBondContact O-CD1 3.37Å; L765-L767 PolarHBondContact O-N 3.14Å
768	K	83.3	Confident	84.1	Confident	102 Å²	102	44.4 Å²	44.4	44%	0.443	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	162.2	176.3	-58.8	-173	179.5	180	0	111.2	F644 F645 A646 L647 G770	F644-K768 HydrophobicContact CB-CD 4.11Å; F644-K768 HydrophobicContact CB-CG 4.23Å; F644-K768 HydrophobicContact CD1-CD 4.21Å; F644-K768 HydrophobicContact CD2-CB 3.66Å; F644-K768 HydrophobicContact CD2-CD 4.09Å; F644-K768 HydrophobicContact CD2-CG 4.08Å; F644-K768 HydrophobicContact CE2-CB 4.03Å; F644-K768 HydrophobicContact CG-CB 4.28Å; F644-K768 HydrophobicContact CG-CD 3.87Å; F644-K768 HydrophobicContact CG-CG 4.2Å; F645-K768 PolarHBondContact O-N 3.11Å; A646-K768 WeakPolarHBondContact CA-O 3.37Å; L647-K768 PolarHBondContact N-O 2.67Å; K768-G770 PolarHBondContact O-N 2.98Å
769	H	80.4	Confident	84.2	Confident	43 Å²	43	42.2 Å²	42.2	20%	0.199	24%	0.235	C	C	.	.			trans	-74.7	119.3	172.5	-68.3	-79.2	0	0	0	110.5	P735 V771 T943	P735-H769 WeakPolarHBondContact CG-NE2 3.44Å; H769-V771 HydrophobicContact CB-CG2 4.1Å; H769-T943 VanDerWaalsContact O-CG2 3.27Å; H769-T943 WeakPolarHBondContact O-CG2 3.46Å
770	G	77.1	Confident	84.2	Confident	16 Å²	16	45.8 Å²	45.8	17%	0.165	26%	0.256	C	S	.	.			trans	-94.5	91.4	167.2	0	0	0	0	0	110.3	K768 P812 S813	K768-G770 PolarHBondContact O-N 2.98Å; G770-P812 WeakPolarHBondContact O-CD 3.08Å; G770-P812 WeakPolarHBondContact O-CG 3.26Å; G770-S813 PolarHBondContact N-OG 3.47Å; G770-S813 WeakPolarHBondContact O-CB 3.48Å; G770-S813 PolarHBondContact O-N 3.08Å; G770-S813 PolarHBondContact O-OG 2.92Å
771	V	79.7	Confident	84.2	Confident	24 Å²	24	44.7 Å²	44.7	15%	0.145	25%	0.251	C	S	.	.			trans	-101.9	135.7	-177.1	176.7	0	0	0	0	109.9	H769 I773 A815 Y940	H769-V771 HydrophobicContact CB-CG2 4.1Å; V771-I773 HydrophobicContact CG1-CD1 3.86Å; V771-I773 HydrophobicContact CG1-CG1 3.72Å; V771-A815 HydrophobicContact CG1-CB 3.61Å; V771-A815 HydrophobicContact CG2-CB 4.23Å; V771-Y940 HydrophobicContact CB-CE2 4Å; V771-Y940 HydrophobicContact CG1-CD2 4.36Å; V771-Y940 HydrophobicContact CG1-CE2 4.04Å
772	G	79.9	Confident	83.7	Confident	24 Å²	24	48.7 Å²	48.7	25%	0.247	27%	0.266	C	S	.	.			trans	-136.8	106.2	172.7	0	0	0	0	0	109.4	N809 S810 G811	G772-N809 CarbonylContact O-C 3.51Å; G772-N809 PolarHBondContact O-OD1 2.93Å; G772-S810 CarbonylContact O-C 3.59Å; G772-S810 WeakPolarHBondContact O-CA 3.34Å; G772-S810 PolarHBondContact O-N 3.08Å; G772-S810 PolarHBondContact O-OG 3.1Å; G772-S810 VanDerWaalsContact O-OG 3.08Å; G772-G811 PolarHBondContact O-N 3.46Å
773	I	79.5	Confident	83.3	Confident	20 Å²	20	48.2 Å²	48.2	10%	0.103	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	128	-176.3	-62.3	170.8	0	0	0	109.7	V771 V807 L808 A815 T818 V938 Y940	V771-I773 HydrophobicContact CG1-CD1 3.86Å; V771-I773 HydrophobicContact CG1-CG1 3.72Å; I773-V807 HydrophobicContact CG2-CG1 3.59Å; I773-L808 WeakPolarHBondContact CA-O 3.48Å; I773-A815 HydrophobicContact CD1-CB 3.8Å; I773-A815 HydrophobicContact CG1-CB 4.36Å; I773-T818 HydrophobicContact CD1-CG2 3.93Å; I773-V938 HydrophobicContact CD1-CG1 3.78Å; I773-V938 HydrophobicContact CG2-CB 4.48Å; I773-V938 HydrophobicContact CG2-CG1 4.22Å; I773-V938 HydrophobicContact CG2-CG2 4.11Å; I773-Y940 HydrophobicContact CD1-CD1 4.2Å
774	N	81.7	Confident	82.9	Confident	48 Å²	48	47.9 Å²	47.9	26%	0.257	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	145	174.2	-64.9	-22.9	0	0	0	110	V807 L808 S810	N774-V807 CarbonylContact O-C 3.52Å; N774-L808 PolarHBondContact N-O 3.13Å; N774-L808 PolarHBondContact O-N 3.07Å; N774-S810 PolarHBondContact ND2-OG 2.73Å
775	I	81.3	Confident	82.3	Confident	14 Å²	14	48.8 Å²	48.8	7%	0.072	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	132.8	177.4	-49.4	171.5	0	0	0	109.7	F805 K806 V807 A936 V938 N951	I775-F805 HydrophobicContact CG2-CD1 4.45Å; I775-K806 CarbonylContact C-O 3.54Å; I775-K806 WeakPolarHBondContact CA-O 3.04Å; I775-V807 HydrophobicContact CG1-CG1 4.32Å; I775-V807 HydrophobicContact CG1-CG2 4.23Å; I775-V807 HydrophobicContact CG2-CG2 4.17Å; I775-A936 HydrophobicContact CD1-CB 3.88Å; I775-A936 WeakPolarHBondContact CD1-O 3.31Å; I775-A936 HydrophobicContact CG2-CB 4.01Å; I775-V938 HydrophobicContact CD1-CB 4.16Å; I775-V938 HydrophobicContact CD1-CG2 3.18Å; I775-V938 HydrophobicContact CG1-CG2 3.82Å; I775-N951 VanDerWaalsContact O-CB 3.29Å; I775-N951 WeakPolarHBondContact O-CB 3.44Å
776	H	83.2	Confident	81.6	Confident	101 Å²	101	49.2 Å²	49.2	47%	0.468	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	130.6	173.9	-60.6	-69.8	0	0	0	109.8	F805 K806	H776-F805 CarbonylContact O-C 3.56Å; H776-F805 WeakPolarHBondContact O-CA 3.49Å; H776-K806 PolarHBondContact N-O 3.03Å; H776-K806 PolarHBondContact O-N 3.36Å
777	G	82.2	Confident	80.7	Confident	20 Å²	20	49 Å²	49	21%	0.206	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	141.5	-177.8	0	0	0	0	0	111.1	T804 N951	G777-T804 CarbonylContact C-O 3.56Å; G777-T804 VanDerWaalsContact CA-O 3.3Å; G777-T804 WeakPolarHBondContact CA-O 3.44Å; G777-N951 PolarHBondContact N-ND2 3.41Å
778	F	83.1	Confident	79.6	Confident	103 Å²	103	52 Å²	52	45%	0.452	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	151.5	176.8	44	-84.2	0	0	0	110.8	T804	F778-T804 HydrophobicContact CD2-CG2 4.36Å; F778-T804 HydrophobicContact CE1-CG2 3.98Å; F778-T804 HydrophobicContact CE2-CG2 3.49Å; F778-T804 VanDerWaalsContact CE2-CG2 3.49Å; F778-T804 HydrophobicContact CZ-CG2 3.24Å; F778-T804 PolarHBondContact N-O 3.41Å; F778-T804 PolarHBondContact O-N 3.4Å
779	V	85.3	Confident	78.4	Confident	6 Å²	6	51.8 Å²	51.8	4%	0.036	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	142.6	-178.5	63.8	0	0	0	0	110.9	K782 F801 N802 Y803 V953 V955	V779-K782 HydrophobicContact CG1-CG 4.38Å; V779-K782 WeakPolarHBondContact O-CG 3.3Å; V779-F801 HydrophobicContact CG2-CB 4.18Å; V779-F801 HydrophobicContact CG2-CD1 4.37Å; V779-N802 WeakPolarHBondContact CA-O 3.16Å; V779-Y803 HydrophobicContact CB-CD1 4.02Å; V779-Y803 HydrophobicContact CB-CE1 4.05Å; V779-Y803 HydrophobicContact CB-CG 4.38Å; V779-Y803 HydrophobicContact CG2-CD1 4Å; V779-Y803 HydrophobicContact CG2-CD2 3.9Å; V779-Y803 HydrophobicContact CG2-CE1 3.84Å; V779-Y803 HydrophobicContact CG2-CE2 3.72Å; V779-Y803 HydrophobicContact CG2-CG 4.04Å; V779-V953 HydrophobicContact CB-CG1 3.69Å; V779-V953 HydrophobicContact CG1-CG1 3.58Å; V779-V955 HydrophobicContact CB-CG2 4.21Å; V779-V955 HydrophobicContact CG1-CG2 3.73Å; V779-V955 HydrophobicContact CG2-CG2 3.65Å
780	T	83.8	Confident	77.1	Confident	80 Å²	80	55.7 Å²	55.7	49%	0.491	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	124.7	175.9	53.3	0	0	0	0	110.3	N802	T780-N802 PolarHBondContact N-O 3.02Å; T780-N802 PolarHBondContact O-N 3.41Å; T780-N802 PolarHBondContact OG1-O 2.82Å
781	P	86.2	Confident	76	Confident	60 Å²	60	62.7 Å²	62.7	39%	0.39	34%	0.34	S	S	.	.	S	Bend	cis	-70.2	161.2	-7.1	30.1	-33.5	0	0	0	112.8	K800 F801	P781-K800 WeakPolarHBondContact CD-O 3.5Å; P781-F801 HydrophobicContact CG-CD1 4.05Å; P781-F801 HydrophobicContact CG-CE1 3.88Å; P781-F801 WeakPolarHBondContact O-CD1 3.45Å
782	K	79.3	Confident	74.8	Confident	159 Å²	159	66.1 Å²	66.1	69%	0.691	36%	0.356	S	S	*	.	S	Bend	trans	-84.2	-21.5	179.3	-68.8	-176.5	-180	179.5	0	113.5	V779 V955 E956	V779-K782 HydrophobicContact CG1-CG 4.38Å; V779-K782 WeakPolarHBondContact O-CG 3.3Å; K782-V955 WeakPolarHBondContact O-CA 3.39Å; K782-E956 PolarHBondContact O-N 2.86Å
783	S	81.3	Confident	73.6	Confident	63 Å²	63	68 Å²	68	44%	0.441	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	158.2	177.7	59.5	0	0	0	0	111	E956	S783-E956 CarbonylContact C-O 3.58Å; S783-E956 WeakPolarHBondContact CA-O 3.3Å; S783-E956 VanDerWaalsContact CB-O 3.25Å; S783-E956 WeakPolarHBondContact CB-O 3.34Å
784	F	82.4	Confident	72.6	Confident	14 Å²	14	72.7 Å²	72.7	6%	0.061	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	160.8	173.5	74.4	-75.9	0	0	0	110.1	F786 E799 F801 L917 L922 V955 E956 A957 V958	F784-F786 HydrophobicContact CD2-CB 4.5Å; F784-F786 HydrophobicContact CE2-CB 4.11Å; F784-F786 HydrophobicContact CE2-CD1 4.05Å; F784-F786 HydrophobicContact CE2-CG 4.41Å; F784-F786 HydrophobicContact CZ-CD1 4.48Å; F784-E799 HydrophobicContact CD2-CG 3.88Å; F784-E799 HydrophobicContact CE2-CG 4.16Å; F784-F801 HydrophobicContact CB-CZ 4.33Å; F784-F801 AromaticContact CD1-CE1 3.96Å; F784-F801 HydrophobicContact CD1-CE1 3.96Å; F784-F801 HydrophobicContact CD1-CE2 4.38Å; F784-F801 AromaticContact CD1-CZ 3.35Å; F784-F801 HydrophobicContact CD1-CZ 3.35Å; F784-F801 HydrophobicContact CE1-CE2 4.35Å; F784-F801 AromaticContact CE1-CZ 3.69Å; F784-F801 HydrophobicContact CE1-CZ 3.69Å; F784-F801 AromaticContact CG-CZ 3.92Å; F784-F801 HydrophobicContact CG-CZ 3.92Å; F784-L917 HydrophobicContact CE1-CD1 3.95Å; F784-L917 HydrophobicContact CE2-CD2 3.99Å; F784-L917 HydrophobicContact CZ-CD1 3.75Å; F784-L917 HydrophobicContact CZ-CD2 3.6Å; F784-L917 HydrophobicContact CZ-CG 4.36Å; F784-L922 HydrophobicContact CE2-CD1 4.43Å; F784-L922 HydrophobicContact CZ-CD1 3.77Å; F784-V955 HydrophobicContact CD1-CG1 4.36Å; F784-V955 HydrophobicContact CE1-CG1 4.42Å; F784-E956 PolarHBondContact N-O 2.65Å; F784-A957 HydrophobicContact CD1-CB 4.13Å; F784-A957 HydrophobicContact CE1-CB 3.34Å; F784-A957 HydrophobicContact CE2-CB 4.32Å; F784-A957 HydrophobicContact CZ-CB 3.46Å; F784-A957 VanDerWaalsContact CZ-CB 3.46Å; F784-V958 PolarHBondContact O-N 3.1Å
785	V	76.3	Confident	71.5	Confident	93 Å²	93	75.7 Å²	75.7	56%	0.564	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.9	179.7	-177.8	0	0	0	0	108.5	V958	V785-V958 VanDerWaalsContact CA-O 3.27Å; V785-V958 WeakPolarHBondContact CA-O 3.19Å; V785-V958 HydrophobicContact CG2-CB 4.35Å
786	F	74.6	Confident	70.9	Confident	9 Å²	9	76 Å²	76	4%	0.039	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	145.1	176.3	66.8	-79	0	0	0	111.1	F784 P919 L922 L923 A957 V958 F959 S960	F784-F786 HydrophobicContact CD2-CB 4.5Å; F784-F786 HydrophobicContact CE2-CB 4.11Å; F784-F786 HydrophobicContact CE2-CD1 4.05Å; F784-F786 HydrophobicContact CE2-CG 4.41Å; F784-F786 HydrophobicContact CZ-CD1 4.48Å; F786-P919 HydrophobicContact CB-CB 4.21Å; F786-L922 HydrophobicContact CD1-CD1 4.47Å; F786-L922 HydrophobicContact CD2-CB 4.21Å; F786-L922 HydrophobicContact CE1-CB 4.47Å; F786-L922 HydrophobicContact CE1-CD1 4.28Å; F786-L922 HydrophobicContact CE2-CB 3.66Å; F786-L922 HydrophobicContact CZ-CB 3.82Å; F786-L922 HydrophobicContact CZ-CD1 4.43Å; F786-L923 HydrophobicContact CD2-CD2 3.7Å; F786-L923 HydrophobicContact CD2-CG 4.24Å; F786-L923 HydrophobicContact CE2-CD2 3.99Å; F786-A957 HydrophobicContact CD1-CB 4.16Å; F786-A957 HydrophobicContact CE1-CB 3.81Å; F786-V958 WeakPolarHBondContact CD1-O 3.1Å; F786-V958 PolarHBondContact N-O 3.25Å; F786-F959 AromaticContact CD2-CD2 3.95Å; F786-F959 HydrophobicContact CD2-CD2 3.95Å; F786-F959 HydrophobicContact CE1-CB 4.17Å; F786-F959 HydrophobicContact CE2-CB 4.29Å; F786-F959 AromaticContact CE2-CD2 3.55Å; F786-F959 HydrophobicContact CE2-CD2 3.55Å; F786-F959 HydrophobicContact CE2-CE2 4.39Å; F786-F959 HydrophobicContact CE2-CG 4.37Å; F786-F959 HydrophobicContact CZ-CB 3.85Å; F786-F959 AromaticContact CZ-CD2 4Å; F786-F959 HydrophobicContact CZ-CD2 4Å; F786-F959 HydrophobicContact CZ-CG 4.39Å; F786-S960 PolarHBondContact O-N 2.69Å
787	D	68.6	Low	70.5	Confident	26 Å²	26	72.5 Å²	72.5	14%	0.139	41%	0.408	C	S	.	.			trans	-141.3	174.6	-178.1	64.5	7.8	0	0	0	113.5	K962	D787-K962 IonicContact OD2-NZ 3.14Å; D787-K962 PolarHBondContact OD2-NZ 3.26Å; D787-K962 VanDerWaalsContact OD2-NZ 3.14Å
788	D	62.3	Low	70.1	Confident	68 Å²	68	74.3 Å²	74.3	36%	0.364	42%	0.416	S	S	.	.	S	Bend	trans	-91.6	-6.5	-171.9	-157.2	24.8	0	0	0	112.5	Q871	D788-Q871 PolarHBondContact OD2-NE2 2.79Å
789	E	58.2	Low	70	Confident	97 Å²	97	72.5 Å²	72.5	45%	0.453	41%	0.409	S	S	.	.			trans	-100.7	-11.7	-173.6	-84.2	-173.1	177.6	0	0	114.3	L791 K968	E789-L791 PolarHBondContact O-N 3.47Å; E789-K968 IonicContact OE1-NZ 2.91Å; E789-K968 PolarHBondContact OE1-NZ 3.34Å
790	D	53.7	Low	70	Confident	125 Å²	125	77.5 Å²	77.5	67%	0.668	43%	0.43	S	S	*	.	S	Bend	trans	-75.3	112.4	177.2	-78.1	-18.4	0	0	0	110.6	I792	D790-I792 PolarHBondContact O-N 3.23Å
791	L	53.3	Low	70.1	Confident	162 Å²	162	73.8 Å²	73.8	85%	0.848	41%	0.407	S	S	*	.			trans	-42.8	110	163.8	-78.4	149	0	0	0	108	E789 P793	E789-L791 PolarHBondContact O-N 3.47Å; L791-P793 WeakPolarHBondContact O-CD 3.46Å
792	I	55.2	Low	70.3	Confident	96 Å²	96	74.7 Å²	74.7	49%	0.492	41%	0.409	S	S	.	.			trans	-46.7	111.6	172.1	-56.5	170.8	0	0	0	105.6	D790	D790-I792 PolarHBondContact O-N 3.23Å
793	P	54.4	Low	70.7	Confident	65 Å²	65	67.3 Å²	67.3	42%	0.422	38%	0.377	S	S	.	.			trans	-57.6	162.7	178.7	-21.7	32.9	0	0	0	108.3	L791 D795 P798	L791-P793 WeakPolarHBondContact O-CD 3.46Å; P793-D795 CarbonylContact O-C 3.53Å; P793-D795 PolarHBondContact O-N 2.9Å; P793-P798 HydrophobicContact CG-CB 4.45Å
794	A	58.3	Low	71	Confident	118 Å²	118	65.2 Å²	65.2	98%	0.975	36%	0.361	S	S	*	.	S	Bend	trans	-54.8	-13.2	169.7	0	0	0	0	0	112.9
795	D	59.8	Low	71.2	Confident	111 Å²	111	64.6 Å²	64.6	59%	0.594	36%	0.359	S	S	*	.	S	Bend	trans	-105.4	119.1	174.5	-152.6	-6.9	0	0	0	111	P793 Y797	P793-D795 CarbonylContact O-C 3.53Å; P793-D795 PolarHBondContact O-N 2.9Å; D795-Y797 VanDerWaalsContact C-N 3.25Å; D795-Y797 PolarHBondContact O-N 2.86Å
796	C	68.1	Low	71.7	Confident	19 Å²	19	64 Å²	64	13%	0.128	35%	0.349	C	S	.	.	S	Bend	trans	-80.5	-4.9	-168.2	-41.4	0	0	0	0	114.1	P798 C861 N918	C796-P798 VanDerWaalsContact C-CD 3.47Å; C796-C861 HydrophobicContact CB-CB 3.65Å; C796-C861 WeakPolarHBondContact CB-SG 3.22Å; C796-C861 WeakPolarHBondContact SG-CB 3.38Å; C796-C861 CovalentContact SG-SG 1.99Å; C796-C861 PolarHBondContact SG-SG 2.82Å; C796-N918 VanDerWaalsContact O-CG 3.3Å; C796-N918 PolarHBondContact O-OD1 2.95Å
797	Y	74.4	Confident	72.4	Confident	29 Å²	29	63.6 Å²	63.6	11%	0.114	35%	0.347	C	S	.	.			trans	-128.1	66.9	-176.3	-61.6	-92	0	0	0	111.1	D795 E799 Q837 S916 L917 N918	D795-Y797 VanDerWaalsContact C-N 3.25Å; D795-Y797 PolarHBondContact O-N 2.86Å; Y797-E799 PolarHBondContact O-N 3.11Å; Y797-Q837 HydrophobicContact CD1-CB 4.18Å; Y797-Q837 HydrophobicContact CE1-CB 3.85Å; Y797-Q837 VanDerWaalsContact CE2-OE1 3.22Å; Y797-S916 WeakPolarHBondContact CB-OG 3.37Å; Y797-L917 WeakPolarHBondContact CA-O 3.29Å; Y797-N918 HydrophobicContact CD1-CB 3.87Å; Y797-N918 HydrophobicContact CE1-CB 3.81Å
798	P	73.3	Confident	73.2	Confident	58 Å²	58	64.8 Å²	64.8	38%	0.377	35%	0.353	S	S	.	.			trans	-69.7	-30.4	-174.3	27.9	-35.2	0	0	0	113.3	P793 C796 P919	P793-P798 HydrophobicContact CG-CB 4.45Å; C796-P798 VanDerWaalsContact C-CD 3.47Å; P798-P919 HydrophobicContact CG-CG 3.8Å
799	E	81.9	Confident	74.4	Confident	65 Å²	65	61.5 Å²	61.5	30%	0.304	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	125.8	-174.6	-66.8	-58	145.1	0	0	111.3	F784 Y797 F801 S916 L917	F784-E799 HydrophobicContact CD2-CG 3.88Å; F784-E799 HydrophobicContact CE2-CG 4.16Å; Y797-E799 PolarHBondContact O-N 3.11Å; E799-F801 HydrophobicContact CB-CE2 3.99Å; E799-F801 HydrophobicContact CB-CZ 4.33Å; E799-S916 CarbonylContact O-C 3.17Å; E799-S916 WeakPolarHBondContact O-CA 3.33Å; E799-L917 HydrophobicContact CB-CB 4.3Å; E799-L917 PolarHBondContact O-N 2.86Å
