A0A077ZBI7_TRITR Loading...

RING-type E3 ubiquitin transferase

AlphaFold DB , UniProt , Accession A0A077ZBI7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 461 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.2	Very low	34.3	Very low	249 Å²	249	144.2 Å²	144.2	100%	1.227	82%	0.824	S	S	*	*				0	143.8	0	-70.6	177.3	176.8	0	0	107.8
2	G	32.3	Very low	34.9	Very low	67 Å²	67	140.5 Å²	140.5	69%	0.691	82%	0.824	S	S	*	*			trans	85	97.9	-174.3	0	0	0	0	0	112.3
3	I	32.3	Very low	34.9	Very low	147 Å²	147	141.9 Å²	141.9	75%	0.754	83%	0.826	S	S	*	*			cis	75.4	97.1	48	-51.8	167.6	0	0	0	109.8	F5	I3-F5 HydrophobicContact CG2-CE2 4.03Å
4	A	31.2	Very low	34.9	Very low	79 Å²	79	145.1 Å²	145.1	65%	0.653	83%	0.829	S	S	*	*				63.1	143.2	97.1	0	0	0	0	0	113.3
5	F	37.2	Very low	35	Very low	199 Å²	199	145.7 Å²	145.7	87%	0.873	83%	0.829	S	S	*	*			cis	-151.8	174.1	34	-65.4	-103.1	0	0	0	109.1	I3	I3-F5 HydrophobicContact CG2-CE2 4.03Å
6	G	34.4	Very low	34.6	Very low	68 Å²	68	144.5 Å²	144.5	70%	0.701	83%	0.826	S	S	*	*			cis	170.8	149.6	-7.6	0	0	0	0	0	114.1
7	R	33.7	Very low	34.6	Very low	236 Å²	236	142.4 Å²	142.4	89%	0.891	82%	0.818	S	S	*	*			trans	54.2	108.9	148.3	-61	-172.9	173.7	174.5	-1.8	123.6
8	H	31.6	Very low	34.2	Very low	189 Å²	189	142.6 Å²	142.6	88%	0.875	82%	0.817	S	S	*	*				50.3	113.1	122.7	-66.9	-73.5	0	0	0	123.3
9	A	36.1	Very low	34.3	Very low	91 Å²	91	144.8 Å²	144.8	75%	0.752	82%	0.816	S	S	*	*				-171.1	151.2	119.9	0	0	0	0	0	108.5
10	T	38.5	Very low	34.5	Very low	132 Å²	132	142.3 Å²	142.3	81%	0.81	81%	0.808	S	S	*	*			cis	-156.9	158.1	-21.1	17	0	0	0	0	107.1
11	P	34.3	Very low	34.6	Very low	129 Å²	129	141.1 Å²	141.1	84%	0.838	80%	0.8	S	S	*	*			trans	-86	152.3	-170	35.1	-35.2	0	0	0	114
12	A	42	Very low	34.9	Very low	100 Å²	100	132.8 Å²	132.8	83%	0.826	77%	0.766	S	S	*	*			trans	-141.1	135.9	157.9	0	0	0	0	0	107.6
13	D	34.4	Very low	35.8	Very low	159 Å²	159	133.4 Å²	133.4	85%	0.85	75%	0.748	S	S	*	*			trans	-69.2	150.7	-175.8	-62.5	-80.5	0	0	0	113.2
14	E	34.8	Very low	36.7	Very low	186 Å²	186	132 Å²	132	87%	0.869	74%	0.737	S	S	*	*				153.7	151.5	125.1	-77.8	-166.8	138.4	0	0	111.6
15	D	37	Very low	38	Very low	154 Å²	154	130.9 Å²	130.9	82%	0.824	72%	0.716	S	S	*	*			trans	62.4	99.4	178.6	-64.5	-21.6	0	0	0	119.6	P17	D15-P17 VanDerWaalsContact O-CD 3.27Å; D15-P17 WeakPolarHBondContact O-CD 3.4Å
16	T	28.6	Very low	38.8	Very low	127 Å²	127	127.7 Å²	127.7	78%	0.779	71%	0.707	S	S	*	*			trans	-97	110.4	165.4	-55.9	0	0	0	0	111.3	N18	T16-N18 HydrophobicContact CG2-CB 3.96Å
17	P	34.9	Very low	39.9	Very low	108 Å²	108	125.7 Å²	125.7	70%	0.701	68%	0.68	S	S	*	*			trans	-105	91.1	154.9	33.4	-27.6	0	0	0	109.5	D15 F19	D15-P17 VanDerWaalsContact O-CD 3.27Å; D15-P17 WeakPolarHBondContact O-CD 3.4Å; P17-F19 PolarHBondContact O-N 3.2Å
18	N	27.9	Very low	41	Very low	147 Å²	147	122 Å²	122	79%	0.786	67%	0.671	S	S	*	*			trans	-78.5	64	179.9	-145.1	4.9	0	0	0	111.3	T16	T16-N18 HydrophobicContact CG2-CB 3.96Å
19	F	35.7	Very low	42.1	Very low	184 Å²	184	116.7 Å²	116.7	81%	0.807	66%	0.655	S	S	*	*			trans	-110.2	89.1	168.8	-89.3	-80.7	0	0	0	109.1	P17 N21	P17-F19 PolarHBondContact O-N 3.2Å; F19-N21 PolarHBondContact O-N 2.88Å
20	S	37.3	Very low	43.2	Very low	94 Å²	94	115.4 Å²	115.4	66%	0.657	65%	0.65	S	S	*	*			trans	-70.1	95.7	-174.2	53.2	0	0	0	0	112.9	S22	S20-S22 PolarHBondContact O-N 3.12Å; S20-S22 VanDerWaalsContact O-N 3.11Å; S20-S22 PolarHBondContact O-OG 3.49Å
21	N	36.5	Very low	44.5	Very low	118 Å²	118	112.2 Å²	112.2	63%	0.631	63%	0.633	S	S	*	*	S	Bend	trans	77.1	-9.2	134.7	-116.8	-21.8	0	0	0	121.1	F19 K24	F19-N21 PolarHBondContact O-N 2.88Å; N21-K24 WeakPolarHBondContact O-CD 3.39Å; N21-K24 WeakPolarHBondContact O-CE 3.22Å; N21-K24 WeakPolarHBondContact O-CG 3.04Å; N21-K24 PolarHBondContact O-NZ 3.05Å; N21-K24 PolarHBondContact OD1-NZ 3.08Å
22	S	41.7	Very low	46.3	Very low	75 Å²	75	108.6 Å²	108.6	52%	0.524	60%	0.603	S	S	.	*			trans	-107.5	-13.6	-144.4	-57.7	0	0	0	0	121.1	S20 K24	S20-S22 PolarHBondContact O-N 3.12Å; S20-S22 VanDerWaalsContact O-N 3.11Å; S20-S22 PolarHBondContact O-OG 3.49Å; S22-K24 PolarHBondContact O-N 3.43Å
23	Y	51.3	Low	47.9	Very low	80 Å²	80	105.4 Å²	105.4	31%	0.314	57%	0.571	S	S	.	*			trans	-73.7	45.9	178.7	-57.8	-72.8	0	0	0	114.5	Y25 F33 G34 P49	Y23-Y25 PolarHBondContact O-N 2.93Å; Y23-F33 HydrophobicContact CD1-CB 4.24Å; Y23-G34 WeakPolarHBondContact CE1-O 3.37Å; Y23-P49 HydrophobicContact CD1-CG 3.92Å; Y23-P49 HydrophobicContact CE1-CG 4.08Å
24	K	52.8	Low	49.7	Very low	117 Å²	117	99.8 Å²	99.8	51%	0.509	55%	0.551	S	S	.	*			trans	-100.7	67.5	-159.6	-75.2	-172.6	175.7	171.1	0	114.9	N21 S22 L26	N21-K24 WeakPolarHBondContact O-CD 3.39Å; N21-K24 WeakPolarHBondContact O-CE 3.22Å; N21-K24 WeakPolarHBondContact O-CG 3.04Å; N21-K24 PolarHBondContact O-NZ 3.05Å; N21-K24 PolarHBondContact OD1-NZ 3.08Å; S22-K24 PolarHBondContact O-N 3.43Å; K24-L26 HydrophobicContact CB-CD2 4.28Å; K24-L26 HydrophobicContact CB-CG 4.16Å; K24-L26 HydrophobicContact CD-CD2 3.92Å; K24-L26 HydrophobicContact CD-CG 4.39Å; K24-L26 HydrophobicContact CG-CD2 3.84Å; K24-L26 HydrophobicContact CG-CG 4.26Å
25	Y	57.9	Low	51.4	Low	55 Å²	55	95.1 Å²	95.1	22%	0.216	53%	0.532	C	S	.	.			trans	-82.8	102.1	133.7	-170.7	-113.6	0	0	0	108.4	Y23 L27 Y32 N57 L60 N61	Y23-Y25 PolarHBondContact O-N 2.93Å; Y25-L27 PolarHBondContact O-N 2.94Å; Y25-Y32 HydrophobicContact CD1-CD2 4.07Å; Y25-Y32 HydrophobicContact CD1-CE2 4.1Å; Y25-Y32 HydrophobicContact CE1-CE2 4.34Å; Y25-N57 HydrophobicContact CD2-CB 3.49Å; Y25-N57 VanDerWaalsContact CD2-CB 3.49Å; Y25-N57 WeakPolarHBondContact CE1-O 3.46Å; Y25-N57 HydrophobicContact CE2-CB 3.93Å; Y25-N57 HydrophobicContact CG-CB 3.85Å; Y25-L60 HydrophobicContact CD1-CD1 4.38Å; Y25-N61 WeakPolarHBondContact CE1-OD1 3.47Å; Y25-N61 PolarHBondContact OH-ND2 3.28Å; Y25-N61 PolarHBondContact OH-OD1 3.49Å; Y25-N61 VanDerWaalsContact OH-OD1 3.14Å
26	L	54.4	Low	53.3	Low	133 Å²	133	90.8 Å²	90.8	70%	0.696	51%	0.506	S	S	*	.			trans	-76	91.3	-173.1	-71.1	170.2	0	0	0	111.5	K24	K24-L26 HydrophobicContact CB-CD2 4.28Å; K24-L26 HydrophobicContact CB-CG 4.16Å; K24-L26 HydrophobicContact CD-CD2 3.92Å; K24-L26 HydrophobicContact CD-CG 4.39Å; K24-L26 HydrophobicContact CG-CD2 3.84Å; K24-L26 HydrophobicContact CG-CG 4.26Å
27	L	56.7	Low	55.5	Low	25 Å²	25	86.3 Å²	86.3	13%	0.131	48%	0.476	C	S	.	.			trans	-60.4	155.6	153.9	-82.9	172.6	0	0	0	110.3	Y25 S29 Y32	Y25-L27 PolarHBondContact O-N 2.94Å; L27-S29 WeakPolarHBondContact CB-O 3.17Å; L27-S29 WeakPolarHBondContact CD1-O 3.16Å; L27-S29 PolarHBondContact O-N 2.85Å; L27-S29 VanDerWaalsContact O-N 3.14Å; L27-Y32 HydrophobicContact CD1-CD2 3.72Å; L27-Y32 HydrophobicContact CD1-CE1 4.37Å; L27-Y32 HydrophobicContact CD1-CE2 3.33Å; L27-Y32 HydrophobicContact CD1-CG 4.38Å; L27-Y32 HydrophobicContact CD2-CE2 3.7Å; L27-Y32 HydrophobicContact CG-CD2 3.98Å; L27-Y32 HydrophobicContact CG-CE2 3.42Å; L27-Y32 VanDerWaalsContact CG-CE2 3.42Å
28	K	56.7	Low	57.5	Low	160 Å²	160	86.9 Å²	86.9	70%	0.696	47%	0.471	S	S	*	.	S	Bend	trans	-60.3	-15.8	163.5	-68.4	172.7	-176.2	163.6	0	112.7	D192	K28-D192 WeakPolarHBondContact CE-OD1 3.32Å; K28-D192 IonicContact NZ-OD1 2.64Å; K28-D192 PolarHBondContact NZ-OD1 3.25Å
29	S	54.2	Low	59.7	Low	77 Å²	77	81.1 Å²	81.1	54%	0.538	44%	0.44	S	S	.	.	S	Bend	trans	-160.5	120.3	173.9	57.8	0	0	0	0	112.2	L27	L27-S29 WeakPolarHBondContact CB-O 3.17Å; L27-S29 WeakPolarHBondContact CD1-O 3.16Å; L27-S29 PolarHBondContact O-N 2.85Å; L27-S29 VanDerWaalsContact O-N 3.14Å
30	G	60.5	Low	61.6	Low	63 Å²	63	73 Å²	73	65%	0.649	41%	0.408	S	S	*	.			trans	102	167.6	167.9	0	0	0	0	0	116.3
31	S	64.7	Low	63.2	Low	65 Å²	65	70 Å²	70	46%	0.455	38%	0.384	S	S	.	.			trans	-103.9	133.3	167.5	-178.3	0	0	0	0	108.9	F33	S31-F33 VanDerWaalsContact C-N 3.28Å; S31-F33 PolarHBondContact OG-N 3.13Å; S31-F33 VanDerWaalsContact OG-N 3.11Å; S31-F33 PolarHBondContact OG-O 2.83Å
32	Y	71.8	Confident	64.8	Low	54 Å²	54	68.5 Å²	68.5	21%	0.212	37%	0.374	C	S	.	.	S	Bend	trans	-73.3	-23.9	167.3	-82.6	-71	0	0	0	112.6	Y25 L27 L60	Y25-Y32 HydrophobicContact CD1-CD2 4.07Å; Y25-Y32 HydrophobicContact CD1-CE2 4.1Å; Y25-Y32 HydrophobicContact CE1-CE2 4.34Å; L27-Y32 HydrophobicContact CD1-CD2 3.72Å; L27-Y32 HydrophobicContact CD1-CE1 4.37Å; L27-Y32 HydrophobicContact CD1-CE2 3.33Å; L27-Y32 HydrophobicContact CD1-CG 4.38Å; L27-Y32 HydrophobicContact CD2-CE2 3.7Å; L27-Y32 HydrophobicContact CG-CD2 3.98Å; L27-Y32 HydrophobicContact CG-CE2 3.42Å; L27-Y32 VanDerWaalsContact CG-CE2 3.42Å; Y32-L60 HydrophobicContact CD1-CB 4.16Å; Y32-L60 HydrophobicContact CD1-CD2 4.5Å; Y32-L60 HydrophobicContact CD2-CB 3.72Å; Y32-L60 HydrophobicContact CD2-CD1 3.72Å; Y32-L60 HydrophobicContact CD2-CG 4.3Å; Y32-L60 HydrophobicContact CE1-CB 3.98Å; Y32-L60 HydrophobicContact CE2-CB 3.49Å; Y32-L60 VanDerWaalsContact CE2-CB 3.49Å; Y32-L60 HydrophobicContact CE2-CD1 4.35Å; Y32-L60 HydrophobicContact CG-CB 4.05Å; Y32-L60 HydrophobicContact CG-CD1 3.85Å; Y32-L60 HydrophobicContact CG-CG 4.37Å; Y32-L60 VanDerWaalsContact CZ-O 3.29Å; Y32-L60 PolarHBondContact OH-O 2.87Å
33	F	75.5	Confident	66.6	Low	33 Å²	33	71.4 Å²	71.4	15%	0.145	37%	0.373	C	S	.	.			trans	-106.3	136.9	-171	-56.1	-77	0	0	0	111.4	Y23 S31 P49 E50 L60	Y23-F33 HydrophobicContact CD1-CB 4.24Å; S31-F33 VanDerWaalsContact C-N 3.28Å; S31-F33 PolarHBondContact OG-N 3.13Å; S31-F33 VanDerWaalsContact OG-N 3.11Å; S31-F33 PolarHBondContact OG-O 2.83Å; F33-P49 HydrophobicContact CB-CB 4.25Å; F33-P49 HydrophobicContact CB-CG 3.49Å; F33-P49 VanDerWaalsContact CB-CG 3.49Å; F33-P49 HydrophobicContact CD1-CB 3.85Å; F33-P49 HydrophobicContact CD1-CG 3.85Å; F33-P49 HydrophobicContact CD2-CG 4.43Å; F33-P49 HydrophobicContact CG-CB 4.21Å; F33-P49 HydrophobicContact CG-CG 3.68Å; F33-E50 HydrophobicContact CE1-CB 4.24Å; F33-E50 HydrophobicContact CE2-CB 3.71Å; F33-E50 HydrophobicContact CZ-CB 3.52Å; F33-L60 HydrophobicContact CE2-CD1 3.99Å; F33-L60 HydrophobicContact CZ-CD1 3.68Å
34	G	73.5	Confident	67.7	Low	41 Å²	41	68.5 Å²	68.5	42%	0.423	36%	0.362	S	S	.	.			trans	-80.8	-172.2	164.7	0	0	0	0	0	111.9	Y23 H36	Y23-G34 WeakPolarHBondContact CE1-O 3.37Å; G34-H36 PolarHBondContact O-N 2.89Å
35	N	70.8	Confident	68.9	Low	88 Å²	88	69 Å²	69	47%	0.471	37%	0.366	S	S	.	.	S	Bend	trans	-73.7	-6.9	172	66.9	-37.5	0	0	0	113.9
36	H	75.5	Confident	69.7	Low	62 Å²	62	68.4 Å²	68.4	29%	0.287	37%	0.368	S	S	.	.			trans	-146.5	160.9	177.5	65.2	-75.1	0	0	0	110	G34 R43 F44 E45	G34-H36 PolarHBondContact O-N 2.89Å; H36-R43 HydrophobicContact CB-CG 4.19Å; H36-R43 PolarHBondContact CD2-NH1 3Å; H36-R43 PolarHBondContact NE2-NH1 3.1Å; H36-R43 VanDerWaalsContact NE2-NH1 3.19Å; H36-F44 CarbonylContact C-O 3.56Å; H36-F44 WeakPolarHBondContact CA-O 3.42Å; H36-F44 WeakPolarHBondContact CB-O 3.37Å; H36-E45 HydrophobicContact CB-CG 4.06Å
37	F	76.1	Confident	70.5	Confident	34 Å²	34	65.8 Å²	65.8	15%	0.149	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	164.7	165.4	71.3	-87.3	0	0	0	109.9	L39 F44 T46 P49 F52	F37-L39 HydrophobicContact CD2-CB 4.06Å; F37-L39 HydrophobicContact CE2-CB 3.72Å; F37-L39 HydrophobicContact CE2-CD2 4.31Å; F37-F44 HydrophobicContact CD1-CB 3.81Å; F37-F44 HydrophobicContact CD2-CB 4.31Å; F37-F44 HydrophobicContact CD2-CD2 4.09Å; F37-F44 HydrophobicContact CE1-CB 3.32Å; F37-F44 HydrophobicContact CE1-CD2 4.49Å; F37-F44 HydrophobicContact CE1-CG 4.02Å; F37-F44 HydrophobicContact CE2-CB 3.87Å; F37-F44 AromaticContact CE2-CD2 3.46Å; F37-F44 HydrophobicContact CE2-CD2 3.46Å; F37-F44 VanDerWaalsContact CE2-CD2 3.46Å; F37-F44 HydrophobicContact CE2-CE2 4.25Å; F37-F44 AromaticContact CE2-CG 3.77Å; F37-F44 HydrophobicContact CE2-CG 3.77Å; F37-F44 HydrophobicContact CG-CB 4.28Å; F37-F44 HydrophobicContact CZ-CB 3.33Å; F37-F44 HydrophobicContact CZ-CD1 4.22Å; F37-F44 AromaticContact CZ-CD2 3.69Å; F37-F44 HydrophobicContact CZ-CD2 3.69Å; F37-F44 AromaticContact CZ-CG 3.46Å; F37-F44 HydrophobicContact CZ-CG 3.46Å; F37-F44 VanDerWaalsContact CZ-CG 3.46Å; F37-F44 PolarHBondContact N-O 3.4Å; F37-F44 PolarHBondContact O-N 3.49Å; F37-T46 HydrophobicContact CD1-CG2 4.01Å; F37-T46 HydrophobicContact CE1-CG2 3.6Å; F37-P49 HydrophobicContact CD1-CB 3.87Å; F37-F52 HydrophobicContact CD2-CB 4.49Å; F37-F52 HydrophobicContact CE1-CB 4.02Å; F37-F52 AromaticContact CE1-CD2 3.55Å; F37-F52 HydrophobicContact CE1-CD2 3.55Å; F37-F52 HydrophobicContact CE1-CE2 4.08Å; F37-F52 AromaticContact CE1-CG 3.82Å; F37-F52 HydrophobicContact CE1-CG 3.82Å; F37-F52 HydrophobicContact CE2-CB 3.69Å; F37-F52 HydrophobicContact CE2-CD1 4.3Å; F37-F52 AromaticContact CE2-CG 3.97Å; F37-F52 HydrophobicContact CE2-CG 3.97Å; F37-F52 HydrophobicContact CZ-CB 3.43Å; F37-F52 VanDerWaalsContact CZ-CB 3.43Å; F37-F52 AromaticContact CZ-CD1 3.66Å; F37-F52 HydrophobicContact CZ-CD1 3.66Å; F37-F52 AromaticContact CZ-CD2 3.46Å; F37-F52 HydrophobicContact CZ-CD2 3.46Å; F37-F52 VanDerWaalsContact CZ-CD2 3.46Å; F37-F52 HydrophobicContact CZ-CE1 4.2Å; F37-F52 HydrophobicContact CZ-CE2 4.04Å; F37-F52 AromaticContact CZ-CG 3.23Å; F37-F52 HydrophobicContact CZ-CG 3.23Å; F37-F52 HydrophobicContact CZ-CZ 4.37Å
38	M	76.4	Confident	71.3	Confident	119 Å²	119	69.4 Å²	69.4	59%	0.586	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.7	137.7	173.4	-59.1	179.8	-71.2	0	0	108.5	E42 Y74	M38-E42 WeakPolarHBondContact CA-O 3.26Å; M38-Y74 HydrophobicContact SD-CD2 4.4Å
39	L	74.9	Confident	72	Confident	27 Å²	27	62 Å²	62	14%	0.141	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	121.6	174.6	179.3	72.5	0	0	0	108.4	F37 D41 E42 F44 L297 L330 V433	F37-L39 HydrophobicContact CD2-CB 4.06Å; F37-L39 HydrophobicContact CE2-CB 3.72Å; F37-L39 HydrophobicContact CE2-CD2 4.31Å; L39-D41 PolarHBondContact O-N 3.39Å; L39-E42 PolarHBondContact N-O 3.17Å; L39-E42 VanDerWaalsContact N-O 3.07Å; L39-E42 PolarHBondContact O-N 3.18Å; L39-F44 HydrophobicContact CB-CD2 4.17Å; L39-F44 HydrophobicContact CB-CE2 3.84Å; L39-L297 HydrophobicContact CD2-CD1 3.64Å; L39-L330 HydrophobicContact CD1-CD2 4.47Å; L39-V433 HydrophobicContact CB-CG2 4.08Å; L39-V433 HydrophobicContact CD2-CG1 4.13Å; L39-V433 HydrophobicContact CD2-CG2 3.71Å; L39-V433 HydrophobicContact CG-CG2 3.57Å; L39-V433 WeakPolarHBondContact O-CG2 3.43Å
40	G	75.5	Confident	73	Confident	14 Å²	14	60.3 Å²	60.3	14%	0.144	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	-133.2	-165.2	0	0	0	0	0	110.6	Y81	G40-Y81 VanDerWaalsContact C-OH 3.25Å; G40-Y81 PolarHBondContact O-OH 2.94Å
41	D	70.1	Confident	73.5	Confident	29 Å²	29	58 Å²	58	16%	0.155	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	6.5	-178	58.7	-28.9	0	0	0	114.9	L39 Y74 S77 Y81	L39-D41 PolarHBondContact O-N 3.39Å; D41-Y74 PolarHBondContact O-OH 2.81Å; D41-S77 VanDerWaalsContact OD2-CB 3.26Å; D41-S77 WeakPolarHBondContact OD2-CB 3.44Å; D41-Y81 WeakPolarHBondContact CA-OH 3.42Å; D41-Y81 PolarHBondContact N-OH 3.22Å
42	E	70.6	Confident	73.8	Confident	87 Å²	87	56.2 Å²	56.2	41%	0.407	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	143.4	-176.4	-70.9	-174.3	157	0	0	113.1	M38 L39 F44	M38-E42 WeakPolarHBondContact CA-O 3.26Å; L39-E42 PolarHBondContact N-O 3.17Å; L39-E42 VanDerWaalsContact N-O 3.07Å; L39-E42 PolarHBondContact O-N 3.18Å; E42-F44 HydrophobicContact CB-CD2 4.3Å; E42-F44 HydrophobicContact CB-CE1 4.41Å; E42-F44 HydrophobicContact CB-CE2 3.43Å; E42-F44 VanDerWaalsContact CB-CE2 3.43Å; E42-F44 HydrophobicContact CB-CZ 3.5Å; E42-F44 HydrophobicContact CG-CZ 4.42Å; E42-F44 WeakPolarHBondContact O-CE2 3.35Å; E42-F44 WeakPolarHBondContact OE2-CZ 3.43Å
43	R	79	Confident	73.9	Confident	137 Å²	137	55.5 Å²	55.5	52%	0.517	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	122.5	169.3	171.3	-178.1	170.4	132.7	-8.2	109	H36 E45	H36-R43 HydrophobicContact CB-CG 4.19Å; H36-R43 PolarHBondContact CD2-NH1 3Å; H36-R43 PolarHBondContact NE2-NH1 3.1Å; H36-R43 VanDerWaalsContact NE2-NH1 3.19Å; R43-E45 IonicContact CZ-OE1 3.4Å; R43-E45 VanDerWaalsContact CZ-OE1 3.25Å; R43-E45 IonicContact NE-OE1 2.66Å; R43-E45 PolarHBondContact NE-OE1 2.99Å; R43-E45 IonicContact NH2-OE1 2.64Å; R43-E45 PolarHBondContact NH2-OE1 3.29Å
44	F	74	Confident	74	Confident	18 Å²	18	56.6 Å²	56.6	8%	0.079	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	122.8	-178.6	-63.4	-89.3	0	0	0	110.5	H36 F37 L39 E42 V433 E435	H36-F44 CarbonylContact C-O 3.56Å; H36-F44 WeakPolarHBondContact CA-O 3.42Å; H36-F44 WeakPolarHBondContact CB-O 3.37Å; F37-F44 HydrophobicContact CD1-CB 3.81Å; F37-F44 HydrophobicContact CD2-CB 4.31Å; F37-F44 HydrophobicContact CD2-CD2 4.09Å; F37-F44 HydrophobicContact CE1-CB 3.32Å; F37-F44 HydrophobicContact CE1-CD2 4.49Å; F37-F44 HydrophobicContact CE1-CG 4.02Å; F37-F44 HydrophobicContact CE2-CB 3.87Å; F37-F44 AromaticContact CE2-CD2 3.46Å; F37-F44 HydrophobicContact CE2-CD2 3.46Å; F37-F44 VanDerWaalsContact CE2-CD2 3.46Å; F37-F44 HydrophobicContact CE2-CE2 4.25Å; F37-F44 AromaticContact CE2-CG 3.77Å; F37-F44 HydrophobicContact CE2-CG 3.77Å; F37-F44 HydrophobicContact CG-CB 4.28Å; F37-F44 HydrophobicContact CZ-CB 3.33Å; F37-F44 HydrophobicContact CZ-CD1 4.22Å; F37-F44 AromaticContact CZ-CD2 3.69Å; F37-F44 HydrophobicContact CZ-CD2 3.69Å; F37-F44 AromaticContact CZ-CG 3.46Å; F37-F44 HydrophobicContact CZ-CG 3.46Å; F37-F44 VanDerWaalsContact CZ-CG 3.46Å; F37-F44 PolarHBondContact N-O 3.4Å; F37-F44 PolarHBondContact O-N 3.49Å; L39-F44 HydrophobicContact CB-CD2 4.17Å; L39-F44 HydrophobicContact CB-CE2 3.84Å; E42-F44 HydrophobicContact CB-CD2 4.3Å; E42-F44 HydrophobicContact CB-CE1 4.41Å; E42-F44 HydrophobicContact CB-CE2 3.43Å; E42-F44 VanDerWaalsContact CB-CE2 3.43Å; E42-F44 HydrophobicContact CB-CZ 3.5Å; E42-F44 HydrophobicContact CG-CZ 4.42Å; E42-F44 WeakPolarHBondContact O-CE2 3.35Å; E42-F44 WeakPolarHBondContact OE2-CZ 3.43Å; F44-V433 HydrophobicContact CE1-CG1 4.35Å; F44-V433 HydrophobicContact CE2-CB 4.46Å; F44-V433 HydrophobicContact CE2-CG1 4.41Å; F44-V433 HydrophobicContact CE2-CG2 4.3Å; F44-V433 HydrophobicContact CZ-CB 3.88Å; F44-V433 HydrophobicContact CZ-CG1 3.65Å; F44-V433 HydrophobicContact CZ-CG2 4.21Å; F44-E435 WeakPolarHBondContact CD1-OE1 3.48Å; F44-E435 HydrophobicContact CE1-CG 3.9Å
45	E	79.1	Confident	74.3	Confident	128 Å²	128	55.5 Å²	55.5	60%	0.598	28%	0.28	S	S	*	.			trans	-102.7	107.8	171.4	-51.4	-152	152.4	0	0	108.6	H36 R43	H36-E45 HydrophobicContact CB-CG 4.06Å; R43-E45 IonicContact CZ-OE1 3.4Å; R43-E45 VanDerWaalsContact CZ-OE1 3.25Å; R43-E45 IonicContact NE-OE1 2.66Å; R43-E45 PolarHBondContact NE-OE1 2.99Å; R43-E45 IonicContact NH2-OE1 2.64Å; R43-E45 PolarHBondContact NH2-OE1 3.29Å
46	T	73.2	Confident	74.9	Confident	42 Å²	42	56.4 Å²	56.4	26%	0.258	28%	0.282	S	S	.	.			trans	-142	152.8	-175.9	-176.4	0	0	0	0	111	F37 Q48 P49 F52	F37-T46 HydrophobicContact CD1-CG2 4.01Å; F37-T46 HydrophobicContact CE1-CG2 3.6Å; T46-Q48 VanDerWaalsContact C-N 3.26Å; T46-Q48 PolarHBondContact O-N 2.98Å; T46-Q48 PolarHBondContact OG1-N 2.86Å; T46-P49 HydrophobicContact CG2-CB 4.19Å; T46-F52 HydrophobicContact CG2-CE2 4.33Å
47	S	71.5	Confident	75.2	Confident	78 Å²	78	55.9 Å²	55.9	55%	0.545	28%	0.281	S	S	.	.	S	Bend	trans	-79	-5.7	173	56.6	0	0	0	0	113.9
48	Q	73	Confident	75.5	Confident	101 Å²	101	59.2 Å²	59.2	47%	0.472	30%	0.296	S	S	.	.			trans	-134.4	59	-179.2	-62.1	-180	12	0	0	112.3	T46 E50 C51	T46-Q48 VanDerWaalsContact C-N 3.26Å; T46-Q48 PolarHBondContact O-N 2.98Å; T46-Q48 PolarHBondContact OG1-N 2.86Å; Q48-E50 VanDerWaalsContact C-OE2 3.26Å; Q48-E50 WeakPolarHBondContact CA-OE2 3.43Å; Q48-E50 PolarHBondContact O-N 3.3Å; Q48-C51 HydrophobicContact CB-CB 4.34Å; Q48-C51 VanDerWaalsContact O-CB 3.27Å; Q48-C51 WeakPolarHBondContact O-CB 3.35Å; Q48-C51 PolarHBondContact O-N 3.49Å
49	P	73	Confident	76.1	Confident	5 Å²	5	53.9 Å²	53.9	3%	0.032	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-59.4	-29.1	-178.2	25.2	-34.7	0	0	0	113.1	Y23 F33 F37 T46 C51 F52	Y23-P49 HydrophobicContact CD1-CG 3.92Å; Y23-P49 HydrophobicContact CE1-CG 4.08Å; F33-P49 HydrophobicContact CB-CB 4.25Å; F33-P49 HydrophobicContact CB-CG 3.49Å; F33-P49 VanDerWaalsContact CB-CG 3.49Å; F33-P49 HydrophobicContact CD1-CB 3.85Å; F33-P49 HydrophobicContact CD1-CG 3.85Å; F33-P49 HydrophobicContact CD2-CG 4.43Å; F33-P49 HydrophobicContact CG-CB 4.21Å; F33-P49 HydrophobicContact CG-CG 3.68Å; F37-P49 HydrophobicContact CD1-CB 3.87Å; T46-P49 HydrophobicContact CG2-CB 4.19Å; P49-C51 PolarHBondContact O-N 3.45Å; P49-C51 VanDerWaalsContact O-N 3.14Å; P49-F52 PolarHBondContact O-N 2.92Å; P49-F52 VanDerWaalsContact O-N 3.13Å
50	E	74.2	Confident	76.5	Confident	41 Å²	41	53.2 Å²	53.2	19%	0.192	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-58.9	-23	173.9	69.5	-79.3	-176.2	0	0	113.9	F33 Q48 F52 L53 N57	F33-E50 HydrophobicContact CE1-CB 4.24Å; F33-E50 HydrophobicContact CE2-CB 3.71Å; F33-E50 HydrophobicContact CZ-CB 3.52Å; Q48-E50 VanDerWaalsContact C-OE2 3.26Å; Q48-E50 WeakPolarHBondContact CA-OE2 3.43Å; Q48-E50 PolarHBondContact O-N 3.3Å; E50-F52 PolarHBondContact O-N 3.04Å; E50-L53 WeakPolarHBondContact O-CB 3.37Å; E50-L53 PolarHBondContact O-N 3.35Å; E50-N57 WeakPolarHBondContact CB-OD1 3.48Å
51	C	71.5	Confident	77	Confident	16 Å²	16	53.6 Å²	53.6	11%	0.108	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-70.2	-14.8	178.6	-78.2	0	0	0	0	114	Q48 P49 R327	Q48-C51 HydrophobicContact CB-CB 4.34Å; Q48-C51 VanDerWaalsContact O-CB 3.27Å; Q48-C51 WeakPolarHBondContact O-CB 3.35Å; Q48-C51 PolarHBondContact O-N 3.49Å; P49-C51 PolarHBondContact O-N 3.45Å; P49-C51 VanDerWaalsContact O-N 3.14Å; C51-R327 PolarHBondContact O-NH1 2.85Å; C51-R327 PolarHBondContact SG-NH2 2.94Å; C51-R327 VanDerWaalsContact SG-NH2 3.42Å
52	F	70	Confident	77.8	Confident	27 Å²	27	52.9 Å²	52.9	12%	0.118	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-109.2	0.3	178.1	-62.2	-96.8	0	0	0	112.8	F37 T46 P49 E50 F54 R327 A328 E435	F37-F52 HydrophobicContact CD2-CB 4.49Å; F37-F52 HydrophobicContact CE1-CB 4.02Å; F37-F52 AromaticContact CE1-CD2 3.55Å; F37-F52 HydrophobicContact CE1-CD2 3.55Å; F37-F52 HydrophobicContact CE1-CE2 4.08Å; F37-F52 AromaticContact CE1-CG 3.82Å; F37-F52 HydrophobicContact CE1-CG 3.82Å; F37-F52 HydrophobicContact CE2-CB 3.69Å; F37-F52 HydrophobicContact CE2-CD1 4.3Å; F37-F52 AromaticContact CE2-CG 3.97Å; F37-F52 HydrophobicContact CE2-CG 3.97Å; F37-F52 HydrophobicContact CZ-CB 3.43Å; F37-F52 VanDerWaalsContact CZ-CB 3.43Å; F37-F52 AromaticContact CZ-CD1 3.66Å; F37-F52 HydrophobicContact CZ-CD1 3.66Å; F37-F52 AromaticContact CZ-CD2 3.46Å; F37-F52 HydrophobicContact CZ-CD2 3.46Å; F37-F52 VanDerWaalsContact CZ-CD2 3.46Å; F37-F52 HydrophobicContact CZ-CE1 4.2Å; F37-F52 HydrophobicContact CZ-CE2 4.04Å; F37-F52 AromaticContact CZ-CG 3.23Å; F37-F52 HydrophobicContact CZ-CG 3.23Å; F37-F52 HydrophobicContact CZ-CZ 4.37Å; T46-F52 HydrophobicContact CG2-CE2 4.33Å; P49-F52 PolarHBondContact O-N 2.92Å; P49-F52 VanDerWaalsContact O-N 3.13Å; E50-F52 PolarHBondContact O-N 3.04Å; F52-F54 PolarHBondContact O-N 3.26Å; F52-R327 HydrophobicContact CE1-CB 4.49Å; F52-A328 HydrophobicContact CD1-CB 4.4Å; F52-A328 HydrophobicContact CE1-CB 4.19Å; F52-E435 WeakPolarHBondContact CZ-OE1 3.17Å
53	L	75.6	Confident	78.5	Confident	38 Å²	38	50.8 Å²	50.8	20%	0.199	25%	0.252	C	S	.	.			trans	-55.9	128.9	178	-178.5	64.7	0	0	0	110.3	E50 G55 E56 L60	E50-L53 WeakPolarHBondContact O-CB 3.37Å; E50-L53 PolarHBondContact O-N 3.35Å; L53-G55 PolarHBondContact O-N 3.38Å; L53-E56 WeakPolarHBondContact CD2-O 3.45Å; L53-L60 HydrophobicContact CD1-CD2 3.99Å; L53-L60 HydrophobicContact CD2-CD1 4.12Å; L53-L60 HydrophobicContact CD2-CD2 4.22Å; L53-L60 HydrophobicContact CD2-CG 4.04Å
54	F	76.5	Confident	78.4	Confident	56 Å²	56	46.1 Å²	46.1	25%	0.246	24%	0.239	C	C	.	.	S	Bend	trans	-76.3	80.7	173.3	-143.8	-90.5	0	0	0	108.5	F52 Q250 V252 L295 L297 R300 L330	F52-F54 PolarHBondContact O-N 3.26Å; F54-Q250 HydrophobicContact CD1-CB 3.79Å; F54-Q250 HydrophobicContact CD1-CG 4.43Å; F54-Q250 HydrophobicContact CE1-CB 4.28Å; F54-Q250 VanDerWaalsContact O-CD 3.32Å; F54-Q250 VanDerWaalsContact O-CG 3.23Å; F54-Q250 WeakPolarHBondContact O-CG 3.25Å; F54-Q250 PolarHBondContact O-NE2 3.29Å; F54-V252 HydrophobicContact CE1-CG2 4.46Å; F54-V252 HydrophobicContact CZ-CG2 4.35Å; F54-L295 HydrophobicContact CE2-CD1 4.39Å; F54-L295 HydrophobicContact CZ-CD1 4.17Å; F54-L297 HydrophobicContact CD2-CD2 3.88Å; F54-L297 HydrophobicContact CE2-CD2 3.52Å; F54-R300 HydrophobicContact CD1-CG 3.97Å; F54-R300 HydrophobicContact CE1-CB 4.4Å; F54-R300 VanDerWaalsContact CE1-CD 3.47Å; F54-R300 HydrophobicContact CE1-CG 3.64Å; F54-R300 HydrophobicContact CE2-CG 4.29Å; F54-R300 HydrophobicContact CG-CG 4.43Å; F54-R300 HydrophobicContact CZ-CB 4.42Å; F54-R300 HydrophobicContact CZ-CG 3.82Å; F54-L330 HydrophobicContact CE2-CD2 4.16Å
55	G	80.3	Confident	78.3	Confident	18 Å²	18	50.7 Å²	50.7	19%	0.186	26%	0.256	C	S	.	.	S	Bend	trans	139.2	-160.9	-173.4	0	0	0	0	0	113.4	L53	L53-G55 PolarHBondContact O-N 3.38Å
56	E	82.1	Confident	78	Confident	108 Å²	108	52.5 Å²	52.5	51%	0.505	26%	0.262	S	S	.	.			trans	-103.7	152.4	171.9	-67.5	-177.3	-123.2	0	0	110.9	L53 K58 D59	L53-E56 WeakPolarHBondContact CD2-O 3.45Å; E56-K58 HydrophobicContact CB-CD 4.46Å; E56-K58 HydrophobicContact CB-CG 4.02Å; E56-K58 VanDerWaalsContact CD-CE 3.47Å; E56-K58 PolarHBondContact O-N 3.41Å; E56-K58 VanDerWaalsContact O-N 3.11Å; E56-K58 WeakPolarHBondContact OE1-CE 3.28Å; E56-K58 IonicContact OE1-NZ 2.71Å; E56-K58 PolarHBondContact OE1-NZ 2.93Å; E56-K58 WeakPolarHBondContact OE2-CD 3.47Å; E56-K58 WeakPolarHBondContact OE2-CE 3.22Å; E56-K58 IonicContact OE2-NZ 3.16Å; E56-K58 PolarHBondContact OE2-NZ 3.26Å; E56-D59 PolarHBondContact N-OD2 2.69Å; E56-D59 WeakPolarHBondContact O-CA 3.29Å; E56-D59 WeakPolarHBondContact O-CB 3.2Å; E56-D59 VanDerWaalsContact O-CG 3.26Å; E56-D59 PolarHBondContact O-N 3Å
57	N	81.9	Confident	78	Confident	51 Å²	51	56.9 Å²	56.9	27%	0.273	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-56.8	-31.8	177.6	-75	-31.9	0	0	0	113.7	Y25 E50 D59 L60	Y25-N57 HydrophobicContact CD2-CB 3.49Å; Y25-N57 VanDerWaalsContact CD2-CB 3.49Å; Y25-N57 WeakPolarHBondContact CE1-O 3.46Å; Y25-N57 HydrophobicContact CE2-CB 3.93Å; Y25-N57 HydrophobicContact CG-CB 3.85Å; E50-N57 WeakPolarHBondContact CB-OD1 3.48Å; N57-D59 PolarHBondContact O-N 2.86Å; N57-D59 VanDerWaalsContact O-N 3.15Å; N57-L60 WeakPolarHBondContact O-CB 3.49Å; N57-L60 WeakPolarHBondContact O-CG 3.43Å; N57-L60 PolarHBondContact O-N 2.93Å
58	K	84.1	Confident	78.2	Confident	104 Å²	104	57.1 Å²	57.1	45%	0.452	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-63.7	-14.2	174.3	80.3	-170.1	-176	-149	0	113.7	E56 L60 N61	E56-K58 HydrophobicContact CB-CD 4.46Å; E56-K58 HydrophobicContact CB-CG 4.02Å; E56-K58 VanDerWaalsContact CD-CE 3.47Å; E56-K58 PolarHBondContact O-N 3.41Å; E56-K58 VanDerWaalsContact O-N 3.11Å; E56-K58 WeakPolarHBondContact OE1-CE 3.28Å; E56-K58 IonicContact OE1-NZ 2.71Å; E56-K58 PolarHBondContact OE1-NZ 2.93Å; E56-K58 WeakPolarHBondContact OE2-CD 3.47Å; E56-K58 WeakPolarHBondContact OE2-CE 3.22Å; E56-K58 IonicContact OE2-NZ 3.16Å; E56-K58 PolarHBondContact OE2-NZ 3.26Å; K58-L60 VanDerWaalsContact C-N 3.33Å; K58-N61 VanDerWaalsContact O-CB 3.24Å; K58-N61 WeakPolarHBondContact O-CB 3.29Å; K58-N61 PolarHBondContact O-ND2 3.43Å; K58-N61 VanDerWaalsContact O-ND2 3.12Å
59	D	87	Confident	78.3	Confident	6 Å²	6	58.6 Å²	58.6	3%	0.032	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-75.8	-26	178.5	-62.8	-18.5	0	0	0	111.4	E56 N57 N61 F62 K237 L248 Q250	E56-D59 PolarHBondContact N-OD2 2.69Å; E56-D59 WeakPolarHBondContact O-CA 3.29Å; E56-D59 WeakPolarHBondContact O-CB 3.2Å; E56-D59 VanDerWaalsContact O-CG 3.26Å; E56-D59 PolarHBondContact O-N 3Å; N57-D59 PolarHBondContact O-N 2.86Å; N57-D59 VanDerWaalsContact O-N 3.15Å; D59-N61 PolarHBondContact O-N 2.78Å; D59-F62 WeakPolarHBondContact O-CB 3.48Å; D59-F62 WeakPolarHBondContact O-CD2 3.19Å; D59-F62 PolarHBondContact O-N 3.23Å; D59-F62 VanDerWaalsContact O-N 3.12Å; D59-K237 WeakPolarHBondContact OD1-CE 3.5Å; D59-K237 IonicContact OD1-NZ 3.09Å; D59-K237 PolarHBondContact OD1-NZ 3.34Å; D59-K237 IonicContact OD2-NZ 3.33Å; D59-K237 PolarHBondContact OD2-NZ 2.7Å; D59-L248 HydrophobicContact CB-CD2 3.7Å; D59-L248 WeakPolarHBondContact O-CD2 3.49Å; D59-Q250 PolarHBondContact OD2-NE2 2.91Å
60	L	85.2	Confident	78.3	Confident	13 Å²	13	64.5 Å²	64.5	7%	0.068	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-62.5	-26.4	177.1	-59.6	171.8	0	0	0	112.1	Y25 Y32 F33 L53 N57 K58 F62 L63	Y25-L60 HydrophobicContact CD1-CD1 4.38Å; Y32-L60 HydrophobicContact CD1-CB 4.16Å; Y32-L60 HydrophobicContact CD1-CD2 4.5Å; Y32-L60 HydrophobicContact CD2-CB 3.72Å; Y32-L60 HydrophobicContact CD2-CD1 3.72Å; Y32-L60 HydrophobicContact CD2-CG 4.3Å; Y32-L60 HydrophobicContact CE1-CB 3.98Å; Y32-L60 HydrophobicContact CE2-CB 3.49Å; Y32-L60 VanDerWaalsContact CE2-CB 3.49Å; Y32-L60 HydrophobicContact CE2-CD1 4.35Å; Y32-L60 HydrophobicContact CG-CB 4.05Å; Y32-L60 HydrophobicContact CG-CD1 3.85Å; Y32-L60 HydrophobicContact CG-CG 4.37Å; Y32-L60 VanDerWaalsContact CZ-O 3.29Å; Y32-L60 PolarHBondContact OH-O 2.87Å; F33-L60 HydrophobicContact CE2-CD1 3.99Å; F33-L60 HydrophobicContact CZ-CD1 3.68Å; L53-L60 HydrophobicContact CD1-CD2 3.99Å; L53-L60 HydrophobicContact CD2-CD1 4.12Å; L53-L60 HydrophobicContact CD2-CD2 4.22Å; L53-L60 HydrophobicContact CD2-CG 4.04Å; N57-L60 WeakPolarHBondContact O-CB 3.49Å; N57-L60 WeakPolarHBondContact O-CG 3.43Å; N57-L60 PolarHBondContact O-N 2.93Å; K58-L60 VanDerWaalsContact C-N 3.33Å; L60-F62 PolarHBondContact O-N 3.36Å; L60-L63 HydrophobicContact CD2-CD1 4.07Å; L60-L63 WeakPolarHBondContact O-CB 3.22Å; L60-L63 PolarHBondContact O-N 2.73Å
61	N	85.3	Confident	78.3	Confident	22 Å²	22	65.5 Å²	65.5	12%	0.118	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-54.8	-20.8	173	-71.3	-19.1	0	0	0	114.9	Y25 K58 D59 H191	Y25-N61 WeakPolarHBondContact CE1-OD1 3.47Å; Y25-N61 PolarHBondContact OH-ND2 3.28Å; Y25-N61 PolarHBondContact OH-OD1 3.49Å; Y25-N61 VanDerWaalsContact OH-OD1 3.14Å; K58-N61 VanDerWaalsContact O-CB 3.24Å; K58-N61 WeakPolarHBondContact O-CB 3.29Å; K58-N61 PolarHBondContact O-ND2 3.43Å; K58-N61 VanDerWaalsContact O-ND2 3.12Å; D59-N61 PolarHBondContact O-N 2.78Å; N61-H191 HydrophobicContact CB-CB 4.5Å; N61-H191 WeakPolarHBondContact CB-ND1 3.1Å; N61-H191 PolarHBondContact OD1-NE2 3.01Å
62	F	87	Confident	78.3	Confident	14 Å²	14	69.2 Å²	69.2	6%	0.061	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-89.8	-7.1	177.1	-65.2	-81.4	0	0	0	113.1	D59 L60 Y189 I219 I236 K237 K239 L248	D59-F62 WeakPolarHBondContact O-CB 3.48Å; D59-F62 WeakPolarHBondContact O-CD2 3.19Å; D59-F62 PolarHBondContact O-N 3.23Å; D59-F62 VanDerWaalsContact O-N 3.12Å; L60-F62 PolarHBondContact O-N 3.36Å; F62-Y189 HydrophobicContact CD1-CE2 4.43Å; F62-Y189 HydrophobicContact CE1-CD1 4.14Å; F62-Y189 HydrophobicContact CE1-CD2 4.03Å; F62-Y189 AromaticContact CE1-CE1 3.79Å; F62-Y189 HydrophobicContact CE1-CE1 3.79Å; F62-Y189 AromaticContact CE1-CE2 3.68Å; F62-Y189 HydrophobicContact CE1-CE2 3.68Å; F62-Y189 HydrophobicContact CE1-CG 4.25Å; F62-Y189 AromaticContact CE1-CZ 3.55Å; F62-Y189 HydrophobicContact CE2-CD1 4.48Å; F62-Y189 HydrophobicContact CE2-CE1 4.02Å; F62-Y189 AromaticContact CZ-CD1 3.62Å; F62-Y189 HydrophobicContact CZ-CD1 3.62Å; F62-Y189 HydrophobicContact CZ-CD2 4.33Å; F62-Y189 AromaticContact CZ-CE1 3.39Å; F62-Y189 HydrophobicContact CZ-CE1 3.39Å; F62-Y189 HydrophobicContact CZ-CE2 4.15Å; F62-Y189 HydrophobicContact CZ-CG 4.08Å; F62-Y189 AromaticContact CZ-CZ 3.68Å; F62-I219 HydrophobicContact CD1-CD1 3.53Å; F62-I219 HydrophobicContact CE1-CD1 3.83Å; F62-I219 HydrophobicContact CE1-CG2 4.28Å; F62-I236 HydrophobicContact CE1-CD1 4.2Å; F62-I236 HydrophobicContact CZ-CD1 3.83Å; F62-K237 HydrophobicContact CD1-CG 4.5Å; F62-K237 HydrophobicContact CD2-CG 3.85Å; F62-K237 HydrophobicContact CE1-CG 4.36Å; F62-K237 HydrophobicContact CE2-CG 3.71Å; F62-K237 HydrophobicContact CG-CG 4.26Å; F62-K237 HydrophobicContact CZ-CG 3.97Å; F62-K239 HydrophobicContact CB-CD 4.31Å; F62-K239 WeakPolarHBondContact O-CD 3.49Å; F62-K239 WeakPolarHBondContact O-CE 3.3Å; F62-K239 PolarHBondContact O-NZ 2.82Å; F62-L248 HydrophobicContact CB-CD1 3.89Å; F62-L248 HydrophobicContact CB-CD2 4.48Å; F62-L248 HydrophobicContact CG-CD1 4.49Å
63	L	85.1	Confident	78	Confident	44 Å²	44	74.2 Å²	74.2	23%	0.23	38%	0.383	C	S	.	.	S	Bend	trans	-97	162.3	-179.1	-65.1	176.5	0	0	0	112.2	L60 L248	L60-L63 HydrophobicContact CD2-CD1 4.07Å; L60-L63 WeakPolarHBondContact O-CB 3.22Å; L60-L63 PolarHBondContact O-N 2.73Å; L63-L248 HydrophobicContact CD2-CB 3.86Å; L63-L248 HydrophobicContact CG-CB 4.46Å
64	C	75.8	Confident	77.5	Confident	38 Å²	38	79.1 Å²	79.1	26%	0.257	40%	0.399	S	S	.	.			trans	-60.1	138.4	175	-168.7	0	0	0	0	111.4	K66 I141	C64-K66 VanDerWaalsContact C-N 3.3Å; C64-K66 PolarHBondContact O-N 3.42Å; C64-I141 HydrophobicContact CB-CD1 3.89Å
65	R	72.4	Confident	76.9	Confident	115 Å²	115	79.1 Å²	79.1	43%	0.434	40%	0.4	S	S	.	.	S	Bend	trans	-78.8	-9.8	177.3	-65.6	179.5	177.3	154.4	-0.1	113.9	H191 E194	R65-H191 PolarHBondContact NH2-NE2 2.83Å; R65-E194 IonicContact CZ-OE1 2.67Å; R65-E194 IonicContact NH1-OE1 3.83Å; R65-E194 PolarHBondContact NH1-OE1 3.14Å; R65-E194 IonicContact NH2-OE1 2.73Å; R65-E194 PolarHBondContact NH2-OE1 3.31Å
66	K	73.6	Confident	76	Confident	165 Å²	165	80.8 Å²	80.8	72%	0.717	41%	0.409	S	S	*	.	S	Bend	trans	-98.6	133.2	178.2	-67.8	-178.9	178.8	176.9	0	109.5	C64	C64-K66 VanDerWaalsContact C-N 3.3Å; C64-K66 PolarHBondContact O-N 3.42Å
67	P	73	Confident	75	Confident	134 Å²	134	78.7 Å²	78.7	87%	0.87	41%	0.406	S	S	*	.			trans	-55.8	140.3	167.5	-23.7	34.2	0	0	0	110.9
68	V	75	Confident	74.2	Confident	84 Å²	84	78.2 Å²	78.2	51%	0.509	41%	0.407	S	S	.	.			trans	-123.6	136.8	175.7	-179.7	0	0	0	0	107.6	Y70	V68-Y70 PolarHBondContact O-N 2.9Å
69	T	74.7	Confident	73.5	Confident	131 Å²	131	77.6 Å²	77.6	80%	0.804	41%	0.406	S	S	*	.			trans	-68.8	122.1	171.1	-53.4	0	0	0	0	108.7
70	Y	74.9	Confident	73	Confident	129 Å²	129	77.4 Å²	77.4	51%	0.506	41%	0.405	S	S	.	.			trans	-63	129.2	177.5	-164.8	-114.1	0	0	0	109.8	V68 Y72 V245 Y247	V68-Y70 PolarHBondContact O-N 2.9Å; Y70-Y72 HydrophobicContact CD1-CD2 4.46Å; Y70-Y72 AromaticContact CE1-CD2 3.73Å; Y70-Y72 HydrophobicContact CE1-CD2 3.73Å; Y70-Y72 HydrophobicContact CE1-CG 4.34Å; Y70-Y72 HydrophobicContact CE2-CD2 4.33Å; Y70-Y72 AromaticContact CZ-CD2 3.66Å; Y70-V245 HydrophobicContact CD2-CG2 4.39Å; Y70-Y247 HydrophobicContact CE2-CE1 4.45Å
71	P	72.8	Confident	72.6	Confident	62 Å²	62	79 Å²	79	40%	0.403	41%	0.41	S	S	.	.	S	Bend	trans	-79.1	-23.2	-167.2	31.1	-37.4	0	0	0	113.3	D243 V245	P71-D243 HydrophobicContact CG-CB 4.22Å; P71-V245 HydrophobicContact CG-CG2 3.86Å
72	Y	70.9	Confident	72.2	Confident	95 Å²	95	85 Å²	85	37%	0.373	44%	0.438	S	S	.	.	S	Bend	trans	-90.5	138.5	-178.3	-47.2	-62	0	0	0	111.1	Y70 D243 Y247	Y70-Y72 HydrophobicContact CD1-CD2 4.46Å; Y70-Y72 AromaticContact CE1-CD2 3.73Å; Y70-Y72 HydrophobicContact CE1-CD2 3.73Å; Y70-Y72 HydrophobicContact CE1-CG 4.34Å; Y70-Y72 HydrophobicContact CE2-CD2 4.33Å; Y70-Y72 AromaticContact CZ-CD2 3.66Å; Y72-D243 PolarHBondContact OH-OD2 2.64Å; Y72-Y247 WeakPolarHBondContact CE2-OH 3.29Å
73	V	65.4	Low	71.8	Confident	131 Å²	131	85.9 Å²	85.9	79%	0.794	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-66.4	143.6	175.8	-176	0	0	0	0	109.5	Q75	V73-Q75 PolarHBondContact O-N 3.32Å; V73-Q75 VanDerWaalsContact O-N 3.11Å
74	Y	64.9	Low	71.7	Confident	141 Å²	141	86.8 Å²	86.8	55%	0.553	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-56.6	116.2	172.7	178.4	-97.8	0	0	0	110.6	M38 D41	M38-Y74 HydrophobicContact SD-CD2 4.4Å; D41-Y74 PolarHBondContact O-OH 2.81Å
75	Q	62.9	Low	72.2	Confident	57 Å²	57	89.3 Å²	89.3	27%	0.266	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-81.6	134.1	171.4	-65	-179.2	-80.5	0	0	109	V73 P80 Y81	V73-Q75 PolarHBondContact O-N 3.32Å; V73-Q75 VanDerWaalsContact O-N 3.11Å; Q75-P80 PolarHBondContact NE2-O 2.88Å; Q75-Y81 HydrophobicContact CB-CE1 4.46Å
76	S	61.5	Low	73	Confident	52 Å²	52	85.4 Å²	85.4	36%	0.364	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-65.1	155.4	173.7	73.3	0	0	0	0	111	S78 E79	S76-S78 PolarHBondContact O-N 3.14Å; S76-S78 PolarHBondContact OG-OG 3.3Å; S76-E79 PolarHBondContact O-N 3.16Å
77	S	61.7	Low	74	Confident	64 Å²	64	80.5 Å²	80.5	45%	0.448	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-8.8	176.5	57.9	0	0	0	0	115.8	D41	D41-S77 VanDerWaalsContact OD2-CB 3.26Å; D41-S77 WeakPolarHBondContact OD2-CB 3.44Å
78	S	64.6	Low	75	Confident	41 Å²	41	74.2 Å²	74.2	29%	0.287	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-11.4	176.5	71.9	0	0	0	0	114.9	S76	S76-S78 PolarHBondContact O-N 3.14Å; S76-S78 PolarHBondContact OG-OG 3.3Å
79	E	70.4	Confident	76	Confident	92 Å²	92	73 Å²	73	43%	0.43	38%	0.379	S	S	.	.	S	Bend	trans	-113.8	142.2	179.7	-64.9	-168.4	161.1	0	0	111.2	S76	S76-E79 PolarHBondContact O-N 3.16Å
80	P	75.3	Confident	77	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.006	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-79.1	146.5	178	33.3	-35.3	0	0	0	112	Q75 V335 Y364 H428 V430	Q75-P80 PolarHBondContact NE2-O 2.88Å; P80-V335 HydrophobicContact CB-CG2 3.65Å; P80-V335 HydrophobicContact CG-CG2 3.86Å; P80-Y364 HydrophobicContact CG-CD1 4.1Å; P80-Y364 HydrophobicContact CG-CD2 4.39Å; P80-Y364 HydrophobicContact CG-CE1 3.62Å; P80-Y364 HydrophobicContact CG-CE2 3.96Å; P80-Y364 HydrophobicContact CG-CG 4.45Å; P80-H428 HydrophobicContact CB-CB 3.94Å; P80-H428 HydrophobicContact CG-CB 3.97Å; P80-V430 HydrophobicContact CB-CG2 3.78Å
81	Y	76.8	Confident	78	Confident	48 Å²	48	63.6 Å²	63.6	19%	0.188	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	131.1	172.5	-60.4	-76.1	0	0	0	110.8	G40 D41 Q75 H428 I429 M431	G40-Y81 VanDerWaalsContact C-OH 3.25Å; G40-Y81 PolarHBondContact O-OH 2.94Å; D41-Y81 WeakPolarHBondContact CA-OH 3.42Å; D41-Y81 PolarHBondContact N-OH 3.22Å; Q75-Y81 HydrophobicContact CB-CE1 4.46Å; Y81-H428 CarbonylContact O-C 3.54Å; Y81-H428 VanDerWaalsContact O-CA 3.32Å; Y81-H428 WeakPolarHBondContact O-CA 3.49Å; Y81-I429 WeakPolarHBondContact CB-O 3.39Å; Y81-I429 WeakPolarHBondContact CD2-O 3.49Å; Y81-I429 PolarHBondContact N-O 3.44Å; Y81-I429 PolarHBondContact O-N 3.26Å; Y81-M431 HydrophobicContact CD2-CB 4.42Å; Y81-M431 HydrophobicContact CD2-CE 3.88Å; Y81-M431 HydrophobicContact CE2-CB 4.29Å; Y81-M431 HydrophobicContact CE2-CE 4.2Å; Y81-M431 HydrophobicContact CG-CE 4.31Å
82	Q	77.1	Confident	79	Confident	148 Å²	148	63.9 Å²	63.9	69%	0.692	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	134.4	167.7	-173.7	176.8	-10	0	0	109.5
83	A	79	Confident	80	Confident	32 Å²	32	66.6 Å²	66.6	26%	0.264	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-70.4	142.2	175.2	0	0	0	0	0	111.6	H85 P426 E427 I429	A83-H85 PolarHBondContact O-N 2.8Å; A83-P426 WeakPolarHBondContact CB-O 3.39Å; A83-E427 PolarHBondContact N-O 2.97Å; A83-I429 HydrophobicContact CB-CD1 4.36Å
84	L	83.3	Confident	81.5	Confident	63 Å²	63	61.4 Å²	61.4	33%	0.33	31%	0.307	S	S	.	.			trans	-70.1	112.1	177.7	-176.3	70	0	0	0	110.7	C86 V242 Y247	L84-C86 PolarHBondContact O-N 2.9Å; L84-V242 HydrophobicContact CD1-CB 4.1Å; L84-V242 HydrophobicContact CD1-CG1 3.9Å; L84-V242 HydrophobicContact CD1-CG2 4.44Å; L84-V242 HydrophobicContact CD2-CG2 4.48Å; L84-Y247 HydrophobicContact CD1-CE2 4.21Å; L84-Y247 HydrophobicContact CD2-CD1 4.04Å; L84-Y247 HydrophobicContact CD2-CD2 3.65Å; L84-Y247 HydrophobicContact CD2-CE1 4.13Å; L84-Y247 HydrophobicContact CD2-CE2 3.75Å; L84-Y247 HydrophobicContact CD2-CG 3.81Å
85	H	85.1	Confident	83.1	Confident	90 Å²	90	55.2 Å²	55.2	42%	0.417	28%	0.283	S	S	.	.			trans	-80.1	98.2	-178.7	-163.6	-82.4	0	0	0	111.6	A83 M87 D126 Q214	A83-H85 PolarHBondContact O-N 2.8Å; H85-M87 VanDerWaalsContact CE1-SD 3.57Å; H85-M87 WeakPolarHBondContact ND1-CE 3.49Å; H85-M87 PolarHBondContact ND1-SD 3.22Å; H85-D126 IonicContact CE1-OD2 2.78Å; H85-Q214 PolarHBondContact O-NE2 3.21Å; H85-Q214 PolarHBondContact O-OE1 3.26Å
86	C	90.2	Very high	84.7	Confident	34 Å²	34	57 Å²	57	23%	0.23	29%	0.291	C	S	.	.			trans	-89.9	104.1	-178.6	-61.2	0	0	0	0	110.9	L84 V88 F240	L84-C86 PolarHBondContact O-N 2.9Å; C86-V88 PolarHBondContact O-N 2.84Å; C86-V88 VanDerWaalsContact O-N 3.13Å; C86-F240 HydrophobicContact CB-CD1 3.99Å; C86-F240 HydrophobicContact CB-CE1 3.7Å; C86-F240 HydrophobicContact CB-CZ 4.18Å
87	M	93.9	Very high	86.4	Confident	61 Å²	61	55.8 Å²	55.8	30%	0.3	28%	0.278	S	S	.	.	S	Bend	trans	-69.3	-10.4	-169.5	-63.9	-71	-179.1	0	0	115.8	H85 D126 A127 T204 Q214	H85-M87 VanDerWaalsContact CE1-SD 3.57Å; H85-M87 WeakPolarHBondContact ND1-CE 3.49Å; H85-M87 PolarHBondContact ND1-SD 3.22Å; M87-D126 PolarHBondContact O-N 2.83Å; M87-D126 HydrophobicContact SD-CB 4.23Å; M87-A127 HydrophobicContact CB-CB 4.13Å; M87-A127 PolarHBondContact O-N 3.3Å; M87-A127 HydrophobicContact SD-CB 4.46Å; M87-T204 HydrophobicContact CB-CG2 3.58Å; M87-T204 HydrophobicContact CG-CG2 4.39Å; M87-Q214 HydrophobicContact CG-CG 4.4Å; M87-Q214 VanDerWaalsContact CG-OE1 3.29Å
88	V	95	Very high	88	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.018	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	132.3	176.6	56.3	0	0	0	0	110.3	C86 D124 C129 C202 T204 H216	C86-V88 PolarHBondContact O-N 2.84Å; C86-V88 VanDerWaalsContact O-N 3.13Å; V88-D124 CarbonylContact C-O 3.59Å; V88-D124 WeakPolarHBondContact CA-O 3.43Å; V88-C129 HydrophobicContact CG2-CB 4.36Å; V88-C202 HydrophobicContact CG1-CB 3.98Å; V88-C202 HydrophobicContact CG2-CB 3.68Å; V88-T204 HydrophobicContact CG1-CG2 4.36Å; V88-H216 HydrophobicContact CG1-CB 4.08Å; V88-H216 WeakPolarHBondContact O-CB 3.31Å
89	I	95.3	Very high	89.3	Confident	57 Å²	57	60.2 Å²	60.2	29%	0.292	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	131.1	178.3	-172.5	168	0	0	0	111.2	L123 D124 H216 F240	I89-L123 CarbonylContact O-C 3.56Å; I89-L123 VanDerWaalsContact O-CA 3.22Å; I89-L123 WeakPolarHBondContact O-CA 3.17Å; I89-L123 WeakPolarHBondContact O-CB 3.22Å; I89-D124 HydrophobicContact CG2-CB 3.93Å; I89-D124 PolarHBondContact N-O 3.08Å; I89-D124 PolarHBondContact O-N 3.47Å; I89-H216 VanDerWaalsContact CA-CE1 3.5Å; I89-H216 WeakPolarHBondContact CA-CE1 3.47Å; I89-F240 HydrophobicContact CD1-CZ 4.18Å; I89-F240 HydrophobicContact CG1-CZ 4.26Å
90	V	96.9	Very high	90.2	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	127.6	165.2	174.7	0	0	0	0	107.1	R92 F121 L123 I200 H216 Q238	V90-R92 PolarHBondContact O-N 2.73Å; V90-F121 HydrophobicContact CB-CD2 4.39Å; V90-F121 HydrophobicContact CG1-CB 4Å; V90-F121 HydrophobicContact CG1-CD2 3.55Å; V90-F121 HydrophobicContact CG1-CE2 4.12Å; V90-F121 HydrophobicContact CG1-CG 3.84Å; V90-F121 HydrophobicContact CG2-CD2 4.06Å; V90-F121 HydrophobicContact CG2-CE2 3.8Å; V90-L123 HydrophobicContact CG2-CB 4.2Å; V90-I200 HydrophobicContact CG2-CG2 4.06Å; V90-H216 WeakPolarHBondContact CA-NE2 3.42Å; V90-H216 WeakPolarHBondContact CB-NE2 3.39Å; V90-H216 WeakPolarHBondContact CG2-CE1 3.06Å; V90-H216 PolarHBondContact N-CE1 3.04Å; V90-H216 PolarHBondContact N-ND1 2.83Å; V90-H216 PolarHBondContact N-NE2 3.1Å; V90-H216 PolarHBondContact O-NE2 3.16Å; V90-Q238 PolarHBondContact O-NE2 2.9Å
91	R	95.1	Very high	90.4	Very high	64 Å²	64	65.6 Å²	65.6	24%	0.242	32%	0.316	C	S	.	.			trans	-70.6	115.4	178.1	-68.5	-165.9	-169.6	165.1	8.7	110.6	E93 S94 V122 D124 N167	R91-E93 VanDerWaalsContact C-N 3.34Å; R91-E93 WeakPolarHBondContact CB-OE1 3.4Å; R91-E93 PolarHBondContact O-N 3.43Å; R91-S94 WeakPolarHBondContact O-CB 3.09Å; R91-S94 PolarHBondContact O-N 3.44Å; R91-S94 VanDerWaalsContact O-N 3.13Å; R91-S94 PolarHBondContact O-OG 2.97Å; R91-V122 HydrophobicContact CB-CB 4.35Å; R91-V122 HydrophobicContact CG-CB 4.42Å; R91-V122 HydrophobicContact CG-CG1 4.33Å; R91-V122 PolarHBondContact N-O 2.86Å; R91-D124 IonicContact CZ-OD1 2.71Å; R91-D124 IonicContact CZ-OD2 2.7Å; R91-D124 IonicContact NE-OD1 3.37Å; R91-D124 IonicContact NE-OD2 2.73Å; R91-D124 PolarHBondContact NE-OD2 3.44Å; R91-D124 VanDerWaalsContact NH2-CG 3.3Å; R91-D124 IonicContact NH2-OD1 3.62Å; R91-D124 PolarHBondContact NH2-OD1 3.44Å; R91-D124 IonicContact NH2-OD2 2.74Å; R91-D124 PolarHBondContact NH2-OD2 2.72Å; R91-D124 VanDerWaalsContact NH2-OD2 3.09Å; R91-N167 VanDerWaalsContact CZ-OD1 3.24Å; R91-N167 PolarHBondContact NH1-OD1 2.77Å; R91-N167 PolarHBondContact NH2-OD1 2.85Å
92	R	93.9	Very high	89.8	Confident	67 Å²	67	67.2 Å²	67.2	25%	0.253	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-55.7	-48.6	-171.2	-171.4	-177.3	178.7	-169	1.1	112	V90 S94 L95 P235 E251	V90-R92 PolarHBondContact O-N 2.73Å; R92-S94 PolarHBondContact O-N 2.9Å; R92-L95 PolarHBondContact O-N 3.4Å; R92-P235 HydrophobicContact CG-CB 3.77Å; R92-P235 HydrophobicContact CG-CG 3.54Å; R92-P235 PolarHBondContact NE-O 2.87Å; R92-P235 PolarHBondContact NH2-O 2.71Å; R92-P235 WeakPolarHBondContact O-CG 3.42Å; R92-E251 IonicContact CZ-OE1 2.68Å; R92-E251 IonicContact NH1-OE1 2.98Å; R92-E251 PolarHBondContact NH1-OE1 2.65Å; R92-E251 IonicContact NH1-OE2 3.75Å; R92-E251 PolarHBondContact NH1-OE2 3.27Å
93	E	92.6	Very high	89	Confident	152 Å²	152	65.1 Å²	65.1	71%	0.71	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-68	-18.6	-176.6	73.9	-67.8	166.5	0	0	114.1	R91	R91-E93 VanDerWaalsContact C-N 3.34Å; R91-E93 WeakPolarHBondContact CB-OE1 3.4Å; R91-E93 PolarHBondContact O-N 3.43Å
94	S	96.4	Very high	88	Confident	23 Å²	23	69.1 Å²	69.1	16%	0.161	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-81.5	-18.4	177.7	75.7	0	0	0	0	113.8	R91 R92 K96 V122	R91-S94 WeakPolarHBondContact O-CB 3.09Å; R91-S94 PolarHBondContact O-N 3.44Å; R91-S94 VanDerWaalsContact O-N 3.13Å; R91-S94 PolarHBondContact O-OG 2.97Å; R92-S94 PolarHBondContact O-N 2.9Å; S94-K96 PolarHBondContact O-N 2.65Å; S94-V122 PolarHBondContact OG-N 2.93Å
95	L	98	Very high	86.9	Confident	10 Å²	10	73 Å²	73	5%	0.052	37%	0.372	C	S	.	.			trans	-73.2	118.5	-171	-177.9	64.7	0	0	0	112	R92 I119 F121 I200 T218 A220 L233 P235	R92-L95 PolarHBondContact O-N 3.4Å; L95-I119 HydrophobicContact CD1-CG2 3.74Å; L95-F121 HydrophobicContact CB-CB 4.4Å; L95-F121 HydrophobicContact CD1-CB 3.9Å; L95-F121 HydrophobicContact CD1-CD1 3.71Å; L95-F121 HydrophobicContact CD1-CG 4.2Å; L95-I200 HydrophobicContact CD1-CD1 3.42Å; L95-I200 VanDerWaalsContact CD1-CD1 3.42Å; L95-I200 HydrophobicContact CD2-CD1 4.04Å; L95-I200 HydrophobicContact CG-CD1 4.4Å; L95-T218 HydrophobicContact CD2-CG2 4.01Å; L95-A220 HydrophobicContact CD2-CB 3.93Å; L95-L233 HydrophobicContact CD1-CD2 3.57Å; L95-L233 HydrophobicContact CD1-CG 4.45Å; L95-L233 HydrophobicContact CD2-CD2 4.08Å; L95-L233 HydrophobicContact CD2-CG 4.13Å; L95-L233 HydrophobicContact CG-CD2 3.63Å; L95-L233 HydrophobicContact CG-CG 3.98Å; L95-P235 HydrophobicContact CB-CG 4.37Å; L95-P235 HydrophobicContact CD2-CB 3.92Å; L95-P235 HydrophobicContact CD2-CG 4.24Å
96	K	97.5	Very high	85.6	Confident	96 Å²	96	71.2 Å²	71.2	42%	0.417	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	163.2	-179.2	68	-165.9	176.7	-167.2	0	112.8	S94 V98 E120	S94-K96 PolarHBondContact O-N 2.65Å; K96-V98 HydrophobicContact CG-CG2 4.29Å; K96-E120 WeakPolarHBondContact CE-OE1 3.43Å; K96-E120 HydrophobicContact CG-CB 4.2Å; K96-E120 PolarHBondContact N-O 3.38Å; K96-E120 IonicContact NZ-OE1 3.62Å; K96-E120 PolarHBondContact NZ-OE1 3.24Å; K96-E120 PolarHBondContact O-N 3.09Å
97	F	96.7	Very high	83.9	Confident	25 Å²	25	72.3 Å²	72.3	11%	0.11	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	138.9	163.1	-78.7	-35.6	0	0	0	110.8	Y117 H118 I119 F177 P179 I198 A222 F231 L233	F97-Y117 HydrophobicContact CB-CD1 3.53Å; F97-Y117 HydrophobicContact CB-CE1 4.08Å; F97-Y117 HydrophobicContact CB-CG 3.76Å; F97-Y117 HydrophobicContact CD1-CG 4.18Å; F97-Y117 HydrophobicContact CD2-CD2 4.14Å; F97-Y117 HydrophobicContact CD2-CE2 4.5Å; F97-Y117 HydrophobicContact CD2-CG 4.17Å; F97-Y117 HydrophobicContact CG-CD1 4.1Å; F97-Y117 HydrophobicContact CG-CD2 4.23Å; F97-Y117 AromaticContact CG-CG 3.8Å; F97-Y117 HydrophobicContact CG-CG 3.8Å; F97-H118 WeakPolarHBondContact CA-O 3.43Å; F97-I119 HydrophobicContact CD1-CG1 3.94Å; F97-I119 HydrophobicContact CE1-CD1 4.19Å; F97-I119 HydrophobicContact CE1-CG1 3.81Å; F97-F177 HydrophobicContact CE1-CD1 4.12Å; F97-F177 AromaticContact CZ-CD1 3.9Å; F97-F177 HydrophobicContact CZ-CD1 3.9Å; F97-F177 HydrophobicContact CZ-CE1 4.23Å; F97-P179 HydrophobicContact CE2-CG 4.43Å; F97-I198 HydrophobicContact CZ-CD1 3.94Å; F97-A222 HydrophobicContact CE2-CB 3.81Å; F97-A222 HydrophobicContact CZ-CB 4.08Å; F97-F231 HydrophobicContact CD2-CB 4.32Å; F97-F231 HydrophobicContact CE2-CB 4.21Å; F97-L233 HydrophobicContact CB-CB 4.31Å; F97-L233 HydrophobicContact CD1-CB 3.86Å; F97-L233 HydrophobicContact CD1-CD2 3.94Å; F97-L233 HydrophobicContact CD1-CG 4.39Å; F97-L233 HydrophobicContact CD2-CB 3.66Å; F97-L233 HydrophobicContact CE1-CB 4.03Å; F97-L233 HydrophobicContact CE1-CD1 4.04Å; F97-L233 HydrophobicContact CE1-CD2 3.94Å; F97-L233 HydrophobicContact CE1-CG 4.25Å; F97-L233 HydrophobicContact CE2-CB 3.83Å; F97-L233 HydrophobicContact CE2-CD1 4.36Å; F97-L233 HydrophobicContact CG-CB 3.65Å; F97-L233 HydrophobicContact CZ-CB 4.01Å; F97-L233 HydrophobicContact CZ-CD1 3.86Å; F97-L233 HydrophobicContact CZ-CG 4.37Å
98	V	94.9	Very high	82	Confident	44 Å²	44	75 Å²	75	27%	0.267	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126.1	171.6	-179.8	0	0	0	0	107.9	K96 A100 Y117 H118 E120	K96-V98 HydrophobicContact CG-CG2 4.29Å; V98-A100 PolarHBondContact O-N 2.86Å; V98-Y117 CarbonylContact O-C 3.54Å; V98-Y117 VanDerWaalsContact O-CA 3.29Å; V98-Y117 WeakPolarHBondContact O-CA 3.39Å; V98-H118 PolarHBondContact N-O 3.4Å; V98-H118 PolarHBondContact O-N 2.9Å; V98-E120 HydrophobicContact CG2-CB 3.73Å
99	K	92.3	Very high	79.9	Confident	155 Å²	155	81.6 Å²	81.6	67%	0.674	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.7	125.7	-176.9	-74.9	-174.4	177.2	-175.4	0	110.7	Y117	K99-Y117 HydrophobicContact CB-CE1 4.46Å; K99-Y117 HydrophobicContact CG-CD1 4.03Å; K99-Y117 HydrophobicContact CG-CE1 3.54Å
100	A	89.8	Confident	77.8	Confident	18 Å²	18	84.3 Å²	84.3	15%	0.149	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-74.1	142.9	169.8	0	0	0	0	0	109.6	V98 R116 H118 V176	V98-A100 PolarHBondContact O-N 2.86Å; A100-R116 HydrophobicContact CB-CB 3.86Å; A100-R116 PolarHBondContact N-O 2.73Å; A100-H118 WeakPolarHBondContact CA-NE2 3.27Å; A100-H118 VanDerWaalsContact CB-NE2 3.3Å; A100-H118 WeakPolarHBondContact CB-NE2 3.33Å; A100-V176 HydrophobicContact CB-CG1 4.13Å
101	Q	78.5	Confident	75.8	Confident	188 Å²	188	87.6 Å²	87.6	88%	0.879	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-73	130.4	173	-64.6	-176.1	5.9	0	0	109.4	N103	Q101-N103 PolarHBondContact O-N 3.11Å
102	S	65.1	Low	73.9	Confident	81 Å²	81	88.5 Å²	88.5	57%	0.566	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-63.5	127.3	168.3	50.7	0	0	0	0	109
103	N	59.8	Low	72.5	Confident	104 Å²	104	90.3 Å²	90.3	56%	0.556	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-58.2	128.2	176.9	-157.9	37	0	0	0	108.6	Q101 D105 S106	Q101-N103 PolarHBondContact O-N 3.11Å; N103-D105 PolarHBondContact O-N 2.7Å; N103-S106 WeakPolarHBondContact O-CB 3.13Å; N103-S106 PolarHBondContact O-N 3.47Å; N103-S106 PolarHBondContact O-OG 2.89Å
104	P	57.5	Low	71.7	Confident	117 Å²	117	86 Å²	86	76%	0.76	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-16.6	-170.4	22.5	-34	0	0	0	114.4
105	D	59.7	Low	71.2	Confident	144 Å²	144	85.5 Å²	85.5	77%	0.77	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-2.7	175.8	-53.1	-43.4	0	0	0	114.1	N103	N103-D105 PolarHBondContact O-N 2.7Å
106	S	57.7	Low	71	Confident	53 Å²	53	90.7 Å²	90.7	37%	0.371	51%	0.505	S	S	.	.	S	Bend	trans	-71	135.3	176.4	60	0	0	0	0	111.2	N103	N103-S106 WeakPolarHBondContact O-CB 3.13Å; N103-S106 PolarHBondContact O-N 3.47Å; N103-S106 PolarHBondContact O-OG 2.89Å
107	S	55.3	Low	70.9	Confident	56 Å²	56	86.7 Å²	86.7	39%	0.392	49%	0.488	S	S	.	.			trans	-58.1	143.2	-178.5	84.9	0	0	0	0	111.3	D109 D110	S107-D109 PolarHBondContact O-N 3Å; S107-D109 VanDerWaalsContact O-N 3.13Å; S107-D110 PolarHBondContact O-N 3.49Å; S107-D110 PolarHBondContact OG-OD2 2.98Å
108	P	53.9	Low	70.9	Confident	117 Å²	117	86.1 Å²	86.1	76%	0.76	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-24.2	-175	22	-32.4	0	0	0	113.5	S111	P108-S111 PolarHBondContact O-N 2.75Å; P108-S111 PolarHBondContact O-OG 2.78Å
109	D	51	Low	71	Confident	142 Å²	142	84.1 Å²	84.1	76%	0.759	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-41.3	179.2	-113.9	-9.3	0	0	0	112.7	S107 S111 S112	S107-D109 PolarHBondContact O-N 3Å; S107-D109 VanDerWaalsContact O-N 3.13Å; D109-S111 PolarHBondContact O-N 3.2Å; D109-S112 PolarHBondContact O-OG 2.98Å
110	D	51.5	Low	71.3	Confident	115 Å²	115	79.1 Å²	79.1	62%	0.615	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-68.4	-22.8	178.9	-77.9	-47.5	0	0	0	113	S107 S112 C114	S107-D110 PolarHBondContact O-N 3.49Å; S107-D110 PolarHBondContact OG-OD2 2.98Å; D110-S112 VanDerWaalsContact C-N 3.25Å; D110-S112 PolarHBondContact O-N 2.68Å; D110-C114 WeakPolarHBondContact O-CB 3.39Å
111	S	53.8	Low	71.7	Confident	69 Å²	69	78.3 Å²	78.3	48%	0.483	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-69.1	-18.6	-172	74.9	0	0	0	0	114.6	P108 D109	P108-S111 PolarHBondContact O-N 2.75Å; P108-S111 PolarHBondContact O-OG 2.78Å; D109-S111 PolarHBondContact O-N 3.2Å
112	S	56.2	Low	72.6	Confident	83 Å²	83	70.8 Å²	70.8	58%	0.58	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-77	-27.2	-168.2	62.7	0	0	0	0	115.2	D109 D110	D109-S112 PolarHBondContact O-OG 2.98Å; D110-S112 VanDerWaalsContact C-N 3.25Å; D110-S112 PolarHBondContact O-N 2.68Å
113	N	64.7	Low	74.1	Confident	104 Å²	104	67 Å²	67	56%	0.556	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.5	-12.3	-177.2	-86	-38.9	0	0	0	114.7	C115 S180 N229	N113-C115 PolarHBondContact O-N 3.28Å; N113-C115 PolarHBondContact O-SG 2.67Å; N113-S180 WeakPolarHBondContact O-CB 3.24Å; N113-S180 PolarHBondContact O-OG 3.27Å; N113-N229 PolarHBondContact OD1-ND2 3.13Å
114	C	74.6	Confident	75.8	Confident	61 Å²	61	63.3 Å²	63.3	41%	0.412	37%	0.366	S	S	.	.			trans	-72.6	113.3	-176.2	-167.1	0	0	0	0	110.7	D110 R116 D178	D110-C114 WeakPolarHBondContact O-CB 3.39Å; C114-R116 WeakPolarHBondContact SG-CD 3.46Å; C114-R116 WeakPolarHBondContact SG-CG 3.42Å; C114-D178 PolarHBondContact SG-OD2 3.14Å
115	C	88	Confident	77.6	Confident	14 Å²	14	57.8 Å²	57.8	10%	0.095	33%	0.33	C	S	.	.			trans	-113.5	64	-170.6	-66.1	0	0	0	0	110.5	N113 Y117 D178 P179 N229 F231	N113-C115 PolarHBondContact O-N 3.28Å; N113-C115 PolarHBondContact O-SG 2.67Å; C115-Y117 HydrophobicContact CB-CE2 4.06Å; C115-Y117 WeakPolarHBondContact O-CD2 3.13Å; C115-Y117 WeakPolarHBondContact O-CE2 3.37Å; C115-D178 VanDerWaalsContact C-OD1 3.25Å; C115-D178 WeakPolarHBondContact CA-OD1 3.45Å; C115-D178 PolarHBondContact N-OD1 2.87Å; C115-D178 PolarHBondContact N-OD2 3.07Å; C115-D178 VanDerWaalsContact N-OD2 3.1Å; C115-D178 VanDerWaalsContact O-OD1 3.14Å; C115-P179 WeakPolarHBondContact O-CD 3.17Å; C115-N229 PolarHBondContact SG-O 3.17Å; C115-F231 HydrophobicContact CB-CD2 4Å; C115-F231 HydrophobicContact CB-CE2 3.98Å