800	K	85.1	Confident	75.5	Confident	111 Å²	111	60.1 Å²	60.1	48%	0.483	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	132.7	-178.8	-67.4	-175	168.4	-152.9	0	111.8	P781 E914 I915	P781-K800 WeakPolarHBondContact CD-O 3.5Å; K800-E914 WeakPolarHBondContact CD-OE1 3.45Å; K800-E914 IonicContact NZ-OE1 3.72Å; K800-E914 PolarHBondContact NZ-OE1 3.22Å; K800-I915 CarbonylContact C-O 3.56Å; K800-I915 WeakPolarHBondContact CA-O 3.41Å
801	F	86.4	Confident	76.8	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.009	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	129.3	179.4	-60.3	-82.7	0	0	0	110.7	V779 P781 F784 E799 Y803 I915 L917 V955	V779-F801 HydrophobicContact CG2-CB 4.18Å; V779-F801 HydrophobicContact CG2-CD1 4.37Å; P781-F801 HydrophobicContact CG-CD1 4.05Å; P781-F801 HydrophobicContact CG-CE1 3.88Å; P781-F801 WeakPolarHBondContact O-CD1 3.45Å; F784-F801 HydrophobicContact CB-CZ 4.33Å; F784-F801 AromaticContact CD1-CE1 3.96Å; F784-F801 HydrophobicContact CD1-CE1 3.96Å; F784-F801 HydrophobicContact CD1-CE2 4.38Å; F784-F801 AromaticContact CD1-CZ 3.35Å; F784-F801 HydrophobicContact CD1-CZ 3.35Å; F784-F801 HydrophobicContact CE1-CE2 4.35Å; F784-F801 AromaticContact CE1-CZ 3.69Å; F784-F801 HydrophobicContact CE1-CZ 3.69Å; F784-F801 AromaticContact CG-CZ 3.92Å; F784-F801 HydrophobicContact CG-CZ 3.92Å; E799-F801 HydrophobicContact CB-CE2 3.99Å; E799-F801 HydrophobicContact CB-CZ 4.33Å; F801-Y803 HydrophobicContact CB-CD2 4.09Å; F801-Y803 HydrophobicContact CB-CE2 3.57Å; F801-Y803 HydrophobicContact CG-CE2 4.47Å; F801-I915 PolarHBondContact N-O 2.69Å; F801-I915 PolarHBondContact O-N 2.88Å; F801-L917 HydrophobicContact CD2-CB 4.3Å; F801-L917 HydrophobicContact CE2-CB 3.79Å; F801-L917 HydrophobicContact CE2-CD1 4.12Å; F801-V955 HydrophobicContact CD1-CG1 4.05Å; F801-V955 HydrophobicContact CD1-CG2 4.35Å; F801-V955 HydrophobicContact CE1-CG1 3.63Å; F801-V955 HydrophobicContact CZ-CG1 4.08Å
802	N	89.1	Confident	78	Confident	79 Å²	79	49.6 Å²	49.6	42%	0.422	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	112.8	173.1	-67.7	-28	0	0	0	109.2	V779 T780 L913	V779-N802 WeakPolarHBondContact CA-O 3.16Å; T780-N802 PolarHBondContact N-O 3.02Å; T780-N802 PolarHBondContact O-N 3.41Å; T780-N802 PolarHBondContact OG1-O 2.82Å; N802-L913 CarbonylContact C-O 3.27Å; N802-L913 WeakPolarHBondContact CA-O 3.22Å
803	Y	87.3	Confident	79.3	Confident	4 Å²	4	45.1 Å²	45.1	2%	0.016	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	137	173.5	-69.4	-108.8	0	0	0	109.2	V779 F801 Q912 L913 I915 D933 V953 V955	V779-Y803 HydrophobicContact CB-CD1 4.02Å; V779-Y803 HydrophobicContact CB-CE1 4.05Å; V779-Y803 HydrophobicContact CB-CG 4.38Å; V779-Y803 HydrophobicContact CG2-CD1 4Å; V779-Y803 HydrophobicContact CG2-CD2 3.9Å; V779-Y803 HydrophobicContact CG2-CE1 3.84Å; V779-Y803 HydrophobicContact CG2-CE2 3.72Å; V779-Y803 HydrophobicContact CG2-CG 4.04Å; F801-Y803 HydrophobicContact CB-CD2 4.09Å; F801-Y803 HydrophobicContact CB-CE2 3.57Å; F801-Y803 HydrophobicContact CG-CE2 4.47Å; Y803-Q912 CarbonylContact O-C 3.56Å; Y803-Q912 VanDerWaalsContact O-CA 3.3Å; Y803-Q912 WeakPolarHBondContact O-CA 3.49Å; Y803-L913 PolarHBondContact N-O 3.29Å; Y803-L913 PolarHBondContact O-N 3.01Å; Y803-I915 HydrophobicContact CD2-CB 4.42Å; Y803-I915 HydrophobicContact CD2-CD1 3.6Å; Y803-I915 HydrophobicContact CD2-CG1 4.11Å; Y803-I915 HydrophobicContact CE2-CB 4.25Å; Y803-I915 HydrophobicContact CE2-CD1 3.63Å; Y803-I915 HydrophobicContact CE2-CG1 4.28Å; Y803-I915 HydrophobicContact CG-CD1 4.33Å; Y803-D933 HydrophobicContact CE1-CB 4.19Å; Y803-V953 HydrophobicContact CD1-CG1 4.1Å; Y803-V953 HydrophobicContact CE1-CG1 4.04Å; Y803-V955 HydrophobicContact CE1-CG2 4.38Å; Y803-V955 VanDerWaalsContact OH-CG2 3.24Å; Y803-V955 WeakPolarHBondContact OH-CG2 3.46Å
804	T	87.7	Confident	80.5	Confident	19 Å²	19	45.8 Å²	45.8	12%	0.117	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	124.2	174.1	-56	0	0	0	0	109.7	G777 F778 I911 Q912	G777-T804 CarbonylContact C-O 3.56Å; G777-T804 VanDerWaalsContact CA-O 3.3Å; G777-T804 WeakPolarHBondContact CA-O 3.44Å; F778-T804 HydrophobicContact CD2-CG2 4.36Å; F778-T804 HydrophobicContact CE1-CG2 3.98Å; F778-T804 HydrophobicContact CE2-CG2 3.49Å; F778-T804 VanDerWaalsContact CE2-CG2 3.49Å; F778-T804 HydrophobicContact CZ-CG2 3.24Å; F778-T804 PolarHBondContact N-O 3.41Å; F778-T804 PolarHBondContact O-N 3.4Å; T804-I911 CarbonylContact C-O 3.59Å; T804-I911 WeakPolarHBondContact CA-O 3.49Å; T804-Q912 HydrophobicContact CG2-CG 4.16Å
805	F	87.7	Confident	81.7	Confident	1 Å²	1	40.2 Å²	40.2	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	125.8	173.5	-62.1	-90	0	0	0	109.6	I775 H776 I822 T910 I911 L913 A936 V953	I775-F805 HydrophobicContact CG2-CD1 4.45Å; H776-F805 CarbonylContact O-C 3.56Å; H776-F805 WeakPolarHBondContact O-CA 3.49Å; F805-I822 HydrophobicContact CD2-CD1 3.62Å; F805-I822 HydrophobicContact CE2-CD1 3.8Å; F805-I822 HydrophobicContact CE2-CG1 4.4Å; F805-I822 HydrophobicContact CE2-CG2 3.97Å; F805-I822 HydrophobicContact CG-CD1 4.15Å; F805-I822 HydrophobicContact CZ-CD1 4.45Å; F805-I822 HydrophobicContact CZ-CG2 3.94Å; F805-T910 CarbonylContact O-C 3.56Å; F805-T910 VanDerWaalsContact O-CA 3.27Å; F805-T910 WeakPolarHBondContact O-CA 3.28Å; F805-I911 HydrophobicContact CB-CB 4.33Å; F805-I911 PolarHBondContact N-O 3Å; F805-I911 PolarHBondContact O-N 3.41Å; F805-L913 HydrophobicContact CD2-CD1 4.4Å; F805-L913 HydrophobicContact CE2-CD1 3.9Å; F805-A936 HydrophobicContact CD1-CB 3.97Å; F805-A936 HydrophobicContact CE1-CB 4.16Å; F805-V953 HydrophobicContact CE1-CG2 4Å; F805-V953 HydrophobicContact CZ-CG2 4.39Å
806	K	87.4	Confident	82.6	Confident	81 Å²	81	38 Å²	38	35%	0.352	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	116.5	174.6	-179.9	169.4	167.9	132.7	0	109	I775 H776 D908 A909 T910	I775-K806 CarbonylContact C-O 3.54Å; I775-K806 WeakPolarHBondContact CA-O 3.04Å; H776-K806 PolarHBondContact N-O 3.03Å; H776-K806 PolarHBondContact O-N 3.36Å; K806-D908 WeakPolarHBondContact CE-OD2 3.42Å; K806-D908 HydrophobicContact CG-CB 4.16Å; K806-D908 IonicContact NZ-OD2 2.83Å; K806-D908 PolarHBondContact NZ-OD2 2.99Å; K806-A909 CarbonylContact C-O 3.55Å; K806-A909 WeakPolarHBondContact CA-O 3.37Å; K806-T910 HydrophobicContact CB-CG2 4.44Å; K806-T910 HydrophobicContact CG-CG2 4.43Å
807	V	87.4	Confident	83.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	114.4	-179.8	-176.2	0	0	0	0	108.1	I773 N774 I775 V820 L900 L903 D908 A909 V938	I773-V807 HydrophobicContact CG2-CG1 3.59Å; N774-V807 CarbonylContact O-C 3.52Å; I775-V807 HydrophobicContact CG1-CG1 4.32Å; I775-V807 HydrophobicContact CG1-CG2 4.23Å; I775-V807 HydrophobicContact CG2-CG2 4.17Å; V807-V820 HydrophobicContact CG2-CG2 3.93Å; V807-L900 HydrophobicContact CB-CD1 4.26Å; V807-L900 HydrophobicContact CG1-CD1 4.37Å; V807-L900 HydrophobicContact CG2-CD1 4.19Å; V807-L903 HydrophobicContact CG1-CD2 4.23Å; V807-D908 CarbonylContact O-C 3.59Å; V807-D908 WeakPolarHBondContact O-CA 3.35Å; V807-A909 PolarHBondContact N-O 3.48Å; V807-A909 PolarHBondContact O-N 3.34Å; V807-V938 HydrophobicContact CG1-CG2 4.37Å
808	L	86.4	Confident	83.7	Confident	50 Å²	50	40.1 Å²	40.1	26%	0.262	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	129.7	-176.6	175.1	67.3	0	0	0	110.1	I773 N774 S810 D908	I773-L808 WeakPolarHBondContact CA-O 3.48Å; N774-L808 PolarHBondContact N-O 3.13Å; N774-L808 PolarHBondContact O-N 3.07Å; L808-S810 PolarHBondContact O-N 3.04Å; L808-D908 HydrophobicContact CD1-CB 4.16Å
809	N	86.9	Confident	84.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	100.4	167.5	-176.3	13	0	0	0	110	G772 G811 S813 L903 D904 G906 R907	G772-N809 CarbonylContact O-C 3.51Å; G772-N809 PolarHBondContact O-OD1 2.93Å; N809-G811 PolarHBondContact OD1-N 3.2Å; N809-G811 VanDerWaalsContact OD1-N 3.08Å; N809-S813 PolarHBondContact ND2-O 2.82Å; N809-L903 HydrophobicContact CB-CD2 3.91Å; N809-L903 HydrophobicContact CB-CG 4.06Å; N809-L903 PolarHBondContact ND2-O 3.15Å; N809-L903 VanDerWaalsContact ND2-O 3.11Å; N809-D904 WeakPolarHBondContact CB-O 3.43Å; N809-D904 PolarHBondContact ND2-O 3.01Å; N809-G906 WeakPolarHBondContact O-CA 3.49Å; N809-G906 PolarHBondContact O-N 1.99Å; N809-R907 PolarHBondContact N-O 3.34Å; N809-R907 VanDerWaalsContact N-O 3.13Å
810	S	82.4	Confident	84.3	Confident	68 Å²	68	35.7 Å²	35.7	48%	0.476	19%	0.189	S	C	.	.			trans	-87.8	-0.2	173.2	59.3	0	0	0	0	113.8	G772 N774 L808	G772-S810 CarbonylContact O-C 3.59Å; G772-S810 WeakPolarHBondContact O-CA 3.34Å; G772-S810 PolarHBondContact O-N 3.08Å; G772-S810 PolarHBondContact O-OG 3.1Å; G772-S810 VanDerWaalsContact O-OG 3.08Å; N774-S810 PolarHBondContact ND2-OG 2.73Å; L808-S810 PolarHBondContact O-N 3.04Å
811	G	80.7	Confident	84.2	Confident	8 Å²	8	32.8 Å²	32.8	8%	0.082	18%	0.177	C	C	.	.	S	Bend	trans	-75.6	158	176.4	0	0	0	0	0	112.8	G772 N809 S813 A905	G772-G811 PolarHBondContact O-N 3.46Å; N809-G811 PolarHBondContact OD1-N 3.2Å; N809-G811 VanDerWaalsContact OD1-N 3.08Å; G811-S813 VanDerWaalsContact C-N 3.25Å; G811-S813 PolarHBondContact O-N 3.19Å; G811-A905 WeakPolarHBondContact O-CB 3.49Å
812	P	79	Confident	84	Confident	57 Å²	57	32.7 Å²	32.7	37%	0.37	18%	0.177	S	C	.	.	S	Bend	trans	-67.4	-23.8	174.5	27.5	-36.2	0	0	0	113.3	A646 L647 G770	A646-P812 HydrophobicContact CB-CG 4.32Å; L647-P812 CarbonylContact O-C 3.54Å; L647-P812 VanDerWaalsContact O-C 3.27Å; G770-P812 WeakPolarHBondContact O-CD 3.08Å; G770-P812 WeakPolarHBondContact O-CG 3.26Å
813	S	80.8	Confident	83.6	Confident	3 Å²	3	29.5 Å²	29.5	2%	0.021	16%	0.162	C	C	.	.	S	Bend	trans	-104.5	155.6	-178.2	-50.7	0	0	0	0	113.6	L647 G770 N809 G811	L647-S813 WeakPolarHBondContact CB-OG 3.25Å; L647-S813 PolarHBondContact N-OG 2.86Å; L647-S813 PolarHBondContact O-N 2.8Å; L647-S813 PolarHBondContact O-OG 3.1Å; G770-S813 PolarHBondContact N-OG 3.47Å; G770-S813 WeakPolarHBondContact O-CB 3.48Å; G770-S813 PolarHBondContact O-N 3.08Å; G770-S813 PolarHBondContact O-OG 2.92Å; N809-S813 PolarHBondContact ND2-O 2.82Å; G811-S813 VanDerWaalsContact C-N 3.25Å; G811-S813 PolarHBondContact O-N 3.19Å
814	K	81.3	Confident	83.3	Confident	79 Å²	79	29.7 Å²	29.7	34%	0.343	16%	0.163	S	C	.	.	P	Polyproline II helix	trans	-61.1	133.3	166.5	-177.3	172.3	-172.1	141.8	0	111.4	N902 L903 D904	K814-N902 HydrophobicContact CD-CB 4.31Å; K814-N902 HydrophobicContact CG-CB 4.45Å; K814-L903 WeakPolarHBondContact CA-O 3.46Å; K814-D904 WeakPolarHBondContact CD-OD1 3.37Å; K814-D904 WeakPolarHBondContact CE-OD1 3.49Å; K814-D904 IonicContact NZ-OD1 3.97Å; K814-D904 PolarHBondContact NZ-OD1 3.31Å
815	A	81.8	Confident	83	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	124	173.2	0	0	0	0	0	110.3	V771 I773 T818 N902 L903	V771-A815 HydrophobicContact CG1-CB 3.61Å; V771-A815 HydrophobicContact CG2-CB 4.23Å; I773-A815 HydrophobicContact CD1-CB 3.8Å; I773-A815 HydrophobicContact CG1-CB 4.36Å; A815-T818 WeakPolarHBondContact CB-OG1 2.99Å; A815-N902 CarbonylContact O-C 3.59Å; A815-N902 VanDerWaalsContact O-CA 3.29Å; A815-N902 WeakPolarHBondContact O-CA 3.36Å; A815-L903 HydrophobicContact CB-CB 4.39Å; A815-L903 PolarHBondContact N-O 2.94Å; A815-L903 PolarHBondContact O-N 3.33Å
816	L	80.3	Confident	82.5	Confident	66 Å²	66	30.8 Å²	30.8	35%	0.346	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	134.9	180	-62.7	175.6	0	0	0	111.1	T818 N902	L816-T818 PolarHBondContact O-N 2.81Å; L816-N902 WeakPolarHBondContact CA-OD1 3.24Å; L816-N902 HydrophobicContact CD2-CB 4.4Å
817	N	80.3	Confident	82.1	Confident	91 Å²	91	27.8 Å²	27.8	49%	0.487	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	48	56.4	176.4	-68.7	-27.2	0	0	0	113.5	V819 G901 N902	N817-V819 PolarHBondContact O-N 2.86Å; N817-G901 CarbonylContact C-O 3.5Å; N817-G901 WeakPolarHBondContact CA-O 3.41Å; N817-G901 PolarHBondContact N-O 3.38Å; N817-N902 PolarHBondContact N-OD1 2.9Å
818	T	83.8	Confident	81.6	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	121.5	176.4	-55.1	0	0	0	0	110.3	I773 A815 L816 L900 G901 V938	I773-T818 HydrophobicContact CD1-CG2 3.93Å; A815-T818 WeakPolarHBondContact CB-OG1 2.99Å; L816-T818 PolarHBondContact O-N 2.81Å; T818-L900 HydrophobicContact CG2-CD1 4.46Å; T818-L900 PolarHBondContact O-N 2.85Å; T818-G901 PolarHBondContact N-O 3.29Å; T818-V938 HydrophobicContact CG2-CG1 3.81Å
819	V	84.8	Confident	80.9	Confident	30 Å²	30	27.3 Å²	27.3	18%	0.182	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	126.6	176.8	-178.5	0	0	0	0	109.1	N817 Q821 V897 C898 R899 V938 K939	N817-V819 PolarHBondContact O-N 2.86Å; V819-Q821 HydrophobicContact CG1-CG 4.47Å; V819-V897 HydrophobicContact CG1-CG1 3.69Å; V819-C898 CarbonylContact C-O 3.43Å; V819-C898 WeakPolarHBondContact CA-O 3.48Å; V819-R899 HydrophobicContact CG2-CG 4.38Å; V819-V938 CarbonylContact O-C 3.56Å; V819-V938 VanDerWaalsContact O-CA 3.25Å; V819-V938 WeakPolarHBondContact O-CA 3.4Å; V819-K939 PolarHBondContact N-O 3.04Å; V819-K939 PolarHBondContact O-N 3.27Å
820	V	84.5	Confident	80	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	129.8	176.5	-172.9	0	0	0	0	108.8	V807 I822 C898 L900 I911 A936 L937 V938	V807-V820 HydrophobicContact CG2-CG2 3.93Å; V820-I822 HydrophobicContact CG1-CG1 4.14Å; V820-C898 HydrophobicContact CB-CB 4.27Å; V820-C898 PolarHBondContact N-O 2.82Å; V820-C898 PolarHBondContact O-N 2.95Å; V820-L900 HydrophobicContact CG2-CD1 3.53Å; V820-L900 HydrophobicContact CG2-CG 4.12Å; V820-I911 HydrophobicContact CB-CD1 4.02Å; V820-I911 HydrophobicContact CG1-CD1 4.06Å; V820-I911 HydrophobicContact CG2-CD1 4.12Å; V820-A936 HydrophobicContact CG1-CB 3.82Å; V820-L937 CarbonylContact C-O 3.58Å; V820-L937 WeakPolarHBondContact CA-O 3.44Å; V820-V938 HydrophobicContact CG2-CG2 3.83Å
821	Q	82.2	Confident	79.6	Confident	50 Å²	50	32.1 Å²	32.1	23%	0.234	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	119.7	175.8	-54.3	-169.9	-60	0	0	109.4	V819 L896 A936 L937	V819-Q821 HydrophobicContact CG1-CG 4.47Å; Q821-L896 WeakPolarHBondContact CA-O 3Å; Q821-A936 CarbonylContact O-C 3.52Å; Q821-A936 VanDerWaalsContact O-CA 3.27Å; Q821-A936 WeakPolarHBondContact O-CA 3.27Å; Q821-L937 HydrophobicContact CB-CB 4.41Å; Q821-L937 PolarHBondContact N-O 3.42Å; Q821-L937 PolarHBondContact O-N 3.28Å
822	I	82.6	Confident	79.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	134.4	179	-56.4	168.1	0	0	0	107.6	F805 V820 Q895 L896 I911 L913 A936	F805-I822 HydrophobicContact CD2-CD1 3.62Å; F805-I822 HydrophobicContact CE2-CD1 3.8Å; F805-I822 HydrophobicContact CE2-CG1 4.4Å; F805-I822 HydrophobicContact CE2-CG2 3.97Å; F805-I822 HydrophobicContact CG-CD1 4.15Å; F805-I822 HydrophobicContact CZ-CD1 4.45Å; F805-I822 HydrophobicContact CZ-CG2 3.94Å; V820-I822 HydrophobicContact CG1-CG1 4.14Å; I822-Q895 CarbonylContact O-C 3.56Å; I822-Q895 WeakPolarHBondContact O-CA 3.16Å; I822-L896 HydrophobicContact CB-CB 4.45Å; I822-L896 PolarHBondContact N-O 2.86Å; I822-L896 PolarHBondContact O-N 3.03Å; I822-I911 HydrophobicContact CD1-CD1 4.29Å; I822-I911 HydrophobicContact CD1-CG2 4.06Å; I822-L913 HydrophobicContact CD1-CD1 4.13Å; I822-L913 HydrophobicContact CG2-CD1 4.18Å; I822-A936 HydrophobicContact CG1-CB 4.12Å
823	A	80.4	Confident	79.2	Confident	13 Å²	13	33.4 Å²	33.4	11%	0.107	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	111.5	-171.7	0	0	0	0	0	111.8	C886 E894 Q895	A823-C886 HydrophobicContact CB-CB 4.09Å; A823-E894 WeakPolarHBondContact CA-O 3.43Å; A823-Q895 HydrophobicContact CB-CG 4.11Å