116	R	93.1	Very high	79.2	Confident	118 Å²	118	55.4 Å²	55.4	45%	0.445	32%	0.317	S	S	.	.			trans	-77.5	134.5	-172.2	-64.3	178.6	74.4	160.9	0.1	112.7	A100 C114 V176 D178	A100-R116 HydrophobicContact CB-CB 3.86Å; A100-R116 PolarHBondContact N-O 2.73Å; C114-R116 WeakPolarHBondContact SG-CD 3.46Å; C114-R116 WeakPolarHBondContact SG-CG 3.42Å; R116-V176 HydrophobicContact CB-CG1 3.68Å; R116-V176 HydrophobicContact CG-CG1 4.12Å; R116-D178 HydrophobicContact CG-CB 4.12Å
117	Y	95.7	Very high	81	Confident	12 Å²	12	53.7 Å²	53.7	5%	0.047	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	145.9	179.9	-63.2	-78.5	0	0	0	112.8	F97 V98 K99 C115 V176 F177 P179 G230 F231	F97-Y117 HydrophobicContact CB-CD1 3.53Å; F97-Y117 HydrophobicContact CB-CE1 4.08Å; F97-Y117 HydrophobicContact CB-CG 3.76Å; F97-Y117 HydrophobicContact CD1-CG 4.18Å; F97-Y117 HydrophobicContact CD2-CD2 4.14Å; F97-Y117 HydrophobicContact CD2-CE2 4.5Å; F97-Y117 HydrophobicContact CD2-CG 4.17Å; F97-Y117 HydrophobicContact CG-CD1 4.1Å; F97-Y117 HydrophobicContact CG-CD2 4.23Å; F97-Y117 AromaticContact CG-CG 3.8Å; F97-Y117 HydrophobicContact CG-CG 3.8Å; V98-Y117 CarbonylContact O-C 3.54Å; V98-Y117 VanDerWaalsContact O-CA 3.29Å; V98-Y117 WeakPolarHBondContact O-CA 3.39Å; K99-Y117 HydrophobicContact CB-CE1 4.46Å; K99-Y117 HydrophobicContact CG-CD1 4.03Å; K99-Y117 HydrophobicContact CG-CE1 3.54Å; C115-Y117 HydrophobicContact CB-CE2 4.06Å; C115-Y117 WeakPolarHBondContact O-CD2 3.13Å; C115-Y117 WeakPolarHBondContact O-CE2 3.37Å; Y117-V176 WeakPolarHBondContact O-CA 3.43Å; Y117-F177 PolarHBondContact N-O 2.81Å; Y117-F177 PolarHBondContact O-N 2.78Å; Y117-P179 HydrophobicContact CD2-CG 3.89Å; Y117-P179 HydrophobicContact CE2-CG 3.97Å; Y117-G230 WeakPolarHBondContact OH-CA 3.4Å; Y117-F231 HydrophobicContact CE2-CB 3.99Å; Y117-F231 HydrophobicContact CE2-CD2 4.2Å; Y117-F231 PolarHBondContact OH-N 3.3Å
118	H	96.1	Very high	83	Confident	14 Å²	14	52 Å²	52	7%	0.065	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	156.6	155.2	-49.5	-67.4	0	0	0	109.2	F97 V98 A100 D172 F173 H175	F97-H118 WeakPolarHBondContact CA-O 3.43Å; V98-H118 PolarHBondContact N-O 3.4Å; V98-H118 PolarHBondContact O-N 2.9Å; A100-H118 WeakPolarHBondContact CA-NE2 3.27Å; A100-H118 VanDerWaalsContact CB-NE2 3.3Å; A100-H118 WeakPolarHBondContact CB-NE2 3.33Å; H118-D172 PolarHBondContact ND1-O 3.28Å; H118-F173 AromaticContact CD2-CD1 3.85Å; H118-F173 PolarHBondContact CE1-O 2.65Å; H118-F173 AromaticContact NE2-CD1 3.72Å; H118-H175 PolarHBondContact ND1-O 3.3Å
119	I	97.6	Very high	85	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	128.1	168.8	-66.5	-177.1	0	0	0	108	L95 F97 F121 I133 Y135 F170 I198 I200 L233	L95-I119 HydrophobicContact CD1-CG2 3.74Å; F97-I119 HydrophobicContact CD1-CG1 3.94Å; F97-I119 HydrophobicContact CE1-CD1 4.19Å; F97-I119 HydrophobicContact CE1-CG1 3.81Å; I119-F121 HydrophobicContact CG2-CD1 3.75Å; I119-F121 HydrophobicContact CG2-CE1 3.99Å; I119-I133 HydrophobicContact CB-CD1 4.49Å; I119-I133 HydrophobicContact CD1-CD1 4.43Å; I119-I133 HydrophobicContact CD1-CG2 4.16Å; I119-Y135 HydrophobicContact CD1-CE1 4.05Å; I119-Y135 WeakPolarHBondContact CD1-OH 3.46Å; I119-F170 WeakPolarHBondContact O-CE1 3.26Å; I119-I198 HydrophobicContact CD1-CG2 4.26Å; I119-I200 HydrophobicContact CG2-CD1 4.33Å; I119-L233 HydrophobicContact CD1-CD2 4.15Å; I119-L233 HydrophobicContact CG1-CD2 4.01Å; I119-L233 HydrophobicContact CG2-CD2 3.96Å
120	E	98	Very high	87.3	Confident	50 Å²	50	40.1 Å²	40.1	23%	0.234	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	136.9	173.2	-173.6	178.8	118.7	0	0	110	K96 V98 V169 F170 C171	K96-E120 WeakPolarHBondContact CE-OE1 3.43Å; K96-E120 HydrophobicContact CG-CB 4.2Å; K96-E120 PolarHBondContact N-O 3.38Å; K96-E120 IonicContact NZ-OE1 3.62Å; K96-E120 PolarHBondContact NZ-OE1 3.24Å; K96-E120 PolarHBondContact O-N 3.09Å; V98-E120 HydrophobicContact CG2-CB 3.73Å; E120-V169 HydrophobicContact CG-CG1 4.29Å; E120-F170 VanDerWaalsContact CA-O 3.32Å; E120-F170 WeakPolarHBondContact CA-O 3.46Å; E120-C171 HydrophobicContact CB-CB 4.48Å; E120-C171 HydrophobicContact CG-CB 4.21Å
121	F	98.2	Very high	89.5	Confident	1 Å²	1	34.7 Å²	34.7	0%	0.004	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	167.2	170.7	56.2	-95.9	0	0	0	111.5	V90 L95 I119 L123 M131 F170 I200	V90-F121 HydrophobicContact CB-CD2 4.39Å; V90-F121 HydrophobicContact CG1-CB 4Å; V90-F121 HydrophobicContact CG1-CD2 3.55Å; V90-F121 HydrophobicContact CG1-CE2 4.12Å; V90-F121 HydrophobicContact CG1-CG 3.84Å; V90-F121 HydrophobicContact CG2-CD2 4.06Å; V90-F121 HydrophobicContact CG2-CE2 3.8Å; L95-F121 HydrophobicContact CB-CB 4.4Å; L95-F121 HydrophobicContact CD1-CB 3.9Å; L95-F121 HydrophobicContact CD1-CD1 3.71Å; L95-F121 HydrophobicContact CD1-CG 4.2Å; I119-F121 HydrophobicContact CG2-CD1 3.75Å; I119-F121 HydrophobicContact CG2-CE1 3.99Å; F121-L123 HydrophobicContact CD2-CB 4.4Å; F121-L123 HydrophobicContact CD2-CD2 4.32Å; F121-L123 HydrophobicContact CE2-CB 4.33Å; F121-L123 HydrophobicContact CE2-CD2 4Å; F121-M131 HydrophobicContact CZ-CE 3.78Å; F121-M131 HydrophobicContact CZ-CG 4.37Å; F121-M131 HydrophobicContact CZ-SD 4.13Å; F121-F170 HydrophobicContact CD1-CB 4.44Å; F121-F170 AromaticContact CD1-CD1 3.87Å; F121-F170 HydrophobicContact CD1-CD1 3.87Å; F121-F170 HydrophobicContact CD2-CB 4.05Å; F121-F170 HydrophobicContact CE1-CB 4.16Å; F121-F170 AromaticContact CE1-CD1 3.32Å; F121-F170 HydrophobicContact CE1-CD1 3.32Å; F121-F170 HydrophobicContact CE1-CE1 4.01Å; F121-F170 AromaticContact CE1-CG 3.97Å; F121-F170 HydrophobicContact CE1-CG 3.97Å; F121-F170 HydrophobicContact CE2-CB 3.75Å; F121-F170 HydrophobicContact CE2-CD1 4.42Å; F121-F170 HydrophobicContact CE2-CG 4.28Å; F121-F170 HydrophobicContact CG-CB 4.4Å; F121-F170 HydrophobicContact CZ-CB 3.82Å; F121-F170 AromaticContact CZ-CD1 3.66Å; F121-F170 HydrophobicContact CZ-CD1 3.66Å; F121-F170 HydrophobicContact CZ-CE1 4.48Å; F121-F170 AromaticContact CZ-CG 3.82Å; F121-F170 HydrophobicContact CZ-CG 3.82Å; F121-F170 PolarHBondContact N-O 3.44Å; F121-F170 PolarHBondContact O-N 2.99Å; F121-I200 HydrophobicContact CD1-CD1 3.74Å; F121-I200 HydrophobicContact CE1-CD1 3.55Å; F121-I200 HydrophobicContact CE1-CG1 4.08Å; F121-I200 HydrophobicContact CE1-CG2 4Å; F121-I200 HydrophobicContact CE2-CG2 4.32Å; F121-I200 HydrophobicContact CZ-CD1 4.27Å; F121-I200 HydrophobicContact CZ-CG2 3.63Å
122	V	98	Very high	91.6	Very high	30 Å²	30	32.5 Å²	32.5	18%	0.182	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	139.1	169	-179.5	0	0	0	0	109	R91 S94 Q168 V169	R91-V122 HydrophobicContact CB-CB 4.35Å; R91-V122 HydrophobicContact CG-CB 4.42Å; R91-V122 HydrophobicContact CG-CG1 4.33Å; R91-V122 PolarHBondContact N-O 2.86Å; S94-V122 PolarHBondContact OG-N 2.93Å; V122-Q168 CarbonylContact C-O 3.5Å; V122-Q168 VanDerWaalsContact CA-O 3.26Å; V122-Q168 WeakPolarHBondContact CA-O 3.33Å; V122-V169 HydrophobicContact CG2-CG2 4.36Å
123	L	96.9	Very high	93.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	151	169.7	73.3	162.5	0	0	0	111.6	I89 V90 F121 C125 F162 Q168 F170	I89-L123 CarbonylContact O-C 3.56Å; I89-L123 VanDerWaalsContact O-CA 3.22Å; I89-L123 WeakPolarHBondContact O-CA 3.17Å; I89-L123 WeakPolarHBondContact O-CB 3.22Å; V90-L123 HydrophobicContact CG2-CB 4.2Å; F121-L123 HydrophobicContact CD2-CB 4.4Å; F121-L123 HydrophobicContact CD2-CD2 4.32Å; F121-L123 HydrophobicContact CE2-CB 4.33Å; F121-L123 HydrophobicContact CE2-CD2 4Å; L123-C125 VanDerWaalsContact CD1-SG 3.58Å; L123-F162 HydrophobicContact CD1-CD1 4.24Å; L123-F162 HydrophobicContact CD1-CD2 3.92Å; L123-F162 HydrophobicContact CD1-CE1 4.36Å; L123-F162 HydrophobicContact CD1-CE2 4.05Å; L123-F162 HydrophobicContact CD1-CG 4.01Å; L123-F162 HydrophobicContact CD1-CZ 4.26Å; L123-F162 HydrophobicContact CD2-CD1 4.08Å; L123-F162 HydrophobicContact CD2-CE1 3.62Å; L123-F162 HydrophobicContact CD2-CE2 4.39Å; L123-F162 HydrophobicContact CD2-CZ 3.78Å; L123-Q168 HydrophobicContact CD2-CB 3.97Å; L123-Q168 WeakPolarHBondContact CD2-O 3.44Å; L123-Q168 HydrophobicContact CG-CB 4.29Å; L123-Q168 PolarHBondContact N-O 3.48Å; L123-Q168 WeakPolarHBondContact O-CB 3.36Å; L123-Q168 PolarHBondContact O-N 3.24Å; L123-F170 HydrophobicContact CD2-CB 4.3Å
124	D	95.5	Very high	95.2	Very high	28 Å²	28	24.6 Å²	24.6	15%	0.15	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	134.7	171.9	-55.6	-68.5	0	0	0	108.3	V88 I89 R91 A166 N167	V88-D124 CarbonylContact C-O 3.59Å; V88-D124 WeakPolarHBondContact CA-O 3.43Å; I89-D124 HydrophobicContact CG2-CB 3.93Å; I89-D124 PolarHBondContact N-O 3.08Å; I89-D124 PolarHBondContact O-N 3.47Å; R91-D124 IonicContact CZ-OD1 2.71Å; R91-D124 IonicContact CZ-OD2 2.7Å; R91-D124 IonicContact NE-OD1 3.37Å; R91-D124 IonicContact NE-OD2 2.73Å; R91-D124 PolarHBondContact NE-OD2 3.44Å; R91-D124 VanDerWaalsContact NH2-CG 3.3Å; R91-D124 IonicContact NH2-OD1 3.62Å; R91-D124 PolarHBondContact NH2-OD1 3.44Å; R91-D124 IonicContact NH2-OD2 2.74Å; R91-D124 PolarHBondContact NH2-OD2 2.72Å; R91-D124 VanDerWaalsContact NH2-OD2 3.09Å; D124-A166 VanDerWaalsContact OD1-CA 3.23Å; D124-A166 WeakPolarHBondContact OD1-CA 3.27Å; D124-A166 WeakPolarHBondContact OD1-CB 3.44Å; D124-N167 PolarHBondContact OD1-N 2.95Å
125	C	95.4	Very high	96.4	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.007	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	114.8	-176.2	-57.4	0	0	0	0	109.5	L123 T164 G165	L123-C125 VanDerWaalsContact CD1-SG 3.58Å; C125-T164 CarbonylContact O-C 3.57Å; C125-T164 VanDerWaalsContact O-CA 3.29Å; C125-T164 WeakPolarHBondContact O-CA 3.48Å; C125-T164 WeakPolarHBondContact O-CG2 3.17Å; C125-G165 PolarHBondContact N-O 2.94Å; C125-G165 PolarHBondContact O-N 2.85Å
126	D	93.2	Very high	96.8	Very high	93 Å²	93	22.5 Å²	22.5	50%	0.497	11%	0.11	S	C	.	.	S	Bend	trans	-84.5	-26.2	171.6	-62.1	-37.1	0	0	0	111.2	H85 M87 T164	H85-D126 IonicContact CE1-OD2 2.78Å; M87-D126 PolarHBondContact O-N 2.83Å; M87-D126 HydrophobicContact SD-CB 4.23Å; D126-T164 WeakPolarHBondContact O-CG2 3.49Å; D126-T164 PolarHBondContact O-OG1 2.94Å
127	A	94.4	Very high	97	Very high	17 Å²	17	16.9 Å²	16.9	14%	0.14	9%	0.089	C	C	.	.	S	Bend	trans	-119	152	171.2	0	0	0	0	0	111.5	M87 C129 T204	M87-A127 HydrophobicContact CB-CB 4.13Å; M87-A127 PolarHBondContact O-N 3.3Å; M87-A127 HydrophobicContact SD-CB 4.46Å; A127-C129 PolarHBondContact O-N 2.81Å; A127-T204 HydrophobicContact CB-CG2 3.97Å
128	P	96.7	Very high	97	Very high	21 Å²	21	18.4 Å²	18.4	14%	0.136	10%	0.1	C	C	.	.			trans	-59.9	134.5	173.9	-19.2	31.7	0	0	0	110.8	F162 T164 R205	P128-F162 CarbonylContact C-O 3.58Å; P128-F162 WeakPolarHBondContact CA-O 3.29Å; P128-T164 WeakPolarHBondContact CD-OG1 3.2Å; P128-R205 VanDerWaalsContact CB-NH2 3.34Å; P128-R205 PolarHBondContact O-N 3Å
129	C	97.5	Very high	96.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	160.7	-171.7	82.6	0	0	0	0	112.9	V88 A127 Q161 F162 F203	V88-C129 HydrophobicContact CG2-CB 4.36Å; A127-C129 PolarHBondContact O-N 2.81Å; C129-Q161 PolarHBondContact O-OE1 2.91Å; C129-F162 PolarHBondContact N-O 2.82Å; C129-F162 PolarHBondContact O-N 2.9Å; C129-F203 CarbonylContact C-O 3.55Å; C129-F203 VanDerWaalsContact CA-O 3.23Å; C129-F203 WeakPolarHBondContact CA-O 3.23Å; C129-F203 VanDerWaalsContact CB-O 3.27Å; C129-F203 WeakPolarHBondContact CB-O 3.41Å
130	T	98	Very high	96.6	Very high	10 Å²	10	23.7 Å²	23.7	6%	0.061	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	139.4	163.9	-58.3	0	0	0	0	108.8	I132 P159 Y160 Q161 C202 F203	T130-I132 HydrophobicContact CG2-CG1 4.29Å; T130-P159 HydrophobicContact CG2-CB 3.83Å; T130-Y160 CarbonylContact C-O 3.58Å; T130-Y160 VanDerWaalsContact CA-O 3.3Å; T130-Y160 WeakPolarHBondContact CA-O 3.48Å; T130-Q161 PolarHBondContact OG1-NE2 3.37Å; T130-Q161 PolarHBondContact OG1-OE1 2.78Å; T130-C202 CarbonylContact O-C 3.52Å; T130-C202 WeakPolarHBondContact O-CA 3.21Å; T130-F203 VanDerWaalsContact CB-CZ 3.49Å; T130-F203 HydrophobicContact CG2-CE1 3.9Å; T130-F203 HydrophobicContact CG2-CE2 4.24Å; T130-F203 HydrophobicContact CG2-CZ 3.58Å; T130-F203 PolarHBondContact N-O 2.86Å; T130-F203 PolarHBondContact O-N 3.11Å
131	M	98.1	Very high	96.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	136.3	174.5	-176.1	-81.8	-70.5	0	0	110.4	F121 I133 Y160 F162 F170 I200 H201 C202	F121-M131 HydrophobicContact CZ-CE 3.78Å; F121-M131 HydrophobicContact CZ-CG 4.37Å; F121-M131 HydrophobicContact CZ-SD 4.13Å; M131-I133 HydrophobicContact CE-CD1 4.48Å; M131-I133 HydrophobicContact CE-CG1 4.38Å; M131-I133 HydrophobicContact SD-CD1 4.3Å; M131-I133 HydrophobicContact SD-CG1 3.61Å; M131-Y160 HydrophobicContact CE-CD2 3.35Å; M131-Y160 HydrophobicContact CE-CE2 4.05Å; M131-Y160 HydrophobicContact CE-CG 3.82Å; M131-Y160 PolarHBondContact N-O 3.49Å; M131-Y160 PolarHBondContact O-N 3.14Å; M131-Y160 HydrophobicContact SD-CD2 3.97Å; M131-F162 HydrophobicContact CB-CD2 4.18Å; M131-F162 HydrophobicContact CB-CE2 3.89Å; M131-F162 HydrophobicContact CE-CE2 4.04Å; M131-F162 HydrophobicContact CE-CZ 4.41Å; M131-F170 HydrophobicContact CE-CD1 4.11Å; M131-F170 HydrophobicContact CE-CD2 3.48Å; M131-F170 VanDerWaalsContact CE-CD2 3.48Å; M131-F170 HydrophobicContact CE-CE1 4.11Å; M131-F170 HydrophobicContact CE-CE2 3.46Å; M131-F170 VanDerWaalsContact CE-CE2 3.46Å; M131-F170 HydrophobicContact CE-CG 3.79Å; M131-F170 HydrophobicContact CE-CZ 3.79Å; M131-I200 HydrophobicContact CG-CG2 3.93Å; M131-I200 HydrophobicContact SD-CG2 4.01Å; M131-H201 CarbonylContact C-O 3.53Å; M131-H201 VanDerWaalsContact CA-O 3.28Å; M131-H201 WeakPolarHBondContact CA-O 3.49Å; M131-C202 VanDerWaalsContact CG-SG 3.51Å
132	I	98.4	Very high	95.8	Very high	23 Å²	23	25.9 Å²	25.9	12%	0.118	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	136.9	176.5	-53.7	175.4	0	0	0	108.8	T130 Y134 T156 P159 H201 F203	T130-I132 HydrophobicContact CG2-CG1 4.29Å; I132-Y134 HydrophobicContact CB-CD2 4.41Å; I132-Y134 HydrophobicContact CB-CE2 3.68Å; I132-Y134 HydrophobicContact CG2-CD1 4.46Å; I132-Y134 HydrophobicContact CG2-CD2 4.02Å; I132-Y134 HydrophobicContact CG2-CE1 4.02Å; I132-Y134 HydrophobicContact CG2-CE2 3.51Å; I132-Y134 HydrophobicContact CG2-CG 4.47Å; I132-T156 HydrophobicContact CG2-CG2 3.51Å; I132-P159 HydrophobicContact CD1-CB 4.38Å; I132-P159 HydrophobicContact CG1-CB 4.11Å; I132-H201 PolarHBondContact N-O 3.05Å; I132-H201 PolarHBondContact O-N 2.89Å; I132-F203 HydrophobicContact CD1-CE1 4.06Å; I132-F203 HydrophobicContact CD1-CZ 4.48Å; I132-F203 HydrophobicContact CG1-CE1 4.44Å
133	I	98.5	Very high	95.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	127.4	173.1	-49.9	-178.3	0	0	0	108.7	I119 M131 Y135 T156 S157 F170 V199 I200	I119-I133 HydrophobicContact CB-CD1 4.49Å; I119-I133 HydrophobicContact CD1-CD1 4.43Å; I119-I133 HydrophobicContact CD1-CG2 4.16Å; M131-I133 HydrophobicContact CE-CD1 4.48Å; M131-I133 HydrophobicContact CE-CG1 4.38Å; M131-I133 HydrophobicContact SD-CD1 4.3Å; M131-I133 HydrophobicContact SD-CG1 3.61Å; I133-Y135 HydrophobicContact CG2-CE1 4.32Å; I133-Y135 HydrophobicContact CG2-CE2 3.97Å; I133-T156 WeakPolarHBondContact O-CA 3.37Å; I133-S157 PolarHBondContact N-OG 2.86Å; I133-S157 PolarHBondContact O-N 3.13Å; I133-F170 HydrophobicContact CD1-CE1 3.66Å; I133-F170 HydrophobicContact CD1-CZ 3.95Å; I133-V199 WeakPolarHBondContact CA-O 3.47Å; I133-I200 HydrophobicContact CG1-CG1 4.32Å
134	Y	98.4	Very high	94.7	Very high	22 Å²	22	33.1 Å²	33.1	9%	0.086	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	137.9	176.2	-56.1	-97.2	0	0	0	110.4	I132 Y148 T156 I198 V199 H201	I132-Y134 HydrophobicContact CB-CD2 4.41Å; I132-Y134 HydrophobicContact CB-CE2 3.68Å; I132-Y134 HydrophobicContact CG2-CD1 4.46Å; I132-Y134 HydrophobicContact CG2-CD2 4.02Å; I132-Y134 HydrophobicContact CG2-CE1 4.02Å; I132-Y134 HydrophobicContact CG2-CE2 3.51Å; I132-Y134 HydrophobicContact CG2-CG 4.47Å; Y134-Y148 HydrophobicContact CD2-CD2 4.47Å; Y134-Y148 HydrophobicContact CD2-CG 4.33Å; Y134-Y148 WeakPolarHBondContact CE1-O 3.4Å; Y134-Y148 HydrophobicContact CE2-CD2 4.25Å; Y134-Y148 HydrophobicContact CE2-CG 4.36Å; Y134-T156 HydrophobicContact CD1-CG2 3.57Å; Y134-T156 HydrophobicContact CE1-CG2 3.58Å; Y134-T156 HydrophobicContact CG-CG2 4.35Å; Y134-I198 WeakPolarHBondContact O-CA 3.38Å; Y134-V199 PolarHBondContact N-O 2.8Å; Y134-V199 PolarHBondContact O-N 3.24Å; Y134-H201 HydrophobicContact CD2-CB 4.29Å; Y134-H201 HydrophobicContact CE2-CB 3.88Å
135	Y	98.1	Very high	94.6	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.016	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	136.7	169.4	-48.4	-93.6	0	0	0	110.7	I119 I133 A137 T150 L155 H175 F177 P197 I198	I119-Y135 HydrophobicContact CD1-CE1 4.05Å; I119-Y135 WeakPolarHBondContact CD1-OH 3.46Å; I133-Y135 HydrophobicContact CG2-CE1 4.32Å; I133-Y135 HydrophobicContact CG2-CE2 3.97Å; Y135-A137 PolarHBondContact O-N 2.91Å; Y135-T150 WeakPolarHBondContact O-CB 2.94Å; Y135-T150 PolarHBondContact O-OG1 3.01Å; Y135-L155 HydrophobicContact CD2-CB 4.5Å; Y135-L155 WeakPolarHBondContact CD2-O 3.31Å; Y135-L155 PolarHBondContact N-O 3.15Å; Y135-H175 AromaticContact CE2-CE1 3.74Å; Y135-H175 AromaticContact CE2-NE2 3.39Å; Y135-H175 WeakPolarHBondContact CE2-NE2 3.41Å; Y135-H175 AromaticContact CZ-NE2 3.54Å; Y135-H175 PolarHBondContact OH-CD2 3.47Å; Y135-H175 PolarHBondContact OH-NE2 3.45Å; Y135-F177 HydrophobicContact CD1-CD1 4.02Å; Y135-F177 AromaticContact CD1-CD2 3.41Å; Y135-F177 HydrophobicContact CD1-CD2 3.41Å; Y135-F177 VanDerWaalsContact CD1-CD2 3.41Å; Y135-F177 AromaticContact CD1-CE1 3.98Å; Y135-F177 HydrophobicContact CD1-CE1 3.98Å; Y135-F177 AromaticContact CD1-CE2 3.36Å; Y135-F177 HydrophobicContact CD1-CE2 3.36Å; Y135-F177 AromaticContact CD1-CG 3.76Å; Y135-F177 HydrophobicContact CD1-CG 3.76Å; Y135-F177 AromaticContact CD1-CZ 3.67Å; Y135-F177 HydrophobicContact CD1-CZ 3.67Å; Y135-F177 HydrophobicContact CD2-CD2 4.2Å; Y135-F177 HydrophobicContact CD2-CE2 4.5Å; Y135-F177 HydrophobicContact CE1-CB 3.75Å; Y135-F177 AromaticContact CE1-CD1 3.68Å; Y135-F177 HydrophobicContact CE1-CD1 3.68Å; Y135-F177 AromaticContact CE1-CD2 3.45Å; Y135-F177 HydrophobicContact CE1-CD2 3.45Å; Y135-F177 VanDerWaalsContact CE1-CD2 3.45Å; Y135-F177 HydrophobicContact CE1-CE1 4.09Å; Y135-F177 AromaticContact CE1-CE2 3.89Å; Y135-F177 HydrophobicContact CE1-CE2 3.89Å; Y135-F177 AromaticContact CE1-CG 3.34Å; Y135-F177 HydrophobicContact CE1-CG 3.34Å; Y135-F177 HydrophobicContact CE1-CZ 4.2Å; Y135-F177 HydrophobicContact CE2-CD2 4.25Å; Y135-F177 AromaticContact CG-CD2 3.83Å; Y135-F177 HydrophobicContact CG-CD2 3.83Å; Y135-F177 AromaticContact CG-CE2 3.74Å; Y135-F177 HydrophobicContact CG-CE2 3.74Å; Y135-F177 HydrophobicContact CG-CZ 4.39Å; Y135-F177 AromaticContact CZ-CD2 3.9Å; Y135-F177 AromaticContact CZ-CG 3.84Å; Y135-P197 CarbonylContact C-O 3.26Å; Y135-P197 VanDerWaalsContact CA-O 3.29Å; Y135-P197 WeakPolarHBondContact CA-O 3.16Å; Y135-I198 HydrophobicContact CD1-CD1 4.43Å; Y135-I198 HydrophobicContact CD1-CG1 3.97Å; Y135-I198 HydrophobicContact CD1-CG2 4.31Å; Y135-I198 HydrophobicContact CE1-CD1 4.45Å; Y135-I198 HydrophobicContact CE1-CG1 4.37Å; Y135-I198 HydrophobicContact CE1-CG2 4.17Å
136	F	97.4	Very high	94.5	Very high	26 Å²	26	32.1 Å²	32.1	11%	0.114	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	53.8	49.3	-178.5	-46.6	-85.7	0	0	0	112.6	L155 F177 F182 E186 L187 I195 I196 P197	F136-L155 HydrophobicContact CD2-CD1 3.54Å; F136-L155 HydrophobicContact CE2-CD1 4.2Å; F136-L155 HydrophobicContact CG-CD1 4.46Å; F136-F177 HydrophobicContact CE2-CE2 4.08Å; F136-F177 HydrophobicContact CE2-CZ 4.14Å; F136-F177 HydrophobicContact CZ-CZ 4.26Å; F136-F182 HydrophobicContact CE1-CB 4.45Å; F136-F182 HydrophobicContact CE1-CG 4.39Å; F136-F182 HydrophobicContact CE2-CD1 4.09Å; F136-F182 AromaticContact CE2-CD2 3.76Å; F136-F182 HydrophobicContact CE2-CD2 3.76Å; F136-F182 HydrophobicContact CE2-CE1 4.23Å; F136-F182 AromaticContact CE2-CE2 3.86Å; F136-F182 HydrophobicContact CE2-CE2 3.86Å; F136-F182 AromaticContact CE2-CG 3.89Å; F136-F182 HydrophobicContact CE2-CG 3.89Å; F136-F182 HydrophobicContact CE2-CZ 4.1Å; F136-F182 HydrophobicContact CZ-CB 3.84Å; F136-F182 AromaticContact CZ-CD1 3.93Å; F136-F182 HydrophobicContact CZ-CD1 3.93Å; F136-F182 AromaticContact CZ-CD2 3.54Å; F136-F182 HydrophobicContact CZ-CD2 3.54Å; F136-F182 HydrophobicContact CZ-CE2 4.13Å; F136-F182 AromaticContact CZ-CG 3.42Å; F136-F182 HydrophobicContact CZ-CG 3.42Å; F136-F182 VanDerWaalsContact CZ-CG 3.42Å; F136-E186 HydrophobicContact CD1-CB 4.32Å; F136-E186 HydrophobicContact CE1-CB 3.8Å; F136-E186 VanDerWaalsContact CE1-O 3.31Å; F136-E186 WeakPolarHBondContact CE1-O 3.32Å; F136-L187 HydrophobicContact CE1-CD2 4.2Å; F136-L187 HydrophobicContact CZ-CD2 3.82Å; F136-I195 HydrophobicContact CB-CG2 3.97Å; F136-I196 CarbonylContact C-O 3.48Å; F136-I196 VanDerWaalsContact CA-O 3.25Å; F136-I196 WeakPolarHBondContact CA-O 3.14Å; F136-I196 PolarHBondContact N-O 2.66Å; F136-P197 PolarHBondContact N-O 3.12Å
137	A	96.9	Very high	94.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	143.3	-174.6	0	0	0	0	0	112.8	Y135 Y148 S149 I196 V199	Y135-A137 PolarHBondContact O-N 2.91Å; A137-Y148 HydrophobicContact CB-CD1 4.31Å; A137-S149 CarbonylContact C-O 3.59Å; A137-S149 WeakPolarHBondContact CA-O 3.5Å; A137-I196 PolarHBondContact N-O 2.99Å; A137-I196 PolarHBondContact O-N 2.64Å; A137-V199 HydrophobicContact CB-CG2 4.25Å
138	T	95	Very high	94.7	Very high	45 Å²	45	32 Å²	32	28%	0.276	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	143.8	158.2	53.4	0	0	0	0	109.3	Y148 S149 I195	T138-Y148 WeakPolarHBondContact O-CA 3.22Å; T138-S149 PolarHBondContact N-O 3.29Å; T138-S149 PolarHBondContact O-N 3.15Å; T138-S149 PolarHBondContact OG1-O 3.11Å; T138-S149 PolarHBondContact OG1-OG 2.98Å; T138-I195 HydrophobicContact CG2-CG1 4.41Å
139	E	94.7	Very high	94.7	Very high	52 Å²	52	33.5 Å²	33.5	24%	0.243	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	141.2	178.4	-175	-179.7	82.7	0	0	110.9	I141 Y148 I196 K239	E139-I141 HydrophobicContact CG-CG1 4.25Å; E139-Y148 HydrophobicContact CB-CD1 4.01Å; E139-Y148 HydrophobicContact CB-CE1 3.71Å; E139-Y148 HydrophobicContact CG-CD1 4.16Å; E139-Y148 HydrophobicContact CG-CE1 3.57Å; E139-Y148 VanDerWaalsContact OE2-CE1 3.29Å; E139-Y148 WeakPolarHBondContact OE2-CE1 3.27Å; E139-Y148 VanDerWaalsContact OE2-CZ 3.3Å; E139-Y148 PolarHBondContact OE2-OH 2.95Å; E139-I196 HydrophobicContact CB-CD1 4.04Å; E139-K239 IonicContact OE1-NZ 2.72Å; E139-K239 PolarHBondContact OE1-NZ 2.69Å; E139-K239 IonicContact OE2-NZ 3.95Å; E139-K239 PolarHBondContact OE2-NZ 3.01Å
140	T	92.4	Very high	94.6	Very high	74 Å²	74	34.8 Å²	34.8	45%	0.454	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	128.7	164.8	-62.7	0	0	0	0	108.5	T142 L147	T140-T142 HydrophobicContact CG2-CG2 4.2Å; T140-L147 PolarHBondContact N-O 2.73Å; T140-L147 PolarHBondContact O-N 3.21Å
141	I	90.3	Very high	94.5	Very high	40 Å²	40	42.7 Å²	42.7	21%	0.205	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	118.8	176.4	-50.6	-178.8	0	0	0	107.8	C64 E139 F146 Y241	C64-I141 HydrophobicContact CB-CD1 3.89Å; E139-I141 HydrophobicContact CG-CG1 4.25Å; I141-F146 HydrophobicContact CD1-CD1 4.37Å; I141-F146 HydrophobicContact CD1-CE1 4.16Å; I141-F146 HydrophobicContact CG1-CD1 4.03Å; I141-F146 HydrophobicContact CG1-CE1 4.31Å; I141-F146 HydrophobicContact CG2-CD1 4.28Å; I141-F146 HydrophobicContact CG2-CE1 4.41Å; I141-Y241 HydrophobicContact CG2-CD2 4.17Å; I141-Y241 HydrophobicContact CG2-CE2 3.71Å
142	T	88.6	Confident	94.3	Very high	57 Å²	57	47.2 Å²	47.2	35%	0.35	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-174.8	176.2	68.1	0	0	0	0	110.4	T140 D144 G145 Y241	T140-T142 HydrophobicContact CG2-CG2 4.2Å; T142-D144 PolarHBondContact O-N 3.31Å; T142-D144 PolarHBondContact OG1-N 2.9Å; T142-G145 PolarHBondContact N-O 3.31Å; T142-G145 PolarHBondContact OG1-N 3.39Å; T142-Y241 PolarHBondContact O-OH 2.87Å
143	S	85.5	Confident	94	Very high	72 Å²	72	51.1 Å²	51.1	50%	0.503	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-24.9	164.1	45.3	0	0	0	0	112.7	M212 Y241 N244	S143-M212 WeakPolarHBondContact O-CE 3.42Å; S143-Y241 VanDerWaalsContact C-OH 3.26Å; S143-Y241 WeakPolarHBondContact CA-OH 3.26Å; S143-Y241 PolarHBondContact O-OH 2.92Å; S143-N244 PolarHBondContact O-OD1 3.33Å
144	D	86.7	Confident	93.8	Very high	111 Å²	111	57.2 Å²	57.2	59%	0.594	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	1.2	-168.7	-39.7	-32.3	0	0	0	111.3	T142 H215	T142-D144 PolarHBondContact O-N 3.31Å; T142-D144 PolarHBondContact OG1-N 2.9Å; D144-H215 PolarHBondContact O-NE2 3.3Å; D144-H215 VanDerWaalsContact O-NE2 3.11Å
145	G	92.2	Very high	93.7	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	125.4	-151.6	174.6	0	0	0	0	0	115.4	T142	T142-G145 PolarHBondContact N-O 3.31Å; T142-G145 PolarHBondContact OG1-N 3.39Å
146	F	94.3	Very high	93.6	Very high	7 Å²	7	58.7 Å²	58.7	3%	0.031	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	128.6	177.9	-54.8	-39.9	0	0	0	110.8	I141 Y148 H201 H215 S217 K239 F240 Y241 C246	I141-F146 HydrophobicContact CD1-CD1 4.37Å; I141-F146 HydrophobicContact CD1-CE1 4.16Å; I141-F146 HydrophobicContact CG1-CD1 4.03Å; I141-F146 HydrophobicContact CG1-CE1 4.31Å; I141-F146 HydrophobicContact CG2-CD1 4.28Å; I141-F146 HydrophobicContact CG2-CE1 4.41Å; F146-Y148 HydrophobicContact CB-CE2 3.8Å; F146-H201 PolarHBondContact O-CE1 3.03Å; F146-H201 PolarHBondContact O-NE2 3.12Å; F146-H215 HydrophobicContact CD2-CB 3.68Å; F146-H215 HydrophobicContact CE2-CB 4.22Å; F146-H215 HydrophobicContact CG-CB 4.36Å; F146-S217 WeakPolarHBondContact CD2-OG 3.22Å; F146-K239 HydrophobicContact CE2-CB 3.87Å; F146-K239 HydrophobicContact CZ-CB 3.89Å; F146-F240 WeakPolarHBondContact CZ-O 3.48Å; F146-Y241 HydrophobicContact CD1-CD2 4.14Å; F146-Y241 AromaticContact CE1-CD2 3.77Å; F146-Y241 HydrophobicContact CE1-CD2 3.77Å; F146-Y241 HydrophobicContact CE1-CG 4.35Å; F146-Y241 HydrophobicContact CZ-CD2 4.27Å; F146-C246 HydrophobicContact CE1-CB 4.2Å; F146-C246 HydrophobicContact CZ-CB 4.44Å
147	L	95.2	Very high	93.6	Very high	100 Å²	100	57.9 Å²	57.9	52%	0.524	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	123.8	168.2	-179.9	64.3	0	0	0	109.3	T140	T140-L147 PolarHBondContact N-O 2.73Å; T140-L147 PolarHBondContact O-N 3.21Å
148	Y	96.8	Very high	93.7	Very high	6 Å²	6	62.9 Å²	62.9	2%	0.024	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	142.1	172.9	-63.6	-75.6	0	0	0	110.8	Y134 A137 T138 E139 F146 I196 V199 H201 S217	Y134-Y148 HydrophobicContact CD2-CD2 4.47Å; Y134-Y148 HydrophobicContact CD2-CG 4.33Å; Y134-Y148 WeakPolarHBondContact CE1-O 3.4Å; Y134-Y148 HydrophobicContact CE2-CD2 4.25Å; Y134-Y148 HydrophobicContact CE2-CG 4.36Å; A137-Y148 HydrophobicContact CB-CD1 4.31Å; T138-Y148 WeakPolarHBondContact O-CA 3.22Å; E139-Y148 HydrophobicContact CB-CD1 4.01Å; E139-Y148 HydrophobicContact CB-CE1 3.71Å; E139-Y148 HydrophobicContact CG-CD1 4.16Å; E139-Y148 HydrophobicContact CG-CE1 3.57Å; E139-Y148 VanDerWaalsContact OE2-CE1 3.29Å; E139-Y148 WeakPolarHBondContact OE2-CE1 3.27Å; E139-Y148 VanDerWaalsContact OE2-CZ 3.3Å; E139-Y148 PolarHBondContact OE2-OH 2.95Å; F146-Y148 HydrophobicContact CB-CE2 3.8Å; Y148-I196 HydrophobicContact CE1-CD1 3.92Å; Y148-V199 HydrophobicContact CD1-CG1 4.18Å; Y148-V199 HydrophobicContact CD1-CG2 4.17Å; Y148-V199 HydrophobicContact CD2-CG1 4.01Å; Y148-V199 HydrophobicContact CE1-CG1 3.96Å; Y148-V199 HydrophobicContact CE1-CG2 4.11Å; Y148-V199 HydrophobicContact CE2-CG1 3.77Å; Y148-V199 HydrophobicContact CG-CG1 4.21Å; Y148-H201 HydrophobicContact CD2-CB 3.86Å; Y148-H201 AromaticContact CD2-CE1 3.98Å; Y148-H201 AromaticContact CD2-CG 3.64Å; Y148-H201 AromaticContact CD2-ND1 3.63Å; Y148-H201 HydrophobicContact CE2-CB 4.02Å; Y148-H201 AromaticContact CE2-CD2 3.72Å; Y148-H201 AromaticContact CE2-CG 3.75Å; Y148-S217 WeakPolarHBondContact CE2-OG 3.49Å; Y148-S217 VanDerWaalsContact OH-CB 3.27Å; Y148-S217 WeakPolarHBondContact OH-CB 3.48Å; Y148-S217 PolarHBondContact OH-OG 3.13Å
149	S	95.8	Very high	93.8	Very high	54 Å²	54	64.7 Å²	64.7	38%	0.378	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	142.8	176.2	59.6	0	0	0	0	110.6	A137 T138	A137-S149 CarbonylContact C-O 3.59Å; A137-S149 WeakPolarHBondContact CA-O 3.5Å; T138-S149 PolarHBondContact N-O 3.29Å; T138-S149 PolarHBondContact O-N 3.15Å; T138-S149 PolarHBondContact OG1-O 3.11Å; T138-S149 PolarHBondContact OG1-OG 2.98Å
150	T	96.3	Very high	93.9	Very high	26 Å²	26	63.4 Å²	63.4	16%	0.16	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	152.5	172.6	-177.1	0	0	0	0	110.1	Y135 R152 L155 T156	Y135-T150 WeakPolarHBondContact O-CB 2.94Å; Y135-T150 PolarHBondContact O-OG1 3.01Å; T150-R152 WeakPolarHBondContact CG2-O 3.08Å; T150-R152 PolarHBondContact O-N 2.78Å; T150-L155 HydrophobicContact CG2-CB 4.15Å; T150-T156 WeakPolarHBondContact CG2-OG1 3.38Å
151	K	94.1	Very high	94.2	Very high	177 Å²	177	64.8 Å²	64.8	77%	0.77	34%	0.341	S	S	*	.	S	Bend	trans	-70.6	-12.8	178.4	-63.9	-178.6	-177.8	175	0	113.2
152	R	94.2	Very high	94.5	Very high	94 Å²	94	64 Å²	64	36%	0.355	34%	0.336	S	S	.	.	S	Bend	trans	-133.9	100.5	-171.3	-76.4	-158.6	-59.7	123	-7.4	109.3	T150 E154 L155	T150-R152 WeakPolarHBondContact CG2-O 3.08Å; T150-R152 PolarHBondContact O-N 2.78Å; R152-E154 WeakPolarHBondContact CB-OE1 3.49Å; R152-E154 WeakPolarHBondContact CB-OE2 3.43Å; R152-E154 WeakPolarHBondContact CD-OE1 3.23Å; R152-E154 IonicContact CZ-OE1 2.71Å; R152-E154 IonicContact NE-OE1 2.69Å; R152-E154 IonicContact NH1-OE1 2.95Å; R152-E154 PolarHBondContact NH1-OE1 3.44Å; R152-E154 PolarHBondContact O-N 3.36Å; R152-L155 HydrophobicContact CB-CD1 3.99Å; R152-L155 HydrophobicContact CB-CG 4.07Å; R152-L155 VanDerWaalsContact O-CB 3.28Å; R152-L155 WeakPolarHBondContact O-CB 3.23Å; R152-L155 PolarHBondContact O-N 3.19Å
153	P	92.7	Very high	94.9	Very high	106 Å²	106	66.4 Å²	66.4	69%	0.688	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-55.9	-27.1	-171	-28.9	36.6	0	0	0	115	L155 T156	P153-L155 PolarHBondContact O-N 3.11Å; P153-T156 PolarHBondContact O-N 3.19Å; P153-T156 VanDerWaalsContact O-N 3.08Å
154	E	93.9	Very high	95.5	Very high	127 Å²	127	67.1 Å²	67.1	59%	0.593	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-66.3	-11.7	174.1	76.3	-78.6	-171.7	0	0	114.1	R152 T156	R152-E154 WeakPolarHBondContact CB-OE1 3.49Å; R152-E154 WeakPolarHBondContact CB-OE2 3.43Å; R152-E154 WeakPolarHBondContact CD-OE1 3.23Å; R152-E154 IonicContact CZ-OE1 2.71Å; R152-E154 IonicContact NE-OE1 2.69Å; R152-E154 IonicContact NH1-OE1 2.95Å; R152-E154 PolarHBondContact NH1-OE1 3.44Å; R152-E154 PolarHBondContact O-N 3.36Å; E154-T156 VanDerWaalsContact C-N 3.33Å
155	L	96.1	Very high	95.8	Very high	14 Å²	14	63 Å²	63	7%	0.073	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-93.3	20.8	170.7	-63.3	-176.3	0	0	0	113.3	Y135 F136 T150 R152 P153 F182	Y135-L155 HydrophobicContact CD2-CB 4.5Å; Y135-L155 WeakPolarHBondContact CD2-O 3.31Å; Y135-L155 PolarHBondContact N-O 3.15Å; F136-L155 HydrophobicContact CD2-CD1 3.54Å; F136-L155 HydrophobicContact CE2-CD1 4.2Å; F136-L155 HydrophobicContact CG-CD1 4.46Å; T150-L155 HydrophobicContact CG2-CB 4.15Å; R152-L155 HydrophobicContact CB-CD1 3.99Å; R152-L155 HydrophobicContact CB-CG 4.07Å; R152-L155 VanDerWaalsContact O-CB 3.28Å; R152-L155 WeakPolarHBondContact O-CB 3.23Å; R152-L155 PolarHBondContact O-N 3.19Å; P153-L155 PolarHBondContact O-N 3.11Å; L155-F182 HydrophobicContact CD2-CZ 4.31Å
156	T	97.6	Very high	95.9	Very high	43 Å²	43	65.1 Å²	65.1	26%	0.264	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-120.5	136.8	167.9	-44.8	0	0	0	0	109	I132 I133 Y134 T150 P153 E154	I132-T156 HydrophobicContact CG2-CG2 3.51Å; I133-T156 WeakPolarHBondContact O-CA 3.37Å; Y134-T156 HydrophobicContact CD1-CG2 3.57Å; Y134-T156 HydrophobicContact CE1-CG2 3.58Å; Y134-T156 HydrophobicContact CG-CG2 4.35Å; T150-T156 WeakPolarHBondContact CG2-OG1 3.38Å; P153-T156 PolarHBondContact O-N 3.19Å; P153-T156 VanDerWaalsContact O-N 3.08Å; E154-T156 VanDerWaalsContact C-N 3.33Å
157	S	97.6	Very high	95.9	Very high	10 Å²	10	68.9 Å²	68.9	7%	0.07	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-68.3	163.9	171.3	75.2	0	0	0	0	111.6	I133 Y160	I133-S157 PolarHBondContact N-OG 2.86Å; I133-S157 PolarHBondContact O-N 3.13Å; S157-Y160 WeakPolarHBondContact OG-CE2 3.38Å
158	K	97	Very high	96	Very high	105 Å²	105	66.4 Å²	66.4	46%	0.457	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-58.9	151.5	156.7	67.6	-164.1	177.3	-152.2	0	109.3	Y160 D172 D174	K158-Y160 HydrophobicContact CD-CE1 4.31Å; K158-Y160 HydrophobicContact CG-CE1 3.96Å; K158-Y160 HydrophobicContact CG-CE2 4.37Å; K158-Y160 VanDerWaalsContact O-CD2 3.3Å; K158-Y160 WeakPolarHBondContact O-CD2 3.17Å; K158-Y160 WeakPolarHBondContact O-CE2 3.49Å; K158-D172 WeakPolarHBondContact CE-OD2 3.13Å; K158-D172 IonicContact NZ-OD1 3.13Å; K158-D172 IonicContact NZ-OD2 3.79Å; K158-D172 PolarHBondContact NZ-OD2 3Å; K158-D174 IonicContact NZ-OD2 3Å
159	P	97.7	Very high	96	Very high	82 Å²	82	70.5 Å²	70.5	53%	0.532	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-69.5	133	171.4	28.3	-33.5	0	0	0	110.6	T130 I132	T130-P159 HydrophobicContact CG2-CB 3.83Å; I132-P159 HydrophobicContact CD1-CB 4.38Å; I132-P159 HydrophobicContact CG1-CB 4.11Å
160	Y	98.2	Very high	96.1	Very high	26 Å²	26	68.4 Å²	68.4	10%	0.102	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	139.7	175	-59.3	-82.4	0	0	0	109.8	T130 M131 S157 K158 F170 D172 H175	T130-Y160 CarbonylContact C-O 3.58Å; T130-Y160 VanDerWaalsContact CA-O 3.3Å; T130-Y160 WeakPolarHBondContact CA-O 3.48Å; M131-Y160 HydrophobicContact CE-CD2 3.35Å; M131-Y160 HydrophobicContact CE-CE2 4.05Å; M131-Y160 HydrophobicContact CE-CG 3.82Å; M131-Y160 PolarHBondContact N-O 3.49Å; M131-Y160 PolarHBondContact O-N 3.14Å; M131-Y160 HydrophobicContact SD-CD2 3.97Å; S157-Y160 WeakPolarHBondContact OG-CE2 3.38Å; K158-Y160 HydrophobicContact CD-CE1 4.31Å; K158-Y160 HydrophobicContact CG-CE1 3.96Å; K158-Y160 HydrophobicContact CG-CE2 4.37Å; K158-Y160 VanDerWaalsContact O-CD2 3.3Å; K158-Y160 WeakPolarHBondContact O-CD2 3.17Å; K158-Y160 WeakPolarHBondContact O-CE2 3.49Å; Y160-F170 AromaticContact CD1-CE2 3.77Å; Y160-F170 HydrophobicContact CD1-CE2 3.77Å; Y160-F170 AromaticContact CD2-CE2 3.93Å; Y160-F170 HydrophobicContact CD2-CE2 3.93Å; Y160-F170 HydrophobicContact CD2-CZ 4.31Å; Y160-F170 AromaticContact CE1-CE2 3.67Å; Y160-F170 HydrophobicContact CE1-CE2 3.67Å; Y160-F170 HydrophobicContact CE1-CZ 4.2Å; Y160-F170 AromaticContact CE2-CE2 3.83Å; Y160-F170 HydrophobicContact CE2-CE2 3.83Å; Y160-F170 AromaticContact CE2-CZ 3.83Å; Y160-F170 HydrophobicContact CE2-CZ 3.83Å; Y160-F170 AromaticContact CG-CE2 3.89Å; Y160-F170 HydrophobicContact CG-CE2 3.89Å; Y160-F170 AromaticContact CZ-CE2 3.72Å; Y160-F170 AromaticContact CZ-CZ 3.8Å; Y160-D172 HydrophobicContact CE1-CB 3.95Å; Y160-D172 WeakPolarHBondContact CE1-OD2 3.15Å; Y160-D172 VanDerWaalsContact CZ-OD2 3.27Å; Y160-D172 PolarHBondContact OH-OD2 2.78Å; Y160-H175 WeakPolarHBondContact OH-CB 3.43Å
161	Q	97.5	Very high	96	Very high	102 Å²	102	68.9 Å²	68.9	48%	0.477	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	129.9	178.2	-63.5	-60.3	-38.1	0	0	109.4	C129 T130 R205	C129-Q161 PolarHBondContact O-OE1 2.91Å; T130-Q161 PolarHBondContact OG1-NE2 3.37Å; T130-Q161 PolarHBondContact OG1-OE1 2.78Å; Q161-R205 VanDerWaalsContact OE1-CZ 3.3Å
162	F	97.5	Very high	96.1	Very high	23 Å²	23	61.5 Å²	61.5	10%	0.101	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	145.9	170.4	-64.2	-91.6	0	0	0	109.2	L123 P128 C129 M131 Q168 F170 R205	L123-F162 HydrophobicContact CD1-CD1 4.24Å; L123-F162 HydrophobicContact CD1-CD2 3.92Å; L123-F162 HydrophobicContact CD1-CE1 4.36Å; L123-F162 HydrophobicContact CD1-CE2 4.05Å; L123-F162 HydrophobicContact CD1-CG 4.01Å; L123-F162 HydrophobicContact CD1-CZ 4.26Å; L123-F162 HydrophobicContact CD2-CD1 4.08Å; L123-F162 HydrophobicContact CD2-CE1 3.62Å; L123-F162 HydrophobicContact CD2-CE2 4.39Å; L123-F162 HydrophobicContact CD2-CZ 3.78Å; P128-F162 CarbonylContact C-O 3.58Å; P128-F162 WeakPolarHBondContact CA-O 3.29Å; C129-F162 PolarHBondContact N-O 2.82Å; C129-F162 PolarHBondContact O-N 2.9Å; M131-F162 HydrophobicContact CB-CD2 4.18Å; M131-F162 HydrophobicContact CB-CE2 3.89Å; M131-F162 HydrophobicContact CE-CE2 4.04Å; M131-F162 HydrophobicContact CE-CZ 4.41Å; F162-Q168 HydrophobicContact CD1-CB 4.47Å; F162-F170 HydrophobicContact CZ-CB 4.13Å; F162-F170 AromaticContact CZ-CD2 3.95Å; F162-F170 HydrophobicContact CZ-CD2 3.95Å; F162-F170 HydrophobicContact CZ-CG 4.45Å; F162-R205 PolarHBondContact O-NH2 2.69Å
163	D	97	Very high	96	Very high	108 Å²	108	63.7 Å²	63.7	58%	0.578	35%	0.351	S	S	*	.			trans	-97.6	172.5	169.9	-61.3	-40.1	0	0	0	109.1	G165 Q168 R205	D163-G165 PolarHBondContact O-N 2.95Å; D163-Q168 PolarHBondContact O-NE2 2.94Å; D163-R205 IonicContact OD1-NH2 3.63Å; D163-R205 PolarHBondContact OD1-NH2 3.37Å; D163-R205 VanDerWaalsContact OD1-NH2 3.13Å
164	T	96.3	Very high	96	Very high	87 Å²	87	65.3 Å²	65.3	53%	0.534	35%	0.354	S	S	.	.	S	Bend	trans	-58.1	132.3	176.2	-63.7	0	0	0	0	111.1	C125 D126 P128	C125-T164 CarbonylContact O-C 3.57Å; C125-T164 VanDerWaalsContact O-CA 3.29Å; C125-T164 WeakPolarHBondContact O-CA 3.48Å; C125-T164 WeakPolarHBondContact O-CG2 3.17Å; D126-T164 WeakPolarHBondContact O-CG2 3.49Å; D126-T164 PolarHBondContact O-OG1 2.94Å; P128-T164 WeakPolarHBondContact CD-OG1 3.2Å
165	G	94.6	Very high	96	Very high	25 Å²	25	60.6 Å²	60.6	26%	0.258	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	163.6	149.2	179.4	0	0	0	0	0	113	C125 D163 Q168	C125-G165 PolarHBondContact N-O 2.94Å; C125-G165 PolarHBondContact O-N 2.85Å; D163-G165 PolarHBondContact O-N 2.95Å; G165-Q168 PolarHBondContact O-NE2 2.84Å
166	A	92.8	Very high	95.9	Very high	46 Å²	46	62.1 Å²	62.1	38%	0.38	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	163.4	174.3	0	0	0	0	0	112	D124 Q168	D124-A166 VanDerWaalsContact OD1-CA 3.23Å; D124-A166 WeakPolarHBondContact OD1-CA 3.27Å; D124-A166 WeakPolarHBondContact OD1-CB 3.44Å; A166-Q168 PolarHBondContact O-N 2.99Å
167	N	94.6	Very high	95.8	Very high	86 Å²	86	60.5 Å²	60.5	46%	0.46	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	55.4	30.3	179.1	-56.8	-78.4	0	0	0	114.1	R91 D124 V169	R91-N167 VanDerWaalsContact CZ-OD1 3.24Å; R91-N167 PolarHBondContact NH1-OD1 2.77Å; R91-N167 PolarHBondContact NH2-OD1 2.85Å; D124-N167 PolarHBondContact OD1-N 2.95Å; N167-V169 PolarHBondContact O-N 2.83Å
168	Q	96.9	Very high	95.7	Very high	47 Å²	47	60.8 Å²	60.8	22%	0.22	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	126.9	179.3	-58.3	-169.3	69.4	0	0	109.2	V122 L123 F162 D163 G165 A166	V122-Q168 CarbonylContact C-O 3.5Å; V122-Q168 VanDerWaalsContact CA-O 3.26Å; V122-Q168 WeakPolarHBondContact CA-O 3.33Å; L123-Q168 HydrophobicContact CD2-CB 3.97Å; L123-Q168 WeakPolarHBondContact CD2-O 3.44Å; L123-Q168 HydrophobicContact CG-CB 4.29Å; L123-Q168 PolarHBondContact N-O 3.48Å; L123-Q168 WeakPolarHBondContact O-CB 3.36Å; L123-Q168 PolarHBondContact O-N 3.24Å; F162-Q168 HydrophobicContact CD1-CB 4.47Å; D163-Q168 PolarHBondContact O-NE2 2.94Å; G165-Q168 PolarHBondContact O-NE2 2.84Å; A166-Q168 PolarHBondContact O-N 2.99Å
169	V	97.3	Very high	95.6	Very high	93 Å²	93	55.8 Å²	55.8	56%	0.564	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	123.4	178.1	-177.2	0	0	0	0	109.4	E120 V122 N167	E120-V169 HydrophobicContact CG-CG1 4.29Å; V122-V169 HydrophobicContact CG2-CG2 4.36Å; N167-V169 PolarHBondContact O-N 2.83Å
170	F	98	Very high	95.4	Very high	10 Å²	10	54 Å²	54	4%	0.044	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	127.1	165.9	174.9	-99.8	0	0	0	110.3	I119 E120 F121 L123 M131 I133 Y160 F162 D172	I119-F170 WeakPolarHBondContact O-CE1 3.26Å; E120-F170 VanDerWaalsContact CA-O 3.32Å; E120-F170 WeakPolarHBondContact CA-O 3.46Å; F121-F170 HydrophobicContact CD1-CB 4.44Å; F121-F170 AromaticContact CD1-CD1 3.87Å; F121-F170 HydrophobicContact CD1-CD1 3.87Å; F121-F170 HydrophobicContact CD2-CB 4.05Å; F121-F170 HydrophobicContact CE1-CB 4.16Å; F121-F170 AromaticContact CE1-CD1 3.32Å; F121-F170 HydrophobicContact CE1-CD1 3.32Å; F121-F170 HydrophobicContact CE1-CE1 4.01Å; F121-F170 AromaticContact CE1-CG 3.97Å; F121-F170 HydrophobicContact CE1-CG 3.97Å; F121-F170 HydrophobicContact CE2-CB 3.75Å; F121-F170 HydrophobicContact CE2-CD1 4.42Å; F121-F170 HydrophobicContact CE2-CG 4.28Å; F121-F170 HydrophobicContact CG-CB 4.4Å; F121-F170 HydrophobicContact CZ-CB 3.82Å; F121-F170 AromaticContact CZ-CD1 3.66Å; F121-F170 HydrophobicContact CZ-CD1 3.66Å; F121-F170 HydrophobicContact CZ-CE1 4.48Å; F121-F170 AromaticContact CZ-CG 3.82Å; F121-F170 HydrophobicContact CZ-CG 3.82Å; F121-F170 PolarHBondContact N-O 3.44Å; F121-F170 PolarHBondContact O-N 2.99Å; L123-F170 HydrophobicContact CD2-CB 4.3Å; M131-F170 HydrophobicContact CE-CD1 4.11Å; M131-F170 HydrophobicContact CE-CD2 3.48Å; M131-F170 VanDerWaalsContact CE-CD2 3.48Å; M131-F170 HydrophobicContact CE-CE1 4.11Å; M131-F170 HydrophobicContact CE-CE2 3.46Å; M131-F170 VanDerWaalsContact CE-CE2 3.46Å; M131-F170 HydrophobicContact CE-CG 3.79Å; M131-F170 HydrophobicContact CE-CZ 3.79Å; I133-F170 HydrophobicContact CD1-CE1 3.66Å; I133-F170 HydrophobicContact CD1-CZ 3.95Å; Y160-F170 AromaticContact CD1-CE2 3.77Å; Y160-F170 HydrophobicContact CD1-CE2 3.77Å; Y160-F170 AromaticContact CD2-CE2 3.93Å; Y160-F170 HydrophobicContact CD2-CE2 3.93Å; Y160-F170 HydrophobicContact CD2-CZ 4.31Å; Y160-F170 AromaticContact CE1-CE2 3.67Å; Y160-F170 HydrophobicContact CE1-CE2 3.67Å; Y160-F170 HydrophobicContact CE1-CZ 4.2Å; Y160-F170 AromaticContact CE2-CE2 3.83Å; Y160-F170 HydrophobicContact CE2-CE2 3.83Å; Y160-F170 AromaticContact CE2-CZ 3.83Å; Y160-F170 HydrophobicContact CE2-CZ 3.83Å; Y160-F170 AromaticContact CG-CE2 3.89Å; Y160-F170 HydrophobicContact CG-CE2 3.89Å; Y160-F170 AromaticContact CZ-CE2 3.72Å; Y160-F170 AromaticContact CZ-CZ 3.8Å; F162-F170 HydrophobicContact CZ-CB 4.13Å; F162-F170 AromaticContact CZ-CD2 3.95Å; F162-F170 HydrophobicContact CZ-CD2 3.95Å; F162-F170 HydrophobicContact CZ-CG 4.45Å; F170-D172 HydrophobicContact CE2-CB 3.89Å; F170-D172 HydrophobicContact CZ-CB 3.73Å
171	C	95.4	Very high	95.2	Very high	36 Å²	36	58.7 Å²	58.7	24%	0.243	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	107.3	165.1	-167.6	0	0	0	0	108.1	E120	E120-C171 HydrophobicContact CB-CB 4.48Å; E120-C171 HydrophobicContact CG-CB 4.21Å
172	D	95.3	Very high	95.1	Very high	22 Å²	22	55.8 Å²	55.8	12%	0.118	31%	0.311	C	S	.	.			trans	-104.1	112.5	176.5	-176.1	5	0	0	0	110.7	H118 K158 Y160 F170 D174 H175	H118-D172 PolarHBondContact ND1-O 3.28Å; K158-D172 WeakPolarHBondContact CE-OD2 3.13Å; K158-D172 IonicContact NZ-OD1 3.13Å; K158-D172 IonicContact NZ-OD2 3.79Å; K158-D172 PolarHBondContact NZ-OD2 3Å; Y160-D172 HydrophobicContact CE1-CB 3.95Å; Y160-D172 WeakPolarHBondContact CE1-OD2 3.15Å; Y160-D172 VanDerWaalsContact CZ-OD2 3.27Å; Y160-D172 PolarHBondContact OH-OD2 2.78Å; F170-D172 HydrophobicContact CE2-CB 3.89Å; F170-D172 HydrophobicContact CZ-CB 3.73Å; D172-D174 VanDerWaalsContact C-N 3.27Å; D172-D174 PolarHBondContact O-N 2.71Å; D172-D174 WeakPolarHBondContact OD1-CB 3.33Å; D172-D174 PolarHBondContact OD1-N 2.69Å; D172-H175 HydrophobicContact CB-CB 4.03Å; D172-H175 PolarHBondContact O-N 2.76Å
173	F	92.4	Very high	94.9	Very high	140 Å²	140	61.4 Å²	61.4	61%	0.614	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-18.9	-179.9	-62.9	-74.4	0	0	0	113.6	H118 H175	H118-F173 AromaticContact CD2-CD1 3.85Å; H118-F173 PolarHBondContact CE1-O 2.65Å; H118-F173 AromaticContact NE2-CD1 3.72Å; F173-H175 VanDerWaalsContact C-N 3.33Å
174	D	92.3	Very high	94.7	Very high	140 Å²	140	59.5 Å²	59.5	75%	0.749	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-20.5	172.6	-63.3	-31.9	0	0	0	111.8	K158 D172	K158-D174 IonicContact NZ-OD2 3Å; D172-D174 VanDerWaalsContact C-N 3.27Å; D172-D174 PolarHBondContact O-N 2.71Å; D172-D174 WeakPolarHBondContact OD1-CB 3.33Å; D172-D174 PolarHBondContact OD1-N 2.69Å
175	H	93.9	Very high	94.6	Very high	27 Å²	27	59.7 Å²	59.7	13%	0.125	33%	0.333	C	S	.	.			trans	-93.6	108.6	179.7	-166.6	61.6	0	0	0	110.4	H118 Y135 Y160 D172 F173	H118-H175 PolarHBondContact ND1-O 3.3Å; Y135-H175 AromaticContact CE2-CE1 3.74Å; Y135-H175 AromaticContact CE2-NE2 3.39Å; Y135-H175 WeakPolarHBondContact CE2-NE2 3.41Å; Y135-H175 AromaticContact CZ-NE2 3.54Å; Y135-H175 PolarHBondContact OH-CD2 3.47Å; Y135-H175 PolarHBondContact OH-NE2 3.45Å; Y160-H175 WeakPolarHBondContact OH-CB 3.43Å; D172-H175 HydrophobicContact CB-CB 4.03Å; D172-H175 PolarHBondContact O-N 2.76Å; F173-H175 VanDerWaalsContact C-N 3.33Å
176	V	95	Very high	94.6	Very high	47 Å²	47	62.1 Å²	62.1	29%	0.285	34%	0.337	S	S	.	.			trans	-126.3	124.2	-174.8	-174.8	0	0	0	0	110.4	A100 R116 Y117	A100-V176 HydrophobicContact CB-CG1 4.13Å; R116-V176 HydrophobicContact CB-CG1 3.68Å; R116-V176 HydrophobicContact CG-CG1 4.12Å; Y117-V176 WeakPolarHBondContact O-CA 3.43Å
177	F	95.5	Very high	94.8	Very high	9 Å²	9	60 Å²	60	4%	0.039	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-108.4	135.8	173.1	-178.1	-118.8	0	0	0	110	F97 Y117 Y135 F136 P179 F182 L187 I198	F97-F177 HydrophobicContact CE1-CD1 4.12Å; F97-F177 AromaticContact CZ-CD1 3.9Å; F97-F177 HydrophobicContact CZ-CD1 3.9Å; F97-F177 HydrophobicContact CZ-CE1 4.23Å; Y117-F177 PolarHBondContact N-O 2.81Å; Y117-F177 PolarHBondContact O-N 2.78Å; Y135-F177 HydrophobicContact CD1-CD1 4.02Å; Y135-F177 AromaticContact CD1-CD2 3.41Å; Y135-F177 HydrophobicContact CD1-CD2 3.41Å; Y135-F177 VanDerWaalsContact CD1-CD2 3.41Å; Y135-F177 AromaticContact CD1-CE1 3.98Å; Y135-F177 HydrophobicContact CD1-CE1 3.98Å; Y135-F177 AromaticContact CD1-CE2 3.36Å; Y135-F177 HydrophobicContact CD1-CE2 3.36Å; Y135-F177 AromaticContact CD1-CG 3.76Å; Y135-F177 HydrophobicContact CD1-CG 3.76Å; Y135-F177 AromaticContact CD1-CZ 3.67Å; Y135-F177 HydrophobicContact CD1-CZ 3.67Å; Y135-F177 HydrophobicContact CD2-CD2 4.2Å; Y135-F177 HydrophobicContact CD2-CE2 4.5Å; Y135-F177 HydrophobicContact CE1-CB 3.75Å; Y135-F177 AromaticContact CE1-CD1 3.68Å; Y135-F177 HydrophobicContact CE1-CD1 3.68Å; Y135-F177 AromaticContact CE1-CD2 3.45Å; Y135-F177 HydrophobicContact CE1-CD2 3.45Å; Y135-F177 VanDerWaalsContact CE1-CD2 3.45Å; Y135-F177 HydrophobicContact CE1-CE1 4.09Å; Y135-F177 AromaticContact CE1-CE2 3.89Å; Y135-F177 HydrophobicContact CE1-CE2 3.89Å; Y135-F177 AromaticContact CE1-CG 3.34Å; Y135-F177 HydrophobicContact CE1-CG 3.34Å; Y135-F177 HydrophobicContact CE1-CZ 4.2Å; Y135-F177 HydrophobicContact CE2-CD2 4.25Å; Y135-F177 AromaticContact CG-CD2 3.83Å; Y135-F177 HydrophobicContact CG-CD2 3.83Å; Y135-F177 AromaticContact CG-CE2 3.74Å; Y135-F177 HydrophobicContact CG-CE2 3.74Å; Y135-F177 HydrophobicContact CG-CZ 4.39Å; Y135-F177 AromaticContact CZ-CD2 3.9Å; Y135-F177 AromaticContact CZ-CG 3.84Å; F136-F177 HydrophobicContact CE2-CE2 4.08Å; F136-F177 HydrophobicContact CE2-CZ 4.14Å; F136-F177 HydrophobicContact CZ-CZ 4.26Å; F177-P179 HydrophobicContact CD1-CB 4.43Å; F177-P179 HydrophobicContact CD1-CG 4.44Å; F177-P179 HydrophobicContact CE1-CB 3.84Å; F177-P179 HydrophobicContact CE1-CG 4.32Å; F177-P179 HydrophobicContact CZ-CB 4.47Å; F177-F182 HydrophobicContact CD2-CE2 4.42Å; F177-F182 HydrophobicContact CE2-CD2 4.01Å; F177-F182 AromaticContact CE2-CE2 3.54Å; F177-F182 HydrophobicContact CE2-CE2 3.54Å; F177-F182 AromaticContact CZ-CD2 3.93Å; F177-F182 HydrophobicContact CZ-CD2 3.93Å; F177-F182 AromaticContact CZ-CE2 3.95Å; F177-F182 HydrophobicContact CZ-CE2 3.95Å; F177-L187 HydrophobicContact CE1-CD2 4.36Å; F177-L187 HydrophobicContact CZ-CD2 4.08Å; F177-I198 HydrophobicContact CE1-CD1 4.15Å
178	D	95	Very high	94.8	Very high	15 Å²	15	59.5 Å²	59.5	8%	0.08	32%	0.317	C	S	.	.			trans	-117.3	95.6	172.6	-166.7	-14.1	0	0	0	110.1	C114 C115 R116 S180 L181 F182	C114-D178 PolarHBondContact SG-OD2 3.14Å; C115-D178 VanDerWaalsContact C-OD1 3.25Å; C115-D178 WeakPolarHBondContact CA-OD1 3.45Å; C115-D178 PolarHBondContact N-OD1 2.87Å; C115-D178 PolarHBondContact N-OD2 3.07Å; C115-D178 VanDerWaalsContact N-OD2 3.1Å; C115-D178 VanDerWaalsContact O-OD1 3.14Å; R116-D178 HydrophobicContact CG-CB 4.12Å; D178-S180 PolarHBondContact O-N 3.43Å; D178-S180 WeakPolarHBondContact OD1-CB 3.38Å; D178-S180 PolarHBondContact OD1-N 2.89Å; D178-S180 PolarHBondContact OD1-OG 2.95Å; D178-L181 HydrophobicContact CB-CD1 3.93Å; D178-L181 HydrophobicContact CB-CG 3.96Å; D178-L181 PolarHBondContact O-N 2.96Å; D178-F182 WeakPolarHBondContact O-CE2 3.41Å
179	P	95.3	Very high	94.6	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-60.9	-20.4	175.1	22.5	-33.2	0	0	0	114.2	F97 C115 Y117 F177 L181 F182 L187 A222 F231	F97-P179 HydrophobicContact CE2-CG 4.43Å; C115-P179 WeakPolarHBondContact O-CD 3.17Å; Y117-P179 HydrophobicContact CD2-CG 3.89Å; Y117-P179 HydrophobicContact CE2-CG 3.97Å; F177-P179 HydrophobicContact CD1-CB 4.43Å; F177-P179 HydrophobicContact CD1-CG 4.44Å; F177-P179 HydrophobicContact CE1-CB 3.84Å; F177-P179 HydrophobicContact CE1-CG 4.32Å; F177-P179 HydrophobicContact CZ-CB 4.47Å; P179-L181 PolarHBondContact O-N 3.22Å; P179-F182 PolarHBondContact O-N 2.85Å; P179-L187 HydrophobicContact CB-CD1 3.81Å; P179-L187 HydrophobicContact CB-CD2 4.05Å; P179-A222 HydrophobicContact CB-CB 4.26Å; P179-F231 HydrophobicContact CB-CB 4.43Å; P179-F231 HydrophobicContact CB-CD1 3.79Å; P179-F231 HydrophobicContact CB-CD2 4.09Å; P179-F231 HydrophobicContact CB-CE1 3.96Å; P179-F231 HydrophobicContact CB-CE2 4.26Å; P179-F231 HydrophobicContact CB-CG 3.85Å; P179-F231 HydrophobicContact CB-CZ 4.19Å; P179-F231 HydrophobicContact CG-CB 3.8Å; P179-F231 HydrophobicContact CG-CD1 4Å; P179-F231 HydrophobicContact CG-CD2 3.55Å; P179-F231 HydrophobicContact CG-CE1 4.46Å; P179-F231 HydrophobicContact CG-CE2 4.06Å; P179-F231 HydrophobicContact CG-CG 3.5Å; P179-F231 HydrophobicContact CG-CZ 4.48Å
180	S	93.3	Very high	94.2	Very high	44 Å²	44	58 Å²	58	31%	0.308	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-70	-14.8	-179.4	79.4	0	0	0	0	113.6	N113 D178 F182	N113-S180 WeakPolarHBondContact O-CB 3.24Å; N113-S180 PolarHBondContact O-OG 3.27Å; D178-S180 PolarHBondContact O-N 3.43Å; D178-S180 WeakPolarHBondContact OD1-CB 3.38Å; D178-S180 PolarHBondContact OD1-N 2.89Å; D178-S180 PolarHBondContact OD1-OG 2.95Å; S180-F182 PolarHBondContact O-N 2.93Å
181	L	93.7	Very high	93.5	Very high	126 Å²	126	59.3 Å²	59.3	66%	0.66	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-75.5	-6	174.6	-56.3	-179.3	0	0	0	113.8	D178 P179	D178-L181 HydrophobicContact CB-CD1 3.93Å; D178-L181 HydrophobicContact CB-CG 3.96Å; D178-L181 PolarHBondContact O-N 2.96Å; P179-L181 PolarHBondContact O-N 3.22Å
182	F	94.3	Very high	93.1	Very high	40 Å²	40	63 Å²	63	18%	0.175	33%	0.326	C	S	.	.	S	Bend	trans	-123.8	155	-173.8	-53.4	-61	0	0	0	112.1	F136 L155 F177 D178 P179 S180 L187	F136-F182 HydrophobicContact CE1-CB 4.45Å; F136-F182 HydrophobicContact CE1-CG 4.39Å; F136-F182 HydrophobicContact CE2-CD1 4.09Å; F136-F182 AromaticContact CE2-CD2 3.76Å; F136-F182 HydrophobicContact CE2-CD2 3.76Å; F136-F182 HydrophobicContact CE2-CE1 4.23Å; F136-F182 AromaticContact CE2-CE2 3.86Å; F136-F182 HydrophobicContact CE2-CE2 3.86Å; F136-F182 AromaticContact CE2-CG 3.89Å; F136-F182 HydrophobicContact CE2-CG 3.89Å; F136-F182 HydrophobicContact CE2-CZ 4.1Å; F136-F182 HydrophobicContact CZ-CB 3.84Å; F136-F182 AromaticContact CZ-CD1 3.93Å; F136-F182 HydrophobicContact CZ-CD1 3.93Å; F136-F182 AromaticContact CZ-CD2 3.54Å; F136-F182 HydrophobicContact CZ-CD2 3.54Å; F136-F182 HydrophobicContact CZ-CE2 4.13Å; F136-F182 AromaticContact CZ-CG 3.42Å; F136-F182 HydrophobicContact CZ-CG 3.42Å; F136-F182 VanDerWaalsContact CZ-CG 3.42Å; L155-F182 HydrophobicContact CD2-CZ 4.31Å; F177-F182 HydrophobicContact CD2-CE2 4.42Å; F177-F182 HydrophobicContact CE2-CD2 4.01Å; F177-F182 AromaticContact CE2-CE2 3.54Å; F177-F182 HydrophobicContact CE2-CE2 3.54Å; F177-F182 AromaticContact CZ-CD2 3.93Å; F177-F182 HydrophobicContact CZ-CD2 3.93Å; F177-F182 AromaticContact CZ-CE2 3.95Å; F177-F182 HydrophobicContact CZ-CE2 3.95Å; D178-F182 WeakPolarHBondContact O-CE2 3.41Å; P179-F182 PolarHBondContact O-N 2.85Å; S180-F182 PolarHBondContact O-N 2.93Å; F182-L187 HydrophobicContact CB-CD2 4.02Å; F182-L187 HydrophobicContact CB-CG 4.24Å; F182-L187 HydrophobicContact CD2-CD2 4.28Å
183	K	94	Very high	92.7	Very high	141 Å²	141	66.1 Å²	66.1	61%	0.613	34%	0.339	S	S	*	.			trans	-72.2	143.8	177.4	-59.4	167.6	-175.1	166.8	0	109.2	N185 E186 L187	K183-N185 WeakPolarHBondContact CB-OD1 3.35Å; K183-N185 PolarHBondContact O-N 3.42Å; K183-E186 HydrophobicContact CB-CG 4.15Å; K183-E186 VanDerWaalsContact CB-OE2 3.23Å; K183-E186 WeakPolarHBondContact CB-OE2 3.42Å; K183-E186 WeakPolarHBondContact CG-OE2 3.49Å; K183-E186 PolarHBondContact N-OE2 2.91Å; K183-E186 WeakPolarHBondContact O-CB 3.43Å; K183-E186 PolarHBondContact O-N 3.2Å; K183-L187 PolarHBondContact O-N 3.46Å
184	A	92.8	Very high	92.5	Very high	68 Å²	68	64 Å²	64	56%	0.562	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-29.3	-178.9	0	0	0	0	0	113.7	E186 L188	A184-E186 VanDerWaalsContact C-N 3.35Å; A184-L188 WeakPolarHBondContact O-CG 3.45Å
185	N	93.9	Very high	92.6	Very high	91 Å²	91	59.4 Å²	59.4	49%	0.487	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-1.7	177.4	71.4	-31.8	0	0	0	115	K183 K193	K183-N185 WeakPolarHBondContact CB-OD1 3.35Å; K183-N185 PolarHBondContact O-N 3.42Å; N185-K193 PolarHBondContact O-NZ 2.94Å; N185-K193 VanDerWaalsContact O-NZ 3.13Å
186	E	95.2	Very high	92.7	Very high	77 Å²	77	58.5 Å²	58.5	36%	0.36	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-27.8	168.9	-61.1	175.5	111.9	0	0	110.7	F136 K183 A184 L188	F136-E186 HydrophobicContact CD1-CB 4.32Å; F136-E186 HydrophobicContact CE1-CB 3.8Å; F136-E186 VanDerWaalsContact CE1-O 3.31Å; F136-E186 WeakPolarHBondContact CE1-O 3.32Å; K183-E186 HydrophobicContact CB-CG 4.15Å; K183-E186 VanDerWaalsContact CB-OE2 3.23Å; K183-E186 WeakPolarHBondContact CB-OE2 3.42Å; K183-E186 WeakPolarHBondContact CG-OE2 3.49Å; K183-E186 PolarHBondContact N-OE2 2.91Å; K183-E186 WeakPolarHBondContact O-CB 3.43Å; K183-E186 PolarHBondContact O-N 3.2Å; A184-E186 VanDerWaalsContact C-N 3.35Å; E186-L188 VanDerWaalsContact C-N 3.29Å