824	L	80.9	Confident	79.2	Confident	8 Å²	8	34.5 Å²	34.5	4%	0.042	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	138.2	-171.2	-63.9	163.8	0	0	0	111.8	K826 L838 C893 E894 I915 D933	L824-K826 PolarHBondContact O-N 2.97Å; L824-L838 HydrophobicContact CD1-CD1 4.29Å; L824-C893 CarbonylContact O-C 3.53Å; L824-C893 WeakPolarHBondContact O-CA 3.39Å; L824-C893 WeakPolarHBondContact O-CB 3.38Å; L824-E894 PolarHBondContact N-O 2.87Å; L824-E894 PolarHBondContact O-N 3.47Å; L824-I915 HydrophobicContact CD1-CD1 3.47Å; L824-I915 VanDerWaalsContact CD1-CD1 3.47Å; L824-I915 HydrophobicContact CD1-CG1 4.42Å; L824-I915 HydrophobicContact CD2-CD1 3.55Å; L824-I915 HydrophobicContact CG-CD1 4.14Å; L824-D933 WeakPolarHBondContact CD2-OD2 3.47Å
825	P	80.9	Confident	79.1	Confident	6 Å²	6	30.7 Å²	30.7	4%	0.039	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	117.1	179.8	26.5	-30.9	0	0	0	111.3	L836 C886 I931	P825-L836 HydrophobicContact CG-CD1 3.87Å; P825-L836 WeakPolarHBondContact O-CB 3.14Å; P825-L836 WeakPolarHBondContact O-CD1 3.47Å; P825-L836 WeakPolarHBondContact O-CG 3.45Å; P825-C886 WeakPolarHBondContact CA-SG 3.49Å; P825-I931 HydrophobicContact CG-CG2 3.82Å
826	K	78.6	Confident	79.1	Confident	37 Å²	37	31 Å²	31	16%	0.161	17%	0.174	C	C	.	.			trans	-87	-31.8	-174.2	-171	-178.5	-176.4	-176.8	0	113	L824 R834 L835 V857 L892 E894	L824-K826 PolarHBondContact O-N 2.97Å; K826-R834 HydrophobicContact CG-CG 4.47Å; K826-L835 PolarHBondContact O-N 3.48Å; K826-V857 HydrophobicContact CD-CG2 4.02Å; K826-L892 WeakPolarHBondContact CB-O 3.41Å; K826-L892 PolarHBondContact N-O 2.66Å; K826-E894 HydrophobicContact CB-CB 4.4Å
827	I	78.2	Confident	79.2	Confident	17 Å²	17	30.8 Å²	30.8	9%	0.087	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-137.9	142.4	-169.1	-53.1	174.5	0	0	0	110.3	Y831 V857	I827-Y831 WeakPolarHBondContact CG2-O 3.32Å; I827-V857 HydrophobicContact CD1-CG1 4.28Å; I827-V857 HydrophobicContact CD1-CG2 3.57Å; I827-V857 HydrophobicContact CG1-CG1 4.2Å; I827-V857 HydrophobicContact CG1-CG2 4.1Å
828	L	77.6	Confident	79.4	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.005	15%	0.153	C	C	.	.			trans	-90.6	96.4	169.6	-178.7	69.6	0	0	0	110.3	Y831 M884 V921 L922	L828-Y831 HydrophobicContact CD2-CD2 4.36Å; L828-Y831 WeakPolarHBondContact O-CB 3.03Å; L828-Y831 PolarHBondContact O-N 2.93Å; L828-M884 HydrophobicContact CD1-CG 4.26Å; L828-M884 HydrophobicContact CD1-SD 3.37Å; L828-M884 WeakPolarHBondContact CD1-SD 2.87Å; L828-V921 HydrophobicContact CB-CG1 3.93Å; L828-V921 HydrophobicContact CD2-CG1 4.4Å; L828-V921 WeakPolarHBondContact CD2-O 3.25Å; L828-L922 HydrophobicContact CD2-CD2 4.39Å
829	A	70.1	Confident	79.4	Confident	39 Å²	39	30.8 Å²	30.8	32%	0.322	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	137.2	178.1	0	0	0	0	0	112	R882 L892	A829-R882 PolarHBondContact O-NH2 2.91Å; A829-L892 HydrophobicContact CB-CD1 4.08Å
830	P	68.7	Low	79.5	Confident	110 Å²	110	32.4 Å²	32.4	71%	0.714	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	cis	-91.7	5.2	7.7	37.4	-36.1	0	0	0	115.1
831	Y	73.6	Confident	79.7	Confident	59 Å²	59	36.3 Å²	36.3	23%	0.231	19%	0.193	C	C	.	.			trans	-80.6	122.6	-172	-54.8	-68.3	0	0	0	111.2	I827 L828 H833 E924	I827-Y831 WeakPolarHBondContact CG2-O 3.32Å; L828-Y831 HydrophobicContact CD2-CD2 4.36Å; L828-Y831 WeakPolarHBondContact O-CB 3.03Å; L828-Y831 PolarHBondContact O-N 2.93Å; Y831-H833 PolarHBondContact O-N 3.48Å; Y831-E924 WeakPolarHBondContact CB-OE2 2.97Å; Y831-E924 WeakPolarHBondContact CD1-OE2 2.86Å; Y831-E924 HydrophobicContact CD2-CB 4.18Å; Y831-E924 WeakPolarHBondContact CD2-OE2 3.26Å; Y831-E924 HydrophobicContact CE1-CB 4.24Å; Y831-E924 WeakPolarHBondContact CE1-OE2 3.38Å; Y831-E924 HydrophobicContact CE2-CB 3.74Å; Y831-E924 PolarHBondContact OH-O 3.15Å
832	P	74.2	Confident	80	Confident	76 Å²	76	40.2 Å²	40.2	49%	0.494	21%	0.209	S	C	.	.			trans	-82.6	29.9	-171.8	35.3	-37.2	0	0	0	113.9	N858	P832-N858 WeakPolarHBondContact O-CB 3.27Å; P832-N858 PolarHBondContact O-N 3.42Å
833	H	78.3	Confident	80.3	Confident	17 Å²	17	41.8 Å²	41.8	8%	0.079	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-97.3	143.7	178.6	-67.4	-78.9	0	0	0	111.3	Y831 L835 V921	Y831-H833 PolarHBondContact O-N 3.48Å; H833-L835 PolarHBondContact O-N 3.15Å; H833-V921 HydrophobicContact CB-CG1 4.28Å; H833-V921 HydrophobicContact CB-CG2 3.64Å
834	R	79.5	Confident	80.6	Confident	25 Å²	25	44.1 Å²	44.1	9%	0.094	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-68.7	119.6	177.7	-167.2	171.1	-167	158.2	1.4	110.1	K826 L836 V857 N858 E859 E894	K826-R834 HydrophobicContact CG-CG 4.47Å; R834-L836 WeakPolarHBondContact CG-O 3.37Å; R834-L836 PolarHBondContact NE-O 2.83Å; R834-L836 VanDerWaalsContact NE-O 3.12Å; R834-V857 HydrophobicContact CB-CG1 3.71Å; R834-V857 HydrophobicContact CG-CG1 4.45Å; R834-N858 PolarHBondContact N-O 2.79Å; R834-E859 IonicContact NH1-OE1 2.69Å; R834-E859 PolarHBondContact NH1-OE1 3.46Å; R834-E894 IonicContact CZ-OE2 3.31Å; R834-E894 IonicContact NH2-OE1 2.8Å; R834-E894 PolarHBondContact NH2-OE1 2.8Å; R834-E894 IonicContact NH2-OE2 3.63Å; R834-E894 PolarHBondContact NH2-OE2 2.83Å
835	L	80.1	Confident	80.6	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.255	C	S	.	.			trans	-87.6	-52.8	178.6	176.6	66.6	0	0	0	111.5	K826 H833 M884 L917 N918 V921 L922	K826-L835 PolarHBondContact O-N 3.48Å; H833-L835 PolarHBondContact O-N 3.15Å; L835-M884 HydrophobicContact CD2-CE 3.4Å; L835-M884 VanDerWaalsContact CD2-CE 3.4Å; L835-M884 HydrophobicContact CD2-SD 3.8Å; L835-L917 HydrophobicContact CD1-CG 4.33Å; L835-L917 WeakPolarHBondContact O-CA 3.43Å; L835-N918 PolarHBondContact O-N 3.03Å; L835-V921 HydrophobicContact CB-CG1 4.45Å; L835-V921 HydrophobicContact CD1-CB 4.06Å; L835-V921 HydrophobicContact CD1-CG1 4.24Å; L835-L922 HydrophobicContact CD1-CD1 4.46Å; L835-L922 HydrophobicContact CD1-CD2 3.61Å; L835-L922 HydrophobicContact CD1-CG 3.79Å; L835-L922 HydrophobicContact CD2-CD2 4.38Å
836	L	81.8	Confident	80.8	Confident	5 Å²	5	50.7 Å²	50.7	3%	0.026	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	137.7	-179.9	-65.5	-179.1	0	0	0	110.8	P825 R834 I915 S916 L917	P825-L836 HydrophobicContact CG-CD1 3.87Å; P825-L836 WeakPolarHBondContact O-CB 3.14Å; P825-L836 WeakPolarHBondContact O-CD1 3.47Å; P825-L836 WeakPolarHBondContact O-CG 3.45Å; R834-L836 WeakPolarHBondContact CG-O 3.37Å; R834-L836 PolarHBondContact NE-O 2.83Å; R834-L836 VanDerWaalsContact NE-O 3.12Å; L836-I915 HydrophobicContact CB-CG2 4.11Å; L836-I915 HydrophobicContact CD1-CG2 4.5Å; L836-I915 HydrophobicContact CD2-CG2 3.94Å; L836-I915 HydrophobicContact CG-CG2 4.42Å; L836-S916 WeakPolarHBondContact CA-O 3.02Å; L836-L917 HydrophobicContact CD2-CB 3.72Å; L836-L917 HydrophobicContact CD2-CD1 3.72Å; L836-L917 HydrophobicContact CD2-CG 3.89Å
837	Q	82.4	Confident	81.1	Confident	63 Å²	63	52.7 Å²	52.7	29%	0.294	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	123.5	172.8	-178.6	176.5	5.9	0	0	109.6	Y797 I839 I915 S916	Y797-Q837 HydrophobicContact CD1-CB 4.18Å; Y797-Q837 HydrophobicContact CE1-CB 3.85Å; Y797-Q837 VanDerWaalsContact CE2-OE1 3.22Å; Q837-I839 PolarHBondContact O-N 2.83Å; Q837-I915 CarbonylContact O-C 3.58Å; Q837-I915 WeakPolarHBondContact O-CA 3.32Å; Q837-S916 PolarHBondContact N-O 2.04Å; Q837-S916 PolarHBondContact O-N 2.77Å
838	L	83.4	Confident	81.6	Confident	18 Å²	18	52.6 Å²	52.6	9%	0.094	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	116.6	170.2	-174.1	66.9	0	0	0	108.5	L824 W841 I850 L896 L913 I915	L824-L838 HydrophobicContact CD1-CD1 4.29Å; L838-W841 HydrophobicContact CD2-CE3 3.59Å; L838-W841 HydrophobicContact CD2-CZ3 3.86Å; L838-W841 HydrophobicContact CG-CE3 3.91Å; L838-W841 HydrophobicContact CG-CZ3 4.25Å; L838-I850 HydrophobicContact CD2-CD1 4.08Å; L838-I850 HydrophobicContact CD2-CG1 4.18Å; L838-L896 HydrophobicContact CD2-CD1 4.09Å; L838-L896 HydrophobicContact CD2-CD2 4.44Å; L838-L913 HydrophobicContact CD1-CB 4.04Å; L838-L913 HydrophobicContact CD1-CD2 4.45Å; L838-I915 HydrophobicContact CD1-CD1 4.34Å; L838-I915 HydrophobicContact CD1-CG1 3.76Å
839	I	84.4	Confident	82.1	Confident	73 Å²	73	55.4 Å²	55.4	37%	0.374	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-56.2	-177.2	-63.3	173.3	0	0	0	110.4	Q837 E914 S916	Q837-I839 PolarHBondContact O-N 2.83Å; I839-E914 HydrophobicContact CB-CB 4.46Å; I839-E914 HydrophobicContact CB-CG 4.34Å; I839-E914 HydrophobicContact CD1-CG 4.29Å; I839-E914 PolarHBondContact N-O 2.85Å; I839-S916 WeakPolarHBondContact CD1-OG 3.38Å
840	D	86.3	Confident	82.8	Confident	64 Å²	64	56.1 Å²	56.1	34%	0.342	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	154.8	-174.5	-168.8	21.2	0	0	0	110.3	K842 E914	D840-K842 VanDerWaalsContact OD2-CE 3.28Å; D840-K842 WeakPolarHBondContact OD2-CE 3.28Å; D840-K842 IonicContact OD2-NZ 3.66Å; D840-E914 HydrophobicContact CB-CB 4.4Å; D840-E914 PolarHBondContact N-O 2.92Å; D840-E914 PolarHBondContact O-N 2.79Å
841	W	88.9	Confident	82.9	Confident	82 Å²	82	52.8 Å²	52.8	31%	0.311	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	136.8	172.4	59.5	83.6	0	0	0	111.1	L838 C848 I850 L896 Q912 L913	L838-W841 HydrophobicContact CD2-CE3 3.59Å; L838-W841 HydrophobicContact CD2-CZ3 3.86Å; L838-W841 HydrophobicContact CG-CE3 3.91Å; L838-W841 HydrophobicContact CG-CZ3 4.25Å; W841-C848 HydrophobicContact CG-CB 4.33Å; W841-C848 PolarHBondContact NE1-O 2.79Å; W841-C848 VanDerWaalsContact NE1-O 3.15Å; W841-I850 HydrophobicContact CH2-CD1 3.86Å; W841-I850 HydrophobicContact CH2-CG1 4.05Å; W841-I850 HydrophobicContact CZ3-CD1 3.81Å; W841-I850 HydrophobicContact CZ3-CG1 4.2Å; W841-L896 HydrophobicContact CB-CD2 4.39Å; W841-L896 HydrophobicContact CD2-CD1 4.17Å; W841-L896 HydrophobicContact CE3-CD1 4.48Å; W841-L896 HydrophobicContact CG-CD1 4.43Å; W841-Q912 CarbonylContact C-O 3.46Å; W841-Q912 VanDerWaalsContact CA-O 3.26Å; W841-Q912 WeakPolarHBondContact CA-O 3.5Å; W841-L913 HydrophobicContact CB-CD2 3.52Å
842	K	88.9	Confident	82.2	Confident	131 Å²	131	56.8 Å²	56.8	57%	0.57	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.4	126.2	176.4	-67.9	177.9	-175.7	164.8	0	109.2	D840 Q912	D840-K842 VanDerWaalsContact OD2-CE 3.28Å; D840-K842 WeakPolarHBondContact OD2-CE 3.28Å; D840-K842 IonicContact OD2-NZ 3.66Å; K842-Q912 HydrophobicContact CB-CB 4.49Å; K842-Q912 PolarHBondContact N-O 2.82Å; K842-Q912 PolarHBondContact O-N 3.42Å
843	S	89.1	Confident	81.4	Confident	33 Å²	33	58.8 Å²	58.8	23%	0.231	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	138.4	170.7	-168.6	0	0	0	0	109.7	H845 L900 T910	S843-H845 PolarHBondContact O-N 2.85Å; S843-H845 PolarHBondContact OG-O 3.35Å; S843-L900 WeakPolarHBondContact OG-CD2 3.28Å; S843-T910 WeakPolarHBondContact CA-O 3.31Å; S843-T910 PolarHBondContact OG-O 3.05Å
844	S	86.6	Confident	80.3	Confident	63 Å²	63	63.7 Å²	63.7	44%	0.441	35%	0.354	S	S	.	.	S	Bend	trans	-71.3	-22.1	174.1	67.2	0	0	0	0	112.8	T910	S844-T910 WeakPolarHBondContact CB-OG1 3.26Å; S844-T910 PolarHBondContact N-O 2.85Å; S844-T910 PolarHBondContact OG-N 2.91Å; S844-T910 PolarHBondContact OG-OG1 3.39Å
845	H	81.3	Confident	79.4	Confident	95 Å²	95	66 Å²	66	44%	0.44	37%	0.368	S	S	.	.	S	Bend	trans	-143.8	131.2	-179.7	-83	71.4	0	0	0	110.9	S843 L900 A909	S843-H845 PolarHBondContact O-N 2.85Å; S843-H845 PolarHBondContact OG-O 3.35Å; H845-L900 WeakPolarHBondContact O-CD2 3.34Å; H845-A909 HydrophobicContact CB-CB 4.43Å
846	G	84.4	Confident	78.3	Confident	57 Å²	57	71.5 Å²	71.5	59%	0.588	41%	0.407	S	S	*	.	S	Bend	trans	78.9	-161.7	177	0	0	0	0	0	114.4	R899	G846-R899 VanDerWaalsContact CA-O 3.26Å; G846-R899 WeakPolarHBondContact CA-O 3.27Å
847	S	85.9	Confident	77.6	Confident	78 Å²	78	72.5 Å²	72.5	55%	0.545	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	139.7	-173.9	64	0	0	0	0	112	R899	S847-R899 PolarHBondContact N-O 2.92Å; S847-R899 VanDerWaalsContact N-O 3.1Å; S847-R899 PolarHBondContact O-N 2.82Å
848	C	88.6	Confident	76.9	Confident	16 Å²	16	72.5 Å²	72.5	11%	0.108	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	145.8	174	-51	0	0	0	0	111.7	W841 L896 V897 C898	W841-C848 HydrophobicContact CG-CB 4.33Å; W841-C848 PolarHBondContact NE1-O 2.79Å; W841-C848 VanDerWaalsContact NE1-O 3.15Å; C848-L896 HydrophobicContact CB-CD1 4.01Å; C848-L896 HydrophobicContact CB-CD2 4.44Å; C848-L896 HydrophobicContact CB-CG 4.23Å; C848-V897 CarbonylContact C-O 3.55Å; C848-V897 VanDerWaalsContact CA-O 3.32Å; C848-V897 WeakPolarHBondContact CA-O 3.39Å; C848-C898 HydrophobicContact CB-CB 4.01Å; C848-C898 WeakPolarHBondContact CB-SG 3.37Å; C848-C898 VanDerWaalsContact SG-CA 3.58Å; C848-C898 WeakPolarHBondContact SG-CB 3.5Å; C848-C898 CovalentContact SG-SG 2.04Å; C848-C898 PolarHBondContact SG-SG 3.42Å
849	S	87.3	Confident	76	Confident	60 Å²	60	77.6 Å²	77.6	42%	0.42	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	143.9	177.6	59	0	0	0	0	110.4	V897	S849-V897 PolarHBondContact N-O 2.82Å; S849-V897 PolarHBondContact O-N 2.82Å
850	I	84.3	Confident	75.1	Confident	54 Å²	54	79 Å²	79	28%	0.277	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	137.1	172.2	-59	171.5	0	0	0	108.6	L838 W841 E894 L896	L838-I850 HydrophobicContact CD2-CD1 4.08Å; L838-I850 HydrophobicContact CD2-CG1 4.18Å; W841-I850 HydrophobicContact CH2-CD1 3.86Å; W841-I850 HydrophobicContact CH2-CG1 4.05Å; W841-I850 HydrophobicContact CZ3-CD1 3.81Å; W841-I850 HydrophobicContact CZ3-CG1 4.2Å; I850-E894 HydrophobicContact CG2-CG 4Å; I850-L896 HydrophobicContact CG1-CD1 4.03Å
851	S	71.4	Confident	74	Confident	40 Å²	40	78 Å²	78	28%	0.28	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	116.5	174.1	66.9	0	0	0	0	110.8	K853 Q895	S851-K853 PolarHBondContact O-N 2.85Å; S851-Q895 PolarHBondContact N-O 2.73Å; S851-Q895 VanDerWaalsContact OG-CB 3.28Å; S851-Q895 WeakPolarHBondContact OG-CB 3.29Å; S851-Q895 PolarHBondContact OG-O 2.89Å
852	D	59.6	Low	72.7	Confident	143 Å²	143	81 Å²	81	77%	0.765	47%	0.466	S	S	*	.			trans	-68.4	109.6	-177.6	-80.2	-30.5	0	0	0	112.7
853	K	57.2	Low	71.5	Confident	118 Å²	118	75.7 Å²	75.7	51%	0.513	44%	0.444	S	S	.	.			trans	-130.7	90.5	159.9	-70	-175.4	-179	177.1	0	107.5	S851 I855	S851-K853 PolarHBondContact O-N 2.85Å; K853-I855 PolarHBondContact O-N 2.83Å
854	T	54.7	Low	70.2	Confident	119 Å²	119	77.9 Å²	77.9	73%	0.73	46%	0.458	S	S	*	.			trans	-87.2	111.7	-170.3	52.2	0	0	0	0	111.7
855	I	60.1	Low	68.9	Low	74 Å²	74	83.1 Å²	83.1	38%	0.379	48%	0.475	S	S	.	.			trans	-88.3	141.3	144.3	-63.2	177.8	0	0	0	106.7	K853 V857 N891	K853-I855 PolarHBondContact O-N 2.83Å; I855-V857 WeakPolarHBondContact O-CG2 3.4Å; I855-V857 PolarHBondContact O-N 2.85Å; I855-N891 HydrophobicContact CD1-CB 3.61Å; I855-N891 HydrophobicContact CG1-CB 4.35Å
856	S	58.3	Low	68	Low	116 Å²	116	80 Å²	80	81%	0.811	47%	0.466	S	S	*	.			trans	-64.2	112.2	170.5	53.8	0	0	0	0	109.5
857	V	66.6	Low	67.2	Low	25 Å²	25	80.3 Å²	80.3	15%	0.152	46%	0.46	C	S	.	.			trans	-101.3	139.2	177.1	-173.9	0	0	0	0	108.3	K826 I827 R834 I855 E859	K826-V857 HydrophobicContact CD-CG2 4.02Å; I827-V857 HydrophobicContact CD1-CG1 4.28Å; I827-V857 HydrophobicContact CD1-CG2 3.57Å; I827-V857 HydrophobicContact CG1-CG1 4.2Å; I827-V857 HydrophobicContact CG1-CG2 4.1Å; R834-V857 HydrophobicContact CB-CG1 3.71Å; R834-V857 HydrophobicContact CG-CG1 4.45Å; I855-V857 WeakPolarHBondContact O-CG2 3.4Å; I855-V857 PolarHBondContact O-N 2.85Å; V857-E859 PolarHBondContact O-N 3Å
858	N	66.9	Low	66.3	Low	64 Å²	64	80.8 Å²	80.8	34%	0.342	45%	0.452	S	S	.	.	B	Isolated β-bridge	trans	-77.5	117.5	172.8	-164.5	0.9	0	0	0	109.3	P832 R834 D860	P832-N858 WeakPolarHBondContact O-CB 3.27Å; P832-N858 PolarHBondContact O-N 3.42Å; R834-N858 PolarHBondContact N-O 2.79Å; N858-D860 VanDerWaalsContact C-N 3.35Å; N858-D860 WeakPolarHBondContact OD1-CB 3.47Å; N858-D860 PolarHBondContact OD1-N 3.07Å; N858-D860 VanDerWaalsContact OD1-N 3.15Å; N858-D860 PolarHBondContact OD1-OD2 2.88Å
859	E	66.3	Low	65.3	Low	124 Å²	124	85.7 Å²	85.7	58%	0.579	48%	0.476	S	S	*	.			trans	-92.2	2	178.7	-60.5	-167.5	151.5	0	0	112.3	R834 V857 C861	R834-E859 IonicContact NH1-OE1 2.69Å; R834-E859 PolarHBondContact NH1-OE1 3.46Å; V857-E859 PolarHBondContact O-N 3Å; E859-C861 PolarHBondContact O-N 3.17Å
860	D	64.4	Low	64.3	Low	104 Å²	104	87.6 Å²	87.6	56%	0.556	48%	0.477	S	S	*	.			trans	-63.9	128.5	175.8	-74.9	-24.9	0	0	0	111.6	N858 N862	N858-D860 VanDerWaalsContact C-N 3.35Å; N858-D860 WeakPolarHBondContact OD1-CB 3.47Å; N858-D860 PolarHBondContact OD1-N 3.07Å; N858-D860 VanDerWaalsContact OD1-N 3.15Å; N858-D860 PolarHBondContact OD1-OD2 2.88Å; D860-N862 VanDerWaalsContact C-N 3.26Å; D860-N862 PolarHBondContact O-N 2.89Å
861	C	62.6	Low	63.5	Low	42 Å²	42	86.8 Å²	86.8	28%	0.284	47%	0.472	S	S	.	.	S	Bend	trans	-75.1	-14	177.8	-56.2	0	0	0	0	114.2	C796 E859 V863	C796-C861 HydrophobicContact CB-CB 3.65Å; C796-C861 WeakPolarHBondContact CB-SG 3.22Å; C796-C861 WeakPolarHBondContact SG-CB 3.38Å; C796-C861 CovalentContact SG-SG 1.99Å; C796-C861 PolarHBondContact SG-SG 2.82Å; E859-C861 PolarHBondContact O-N 3.17Å; C861-V863 VanDerWaalsContact C-N 3.26Å; C861-V863 PolarHBondContact O-N 2.88Å
862	N	62.4	Low	63.4	Low	146 Å²	146	86.5 Å²	86.5	78%	0.781	47%	0.466	S	S	*	.			trans	-82.3	74.6	177.9	-72.7	-22.9	0	0	0	109.8	D860	D860-N862 VanDerWaalsContact C-N 3.26Å; D860-N862 PolarHBondContact O-N 2.89Å
863	V	63.2	Low	63.9	Low	18 Å²	18	84.1 Å²	84.1	11%	0.109	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-70.2	133.5	170.5	-172.6	0	0	0	0	108.3	C861 Q865 A920 V921 E924	C861-V863 VanDerWaalsContact C-N 3.26Å; C861-V863 PolarHBondContact O-N 2.88Å; V863-Q865 PolarHBondContact O-N 2.83Å; V863-A920 HydrophobicContact CB-CB 4.17Å; V863-A920 HydrophobicContact CG2-CB 3.93Å; V863-V921 HydrophobicContact CG2-CG2 4.19Å; V863-E924 HydrophobicContact CG1-CG 3.82Å
864	P	61.7	Low	64.4	Low	80 Å²	80	81 Å²	81	52%	0.519	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-62.1	123.9	-178.9	3.7	-2	0	0	0	111.4
865	Q	60.6	Low	65.1	Low	172 Å²	172	78.7 Å²	78.7	80%	0.804	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-63	141.4	176.4	-71.9	-178.8	-22.7	0	0	111.3	V863 S867	V863-Q865 PolarHBondContact O-N 2.83Å; Q865-S867 PolarHBondContact O-N 2.85Å
866	A	62.2	Low	65.6	Low	30 Å²	30	82 Å²	82	25%	0.248	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-58.4	139.5	175.1	0	0	0	0	0	110.7	K870 Q871 F874	A866-K870 HydrophobicContact CB-CB 4.31Å; A866-Q871 HydrophobicContact CB-CG 4.38Å; A866-F874 HydrophobicContact CB-CE2 4.42Å
867	S	66.8	Low	66.1	Low	64 Å²	64	78.8 Å²	78.8	45%	0.448	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-63.1	149.8	177	66.4	0	0	0	0	111.2	Q865 I869 K870 Q871	Q865-S867 PolarHBondContact O-N 2.85Å; S867-I869 PolarHBondContact O-N 3.43Å; S867-K870 WeakPolarHBondContact O-CA 3.36Å; S867-K870 WeakPolarHBondContact O-CB 3.3Å; S867-K870 PolarHBondContact O-N 3.46Å; S867-Q871 PolarHBondContact O-N 2.87Å; S867-Q871 VanDerWaalsContact O-N 3.09Å
868	F	66.8	Low	66.1	Low	88 Å²	88	82.9 Å²	82.9	39%	0.386	44%	0.436	S	S	.	.	H	α-helix	trans	-50.6	-35.2	179.2	175.3	-107.1	0	0	0	113.5	Q871 I872 A966 F970	F868-Q871 PolarHBondContact O-N 2.86Å; F868-I872 HydrophobicContact CD1-CD1 4.13Å; F868-I872 HydrophobicContact CE1-CD1 3.54Å; F868-I872 HydrophobicContact CE2-CD1 4.26Å; F868-I872 HydrophobicContact CZ-CD1 3.62Å; F868-I872 HydrophobicContact CZ-CG1 4.38Å; F868-I872 PolarHBondContact O-N 3.37Å; F868-A966 HydrophobicContact CD2-CB 3.91Å; F868-A966 HydrophobicContact CE2-CB 3.67Å; F868-F970 HydrophobicContact CE1-CD2 4.38Å; F868-F970 HydrophobicContact CZ-CB 4.02Å; F868-F970 HydrophobicContact CZ-CD2 4.03Å; F868-F970 HydrophobicContact CZ-CG 4.11Å
869	I	67.9	Low	66	Low	119 Å²	119	83 Å²	83	61%	0.61	44%	0.439	S	S	*	.	H	α-helix	trans	-65.9	-42.4	176	-60.7	174.1	0	0	0	111.2	S867 I872 I873	S867-I869 PolarHBondContact O-N 3.43Å; I869-I872 PolarHBondContact O-N 3.31Å; I869-I873 HydrophobicContact CG2-CD1 3.99Å; I869-I873 WeakPolarHBondContact O-CG1 3.3Å; I869-I873 PolarHBondContact O-N 3.25Å; I869-I873 VanDerWaalsContact O-N 3.11Å
870	K	67	Low	66.1	Low	100 Å²	100	80.5 Å²	80.5	44%	0.435	43%	0.432	S	S	.	.	H	α-helix	trans	-64.3	-40	176.5	-76.3	-176.3	174.4	-173.6	0	111.4	A866 S867 I872 I873 F874	A866-K870 HydrophobicContact CB-CB 4.31Å; S867-K870 WeakPolarHBondContact O-CA 3.36Å; S867-K870 WeakPolarHBondContact O-CB 3.3Å; S867-K870 PolarHBondContact O-N 3.46Å; K870-I872 VanDerWaalsContact C-N 3.34Å; K870-I872 PolarHBondContact O-N 2.01Å; K870-I873 PolarHBondContact O-N 3.19Å; K870-F874 HydrophobicContact CB-CD2 4.34Å; K870-F874 HydrophobicContact CB-CE2 3.96Å; K870-F874 HydrophobicContact CB-CZ 4.43Å; K870-F874 WeakPolarHBondContact O-CB 3.46Å; K870-F874 WeakPolarHBondContact O-CD2 3.35Å; K870-F874 WeakPolarHBondContact O-CG 3.5Å; K870-F874 PolarHBondContact O-N 2.85Å
871	Q	66.9	Low	66.4	Low	37 Å²	37	80.1 Å²	80.1	17%	0.173	43%	0.434	C	S	.	.	H	α-helix	trans	-60.3	-40.4	176.6	-70.7	179.7	-17.4	0	0	112.8	D788 A866 S867 F868 F875 V967	D788-Q871 PolarHBondContact OD2-NE2 2.79Å; A866-Q871 HydrophobicContact CB-CG 4.38Å; S867-Q871 PolarHBondContact O-N 2.87Å; S867-Q871 VanDerWaalsContact O-N 3.09Å; F868-Q871 PolarHBondContact O-N 2.86Å; Q871-F875 PolarHBondContact O-N 3Å; Q871-F875 VanDerWaalsContact O-N 3.1Å; Q871-V967 HydrophobicContact CB-CG2 4.44Å
872	I	68.5	Low	67	Low	33 Å²	33	81.9 Å²	81.9	17%	0.169	43%	0.434	C	S	.	.	H	α-helix	trans	-64.8	-46.2	174.1	-67.5	171.4	0	0	0	110.8	F868 I869 K870 F874 F875 F876 V967 F970	F868-I872 HydrophobicContact CD1-CD1 4.13Å; F868-I872 HydrophobicContact CE1-CD1 3.54Å; F868-I872 HydrophobicContact CE2-CD1 4.26Å; F868-I872 HydrophobicContact CZ-CD1 3.62Å; F868-I872 HydrophobicContact CZ-CG1 4.38Å; F868-I872 PolarHBondContact O-N 3.37Å; I869-I872 PolarHBondContact O-N 3.31Å; K870-I872 VanDerWaalsContact C-N 3.34Å; K870-I872 PolarHBondContact O-N 2.01Å; I872-F874 VanDerWaalsContact C-N 3.31Å; I872-F874 PolarHBondContact O-N 3.43Å; I872-F875 PolarHBondContact O-N 3.24Å; I872-F876 HydrophobicContact CG2-CD2 3.96Å; I872-F876 HydrophobicContact CG2-CE2 4.05Å; I872-F876 VanDerWaalsContact O-CD2 3.3Å; I872-F876 WeakPolarHBondContact O-CD2 3.18Å; I872-F876 PolarHBondContact O-N 3.49Å; I872-V967 HydrophobicContact CG1-CG2 4.1Å; I872-F970 HydrophobicContact CD1-CD1 4.1Å; I872-F970 HydrophobicContact CD1-CE1 4.11Å; I872-F970 HydrophobicContact CD1-CG 4.38Å; I872-F970 HydrophobicContact CD1-CZ 4.39Å
873	I	70	Confident	67.5	Low	93 Å²	93	79 Å²	79	48%	0.477	42%	0.423	S	S	.	.	H	α-helix	trans	-59.9	-44.3	179	-68.2	167.3	0	0	0	110.4	I869 K870 F875 F876 S877	I869-I873 HydrophobicContact CG2-CD1 3.99Å; I869-I873 WeakPolarHBondContact O-CG1 3.3Å; I869-I873 PolarHBondContact O-N 3.25Å; I869-I873 VanDerWaalsContact O-N 3.11Å; K870-I873 PolarHBondContact O-N 3.19Å; I873-F875 PolarHBondContact O-N 2.83Å; I873-F876 PolarHBondContact O-N 2.98Å; I873-S877 VanDerWaalsContact O-CB 3.3Å; I873-S877 WeakPolarHBondContact O-CB 3.46Å; I873-S877 PolarHBondContact O-N 2.92Å; I873-S877 PolarHBondContact O-OG 2.84Å
874	F	69.6	Low	67.9	Low	53 Å²	53	79 Å²	79	23%	0.232	42%	0.421	C	S	.	.	H	α-helix	trans	-64.2	-37.8	179.5	-66.4	-35	0	0	0	112.8	A866 K870 I872 F876 S877 A926	A866-F874 HydrophobicContact CB-CE2 4.42Å; K870-F874 HydrophobicContact CB-CD2 4.34Å; K870-F874 HydrophobicContact CB-CE2 3.96Å; K870-F874 HydrophobicContact CB-CZ 4.43Å; K870-F874 WeakPolarHBondContact O-CB 3.46Å; K870-F874 WeakPolarHBondContact O-CD2 3.35Å; K870-F874 WeakPolarHBondContact O-CG 3.5Å; K870-F874 PolarHBondContact O-N 2.85Å; I872-F874 VanDerWaalsContact C-N 3.31Å; I872-F874 PolarHBondContact O-N 3.43Å; F874-F876 VanDerWaalsContact C-N 3.34Å; F874-F876 PolarHBondContact O-N 3.38Å; F874-S877 PolarHBondContact O-N 3.39Å; F874-A926 HydrophobicContact CB-CB 3.66Å; F874-A926 HydrophobicContact CD1-CB 3.35Å; F874-A926 HydrophobicContact CD2-CB 3.73Å; F874-A926 HydrophobicContact CE1-CB 3.77Å; F874-A926 HydrophobicContact CE2-CB 4.11Å; F874-A926 HydrophobicContact CG-CB 3.32Å; F874-A926 HydrophobicContact CZ-CB 4.12Å
875	F	69.4	Low	68.5	Low	70 Å²	70	80.9 Å²	80.9	31%	0.307	42%	0.422	S	S	.	.	H	α-helix	trans	-64.9	-35.5	176.8	-176.5	-101.5	0	0	0	113.4	Q871 I872 I873 P963 V967 I971	Q871-F875 PolarHBondContact O-N 3Å; Q871-F875 VanDerWaalsContact O-N 3.1Å; I872-F875 PolarHBondContact O-N 3.24Å; I873-F875 PolarHBondContact O-N 2.83Å; F875-P963 HydrophobicContact CD2-CB 4.03Å; F875-P963 HydrophobicContact CE2-CB 3.68Å; F875-P963 HydrophobicContact CE2-CG 4.02Å; F875-P963 HydrophobicContact CZ-CB 4.16Å; F875-P963 HydrophobicContact CZ-CG 4.38Å; F875-V967 HydrophobicContact CD1-CG1 4.48Å; F875-V967 HydrophobicContact CG-CG1 4.5Å; F875-I971 HydrophobicContact CE1-CD1 4.33Å
876	F	70.6	Confident	69.1	Low	144 Å²	144	72.8 Å²	72.8	63%	0.632	38%	0.384	S	S	*	.	H	α-helix	trans	-93	-2.8	179.6	-69.9	-70	0	0	0	114.2	I872 I873 F874	I872-F876 HydrophobicContact CG2-CD2 3.96Å; I872-F876 HydrophobicContact CG2-CE2 4.05Å; I872-F876 VanDerWaalsContact O-CD2 3.3Å; I872-F876 WeakPolarHBondContact O-CD2 3.18Å; I872-F876 PolarHBondContact O-N 3.49Å; I873-F876 PolarHBondContact O-N 2.98Å; F874-F876 VanDerWaalsContact C-N 3.34Å; F874-F876 PolarHBondContact O-N 3.38Å
877	S	68.8	Low	69.2	Low	49 Å²	49	72.6 Å²	72.6	34%	0.343	39%	0.385	S	S	.	.	S	Bend	trans	-91.4	145.7	-178.9	-66	0	0	0	0	112.2	I873 F874	I873-S877 VanDerWaalsContact O-CB 3.3Å; I873-S877 WeakPolarHBondContact O-CB 3.46Å; I873-S877 PolarHBondContact O-N 2.92Å; I873-S877 PolarHBondContact O-OG 2.84Å; F874-S877 PolarHBondContact O-N 3.39Å
878	P	65.7	Low	68.8	Low	111 Å²	111	78.7 Å²	78.7	72%	0.721	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-69.2	137.3	172.1	28.5	-32.7	0	0	0	111	T880	P878-T880 PolarHBondContact O-N 2.76Å
879	T	65.5	Low	68.5	Low	66 Å²	66	79.8 Å²	79.8	41%	0.405	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-70.4	121.5	175.9	46.5	0	0	0	0	110.7	Q961	T879-Q961 HydrophobicContact CG2-CG 4.42Å; T879-Q961 VanDerWaalsContact CG2-NE2 3.28Å
880	T	68.2	Low	68.5	Low	72 Å²	72	76.4 Å²	76.4	44%	0.442	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-103	155.9	170.9	56.2	0	0	0	0	110.4	P878 H927 T928	P878-T880 PolarHBondContact O-N 2.76Å; T880-H927 WeakPolarHBondContact O-CB 3.49Å; T880-H927 PolarHBondContact OG1-CE1 2.9Å; T880-H927 PolarHBondContact OG1-ND1 3.14Å; T880-T928 PolarHBondContact O-N 2.93Å
881	T	70.7	Confident	68.5	Low	96 Å²	96	76 Å²	76	59%	0.589	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	125	177.8	47.4	0	0	0	0	111.4	T928 L930	T881-T928 CarbonylContact C-O 3.41Å; T881-T928 VanDerWaalsContact CA-O 3.24Å; T881-T928 WeakPolarHBondContact CA-O 3.46Å; T881-T928 HydrophobicContact CG2-CG2 4.32Å; T881-L930 HydrophobicContact CG2-CD1 4.4Å
882	R	75.4	Confident	68.9	Low	78 Å²	78	77.2 Å²	77.2	29%	0.294	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	123.9	175.3	-174.2	173.9	176.8	-179.2	-4.7	109.7	A829 D925 H927 T928 L930	A829-R882 PolarHBondContact O-NH2 2.91Å; R882-D925 IonicContact CZ-OD2 3.52Å; R882-D925 IonicContact NH1-OD2 3.53Å; R882-D925 PolarHBondContact NH1-OD2 3.18Å; R882-H927 HydrophobicContact CB-CB 4.33Å; R882-T928 PolarHBondContact N-O 3.5Å; R882-L930 PolarHBondContact O-N 3.5Å
883	T	71.5	Confident	69.4	Low	87 Å²	87	76.4 Å²	76.4	53%	0.534	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	130.5	177.6	54.7	0	0	0	0	111.1	L930	T883-L930 CarbonylContact C-O 3.43Å; T883-L930 WeakPolarHBondContact CA-O 3.45Å; T883-L930 HydrophobicContact CG2-CB 4.01Å; T883-L930 HydrophobicContact CG2-CD1 4.21Å
884	M	72.2	Confident	69.9	Low	17 Å²	17	73.5 Å²	73.5	8%	0.084	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	132.7	171.8	-67.2	-167.5	-67.8	0	0	109.9	L828 L835 V929 L930 I931 K932	L828-M884 HydrophobicContact CD1-CG 4.26Å; L828-M884 HydrophobicContact CD1-SD 3.37Å; L828-M884 WeakPolarHBondContact CD1-SD 2.87Å; L835-M884 HydrophobicContact CD2-CE 3.4Å; L835-M884 VanDerWaalsContact CD2-CE 3.4Å; L835-M884 HydrophobicContact CD2-SD 3.8Å; M884-V929 HydrophobicContact CE-CG1 3.48Å; M884-V929 VanDerWaalsContact CE-CG1 3.48Å; M884-V929 HydrophobicContact CG-CG1 4.29Å; M884-V929 HydrophobicContact SD-CG1 4.31Å; M884-L930 PolarHBondContact N-O 3.06Å; M884-I931 HydrophobicContact CE-CB 4.14Å; M884-I931 HydrophobicContact CE-CD1 3.68Å; M884-I931 HydrophobicContact CE-CG1 3.48Å; M884-I931 VanDerWaalsContact CE-CG1 3.48Å; M884-I931 HydrophobicContact CE-CG2 4.03Å; M884-K932 CarbonylContact O-C 3.59Å; M884-K932 WeakPolarHBondContact O-CA 3.24Å; M884-K932 VanDerWaalsContact O-CB 3.28Å; M884-K932 WeakPolarHBondContact O-CB 2.96Å; M884-K932 PolarHBondContact O-N 3.3Å
885	F	73.5	Confident	70.5	Confident	120 Å²	120	72.6 Å²	72.6	53%	0.526	38%	0.383	S	S	.	.			trans	-147.9	149.4	176	67.1	-88.9	0	0	0	110.8	Q934	F885-Q934 HydrophobicContact CB-CG 4.1Å
886	C	73.6	Confident	71.3	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.007	37%	0.369	C	S	.	.			trans	-92.3	122	174.6	-67.8	0	0	0	0	114.1	A823 P825 C893 Q934	A823-C886 HydrophobicContact CB-CB 4.09Å; P825-C886 WeakPolarHBondContact CA-SG 3.49Å; C886-C893 WeakPolarHBondContact CA-SG 3.39Å; C886-C893 HydrophobicContact CB-CB 3.63Å; C886-C893 WeakPolarHBondContact CB-SG 2.99Å; C886-C893 WeakPolarHBondContact SG-CB 3.31Å; C886-C893 CovalentContact SG-SG 2.01Å; C886-C893 PolarHBondContact SG-SG 2.84Å; C886-Q934 HydrophobicContact CB-CB 4.07Å; C886-Q934 HydrophobicContact CB-CG 4.22Å; C886-Q934 WeakPolarHBondContact O-CB 3.45Å; C886-Q934 WeakPolarHBondContact O-CG 2.94Å; C886-Q934 PolarHBondContact O-OE1 3.4Å
887	G	63.8	Low	72.1	Confident	26 Å²	26	63.4 Å²	63.4	27%	0.268	34%	0.344	S	S	.	.			trans	-72.4	164.1	168.5	0	0	0	0	0	113.6	V889 D890	G887-V889 PolarHBondContact O-N 2.86Å; G887-D890 PolarHBondContact O-N 3.31Å
888	R	59.3	Low	73	Confident	192 Å²	192	61 Å²	61	73%	0.725	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-24.7	178.5	-76.5	-176.5	179.5	172.3	0.9	114.2
889	V	61.1	Low	74.1	Confident	112 Å²	112	63.2 Å²	63.2	68%	0.679	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.3	36.8	-178.2	-159.5	0	0	0	0	109.8	G887	G887-V889 PolarHBondContact O-N 2.86Å
890	D	66.9	Low	75.1	Confident	48 Å²	48	60.4 Å²	60.4	26%	0.257	30%	0.304	S	S	.	.			trans	-84.3	120.8	178.8	-160.3	-18.3	0	0	0	110.5	G887 L892 C893	G887-D890 PolarHBondContact O-N 3.31Å; D890-L892 PolarHBondContact O-N 2.86Å; D890-L892 VanDerWaalsContact OD1-CB 3.31Å; D890-L892 WeakPolarHBondContact OD1-CB 3.49Å; D890-L892 WeakPolarHBondContact OD1-CG 3.39Å; D890-L892 PolarHBondContact OD1-N 2.85Å; D890-C893 PolarHBondContact O-N 3.41Å
891	N	68.4	Low	75.8	Confident	92 Å²	92	58.4 Å²	58.4	49%	0.492	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-9.4	178.1	-62.5	-23.1	0	0	0	112.1	I855 C893	I855-N891 HydrophobicContact CD1-CB 3.61Å; I855-N891 HydrophobicContact CG1-CB 4.35Å; N891-C893 PolarHBondContact O-N 3.12Å