187	L	96.6	Very high	92.8	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.005	29%	0.289	C	S	.	.	S	Bend	trans	-78.1	-10.7	177.6	-63.1	175.1	0	0	0	114.2	F136 F177 P179 F182 K183 P197 V221 A222 F231	F136-L187 HydrophobicContact CE1-CD2 4.2Å; F136-L187 HydrophobicContact CZ-CD2 3.82Å; F177-L187 HydrophobicContact CE1-CD2 4.36Å; F177-L187 HydrophobicContact CZ-CD2 4.08Å; P179-L187 HydrophobicContact CB-CD1 3.81Å; P179-L187 HydrophobicContact CB-CD2 4.05Å; F182-L187 HydrophobicContact CB-CD2 4.02Å; F182-L187 HydrophobicContact CB-CG 4.24Å; F182-L187 HydrophobicContact CD2-CD2 4.28Å; K183-L187 PolarHBondContact O-N 3.46Å; L187-P197 WeakPolarHBondContact O-CB 3.41Å; L187-P197 WeakPolarHBondContact O-CG 3.45Å; L187-V221 WeakPolarHBondContact O-CA 3.43Å; L187-V221 VanDerWaalsContact O-CB 3.32Å; L187-V221 WeakPolarHBondContact O-CB 3.48Å; L187-A222 HydrophobicContact CB-CB 4.19Å; L187-A222 WeakPolarHBondContact CB-O 3.44Å; L187-A222 HydrophobicContact CD1-CB 4.32Å; L187-A222 HydrophobicContact CD2-CB 4.21Å; L187-A222 HydrophobicContact CG-CB 4.48Å; L187-A222 PolarHBondContact O-N 2.93Å; L187-A222 VanDerWaalsContact O-N 3.09Å; L187-F231 HydrophobicContact CD1-CD1 4.05Å; L187-F231 HydrophobicContact CD1-CE1 3.57Å; L187-F231 HydrophobicContact CD1-CZ 4.44Å
188	L	95.4	Very high	92.9	Very high	76 Å²	76	56 Å²	56	40%	0.398	29%	0.287	S	S	.	.	S	Bend	trans	-103.5	142.8	176.8	-62.2	175.7	0	0	0	110.3	A184 E186 D190 P197 V221 E223	A184-L188 WeakPolarHBondContact O-CG 3.45Å; E186-L188 VanDerWaalsContact C-N 3.29Å; L188-D190 PolarHBondContact O-N 3.34Å; L188-P197 WeakPolarHBondContact O-CG 3.2Å; L188-V221 HydrophobicContact CD2-CB 4.33Å; L188-V221 HydrophobicContact CD2-CG2 4.42Å; L188-E223 HydrophobicContact CD2-CG 3.81Å
189	Y	93.1	Very high	93.1	Very high	56 Å²	56	55.2 Å²	55.2	22%	0.22	28%	0.283	C	S	.	.			trans	-66.8	126.6	177.4	176.2	-99.9	0	0	0	110.7	F62 H191 I196 I236	F62-Y189 HydrophobicContact CD1-CE2 4.43Å; F62-Y189 HydrophobicContact CE1-CD1 4.14Å; F62-Y189 HydrophobicContact CE1-CD2 4.03Å; F62-Y189 AromaticContact CE1-CE1 3.79Å; F62-Y189 HydrophobicContact CE1-CE1 3.79Å; F62-Y189 AromaticContact CE1-CE2 3.68Å; F62-Y189 HydrophobicContact CE1-CE2 3.68Å; F62-Y189 HydrophobicContact CE1-CG 4.25Å; F62-Y189 AromaticContact CE1-CZ 3.55Å; F62-Y189 HydrophobicContact CE2-CD1 4.48Å; F62-Y189 HydrophobicContact CE2-CE1 4.02Å; F62-Y189 AromaticContact CZ-CD1 3.62Å; F62-Y189 HydrophobicContact CZ-CD1 3.62Å; F62-Y189 HydrophobicContact CZ-CD2 4.33Å; F62-Y189 AromaticContact CZ-CE1 3.39Å; F62-Y189 HydrophobicContact CZ-CE1 3.39Å; F62-Y189 HydrophobicContact CZ-CE2 4.15Å; F62-Y189 HydrophobicContact CZ-CG 4.08Å; F62-Y189 AromaticContact CZ-CZ 3.68Å; Y189-H191 HydrophobicContact CE1-CB 4.08Å; Y189-H191 PolarHBondContact OH-ND1 3.16Å; Y189-H191 VanDerWaalsContact OH-ND1 3.15Å; Y189-I196 HydrophobicContact CD2-CG1 4.4Å; Y189-I196 HydrophobicContact CE2-CG1 4.12Å; Y189-I236 HydrophobicContact CD1-CD1 4.35Å; Y189-I236 HydrophobicContact CG-CD1 3.92Å
190	D	88.2	Confident	93.3	Very high	51 Å²	51	55.2 Å²	55.2	27%	0.273	28%	0.283	S	S	.	.	B	Isolated β-bridge	trans	-130.5	109.3	178.3	-175.6	-18.8	0	0	0	108.7	L188 D192 K193	L188-D190 PolarHBondContact O-N 3.34Å; D190-D192 VanDerWaalsContact C-N 3.25Å; D190-D192 PolarHBondContact O-N 2.83Å; D190-D192 WeakPolarHBondContact OD1-CB 3.24Å; D190-D192 PolarHBondContact OD1-N 3.48Å; D190-K193 HydrophobicContact CB-CB 4.32Å; D190-K193 HydrophobicContact CB-CD 4.11Å; D190-K193 HydrophobicContact CB-CG 4.08Å; D190-K193 PolarHBondContact O-N 3.4Å; D190-K193 WeakPolarHBondContact OD2-CE 3.44Å; D190-K193 IonicContact OD2-NZ 3.62Å; D190-K193 PolarHBondContact OD2-NZ 3.13Å
191	H	83.2	Confident	93.5	Very high	39 Å²	39	53.4 Å²	53.4	18%	0.181	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-62.4	-33.5	-178	-174.1	63	0	0	0	112.4	N61 R65 Y189 K193 E194	N61-H191 HydrophobicContact CB-CB 4.5Å; N61-H191 WeakPolarHBondContact CB-ND1 3.1Å; N61-H191 PolarHBondContact OD1-NE2 3.01Å; R65-H191 PolarHBondContact NH2-NE2 2.83Å; Y189-H191 HydrophobicContact CE1-CB 4.08Å; Y189-H191 PolarHBondContact OH-ND1 3.16Å; Y189-H191 VanDerWaalsContact OH-ND1 3.15Å; H191-K193 PolarHBondContact O-N 3.2Å; H191-E194 PolarHBondContact O-N 3.25Å
192	D	85.8	Confident	93.7	Very high	112 Å²	112	47.4 Å²	47.4	60%	0.599	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-69	-22.9	-178.1	-82.8	-51.6	0	0	0	112.8	K28 D190	K28-D192 WeakPolarHBondContact CE-OD1 3.32Å; K28-D192 IonicContact NZ-OD1 2.64Å; K28-D192 PolarHBondContact NZ-OD1 3.25Å; D190-D192 VanDerWaalsContact C-N 3.25Å; D190-D192 PolarHBondContact O-N 2.83Å; D190-D192 WeakPolarHBondContact OD1-CB 3.24Å; D190-D192 PolarHBondContact OD1-N 3.48Å
193	K	88.4	Confident	93.9	Very high	88 Å²	88	48 Å²	48	38%	0.383	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-86.2	-16	175.2	-63.3	-172.9	-172.2	103.7	0	113.9	N185 D190 H191 I195	N185-K193 PolarHBondContact O-NZ 2.94Å; N185-K193 VanDerWaalsContact O-NZ 3.13Å; D190-K193 HydrophobicContact CB-CB 4.32Å; D190-K193 HydrophobicContact CB-CD 4.11Å; D190-K193 HydrophobicContact CB-CG 4.08Å; D190-K193 PolarHBondContact O-N 3.4Å; D190-K193 WeakPolarHBondContact OD2-CE 3.44Å; D190-K193 IonicContact OD2-NZ 3.62Å; D190-K193 PolarHBondContact OD2-NZ 3.13Å; H191-K193 PolarHBondContact O-N 3.2Å; K193-I195 HydrophobicContact CB-CB 4.34Å; K193-I195 HydrophobicContact CB-CD1 4.43Å; K193-I195 PolarHBondContact O-N 3.12Å; K193-I195 VanDerWaalsContact O-N 3.14Å
194	E	88.1	Confident	94	Very high	97 Å²	97	41.8 Å²	41.8	45%	0.453	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	26.4	-171.6	-56.4	-174.7	160	0	0	113.8	R65 H191	R65-E194 IonicContact CZ-OE1 2.67Å; R65-E194 IonicContact NH1-OE1 3.83Å; R65-E194 PolarHBondContact NH1-OE1 3.14Å; R65-E194 IonicContact NH2-OE1 2.73Å; R65-E194 PolarHBondContact NH2-OE1 3.31Å; H191-E194 PolarHBondContact O-N 3.25Å
195	I	93.8	Very high	94.1	Very high	43 Å²	43	42.8 Å²	42.8	22%	0.221	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-112.3	127.6	179.8	-70	165.7	0	0	0	109.4	F136 T138 K193	F136-I195 HydrophobicContact CB-CG2 3.97Å; T138-I195 HydrophobicContact CG2-CG1 4.41Å; K193-I195 HydrophobicContact CB-CB 4.34Å; K193-I195 HydrophobicContact CB-CD1 4.43Å; K193-I195 PolarHBondContact O-N 3.12Å; K193-I195 VanDerWaalsContact O-N 3.14Å
196	I	95.9	Very high	93.7	Very high	8 Å²	8	41.4 Å²	41.4	4%	0.041	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	118.1	176.5	-52.7	170.9	0	0	0	108.4	F136 A137 E139 Y148 Y189 I198 V199 I219	F136-I196 CarbonylContact C-O 3.48Å; F136-I196 VanDerWaalsContact CA-O 3.25Å; F136-I196 WeakPolarHBondContact CA-O 3.14Å; F136-I196 PolarHBondContact N-O 2.66Å; A137-I196 PolarHBondContact N-O 2.99Å; A137-I196 PolarHBondContact O-N 2.64Å; E139-I196 HydrophobicContact CB-CD1 4.04Å; Y148-I196 HydrophobicContact CE1-CD1 3.92Å; Y189-I196 HydrophobicContact CD2-CG1 4.4Å; Y189-I196 HydrophobicContact CE2-CG1 4.12Å; I196-I198 PolarHBondContact O-N 3.47Å; I196-V199 HydrophobicContact CB-CG2 3.77Å; I196-V199 HydrophobicContact CD1-CG2 4.17Å; I196-V199 HydrophobicContact CG2-CG2 3.38Å; I196-I219 HydrophobicContact CD1-CD1 4.3Å; I196-I219 HydrophobicContact CG2-CB 4.31Å; I196-I219 HydrophobicContact CG2-CG1 4.22Å; I196-I219 HydrophobicContact CG2-CG2 3.34Å
197	P	97.4	Very high	93.1	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.006	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62	-44	-171.5	-26	34.5	0	0	0	114.1	Y135 F136 L187 L188 V221	Y135-P197 CarbonylContact C-O 3.26Å; Y135-P197 VanDerWaalsContact CA-O 3.29Å; Y135-P197 WeakPolarHBondContact CA-O 3.16Å; F136-P197 PolarHBondContact N-O 3.12Å; L187-P197 WeakPolarHBondContact O-CB 3.41Å; L187-P197 WeakPolarHBondContact O-CG 3.45Å; L188-P197 WeakPolarHBondContact O-CG 3.2Å; P197-V221 HydrophobicContact CG-CG1 4.35Å
198	I	98.3	Very high	92.6	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	127.8	179.6	-50.5	-179.6	0	0	0	108.5	F97 I119 Y134 Y135 F177 I196 A220 A222 L233	F97-I198 HydrophobicContact CZ-CD1 3.94Å; I119-I198 HydrophobicContact CD1-CG2 4.26Å; Y134-I198 WeakPolarHBondContact O-CA 3.38Å; Y135-I198 HydrophobicContact CD1-CD1 4.43Å; Y135-I198 HydrophobicContact CD1-CG1 3.97Å; Y135-I198 HydrophobicContact CD1-CG2 4.31Å; Y135-I198 HydrophobicContact CE1-CD1 4.45Å; Y135-I198 HydrophobicContact CE1-CG1 4.37Å; Y135-I198 HydrophobicContact CE1-CG2 4.17Å; F177-I198 HydrophobicContact CE1-CD1 4.15Å; I196-I198 PolarHBondContact O-N 3.47Å; I198-A220 HydrophobicContact CB-CB 4.22Å; I198-A220 HydrophobicContact CG2-CB 4.5Å; I198-A220 PolarHBondContact N-O 3.21Å; I198-A220 PolarHBondContact O-N 2.97Å; I198-A222 HydrophobicContact CD1-CB 4.26Å; I198-L233 HydrophobicContact CD1-CD1 3.45Å; I198-L233 VanDerWaalsContact CD1-CD1 3.45Å; I198-L233 HydrophobicContact CG2-CD1 4.48Å
199	V	98.4	Very high	91.9	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	126.4	174.1	-176.8	0	0	0	0	109.2	I133 Y134 A137 Y148 I196 H201	I133-V199 WeakPolarHBondContact CA-O 3.47Å; Y134-V199 PolarHBondContact N-O 2.8Å; Y134-V199 PolarHBondContact O-N 3.24Å; A137-V199 HydrophobicContact CB-CG2 4.25Å; Y148-V199 HydrophobicContact CD1-CG1 4.18Å; Y148-V199 HydrophobicContact CD1-CG2 4.17Å; Y148-V199 HydrophobicContact CD2-CG1 4.01Å; Y148-V199 HydrophobicContact CE1-CG1 3.96Å; Y148-V199 HydrophobicContact CE1-CG2 4.11Å; Y148-V199 HydrophobicContact CE2-CG1 3.77Å; Y148-V199 HydrophobicContact CG-CG1 4.21Å; I196-V199 HydrophobicContact CB-CG2 3.77Å; I196-V199 HydrophobicContact CD1-CG2 4.17Å; I196-V199 HydrophobicContact CG2-CG2 3.38Å; V199-H201 HydrophobicContact CG1-CB 4.26Å
200	I	98.6	Very high	91.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	110.4	162.5	-61.9	158	0	0	0	106.6	V90 L95 I119 F121 M131 I133 S217 T218	V90-I200 HydrophobicContact CG2-CG2 4.06Å; L95-I200 HydrophobicContact CD1-CD1 3.42Å; L95-I200 VanDerWaalsContact CD1-CD1 3.42Å; L95-I200 HydrophobicContact CD2-CD1 4.04Å; L95-I200 HydrophobicContact CG-CD1 4.4Å; I119-I200 HydrophobicContact CG2-CD1 4.33Å; F121-I200 HydrophobicContact CD1-CD1 3.74Å; F121-I200 HydrophobicContact CE1-CD1 3.55Å; F121-I200 HydrophobicContact CE1-CG1 4.08Å; F121-I200 HydrophobicContact CE1-CG2 4Å; F121-I200 HydrophobicContact CE2-CG2 4.32Å; F121-I200 HydrophobicContact CZ-CD1 4.27Å; F121-I200 HydrophobicContact CZ-CG2 3.63Å; M131-I200 HydrophobicContact CG-CG2 3.93Å; M131-I200 HydrophobicContact SD-CG2 4.01Å; I133-I200 HydrophobicContact CG1-CG1 4.32Å; I200-S217 WeakPolarHBondContact O-CA 3.29Å; I200-T218 PolarHBondContact N-O 2.93Å; I200-T218 PolarHBondContact O-N 3.06Å
201	H	98.4	Very high	91.2	Very high	6 Å²	6	54.2 Å²	54.2	3%	0.028	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	114.8	-177.6	179.9	-150.2	0	0	0	109.4	M131 I132 Y134 F146 Y148 V199 F203 H215 S217	M131-H201 CarbonylContact C-O 3.53Å; M131-H201 VanDerWaalsContact CA-O 3.28Å; M131-H201 WeakPolarHBondContact CA-O 3.49Å; I132-H201 PolarHBondContact N-O 3.05Å; I132-H201 PolarHBondContact O-N 2.89Å; Y134-H201 HydrophobicContact CD2-CB 4.29Å; Y134-H201 HydrophobicContact CE2-CB 3.88Å; F146-H201 PolarHBondContact O-CE1 3.03Å; F146-H201 PolarHBondContact O-NE2 3.12Å; Y148-H201 HydrophobicContact CD2-CB 3.86Å; Y148-H201 AromaticContact CD2-CE1 3.98Å; Y148-H201 AromaticContact CD2-CG 3.64Å; Y148-H201 AromaticContact CD2-ND1 3.63Å; Y148-H201 HydrophobicContact CE2-CB 4.02Å; Y148-H201 AromaticContact CE2-CD2 3.72Å; Y148-H201 AromaticContact CE2-CG 3.75Å; V199-H201 HydrophobicContact CG1-CB 4.26Å; H201-F203 AromaticContact CE1-CD1 3.87Å; H201-F203 AromaticContact ND1-CD1 3.99Å; H201-H215 AromaticContact CE1-ND1 3.66Å; H201-H215 AromaticContact NE2-CG 3.86Å; H201-H215 AromaticContact NE2-ND1 3.08Å; H201-H215 PolarHBondContact NE2-ND1 2.89Å; H201-S217 PolarHBondContact CD2-OG 3.32Å
202	C	98.3	Very high	91.4	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	142.3	170.1	-57.9	0	0	0	0	109.2	V88 T130 M131 H215 H216	V88-C202 HydrophobicContact CG1-CB 3.98Å; V88-C202 HydrophobicContact CG2-CB 3.68Å; T130-C202 CarbonylContact O-C 3.52Å; T130-C202 WeakPolarHBondContact O-CA 3.21Å; M131-C202 VanDerWaalsContact CG-SG 3.51Å; C202-H215 CarbonylContact O-C 3.54Å; C202-H215 WeakPolarHBondContact O-CA 3.38Å; C202-H216 HydrophobicContact CB-CB 4.39Å; C202-H216 PolarHBondContact N-O 3.26Å; C202-H216 PolarHBondContact O-N 3.3Å
203	F	97.5	Very high	91.7	Very high	52 Å²	52	52.7 Å²	52.7	23%	0.228	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	140.1	171.2	57.5	-88.1	0	0	0	111.2	C129 T130 I132 H201 Q214 H215	C129-F203 CarbonylContact C-O 3.55Å; C129-F203 VanDerWaalsContact CA-O 3.23Å; C129-F203 WeakPolarHBondContact CA-O 3.23Å; C129-F203 VanDerWaalsContact CB-O 3.27Å; C129-F203 WeakPolarHBondContact CB-O 3.41Å; T130-F203 VanDerWaalsContact CB-CZ 3.49Å; T130-F203 HydrophobicContact CG2-CE1 3.9Å; T130-F203 HydrophobicContact CG2-CE2 4.24Å; T130-F203 HydrophobicContact CG2-CZ 3.58Å; T130-F203 PolarHBondContact N-O 2.86Å; T130-F203 PolarHBondContact O-N 3.11Å; I132-F203 HydrophobicContact CD1-CE1 4.06Å; I132-F203 HydrophobicContact CD1-CZ 4.48Å; I132-F203 HydrophobicContact CG1-CE1 4.44Å; H201-F203 AromaticContact CE1-CD1 3.87Å; H201-F203 AromaticContact ND1-CD1 3.99Å; F203-Q214 CarbonylContact C-O 3.52Å; F203-Q214 VanDerWaalsContact CA-O 3.26Å; F203-Q214 WeakPolarHBondContact CA-O 3.35Å; F203-H215 VanDerWaalsContact CB-ND1 3.35Å; F203-H215 WeakPolarHBondContact CB-ND1 3.37Å
204	T	96.9	Very high	92.1	Very high	11 Å²	11	49.8 Å²	49.8	7%	0.067	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	156	179.2	59.9	0	0	0	0	111.1	M87 V88 A127 P206 A213 Q214	M87-T204 HydrophobicContact CB-CG2 3.58Å; M87-T204 HydrophobicContact CG-CG2 4.39Å; V88-T204 HydrophobicContact CG1-CG2 4.36Å; A127-T204 HydrophobicContact CB-CG2 3.97Å; T204-P206 WeakPolarHBondContact O-CD 3.45Å; T204-A213 WeakPolarHBondContact OG1-CA 3.48Å; T204-Q214 HydrophobicContact CG2-CB 4.16Å; T204-Q214 PolarHBondContact N-O 3.43Å; T204-Q214 PolarHBondContact OG1-N 3.31Å
205	R	94	Very high	92.5	Very high	88 Å²	88	45.9 Å²	45.9	33%	0.332	25%	0.254	S	S	.	.			trans	-101.2	101.6	171.4	-67.5	-176	-83	145.8	-10.1	108	P128 Q161 F162 D163	P128-R205 VanDerWaalsContact CB-NH2 3.34Å; P128-R205 PolarHBondContact O-N 3Å; Q161-R205 VanDerWaalsContact OE1-CZ 3.3Å; F162-R205 PolarHBondContact O-NH2 2.69Å; D163-R205 IonicContact OD1-NH2 3.63Å; D163-R205 PolarHBondContact OD1-NH2 3.37Å; D163-R205 VanDerWaalsContact OD1-NH2 3.13Å
206	P	87	Confident	92.7	Very high	62 Å²	62	43.9 Å²	43.9	40%	0.403	24%	0.244	S	C	.	.			trans	-54.6	138.9	179.1	-28.1	37	0	0	0	112.3	T204 E211 A213	T204-P206 WeakPolarHBondContact O-CD 3.45Å; P206-E211 HydrophobicContact CB-CB 3.86Å; P206-E211 WeakPolarHBondContact CB-O 3.48Å; P206-E211 WeakPolarHBondContact CG-O 3.11Å; P206-A213 HydrophobicContact CG-CB 4.16Å
207	H	82.7	Confident	92.8	Very high	146 Å²	146	43.5 Å²	43.5	68%	0.676	24%	0.242	S	C	*	.	S	Bend	trans	-80.4	-24.9	177.6	-67.9	-67.9	0	0	0	112.2	E211	H207-E211 IonicContact CD2-OE2 3.66Å; H207-E211 PolarHBondContact N-OE2 2.82Å
208	C	84.6	Confident	92.8	Very high	54 Å²	54	43.4 Å²	43.4	37%	0.365	24%	0.241	S	C	.	.	S	Bend	trans	-141.4	164.9	177.3	68.2	0	0	0	0	112	S210 E211	C208-S210 PolarHBondContact O-N 2.8Å; C208-S210 PolarHBondContact SG-OG 2.92Å; C208-E211 PolarHBondContact O-N 3.41Å; C208-E211 VanDerWaalsContact SG-CD 3.54Å; C208-E211 PolarHBondContact SG-OE1 3Å
209	S	80.3	Confident	92.8	Very high	135 Å²	135	43.4 Å²	43.4	94%	0.944	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-7.5	-175.9	57.7	0	0	0	0	115.3
210	S	83	Confident	92.8	Very high	104 Å²	104	43.4 Å²	43.4	73%	0.727	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-12.8	174.8	47.3	0	0	0	0	113.7	C208	C208-S210 PolarHBondContact O-N 2.8Å; C208-S210 PolarHBondContact SG-OG 2.92Å
211	E	83.6	Confident	92.7	Very high	91 Å²	91	43.7 Å²	43.7	43%	0.425	24%	0.243	S	C	.	.	S	Bend	trans	-85.4	127	175.4	-78.5	161.1	-152.6	0	0	109.9	P206 H207 C208	P206-E211 HydrophobicContact CB-CB 3.86Å; P206-E211 WeakPolarHBondContact CB-O 3.48Å; P206-E211 WeakPolarHBondContact CG-O 3.11Å; H207-E211 IonicContact CD2-OE2 3.66Å; H207-E211 PolarHBondContact N-OE2 2.82Å; C208-E211 PolarHBondContact O-N 3.41Å; C208-E211 VanDerWaalsContact SG-CD 3.54Å; C208-E211 PolarHBondContact SG-OE1 3Å
212	M	88.1	Confident	92.7	Very high	95 Å²	95	43.5 Å²	43.5	47%	0.468	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-82.1	143.2	170.8	-62	-167.9	70.7	0	0	110.1	S143 Q214 N244	S143-M212 WeakPolarHBondContact O-CE 3.42Å; M212-Q214 PolarHBondContact O-N 2.95Å; M212-N244 VanDerWaalsContact CE-OD1 3.25Å; M212-N244 WeakPolarHBondContact CE-OD1 3.43Å
213	A	93.5	Very high	92.5	Very high	25 Å²	25	46.6 Å²	46.6	21%	0.207	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-67.4	132.3	173.6	0	0	0	0	0	109.9	T204 P206 H215	T204-A213 WeakPolarHBondContact OG1-CA 3.48Å; P206-A213 HydrophobicContact CG-CB 4.16Å; A213-H215 PolarHBondContact O-CD2 2.89Å
214	Q	95.4	Very high	92.3	Very high	26 Å²	26	51.7 Å²	51.7	12%	0.121	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-84.9	138.8	163.7	-67.9	-166.9	1.1	0	0	108.5	H85 M87 F203 T204 M212 Y241 V242	H85-Q214 PolarHBondContact O-NE2 3.21Å; H85-Q214 PolarHBondContact O-OE1 3.26Å; M87-Q214 HydrophobicContact CG-CG 4.4Å; M87-Q214 VanDerWaalsContact CG-OE1 3.29Å; F203-Q214 CarbonylContact C-O 3.52Å; F203-Q214 VanDerWaalsContact CA-O 3.26Å; F203-Q214 WeakPolarHBondContact CA-O 3.35Å; T204-Q214 HydrophobicContact CG2-CB 4.16Å; T204-Q214 PolarHBondContact N-O 3.43Å; T204-Q214 PolarHBondContact OG1-N 3.31Å; M212-Q214 PolarHBondContact O-N 2.95Å; Q214-Y241 WeakPolarHBondContact CA-O 3.43Å; Q214-V242 HydrophobicContact CB-CG2 4.37Å; Q214-V242 HydrophobicContact CG-CB 4.49Å; Q214-V242 HydrophobicContact CG-CG1 4.16Å; Q214-V242 HydrophobicContact CG-CG2 3.97Å
215	H	97.1	Very high	91.8	Very high	16 Å²	16	52.9 Å²	52.9	7%	0.074	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	138	175.8	-58	-106.1	0	0	0	110.4	D144 F146 H201 C202 F203 A213 F240 Y241	D144-H215 PolarHBondContact O-NE2 3.3Å; D144-H215 VanDerWaalsContact O-NE2 3.11Å; F146-H215 HydrophobicContact CD2-CB 3.68Å; F146-H215 HydrophobicContact CE2-CB 4.22Å; F146-H215 HydrophobicContact CG-CB 4.36Å; H201-H215 AromaticContact CE1-ND1 3.66Å; H201-H215 AromaticContact NE2-CG 3.86Å; H201-H215 AromaticContact NE2-ND1 3.08Å; H201-H215 PolarHBondContact NE2-ND1 2.89Å; C202-H215 CarbonylContact O-C 3.54Å; C202-H215 WeakPolarHBondContact O-CA 3.38Å; F203-H215 VanDerWaalsContact CB-ND1 3.35Å; F203-H215 WeakPolarHBondContact CB-ND1 3.37Å; A213-H215 PolarHBondContact O-CD2 2.89Å; H215-F240 CarbonylContact O-C 3.54Å; H215-F240 VanDerWaalsContact O-CA 3.22Å; H215-F240 WeakPolarHBondContact O-CA 3.5Å; H215-Y241 PolarHBondContact N-O 2.91Å; H215-Y241 PolarHBondContact O-N 3.21Å
216	H	97.5	Very high	90.9	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	140.3	164.9	176.3	-128.5	0	0	0	109	V88 I89 V90 C202 T218 Q238 K239 F240	V88-H216 HydrophobicContact CG1-CB 4.08Å; V88-H216 WeakPolarHBondContact O-CB 3.31Å; I89-H216 VanDerWaalsContact CA-CE1 3.5Å; I89-H216 WeakPolarHBondContact CA-CE1 3.47Å; V90-H216 WeakPolarHBondContact CA-NE2 3.42Å; V90-H216 WeakPolarHBondContact CB-NE2 3.39Å; V90-H216 WeakPolarHBondContact CG2-CE1 3.06Å; V90-H216 PolarHBondContact N-CE1 3.04Å; V90-H216 PolarHBondContact N-ND1 2.83Å; V90-H216 PolarHBondContact N-NE2 3.1Å; V90-H216 PolarHBondContact O-NE2 3.16Å; C202-H216 HydrophobicContact CB-CB 4.39Å; C202-H216 PolarHBondContact N-O 3.26Å; C202-H216 PolarHBondContact O-N 3.3Å; H216-T218 PolarHBondContact NE2-OG1 2.85Å; H216-Q238 PolarHBondContact NE2-NE2 2.88Å; H216-K239 CarbonylContact C-O 3.52Å; H216-K239 WeakPolarHBondContact CA-O 3.13Å; H216-K239 PolarHBondContact CD2-O 3.25Å; H216-F240 HydrophobicContact CB-CD1 3.91Å; H216-F240 HydrophobicContact CB-CE1 3.78Å; H216-F240 AromaticContact CD2-CD1 3.7Å; H216-F240 AromaticContact CD2-CE1 3.2Å; H216-F240 WeakPolarHBondContact CD2-CE1 3.47Å; H216-F240 AromaticContact CD2-CZ 3.39Å; H216-F240 WeakPolarHBondContact CD2-CZ 3.4Å; H216-F240 AromaticContact CG-CE1 3.59Å
217	S	97.9	Very high	90	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	117.8	177.5	-61.1	0	0	0	0	110.7	F146 Y148 I200 H201 Q238 K239	F146-S217 WeakPolarHBondContact CD2-OG 3.22Å; Y148-S217 WeakPolarHBondContact CE2-OG 3.49Å; Y148-S217 VanDerWaalsContact OH-CB 3.27Å; Y148-S217 WeakPolarHBondContact OH-CB 3.48Å; Y148-S217 PolarHBondContact OH-OG 3.13Å; I200-S217 WeakPolarHBondContact O-CA 3.29Å; H201-S217 PolarHBondContact CD2-OG 3.32Å; S217-Q238 CarbonylContact O-C 3.51Å; S217-Q238 VanDerWaalsContact O-CA 3.29Å; S217-Q238 WeakPolarHBondContact O-CA 3.42Å; S217-K239 PolarHBondContact N-O 2.98Å; S217-K239 PolarHBondContact O-N 2.82Å
218	T	98.3	Very high	89.6	Confident	0 Å²	0	54 Å²	54	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115.2	173.1	-61	0	0	0	0	109	L95 I200 H216 P235 Q238	L95-T218 HydrophobicContact CD2-CG2 4.01Å; I200-T218 PolarHBondContact N-O 2.93Å; I200-T218 PolarHBondContact O-N 3.06Å; H216-T218 PolarHBondContact NE2-OG1 2.85Å; T218-P235 HydrophobicContact CG2-CB 4.11Å; T218-Q238 HydrophobicContact CG2-CG 4.05Å; T218-Q238 PolarHBondContact OG1-NE2 2.85Å
219	I	97.5	Very high	89.5	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	129	-178.9	-61.8	173.7	0	0	0	108.6	F62 I196 P235 I236 K237 K239	F62-I219 HydrophobicContact CD1-CD1 3.53Å; F62-I219 HydrophobicContact CE1-CD1 3.83Å; F62-I219 HydrophobicContact CE1-CG2 4.28Å; I196-I219 HydrophobicContact CD1-CD1 4.3Å; I196-I219 HydrophobicContact CG2-CB 4.31Å; I196-I219 HydrophobicContact CG2-CG1 4.22Å; I196-I219 HydrophobicContact CG2-CG2 3.34Å; I219-P235 CarbonylContact O-C 3.6Å; I219-P235 WeakPolarHBondContact O-CA 3.07Å; I219-I236 HydrophobicContact CB-CG1 4.25Å; I219-I236 HydrophobicContact CG2-CD1 3.83Å; I219-I236 HydrophobicContact CG2-CG1 3.7Å; I219-I236 WeakPolarHBondContact O-CG1 2.95Å; I219-I236 PolarHBondContact O-N 3.37Å; I219-K237 PolarHBondContact N-O 3.09Å; I219-K237 PolarHBondContact O-N 3.38Å; I219-K239 HydrophobicContact CD1-CD 3.98Å
220	A	98.2	Very high	90	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	161.7	-178.3	0	0	0	0	0	113	L95 I198 L233 K234	L95-A220 HydrophobicContact CD2-CB 3.93Å; I198-A220 HydrophobicContact CB-CB 4.22Å; I198-A220 HydrophobicContact CG2-CB 4.5Å; I198-A220 PolarHBondContact N-O 3.21Å; I198-A220 PolarHBondContact O-N 2.97Å; A220-L233 HydrophobicContact CB-CD1 3.64Å; A220-L233 HydrophobicContact CB-CG 4.34Å; A220-K234 CarbonylContact C-O 3.56Å; A220-K234 VanDerWaalsContact CA-O 3.24Å; A220-K234 WeakPolarHBondContact CA-O 3.29Å; A220-K234 WeakPolarHBondContact CB-O 3.39Å
221	V	97.9	Very high	90.5	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.03	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	157.8	174.5	-60.1	0	0	0	0	109.6	L187 L188 P197 E223 K234 I236	L187-V221 WeakPolarHBondContact O-CA 3.43Å; L187-V221 VanDerWaalsContact O-CB 3.32Å; L187-V221 WeakPolarHBondContact O-CB 3.48Å; L188-V221 HydrophobicContact CD2-CB 4.33Å; L188-V221 HydrophobicContact CD2-CG2 4.42Å; P197-V221 HydrophobicContact CG-CG1 4.35Å; V221-E223 HydrophobicContact CG2-CG 4.21Å; V221-K234 HydrophobicContact CG2-CB 3.95Å; V221-K234 HydrophobicContact CG2-CD 4.25Å; V221-K234 HydrophobicContact CG2-CG 4.43Å; V221-K234 PolarHBondContact N-O 3.34Å; V221-K234 PolarHBondContact O-N 2.94Å; V221-I236 HydrophobicContact CG1-CD1 4.04Å; V221-I236 HydrophobicContact CG1-CG2 4.02Å; V221-I236 HydrophobicContact CG2-CG2 3.86Å
222	A	97.3	Very high	91.1	Very high	3 Å²	3	42.9 Å²	42.9	3%	0.025	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	109.7	171	0	0	0	0	0	109.8	F97 P179 L187 I198 T232	F97-A222 HydrophobicContact CE2-CB 3.81Å; F97-A222 HydrophobicContact CZ-CB 4.08Å; P179-A222 HydrophobicContact CB-CB 4.26Å; L187-A222 HydrophobicContact CB-CB 4.19Å; L187-A222 WeakPolarHBondContact CB-O 3.44Å; L187-A222 HydrophobicContact CD1-CB 4.32Å; L187-A222 HydrophobicContact CD2-CB 4.21Å; L187-A222 HydrophobicContact CG-CB 4.48Å; L187-A222 PolarHBondContact O-N 2.93Å; L187-A222 VanDerWaalsContact O-N 3.09Å; I198-A222 HydrophobicContact CD1-CB 4.26Å; A222-T232 WeakPolarHBondContact CA-O 3.34Å
223	E	94.7	Very high	91.5	Very high	65 Å²	65	39.1 Å²	39.1	30%	0.304	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	141	176.9	-74.2	174	-176.5	0	0	109.4	L188 V221 F231 T232 K234	L188-E223 HydrophobicContact CD2-CG 3.81Å; V221-E223 HydrophobicContact CG2-CG 4.21Å; E223-F231 CarbonylContact O-C 3.59Å; E223-F231 WeakPolarHBondContact O-CA 3.47Å; E223-T232 PolarHBondContact N-O 3.02Å; E223-T232 PolarHBondContact O-N 3.16Å; E223-T232 PolarHBondContact O-OG1 3.13Å; E223-K234 VanDerWaalsContact CD-CD 3.42Å; E223-K234 HydrophobicContact CG-CD 4.47Å; E223-K234 VanDerWaalsContact OE1-CD 3.31Å; E223-K234 WeakPolarHBondContact OE1-CD 3.39Å; E223-K234 IonicContact OE1-NZ 3.25Å; E223-K234 PolarHBondContact OE1-NZ 3.15Å; E223-K234 VanDerWaalsContact OE2-CD 3.23Å; E223-K234 WeakPolarHBondContact OE2-CD 3.2Å; E223-K234 IonicContact OE2-NZ 2.65Å; E223-K234 PolarHBondContact OE2-NZ 3.37Å
224	R	92.1	Very high	91.7	Very high	159 Å²	159	42.3 Å²	42.3	60%	0.6	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	129.7	175	-168	177.1	-174.4	177.2	-0.6	109.2	N229 F231	R224-N229 PolarHBondContact NH2-OD1 2.71Å; R224-F231 HydrophobicContact CB-CD1 4.14Å; R224-F231 HydrophobicContact CB-CE1 4.03Å; R224-F231 HydrophobicContact CG-CE1 4.32Å; R224-F231 HydrophobicContact CG-CZ 4.42Å
225	S	87.4	Confident	91.8	Very high	36 Å²	36	41.9 Å²	41.9	25%	0.252	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-65.3	137.7	175.6	-63.2	0	0	0	0	110.5	D227 G230	S225-D227 PolarHBondContact O-N 3.13Å; S225-G230 PolarHBondContact N-O 3.49Å
226	G	75.3	Confident	91.7	Very high	80 Å²	80	43.1 Å²	43.1	83%	0.825	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-39.2	-179.7	0	0	0	0	0	113.7
227	D	68.8	Low	91.6	Very high	172 Å²	172	44.5 Å²	44.5	92%	0.92	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-3.1	-168.2	-48.9	-47.8	0	0	0	114.4	S225	S225-D227 PolarHBondContact O-N 3.13Å
228	S	73.4	Confident	91.5	Very high	67 Å²	67	45 Å²	45	47%	0.469	25%	0.251	S	S	.	.	S	Bend	trans	-148.9	157.1	-178.4	66.6	0	0	0	0	111.2	G230	S228-G230 PolarHBondContact O-N 3.23Å
229	N	81.6	Confident	91.3	Very high	60 Å²	60	45 Å²	45	32%	0.321	25%	0.251	S	S	.	.	S	Bend	trans	-65.6	2.9	176.6	-155.6	24.8	0	0	0	114.1	N113 C115 R224	N113-N229 PolarHBondContact OD1-ND2 3.13Å; C115-N229 PolarHBondContact SG-O 3.17Å; R224-N229 PolarHBondContact NH2-OD1 2.71Å
230	G	91.1	Very high	91.2	Very high	6 Å²	6	45.4 Å²	45.4	6%	0.062	25%	0.253	C	S	.	.			trans	-84.8	172.4	-176.7	0	0	0	0	0	114.6	Y117 S225 S228	Y117-G230 WeakPolarHBondContact OH-CA 3.4Å; S225-G230 PolarHBondContact N-O 3.49Å; S228-G230 PolarHBondContact O-N 3.23Å
231	F	95	Very high	91	Very high	21 Å²	21	45.9 Å²	45.9	9%	0.092	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	151.3	178	-64.2	-102.7	0	0	0	110.9	F97 C115 Y117 P179 L187 E223 R224	F97-F231 HydrophobicContact CD2-CB 4.32Å; F97-F231 HydrophobicContact CE2-CB 4.21Å; C115-F231 HydrophobicContact CB-CD2 4Å; C115-F231 HydrophobicContact CB-CE2 3.98Å; Y117-F231 HydrophobicContact CE2-CB 3.99Å; Y117-F231 HydrophobicContact CE2-CD2 4.2Å; Y117-F231 PolarHBondContact OH-N 3.3Å; P179-F231 HydrophobicContact CB-CB 4.43Å; P179-F231 HydrophobicContact CB-CD1 3.79Å; P179-F231 HydrophobicContact CB-CD2 4.09Å; P179-F231 HydrophobicContact CB-CE1 3.96Å; P179-F231 HydrophobicContact CB-CE2 4.26Å; P179-F231 HydrophobicContact CB-CG 3.85Å; P179-F231 HydrophobicContact CB-CZ 4.19Å; P179-F231 HydrophobicContact CG-CB 3.8Å; P179-F231 HydrophobicContact CG-CD1 4Å; P179-F231 HydrophobicContact CG-CD2 3.55Å; P179-F231 HydrophobicContact CG-CE1 4.46Å; P179-F231 HydrophobicContact CG-CE2 4.06Å; P179-F231 HydrophobicContact CG-CG 3.5Å; P179-F231 HydrophobicContact CG-CZ 4.48Å; L187-F231 HydrophobicContact CD1-CD1 4.05Å; L187-F231 HydrophobicContact CD1-CE1 3.57Å; L187-F231 HydrophobicContact CD1-CZ 4.44Å; E223-F231 CarbonylContact O-C 3.59Å; E223-F231 WeakPolarHBondContact O-CA 3.47Å; R224-F231 HydrophobicContact CB-CD1 4.14Å; R224-F231 HydrophobicContact CB-CE1 4.03Å; R224-F231 HydrophobicContact CG-CE1 4.32Å; R224-F231 HydrophobicContact CG-CZ 4.42Å
232	T	95.3	Very high	90.7	Very high	64 Å²	64	45.9 Å²	45.9	39%	0.393	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	134.1	170.8	51.3	0	0	0	0	109.8	A222 E223	A222-T232 WeakPolarHBondContact CA-O 3.34Å; E223-T232 PolarHBondContact N-O 3.02Å; E223-T232 PolarHBondContact O-N 3.16Å; E223-T232 PolarHBondContact O-OG1 3.13Å
233	L	97.5	Very high	90.3	Very high	15 Å²	15	49.3 Å²	49.3	8%	0.079	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	129.2	169.9	-175.2	57.5	0	0	0	108.7	L95 F97 I119 I198 A220	L95-L233 HydrophobicContact CD1-CD2 3.57Å; L95-L233 HydrophobicContact CD1-CG 4.45Å; L95-L233 HydrophobicContact CD2-CD2 4.08Å; L95-L233 HydrophobicContact CD2-CG 4.13Å; L95-L233 HydrophobicContact CG-CD2 3.63Å; L95-L233 HydrophobicContact CG-CG 3.98Å; F97-L233 HydrophobicContact CB-CB 4.31Å; F97-L233 HydrophobicContact CD1-CB 3.86Å; F97-L233 HydrophobicContact CD1-CD2 3.94Å; F97-L233 HydrophobicContact CD1-CG 4.39Å; F97-L233 HydrophobicContact CD2-CB 3.66Å; F97-L233 HydrophobicContact CE1-CB 4.03Å; F97-L233 HydrophobicContact CE1-CD1 4.04Å; F97-L233 HydrophobicContact CE1-CD2 3.94Å; F97-L233 HydrophobicContact CE1-CG 4.25Å; F97-L233 HydrophobicContact CE2-CB 3.83Å; F97-L233 HydrophobicContact CE2-CD1 4.36Å; F97-L233 HydrophobicContact CG-CB 3.65Å; F97-L233 HydrophobicContact CZ-CB 4.01Å; F97-L233 HydrophobicContact CZ-CD1 3.86Å; F97-L233 HydrophobicContact CZ-CG 4.37Å; I119-L233 HydrophobicContact CD1-CD2 4.15Å; I119-L233 HydrophobicContact CG1-CD2 4.01Å; I119-L233 HydrophobicContact CG2-CD2 3.96Å; I198-L233 HydrophobicContact CD1-CD1 3.45Å; I198-L233 VanDerWaalsContact CD1-CD1 3.45Å; I198-L233 HydrophobicContact CG2-CD1 4.48Å; A220-L233 HydrophobicContact CB-CD1 3.64Å; A220-L233 HydrophobicContact CB-CG 4.34Å
234	K	97	Very high	89.9	Confident	92 Å²	92	49.5 Å²	49.5	40%	0.4	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	110.4	-174.1	-176.8	-178.6	-176.1	179.3	0	110.8	A220 V221 E223 I236	A220-K234 CarbonylContact C-O 3.56Å; A220-K234 VanDerWaalsContact CA-O 3.24Å; A220-K234 WeakPolarHBondContact CA-O 3.29Å; A220-K234 WeakPolarHBondContact CB-O 3.39Å; V221-K234 HydrophobicContact CG2-CB 3.95Å; V221-K234 HydrophobicContact CG2-CD 4.25Å; V221-K234 HydrophobicContact CG2-CG 4.43Å; V221-K234 PolarHBondContact N-O 3.34Å; V221-K234 PolarHBondContact O-N 2.94Å; E223-K234 VanDerWaalsContact CD-CD 3.42Å; E223-K234 HydrophobicContact CG-CD 4.47Å; E223-K234 VanDerWaalsContact OE1-CD 3.31Å; E223-K234 WeakPolarHBondContact OE1-CD 3.39Å; E223-K234 IonicContact OE1-NZ 3.25Å; E223-K234 PolarHBondContact OE1-NZ 3.15Å; E223-K234 VanDerWaalsContact OE2-CD 3.23Å; E223-K234 WeakPolarHBondContact OE2-CD 3.2Å; E223-K234 IonicContact OE2-NZ 2.65Å; E223-K234 PolarHBondContact OE2-NZ 3.37Å; K234-I236 PolarHBondContact O-N 2.74Å
235	P	96.8	Very high	89.7	Confident	18 Å²	18	42.9 Å²	42.9	12%	0.117	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	124.9	173.9	25.8	-30.5	0	0	0	110.3	R92 L95 T218 I219	R92-P235 HydrophobicContact CG-CB 3.77Å; R92-P235 HydrophobicContact CG-CG 3.54Å; R92-P235 PolarHBondContact NE-O 2.87Å; R92-P235 PolarHBondContact NH2-O 2.71Å; R92-P235 WeakPolarHBondContact O-CG 3.42Å; L95-P235 HydrophobicContact CB-CG 4.37Å; L95-P235 HydrophobicContact CD2-CB 3.92Å; L95-P235 HydrophobicContact CD2-CG 4.24Å; T218-P235 HydrophobicContact CG2-CB 4.11Å; I219-P235 CarbonylContact O-C 3.6Å; I219-P235 WeakPolarHBondContact O-CA 3.07Å
236	I	95.1	Very high	89.8	Confident	41 Å²	41	42.2 Å²	42.2	21%	0.21	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	-36.5	-178.8	60.6	168	0	0	0	112.9	F62 Y189 I219 V221 K234	F62-I236 HydrophobicContact CE1-CD1 4.2Å; F62-I236 HydrophobicContact CZ-CD1 3.83Å; Y189-I236 HydrophobicContact CD1-CD1 4.35Å; Y189-I236 HydrophobicContact CG-CD1 3.92Å; I219-I236 HydrophobicContact CB-CG1 4.25Å; I219-I236 HydrophobicContact CG2-CD1 3.83Å; I219-I236 HydrophobicContact CG2-CG1 3.7Å; I219-I236 WeakPolarHBondContact O-CG1 2.95Å; I219-I236 PolarHBondContact O-N 3.37Å; V221-I236 HydrophobicContact CG1-CD1 4.04Å; V221-I236 HydrophobicContact CG1-CG2 4.02Å; V221-I236 HydrophobicContact CG2-CG2 3.86Å; K234-I236 PolarHBondContact O-N 2.74Å
237	K	95.1	Very high	90.6	Very high	29 Å²	29	40.5 Å²	40.5	13%	0.126	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	156.3	-178.8	-72	-58.3	177.1	-176.7	0	111.7	D59 F62 I219 L248 Q250	D59-K237 WeakPolarHBondContact OD1-CE 3.5Å; D59-K237 IonicContact OD1-NZ 3.09Å; D59-K237 PolarHBondContact OD1-NZ 3.34Å; D59-K237 IonicContact OD2-NZ 3.33Å; D59-K237 PolarHBondContact OD2-NZ 2.7Å; F62-K237 HydrophobicContact CD1-CG 4.5Å; F62-K237 HydrophobicContact CD2-CG 3.85Å; F62-K237 HydrophobicContact CE1-CG 4.36Å; F62-K237 HydrophobicContact CE2-CG 3.71Å; F62-K237 HydrophobicContact CG-CG 4.26Å; F62-K237 HydrophobicContact CZ-CG 3.97Å; I219-K237 PolarHBondContact N-O 3.09Å; I219-K237 PolarHBondContact O-N 3.38Å; K237-L248 HydrophobicContact CB-CD1 4.1Å; K237-L248 HydrophobicContact CD-CD1 4.2Å; K237-L248 HydrophobicContact CD-CD2 4.4Å; K237-L248 HydrophobicContact CD-CG 4.48Å; K237-L248 HydrophobicContact CG-CD1 4.26Å; K237-Q250 VanDerWaalsContact NZ-OE1 3.09Å
238	Q	96.3	Very high	91.7	Very high	10 Å²	10	33.8 Å²	33.8	5%	0.047	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	138.1	170.9	-66.6	-176.3	-64	0	0	109.6	V90 H216 S217 T218 L249	V90-Q238 PolarHBondContact O-NE2 2.9Å; H216-Q238 PolarHBondContact NE2-NE2 2.88Å; S217-Q238 CarbonylContact O-C 3.51Å; S217-Q238 VanDerWaalsContact O-CA 3.29Å; S217-Q238 WeakPolarHBondContact O-CA 3.42Å; T218-Q238 HydrophobicContact CG2-CG 4.05Å; T218-Q238 PolarHBondContact OG1-NE2 2.85Å; Q238-L249 HydrophobicContact CB-CB 4.07Å; Q238-L249 HydrophobicContact CB-CD2 4.19Å; Q238-L249 WeakPolarHBondContact O-CB 2.94Å; Q238-L249 PolarHBondContact O-N 3.46Å
239	K	95.2	Very high	92.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	146.3	-177.6	-65.1	173.7	57.6	170.6	0	110.5	F62 E139 F146 H216 S217 I219 C246 Y247 L248	F62-K239 HydrophobicContact CB-CD 4.31Å; F62-K239 WeakPolarHBondContact O-CD 3.49Å; F62-K239 WeakPolarHBondContact O-CE 3.3Å; F62-K239 PolarHBondContact O-NZ 2.82Å; E139-K239 IonicContact OE1-NZ 2.72Å; E139-K239 PolarHBondContact OE1-NZ 2.69Å; E139-K239 IonicContact OE2-NZ 3.95Å; E139-K239 PolarHBondContact OE2-NZ 3.01Å; F146-K239 HydrophobicContact CE2-CB 3.87Å; F146-K239 HydrophobicContact CZ-CB 3.89Å; H216-K239 CarbonylContact C-O 3.52Å; H216-K239 WeakPolarHBondContact CA-O 3.13Å; H216-K239 PolarHBondContact CD2-O 3.25Å; S217-K239 PolarHBondContact N-O 2.98Å; S217-K239 PolarHBondContact O-N 2.82Å; I219-K239 HydrophobicContact CD1-CD 3.98Å; K239-C246 WeakPolarHBondContact CE-SG 3.23Å; K239-Y247 CarbonylContact C-O 3.59Å; K239-Y247 VanDerWaalsContact CA-O 3.29Å; K239-Y247 WeakPolarHBondContact CA-O 3.37Å; K239-L248 HydrophobicContact CG-CD1 3.69Å
240	F	95.2	Very high	92.9	Very high	10 Å²	10	33 Å²	33	4%	0.044	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	147.6	168.4	-62.3	-85	0	0	0	110.9	C86 I89 F146 H215 H216 V242 C246 Y247 L249	C86-F240 HydrophobicContact CB-CD1 3.99Å; C86-F240 HydrophobicContact CB-CE1 3.7Å; C86-F240 HydrophobicContact CB-CZ 4.18Å; I89-F240 HydrophobicContact CD1-CZ 4.18Å; I89-F240 HydrophobicContact CG1-CZ 4.26Å; F146-F240 WeakPolarHBondContact CZ-O 3.48Å; H215-F240 CarbonylContact O-C 3.54Å; H215-F240 VanDerWaalsContact O-CA 3.22Å; H215-F240 WeakPolarHBondContact O-CA 3.5Å; H216-F240 HydrophobicContact CB-CD1 3.91Å; H216-F240 HydrophobicContact CB-CE1 3.78Å; H216-F240 AromaticContact CD2-CD1 3.7Å; H216-F240 AromaticContact CD2-CE1 3.2Å; H216-F240 WeakPolarHBondContact CD2-CE1 3.47Å; H216-F240 AromaticContact CD2-CZ 3.39Å; H216-F240 WeakPolarHBondContact CD2-CZ 3.4Å; H216-F240 AromaticContact CG-CE1 3.59Å; F240-V242 HydrophobicContact CB-CG2 4.37Å; F240-C246 CarbonylContact O-C 3.54Å; F240-C246 WeakPolarHBondContact O-CA 2.91Å; F240-Y247 PolarHBondContact N-O 3.17Å; F240-Y247 PolarHBondContact O-N 3.21Å; F240-L249 HydrophobicContact CE2-CB 4.26Å; F240-L249 HydrophobicContact CE2-CD1 4.42Å; F240-L249 HydrophobicContact CE2-CD2 4.26Å
241	Y	94	Very high	92.6	Very high	11 Å²	11	36.5 Å²	36.5	4%	0.043	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	115.1	164.4	-164.2	-85.9	0	0	0	108.3	I141 T142 S143 F146 Q214 H215 N244 V245 C246	I141-Y241 HydrophobicContact CG2-CD2 4.17Å; I141-Y241 HydrophobicContact CG2-CE2 3.71Å; T142-Y241 PolarHBondContact O-OH 2.87Å; S143-Y241 VanDerWaalsContact C-OH 3.26Å; S143-Y241 WeakPolarHBondContact CA-OH 3.26Å; S143-Y241 PolarHBondContact O-OH 2.92Å; F146-Y241 HydrophobicContact CD1-CD2 4.14Å; F146-Y241 AromaticContact CE1-CD2 3.77Å; F146-Y241 HydrophobicContact CE1-CD2 3.77Å; F146-Y241 HydrophobicContact CE1-CG 4.35Å; F146-Y241 HydrophobicContact CZ-CD2 4.27Å; Q214-Y241 WeakPolarHBondContact CA-O 3.43Å; H215-Y241 PolarHBondContact N-O 2.91Å; H215-Y241 PolarHBondContact O-N 3.21Å; Y241-N244 WeakPolarHBondContact OH-CA 3.49Å; Y241-V245 WeakPolarHBondContact CA-O 3.22Å; Y241-C246 HydrophobicContact CD2-CB 4.39Å
242	V	91.4	Very high	92.3	Very high	4 Å²	4	37.4 Å²	37.4	2%	0.024	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	136.6	-179	-173.9	0	0	0	0	107.6	L84 Q214 F240 N244 V245 Y247	L84-V242 HydrophobicContact CD1-CB 4.1Å; L84-V242 HydrophobicContact CD1-CG1 3.9Å; L84-V242 HydrophobicContact CD1-CG2 4.44Å; L84-V242 HydrophobicContact CD2-CG2 4.48Å; Q214-V242 HydrophobicContact CB-CG2 4.37Å; Q214-V242 HydrophobicContact CG-CB 4.49Å; Q214-V242 HydrophobicContact CG-CG1 4.16Å; Q214-V242 HydrophobicContact CG-CG2 3.97Å; F240-V242 HydrophobicContact CB-CG2 4.37Å; V242-N244 VanDerWaalsContact C-N 3.28Å; V242-N244 PolarHBondContact O-N 2.93Å; V242-V245 PolarHBondContact N-O 2.85Å; V242-V245 VanDerWaalsContact N-O 3.08Å; V242-V245 PolarHBondContact O-N 2.88Å; V242-Y247 HydrophobicContact CB-CE2 4.11Å
243	D	87.4	Confident	92	Very high	75 Å²	75	38.6 Å²	38.6	40%	0.401	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	45.5	176.7	-57.5	-13.9	0	0	0	114.1	P71 Y72 V245	P71-D243 HydrophobicContact CG-CB 4.22Å; Y72-D243 PolarHBondContact OH-OD2 2.64Å; D243-V245 PolarHBondContact O-N 3.32Å
244	N	86.5	Confident	91.5	Very high	70 Å²	70	39 Å²	39	37%	0.374	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	66	7.7	-176.7	-54.9	-49.9	0	0	0	116.4	S143 M212 Y241 V242	S143-N244 PolarHBondContact O-OD1 3.33Å; M212-N244 VanDerWaalsContact CE-OD1 3.25Å; M212-N244 WeakPolarHBondContact CE-OD1 3.43Å; Y241-N244 WeakPolarHBondContact OH-CA 3.49Å; V242-N244 VanDerWaalsContact C-N 3.28Å; V242-N244 PolarHBondContact O-N 2.93Å
245	V	88.1	Confident	90.8	Very high	19 Å²	19	37.2 Å²	37.2	12%	0.115	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	133.9	179.8	179.4	0	0	0	0	111.1	Y70 P71 Y241 V242 D243 Y247	Y70-V245 HydrophobicContact CD2-CG2 4.39Å; P71-V245 HydrophobicContact CG-CG2 3.86Å; Y241-V245 WeakPolarHBondContact CA-O 3.22Å; V242-V245 PolarHBondContact N-O 2.85Å; V242-V245 VanDerWaalsContact N-O 3.08Å; V242-V245 PolarHBondContact O-N 2.88Å; D243-V245 PolarHBondContact O-N 3.32Å; V245-Y247 HydrophobicContact CB-CD2 4.35Å; V245-Y247 HydrophobicContact CB-CE2 3.58Å; V245-Y247 HydrophobicContact CG1-CD1 4.28Å; V245-Y247 HydrophobicContact CG1-CD2 4.09Å; V245-Y247 HydrophobicContact CG1-CE1 3.82Å; V245-Y247 HydrophobicContact CG1-CE2 3.62Å; V245-Y247 HydrophobicContact CG1-CG 4.39Å; V245-Y247 VanDerWaalsContact CG1-CZ 3.46Å; V245-Y247 WeakPolarHBondContact O-CD2 3.29Å; V245-Y247 WeakPolarHBondContact O-CE2 3.49Å
246	C	90.7	Very high	89.5	Confident	22 Å²	22	41 Å²	41	15%	0.149	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	113.3	170.5	178.3	0	0	0	0	110	F146 K239 F240 Y241	F146-C246 HydrophobicContact CE1-CB 4.2Å; F146-C246 HydrophobicContact CZ-CB 4.44Å; K239-C246 WeakPolarHBondContact CE-SG 3.23Å; F240-C246 CarbonylContact O-C 3.54Å; F240-C246 WeakPolarHBondContact O-CA 2.91Å; Y241-C246 HydrophobicContact CD2-CB 4.39Å
247	Y	90.5	Very high	87.8	Confident	44 Å²	44	42.2 Å²	42.2	17%	0.173	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	143.2	173.9	-56.4	-91.8	0	0	0	110.2	Y70 Y72 L84 K239 F240 V242 V245	Y70-Y247 HydrophobicContact CE2-CE1 4.45Å; Y72-Y247 WeakPolarHBondContact CE2-OH 3.29Å; L84-Y247 HydrophobicContact CD1-CE2 4.21Å; L84-Y247 HydrophobicContact CD2-CD1 4.04Å; L84-Y247 HydrophobicContact CD2-CD2 3.65Å; L84-Y247 HydrophobicContact CD2-CE1 4.13Å; L84-Y247 HydrophobicContact CD2-CE2 3.75Å; L84-Y247 HydrophobicContact CD2-CG 3.81Å; K239-Y247 CarbonylContact C-O 3.59Å; K239-Y247 VanDerWaalsContact CA-O 3.29Å; K239-Y247 WeakPolarHBondContact CA-O 3.37Å; F240-Y247 PolarHBondContact N-O 3.17Å; F240-Y247 PolarHBondContact O-N 3.21Å; V242-Y247 HydrophobicContact CB-CE2 4.11Å; V245-Y247 HydrophobicContact CB-CD2 4.35Å; V245-Y247 HydrophobicContact CB-CE2 3.58Å; V245-Y247 HydrophobicContact CG1-CD1 4.28Å; V245-Y247 HydrophobicContact CG1-CD2 4.09Å; V245-Y247 HydrophobicContact CG1-CE1 3.82Å; V245-Y247 HydrophobicContact CG1-CE2 3.62Å; V245-Y247 HydrophobicContact CG1-CG 4.39Å; V245-Y247 VanDerWaalsContact CG1-CZ 3.46Å; V245-Y247 WeakPolarHBondContact O-CD2 3.29Å; V245-Y247 WeakPolarHBondContact O-CE2 3.49Å
248	L	92.1	Very high	86	Confident	31 Å²	31	46.4 Å²	46.4	16%	0.162	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	121.5	170.8	-173.9	72	0	0	0	108.9	D59 F62 L63 K237 K239	D59-L248 HydrophobicContact CB-CD2 3.7Å; D59-L248 WeakPolarHBondContact O-CD2 3.49Å; F62-L248 HydrophobicContact CB-CD1 3.89Å; F62-L248 HydrophobicContact CB-CD2 4.48Å; F62-L248 HydrophobicContact CG-CD1 4.49Å; L63-L248 HydrophobicContact CD2-CB 3.86Å; L63-L248 HydrophobicContact CG-CB 4.46Å; K237-L248 HydrophobicContact CB-CD1 4.1Å; K237-L248 HydrophobicContact CD-CD1 4.2Å; K237-L248 HydrophobicContact CD-CD2 4.4Å; K237-L248 HydrophobicContact CD-CG 4.48Å; K237-L248 HydrophobicContact CG-CD1 4.26Å; K239-L248 HydrophobicContact CG-CD1 3.69Å
249	L	91.8	Very high	83.7	Confident	75 Å²	75	48.5 Å²	48.5	39%	0.393	26%	0.258	S	S	.	.			trans	-73.6	136.4	-179.7	-170.2	66.1	0	0	0	110.5	Q238 F240	Q238-L249 HydrophobicContact CB-CB 4.07Å; Q238-L249 HydrophobicContact CB-CD2 4.19Å; Q238-L249 WeakPolarHBondContact O-CB 2.94Å; Q238-L249 PolarHBondContact O-N 3.46Å; F240-L249 HydrophobicContact CE2-CB 4.26Å; F240-L249 HydrophobicContact CE2-CD1 4.42Å; F240-L249 HydrophobicContact CE2-CD2 4.26Å
250	Q	89	Confident	81.5	Confident	36 Å²	36	51.4 Å²	51.4	17%	0.168	27%	0.273	C	S	.	.			trans	-132	133.9	178.4	-64.5	-78	24.8	0	0	109.3	F54 D59 K237	F54-Q250 HydrophobicContact CD1-CB 3.79Å; F54-Q250 HydrophobicContact CD1-CG 4.43Å; F54-Q250 HydrophobicContact CE1-CB 4.28Å; F54-Q250 VanDerWaalsContact O-CD 3.32Å; F54-Q250 VanDerWaalsContact O-CG 3.23Å; F54-Q250 WeakPolarHBondContact O-CG 3.25Å; F54-Q250 PolarHBondContact O-NE2 3.29Å; D59-Q250 PolarHBondContact OD2-NE2 2.91Å; K237-Q250 VanDerWaalsContact NZ-OE1 3.09Å
251	E	85.2	Confident	79.1	Confident	80 Å²	80	55.3 Å²	55.3	37%	0.374	30%	0.301	S	S	.	.			trans	-70.5	153.3	-177.2	-67.3	170.7	146.7	0	0	112.3	R92 Y253 R300	R92-E251 IonicContact CZ-OE1 2.68Å; R92-E251 IonicContact NH1-OE1 2.98Å; R92-E251 PolarHBondContact NH1-OE1 2.65Å; R92-E251 IonicContact NH1-OE2 3.75Å; R92-E251 PolarHBondContact NH1-OE2 3.27Å; E251-Y253 HydrophobicContact CB-CE1 4.22Å; E251-Y253 PolarHBondContact OE2-OH 3.28Å; E251-R300 WeakPolarHBondContact O-CD 3.45Å; E251-R300 PolarHBondContact O-NH1 3.33Å
252	V	88.7	Confident	76.8	Confident	39 Å²	39	58.7 Å²	58.7	24%	0.236	33%	0.326	C	S	.	.			trans	-111.4	121.3	163.2	169.9	0	0	0	0	107.8	F54 L255 L295 L302	F54-V252 HydrophobicContact CE1-CG2 4.46Å; F54-V252 HydrophobicContact CZ-CG2 4.35Å; V252-L255 HydrophobicContact CB-CB 4.19Å; V252-L255 HydrophobicContact CB-CD2 4.14Å; V252-L255 HydrophobicContact CG1-CB 3.92Å; V252-L255 HydrophobicContact CG1-CD1 4.35Å; V252-L255 HydrophobicContact CG1-CD2 4.43Å; V252-L255 HydrophobicContact CG1-CG 4.48Å; V252-L295 HydrophobicContact CB-CD2 4.31Å; V252-L295 HydrophobicContact CG1-CD2 3.38Å; V252-L295 HydrophobicContact CG2-CD2 4Å; V252-L302 HydrophobicContact CG1-CB 3.66Å; V252-L302 HydrophobicContact CG1-CD2 4.49Å
253	Y	88.7	Confident	74.6	Confident	89 Å²	89	61.5 Å²	61.5	35%	0.349	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-80.2	129.1	178.5	-57.8	-59	0	0	0	109.8	E251 R300 L302	E251-Y253 HydrophobicContact CB-CE1 4.22Å; E251-Y253 PolarHBondContact OE2-OH 3.28Å; Y253-R300 HydrophobicContact CD2-CB 4.32Å; Y253-R300 PolarHBondContact N-O 2.8Å; Y253-R300 PolarHBondContact OH-NH1 2.73Å; Y253-R300 PolarHBondContact OH-NH2 3.08Å; Y253-L302 PolarHBondContact O-N 3.36Å
254	G	87	Confident	72.5	Confident	23 Å²	23	64.7 Å²	64.7	24%	0.237	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.8	9.4	-178.9	0	0	0	0	0	115.8	E256 R292	G254-E256 VanDerWaalsContact C-N 3.28Å; G254-E256 PolarHBondContact O-N 2.77Å; G254-R292 PolarHBondContact O-NH1 2.74Å
255	L	81.7	Confident	70.6	Confident	55 Å²	55	65.3 Å²	65.3	29%	0.288	38%	0.382	S	S	.	.			trans	-87	22.2	175.7	-159.1	71	0	0	0	113.3	V252 N257 L302 L369 L373	V252-L255 HydrophobicContact CB-CB 4.19Å; V252-L255 HydrophobicContact CB-CD2 4.14Å; V252-L255 HydrophobicContact CG1-CB 3.92Å; V252-L255 HydrophobicContact CG1-CD1 4.35Å; V252-L255 HydrophobicContact CG1-CD2 4.43Å; V252-L255 HydrophobicContact CG1-CG 4.48Å; L255-N257 PolarHBondContact O-N 3.26Å; L255-L302 HydrophobicContact CD1-CD2 3.35Å; L255-L369 HydrophobicContact CD1-CD2 4.01Å; L255-L369 HydrophobicContact CD1-CG 4.29Å; L255-L373 HydrophobicContact CD1-CD1 3.54Å; L255-L373 HydrophobicContact CD2-CD1 3.93Å; L255-L373 HydrophobicContact CG-CD1 3.72Å
256	E	69.7	Low	68.6	Low	99 Å²	99	68.7 Å²	68.7	46%	0.463	41%	0.407	S	S	.	.			trans	-70.3	128.9	-156.7	-57.5	167.9	119.7	0	0	114.9	G254 K258	G254-E256 VanDerWaalsContact C-N 3.28Å; G254-E256 PolarHBondContact O-N 2.77Å; E256-K258 HydrophobicContact CB-CD 4.33Å; E256-K258 HydrophobicContact CB-CG 4.06Å; E256-K258 VanDerWaalsContact CD-NZ 3.31Å; E256-K258 PolarHBondContact O-N 2.91Å; E256-K258 IonicContact OE1-NZ 2.72Å; E256-K258 PolarHBondContact OE1-NZ 2.67Å; E256-K258 VanDerWaalsContact OE2-CE 3.22Å; E256-K258 WeakPolarHBondContact OE2-CE 3.37Å; E256-K258 IonicContact OE2-NZ 2.65Å; E256-K258 PolarHBondContact OE2-NZ 2.89Å
257	N	59.4	Low	66	Low	65 Å²	65	71.4 Å²	71.4	35%	0.348	44%	0.438	S	S	.	.			trans	-74	54.9	171.8	-71	49.5	0	0	0	113.3	L255 G259 I260 L373 N374	L255-N257 PolarHBondContact O-N 3.26Å; N257-G259 PolarHBondContact O-N 2.91Å; N257-G259 VanDerWaalsContact O-N 3.13Å; N257-I260 PolarHBondContact O-N 3.02Å; N257-L373 PolarHBondContact ND2-O 2.83Å; N257-N374 WeakPolarHBondContact CA-OD1 3.32Å; N257-N374 VanDerWaalsContact CB-OD1 3.29Å; N257-N374 WeakPolarHBondContact CB-OD1 3.45Å; N257-N374 PolarHBondContact ND2-OD1 2.83Å; N257-N374 VanDerWaalsContact ND2-OD1 3.16Å
258	K	57.3	Low	63.5	Low	117 Å²	117	72.3 Å²	72.3	51%	0.509	46%	0.461	S	S	.	.	H	α-helix	trans	-64.8	-15.3	-175.3	-84.6	175.4	170	157.1	0	115.2	E256 I260	E256-K258 HydrophobicContact CB-CD 4.33Å; E256-K258 HydrophobicContact CB-CG 4.06Å; E256-K258 VanDerWaalsContact CD-NZ 3.31Å; E256-K258 PolarHBondContact O-N 2.91Å; E256-K258 IonicContact OE1-NZ 2.72Å; E256-K258 PolarHBondContact OE1-NZ 2.67Å; E256-K258 VanDerWaalsContact OE2-CE 3.22Å; E256-K258 WeakPolarHBondContact OE2-CE 3.37Å; E256-K258 IonicContact OE2-NZ 2.65Å; E256-K258 PolarHBondContact OE2-NZ 2.89Å; K258-I260 VanDerWaalsContact C-N 3.28Å; K258-I260 PolarHBondContact O-N 3.21Å
259	G	47.7	Very low	61	Low	55 Å²	55	80.1 Å²	80.1	57%	0.567	50%	0.497	S	S	*	.	H	α-helix	trans	-62.5	-29.3	178.8	0	0	0	0	0	114.7	N257	N257-G259 PolarHBondContact O-N 2.91Å; N257-G259 VanDerWaalsContact O-N 3.13Å
260	I	49	Very low	58.4	Low	60 Å²	60	86.3 Å²	86.3	31%	0.308	52%	0.523	S	S	.	.	H	α-helix	trans	-84.1	-34.9	-172.1	-55.3	175.6	0	0	0	111.8	N257 K258	N257-I260 PolarHBondContact O-N 3.02Å; K258-I260 VanDerWaalsContact C-N 3.28Å; K258-I260 PolarHBondContact O-N 3.21Å
261	S	45.7	Very low	56.1	Low	92 Å²	92	88.3 Å²	88.3	64%	0.643	55%	0.554	S	S	*	*	H	α-helix	trans	-69.6	-34.1	-178	-56.4	0	0	0	0	113.3
262	S	44.7	Very low	53.9	Low	82 Å²	82	90.2 Å²	90.2	57%	0.573	58%	0.576	S	S	*	*	H	α-helix	trans	-76.9	-37.4	-179.8	-58.1	0	0	0	0	112.7	N264 A265 S266	S262-N264 PolarHBondContact O-N 2.97Å; S262-A265 PolarHBondContact O-N 3.36Å; S262-S266 PolarHBondContact O-N 2.86Å; S262-S266 PolarHBondContact O-OG 2.82Å
263	A	44.9	Very low	51.6	Low	64 Å²	64	94.2 Å²	94.2	53%	0.529	61%	0.606	S	S	.	*	H	α-helix	trans	-63.4	-37.5	-176.6	0	0	0	0	0	113.5	S266	A263-S266 PolarHBondContact O-OG 2.65Å
264	N	44.1	Very low	49	Very low	141 Å²	141	93.4 Å²	93.4	75%	0.754	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-9.3	179.2	-72.3	-23.8	0	0	0	113.8	S262	S262-N264 PolarHBondContact O-N 2.97Å
265	A	46.3	Very low	46.7	Very low	83 Å²	83	98.5 Å²	98.5	69%	0.686	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-24.2	176.3	0	0	0	0	0	112.9	S262 G267	S262-A265 PolarHBondContact O-N 3.36Å; A265-G267 PolarHBondContact O-N 3.09Å; A265-G267 VanDerWaalsContact O-N 3.12Å
266	S	45.7	Very low	44.9	Very low	91 Å²	91	101.9 Å²	101.9	64%	0.636	68%	0.675	S	S	*	*			trans	-81.7	27.4	179.6	50.7	0	0	0	0	114.6	S262 A263 G268	S262-S266 PolarHBondContact O-N 2.86Å; S262-S266 PolarHBondContact O-OG 2.82Å; A263-S266 PolarHBondContact O-OG 2.65Å; S266-G268 VanDerWaalsContact C-N 3.26Å; S266-G268 PolarHBondContact O-N 2.72Å
267	G	37.9	Very low	43.8	Very low	78 Å²	78	107.2 Å²	107.2	80%	0.804	69%	0.69	S	S	*	*	S	Bend	trans	-76	65.9	175.9	0	0	0	0	0	113.4	A265	A265-G267 PolarHBondContact O-N 3.09Å; A265-G267 VanDerWaalsContact O-N 3.12Å
268	G	36.3	Very low	43.2	Very low	63 Å²	63	112.9 Å²	112.9	65%	0.649	72%	0.715	S	S	*	*	S	Bend	trans	113.7	75	167.2	0	0	0	0	0	116.3	S266	S266-G268 VanDerWaalsContact C-N 3.26Å; S266-G268 PolarHBondContact O-N 2.72Å
269	Q	40.9	Very low	42.9	Very low	196 Å²	196	113 Å²	113	92%	0.916	72%	0.717	S	S	*	*			trans	-154.9	113.9	143.9	-124	159.9	86	0	0	111.2
270	E	37.4	Very low	43.4	Very low	204 Å²	204	113.6 Å²	113.6	95%	0.953	71%	0.712	S	S	*	*			trans	-81.3	122	174.1	-63.5	176.1	-178.2	0	0	109.3
271	G	39.2	Very low	44.7	Very low	78 Å²	78	112.6 Å²	112.6	80%	0.804	72%	0.716	S	S	*	*			trans	111.5	96.2	163.4	0	0	0	0	0	116.8
272	S	40.2	Very low	46.6	Very low	121 Å²	121	108.6 Å²	108.6	85%	0.846	69%	0.689	S	S	*	*				-164.3	128.5	122.4	-169.3	0	0	0	0	110.4
273	S	39.2	Very low	48.8	Very low	122 Å²	122	106.7 Å²	106.7	85%	0.853	67%	0.671	S	S	*	*			trans	-76.6	123.6	170.7	51.2	0	0	0	0	110.8
274	G	34.9	Very low	51.2	Low	72 Å²	72	103.7 Å²	103.7	74%	0.742	65%	0.646	S	S	*	*	S	Bend	trans	167.1	96.7	172	0	0	0	0	0	114.1
275	D	38.5	Very low	53.5	Low	130 Å²	130	99.7 Å²	99.7	70%	0.695	63%	0.626	S	S	*	*			trans	54.8	71.8	160.7	-148.5	12.2	0	0	0	117	R277	D275-R277 PolarHBondContact O-N 2.86Å; D275-R277 WeakPolarHBondContact OD1-CB 3.35Å; D275-R277 VanDerWaalsContact OD1-CD 3.29Å; D275-R277 WeakPolarHBondContact OD1-CD 3.47Å; D275-R277 VanDerWaalsContact OD1-CG 3.28Å; D275-R277 WeakPolarHBondContact OD1-CG 3.27Å
276	S	43.6	Very low	55.8	Low	127 Å²	127	99.8 Å²	99.8	89%	0.888	62%	0.618	S	S	*	*			trans	-74	44.9	170	65.9	0	0	0	0	112.8	E278	S276-E278 VanDerWaalsContact C-N 3.29Å
277	R	46.6	Very low	58.1	Low	210 Å²	210	97.7 Å²	97.7	79%	0.792	60%	0.603	S	S	*	*			trans	-94.7	40.3	171.9	-78.3	-175.9	161	-170.6	-7.1	111.5	D275 E279	D275-R277 PolarHBondContact O-N 2.86Å; D275-R277 WeakPolarHBondContact OD1-CB 3.35Å; D275-R277 VanDerWaalsContact OD1-CD 3.29Å; D275-R277 WeakPolarHBondContact OD1-CD 3.47Å; D275-R277 VanDerWaalsContact OD1-CG 3.28Å; D275-R277 WeakPolarHBondContact OD1-CG 3.27Å; R277-E279 PolarHBondContact O-N 2.64Å
278	E	46.6	Very low	60.7	Low	185 Å²	185	100.1 Å²	100.1	86%	0.864	60%	0.595	S	S	*	*			trans	-73.7	73.4	157.7	-68.5	-167.2	158.3	0	0	108.1	S276 C280	S276-E278 VanDerWaalsContact C-N 3.29Å; E278-C280 PolarHBondContact O-N 2.76Å; E278-C280 VanDerWaalsContact O-N 3.09Å
279	E	52	Low	63.4	Low	120 Å²	120	100.5 Å²	100.5	56%	0.561	59%	0.588	S	S	*	*			trans	-35.6	109.7	173.8	-163.4	166.5	-99	0	0	109	R277 G281 E283	R277-E279 PolarHBondContact O-N 2.64Å; E279-G281 PolarHBondContact O-N 2.81Å; E279-E283 HydrophobicContact CG-CG 4.41Å
280	C	58.7	Low	65.8	Low	66 Å²	66	96 Å²	96	45%	0.446	57%	0.567	S	S	.	*			trans	-52.6	119.6	-168.8	-174.8	0	0	0	0	107.9	E278 A282 E283 W291	E278-C280 PolarHBondContact O-N 2.76Å; E278-C280 VanDerWaalsContact O-N 3.09Å; C280-A282 PolarHBondContact O-N 2.73Å; C280-E283 PolarHBondContact O-N 2.87Å; C280-W291 HydrophobicContact CB-CH2 4.3Å; C280-W291 HydrophobicContact CB-CZ3 4.29Å
281	G	75.3	Confident	68.3	Low	39 Å²	39	90.4 Å²	90.4	40%	0.402	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	35.9	-158.7	0	0	0	0	0	116.2	E279 R292	E279-G281 PolarHBondContact O-N 2.81Å; G281-R292 VanDerWaalsContact C-NH2 3.26Å; G281-R292 PolarHBondContact O-NH1 2.71Å; G281-R292 PolarHBondContact O-NH2 3.25Å
282	A	85.9	Confident	70.9	Confident	8 Å²	8	88.5 Å²	88.5	7%	0.066	51%	0.506	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	2.8	179.5	0	0	0	0	0	113.2	C280 W291 R292 I370	C280-A282 PolarHBondContact O-N 2.73Å; A282-W291 HydrophobicContact CB-CE3 3.93Å; A282-W291 HydrophobicContact CB-CZ3 4Å; A282-R292 WeakPolarHBondContact O-CD 3.47Å; A282-R292 WeakPolarHBondContact O-CG 3.39Å; A282-R292 PolarHBondContact O-N 2.64Å; A282-I370 HydrophobicContact CB-CB 4.1Å; A282-I370 HydrophobicContact CB-CD1 3.61Å; A282-I370 HydrophobicContact CB-CG1 3.63Å
283	E	91.2	Very high	73.4	Confident	43 Å²	43	83.8 Å²	83.8	20%	0.201	47%	0.471	C	S	.	.	B	Isolated β-bridge	trans	-73.7	150.3	171.6	-67.8	-168	-170.6	0	0	113.5	E279 C280 V285 M288 S289 W291 R292	E279-E283 HydrophobicContact CG-CG 4.41Å; C280-E283 PolarHBondContact O-N 2.87Å; E283-V285 PolarHBondContact O-N 3.35Å; E283-M288 VanDerWaalsContact OE2-C 3.27Å; E283-S289 PolarHBondContact OE2-N 3.14Å; E283-W291 HydrophobicContact CG-CE3 4.43Å; E283-W291 HydrophobicContact CG-CZ3 4.42Å; E283-R292 VanDerWaalsContact O-CZ 3.24Å; E283-R292 PolarHBondContact O-NE 3.22Å; E283-R292 PolarHBondContact O-NH2 2.89Å
284	C	94	Very high	76	Confident	1 Å²	1	78 Å²	78	1%	0.007	43%	0.43	C	S	.	.			trans	-58.6	122.2	178.9	174.2	0	0	0	0	112.3	V286 C287 M288 E290 C305 C308	C284-V286 PolarHBondContact O-N 3.09Å; C284-C287 PolarHBondContact O-N 3.02Å; C284-C287 VanDerWaalsContact SG-SG 3.67Å; C284-M288 PolarHBondContact O-N 3.49Å; C284-E290 WeakPolarHBondContact CB-O 3.39Å; C284-E290 PolarHBondContact N-O 2.81Å; C284-C305 HydrophobicContact CB-CB 3.94Å; C284-C305 PolarHBondContact SG-N 3.03Å; C284-C305 VanDerWaalsContact SG-SG 3.69Å; C284-C308 VanDerWaalsContact SG-SG 3.62Å