892	L	74.6	Confident	76.5	Confident	61 Å²	61	57.5 Å²	57.5	32%	0.319	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	0.2	173.7	-58.3	173.4	0	0	0	112.6	K826 A829 D890	K826-L892 WeakPolarHBondContact CB-O 3.41Å; K826-L892 PolarHBondContact N-O 2.66Å; A829-L892 HydrophobicContact CB-CD1 4.08Å; D890-L892 PolarHBondContact O-N 2.86Å; D890-L892 VanDerWaalsContact OD1-CB 3.31Å; D890-L892 WeakPolarHBondContact OD1-CB 3.49Å; D890-L892 WeakPolarHBondContact OD1-CG 3.39Å; D890-L892 PolarHBondContact OD1-N 2.85Å
893	C	78.9	Confident	76.9	Confident	16 Å²	16	54.2 Å²	54.2	11%	0.108	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	144.7	-173.8	-64.4	0	0	0	0	113.4	L824 C886 D890 N891	L824-C893 CarbonylContact O-C 3.53Å; L824-C893 WeakPolarHBondContact O-CA 3.39Å; L824-C893 WeakPolarHBondContact O-CB 3.38Å; C886-C893 WeakPolarHBondContact CA-SG 3.39Å; C886-C893 HydrophobicContact CB-CB 3.63Å; C886-C893 WeakPolarHBondContact CB-SG 2.99Å; C886-C893 WeakPolarHBondContact SG-CB 3.31Å; C886-C893 CovalentContact SG-SG 2.01Å; C886-C893 PolarHBondContact SG-SG 2.84Å; D890-C893 PolarHBondContact O-N 3.41Å; N891-C893 PolarHBondContact O-N 3.12Å
894	E	80.3	Confident	77.5	Confident	33 Å²	33	52.4 Å²	52.4	15%	0.154	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	129.7	175.3	-169.2	159.7	-150.9	0	0	109	A823 L824 K826 R834 I850	A823-E894 WeakPolarHBondContact CA-O 3.43Å; L824-E894 PolarHBondContact N-O 2.87Å; L824-E894 PolarHBondContact O-N 3.47Å; K826-E894 HydrophobicContact CB-CB 4.4Å; R834-E894 IonicContact CZ-OE2 3.31Å; R834-E894 IonicContact NH2-OE1 2.8Å; R834-E894 PolarHBondContact NH2-OE1 2.8Å; R834-E894 IonicContact NH2-OE2 3.63Å; R834-E894 PolarHBondContact NH2-OE2 2.83Å; I850-E894 HydrophobicContact CG2-CG 4Å
895	Q	82.6	Confident	77.9	Confident	34 Å²	34	53.9 Å²	53.9	16%	0.159	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	122.5	-175.9	-75.7	-173.9	-7.4	0	0	110.8	I822 A823 S851	I822-Q895 CarbonylContact O-C 3.56Å; I822-Q895 WeakPolarHBondContact O-CA 3.16Å; A823-Q895 HydrophobicContact CB-CG 4.11Å; S851-Q895 PolarHBondContact N-O 2.73Å; S851-Q895 VanDerWaalsContact OG-CB 3.28Å; S851-Q895 WeakPolarHBondContact OG-CB 3.29Å; S851-Q895 PolarHBondContact OG-O 2.89Å
896	L	85.9	Confident	78.2	Confident	2 Å²	2	51 Å²	51	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	123.4	171.7	-175.6	72.2	0	0	0	109.6	Q821 I822 L838 W841 C848 I850 L913	Q821-L896 WeakPolarHBondContact CA-O 3Å; I822-L896 HydrophobicContact CB-CB 4.45Å; I822-L896 PolarHBondContact N-O 2.86Å; I822-L896 PolarHBondContact O-N 3.03Å; L838-L896 HydrophobicContact CD2-CD1 4.09Å; L838-L896 HydrophobicContact CD2-CD2 4.44Å; W841-L896 HydrophobicContact CB-CD2 4.39Å; W841-L896 HydrophobicContact CD2-CD1 4.17Å; W841-L896 HydrophobicContact CE3-CD1 4.48Å; W841-L896 HydrophobicContact CG-CD1 4.43Å; C848-L896 HydrophobicContact CB-CD1 4.01Å; C848-L896 HydrophobicContact CB-CD2 4.44Å; C848-L896 HydrophobicContact CB-CG 4.23Å; I850-L896 HydrophobicContact CG1-CD1 4.03Å; L896-L913 HydrophobicContact CD2-CD1 4.22Å; L896-L913 HydrophobicContact CD2-CD2 3.27Å; L896-L913 HydrophobicContact CD2-CG 4.4Å
897	V	87.3	Confident	78.8	Confident	18 Å²	18	57.9 Å²	57.9	11%	0.109	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	110.7	179.3	-176.6	0	0	0	0	109.3	V819 C848 S849	V819-V897 HydrophobicContact CG1-CG1 3.69Å; C848-V897 CarbonylContact C-O 3.55Å; C848-V897 VanDerWaalsContact CA-O 3.32Å; C848-V897 WeakPolarHBondContact CA-O 3.39Å; S849-V897 PolarHBondContact N-O 2.82Å; S849-V897 PolarHBondContact O-N 2.82Å
898	C	87.9	Confident	79.9	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	118.2	176.8	-68.8	0	0	0	0	110.9	V819 V820 C848 L900 I911	V819-C898 CarbonylContact C-O 3.43Å; V819-C898 WeakPolarHBondContact CA-O 3.48Å; V820-C898 HydrophobicContact CB-CB 4.27Å; V820-C898 PolarHBondContact N-O 2.82Å; V820-C898 PolarHBondContact O-N 2.95Å; C848-C898 HydrophobicContact CB-CB 4.01Å; C848-C898 WeakPolarHBondContact CB-SG 3.37Å; C848-C898 VanDerWaalsContact SG-CA 3.58Å; C848-C898 WeakPolarHBondContact SG-CB 3.5Å; C848-C898 CovalentContact SG-SG 2.04Å; C848-C898 PolarHBondContact SG-SG 3.42Å; C898-L900 HydrophobicContact CB-CD2 4.28Å; C898-I911 HydrophobicContact CB-CD1 3.79Å; C898-I911 HydrophobicContact CB-CG1 4.5Å
899	R	88.6	Confident	81.4	Confident	156 Å²	156	50.5 Å²	50.5	59%	0.589	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	97.2	175.2	-62.2	179	-177.8	-115.6	3	108.5	V819 G846 S847 G901	V819-R899 HydrophobicContact CG2-CG 4.38Å; G846-R899 VanDerWaalsContact CA-O 3.26Å; G846-R899 WeakPolarHBondContact CA-O 3.27Å; S847-R899 PolarHBondContact N-O 2.92Å; S847-R899 VanDerWaalsContact N-O 3.1Å; S847-R899 PolarHBondContact O-N 2.82Å; R899-G901 VanDerWaalsContact C-N 3.3Å; R899-G901 PolarHBondContact O-N 3.4Å
900	L	86.1	Confident	82.7	Confident	8 Å²	8	47.2 Å²	47.2	4%	0.042	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-7.9	-174.3	-57.1	-178.5	0	0	0	113.4	V807 T818 V820 S843 H845 C898 A909 I911	V807-L900 HydrophobicContact CB-CD1 4.26Å; V807-L900 HydrophobicContact CG1-CD1 4.37Å; V807-L900 HydrophobicContact CG2-CD1 4.19Å; T818-L900 HydrophobicContact CG2-CD1 4.46Å; T818-L900 PolarHBondContact O-N 2.85Å; V820-L900 HydrophobicContact CG2-CD1 3.53Å; V820-L900 HydrophobicContact CG2-CG 4.12Å; S843-L900 WeakPolarHBondContact OG-CD2 3.28Å; H845-L900 WeakPolarHBondContact O-CD2 3.34Å; C898-L900 HydrophobicContact CB-CD2 4.28Å; L900-A909 HydrophobicContact CD1-CB 3.86Å; L900-I911 HydrophobicContact CD2-CD1 4.22Å; L900-I911 HydrophobicContact CD2-CG1 4.2Å
901	G	83.9	Confident	83.8	Confident	29 Å²	29	44.9 Å²	44.9	30%	0.299	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	74.1	-141.8	-177.1	0	0	0	0	0	111.6	N817 T818 R899	N817-G901 CarbonylContact C-O 3.5Å; N817-G901 WeakPolarHBondContact CA-O 3.41Å; N817-G901 PolarHBondContact N-O 3.38Å; T818-G901 PolarHBondContact N-O 3.29Å; R899-G901 VanDerWaalsContact C-N 3.3Å; R899-G901 PolarHBondContact O-N 3.4Å
902	N	84.1	Confident	84.9	Confident	77 Å²	77	45.4 Å²	45.4	41%	0.412	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	127.8	-178.2	-55.7	-34.9	0	0	0	111.1	K814 A815 L816 N817	K814-N902 HydrophobicContact CD-CB 4.31Å; K814-N902 HydrophobicContact CG-CB 4.45Å; A815-N902 CarbonylContact O-C 3.59Å; A815-N902 VanDerWaalsContact O-CA 3.29Å; A815-N902 WeakPolarHBondContact O-CA 3.36Å; L816-N902 WeakPolarHBondContact CA-OD1 3.24Å; L816-N902 HydrophobicContact CD2-CB 4.4Å; N817-N902 PolarHBondContact N-OD1 2.9Å
903	L	84	Confident	85.6	Confident	9 Å²	9	42.6 Å²	42.6	5%	0.047	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	114.6	-178.2	-169.4	65.2	0	0	0	110.7	V807 N809 K814 A815 R907 A909	V807-L903 HydrophobicContact CG1-CD2 4.23Å; N809-L903 HydrophobicContact CB-CD2 3.91Å; N809-L903 HydrophobicContact CB-CG 4.06Å; N809-L903 PolarHBondContact ND2-O 3.15Å; N809-L903 VanDerWaalsContact ND2-O 3.11Å; K814-L903 WeakPolarHBondContact CA-O 3.46Å; A815-L903 HydrophobicContact CB-CB 4.39Å; A815-L903 PolarHBondContact N-O 2.94Å; A815-L903 PolarHBondContact O-N 3.33Å; L903-R907 HydrophobicContact CD1-CB 4.21Å; L903-A909 HydrophobicContact CD1-CB 4.19Å
904	D	83.6	Confident	86.1	Confident	50 Å²	50	44.5 Å²	44.5	27%	0.267	24%	0.238	S	C	.	.			trans	-66	158.6	-179.6	-57.4	-45.2	0	0	0	112.2	N809 K814 G906 R907	N809-D904 WeakPolarHBondContact CB-O 3.43Å; N809-D904 PolarHBondContact ND2-O 3.01Å; K814-D904 WeakPolarHBondContact CD-OD1 3.37Å; K814-D904 WeakPolarHBondContact CE-OD1 3.49Å; K814-D904 IonicContact NZ-OD1 3.97Å; K814-D904 PolarHBondContact NZ-OD1 3.31Å; D904-G906 PolarHBondContact O-N 2.88Å; D904-R907 HydrophobicContact CB-CB 4.44Å; D904-R907 HydrophobicContact CB-CG 4.05Å; D904-R907 PolarHBondContact O-N 2.83Å; D904-R907 IonicContact OD2-CZ 3.99Å; D904-R907 IonicContact OD2-NE 3.49Å; D904-R907 IonicContact OD2-NH1 3.66Å
905	A	81.6	Confident	86.4	Confident	48 Å²	48	43 Å²	43	40%	0.397	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	133.7	176.7	0	0	0	0	0	110.9	G811 R907	G811-A905 WeakPolarHBondContact O-CB 3.49Å; A905-R907 PolarHBondContact O-N 3.05Å
906	G	80.8	Confident	86.6	Confident	59 Å²	59	41.4 Å²	41.4	61%	0.608	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	75	-4.7	-178.6	0	0	0	0	0	115.6	N809 D904	N809-G906 WeakPolarHBondContact O-CA 3.49Å; N809-G906 PolarHBondContact O-N 1.99Å; D904-G906 PolarHBondContact O-N 2.88Å
907	R	85.1	Confident	86.5	Confident	145 Å²	145	41.4 Å²	41.4	55%	0.547	22%	0.223	S	C	.	.			trans	-87.6	150.8	176.5	-69.7	-161	178.4	-172.8	-0.1	112.2	N809 L903 D904 A905	N809-R907 PolarHBondContact N-O 3.34Å; N809-R907 VanDerWaalsContact N-O 3.13Å; L903-R907 HydrophobicContact CD1-CB 4.21Å; D904-R907 HydrophobicContact CB-CB 4.44Å; D904-R907 HydrophobicContact CB-CG 4.05Å; D904-R907 PolarHBondContact O-N 2.83Å; D904-R907 IonicContact OD2-CZ 3.99Å; D904-R907 IonicContact OD2-NE 3.49Å; D904-R907 IonicContact OD2-NH1 3.66Å; A905-R907 PolarHBondContact O-N 3.05Å
908	D	87.8	Confident	86.2	Confident	64 Å²	64	40.9 Å²	40.9	34%	0.342	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	149.2	173.8	67.3	-45.7	0	0	0	113.1	K806 V807 L808	K806-D908 WeakPolarHBondContact CE-OD2 3.42Å; K806-D908 HydrophobicContact CG-CB 4.16Å; K806-D908 IonicContact NZ-OD2 2.83Å; K806-D908 PolarHBondContact NZ-OD2 2.99Å; V807-D908 CarbonylContact O-C 3.59Å; V807-D908 WeakPolarHBondContact O-CA 3.35Å; L808-D908 HydrophobicContact CD1-CB 4.16Å
909	A	89.3	Confident	85.7	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	143.2	170.5	0	0	0	0	0	109.3	K806 V807 H845 L900 L903	K806-A909 CarbonylContact C-O 3.55Å; K806-A909 WeakPolarHBondContact CA-O 3.37Å; V807-A909 PolarHBondContact N-O 3.48Å; V807-A909 PolarHBondContact O-N 3.34Å; H845-A909 HydrophobicContact CB-CB 4.43Å; L900-A909 HydrophobicContact CD1-CB 3.86Å; L903-A909 HydrophobicContact CD1-CB 4.19Å
910	T	89.8	Confident	85	Confident	42 Å²	42	35.4 Å²	35.4	26%	0.258	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	138	-178.2	53.2	0	0	0	0	110.5	F805 K806 S843 S844	F805-T910 CarbonylContact O-C 3.56Å; F805-T910 VanDerWaalsContact O-CA 3.27Å; F805-T910 WeakPolarHBondContact O-CA 3.28Å; K806-T910 HydrophobicContact CB-CG2 4.44Å; K806-T910 HydrophobicContact CG-CG2 4.43Å; S843-T910 WeakPolarHBondContact CA-O 3.31Å; S843-T910 PolarHBondContact OG-O 3.05Å; S844-T910 WeakPolarHBondContact CB-OG1 3.26Å; S844-T910 PolarHBondContact N-O 2.85Å; S844-T910 PolarHBondContact OG-N 2.91Å; S844-T910 PolarHBondContact OG-OG1 3.39Å
911	I	90.1	Very high	84.4	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	116	175	-57.4	162.4	0	0	0	106.7	T804 F805 V820 I822 C898 L900 L913	T804-I911 CarbonylContact C-O 3.59Å; T804-I911 WeakPolarHBondContact CA-O 3.49Å; F805-I911 HydrophobicContact CB-CB 4.33Å; F805-I911 PolarHBondContact N-O 3Å; F805-I911 PolarHBondContact O-N 3.41Å; V820-I911 HydrophobicContact CB-CD1 4.02Å; V820-I911 HydrophobicContact CG1-CD1 4.06Å; V820-I911 HydrophobicContact CG2-CD1 4.12Å; I822-I911 HydrophobicContact CD1-CD1 4.29Å; I822-I911 HydrophobicContact CD1-CG2 4.06Å; C898-I911 HydrophobicContact CB-CD1 3.79Å; C898-I911 HydrophobicContact CB-CG1 4.5Å; L900-I911 HydrophobicContact CD2-CD1 4.22Å; L900-I911 HydrophobicContact CD2-CG1 4.2Å; I911-L913 HydrophobicContact CG2-CD2 3.78Å; I911-L913 HydrophobicContact CG2-CG 4.36Å
912	Q	89.9	Confident	84	Confident	102 Å²	102	33.7 Å²	33.7	48%	0.477	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.2	176.5	-68.1	179.6	-22.8	0	0	109.1	Y803 T804 W841 K842	Y803-Q912 CarbonylContact O-C 3.56Å; Y803-Q912 VanDerWaalsContact O-CA 3.3Å; Y803-Q912 WeakPolarHBondContact O-CA 3.49Å; T804-Q912 HydrophobicContact CG2-CG 4.16Å; W841-Q912 CarbonylContact C-O 3.46Å; W841-Q912 VanDerWaalsContact CA-O 3.26Å; W841-Q912 WeakPolarHBondContact CA-O 3.5Å; K842-Q912 HydrophobicContact CB-CB 4.49Å; K842-Q912 PolarHBondContact N-O 2.82Å; K842-Q912 PolarHBondContact O-N 3.42Å
913	L	89.4	Confident	83.4	Confident	3 Å²	3	32.2 Å²	32.2	2%	0.016	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	132.9	178.2	-45.7	176.2	0	0	0	109.1	N802 Y803 F805 I822 L838 W841 L896 I911 I915	N802-L913 CarbonylContact C-O 3.27Å; N802-L913 WeakPolarHBondContact CA-O 3.22Å; Y803-L913 PolarHBondContact N-O 3.29Å; Y803-L913 PolarHBondContact O-N 3.01Å; F805-L913 HydrophobicContact CD2-CD1 4.4Å; F805-L913 HydrophobicContact CE2-CD1 3.9Å; I822-L913 HydrophobicContact CD1-CD1 4.13Å; I822-L913 HydrophobicContact CG2-CD1 4.18Å; L838-L913 HydrophobicContact CD1-CB 4.04Å; L838-L913 HydrophobicContact CD1-CD2 4.45Å; W841-L913 HydrophobicContact CB-CD2 3.52Å; L896-L913 HydrophobicContact CD2-CD1 4.22Å; L896-L913 HydrophobicContact CD2-CD2 3.27Å; L896-L913 HydrophobicContact CD2-CG 4.4Å; I911-L913 HydrophobicContact CG2-CD2 3.78Å; I911-L913 HydrophobicContact CG2-CG 4.36Å; L913-I915 HydrophobicContact CB-CG1 4.32Å
914	E	89.6	Confident	82.5	Confident	55 Å²	55	33 Å²	33	26%	0.257	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	117	166.9	-173.2	176.9	170.6	0	0	108	K800 I839 D840	K800-E914 WeakPolarHBondContact CD-OE1 3.45Å; K800-E914 IonicContact NZ-OE1 3.72Å; K800-E914 PolarHBondContact NZ-OE1 3.22Å; I839-E914 HydrophobicContact CB-CB 4.46Å; I839-E914 HydrophobicContact CB-CG 4.34Å; I839-E914 HydrophobicContact CD1-CG 4.29Å; I839-E914 PolarHBondContact N-O 2.85Å; D840-E914 HydrophobicContact CB-CB 4.4Å; D840-E914 PolarHBondContact N-O 2.92Å; D840-E914 PolarHBondContact O-N 2.79Å
915	I	87.2	Confident	81.6	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	136.4	-178.4	-59.9	-179.2	0	0	0	108.1	K800 F801 Y803 L824 L836 Q837 L838 L913	K800-I915 CarbonylContact C-O 3.56Å; K800-I915 WeakPolarHBondContact CA-O 3.41Å; F801-I915 PolarHBondContact N-O 2.69Å; F801-I915 PolarHBondContact O-N 2.88Å; Y803-I915 HydrophobicContact CD2-CB 4.42Å; Y803-I915 HydrophobicContact CD2-CD1 3.6Å; Y803-I915 HydrophobicContact CD2-CG1 4.11Å; Y803-I915 HydrophobicContact CE2-CB 4.25Å; Y803-I915 HydrophobicContact CE2-CD1 3.63Å; Y803-I915 HydrophobicContact CE2-CG1 4.28Å; Y803-I915 HydrophobicContact CG-CD1 4.33Å; L824-I915 HydrophobicContact CD1-CD1 3.47Å; L824-I915 VanDerWaalsContact CD1-CD1 3.47Å; L824-I915 HydrophobicContact CD1-CG1 4.42Å; L824-I915 HydrophobicContact CD2-CD1 3.55Å; L824-I915 HydrophobicContact CG-CD1 4.14Å; L836-I915 HydrophobicContact CB-CG2 4.11Å; L836-I915 HydrophobicContact CD1-CG2 4.5Å; L836-I915 HydrophobicContact CD2-CG2 3.94Å; L836-I915 HydrophobicContact CG-CG2 4.42Å; Q837-I915 CarbonylContact O-C 3.58Å; Q837-I915 WeakPolarHBondContact O-CA 3.32Å; L838-I915 HydrophobicContact CD1-CD1 4.34Å; L838-I915 HydrophobicContact CD1-CG1 3.76Å; L913-I915 HydrophobicContact CB-CG1 4.32Å
916	S	86.6	Confident	80.4	Confident	2 Å²	2	30.1 Å²	30.1	1%	0.014	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	149.5	169.8	64.5	0	0	0	0	112.1	Y797 E799 L836 Q837 I839	Y797-S916 WeakPolarHBondContact CB-OG 3.37Å; E799-S916 CarbonylContact O-C 3.17Å; E799-S916 WeakPolarHBondContact O-CA 3.33Å; L836-S916 WeakPolarHBondContact CA-O 3.02Å; Q837-S916 PolarHBondContact N-O 2.04Å; Q837-S916 PolarHBondContact O-N 2.77Å; I839-S916 WeakPolarHBondContact CD1-OG 3.38Å
917	L	83.6	Confident	79.6	Confident	1 Å²	1	30 Å²	30	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137.5	-175.9	-179.2	151.4	0	0	0	110	F784 Y797 E799 F801 L835 L836 P919 L922 I931	F784-L917 HydrophobicContact CE1-CD1 3.95Å; F784-L917 HydrophobicContact CE2-CD2 3.99Å; F784-L917 HydrophobicContact CZ-CD1 3.75Å; F784-L917 HydrophobicContact CZ-CD2 3.6Å; F784-L917 HydrophobicContact CZ-CG 4.36Å; Y797-L917 WeakPolarHBondContact CA-O 3.29Å; E799-L917 HydrophobicContact CB-CB 4.3Å; E799-L917 PolarHBondContact O-N 2.86Å; F801-L917 HydrophobicContact CD2-CB 4.3Å; F801-L917 HydrophobicContact CE2-CB 3.79Å; F801-L917 HydrophobicContact CE2-CD1 4.12Å; L835-L917 HydrophobicContact CD1-CG 4.33Å; L835-L917 WeakPolarHBondContact O-CA 3.43Å; L836-L917 HydrophobicContact CD2-CB 3.72Å; L836-L917 HydrophobicContact CD2-CD1 3.72Å; L836-L917 HydrophobicContact CD2-CG 3.89Å; L917-P919 HydrophobicContact CD2-CB 4.26Å; L917-P919 VanDerWaalsContact O-CD 3.32Å; L917-P919 WeakPolarHBondContact O-CD 2.91Å; L917-L922 HydrophobicContact CD1-CD1 4.36Å; L917-L922 HydrophobicContact CD2-CD1 3.96Å; L917-I931 HydrophobicContact CD1-CD1 3.57Å
918	N	81.8	Confident	78.3	Confident	8 Å²	8	24 Å²	24	4%	0.043	13%	0.128	C	C	.	.			trans	-93.2	105.9	171.1	-177.1	-9	0	0	0	110.2	C796 Y797 L835 A920 V921	C796-N918 VanDerWaalsContact O-CG 3.3Å; C796-N918 PolarHBondContact O-OD1 2.95Å; Y797-N918 HydrophobicContact CD1-CB 3.87Å; Y797-N918 HydrophobicContact CE1-CB 3.81Å; L835-N918 PolarHBondContact O-N 3.03Å; N918-A920 PolarHBondContact O-N 3.31Å; N918-A920 VanDerWaalsContact OD1-CB 3.26Å; N918-A920 WeakPolarHBondContact OD1-CB 3.48Å; N918-A920 PolarHBondContact OD1-N 3.25Å; N918-V921 HydrophobicContact CB-CG2 4.22Å; N918-V921 PolarHBondContact O-N 2.9Å
919	P	75.9	Confident	76.9	Confident	28 Å²	28	21 Å²	21	18%	0.182	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-69.9	-21.4	-177.5	28.6	-34.3	0	0	0	112.6	F786 P798 L917 V921 L922 L923	F786-P919 HydrophobicContact CB-CB 4.21Å; P798-P919 HydrophobicContact CG-CG 3.8Å; L917-P919 HydrophobicContact CD2-CB 4.26Å; L917-P919 VanDerWaalsContact O-CD 3.32Å; L917-P919 WeakPolarHBondContact O-CD 2.91Å; P919-V921 PolarHBondContact O-N 2.81Å; P919-L922 WeakPolarHBondContact O-CB 3.07Å; P919-L922 PolarHBondContact O-N 3.35Å; P919-L923 PolarHBondContact O-N 3.25Å
920	A	73.9	Confident	75.3	Confident	13 Å²	13	22.9 Å²	22.9	11%	0.107	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-63.9	-31.2	-179.5	0	0	0	0	0	112.6	V863 N918 L922 L923	V863-A920 HydrophobicContact CB-CB 4.17Å; V863-A920 HydrophobicContact CG2-CB 3.93Å; N918-A920 PolarHBondContact O-N 3.31Å; N918-A920 VanDerWaalsContact OD1-CB 3.26Å; N918-A920 WeakPolarHBondContact OD1-CB 3.48Å; N918-A920 PolarHBondContact OD1-N 3.25Å; A920-L922 VanDerWaalsContact C-N 3.25Å; A920-L922 PolarHBondContact O-N 3.4Å; A920-L923 PolarHBondContact O-N 3.3Å
921	V	74.9	Confident	73.8	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-68	-28.1	175.5	-176.4	0	0	0	0	111.5	L828 H833 L835 V863 N918 P919	L828-V921 HydrophobicContact CB-CG1 3.93Å; L828-V921 HydrophobicContact CD2-CG1 4.4Å; L828-V921 WeakPolarHBondContact CD2-O 3.25Å; H833-V921 HydrophobicContact CB-CG1 4.28Å; H833-V921 HydrophobicContact CB-CG2 3.64Å; L835-V921 HydrophobicContact CB-CG1 4.45Å; L835-V921 HydrophobicContact CD1-CB 4.06Å; L835-V921 HydrophobicContact CD1-CG1 4.24Å; V863-V921 HydrophobicContact CG2-CG2 4.19Å; N918-V921 HydrophobicContact CB-CG2 4.22Å; N918-V921 PolarHBondContact O-N 2.9Å; P919-V921 PolarHBondContact O-N 2.81Å
922	L	74.6	Confident	72.1	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-22.5	176.5	-59.1	177.4	0	0	0	112.4	F784 F786 L828 L835 L917 P919 A920 E924 D925 V929 A957	F784-L922 HydrophobicContact CE2-CD1 4.43Å; F784-L922 HydrophobicContact CZ-CD1 3.77Å; F786-L922 HydrophobicContact CD1-CD1 4.47Å; F786-L922 HydrophobicContact CD2-CB 4.21Å; F786-L922 HydrophobicContact CE1-CB 4.47Å; F786-L922 HydrophobicContact CE1-CD1 4.28Å; F786-L922 HydrophobicContact CE2-CB 3.66Å; F786-L922 HydrophobicContact CZ-CB 3.82Å; F786-L922 HydrophobicContact CZ-CD1 4.43Å; L828-L922 HydrophobicContact CD2-CD2 4.39Å; L835-L922 HydrophobicContact CD1-CD1 4.46Å; L835-L922 HydrophobicContact CD1-CD2 3.61Å; L835-L922 HydrophobicContact CD1-CG 3.79Å; L835-L922 HydrophobicContact CD2-CD2 4.38Å; L917-L922 HydrophobicContact CD1-CD1 4.36Å; L917-L922 HydrophobicContact CD2-CD1 3.96Å; P919-L922 WeakPolarHBondContact O-CB 3.07Å; P919-L922 PolarHBondContact O-N 3.35Å; A920-L922 VanDerWaalsContact C-N 3.25Å; A920-L922 PolarHBondContact O-N 3.4Å; L922-E924 VanDerWaalsContact C-N 3.27Å; L922-E924 PolarHBondContact O-N 2.89Å; L922-D925 PolarHBondContact O-N 3.39Å; L922-V929 HydrophobicContact CD2-CB 4.4Å; L922-V929 HydrophobicContact CD2-CG1 4.27Å; L922-V929 HydrophobicContact CD2-CG2 4.24Å; L922-A957 HydrophobicContact CD1-CB 4.06Å
923	L	70.8	Confident	70.6	Confident	46 Å²	46	20 Å²	20	24%	0.241	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-17.4	178.5	-67.9	173.6	0	0	0	113.4	F786 P919 A920 D925 F959	F786-L923 HydrophobicContact CD2-CD2 3.7Å; F786-L923 HydrophobicContact CD2-CG 4.24Å; F786-L923 HydrophobicContact CE2-CD2 3.99Å; P919-L923 PolarHBondContact O-N 3.25Å; A920-L923 PolarHBondContact O-N 3.3Å; L923-D925 PolarHBondContact O-N 3.23Å; L923-F959 HydrophobicContact CD2-CD2 4.34Å; L923-F959 HydrophobicContact CD2-CE2 3.81Å
924	E	66.8	Low	69.1	Low	27 Å²	27	22.3 Å²	22.3	13%	0.126	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-13.3	174.6	-68.9	-163.6	128.1	0	0	113.2	Y831 V863 L922	Y831-E924 WeakPolarHBondContact CB-OE2 2.97Å; Y831-E924 WeakPolarHBondContact CD1-OE2 2.86Å; Y831-E924 HydrophobicContact CD2-CB 4.18Å; Y831-E924 WeakPolarHBondContact CD2-OE2 3.26Å; Y831-E924 HydrophobicContact CE1-CB 4.24Å; Y831-E924 WeakPolarHBondContact CE1-OE2 3.38Å; Y831-E924 HydrophobicContact CE2-CB 3.74Å; Y831-E924 PolarHBondContact OH-O 3.15Å; V863-E924 HydrophobicContact CG1-CG 3.82Å; L922-E924 VanDerWaalsContact C-N 3.27Å; L922-E924 PolarHBondContact O-N 2.89Å
925	D	63.3	Low	67.4	Low	25 Å²	25	20.3 Å²	20.3	13%	0.134	11%	0.106	C	C	.	.	S	Bend	trans	-138.3	102.5	-178.8	-161.6	20	0	0	0	110.7	R882 L922 L923 H927	R882-D925 IonicContact CZ-OD2 3.52Å; R882-D925 IonicContact NH1-OD2 3.53Å; R882-D925 PolarHBondContact NH1-OD2 3.18Å; L922-D925 PolarHBondContact O-N 3.39Å; L923-D925 PolarHBondContact O-N 3.23Å; D925-H927 PolarHBondContact O-N 2.98Å; D925-H927 IonicContact OD1-CD2 3.76Å; D925-H927 PolarHBondContact OD1-CD2 3.21Å; D925-H927 IonicContact OD1-NE2 3.89Å; D925-H927 IonicContact OD2-CD2 3.18Å
926	A	57.7	Low	65.9	Low	11 Å²	11	20.3 Å²	20.3	9%	0.091	11%	0.107	C	C	.	.			trans	-77.4	67.8	-174.5	0	0	0	0	0	112.9	F874 F959	F874-A926 HydrophobicContact CB-CB 3.66Å; F874-A926 HydrophobicContact CD1-CB 3.35Å; F874-A926 HydrophobicContact CD2-CB 3.73Å; F874-A926 HydrophobicContact CE1-CB 3.77Å; F874-A926 HydrophobicContact CE2-CB 4.11Å; F874-A926 HydrophobicContact CG-CB 3.32Å; F874-A926 HydrophobicContact CZ-CB 4.12Å; A926-F959 HydrophobicContact CB-CE1 4.39Å
927	H	63.2	Low	64.5	Low	56 Å²	56	22 Å²	22	26%	0.259	12%	0.115	S	C	.	.	S	Bend	trans	-127.6	152.8	178.1	-67.6	-29.7	0	0	0	110.2	T880 R882 D925 V929	T880-H927 WeakPolarHBondContact O-CB 3.49Å; T880-H927 PolarHBondContact OG1-CE1 2.9Å; T880-H927 PolarHBondContact OG1-ND1 3.14Å; R882-H927 HydrophobicContact CB-CB 4.33Å; D925-H927 PolarHBondContact O-N 2.98Å; D925-H927 IonicContact OD1-CD2 3.76Å; D925-H927 PolarHBondContact OD1-CD2 3.21Å; D925-H927 IonicContact OD1-NE2 3.89Å; D925-H927 IonicContact OD2-CD2 3.18Å; H927-V929 WeakPolarHBondContact O-CG2 3.41Å; H927-V929 PolarHBondContact O-N 2.91Å
928	T	56.9	Low	63.1	Low	20 Å²	20	23.3 Å²	23.3	12%	0.123	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	114.1	167.6	-52	0	0	0	0	107	T880 T881 R882	T880-T928 PolarHBondContact O-N 2.93Å; T881-T928 CarbonylContact C-O 3.41Å; T881-T928 VanDerWaalsContact CA-O 3.24Å; T881-T928 WeakPolarHBondContact CA-O 3.46Å; T881-T928 HydrophobicContact CG2-CG2 4.32Å; R882-T928 PolarHBondContact N-O 3.5Å
929	V	59.6	Low	61.9	Low	1 Å²	1	28.5 Å²	28.5	1%	0.006	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	116.6	-173.2	-175.3	0	0	0	0	109.8	M884 L922 H927 I931 A957	M884-V929 HydrophobicContact CE-CG1 3.48Å; M884-V929 VanDerWaalsContact CE-CG1 3.48Å; M884-V929 HydrophobicContact CG-CG1 4.29Å; M884-V929 HydrophobicContact SD-CG1 4.31Å; L922-V929 HydrophobicContact CD2-CB 4.4Å; L922-V929 HydrophobicContact CD2-CG1 4.27Å; L922-V929 HydrophobicContact CD2-CG2 4.24Å; H927-V929 WeakPolarHBondContact O-CG2 3.41Å; H927-V929 PolarHBondContact O-N 2.91Å; V929-I931 HydrophobicContact CG1-CG1 4.25Å; V929-A957 HydrophobicContact CB-CB 4.27Å; V929-A957 PolarHBondContact N-O 3.33Å; V929-A957 WeakPolarHBondContact O-CB 3.01Å; V929-A957 PolarHBondContact O-N 3.05Å
930	L	56.4	Low	61.3	Low	40 Å²	40	29.9 Å²	29.9	21%	0.209	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	108	170.3	-75	167.2	0	0	0	108.8	T881 R882 T883 M884 K932 V954 E956	T881-L930 HydrophobicContact CG2-CD1 4.4Å; R882-L930 PolarHBondContact O-N 3.5Å; T883-L930 CarbonylContact C-O 3.43Å; T883-L930 WeakPolarHBondContact CA-O 3.45Å; T883-L930 HydrophobicContact CG2-CB 4.01Å; T883-L930 HydrophobicContact CG2-CD1 4.21Å; M884-L930 PolarHBondContact N-O 3.06Å; L930-K932 PolarHBondContact O-N 3.48Å; L930-V954 HydrophobicContact CD2-CG1 4.21Å; L930-E956 HydrophobicContact CD2-CB 3.83Å; L930-E956 HydrophobicContact CD2-CG 3.69Å
931	I	58.4	Low	60.1	Low	3 Å²	3	35.3 Å²	35.3	2%	0.015	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	107.3	175	-42.7	-165.1	0	0	0	107.7	P825 M884 L917 V929 V954 V955	P825-I931 HydrophobicContact CG-CG2 3.82Å; M884-I931 HydrophobicContact CE-CB 4.14Å; M884-I931 HydrophobicContact CE-CD1 3.68Å; M884-I931 HydrophobicContact CE-CG1 3.48Å; M884-I931 VanDerWaalsContact CE-CG1 3.48Å; M884-I931 HydrophobicContact CE-CG2 4.03Å; L917-I931 HydrophobicContact CD1-CD1 3.57Å; V929-I931 HydrophobicContact CG1-CG1 4.25Å; I931-V954 WeakPolarHBondContact O-CA 3.43Å; I931-V955 HydrophobicContact CB-CB 4.36Å; I931-V955 PolarHBondContact N-O 3.39Å; I931-V955 PolarHBondContact O-N 3.41Å
932	K	54.4	Low	58.9	Low	78 Å²	78	44.5 Å²	44.5	34%	0.339	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	109.4	175	-173	169.5	-174.7	178.9	0	109.1	M884 L930 V954	M884-K932 CarbonylContact O-C 3.59Å; M884-K932 WeakPolarHBondContact O-CA 3.24Å; M884-K932 VanDerWaalsContact O-CB 3.28Å; M884-K932 WeakPolarHBondContact O-CB 2.96Å; M884-K932 PolarHBondContact O-N 3.3Å; L930-K932 PolarHBondContact O-N 3.48Å; K932-V954 HydrophobicContact CG-CG2 4.15Å
933	D	56.4	Low	57.5	Low	2 Å²	2	47.2 Å²	47.2	1%	0.011	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	134.6	168.6	-168.4	11.9	0	0	0	109.1	Y803 L824 V953	Y803-D933 HydrophobicContact CE1-CB 4.19Å; L824-D933 WeakPolarHBondContact CD2-OD2 3.47Å; D933-V953 HydrophobicContact CB-CB 4.39Å; D933-V953 WeakPolarHBondContact CB-O 3.32Å; D933-V953 PolarHBondContact N-O 3.1Å
934	Q	58	Low	56.3	Low	51 Å²	51	52.5 Å²	52.5	24%	0.238	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	158.4	-177.1	-91.6	-104.5	-10.9	0	0	110.8	F885 C886 A936	F885-Q934 HydrophobicContact CB-CG 4.1Å; C886-Q934 HydrophobicContact CB-CB 4.07Å; C886-Q934 HydrophobicContact CB-CG 4.22Å; C886-Q934 WeakPolarHBondContact O-CB 3.45Å; C886-Q934 WeakPolarHBondContact O-CG 2.94Å; C886-Q934 PolarHBondContact O-OE1 3.4Å; Q934-A936 PolarHBondContact O-N 3.45Å
935	P	55.3	Low	55	Low	13 Å²	13	57.4 Å²	57.4	8%	0.084	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	134.7	-162.1	31.5	-38.3	0	0	0	111.4	L937 L950 N951	P935-L937 PolarHBondContact O-N 3.23Å; P935-L950 HydrophobicContact CB-CB 4.35Å; P935-L950 HydrophobicContact CB-CD1 3.88Å; P935-L950 HydrophobicContact CB-CD2 4.48Å; P935-L950 HydrophobicContact CB-CG 3.55Å; P935-L950 HydrophobicContact CG-CD1 3.41Å; P935-L950 VanDerWaalsContact CG-CD1 3.41Å; P935-L950 HydrophobicContact CG-CD2 3.97Å; P935-L950 HydrophobicContact CG-CG 3.38Å; P935-N951 WeakPolarHBondContact CA-O 3.5Å; P935-N951 WeakPolarHBondContact CB-O 3.1Å
936	A	54.9	Low	54	Low	2 Å²	2	61 Å²	61	2%	0.017	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54	111.1	164.1	0	0	0	0	0	108.4	I775 F805 V820 Q821 I822 Q934	I775-A936 HydrophobicContact CD1-CB 3.88Å; I775-A936 WeakPolarHBondContact CD1-O 3.31Å; I775-A936 HydrophobicContact CG2-CB 4.01Å; F805-A936 HydrophobicContact CD1-CB 3.97Å; F805-A936 HydrophobicContact CE1-CB 4.16Å; V820-A936 HydrophobicContact CG1-CB 3.82Å; Q821-A936 CarbonylContact O-C 3.52Å; Q821-A936 VanDerWaalsContact O-CA 3.27Å; Q821-A936 WeakPolarHBondContact O-CA 3.27Å; I822-A936 HydrophobicContact CG1-CB 4.12Å; Q934-A936 PolarHBondContact O-N 3.45Å
937	L	56.8	Low	53.4	Low	36 Å²	36	64.9 Å²	64.9	19%	0.188	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	119.1	179.9	-172	93.2	0	0	0	108.6	V820 Q821 P935 K939 P948	V820-L937 CarbonylContact C-O 3.58Å; V820-L937 WeakPolarHBondContact CA-O 3.44Å; Q821-L937 HydrophobicContact CB-CB 4.41Å; Q821-L937 PolarHBondContact N-O 3.42Å; Q821-L937 PolarHBondContact O-N 3.28Å; P935-L937 PolarHBondContact O-N 3.23Å; L937-K939 HydrophobicContact CD2-CD 4.37Å; L937-K939 HydrophobicContact CD2-CG 4.08Å; L937-P948 HydrophobicContact CD1-CB 4Å
938	V	55.9	Low	52.8	Low	30 Å²	30	65.6 Å²	65.6	18%	0.182	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	124.9	171.4	171.5	0	0	0	0	110.4	I773 I775 V807 T818 V819 V820 Y940	I773-V938 HydrophobicContact CD1-CG1 3.78Å; I773-V938 HydrophobicContact CG2-CB 4.48Å; I773-V938 HydrophobicContact CG2-CG1 4.22Å; I773-V938 HydrophobicContact CG2-CG2 4.11Å; I775-V938 HydrophobicContact CD1-CB 4.16Å; I775-V938 HydrophobicContact CD1-CG2 3.18Å; I775-V938 HydrophobicContact CG1-CG2 3.82Å; V807-V938 HydrophobicContact CG1-CG2 4.37Å; T818-V938 HydrophobicContact CG2-CG1 3.81Å; V819-V938 CarbonylContact O-C 3.56Å; V819-V938 VanDerWaalsContact O-CA 3.25Å; V819-V938 WeakPolarHBondContact O-CA 3.4Å; V820-V938 HydrophobicContact CG2-CG2 3.83Å; V938-Y940 HydrophobicContact CG1-CD1 4.11Å
939	K	56.7	Low	52.6	Low	116 Å²	116	70.4 Å²	70.4	50%	0.504	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	139	164.4	-73.1	179.2	179	167.1	0	109.1	V819 L937	V819-K939 PolarHBondContact N-O 3.04Å; V819-K939 PolarHBondContact O-N 3.27Å; L937-K939 HydrophobicContact CD2-CD 4.37Å; L937-K939 HydrophobicContact CD2-CG 4.08Å
940	Y	62.7	Low	52.4	Low	58 Å²	58	75.5 Å²	75.5	23%	0.227	40%	0.395	C	S	.	.			trans	-143.3	152.3	173.3	60.2	-81.8	0	0	0	108.8	V771 I773 V938 T943	V771-Y940 HydrophobicContact CB-CE2 4Å; V771-Y940 HydrophobicContact CG1-CD2 4.36Å; V771-Y940 HydrophobicContact CG1-CE2 4.04Å; I773-Y940 HydrophobicContact CD1-CD1 4.2Å; V938-Y940 HydrophobicContact CG1-CD1 4.11Å; Y940-T943 HydrophobicContact CE2-CG2 4.18Å; Y940-T943 WeakPolarHBondContact CE2-OG1 3.44Å; Y940-T943 PolarHBondContact OH-OG1 2.85Å
941	L	47.7	Very low	52.7	Low	127 Å²	127	75.9 Å²	75.9	67%	0.665	40%	0.397	S	S	*	.	S	Bend	trans	-87.4	129.6	-175.6	-95.1	135	0	0	0	110.6
942	K	49.7	Very low	53	Low	192 Å²	192	78.3 Å²	78.3	84%	0.835	41%	0.412	S	S	*	.	S	Bend	trans	72	80.5	172.8	-68	179.3	171.1	178.1	0	117.6
943	T	46.2	Very low	53.8	Low	57 Å²	57	75 Å²	75	35%	0.35	40%	0.398	S	S	.	.			trans	-155.8	162.4	142.7	52.9	0	0	0	0	110.1	H769 Y940	H769-T943 VanDerWaalsContact O-CG2 3.27Å; H769-T943 WeakPolarHBondContact O-CG2 3.46Å; Y940-T943 HydrophobicContact CE2-CG2 4.18Å; Y940-T943 WeakPolarHBondContact CE2-OG1 3.44Å; Y940-T943 PolarHBondContact OH-OG1 2.85Å