285	V	93.9	Very high	78.7	Confident	56 Å²	56	75 Å²	75	34%	0.339	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-5.2	-176.8	-52	0	0	0	0	114.6	E283 C303 I304 P320 I321	E283-V285 PolarHBondContact O-N 3.35Å; V285-C303 HydrophobicContact CG1-CB 4.46Å; V285-C303 HydrophobicContact CG2-CB 4.28Å; V285-C303 WeakPolarHBondContact CG2-O 3.39Å; V285-C303 PolarHBondContact N-O 2.9Å; V285-I304 HydrophobicContact CG2-CG2 4.35Å; V285-P320 HydrophobicContact CG2-CB 4.04Å; V285-I321 HydrophobicContact CG1-CD1 4.35Å; V285-I321 HydrophobicContact CG2-CD1 4.43Å
286	V	93.7	Very high	81.3	Confident	86 Å²	86	68.9 Å²	68.9	52%	0.521	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-37.8	-178.5	177.2	0	0	0	0	112.3	C284 I304 C308	C284-V286 PolarHBondContact O-N 3.09Å; V286-I304 HydrophobicContact CG2-CG2 3.76Å; V286-C308 HydrophobicContact CB-CB 4.13Å; V286-C308 HydrophobicContact CG1-CB 4.23Å
287	C	94.9	Very high	83.5	Confident	47 Å²	47	63 Å²	63	32%	0.318	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-16.6	-177.1	70.3	0	0	0	0	115.1	C284 S289	C284-C287 PolarHBondContact O-N 3.02Å; C284-C287 VanDerWaalsContact SG-SG 3.67Å; C287-S289 VanDerWaalsContact C-N 3.3Å; C287-S289 PolarHBondContact O-N 2.98Å; C287-S289 PolarHBondContact SG-OG 2.7Å
288	M	92.7	Very high	85.4	Confident	129 Å²	129	55.1 Å²	55.1	64%	0.635	30%	0.299	S	S	*	.	S	Bend	trans	49.5	52	179.2	-58.1	164.6	-179.9	0	0	111.3	E283 C284	E283-M288 VanDerWaalsContact OE2-C 3.27Å; C284-M288 PolarHBondContact O-N 3.49Å
289	S	91.5	Very high	87.5	Confident	71 Å²	71	47.3 Å²	47.3	50%	0.497	27%	0.265	S	S	.	.	S	Bend	trans	-158.4	-42.4	-174.8	76.4	0	0	0	0	113.4	E283 C287	E283-S289 PolarHBondContact OE2-N 3.14Å; C287-S289 VanDerWaalsContact C-N 3.3Å; C287-S289 PolarHBondContact O-N 2.98Å; C287-S289 PolarHBondContact SG-OG 2.7Å
290	E	91.8	Very high	89.4	Confident	101 Å²	101	43.2 Å²	43.2	47%	0.472	24%	0.244	S	C	.	.	S	Bend	trans	-103.8	146	-179.2	-65.3	-58.8	140.8	0	0	110.5	C284 C305	C284-E290 WeakPolarHBondContact CB-O 3.39Å; C284-E290 PolarHBondContact N-O 2.81Å; E290-C305 HydrophobicContact CB-CB 3.51Å; E290-C305 HydrophobicContact CG-CB 4.43Å
291	W	90.8	Very high	91	Very high	86 Å²	86	41.5 Å²	41.5	33%	0.326	23%	0.23	S	C	.	.	B	Isolated β-bridge	trans	-64	150.3	174.5	-58	100.6	0	0	0	112.3	C280 A282 E283 D293 C305 I370 I377	C280-W291 HydrophobicContact CB-CH2 4.3Å; C280-W291 HydrophobicContact CB-CZ3 4.29Å; A282-W291 HydrophobicContact CB-CE3 3.93Å; A282-W291 HydrophobicContact CB-CZ3 4Å; E283-W291 HydrophobicContact CG-CE3 4.43Å; E283-W291 HydrophobicContact CG-CZ3 4.42Å; W291-D293 PolarHBondContact O-N 3.18Å; W291-C305 WeakPolarHBondContact O-CB 3.34Å; W291-I370 HydrophobicContact CD2-CG2 3.95Å; W291-I370 HydrophobicContact CE3-CG2 3.66Å; W291-I370 HydrophobicContact CG-CG2 4.45Å; W291-I370 HydrophobicContact CZ3-CG2 4.06Å; W291-I377 HydrophobicContact CH2-CD1 3.62Å; W291-I377 HydrophobicContact CZ2-CD1 3.95Å; W291-I377 HydrophobicContact CZ3-CD1 4.2Å
292	R	93	Very high	91.9	Very high	38 Å²	38	40 Å²	40	14%	0.143	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-70.7	125.1	172.4	-59.6	161.3	-167.3	156.3	21.6	110.1	G254 G281 A282 E283 L302	G254-R292 PolarHBondContact O-NH1 2.74Å; G281-R292 VanDerWaalsContact C-NH2 3.26Å; G281-R292 PolarHBondContact O-NH1 2.71Å; G281-R292 PolarHBondContact O-NH2 3.25Å; A282-R292 WeakPolarHBondContact O-CD 3.47Å; A282-R292 WeakPolarHBondContact O-CG 3.39Å; A282-R292 PolarHBondContact O-N 2.64Å; E283-R292 VanDerWaalsContact O-CZ 3.24Å; E283-R292 PolarHBondContact O-NE 3.22Å; E283-R292 PolarHBondContact O-NH2 2.89Å; R292-L302 HydrophobicContact CB-CD1 3.83Å; R292-L302 HydrophobicContact CB-CD2 4.36Å; R292-L302 HydrophobicContact CB-CG 3.75Å; R292-L302 WeakPolarHBondContact CD-O 3.46Å
293	D	92.8	Very high	92.2	Very high	23 Å²	23	39.8 Å²	39.8	12%	0.123	21%	0.21	C	C	.	.			trans	-130.1	-2.2	174.4	71.4	-10.2	0	0	0	112	W291 I304 C305 S306 Q331 V332	W291-D293 PolarHBondContact O-N 3.18Å; D293-I304 PolarHBondContact N-O 2.89Å; D293-C305 VanDerWaalsContact OD1-C 3.24Å; D293-C305 VanDerWaalsContact OD1-CA 3.29Å; D293-C305 WeakPolarHBondContact OD1-CA 3.39Å; D293-S306 WeakPolarHBondContact OD1-CA 3.38Å; D293-S306 WeakPolarHBondContact OD1-CB 3.38Å; D293-S306 PolarHBondContact OD1-N 2.89Å; D293-S306 WeakPolarHBondContact OD2-CB 3.3Å; D293-S306 PolarHBondContact OD2-OG 2.86Å; D293-Q331 CarbonylContact O-C 3.58Å; D293-Q331 WeakPolarHBondContact O-CA 3.28Å; D293-Q331 PolarHBondContact OD2-NE2 3.24Å; D293-V332 PolarHBondContact O-N 3.18Å
294	T	93	Very high	92.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	123.2	-170.5	-56.4	0	0	0	0	112.9	I304 S306 A309 L329 L330	T294-I304 WeakPolarHBondContact CB-O 3.37Å; T294-I304 HydrophobicContact CG2-CG1 4.27Å; T294-I304 PolarHBondContact N-O 3.38Å; T294-S306 WeakPolarHBondContact OG1-CA 3.38Å; T294-A309 HydrophobicContact CG2-CB 3.72Å; T294-L329 HydrophobicContact CG2-CB 3.9Å; T294-L330 WeakPolarHBondContact CA-O 3.39Å
295	L	92.5	Very high	92.4	Very high	10 Å²	10	37.8 Å²	37.8	5%	0.052	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	143.3	173.9	-66.1	165.8	0	0	0	111.2	F54 V252 L302 L329 L330 V332	F54-L295 HydrophobicContact CE2-CD1 4.39Å; F54-L295 HydrophobicContact CZ-CD1 4.17Å; V252-L295 HydrophobicContact CB-CD2 4.31Å; V252-L295 HydrophobicContact CG1-CD2 3.38Å; V252-L295 HydrophobicContact CG2-CD2 4Å; L295-L302 HydrophobicContact CD2-CB 3.74Å; L295-L302 HydrophobicContact CD2-CD1 4.42Å; L295-L329 WeakPolarHBondContact O-CA 3.42Å; L295-L330 HydrophobicContact CB-CB 4.13Å; L295-L330 WeakPolarHBondContact CB-O 3.46Å; L295-L330 HydrophobicContact CD1-CD2 3.82Å; L295-L330 HydrophobicContact CD1-CG 4.18Å; L295-L330 PolarHBondContact N-O 3.44Å; L295-L330 PolarHBondContact O-N 2.95Å; L295-V332 HydrophobicContact CD1-CG2 3.66Å; L295-V332 HydrophobicContact CG-CG2 4.33Å
296	I	92.2	Very high	92.4	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	118.6	176	-56.2	-170.1	0	0	0	110.4	C299 R300 H301 C303 I304 L312 C319 P320 F326 L329	I296-C299 CarbonylContact O-C 3.54Å; I296-C299 PolarHBondContact O-N 3.25Å; I296-C299 VanDerWaalsContact O-N 3.16Å; I296-C299 PolarHBondContact O-SG 2.88Å; I296-R300 PolarHBondContact O-N 3.48Å; I296-H301 PolarHBondContact N-O 3.04Å; I296-H301 VanDerWaalsContact N-O 3.08Å; I296-C303 WeakPolarHBondContact CD1-SG 3.46Å; I296-I304 HydrophobicContact CD1-CD1 4.14Å; I296-I304 HydrophobicContact CG1-CD1 4.41Å; I296-L312 HydrophobicContact CD1-CD2 4.16Å; I296-C319 HydrophobicContact CD1-CB 4.3Å; I296-C319 HydrophobicContact CG2-CB 4.03Å; I296-P320 VanDerWaalsContact CD1-CD 3.44Å; I296-F326 HydrophobicContact CG2-CB 3.24Å; I296-F326 HydrophobicContact CG2-CD1 3.88Å; I296-F326 HydrophobicContact CG2-CG 3.72Å; I296-L329 HydrophobicContact CB-CD2 4.29Å; I296-L329 HydrophobicContact CD1-CD2 4.49Å; I296-L329 HydrophobicContact CG1-CD2 3.84Å; I296-L329 HydrophobicContact CG2-CD2 4.2Å
297	L	89.5	Confident	92.4	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.021	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	138.7	-176.4	-52.3	-173.5	0	0	0	112.1	L39 F54 F326 R327 A328 L330	L39-L297 HydrophobicContact CD2-CD1 3.64Å; F54-L297 HydrophobicContact CD2-CD2 3.88Å; F54-L297 HydrophobicContact CE2-CD2 3.52Å; L297-F326 CarbonylContact O-C 3.54Å; L297-F326 WeakPolarHBondContact O-CA 3.46Å; L297-F326 VanDerWaalsContact O-CB 3.3Å; L297-F326 WeakPolarHBondContact O-CB 3.34Å; L297-R327 PolarHBondContact O-N 2.85Å; L297-A328 WeakPolarHBondContact CB-O 3.37Å; L297-A328 HydrophobicContact CD1-CB 4.3Å; L297-A328 PolarHBondContact N-O 3.43Å; L297-L330 HydrophobicContact CD1-CB 4.14Å; L297-L330 HydrophobicContact CD2-CB 4.49Å; L297-L330 HydrophobicContact CG-CB 4.35Å
298	P	86.9	Confident	92.4	Very high	45 Å²	45	34.8 Å²	34.8	29%	0.292	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	cis	-91.3	4.4	8.4	36.1	-37	0	0	0	114.7	R300	P298-R300 VanDerWaalsContact C-N 3.33Å; P298-R300 PolarHBondContact O-N 3.19Å
299	C	91.2	Very high	92.4	Very high	21 Å²	21	28.8 Å²	28.8	14%	0.142	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-8.5	-169	74.5	0	0	0	0	116.2	I296 H301 C322	I296-C299 CarbonylContact O-C 3.54Å; I296-C299 PolarHBondContact O-N 3.25Å; I296-C299 VanDerWaalsContact O-N 3.16Å; I296-C299 PolarHBondContact O-SG 2.88Å; C299-H301 VanDerWaalsContact C-N 3.26Å; C299-H301 PolarHBondContact O-N 2.86Å; C299-H301 PolarHBondContact O-ND1 2.59Å; C299-H301 PolarHBondContact SG-ND1 3.34Å; C299-C322 VanDerWaalsContact CB-SG 3.58Å
300	R	91.9	Very high	92.4	Very high	34 Å²	34	30.1 Å²	30.1	13%	0.128	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	22.6	175.1	-57.9	175.9	-71.5	118.3	1.7	115.7	F54 E251 Y253 I296 P298	F54-R300 HydrophobicContact CD1-CG 3.97Å; F54-R300 HydrophobicContact CE1-CB 4.4Å; F54-R300 VanDerWaalsContact CE1-CD 3.47Å; F54-R300 HydrophobicContact CE1-CG 3.64Å; F54-R300 HydrophobicContact CE2-CG 4.29Å; F54-R300 HydrophobicContact CG-CG 4.43Å; F54-R300 HydrophobicContact CZ-CB 4.42Å; F54-R300 HydrophobicContact CZ-CG 3.82Å; E251-R300 WeakPolarHBondContact O-CD 3.45Å; E251-R300 PolarHBondContact O-NH1 3.33Å; Y253-R300 HydrophobicContact CD2-CB 4.32Å; Y253-R300 PolarHBondContact N-O 2.8Å; Y253-R300 PolarHBondContact OH-NH1 2.73Å; Y253-R300 PolarHBondContact OH-NH2 3.08Å; I296-R300 PolarHBondContact O-N 3.48Å; P298-R300 VanDerWaalsContact C-N 3.33Å; P298-R300 PolarHBondContact O-N 3.19Å
301	H	92.8	Very high	92.3	Very high	30 Å²	30	28.1 Å²	28.1	14%	0.139	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	115.6	173.5	-68.8	94.9	0	0	0	111.3	I296 C299 C303 I321	I296-H301 PolarHBondContact N-O 3.04Å; I296-H301 VanDerWaalsContact N-O 3.08Å; C299-H301 VanDerWaalsContact C-N 3.26Å; C299-H301 PolarHBondContact O-N 2.86Å; C299-H301 PolarHBondContact O-ND1 2.59Å; C299-H301 PolarHBondContact SG-ND1 3.34Å; H301-C303 PolarHBondContact O-N 2.84Å; H301-I321 HydrophobicContact CB-CB 4.47Å; H301-I321 HydrophobicContact CB-CG1 4.22Å
302	L	93.3	Very high	92.3	Very high	8 Å²	8	25.2 Å²	25.2	4%	0.042	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	104	162.3	179.7	62.9	0	0	0	107.5	V252 Y253 L255 R292 L295 L369	V252-L302 HydrophobicContact CG1-CB 3.66Å; V252-L302 HydrophobicContact CG1-CD2 4.49Å; Y253-L302 PolarHBondContact O-N 3.36Å; L255-L302 HydrophobicContact CD1-CD2 3.35Å; R292-L302 HydrophobicContact CB-CD1 3.83Å; R292-L302 HydrophobicContact CB-CD2 4.36Å; R292-L302 HydrophobicContact CB-CG 3.75Å; R292-L302 WeakPolarHBondContact CD-O 3.46Å; L295-L302 HydrophobicContact CD2-CB 3.74Å; L295-L302 HydrophobicContact CD2-CD1 4.42Å; L302-L369 HydrophobicContact CD1-CD2 4.49Å; L302-L369 HydrophobicContact CD2-CD2 3.82Å
303	C	93.3	Very high	92	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.014	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	-13.5	-171.2	55.8	0	0	0	0	115.2	V285 I296 H301 I321	V285-C303 HydrophobicContact CG1-CB 4.46Å; V285-C303 HydrophobicContact CG2-CB 4.28Å; V285-C303 WeakPolarHBondContact CG2-O 3.39Å; V285-C303 PolarHBondContact N-O 2.9Å; I296-C303 WeakPolarHBondContact CD1-SG 3.46Å; H301-C303 PolarHBondContact O-N 2.84Å; C303-I321 HydrophobicContact CB-CD1 3.94Å; C303-I321 HydrophobicContact CB-CG1 3.68Å
304	I	94.6	Very high	91.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	155.2	-177.6	65.4	-173.8	0	0	0	112	V285 V286 D293 T294 I296 C308 A309 L312 P320	V285-I304 HydrophobicContact CG2-CG2 4.35Å; V286-I304 HydrophobicContact CG2-CG2 3.76Å; D293-I304 PolarHBondContact N-O 2.89Å; T294-I304 WeakPolarHBondContact CB-O 3.37Å; T294-I304 HydrophobicContact CG2-CG1 4.27Å; T294-I304 PolarHBondContact N-O 3.38Å; I296-I304 HydrophobicContact CD1-CD1 4.14Å; I296-I304 HydrophobicContact CG1-CD1 4.41Å; I304-C308 HydrophobicContact CB-CB 4.26Å; I304-A309 HydrophobicContact CD1-CB 3.8Å; I304-A309 HydrophobicContact CG1-CB 4.22Å; I304-L312 HydrophobicContact CD1-CD2 3.62Å; I304-P320 HydrophobicContact CG2-CG 4.33Å
305	C	94.8	Very high	91.2	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.02	19%	0.193	C	C	.	.			trans	-81.3	160.2	165	71.5	0	0	0	0	110.8	C284 E290 W291 D293 T307 C308 A309	C284-C305 HydrophobicContact CB-CB 3.94Å; C284-C305 PolarHBondContact SG-N 3.03Å; C284-C305 VanDerWaalsContact SG-SG 3.69Å; E290-C305 HydrophobicContact CB-CB 3.51Å; E290-C305 HydrophobicContact CG-CB 4.43Å; W291-C305 WeakPolarHBondContact O-CB 3.34Å; D293-C305 VanDerWaalsContact OD1-C 3.24Å; D293-C305 VanDerWaalsContact OD1-CA 3.29Å; D293-C305 WeakPolarHBondContact OD1-CA 3.39Å; C305-T307 VanDerWaalsContact C-N 3.32Å; C305-T307 PolarHBondContact O-N 2.81Å; C305-C308 CarbonylContact O-C 3.55Å; C305-C308 WeakPolarHBondContact O-CA 3.43Å; C305-C308 WeakPolarHBondContact O-CB 3.29Å; C305-C308 PolarHBondContact O-N 3.2Å; C305-C308 PolarHBondContact SG-N 2.94Å; C305-A309 PolarHBondContact O-N 2.93Å
306	S	92.8	Very high	90.7	Very high	19 Å²	19	41.4 Å²	41.4	13%	0.133	21%	0.212	C	C	.	.	H	α-helix	trans	-65.5	-30.5	-175.5	46.8	0	0	0	0	114.1	D293 T294 C308 A309 Q310 Q331	D293-S306 WeakPolarHBondContact OD1-CA 3.38Å; D293-S306 WeakPolarHBondContact OD1-CB 3.38Å; D293-S306 PolarHBondContact OD1-N 2.89Å; D293-S306 WeakPolarHBondContact OD2-CB 3.3Å; D293-S306 PolarHBondContact OD2-OG 2.86Å; T294-S306 WeakPolarHBondContact OG1-CA 3.38Å; S306-C308 VanDerWaalsContact C-N 3.35Å; S306-A309 WeakPolarHBondContact O-CB 3.48Å; S306-A309 PolarHBondContact O-N 3.1Å; S306-Q310 WeakPolarHBondContact O-CG 3.42Å; S306-Q310 PolarHBondContact O-N 2.84Å; S306-Q331 PolarHBondContact OG-NE2 2.86Å
307	T	93.7	Very high	90.4	Very high	91 Å²	91	45.1 Å²	45.1	56%	0.558	23%	0.232	S	C	*	.	H	α-helix	trans	-62.3	-42.6	170.5	-49.8	0	0	0	0	111.4	C305 S311	C305-T307 VanDerWaalsContact C-N 3.32Å; C305-T307 PolarHBondContact O-N 2.81Å; T307-S311 PolarHBondContact O-N 2.83Å
308	C	95	Very high	90.6	Very high	16 Å²	16	48 Å²	48	11%	0.108	25%	0.247	C	C	.	.	H	α-helix	trans	-70.9	-36	174.5	-72.9	0	0	0	0	112	C284 V286 I304 C305 S306 Q310 S311 L312	C284-C308 VanDerWaalsContact SG-SG 3.62Å; V286-C308 HydrophobicContact CB-CB 4.13Å; V286-C308 HydrophobicContact CG1-CB 4.23Å; I304-C308 HydrophobicContact CB-CB 4.26Å; C305-C308 CarbonylContact O-C 3.55Å; C305-C308 WeakPolarHBondContact O-CA 3.43Å; C305-C308 WeakPolarHBondContact O-CB 3.29Å; C305-C308 PolarHBondContact O-N 3.2Å; C305-C308 PolarHBondContact SG-N 2.94Å; S306-C308 VanDerWaalsContact C-N 3.35Å; C308-Q310 PolarHBondContact O-N 3.31Å; C308-S311 PolarHBondContact O-N 3.24Å; C308-S311 VanDerWaalsContact O-N 3.17Å; C308-L312 WeakPolarHBondContact O-CB 3.45Å; C308-L312 PolarHBondContact O-N 3.48Å
309	A	93.6	Very high	90.9	Very high	3 Å²	3	45.9 Å²	45.9	3%	0.025	23%	0.234	C	C	.	.	H	α-helix	trans	-59.3	-44.8	175.4	0	0	0	0	0	112.5	T294 I304 C305 S306 S311 L312 R313 L329	T294-A309 HydrophobicContact CG2-CB 3.72Å; I304-A309 HydrophobicContact CD1-CB 3.8Å; I304-A309 HydrophobicContact CG1-CB 4.22Å; C305-A309 PolarHBondContact O-N 2.93Å; S306-A309 WeakPolarHBondContact O-CB 3.48Å; S306-A309 PolarHBondContact O-N 3.1Å; A309-S311 VanDerWaalsContact C-N 3.29Å; A309-S311 PolarHBondContact O-N 3.04Å; A309-L312 PolarHBondContact O-N 3.06Å; A309-R313 PolarHBondContact O-N 2.88Å; A309-R313 VanDerWaalsContact O-N 3.1Å; A309-L329 HydrophobicContact CB-CD1 3.91Å; A309-L329 WeakPolarHBondContact O-CD1 3.32Å
310	Q	90.1	Very high	91.1	Very high	99 Å²	99	47.5 Å²	47.5	46%	0.463	24%	0.244	S	C	.	.	H	α-helix	trans	-59.6	-38.8	174.4	-71.3	174.7	28.8	0	0	112.2	S306 C308 R313 Y314	S306-Q310 WeakPolarHBondContact O-CG 3.42Å; S306-Q310 PolarHBondContact O-N 2.84Å; C308-Q310 PolarHBondContact O-N 3.31Å; Q310-R313 WeakPolarHBondContact O-CG 3.29Å; Q310-Y314 WeakPolarHBondContact O-CD2 3.48Å; Q310-Y314 WeakPolarHBondContact O-CE2 3.39Å
311	S	90.5	Very high	91.2	Very high	58 Å²	58	50.1 Å²	50.1	41%	0.406	26%	0.26	S	S	.	.	H	α-helix	trans	-72.3	-37.3	174.7	-72	0	0	0	0	112.9	T307 C308 A309 K315	T307-S311 PolarHBondContact O-N 2.83Å; C308-S311 PolarHBondContact O-N 3.24Å; C308-S311 VanDerWaalsContact O-N 3.17Å; A309-S311 VanDerWaalsContact C-N 3.29Å; A309-S311 PolarHBondContact O-N 3.04Å; S311-K315 WeakPolarHBondContact O-CG 3.33Å; S311-K315 PolarHBondContact O-N 3.38Å
312	L	90.1	Very high	91.2	Very high	26 Å²	26	51.4 Å²	51.4	14%	0.136	27%	0.271	C	S	.	.	H	α-helix	trans	-64.2	-50.6	-176.1	-172.4	67	0	0	0	110.6	I296 I304 C308 A309 Y314 K315 V316 F326	I296-L312 HydrophobicContact CD1-CD2 4.16Å; I304-L312 HydrophobicContact CD1-CD2 3.62Å; C308-L312 WeakPolarHBondContact O-CB 3.45Å; C308-L312 PolarHBondContact O-N 3.48Å; A309-L312 PolarHBondContact O-N 3.06Å; L312-Y314 PolarHBondContact O-N 3.13Å; L312-K315 PolarHBondContact O-N 2.85Å; L312-V316 HydrophobicContact CD1-CB 4.08Å; L312-V316 PolarHBondContact O-N 3.34Å; L312-F326 HydrophobicContact CD2-CE1 3.66Å; L312-F326 HydrophobicContact CD2-CZ 4.03Å; L312-F326 HydrophobicContact CG-CE1 3.8Å; L312-F326 HydrophobicContact CG-CZ 3.94Å
313	R	87.3	Confident	91.3	Very high	51 Å²	51	60.7 Å²	60.7	19%	0.192	31%	0.306	C	S	.	.	H	α-helix	trans	-55.4	-24.9	-176.8	67	173.6	-174.8	-178.7	-0.5	115.1	A309 Q310 L329 L436	A309-R313 PolarHBondContact O-N 2.88Å; A309-R313 VanDerWaalsContact O-N 3.1Å; Q310-R313 WeakPolarHBondContact O-CG 3.29Å; R313-L329 HydrophobicContact CB-CD1 4.08Å; R313-L436 HydrophobicContact CB-CD2 4.17Å; R313-L436 WeakPolarHBondContact O-CD2 3.39Å
314	Y	84.5	Confident	91.2	Very high	129 Å²	129	62.4 Å²	62.4	51%	0.506	32%	0.32	S	S	.	.	H	α-helix	trans	-93.1	-23.7	176.8	-60.3	-58.2	0	0	0	114.1	Q310 L312	Q310-Y314 WeakPolarHBondContact O-CD2 3.48Å; Q310-Y314 WeakPolarHBondContact O-CE2 3.39Å; L312-Y314 PolarHBondContact O-N 3.13Å
315	K	85	Confident	91	Very high	156 Å²	156	66.6 Å²	66.6	68%	0.678	35%	0.347	S	S	*	.	H	α-helix	trans	-100.2	-50	-173	-66.3	178.3	-178	179.1	0	112.9	S311 L312	S311-K315 WeakPolarHBondContact O-CG 3.33Å; S311-K315 PolarHBondContact O-N 3.38Å; L312-K315 PolarHBondContact O-N 2.85Å
316	V	82.5	Confident	90.7	Very high	74 Å²	74	66.7 Å²	66.7	45%	0.448	35%	0.347	S	S	.	.			trans	-143.7	130.5	-169.9	-172.4	0	0	0	0	109.5	L312 N318 F326	L312-V316 HydrophobicContact CD1-CB 4.08Å; L312-V316 PolarHBondContact O-N 3.34Å; V316-N318 HydrophobicContact CG1-CB 4.16Å; V316-F326 VanDerWaalsContact O-CE1 3.26Å; V316-F326 WeakPolarHBondContact O-CE1 3.35Å; V316-F326 WeakPolarHBondContact O-CZ 3.48Å
317	N	85.6	Confident	90.3	Very high	79 Å²	79	71.1 Å²	71.1	42%	0.422	36%	0.361	S	S	.	.			trans	-100.2	27.7	-177.8	61.4	-32.1	0	0	0	113.4	P325 F326 L436	N317-P325 CarbonylContact O-C 3.51Å; N317-P325 WeakPolarHBondContact O-CA 3.44Å; N317-F326 WeakPolarHBondContact O-CD1 3.38Å; N317-F326 PolarHBondContact O-N 3.13Å; N317-L436 HydrophobicContact CB-CD1 3.84Å; N317-L436 HydrophobicContact CB-CD2 4.09Å
318	N	93.5	Very high	90	Very high	63 Å²	63	66.8 Å²	66.8	34%	0.337	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-120.9	143	-178.6	-63.3	77.1	0	0	0	111.2	V316 R323 A324	V316-N318 HydrophobicContact CG1-CB 4.16Å; N318-R323 PolarHBondContact ND2-O 3.26Å; N318-A324 WeakPolarHBondContact CA-O 3.25Å
319	C	93.5	Very high	89.8	Confident	2 Å²	2	66 Å²	66	1%	0.014	33%	0.33	C	S	.	.			trans	-64	130	172.8	177.7	0	0	0	0	111	I296 I321 R323 A324	I296-C319 HydrophobicContact CD1-CB 4.3Å; I296-C319 HydrophobicContact CG2-CB 4.03Å; C319-I321 PolarHBondContact O-N 3.49Å; C319-I321 PolarHBondContact SG-N 2.91Å; C319-I321 VanDerWaalsContact SG-N 3.41Å; C319-R323 WeakPolarHBondContact O-CA 3.28Å; C319-R323 PolarHBondContact O-N 3.28Å; C319-A324 PolarHBondContact N-O 2.71Å
320	P	94.1	Very high	89.6	Confident	55 Å²	55	66.1 Å²	66.1	36%	0.357	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-29.9	176	-27	36.3	0	0	0	114.4	V285 I296 I304	V285-P320 HydrophobicContact CG2-CB 4.04Å; I296-P320 VanDerWaalsContact CD1-CD 3.44Å; I304-P320 HydrophobicContact CG2-CG 4.33Å
321	I	94	Very high	89.7	Confident	89 Å²	89	61.8 Å²	61.8	46%	0.456	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-64.3	-175.9	-50.1	-57.2	0	0	0	111.5	V285 H301 C303 C319	V285-I321 HydrophobicContact CG1-CD1 4.35Å; V285-I321 HydrophobicContact CG2-CD1 4.43Å; H301-I321 HydrophobicContact CB-CB 4.47Å; H301-I321 HydrophobicContact CB-CG1 4.22Å; C303-I321 HydrophobicContact CB-CD1 3.94Å; C303-I321 HydrophobicContact CB-CG1 3.68Å; C319-I321 PolarHBondContact O-N 3.49Å; C319-I321 PolarHBondContact SG-N 2.91Å; C319-I321 VanDerWaalsContact SG-N 3.41Å
322	C	94.5	Very high	89.6	Confident	56 Å²	56	59.8 Å²	59.8	38%	0.378	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-2.1	-173.5	67.3	0	0	0	0	114.7	C299 A324	C299-C322 VanDerWaalsContact CB-SG 3.58Å; C322-A324 PolarHBondContact O-N 2.82Å
323	R	94.6	Very high	89.4	Confident	203 Å²	203	61.6 Å²	61.6	77%	0.766	30%	0.301	S	S	*	.			trans	60	-0.8	-177	-52.7	179.8	-176.5	176.9	0.5	115.9	N318 C319	N318-R323 PolarHBondContact ND2-O 3.26Å; C319-R323 WeakPolarHBondContact O-CA 3.28Å; C319-R323 PolarHBondContact O-N 3.28Å
324	A	91.2	Very high	89.4	Confident	38 Å²	38	59.2 Å²	59.2	31%	0.314	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-59.2	143	173.9	0	0	0	0	0	110.7	N318 C319 C322	N318-A324 WeakPolarHBondContact CA-O 3.25Å; C319-A324 PolarHBondContact N-O 2.71Å; C322-A324 PolarHBondContact O-N 2.82Å
325	P	90.2	Very high	89.4	Confident	88 Å²	88	53.2 Å²	53.2	57%	0.571	27%	0.269	S	S	*	.	B	Isolated β-bridge	trans	-63.7	137.4	173	28.1	-34	0	0	0	109.9	N317	N317-P325 CarbonylContact O-C 3.51Å; N317-P325 WeakPolarHBondContact O-CA 3.44Å
326	F	88.6	Confident	89.1	Confident	6 Å²	6	49.6 Å²	49.6	3%	0.026	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-100.7	159.7	174.3	71.3	-103	0	0	0	111.6	I296 L297 L312 V316 N317 L329 L436	I296-F326 HydrophobicContact CG2-CB 3.24Å; I296-F326 HydrophobicContact CG2-CD1 3.88Å; I296-F326 HydrophobicContact CG2-CG 3.72Å; L297-F326 CarbonylContact O-C 3.54Å; L297-F326 WeakPolarHBondContact O-CA 3.46Å; L297-F326 VanDerWaalsContact O-CB 3.3Å; L297-F326 WeakPolarHBondContact O-CB 3.34Å; L312-F326 HydrophobicContact CD2-CE1 3.66Å; L312-F326 HydrophobicContact CD2-CZ 4.03Å; L312-F326 HydrophobicContact CG-CE1 3.8Å; L312-F326 HydrophobicContact CG-CZ 3.94Å; V316-F326 VanDerWaalsContact O-CE1 3.26Å; V316-F326 WeakPolarHBondContact O-CE1 3.35Å; V316-F326 WeakPolarHBondContact O-CZ 3.48Å; N317-F326 WeakPolarHBondContact O-CD1 3.38Å; N317-F326 PolarHBondContact O-N 3.13Å; F326-L329 HydrophobicContact CD2-CD2 3.78Å; F326-L329 HydrophobicContact CD2-CG 4.1Å; F326-L329 HydrophobicContact CE1-CD2 4.48Å; F326-L329 HydrophobicContact CE2-CD1 3.96Å; F326-L329 HydrophobicContact CE2-CD2 3.7Å; F326-L329 HydrophobicContact CE2-CG 3.74Å; F326-L329 HydrophobicContact CG-CD2 4.23Å; F326-L329 HydrophobicContact CZ-CD1 4.2Å; F326-L329 HydrophobicContact CZ-CD2 4.08Å; F326-L329 HydrophobicContact CZ-CG 4.36Å; F326-L436 HydrophobicContact CD2-CD1 4.24Å; F326-L436 HydrophobicContact CD2-CD2 4.27Å; F326-L436 HydrophobicContact CD2-CG 4.11Å; F326-L436 HydrophobicContact CE2-CD1 4.26Å; F326-L436 HydrophobicContact CE2-CD2 3.48Å; F326-L436 VanDerWaalsContact CE2-CD2 3.48Å; F326-L436 HydrophobicContact CE2-CG 3.78Å; F326-L436 HydrophobicContact CZ-CD2 3.92Å; F326-L436 WeakPolarHBondContact O-CD1 2.97Å
327	R	84.5	Confident	88.8	Confident	111 Å²	111	48.4 Å²	48.4	42%	0.419	25%	0.249	S	C	.	.	S	Bend	trans	-113.7	-42.1	178.5	-64.6	-175.3	177.1	114.3	-1.5	112.1	C51 F52 L297 L436	C51-R327 PolarHBondContact O-NH1 2.85Å; C51-R327 PolarHBondContact SG-NH2 2.94Å; C51-R327 VanDerWaalsContact SG-NH2 3.42Å; F52-R327 HydrophobicContact CE1-CB 4.49Å; L297-R327 PolarHBondContact O-N 2.85Å; R327-L436 PolarHBondContact O-N 2.57Å
328	A	86.9	Confident	87.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	157.8	178.2	0	0	0	0	0	110.7	F52 L297 V433 F434	F52-A328 HydrophobicContact CD1-CB 4.4Å; F52-A328 HydrophobicContact CE1-CB 4.19Å; L297-A328 WeakPolarHBondContact CB-O 3.37Å; L297-A328 HydrophobicContact CD1-CB 4.3Å; L297-A328 PolarHBondContact N-O 3.43Å; A328-V433 HydrophobicContact CB-CG1 4.04Å; A328-F434 WeakPolarHBondContact CA-O 3.3Å
329	L	90.6	Very high	86.3	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	128.8	172.7	-57.8	174.5	0	0	0	107.4	T294 L295 I296 A309 R313 F326 V433 F434	T294-L329 HydrophobicContact CG2-CB 3.9Å; L295-L329 WeakPolarHBondContact O-CA 3.42Å; I296-L329 HydrophobicContact CB-CD2 4.29Å; I296-L329 HydrophobicContact CD1-CD2 4.49Å; I296-L329 HydrophobicContact CG1-CD2 3.84Å; I296-L329 HydrophobicContact CG2-CD2 4.2Å; A309-L329 HydrophobicContact CB-CD1 3.91Å; A309-L329 WeakPolarHBondContact O-CD1 3.32Å; R313-L329 HydrophobicContact CB-CD1 4.08Å; F326-L329 HydrophobicContact CD2-CD2 3.78Å; F326-L329 HydrophobicContact CD2-CG 4.1Å; F326-L329 HydrophobicContact CE1-CD2 4.48Å; F326-L329 HydrophobicContact CE2-CD1 3.96Å; F326-L329 HydrophobicContact CE2-CD2 3.7Å; F326-L329 HydrophobicContact CE2-CG 3.74Å; F326-L329 HydrophobicContact CG-CD2 4.23Å; F326-L329 HydrophobicContact CZ-CD1 4.2Å; F326-L329 HydrophobicContact CZ-CD2 4.08Å; F326-L329 HydrophobicContact CZ-CG 4.36Å; L329-V433 CarbonylContact O-C 3.52Å; L329-F434 HydrophobicContact CB-CB 4.39Å; L329-F434 PolarHBondContact N-O 2.72Å; L329-F434 PolarHBondContact O-N 2.79Å
330	L	89.9	Confident	84.2	Confident	5 Å²	5	61 Å²	61	3%	0.026	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	105.1	-179.4	169.4	64.7	0	0	0	108.5	L39 F54 T294 L295 L297 V332 M431 V433	L39-L330 HydrophobicContact CD1-CD2 4.47Å; F54-L330 HydrophobicContact CE2-CD2 4.16Å; T294-L330 WeakPolarHBondContact CA-O 3.39Å; L295-L330 HydrophobicContact CB-CB 4.13Å; L295-L330 WeakPolarHBondContact CB-O 3.46Å; L295-L330 HydrophobicContact CD1-CD2 3.82Å; L295-L330 HydrophobicContact CD1-CG 4.18Å; L295-L330 PolarHBondContact N-O 3.44Å; L295-L330 PolarHBondContact O-N 2.95Å; L297-L330 HydrophobicContact CD1-CB 4.14Å; L297-L330 HydrophobicContact CD2-CB 4.49Å; L297-L330 HydrophobicContact CG-CB 4.35Å; L330-V332 HydrophobicContact CG-CG2 4.16Å; L330-M431 HydrophobicContact CD1-CB 4.01Å; L330-M431 HydrophobicContact CD1-CG 4.38Å; L330-M431 HydrophobicContact CD1-SD 4.48Å; L330-V433 HydrophobicContact CD1-CG2 4.13Å
331	Q	91.2	Very high	81.4	Confident	8 Å²	8	63.3 Å²	63.3	4%	0.037	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	132.6	170.4	174.4	171.3	51.8	0	0	109.1	D293 S306 K333 M431 R432 F434	D293-Q331 CarbonylContact O-C 3.58Å; D293-Q331 WeakPolarHBondContact O-CA 3.28Å; D293-Q331 PolarHBondContact OD2-NE2 3.24Å; S306-Q331 PolarHBondContact OG-NE2 2.86Å; Q331-K333 HydrophobicContact CG-CD 4.38Å; Q331-K333 HydrophobicContact CG-CG 4.29Å; Q331-M431 CarbonylContact O-C 3.56Å; Q331-M431 WeakPolarHBondContact O-CA 3.5Å; Q331-R432 HydrophobicContact CB-CB 4.49Å; Q331-R432 PolarHBondContact N-O 2.8Å; Q331-R432 PolarHBondContact O-N 2.83Å; Q331-F434 HydrophobicContact CB-CE2 3.87Å
332	V	89.3	Confident	78.5	Confident	16 Å²	16	65.1 Å²	65.1	10%	0.097	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	117.7	176.2	-175.6	0	0	0	0	108	D293 L295 L330 L369 I429 M431	D293-V332 PolarHBondContact O-N 3.18Å; L295-V332 HydrophobicContact CD1-CG2 3.66Å; L295-V332 HydrophobicContact CG-CG2 4.33Å; L330-V332 HydrophobicContact CG-CG2 4.16Å; V332-L369 HydrophobicContact CB-CD2 4.26Å; V332-L369 HydrophobicContact CG1-CD1 4.18Å; V332-L369 HydrophobicContact CG1-CD2 4.22Å; V332-I429 HydrophobicContact CG1-CG2 3.63Å; V332-M431 HydrophobicContact CG2-CG 4.44Å