944	I	45.5	Very low	54.6	Low	157 Å²	157	78 Å²	78	81%	0.805	42%	0.417	S	S	*	.	S	Bend	trans	-91.3	-4.4	-169.9	-70.6	172.2	0	0	0	113.8	P946	I944-P946 WeakPolarHBondContact O-CD 3.16Å
945	D	40.1	Very low	55.6	Low	131 Å²	131	75.7 Å²	75.7	70%	0.701	41%	0.406	S	S	*	.			trans	-123.5	86.7	176.4	-108.6	-31	0	0	0	112.6	S947	D945-S947 PolarHBondContact O-N 3.09Å
946	P	41.6	Very low	56.7	Low	100 Å²	100	79 Å²	79	65%	0.649	42%	0.42	S	S	*	.			trans	-85.3	87.6	163.7	33.5	-25.5	0	0	0	107.3	I944 P948	I944-P946 WeakPolarHBondContact O-CD 3.16Å; P946-P948 WeakPolarHBondContact O-CD 3.16Å
947	S	44.3	Very low	57.8	Low	92 Å²	92	79 Å²	79	64%	0.643	42%	0.42	S	S	*	.			trans	-78.5	99.7	150.7	-61.7	0	0	0	0	106.1	D945 M949	D945-S947 PolarHBondContact O-N 3.09Å; S947-M949 PolarHBondContact O-N 3.11Å
948	P	51.4	Low	58.6	Low	71 Å²	71	79.7 Å²	79.7	46%	0.461	43%	0.425	S	S	.	.			trans	-63.2	105.8	177.1	26.1	-33.9	0	0	0	108.6	L937 P946 L950	L937-P948 HydrophobicContact CD1-CB 4Å; P946-P948 WeakPolarHBondContact O-CD 3.16Å; P948-L950 PolarHBondContact O-N 3.19Å
949	M	52.8	Low	59.4	Low	121 Å²	121	80 Å²	80	60%	0.596	43%	0.425	S	S	*	.			trans	-69	126.2	172.5	-72.8	-130	126.7	0	0	108.9	S947	S947-M949 PolarHBondContact O-N 3.11Å
950	L	54.5	Low	60	Low	108 Å²	108	75.9 Å²	75.9	57%	0.565	41%	0.41	S	S	*	.			trans	-110.8	110.9	-168.2	-139.1	81.2	0	0	0	108.7	P935 P948	P935-L950 HydrophobicContact CB-CB 4.35Å; P935-L950 HydrophobicContact CB-CD1 3.88Å; P935-L950 HydrophobicContact CB-CD2 4.48Å; P935-L950 HydrophobicContact CB-CG 3.55Å; P935-L950 HydrophobicContact CG-CD1 3.41Å; P935-L950 VanDerWaalsContact CG-CD1 3.41Å; P935-L950 HydrophobicContact CG-CD2 3.97Å; P935-L950 HydrophobicContact CG-CG 3.38Å; P948-L950 PolarHBondContact O-N 3.19Å
951	N	62.7	Low	60	Low	48 Å²	48	78 Å²	78	26%	0.257	42%	0.422	S	S	.	.			trans	-118.5	120.7	175.3	-169.2	55.1	0	0	0	111.4	I775 G777 P935	I775-N951 VanDerWaalsContact O-CB 3.29Å; I775-N951 WeakPolarHBondContact O-CB 3.44Å; G777-N951 PolarHBondContact N-ND2 3.41Å; P935-N951 WeakPolarHBondContact CA-O 3.5Å; P935-N951 WeakPolarHBondContact CB-O 3.1Å
952	T	64.7	Low	60.9	Low	54 Å²	54	77.6 Å²	77.6	33%	0.331	42%	0.415	S	S	.	.			trans	-107.7	133.5	-173.8	58.6	0	0	0	0	111.8
953	V	72.1	Confident	61.6	Low	9 Å²	9	70.2 Å²	70.2	6%	0.055	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	137.8	176.2	-174.8	0	0	0	0	108.8	V779 Y803 F805 D933	V779-V953 HydrophobicContact CB-CG1 3.69Å; V779-V953 HydrophobicContact CG1-CG1 3.58Å; Y803-V953 HydrophobicContact CD1-CG1 4.1Å; Y803-V953 HydrophobicContact CE1-CG1 4.04Å; F805-V953 HydrophobicContact CE1-CG2 4Å; F805-V953 HydrophobicContact CZ-CG2 4.39Å; D933-V953 HydrophobicContact CB-CB 4.39Å; D933-V953 WeakPolarHBondContact CB-O 3.32Å; D933-V953 PolarHBondContact N-O 3.1Å
954	V	74	Confident	62.7	Low	66 Å²	66	68.2 Å²	68.2	40%	0.4	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	133.2	-174.6	-175	0	0	0	0	109.9	L930 I931 K932	L930-V954 HydrophobicContact CD2-CG1 4.21Å; I931-V954 WeakPolarHBondContact O-CA 3.43Å; K932-V954 HydrophobicContact CG-CG2 4.15Å
955	V	78.9	Confident	63.8	Low	1 Å²	1	67.3 Å²	67.3	1%	0.006	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	132	168.9	176.4	0	0	0	0	108.7	V779 K782 F784 F801 Y803 I931	V779-V955 HydrophobicContact CB-CG2 4.21Å; V779-V955 HydrophobicContact CG1-CG2 3.73Å; V779-V955 HydrophobicContact CG2-CG2 3.65Å; K782-V955 WeakPolarHBondContact O-CA 3.39Å; F784-V955 HydrophobicContact CD1-CG1 4.36Å; F784-V955 HydrophobicContact CE1-CG1 4.42Å; F801-V955 HydrophobicContact CD1-CG1 4.05Å; F801-V955 HydrophobicContact CD1-CG2 4.35Å; F801-V955 HydrophobicContact CE1-CG1 3.63Å; F801-V955 HydrophobicContact CZ-CG1 4.08Å; Y803-V955 HydrophobicContact CE1-CG2 4.38Å; Y803-V955 VanDerWaalsContact OH-CG2 3.24Å; Y803-V955 WeakPolarHBondContact OH-CG2 3.46Å; I931-V955 HydrophobicContact CB-CB 4.36Å; I931-V955 PolarHBondContact N-O 3.39Å; I931-V955 PolarHBondContact O-N 3.41Å
956	E	78.1	Confident	65.3	Low	84 Å²	84	63.1 Å²	63.1	39%	0.393	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	119.1	-179.7	-176.2	172.4	-157.8	0	0	111.2	K782 S783 F784 L930 V958	K782-E956 PolarHBondContact O-N 2.86Å; S783-E956 CarbonylContact C-O 3.58Å; S783-E956 WeakPolarHBondContact CA-O 3.3Å; S783-E956 VanDerWaalsContact CB-O 3.25Å; S783-E956 WeakPolarHBondContact CB-O 3.34Å; F784-E956 PolarHBondContact N-O 2.65Å; L930-E956 HydrophobicContact CD2-CB 3.83Å; L930-E956 HydrophobicContact CD2-CG 3.69Å; E956-V958 HydrophobicContact CG-CG2 3.97Å
957	A	76.8	Confident	66.8	Low	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	117.1	173.6	0	0	0	0	0	109.4	F784 F786 L922 V929	F784-A957 HydrophobicContact CD1-CB 4.13Å; F784-A957 HydrophobicContact CE1-CB 3.34Å; F784-A957 HydrophobicContact CE2-CB 4.32Å; F784-A957 HydrophobicContact CZ-CB 3.46Å; F784-A957 VanDerWaalsContact CZ-CB 3.46Å; F786-A957 HydrophobicContact CD1-CB 4.16Å; F786-A957 HydrophobicContact CE1-CB 3.81Å; L922-A957 HydrophobicContact CD1-CB 4.06Å; V929-A957 HydrophobicContact CB-CB 4.27Å; V929-A957 PolarHBondContact N-O 3.33Å; V929-A957 WeakPolarHBondContact O-CB 3.01Å; V929-A957 PolarHBondContact O-N 3.05Å
958	V	74.7	Confident	68.3	Low	51 Å²	51	58.1 Å²	58.1	31%	0.309	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	121.7	-176.1	-175.5	0	0	0	0	110.1	F784 V785 F786 E956	F784-V958 PolarHBondContact O-N 3.1Å; V785-V958 VanDerWaalsContact CA-O 3.27Å; V785-V958 WeakPolarHBondContact CA-O 3.19Å; V785-V958 HydrophobicContact CG2-CB 4.35Å; F786-V958 WeakPolarHBondContact CD1-O 3.1Å; F786-V958 PolarHBondContact N-O 3.25Å; E956-V958 HydrophobicContact CG-CG2 3.97Å
959	F	72.8	Confident	69.6	Low	38 Å²	38	59.7 Å²	59.7	17%	0.167	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	127.7	176.9	-178.4	-111.7	0	0	0	111.3	F786 L923 A926	F786-F959 AromaticContact CD2-CD2 3.95Å; F786-F959 HydrophobicContact CD2-CD2 3.95Å; F786-F959 HydrophobicContact CE1-CB 4.17Å; F786-F959 HydrophobicContact CE2-CB 4.29Å; F786-F959 AromaticContact CE2-CD2 3.55Å; F786-F959 HydrophobicContact CE2-CD2 3.55Å; F786-F959 HydrophobicContact CE2-CE2 4.39Å; F786-F959 HydrophobicContact CE2-CG 4.37Å; F786-F959 HydrophobicContact CZ-CB 3.85Å; F786-F959 AromaticContact CZ-CD2 4Å; F786-F959 HydrophobicContact CZ-CD2 4Å; F786-F959 HydrophobicContact CZ-CG 4.39Å; L923-F959 HydrophobicContact CD2-CD2 4.34Å; L923-F959 HydrophobicContact CD2-CE2 3.81Å; A926-F959 HydrophobicContact CB-CE1 4.39Å
960	S	67.9	Low	71	Confident	28 Å²	28	58.1 Å²	58.1	20%	0.196	30%	0.303	C	S	.	.			trans	-81.3	117.4	175.7	-152.7	0	0	0	0	110.9	F786 K962	F786-S960 PolarHBondContact O-N 2.69Å; S960-K962 PolarHBondContact O-N 3.28Å
961	Q	64.4	Low	72.2	Confident	103 Å²	103	56 Å²	56	48%	0.481	29%	0.291	S	S	.	.			trans	-74.8	32	178.1	-66.6	-176.8	-19.5	0	0	114.2	T879	T879-Q961 HydrophobicContact CG2-CG 4.42Å; T879-Q961 VanDerWaalsContact CG2-NE2 3.28Å
962	K	65.4	Low	73.2	Confident	119 Å²	119	58.9 Å²	58.9	52%	0.517	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-71.1	131	176.2	-68.9	178.8	-166.5	157.3	0	109.4	D787 S960 S964	D787-K962 IonicContact OD2-NZ 3.14Å; D787-K962 PolarHBondContact OD2-NZ 3.26Å; D787-K962 VanDerWaalsContact OD2-NZ 3.14Å; S960-K962 PolarHBondContact O-N 3.28Å; K962-S964 PolarHBondContact O-N 3.43Å
963	P	65.6	Low	74.1	Confident	36 Å²	36	58.6 Å²	58.6	23%	0.234	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-71	133.7	178.9	24.9	-28.6	0	0	0	110.6	F875 V967 K968	F875-P963 HydrophobicContact CD2-CB 4.03Å; F875-P963 HydrophobicContact CE2-CB 3.68Å; F875-P963 HydrophobicContact CE2-CG 4.02Å; F875-P963 HydrophobicContact CZ-CB 4.16Å; F875-P963 HydrophobicContact CZ-CG 4.38Å; P963-V967 HydrophobicContact CB-CB 4.41Å; P963-V967 HydrophobicContact CB-CG1 4.12Å; P963-K968 HydrophobicContact CB-CG 4.11Å; P963-K968 HydrophobicContact CG-CG 4.03Å; P963-K968 WeakPolarHBondContact O-CE 3.34Å; P963-K968 PolarHBondContact O-NZ 3.26Å; P963-K968 VanDerWaalsContact O-NZ 3.13Å
964	S	68	Low	74.7	Confident	16 Å²	16	61.5 Å²	61.5	11%	0.112	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-63.3	158.4	174.8	76.1	0	0	0	0	111.4	K962 A966 V967 K968	K962-S964 PolarHBondContact O-N 3.43Å; S964-A966 PolarHBondContact O-N 3.13Å; S964-V967 PolarHBondContact O-N 2.87Å; S964-V967 WeakPolarHBondContact OG-CG2 3.45Å; S964-V967 PolarHBondContact OG-N 2.99Å; S964-K968 WeakPolarHBondContact O-CG 3.3Å; S964-K968 PolarHBondContact O-N 3.04Å
965	M	69.6	Low	75.2	Confident	138 Å²	138	61.9 Å²	61.9	68%	0.68	33%	0.332	S	S	*	.	H	α-helix	trans	-56.6	-36.3	180	-163.1	174	-164.3	0	0	112.7	K968 I969	M965-K968 PolarHBondContact O-N 3.21Å; M965-I969 HydrophobicContact CG-CD1 4.28Å; M965-I969 VanDerWaalsContact O-CG1 3.28Å; M965-I969 WeakPolarHBondContact O-CG1 3.28Å; M965-I969 PolarHBondContact O-N 3.41Å
966	A	70.6	Confident	75.7	Confident	43 Å²	43	66.8 Å²	66.8	36%	0.355	36%	0.358	S	S	.	.	H	α-helix	trans	-66.8	-40.9	176.1	0	0	0	0	0	112.1	F868 S964 I969 F970	F868-A966 HydrophobicContact CD2-CB 3.91Å; F868-A966 HydrophobicContact CE2-CB 3.67Å; S964-A966 PolarHBondContact O-N 3.13Å; A966-I969 PolarHBondContact O-N 3.45Å; A966-F970 WeakPolarHBondContact O-CB 3.4Å; A966-F970 PolarHBondContact O-N 3.43Å
967	V	72.8	Confident	76.1	Confident	3 Å²	3	67.3 Å²	67.3	2%	0.018	37%	0.366	C	S	.	.	H	α-helix	trans	-67.5	-40.6	175	175.4	0	0	0	0	111	Q871 I872 F875 P963 S964 I969 F970 I971	Q871-V967 HydrophobicContact CB-CG2 4.44Å; I872-V967 HydrophobicContact CG1-CG2 4.1Å; F875-V967 HydrophobicContact CD1-CG1 4.48Å; F875-V967 HydrophobicContact CG-CG1 4.5Å; P963-V967 HydrophobicContact CB-CB 4.41Å; P963-V967 HydrophobicContact CB-CG1 4.12Å; S964-V967 PolarHBondContact O-N 2.87Å; S964-V967 WeakPolarHBondContact OG-CG2 3.45Å; S964-V967 PolarHBondContact OG-N 2.99Å; V967-I969 PolarHBondContact O-N 3.47Å; V967-F970 PolarHBondContact O-N 2.88Å; V967-I971 HydrophobicContact CG1-CD1 3.81Å; V967-I971 HydrophobicContact CG1-CG1 4.32Å; V967-I971 VanDerWaalsContact O-CG1 3.27Å; V967-I971 WeakPolarHBondContact O-CG1 3.45Å; V967-I971 PolarHBondContact O-N 2.85Å
968	K	76.4	Confident	76.7	Confident	84 Å²	84	72.1 Å²	72.1	37%	0.365	39%	0.392	S	S	.	.	H	α-helix	trans	-57.3	-48.6	173.7	-70.5	168.8	-178.8	145.9	0	111	E789 P963 S964 M965 I971 I972	E789-K968 IonicContact OE1-NZ 2.91Å; E789-K968 PolarHBondContact OE1-NZ 3.34Å; P963-K968 HydrophobicContact CB-CG 4.11Å; P963-K968 HydrophobicContact CG-CG 4.03Å; P963-K968 WeakPolarHBondContact O-CE 3.34Å; P963-K968 PolarHBondContact O-NZ 3.26Å; P963-K968 VanDerWaalsContact O-NZ 3.13Å; S964-K968 WeakPolarHBondContact O-CG 3.3Å; S964-K968 PolarHBondContact O-N 3.04Å; M965-K968 PolarHBondContact O-N 3.21Å; K968-I971 PolarHBondContact O-N 3.43Å; K968-I972 WeakPolarHBondContact O-CD1 3.16Å; K968-I972 VanDerWaalsContact O-CG1 3.23Å; K968-I972 WeakPolarHBondContact O-CG1 3.35Å; K968-I972 PolarHBondContact O-N 2.91Å
969	I	78.9	Confident	77.2	Confident	104 Å²	104	71.5 Å²	71.5	53%	0.533	40%	0.396	S	S	.	.	H	α-helix	trans	-64.3	-41.8	177.8	-67.8	166.4	0	0	0	111	M965 A966 V967 I972 A973	M965-I969 HydrophobicContact CG-CD1 4.28Å; M965-I969 VanDerWaalsContact O-CG1 3.28Å; M965-I969 WeakPolarHBondContact O-CG1 3.28Å; M965-I969 PolarHBondContact O-N 3.41Å; A966-I969 PolarHBondContact O-N 3.45Å; V967-I969 PolarHBondContact O-N 3.47Å; I969-I972 PolarHBondContact O-N 3.04Å; I969-A973 WeakPolarHBondContact O-CB 3.27Å; I969-A973 PolarHBondContact O-N 3.3Å
970	F	81.4	Confident	77.9	Confident	88 Å²	88	74.2 Å²	74.2	39%	0.386	41%	0.411	S	S	.	.	H	α-helix	trans	-60.9	-46.6	177	-179.6	-98.1	0	0	0	112.1	F868 I872 A966 V967 I972 A973 V974	F868-F970 HydrophobicContact CE1-CD2 4.38Å; F868-F970 HydrophobicContact CZ-CB 4.02Å; F868-F970 HydrophobicContact CZ-CD2 4.03Å; F868-F970 HydrophobicContact CZ-CG 4.11Å; I872-F970 HydrophobicContact CD1-CD1 4.1Å; I872-F970 HydrophobicContact CD1-CE1 4.11Å; I872-F970 HydrophobicContact CD1-CG 4.38Å; I872-F970 HydrophobicContact CD1-CZ 4.39Å; A966-F970 WeakPolarHBondContact O-CB 3.4Å; A966-F970 PolarHBondContact O-N 3.43Å; V967-F970 PolarHBondContact O-N 2.88Å; F970-I972 VanDerWaalsContact C-N 3.33Å; F970-I972 PolarHBondContact O-N 3.34Å; F970-A973 PolarHBondContact O-N 3.02Å; F970-V974 HydrophobicContact CD1-CG2 4.31Å; F970-V974 HydrophobicContact CD2-CG2 4.33Å; F970-V974 HydrophobicContact CE1-CG2 3.96Å; F970-V974 HydrophobicContact CE2-CG2 3.98Å; F970-V974 HydrophobicContact CG-CG2 4.49Å; F970-V974 HydrophobicContact CZ-CG2 3.78Å; F970-V974 WeakPolarHBondContact O-CB 3.4Å; F970-V974 VanDerWaalsContact O-CG2 3.31Å; F970-V974 WeakPolarHBondContact O-CG2 3.45Å; F970-V974 PolarHBondContact O-N 2.93Å
971	I	80.3	Confident	78.8	Confident	63 Å²	63	76.2 Å²	76.2	32%	0.323	42%	0.423	S	S	.	.	H	α-helix	trans	-60.9	-43.1	176.8	-68.2	167.9	0	0	0	110.7	F875 V967 K968 S975	F875-I971 HydrophobicContact CE1-CD1 4.33Å; V967-I971 HydrophobicContact CG1-CD1 3.81Å; V967-I971 HydrophobicContact CG1-CG1 4.32Å; V967-I971 VanDerWaalsContact O-CG1 3.27Å; V967-I971 WeakPolarHBondContact O-CG1 3.45Å; V967-I971 PolarHBondContact O-N 2.85Å; K968-I971 PolarHBondContact O-N 3.43Å; I971-S975 WeakPolarHBondContact O-CB 3.38Å; I971-S975 PolarHBondContact O-N 3.5Å; I971-S975 PolarHBondContact O-OG 3.31Å
972	I	82.9	Confident	79.8	Confident	108 Å²	108	75.9 Å²	75.9	55%	0.554	42%	0.423	S	S	*	.	H	α-helix	trans	-62.9	-50.1	177.2	-68.1	165.1	0	0	0	110.4	K968 I969 F970 V974 S975 L976	K968-I972 WeakPolarHBondContact O-CD1 3.16Å; K968-I972 VanDerWaalsContact O-CG1 3.23Å; K968-I972 WeakPolarHBondContact O-CG1 3.35Å; K968-I972 PolarHBondContact O-N 2.91Å; I969-I972 PolarHBondContact O-N 3.04Å; F970-I972 VanDerWaalsContact C-N 3.33Å; F970-I972 PolarHBondContact O-N 3.34Å; I972-V974 PolarHBondContact O-N 3.32Å; I972-S975 PolarHBondContact O-N 3.44Å; I972-L976 WeakPolarHBondContact O-CB 3.23Å; I972-L976 PolarHBondContact O-N 2.7Å
973	A	84.8	Confident	80.9	Confident	49 Å²	49	74.7 Å²	74.7	41%	0.405	42%	0.422	S	S	.	.	H	α-helix	trans	-62.1	-45.5	-178	0	0	0	0	0	112.3	I969 F970 S975 L976 V977	I969-A973 WeakPolarHBondContact O-CB 3.27Å; I969-A973 PolarHBondContact O-N 3.3Å; F970-A973 PolarHBondContact O-N 3.02Å; A973-S975 VanDerWaalsContact C-N 3.34Å; A973-S975 PolarHBondContact O-N 2.93Å; A973-L976 PolarHBondContact O-N 2.87Å; A973-V977 WeakPolarHBondContact O-CG2 3.33Å; A973-V977 PolarHBondContact O-N 3.48Å
974	V	84.3	Confident	81.8	Confident	69 Å²	69	77 Å²	77	42%	0.418	44%	0.435	S	S	.	.	H	α-helix	trans	-63.5	-42.1	177.5	172.1	0	0	0	0	110.7	F970 I972 L976 V977 L978	F970-V974 HydrophobicContact CD1-CG2 4.31Å; F970-V974 HydrophobicContact CD2-CG2 4.33Å; F970-V974 HydrophobicContact CE1-CG2 3.96Å; F970-V974 HydrophobicContact CE2-CG2 3.98Å; F970-V974 HydrophobicContact CG-CG2 4.49Å; F970-V974 HydrophobicContact CZ-CG2 3.78Å; F970-V974 WeakPolarHBondContact O-CB 3.4Å; F970-V974 VanDerWaalsContact O-CG2 3.31Å; F970-V974 WeakPolarHBondContact O-CG2 3.45Å; F970-V974 PolarHBondContact O-N 2.93Å; I972-V974 PolarHBondContact O-N 3.32Å; V974-L976 VanDerWaalsContact C-N 3.32Å; V974-L976 PolarHBondContact O-N 3.02Å; V974-V977 PolarHBondContact O-N 3.43Å; V974-L978 WeakPolarHBondContact O-CB 3.31Å; V974-L978 PolarHBondContact O-N 3.31Å
975	S	85.4	Confident	82.5	Confident	74 Å²	74	78.8 Å²	78.8	52%	0.517	45%	0.451	S	S	.	.	H	α-helix	trans	-65.5	-35.4	178.7	-63.3	0	0	0	0	112.3	I971 I972 A973 G979	I971-S975 WeakPolarHBondContact O-CB 3.38Å; I971-S975 PolarHBondContact O-N 3.5Å; I971-S975 PolarHBondContact O-OG 3.31Å; I972-S975 PolarHBondContact O-N 3.44Å; A973-S975 VanDerWaalsContact C-N 3.34Å; A973-S975 PolarHBondContact O-N 2.93Å; S975-G979 PolarHBondContact O-N 3.44Å
976	L	88.6	Confident	83.2	Confident	105 Å²	105	76.7 Å²	76.7	55%	0.55	44%	0.442	S	S	.	.	H	α-helix	trans	-70.5	-43.3	177.3	-139.2	157.6	0	0	0	111.6	I972 A973 V974 G979 L980	I972-L976 WeakPolarHBondContact O-CB 3.23Å; I972-L976 PolarHBondContact O-N 2.7Å; A973-L976 PolarHBondContact O-N 2.87Å; V974-L976 VanDerWaalsContact C-N 3.32Å; V974-L976 PolarHBondContact O-N 3.02Å; L976-G979 PolarHBondContact O-N 2.93Å; L976-L980 HydrophobicContact CD2-CD1 3.71Å; L976-L980 HydrophobicContact CD2-CG 4.18Å; L976-L980 WeakPolarHBondContact O-CB 3.41Å; L976-L980 WeakPolarHBondContact O-CG 3.34Å; L976-L980 PolarHBondContact O-N 3.44Å
977	V	86.8	Confident	83.8	Confident	94 Å²	94	78.7 Å²	78.7	57%	0.57	45%	0.446	S	S	*	.	H	α-helix	trans	-63.2	-47.5	174.3	173.8	0	0	0	0	110.5	A973 V974 G979 L980 T981	A973-V977 WeakPolarHBondContact O-CG2 3.33Å; A973-V977 PolarHBondContact O-N 3.48Å; V974-V977 PolarHBondContact O-N 3.43Å; V977-G979 VanDerWaalsContact C-N 3.34Å; V977-G979 PolarHBondContact O-N 3.24Å; V977-L980 PolarHBondContact O-N 2.89Å; V977-T981 HydrophobicContact CG1-CG2 4.49Å; V977-T981 WeakPolarHBondContact O-CG2 3.46Å; V977-T981 PolarHBondContact O-N 2.92Å; V977-T981 PolarHBondContact O-OG1 3.28Å
978	L	88.7	Confident	84.2	Confident	102 Å²	102	86.1 Å²	86.1	53%	0.534	47%	0.474	S	S	.	.	H	α-helix	trans	-60.7	-45.1	178.1	-145.5	91.1	0	0	0	110.7	V974 L980 T981 I982	V974-L978 WeakPolarHBondContact O-CB 3.31Å; V974-L978 PolarHBondContact O-N 3.31Å; L978-L980 PolarHBondContact O-N 3.39Å; L978-T981 WeakPolarHBondContact CA-OG1 3.36Å; L978-T981 PolarHBondContact O-N 2.94Å; L978-T981 PolarHBondContact O-OG1 3.41Å; L978-I982 HydrophobicContact CD2-CD1 4.31Å; L978-I982 HydrophobicContact CG-CD1 4.47Å; L978-I982 WeakPolarHBondContact O-CG1 3.37Å; L978-I982 PolarHBondContact O-N 2.72Å
979	G	86.2	Confident	84.4	Confident	38 Å²	38	85.1 Å²	85.1	39%	0.392	48%	0.477	S	S	.	.	H	α-helix	trans	-59.1	-44.4	176.4	0	0	0	0	0	113.1	S975 L976 V977 I982 L983	S975-G979 PolarHBondContact O-N 3.44Å; L976-G979 PolarHBondContact O-N 2.93Å; V977-G979 VanDerWaalsContact C-N 3.34Å; V977-G979 PolarHBondContact O-N 3.24Å; G979-I982 PolarHBondContact O-N 2.9Å; G979-L983 VanDerWaalsContact O-CB 3.32Å; G979-L983 WeakPolarHBondContact O-CB 3.32Å; G979-L983 PolarHBondContact O-N 2.8Å
980	L	87.2	Confident	84.5	Confident	94 Å²	94	83.4 Å²	83.4	49%	0.492	47%	0.468	S	S	.	.	H	α-helix	trans	-67	-37.4	176.3	-73.5	170.9	0	0	0	112.4	L976 V977 L978 L983 T984	L976-L980 HydrophobicContact CD2-CD1 3.71Å; L976-L980 HydrophobicContact CD2-CG 4.18Å; L976-L980 WeakPolarHBondContact O-CB 3.41Å; L976-L980 WeakPolarHBondContact O-CG 3.34Å; L976-L980 PolarHBondContact O-N 3.44Å; V977-L980 PolarHBondContact O-N 2.89Å; L978-L980 PolarHBondContact O-N 3.39Å; L980-L983 HydrophobicContact CD2-CD2 4.48Å; L980-L983 PolarHBondContact O-N 3.45Å; L980-T984 WeakPolarHBondContact O-CB 3.35Å; L980-T984 WeakPolarHBondContact O-CG2 3.43Å; L980-T984 PolarHBondContact O-N 2.88Å; L980-T984 PolarHBondContact O-OG1 3.42Å
981	T	85.6	Confident	84.2	Confident	71 Å²	71	87.2 Å²	87.2	44%	0.436	48%	0.48	S	S	.	.	H	α-helix	trans	-66.4	-40.5	175.5	58.2	0	0	0	0	112	V977 L978 T984 A985	V977-T981 HydrophobicContact CG1-CG2 4.49Å; V977-T981 WeakPolarHBondContact O-CG2 3.46Å; V977-T981 PolarHBondContact O-N 2.92Å; V977-T981 PolarHBondContact O-OG1 3.28Å; L978-T981 WeakPolarHBondContact CA-OG1 3.36Å; L978-T981 PolarHBondContact O-N 2.94Å; L978-T981 PolarHBondContact O-OG1 3.41Å; T981-T984 WeakPolarHBondContact CA-OG1 3.47Å; T981-T984 PolarHBondContact O-OG1 2.99Å; T981-A985 WeakPolarHBondContact O-CB 3.34Å; T981-A985 PolarHBondContact O-N 2.9Å
982	I	87.2	Confident	84.2	Confident	95 Å²	95	91.2 Å²	91.2	49%	0.487	50%	0.495	S	S	.	.	H	α-helix	trans	-66.7	-42.1	174.7	-67.4	168.3	0	0	0	110.5	L978 G979 A985 L986	L978-I982 HydrophobicContact CD2-CD1 4.31Å; L978-I982 HydrophobicContact CG-CD1 4.47Å; L978-I982 WeakPolarHBondContact O-CG1 3.37Å; L978-I982 PolarHBondContact O-N 2.72Å; G979-I982 PolarHBondContact O-N 2.9Å; I982-A985 PolarHBondContact O-N 3.26Å; I982-L986 HydrophobicContact CG2-CD1 4.2Å; I982-L986 WeakPolarHBondContact O-CB 3.48Å; I982-L986 PolarHBondContact O-N 3.37Å
983	L	87.4	Confident	83.9	Confident	94 Å²	94	91.3 Å²	91.3	49%	0.492	50%	0.504	S	S	.	.	H	α-helix	trans	-61.2	-45.8	177.4	-172.5	82.3	0	0	0	111.7	G979 L980 L986 I987	G979-L983 VanDerWaalsContact O-CB 3.32Å; G979-L983 WeakPolarHBondContact O-CB 3.32Å; G979-L983 PolarHBondContact O-N 2.8Å; L980-L983 HydrophobicContact CD2-CD2 4.48Å; L980-L983 PolarHBondContact O-N 3.45Å; L983-L986 WeakPolarHBondContact O-CB 3.38Å; L983-L986 PolarHBondContact O-N 2.93Å; L983-I987 HydrophobicContact CD2-CD1 4.31Å; L983-I987 HydrophobicContact CG-CD1 4.05Å; L983-I987 VanDerWaalsContact O-CG1 3.27Å; L983-I987 WeakPolarHBondContact O-CG1 3.44Å; L983-I987 PolarHBondContact O-N 2.85Å
984	T	83.9	Confident	82.8	Confident	84 Å²	84	91 Å²	91	52%	0.515	51%	0.506	S	S	.	.	H	α-helix	trans	-65.7	-40.2	177.6	45.2	0	0	0	0	112	L980 T981 L986 I987 W988	L980-T984 WeakPolarHBondContact O-CB 3.35Å; L980-T984 WeakPolarHBondContact O-CG2 3.43Å; L980-T984 PolarHBondContact O-N 2.88Å; L980-T984 PolarHBondContact O-OG1 3.42Å; T981-T984 WeakPolarHBondContact CA-OG1 3.47Å; T981-T984 PolarHBondContact O-OG1 2.99Å; T984-L986 VanDerWaalsContact C-N 3.34Å; T984-I987 PolarHBondContact O-N 3.27Å; T984-W988 WeakPolarHBondContact O-CB 3.38Å; T984-W988 PolarHBondContact O-N 2.84Å
985	A	83.9	Confident	81.9	Confident	54 Å²	54	94.7 Å²	94.7	45%	0.446	52%	0.517	S	S	.	.	H	α-helix	trans	-61.5	-41.4	171.6	0	0	0	0	0	112	T981 I982 W988 C989	T981-A985 WeakPolarHBondContact O-CB 3.34Å; T981-A985 PolarHBondContact O-N 2.9Å; I982-A985 PolarHBondContact O-N 3.26Å; A985-W988 PolarHBondContact O-N 3.36Å; A985-C989 WeakPolarHBondContact O-CB 3.27Å; A985-C989 PolarHBondContact O-N 2.9Å
986	L	83.9	Confident	80.9	Confident	94 Å²	94	97.5 Å²	97.5	49%	0.492	52%	0.52	S	S	.	.	H	α-helix	trans	-63.6	-46.2	174.9	-100.5	162.7	0	0	0	112.2	I982 L983 T984 W988 C989 L990	I982-L986 HydrophobicContact CG2-CD1 4.2Å; I982-L986 WeakPolarHBondContact O-CB 3.48Å; I982-L986 PolarHBondContact O-N 3.37Å; L983-L986 WeakPolarHBondContact O-CB 3.38Å; L983-L986 PolarHBondContact O-N 2.93Å; T984-L986 VanDerWaalsContact C-N 3.34Å; L986-W988 VanDerWaalsContact C-N 3.29Å; L986-W988 PolarHBondContact O-N 2.88Å; L986-C989 PolarHBondContact O-N 3.38Å; L986-L990 WeakPolarHBondContact O-CB 3.33Å; L986-L990 VanDerWaalsContact O-CG 3.28Å; L986-L990 WeakPolarHBondContact O-CG 3.4Å; L986-L990 PolarHBondContact O-N 3.39Å
987	I	82.8	Confident	79.3	Confident	86 Å²	86	101.6 Å²	101.6	44%	0.441	53%	0.533	S	S	.	.	H	α-helix	trans	-60.1	-42.5	176.3	-70.2	165.9	0	0	0	110.1	L983 T984 L990 W991	L983-I987 HydrophobicContact CD2-CD1 4.31Å; L983-I987 HydrophobicContact CG-CD1 4.05Å; L983-I987 VanDerWaalsContact O-CG1 3.27Å; L983-I987 WeakPolarHBondContact O-CG1 3.44Å; L983-I987 PolarHBondContact O-N 2.85Å; T984-I987 PolarHBondContact O-N 3.27Å; I987-L990 PolarHBondContact O-N 3.43Å; I987-W991 WeakPolarHBondContact O-CB 3.28Å; I987-W991 PolarHBondContact O-N 2.82Å
988	W	81.9	Confident	77.7	Confident	158 Å²	158	107.6 Å²	107.6	60%	0.598	55%	0.545	S	S	*	.	H	α-helix	trans	-64	-44	176.8	-176.7	82.5	0	0	0	112.3	T984 A985 L986 W991 K992	T984-W988 WeakPolarHBondContact O-CB 3.38Å; T984-W988 PolarHBondContact O-N 2.84Å; A985-W988 PolarHBondContact O-N 3.36Å; L986-W988 VanDerWaalsContact C-N 3.29Å; L986-W988 PolarHBondContact O-N 2.88Å; W988-W991 PolarHBondContact O-N 3.32Å; W988-K992 PolarHBondContact O-N 3.02Å
989	C	81	Confident	75.5	Confident	64 Å²	64	110.9 Å²	110.9	43%	0.432	56%	0.564	S	S	.	*	H	α-helix	trans	-60.2	-47.7	172.6	-85.6	0	0	0	0	111.9	A985 L986 W991 K992 C993	A985-C989 WeakPolarHBondContact O-CB 3.27Å; A985-C989 PolarHBondContact O-N 2.9Å; L986-C989 PolarHBondContact O-N 3.38Å; C989-W991 VanDerWaalsContact C-N 3.33Å; C989-W991 PolarHBondContact O-N 3.47Å; C989-K992 PolarHBondContact O-N 3.46Å; C989-C993 WeakPolarHBondContact O-CB 3.35Å; C989-C993 PolarHBondContact O-N 3.32Å; C989-C993 PolarHBondContact O-SG 2.93Å
990	L	79.7	Confident	73.5	Confident	68 Å²	68	118.9 Å²	118.9	36%	0.356	59%	0.588	S	S	.	*	H	α-helix	trans	-64.3	-35.8	179.7	-72.3	169.1	0	0	0	112.4	L986 I987 C993 F995 F996	L986-L990 WeakPolarHBondContact O-CB 3.33Å; L986-L990 VanDerWaalsContact O-CG 3.28Å; L986-L990 WeakPolarHBondContact O-CG 3.4Å; L986-L990 PolarHBondContact O-N 3.39Å; I987-L990 PolarHBondContact O-N 3.43Å; L990-C993 PolarHBondContact O-N 3.43Å; L990-F995 WeakPolarHBondContact O-CB 3.47Å; L990-F995 PolarHBondContact O-N 3.41Å; L990-F996 HydrophobicContact CB-CE2 4.26Å
991	W	75.8	Confident	71.1	Confident	167 Å²	167	123.9 Å²	123.9	63%	0.633	61%	0.606	S	S	*	*	H	α-helix	trans	-65.9	-44.3	173.5	-178.6	69.7	0	0	0	112.1	I987 W988 C989 C993 G994 F996	I987-W991 WeakPolarHBondContact O-CB 3.28Å; I987-W991 PolarHBondContact O-N 2.82Å; W988-W991 PolarHBondContact O-N 3.32Å; C989-W991 VanDerWaalsContact C-N 3.33Å; C989-W991 PolarHBondContact O-N 3.47Å; W991-C993 VanDerWaalsContact C-N 3.33Å; W991-C993 PolarHBondContact O-N 3.24Å; W991-G994 PolarHBondContact O-N 3.43Å; W991-F996 HydrophobicContact CB-CD2 4.49Å
992	K	79.3	Confident	68.7	Low	148 Å²	148	128.8 Å²	128.8	64%	0.643	62%	0.621	S	S	*	*	H	α-helix	trans	-66.1	-31.7	175.4	-89.8	-70.7	-172.8	178.8	0	113.4	W988 C989 G994	W988-K992 PolarHBondContact O-N 3.02Å; C989-K992 PolarHBondContact O-N 3.46Å; K992-G994 PolarHBondContact O-N 3.32Å
993	C	76.6	Confident	66.3	Low	109 Å²	109	131 Å²	131	74%	0.736	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	4.9	175.2	-68.6	0	0	0	0	114.2	C989 L990 W991 F995	C989-C993 WeakPolarHBondContact O-CB 3.35Å; C989-C993 PolarHBondContact O-N 3.32Å; C989-C993 PolarHBondContact O-SG 2.93Å; L990-C993 PolarHBondContact O-N 3.43Å; W991-C993 VanDerWaalsContact C-N 3.33Å; W991-C993 PolarHBondContact O-N 3.24Å; C993-F995 VanDerWaalsContact C-N 3.31Å; C993-F995 PolarHBondContact O-N 3.23Å
994	G	62.2	Low	63.9	Low	43 Å²	43	134.8 Å²	134.8	44%	0.443	64%	0.644	S	S	.	*	T	Hydrogen-bonded Turn	trans	76.3	12	172.2	0	0	0	0	0	115.3	W991 K992 F996 K997	W991-G994 PolarHBondContact O-N 3.43Å; K992-G994 PolarHBondContact O-N 3.32Å; G994-F996 VanDerWaalsContact C-N 3.28Å; G994-F996 PolarHBondContact O-N 3.31Å; G994-K997 PolarHBondContact O-N 3.21Å
995	F	66.5	Low	61.6	Low	146 Å²	146	139.2 Å²	139.2	64%	0.64	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-30.7	-173.1	-174.2	-102	0	0	0	113.9	L990 C993 K997	L990-F995 WeakPolarHBondContact O-CB 3.47Å; L990-F995 PolarHBondContact O-N 3.41Å; C993-F995 VanDerWaalsContact C-N 3.31Å; C993-F995 PolarHBondContact O-N 3.23Å; F995-K997 PolarHBondContact O-N 3.37Å
996	F	64.8	Low	59.3	Low	134 Å²	134	143.2 Å²	143.2	59%	0.588	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	7.4	-176.4	-63	-75.3	0	0	0	115.3	L990 W991 G994	L990-F996 HydrophobicContact CB-CE2 4.26Å; W991-F996 HydrophobicContact CB-CD2 4.49Å; G994-F996 VanDerWaalsContact C-N 3.28Å; G994-F996 PolarHBondContact O-N 3.31Å
997	K	53.3	Low	56.9	Low	190 Å²	190	145 Å²	145	83%	0.826	68%	0.683	S	S	*	*			trans	-104.4	80.5	174	-75.4	-175.1	178.6	179.5	0	111.1	G994 F995	G994-K997 PolarHBondContact O-N 3.21Å; F995-K997 PolarHBondContact O-N 3.37Å
998	R	52.8	Low	54.7	Low	220 Å²	220	151.8 Å²	151.8	83%	0.83	70%	0.703	S	S	*	*			trans	-148.5	120.6	164.8	-125.3	172.2	165.8	169	-5.1	112	F1000	R998-F1000 PolarHBondContact O-N 3.41Å
999	N	42.6	Very low	52.5	Low	172 Å²	172	151.6 Å²	151.6	92%	0.92	71%	0.714	S	S	*	*			trans	-67.9	116.6	175.2	-75.8	-22.5	0	0	0	110.3
1000	F	45	Very low	50.5	Low	205 Å²	205	153.6 Å²	153.6	90%	0.899	73%	0.728	S	S	*	*			trans	-92.4	122.7	170.3	-91.1	-88.1	0	0	0	110.5	R998	R998-F1000 PolarHBondContact O-N 3.41Å
1001	K	35.9	Very low	48.3	Very low	200 Å²	200	161.6 Å²	161.6	87%	0.87	75%	0.754	S	S	*	*			trans	-114.8	112.7	173.8	-152	-179.3	-171.1	-177.9	0	108
1002	K	35.2	Very low	46.5	Very low	174 Å²	174	160.3 Å²	160.3	76%	0.757	76%	0.759	S	S	*	*			trans	63.4	132.3	150	-103.4	176.7	166.9	-165.1	0	123.2
1003	Q	36.9	Very low	44.3	Very low	142 Å²	142	163 Å²	163	66%	0.664	77%	0.767	S	S	*	*			trans	75.8	106.2	144	-89	158.8	-61.2	0	0	117.5
1004	E	38.1	Very low	42.5	Very low	172 Å²	172	163.7 Å²	163.7	80%	0.804	77%	0.768	S	S	*	*				58.6	102.1	78.2	-81.3	179.7	152	0	0	112.4
1005	E	36.1	Very low	41.9	Very low	177 Å²	177	167 Å²	167	83%	0.827	78%	0.781	S	S	*	*				176.8	155.9	105.6	-98.8	-172.3	172	0	0	112.2
1006	L	34.2	Very low	40.7	Very low	138 Å²	138	169 Å²	169	72%	0.723	79%	0.79	S	S	*	*			trans	83.1	106.3	154	-75.6	144.4	0	0	0	120.2
1007	N	33.9	Very low	39.4	Very low	133 Å²	133	169.8 Å²	169.8	71%	0.711	80%	0.799	S	S	*	*				149	147.6	121.6	-84.9	-30.9	0	0	0	111.2
1008	R	37.4	Very low	38.6	Very low	227 Å²	227	167.2 Å²	167.2	86%	0.857	79%	0.794	S	S	*	*			cis	-178.2	134.9	-14.7	-144.5	173.9	173.1	172.7	-4.1	103.7
1009	D	35.5	Very low	37.8	Very low	155 Å²	155	165.2 Å²	165.2	83%	0.829	79%	0.792	S	S	*	*			trans	-80.4	145.5	-176.5	-85	-43.1	0	0	0	115
1010	S	38.5	Very low	37.6	Very low	105 Å²	105	167.2 Å²	167.2	73%	0.734	79%	0.786	S	S	*	*			trans	35.5	127.4	134.6	-164.6	0	0	0	0	121.6
1011	W	34.7	Very low	37.3	Very low	236 Å²	236	164.7 Å²	164.7	89%	0.894	78%	0.777	S	S	*	*			trans	-145.4	137.7	152.9	-88.7	82.4	0	0	0	113.9
1012	D	36.5	Very low	37.6	Very low	140 Å²	140	159.7 Å²	159.7	75%	0.749	77%	0.768	S	S	*	*			trans	-58	160.8	170.6	-81.5	-46.8	0	0	0	116.3
1013	Y	33.2	Very low	37.8	Very low	205 Å²	205	156.8 Å²	156.8	80%	0.804	77%	0.769	S	S	*	*				176.2	142.7	110.1	-124.7	-103	0	0	0	114.1
1014	V	39.9	Very low	37.9	Very low	124 Å²	124	161.5 Å²	161.5	75%	0.752	80%	0.796	S	S	*	*			trans	-122.7	146.7	165.9	-175.3	0	0	0	0	104.3
1015	P	49	Very low	37.9	Very low	112 Å²	112	161 Å²	161	73%	0.727	80%	0.796	S	S	*	*				-162.9	179.6	60.7	40.7	-14.7	0	0	0	120.8
1016	K	40.5	Very low	38	Very low	189 Å²	189	160.1 Å²	160.1	82%	0.822	79%	0.794	S	S	*	*			trans	-28.6	148.7	168.6	-60.7	171.1	175.6	175.4	0	119.7
1017	L	37.9	Very low	38.2	Very low	150 Å²	150	161.3 Å²	161.3	79%	0.785	80%	0.798	S	S	*	*				171.5	129.3	111.9	-96.6	151.1	0	0	0	115.5
1018	N	36.9	Very low	38.4	Very low	136 Å²	136	163 Å²	163	73%	0.727	80%	0.804	S	S	*	*			trans	61.6	138	134.1	-82.4	-3.7	0	0	0	126.9
1019	K	36.8	Very low	38.5	Very low	178 Å²	178	159 Å²	159	77%	0.774	80%	0.8	S	S	*	*			trans	93.8	126	135.7	-90.2	179.1	177	179.7	0	120.8
1020	R	38.5	Very low	38.7	Very low	213 Å²	213	159.3 Å²	159.3	80%	0.804	80%	0.798	S	S	*	*			trans	30.3	141.8	132.4	-73	-176.5	178.7	-174.5	-0.6	117.6
1021	E	38	Very low	38.7	Very low	152 Å²	152	163.1 Å²	163.1	71%	0.71	80%	0.803	S	S	*	*			cis	-175.7	150	39.6	-133.4	158.8	-145.3	0	0	109.1
1022	S	41.6	Very low	39	Very low	96 Å²	96	157.5 Å²	157.5	67%	0.671	80%	0.796	S	S	*	*			trans	34.7	143.8	147	58.8	0	0	0	0	126.3
1023	S	40.4	Very low	39.2	Very low	113 Å²	113	159 Å²	159	79%	0.79	80%	0.8	S	S	*	*			trans	73.3	130.5	153.5	62.8	0	0	0	0	117.1
1024	I	38	Very low	39.8	Very low	240 Å²	240	154.8 Å²	154.8	100%	1.231	80%	0.799	S	S	*	*			cis	-128.5	0	39	-72.4	163	0	0	0	111.9

Retrieved 1,024 of 1,024 residues in 1336.6 ms (Link to these results)

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