333	K	86.5	Confident	75.9	Confident	63 Å²	63	70 Å²	70	27%	0.274	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	138.3	175.6	-83.3	166.9	163.8	153.5	0	109.2	Q331 L366 I429 V430	Q331-K333 HydrophobicContact CG-CD 4.38Å; Q331-K333 HydrophobicContact CG-CG 4.29Å; K333-L366 HydrophobicContact CB-CD2 4.02Å; K333-L366 HydrophobicContact CD-CD2 3.98Å; K333-L366 HydrophobicContact CG-CD2 4.18Å; K333-I429 CarbonylContact O-C 3.46Å; K333-I429 WeakPolarHBondContact O-CA 3.38Å; K333-V430 HydrophobicContact CB-CB 4.29Å; K333-V430 PolarHBondContact N-O 2.99Å; K333-V430 PolarHBondContact O-N 2.9Å
334	T	86.6	Confident	72.9	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.006	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	142.1	173.7	40.5	0	0	0	0	109.9	V367 L369 A372 P426 I429	T334-V367 PolarHBondContact O-N 3.23Å; T334-V367 VanDerWaalsContact O-O 3.11Å; T334-V367 PolarHBondContact OG1-O 2.82Å; T334-L369 HydrophobicContact CG2-CD1 3.65Å; T334-L369 WeakPolarHBondContact OG1-CA 3.23Å; T334-A372 VanDerWaalsContact CB-CB 3.5Å; T334-A372 HydrophobicContact CG2-CB 3.72Å; T334-A372 WeakPolarHBondContact OG1-CB 3.41Å; T334-P426 HydrophobicContact CG2-CB 3.38Å; T334-P426 HydrophobicContact CG2-CG 3.75Å; T334-I429 HydrophobicContact CG2-CG1 4.41Å
335	V	84	Confident	70.1	Confident	3 Å²	3	68.1 Å²	68.1	2%	0.018	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	149.7	176.7	-63.5	0	0	0	0	111.1	P80 Y364 E365 L366 H428 V430	P80-V335 HydrophobicContact CB-CG2 3.65Å; P80-V335 HydrophobicContact CG-CG2 3.86Å; V335-Y364 HydrophobicContact CB-CD1 4.35Å; V335-Y364 HydrophobicContact CG2-CD1 3.85Å; V335-Y364 HydrophobicContact CG2-CG 4.26Å; V335-E365 CarbonylContact C-O 3.48Å; V335-E365 WeakPolarHBondContact CA-O 3.26Å; V335-E365 WeakPolarHBondContact CB-O 3.5Å; V335-L366 HydrophobicContact CG1-CD2 3.77Å; V335-L366 HydrophobicContact CG1-CG 4.34Å; V335-H428 HydrophobicContact CG2-CB 3.54Å; V335-H428 PolarHBondContact N-O 2.84Å; V335-V430 HydrophobicContact CG1-CG2 4.25Å; V335-V430 HydrophobicContact CG2-CG2 4.46Å
336	K	80	Confident	67.3	Low	80 Å²	80	68.6 Å²	68.6	35%	0.348	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	140.9	170.4	-72.5	170.9	-172.4	154.9	0	108.8	S338 Y364 E365 V367 E371	K336-S338 PolarHBondContact O-N 2.94Å; K336-Y364 WeakPolarHBondContact O-CA 3.21Å; K336-E365 PolarHBondContact N-O 3.07Å; K336-E365 PolarHBondContact O-N 3.11Å; K336-V367 HydrophobicContact CB-CG2 4.32Å; K336-V367 HydrophobicContact CD-CG2 3.61Å; K336-V367 HydrophobicContact CG-CG2 3.76Å; K336-E371 IonicContact NZ-OE1 3.9Å; K336-E371 PolarHBondContact NZ-OE1 3.46Å
337	S	75.7	Confident	65	Low	50 Å²	50	74.3 Å²	74.3	35%	0.35	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	116.9	175.4	-175.5	0	0	0	0	109.9	R339	S337-R339 PolarHBondContact O-N 2.83Å
338	S	67.4	Low	62.6	Low	52 Å²	52	73.6 Å²	73.6	36%	0.364	44%	0.443	S	S	.	.			trans	-70.7	92.9	176.6	-58	0	0	0	0	109.1	K336 I340 K363	K336-S338 PolarHBondContact O-N 2.94Å; S338-I340 PolarHBondContact O-N 2.96Å; S338-K363 PolarHBondContact N-O 3.08Å
339	R	59.3	Low	60.4	Low	204 Å²	204	80.8 Å²	80.8	77%	0.77	49%	0.487	S	S	*	.			trans	-64.2	93	177.2	-59.9	-175.7	-164.9	177.4	5.6	110	S337 T341 E427	S337-R339 PolarHBondContact O-N 2.83Å; R339-T341 PolarHBondContact O-N 2.86Å; R339-E427 IonicContact NH2-OE1 2.71Å
340	I	49.8	Very low	57.7	Low	151 Å²	151	89.7 Å²	89.7	77%	0.774	53%	0.529	S	S	*	.			trans	-62.4	107.4	164.7	-57.1	176.6	0	0	0	106.7	S338	S338-I340 PolarHBondContact O-N 2.96Å
341	T	35.9	Very low	55.3	Low	104 Å²	104	94.9 Å²	94.9	64%	0.638	57%	0.566	S	S	*	*			trans	-61.5	131.2	172.2	35.7	0	0	0	0	109	R339 I343	R339-T341 PolarHBondContact O-N 2.86Å; T341-I343 PolarHBondContact O-N 3Å
342	P	32.6	Very low	52.4	Low	128 Å²	128	100.2 Å²	100.2	83%	0.831	60%	0.604	S	S	*	*			trans	-72.8	93	-178.2	28.8	-33.7	0	0	0	109.7	A344	P342-A344 PolarHBondContact O-N 2.78Å
343	I	38.9	Very low	49.8	Very low	158 Å²	158	107.6 Å²	107.6	81%	0.81	64%	0.642	S	S	*	*			trans	-69.8	112.9	168.1	-63.1	178.5	0	0	0	107.4	T341	T341-I343 PolarHBondContact O-N 3Å
344	A	32.2	Very low	47.1	Very low	80 Å²	80	110.5 Å²	110.5	66%	0.661	67%	0.665	S	S	*	*			trans	-66.9	168.4	173.1	0	0	0	0	0	111.8	P342	P342-A344 PolarHBondContact O-N 2.78Å
345	C	31.3	Very low	44.5	Very low	122 Å²	122	121.7 Å²	121.7	82%	0.824	71%	0.709	S	S	*	*			trans	91.5	85.8	171.2	-55.5	0	0	0	0	117.5
346	A	32	Very low	41.9	Very low	97 Å²	97	128.5 Å²	128.5	80%	0.802	74%	0.741	S	S	*	*				40	108.1	116.1	0	0	0	0	0	119.4
347	S	40.6	Very low	39.6	Very low	126 Å²	126	130.4 Å²	130.4	88%	0.881	76%	0.761	S	S	*	*				-168.5	147.1	117.1	25.5	0	0	0	0	110.3
348	A	34.7	Very low	37.7	Very low	96 Å²	96	133.5 Å²	133.5	79%	0.793	78%	0.778	S	S	*	*			trans	-96.3	138.7	-179.6	0	0	0	0	0	111.1
349	T	39.6	Very low	36.6	Very low	151 Å²	151	135 Å²	135	93%	0.926	79%	0.788	S	S	*	*			trans	-161.1	140.5	144.6	13.6	0	0	0	0	110.3
350	E	35	Very low	36.1	Very low	188 Å²	188	129.7 Å²	129.7	88%	0.879	78%	0.776	S	S	*	*			trans	-80.1	140.1	-175.9	-54.7	170.6	135.3	0	0	111.4
351	S	39.2	Very low	36.4	Very low	115 Å²	115	125.3 Å²	125.3	80%	0.804	75%	0.751	S	S	*	*			trans	-168.3	109.4	152.5	-85.5	0	0	0	0	113.2
352	S	30.7	Very low	37.5	Very low	120 Å²	120	127.6 Å²	127.6	84%	0.839	76%	0.759	S	S	*	*			trans	7.9	109.6	145.6	170.7	0	0	0	0	118.3
353	L	33.9	Very low	39.7	Very low	171 Å²	171	127.4 Å²	127.4	90%	0.895	75%	0.745	S	S	*	*			trans	-137.7	148.8	157	-78.4	177.9	0	0	0	112.3
354	T	29.8	Very low	41.5	Very low	123 Å²	123	122.7 Å²	122.7	76%	0.755	72%	0.718	S	S	*	*			trans	-75.3	146.5	-172.1	43.4	0	0	0	0	113.7	E356	T354-E356 PolarHBondContact O-N 3.47Å
355	Y	31.9	Very low	43.9	Very low	236 Å²	236	124.9 Å²	124.9	93%	0.925	71%	0.714	S	S	*	*			trans	-84.6	91.1	-179.4	-136	-91.3	0	0	0	111.2
356	E	30.4	Very low	46.3	Very low	146 Å²	146	124.4 Å²	124.4	68%	0.682	70%	0.703	S	S	*	*			trans	-94.8	132.4	165.5	-78.4	-71.6	137.3	0	0	109.1	T354 T358	T354-E356 PolarHBondContact O-N 3.47Å; E356-T358 VanDerWaalsContact C-N 3.25Å; E356-T358 PolarHBondContact O-N 3.45Å
357	P	30.5	Very low	48.7	Very low	120 Å²	120	120.4 Å²	120.4	78%	0.779	67%	0.669	S	S	*	*			trans	-78.7	70.9	-177.4	33.3	-35.4	0	0	0	111.3	S359	P357-S359 PolarHBondContact O-N 2.94Å
358	T	35.2	Very low	50.8	Low	116 Å²	116	116.7 Å²	116.7	71%	0.712	64%	0.641	S	S	*	*			trans	-71.7	125.4	170.2	40.2	0	0	0	0	110.3	E356	E356-T358 VanDerWaalsContact C-N 3.25Å; E356-T358 PolarHBondContact O-N 3.45Å
359	S	45.2	Very low	53.2	Low	82 Å²	82	113 Å²	113	57%	0.573	61%	0.608	S	S	*	*			trans	-61.1	141.9	-174.5	53.1	0	0	0	0	112.5	P357 F361	P357-S359 PolarHBondContact O-N 2.94Å; S359-F361 PolarHBondContact O-N 2.71Å
360	N	48.8	Very low	55.2	Low	94 Å²	94	106.8 Å²	106.8	50%	0.503	57%	0.569	S	S	.	*	G	3₁₀ helix	trans	-63.4	6.9	-174.7	-87.8	-29	0	0	0	116	N362	N360-N362 PolarHBondContact O-N 2.93Å
361	F	55.2	Low	57.4	Low	58 Å²	58	100.1 Å²	100.1	25%	0.254	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-67.1	-13.7	-179.3	-82.6	-76.9	0	0	0	114.7	S359 K363 Y364 V430	S359-F361 PolarHBondContact O-N 2.71Å; F361-K363 PolarHBondContact O-N 3.12Å; F361-Y364 PolarHBondContact O-N 3.41Å; F361-V430 HydrophobicContact CE1-CG2 4.2Å
362	N	60.8	Low	59.4	Low	152 Å²	152	95 Å²	95	81%	0.813	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-60.5	-6.7	175.2	-81	1.2	0	0	0	115	N360	N360-N362 PolarHBondContact O-N 2.93Å
363	K	77.1	Confident	61.7	Low	124 Å²	124	90.9 Å²	90.9	54%	0.539	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-92.2	-6.4	173.6	-63.3	179.2	-177.2	173.3	0	114.1	S338 F361	S338-K363 PolarHBondContact N-O 3.08Å; F361-K363 PolarHBondContact O-N 3.12Å
364	Y	77	Confident	63.6	Low	59 Å²	59	85.1 Å²	85.1	23%	0.231	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	129.4	-167.4	-67.6	-74.6	0	0	0	112.3	P80 V335 K336 F361	P80-Y364 HydrophobicContact CG-CD1 4.1Å; P80-Y364 HydrophobicContact CG-CD2 4.39Å; P80-Y364 HydrophobicContact CG-CE1 3.62Å; P80-Y364 HydrophobicContact CG-CE2 3.96Å; P80-Y364 HydrophobicContact CG-CG 4.45Å; V335-Y364 HydrophobicContact CB-CD1 4.35Å; V335-Y364 HydrophobicContact CG2-CD1 3.85Å; V335-Y364 HydrophobicContact CG2-CG 4.26Å; K336-Y364 WeakPolarHBondContact O-CA 3.21Å; F361-Y364 PolarHBondContact O-N 3.41Å
365	E	82.5	Confident	65.6	Low	126 Å²	126	79.6 Å²	79.6	59%	0.589	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	130.9	174	-174.3	174.1	-174.4	0	0	110.1	V335 K336	V335-E365 CarbonylContact C-O 3.48Å; V335-E365 WeakPolarHBondContact CA-O 3.26Å; V335-E365 WeakPolarHBondContact CB-O 3.5Å; K336-E365 PolarHBondContact N-O 3.07Å; K336-E365 PolarHBondContact O-N 3.11Å
366	L	83	Confident	67.3	Low	112 Å²	112	72.5 Å²	72.5	59%	0.586	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	130.3	175.5	-81	165.7	0	0	0	110.7	K333 V335	K333-L366 HydrophobicContact CB-CD2 4.02Å; K333-L366 HydrophobicContact CD-CD2 3.98Å; K333-L366 HydrophobicContact CG-CD2 4.18Å; V335-L366 HydrophobicContact CG1-CD2 3.77Å; V335-L366 HydrophobicContact CG1-CG 4.34Å
367	V	82.5	Confident	68.9	Low	13 Å²	13	69.5 Å²	69.5	8%	0.079	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	138.7	175.9	-175.7	0	0	0	0	108.3	T334 K336 L369 E371 A372	T334-V367 PolarHBondContact O-N 3.23Å; T334-V367 VanDerWaalsContact O-O 3.11Å; T334-V367 PolarHBondContact OG1-O 2.82Å; K336-V367 HydrophobicContact CB-CG2 4.32Å; K336-V367 HydrophobicContact CD-CG2 3.61Å; K336-V367 HydrophobicContact CG-CG2 3.76Å; V367-L369 PolarHBondContact O-N 2.86Å; V367-E371 HydrophobicContact CG1-CB 4.11Å; V367-E371 HydrophobicContact CG1-CG 4.33Å; V367-E371 WeakPolarHBondContact CG1-OE1 3.43Å; V367-A372 HydrophobicContact CB-CB 4.38Å; V367-A372 HydrophobicContact CG1-CB 3.86Å
368	P	84.3	Confident	69.9	Low	48 Å²	48	68.5 Å²	68.5	31%	0.312	37%	0.371	S	S	.	.			trans	-58.2	134.7	171.4	-22.5	33.4	0	0	0	111	I370 E371 A372	P368-I370 HydrophobicContact CB-CG2 4.19Å; P368-I370 PolarHBondContact O-N 2.88Å; P368-I370 VanDerWaalsContact O-N 3.13Å; P368-E371 HydrophobicContact CB-CB 4.17Å; P368-E371 WeakPolarHBondContact CD-OE2 3.27Å; P368-E371 HydrophobicContact CG-CB 4.41Å; P368-E371 WeakPolarHBondContact O-CB 3.3Å; P368-E371 PolarHBondContact O-N 3.41Å; P368-A372 PolarHBondContact O-N 2.9Å
369	L	84.8	Confident	70.3	Confident	18 Å²	18	67.6 Å²	67.6	9%	0.094	37%	0.367	C	S	.	.	H	α-helix	trans	-53.5	-38.6	-178.1	176.6	61.7	0	0	0	112.5	L255 L302 V332 T334 V367 A372 L373	L255-L369 HydrophobicContact CD1-CD2 4.01Å; L255-L369 HydrophobicContact CD1-CG 4.29Å; L302-L369 HydrophobicContact CD1-CD2 4.49Å; L302-L369 HydrophobicContact CD2-CD2 3.82Å; V332-L369 HydrophobicContact CB-CD2 4.26Å; V332-L369 HydrophobicContact CG1-CD1 4.18Å; V332-L369 HydrophobicContact CG1-CD2 4.22Å; T334-L369 HydrophobicContact CG2-CD1 3.65Å; T334-L369 WeakPolarHBondContact OG1-CA 3.23Å; V367-L369 PolarHBondContact O-N 2.86Å; L369-A372 PolarHBondContact O-N 2.93Å; L369-L373 HydrophobicContact CD1-CD1 3.78Å; L369-L373 HydrophobicContact CD1-CG 4.26Å; L369-L373 HydrophobicContact CG-CD1 4.01Å; L369-L373 WeakPolarHBondContact O-CD1 3.47Å; L369-L373 VanDerWaalsContact O-CG 3.27Å; L369-L373 WeakPolarHBondContact O-CG 3.32Å; L369-L373 PolarHBondContact O-N 2.87Å
370	I	81.6	Confident	70.1	Confident	21 Å²	21	70.3 Å²	70.3	11%	0.108	39%	0.386	C	S	.	.	H	α-helix	trans	-65.1	-40.8	177.9	-171.2	68.7	0	0	0	112.7	A282 W291 P368 L373 N374 I377	A282-I370 HydrophobicContact CB-CB 4.1Å; A282-I370 HydrophobicContact CB-CD1 3.61Å; A282-I370 HydrophobicContact CB-CG1 3.63Å; W291-I370 HydrophobicContact CD2-CG2 3.95Å; W291-I370 HydrophobicContact CE3-CG2 3.66Å; W291-I370 HydrophobicContact CG-CG2 4.45Å; W291-I370 HydrophobicContact CZ3-CG2 4.06Å; P368-I370 HydrophobicContact CB-CG2 4.19Å; P368-I370 PolarHBondContact O-N 2.88Å; P368-I370 VanDerWaalsContact O-N 3.13Å; I370-L373 PolarHBondContact O-N 3.26Å; I370-N374 WeakPolarHBondContact CD1-ND2 3.49Å; I370-N374 WeakPolarHBondContact O-CB 3.49Å; I370-N374 PolarHBondContact O-N 2.96Å; I370-N374 PolarHBondContact O-ND2 2.98Å; I370-I377 HydrophobicContact CG2-CD1 4.09Å
371	E	81.7	Confident	69.6	Low	49 Å²	49	69.2 Å²	69.2	23%	0.229	40%	0.396	C	S	.	.	H	α-helix	trans	-71.7	-39.2	178.1	-169.6	-151.7	121.8	0	0	110.5	K336 V367 P368 L373 G375	K336-E371 IonicContact NZ-OE1 3.9Å; K336-E371 PolarHBondContact NZ-OE1 3.46Å; V367-E371 HydrophobicContact CG1-CB 4.11Å; V367-E371 HydrophobicContact CG1-CG 4.33Å; V367-E371 WeakPolarHBondContact CG1-OE1 3.43Å; P368-E371 HydrophobicContact CB-CB 4.17Å; P368-E371 WeakPolarHBondContact CD-OE2 3.27Å; P368-E371 HydrophobicContact CG-CB 4.41Å; P368-E371 WeakPolarHBondContact O-CB 3.3Å; P368-E371 PolarHBondContact O-N 3.41Å; E371-L373 PolarHBondContact O-N 2.89Å; E371-G375 WeakPolarHBondContact CA-O 3.2Å; E371-G375 WeakPolarHBondContact CG-O 3.43Å; E371-G375 CarbonylContact O-C 3.58Å; E371-G375 VanDerWaalsContact O-C 3.26Å; E371-G375 WeakPolarHBondContact O-CA 3.15Å; E371-G375 PolarHBondContact O-N 3.23Å
372	A	81.2	Confident	68.6	Low	6 Å²	6	71.6 Å²	71.6	5%	0.05	42%	0.416	C	S	.	.	H	α-helix	trans	-67.4	-14.9	177.3	0	0	0	0	0	114	T334 V367 P368 L369 L424 P426	T334-A372 VanDerWaalsContact CB-CB 3.5Å; T334-A372 HydrophobicContact CG2-CB 3.72Å; T334-A372 WeakPolarHBondContact OG1-CB 3.41Å; V367-A372 HydrophobicContact CB-CB 4.38Å; V367-A372 HydrophobicContact CG1-CB 3.86Å; P368-A372 PolarHBondContact O-N 2.9Å; L369-A372 PolarHBondContact O-N 2.93Å; A372-L424 CarbonylContact O-C 3.58Å; A372-P426 HydrophobicContact CB-CB 4.17Å
373	L	77.7	Confident	67.3	Low	35 Å²	35	72.9 Å²	72.9	18%	0.183	42%	0.417	C	S	.	.	H	α-helix	trans	-107.5	-24.1	178.2	-69.6	170.4	0	0	0	114.4	L255 N257 L369 I370 E371 P426	L255-L373 HydrophobicContact CD1-CD1 3.54Å; L255-L373 HydrophobicContact CD2-CD1 3.93Å; L255-L373 HydrophobicContact CG-CD1 3.72Å; N257-L373 PolarHBondContact ND2-O 2.83Å; L369-L373 HydrophobicContact CD1-CD1 3.78Å; L369-L373 HydrophobicContact CD1-CG 4.26Å; L369-L373 HydrophobicContact CG-CD1 4.01Å; L369-L373 WeakPolarHBondContact O-CD1 3.47Å; L369-L373 VanDerWaalsContact O-CG 3.27Å; L369-L373 WeakPolarHBondContact O-CG 3.32Å; L369-L373 PolarHBondContact O-N 2.87Å; I370-L373 PolarHBondContact O-N 3.26Å; E371-L373 PolarHBondContact O-N 2.89Å; L373-P426 HydrophobicContact CD2-CG 4.38Å
374	N	74.1	Confident	65	Low	49 Å²	49	72.9 Å²	72.9	26%	0.262	43%	0.431	S	S	.	.	H	α-helix	trans	-112.9	-5	-178.3	-68.4	-91.5	0	0	0	113.1	N257 I370	N257-N374 WeakPolarHBondContact CA-OD1 3.32Å; N257-N374 VanDerWaalsContact CB-OD1 3.29Å; N257-N374 WeakPolarHBondContact CB-OD1 3.45Å; N257-N374 PolarHBondContact ND2-OD1 2.83Å; N257-N374 VanDerWaalsContact ND2-OD1 3.16Å; I370-N374 WeakPolarHBondContact CD1-ND2 3.49Å; I370-N374 WeakPolarHBondContact O-CB 3.49Å; I370-N374 PolarHBondContact O-N 2.96Å; I370-N374 PolarHBondContact O-ND2 2.98Å
375	G	71.4	Confident	62.8	Low	7 Å²	7	76.6 Å²	76.6	7%	0.072	45%	0.454	C	S	.	.			trans	78.9	178.9	-166.6	0	0	0	0	0	113.6	E371 I377	E371-G375 WeakPolarHBondContact CA-O 3.2Å; E371-G375 WeakPolarHBondContact CG-O 3.43Å; E371-G375 CarbonylContact O-C 3.58Å; E371-G375 VanDerWaalsContact O-C 3.26Å; E371-G375 WeakPolarHBondContact O-CA 3.15Å; E371-G375 PolarHBondContact O-N 3.23Å; G375-I377 PolarHBondContact O-N 3.42Å
376	P	69.2	Low	60.6	Low	87 Å²	87	75.8 Å²	75.8	57%	0.565	46%	0.463	S	S	*	.			trans	-53.7	124.2	-178.9	-27.1	36	0	0	0	112.1	V378	P376-V378 VanDerWaalsContact C-N 3.33Å; P376-V378 PolarHBondContact O-N 3.17Å
377	I	62.7	Low	58	Low	83 Å²	83	78 Å²	78	43%	0.426	47%	0.474	S	S	.	.			trans	-72.1	92	173	-55.9	176.7	0	0	0	107.6	W291 I370 G375 P379	W291-I377 HydrophobicContact CH2-CD1 3.62Å; W291-I377 HydrophobicContact CZ2-CD1 3.95Å; W291-I377 HydrophobicContact CZ3-CD1 4.2Å; I370-I377 HydrophobicContact CG2-CD1 4.09Å; G375-I377 PolarHBondContact O-N 3.42Å; I377-P379 WeakPolarHBondContact O-CD 3.18Å
378	V	52.7	Low	55.6	Low	100 Å²	100	81.3 Å²	81.3	61%	0.606	50%	0.503	S	S	*	.			trans	-72.1	114.4	174.5	-176.4	0	0	0	0	108.2	P376 S380	P376-V378 VanDerWaalsContact C-N 3.33Å; P376-V378 PolarHBondContact O-N 3.17Å; V378-S380 PolarHBondContact O-N 2.9Å
379	P	43.9	Very low	53.2	Low	97 Å²	97	83.6 Å²	83.6	63%	0.63	53%	0.526	S	S	*	.			trans	-64.1	134.5	171.6	26.4	-30.9	0	0	0	108.8	I377 G381	I377-P379 WeakPolarHBondContact O-CD 3.18Å; P379-G381 VanDerWaalsContact C-N 3.28Å; P379-G381 PolarHBondContact O-N 3.4Å
380	S	39.4	Very low	50.6	Low	138 Å²	138	91 Å²	91	97%	0.965	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	82.6	-176.3	-48.7	0	0	0	0	111.6	V378	V378-S380 PolarHBondContact O-N 2.9Å
381	G	37.9	Very low	48.3	Very low	71 Å²	71	98.3 Å²	98.3	73%	0.732	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	178.6	0.8	-172.9	0	0	0	0	0	117.2	P379	P379-G381 VanDerWaalsContact C-N 3.28Å; P379-G381 PolarHBondContact O-N 3.4Å
382	T	35.1	Very low	46.4	Very low	108 Å²	108	100.9 Å²	100.9	66%	0.663	63%	0.629	S	S	*	*			trans	-139.7	104.8	177.8	-49.6	0	0	0	0	111.8	C384	T382-C384 PolarHBondContact O-N 3.41Å; T382-C384 VanDerWaalsContact O-N 3.15Å
383	Q	32.5	Very low	44.6	Very low	180 Å²	180	106.3 Å²	106.3	84%	0.841	67%	0.667	S	S	*	*			trans	-69.1	105.8	170.2	-68.3	179.8	0.7	0	0	109.4	L385	Q383-L385 PolarHBondContact O-N 2.93Å
384	C	29.2	Very low	42.7	Very low	123 Å²	123	112 Å²	112	83%	0.831	70%	0.696	S	S	*	*			trans	-81.8	98.1	169.9	-161	0	0	0	0	109.2	T382 S386	T382-C384 PolarHBondContact O-N 3.41Å; T382-C384 VanDerWaalsContact O-N 3.15Å; C384-S386 PolarHBondContact O-N 2.93Å; C384-S386 VanDerWaalsContact O-N 3.16Å
385	L	31.8	Very low	41.1	Very low	138 Å²	138	116.6 Å²	116.6	72%	0.723	73%	0.725	S	S	*	*			trans	-66.7	109.9	173.4	-73.2	168	0	0	0	109.7	Q383 L387	Q383-L385 PolarHBondContact O-N 2.93Å; L385-L387 PolarHBondContact O-N 2.96Å; L385-L387 VanDerWaalsContact O-N 3.13Å
386	S	35.4	Very low	39.4	Very low	109 Å²	109	127.6 Å²	127.6	76%	0.762	77%	0.765	S	S	*	*			trans	-65	109.5	171.1	179.7	0	0	0	0	110.5	C384 A388	C384-S386 PolarHBondContact O-N 2.93Å; C384-S386 VanDerWaalsContact O-N 3.16Å; S386-A388 VanDerWaalsContact C-N 3.34Å; S386-A388 PolarHBondContact O-N 3.4Å
387	L	28.2	Very low	37.9	Very low	157 Å²	157	127.1 Å²	127.1	82%	0.822	78%	0.775	S	S	*	*			trans	-75.5	84.1	171.9	-95.3	73.4	0	0	0	110	L385	L385-L387 PolarHBondContact O-N 2.96Å; L385-L387 VanDerWaalsContact O-N 3.13Å
388	A	33.1	Very low	36.9	Very low	84 Å²	84	128.3 Å²	128.3	69%	0.694	79%	0.791	S	S	*	*			trans	-136.8	35.8	178.9	0	0	0	0	0	114.2	S386	S386-A388 VanDerWaalsContact C-N 3.34Å; S386-A388 PolarHBondContact O-N 3.4Å
389	A	33.2	Very low	36.5	Very low	96 Å²	96	129.2 Å²	129.2	79%	0.793	80%	0.802	S	S	*	*			trans	-159.4	63	173.1	0	0	0	0	0	114.3
390	Q	31.2	Very low	36.5	Very low	173 Å²	173	130.4 Å²	130.4	81%	0.808	81%	0.81	S	S	*	*			trans	-132.8	88.6	166	-68.9	-170.8	28	0	0	110.8
391	N	33.2	Very low	36.5	Very low	174 Å²	174	129.7 Å²	129.7	93%	0.93	80%	0.804	S	S	*	*			trans	-179.9	84	154.3	-94	-26.3	0	0	0	110.9
392	A	41.8	Very low	36.7	Very low	103 Å²	103	131 Å²	131	85%	0.851	81%	0.809	S	S	*	*			trans	-151.7	125.2	162.4	0	0	0	0	0	110
393	S	43.4	Very low	36.9	Very low	121 Å²	121	130.4 Å²	130.4	85%	0.846	81%	0.814	S	S	*	*			trans	-92	140	-159.6	-52.8	0	0	0	0	115.1
394	I	36.4	Very low	37.5	Very low	155 Å²	155	127.2 Å²	127.2	80%	0.795	81%	0.809	S	S	*	*			trans	-15.7	119.1	157.4	-56	158.9	0	0	0	116
395	V	41.6	Very low	38	Very low	144 Å²	144	132.7 Å²	132.7	87%	0.873	81%	0.813	S	S	*	*			trans	-148.5	140.2	130.3	-178.9	0	0	0	0	108.8
396	R	35.1	Very low	38.2	Very low	239 Å²	239	135 Å²	135	90%	0.902	82%	0.817	S	S	*	*			trans	-101	148	178.4	-58.7	177.7	-175.6	-175.9	1	111.2
397	G	38.2	Very low	38.5	Very low	76 Å²	76	139 Å²	139	78%	0.784	82%	0.823	S	S	*	*			trans	-176.2	67.9	177.2	0	0	0	0	0	116.9
398	S	42.1	Very low	38.6	Very low	108 Å²	108	139.5 Å²	139.5	76%	0.755	83%	0.827	S	S	*	*			trans	-3.8	117.2	160.3	52.7	0	0	0	0	122
399	S	42.9	Very low	38.7	Very low	119 Å²	119	140 Å²	140	83%	0.832	83%	0.831	S	S	*	*				68.2	156.4	114.6	-56.4	0	0	0	0	122.2
400	P	45.2	Very low	38.5	Very low	123 Å²	123	145.5 Å²	145.5	80%	0.799	84%	0.837	S	S	*	*			trans	-128.4	171.1	-134.5	43.4	-31.4	0	0	0	116.9
401	S	38.7	Very low	38.6	Very low	122 Å²	122	147 Å²	147	85%	0.853	84%	0.841	S	S	*	*			trans	-167.7	160.4	148.4	-151.5	0	0	0	0	116
402	A	42.1	Very low	38.6	Very low	100 Å²	100	145.2 Å²	145.2	83%	0.826	84%	0.836	S	S	*	*			trans	74.5	126.6	159	0	0	0	0	0	121.2
403	A	40.7	Very low	38.1	Very low	94 Å²	94	143.9 Å²	143.9	78%	0.777	83%	0.833	S	S	*	*			trans	-113.7	-158.3	170.5	0	0	0	0	0	109.2
404	P	44.9	Very low	37.4	Very low	114 Å²	114	149 Å²	149	74%	0.74	83%	0.833	S	S	*	*			cis	-131.9	164	-27.4	36.8	-21.8	0	0	0	113.6
405	R	39.7	Very low	37.1	Very low	238 Å²	238	147.6 Å²	147.6	90%	0.898	83%	0.834	S	S	*	*			trans	-171.4	126.5	139.9	-112.8	171.2	-178.1	-161	0.7	115.9
406	K	34.5	Very low	36.5	Very low	187 Å²	187	146.9 Å²	146.9	81%	0.813	83%	0.831	S	S	*	*			trans	13.2	128.5	148.7	-54.2	179.8	175.9	-173.8	0	119.1
407	Q	42.5	Very low	36.2	Very low	192 Å²	192	141.2 Å²	141.2	90%	0.897	83%	0.828	S	S	*	*				-175.9	165	96.8	-94.9	-179	25.9	0	0	112.8
408	N	30.3	Very low	36	Very low	168 Å²	168	145.6 Å²	145.6	90%	0.898	83%	0.832	S	S	*	*			trans	-73.1	140.1	-170.3	-67.7	-33.1	0	0	0	114.4
409	A	35.2	Very low	35.3	Very low	95 Å²	95	149.1 Å²	149.1	79%	0.785	84%	0.837	S	S	*	*			trans	-151	112.6	148.8	0	0	0	0	0	110.9	K411	A409-K411 PolarHBondContact O-N 3.12Å
410	K	30	Very low	34.8	Very low	211 Å²	211	149.1 Å²	149.1	92%	0.917	83%	0.831	S	S	*	*			trans	-85.4	99.3	179.3	-167.7	179.2	-174.7	-177.5	0	108.8
411	K	32.6	Very low	34.3	Very low	204 Å²	204	148.8 Å²	148.8	89%	0.887	82%	0.819	S	S	*	*			trans	-118.9	110.5	171.3	-100.2	-174	174.5	-177.8	0	110.2	A409 G413	A409-K411 PolarHBondContact O-N 3.12Å; K411-G413 PolarHBondContact O-N 2.84Å
412	T	33.7	Very low	34.3	Very low	136 Å²	136	150 Å²	150	83%	0.834	81%	0.812	S	S	*	*			trans	-71.3	105.7	170.2	44.2	0	0	0	0	109.2
413	G	29.7	Very low	34.4	Very low	75 Å²	75	149.3 Å²	149.3	77%	0.773	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-73.9	128.8	175.1	0	0	0	0	0	111.5	K411	K411-G413 PolarHBondContact O-N 2.84Å
414	R	29	Very low	34.7	Very low	228 Å²	228	148.1 Å²	148.1	86%	0.86	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-72	131.8	167.3	-175.1	-179	-173.8	-173.2	1.9	108.1	T416	R414-T416 PolarHBondContact O-N 3.42Å
415	P	31.5	Very low	35.3	Very low	126 Å²	126	147 Å²	147	82%	0.818	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-66.9	126.3	174.7	28	-32.6	0	0	0	109.3
416	T	27.8	Very low	36.2	Very low	129 Å²	129	136.5 Å²	136.5	79%	0.791	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-97.6	140.2	174.4	47.3	0	0	0	0	109.9	R414	R414-T416 PolarHBondContact O-N 3.42Å
417	S	30.1	Very low	37.9	Very low	120 Å²	120	131.9 Å²	131.9	84%	0.839	71%	0.712	S	S	*	*			trans	66.9	83.3	173.8	-165.2	0	0	0	0	115.5
418	L	32.7	Very low	39.5	Very low	168 Å²	168	124.5 Å²	124.5	88%	0.88	68%	0.677	S	S	*	*			trans	-77.8	142.7	147.7	-79.2	160.2	0	0	0	108	V420	L418-V420 PolarHBondContact O-N 3.33Å
419	E	28.2	Very low	41.8	Very low	182 Å²	182	118.2 Å²	118.2	85%	0.85	64%	0.644	S	S	*	*			trans	-57.2	128.7	178.9	-76.1	168.8	108	0	0	111.3	Q421	E419-Q421 VanDerWaalsContact C-N 3.34Å; E419-Q421 PolarHBondContact O-N 3.27Å
420	V	32	Very low	43.9	Very low	119 Å²	119	114.2 Å²	114.2	72%	0.721	61%	0.609	S	S	*	*			trans	-73.2	94.8	167.3	179.1	0	0	0	0	106.7	L418 E422	L418-V420 PolarHBondContact O-N 3.33Å; V420-E422 PolarHBondContact O-N 3.05Å; V420-E422 VanDerWaalsContact O-N 3.09Å
421	Q	34.3	Very low	46.4	Very low	116 Å²	116	106.9 Å²	106.9	54%	0.542	58%	0.579	S	S	.	*			trans	-71.5	102.2	169	-172.7	163.9	11.3	0	0	107.9	E419 V423	E419-Q421 VanDerWaalsContact C-N 3.34Å; E419-Q421 PolarHBondContact O-N 3.27Å; Q421-V423 PolarHBondContact O-N 2.86Å
422	E	38.1	Very low	48.6	Very low	149 Å²	149	101.6 Å²	101.6	70%	0.696	55%	0.554	S	S	*	*			trans	-59.7	101.4	173.5	-69.7	-177.1	155.5	0	0	109.3	V420 L424	V420-E422 PolarHBondContact O-N 3.05Å; V420-E422 VanDerWaalsContact O-N 3.09Å; E422-L424 PolarHBondContact O-N 3.07Å
423	V	45.2	Very low	50.8	Low	84 Å²	84	95.4 Å²	95.4	51%	0.509	52%	0.516	S	S	.	.			trans	-70.1	94.2	159.7	179.4	0	0	0	0	105.5	Q421 T425	Q421-V423 PolarHBondContact O-N 2.86Å; V423-T425 PolarHBondContact O-N 3.19Å
424	L	46.8	Very low	53.1	Low	69 Å²	69	94.2 Å²	94.2	36%	0.361	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-58.3	117	174.6	-73.8	166.8	0	0	0	107.6	A372 E422	A372-L424 CarbonylContact O-C 3.58Å; E422-L424 PolarHBondContact O-N 3.07Å
425	T	57.8	Low	55.4	Low	92 Å²	92	87.6 Å²	87.6	56%	0.564	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-88.2	135.8	164.5	52.8	0	0	0	0	107.2	V423 E427	V423-T425 PolarHBondContact O-N 3.19Å; T425-E427 PolarHBondContact O-N 3.25Å; T425-E427 VanDerWaalsContact O-N 3.1Å
426	P	59.1	Low	57.3	Low	16 Å²	16	84 Å²	84	10%	0.104	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-62.7	117.4	175.2	22.9	-31.5	0	0	0	109.7	A83 T334 A372 L373 H428 I429	A83-P426 WeakPolarHBondContact CB-O 3.39Å; T334-P426 HydrophobicContact CG2-CB 3.38Å; T334-P426 HydrophobicContact CG2-CG 3.75Å; A372-P426 HydrophobicContact CB-CB 4.17Å; L373-P426 HydrophobicContact CD2-CG 4.38Å; P426-H428 PolarHBondContact O-N 3.08Å; P426-H428 VanDerWaalsContact O-N 3.16Å; P426-I429 HydrophobicContact CB-CG1 4.2Å; P426-I429 HydrophobicContact CG-CD1 4.01Å; P426-I429 HydrophobicContact CG-CG1 4.07Å
427	E	68.5	Low	59.1	Low	90 Å²	90	80.6 Å²	80.6	42%	0.421	42%	0.423	S	S	.	.	S	Bend	trans	-52.6	-38.9	175.7	-62.8	-179.3	160.4	0	0	111.2	A83 R339 T425	A83-E427 PolarHBondContact N-O 2.97Å; R339-E427 IonicContact NH2-OE1 2.71Å; T425-E427 PolarHBondContact O-N 3.25Å; T425-E427 VanDerWaalsContact O-N 3.1Å
428	H	77.9	Confident	60.2	Low	37 Å²	37	82.5 Å²	82.5	17%	0.171	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	137.7	-169.6	-65.6	95	0	0	0	111.7	P80 Y81 V335 P426	P80-H428 HydrophobicContact CB-CB 3.94Å; P80-H428 HydrophobicContact CG-CB 3.97Å; Y81-H428 CarbonylContact O-C 3.54Å; Y81-H428 VanDerWaalsContact O-CA 3.32Å; Y81-H428 WeakPolarHBondContact O-CA 3.49Å; V335-H428 HydrophobicContact CG2-CB 3.54Å; V335-H428 PolarHBondContact N-O 2.84Å; P426-H428 PolarHBondContact O-N 3.08Å; P426-H428 VanDerWaalsContact O-N 3.16Å
429	I	78.9	Confident	60.7	Low	37 Å²	37	81.9 Å²	81.9	19%	0.19	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	131.2	-176.4	-52.4	-179.4	0	0	0	109.7	Y81 A83 V332 K333 T334 P426 M431	Y81-I429 WeakPolarHBondContact CB-O 3.39Å; Y81-I429 WeakPolarHBondContact CD2-O 3.49Å; Y81-I429 PolarHBondContact N-O 3.44Å; Y81-I429 PolarHBondContact O-N 3.26Å; A83-I429 HydrophobicContact CB-CD1 4.36Å; V332-I429 HydrophobicContact CG1-CG2 3.63Å; K333-I429 CarbonylContact O-C 3.46Å; K333-I429 WeakPolarHBondContact O-CA 3.38Å; T334-I429 HydrophobicContact CG2-CG1 4.41Å; P426-I429 HydrophobicContact CB-CG1 4.2Å; P426-I429 HydrophobicContact CG-CD1 4.01Å; P426-I429 HydrophobicContact CG-CG1 4.07Å; I429-M431 HydrophobicContact CG2-CG 4.06Å
430	V	79	Confident	61.1	Low	11 Å²	11	78.9 Å²	78.9	7%	0.067	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123	167.1	-178.5	0	0	0	0	108.3	P80 K333 V335 F361	P80-V430 HydrophobicContact CB-CG2 3.78Å; K333-V430 HydrophobicContact CB-CB 4.29Å; K333-V430 PolarHBondContact N-O 2.99Å; K333-V430 PolarHBondContact O-N 2.9Å; V335-V430 HydrophobicContact CG1-CG2 4.25Å; V335-V430 HydrophobicContact CG2-CG2 4.46Å; F361-V430 HydrophobicContact CE1-CG2 4.2Å
431	M	81	Confident	61.1	Low	56 Å²	56	81.8 Å²	81.8	28%	0.276	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	135.9	174.9	-73.3	-171.2	-67.2	0	0	109.7	Y81 L330 Q331 V332 I429	Y81-M431 HydrophobicContact CD2-CB 4.42Å; Y81-M431 HydrophobicContact CD2-CE 3.88Å; Y81-M431 HydrophobicContact CE2-CB 4.29Å; Y81-M431 HydrophobicContact CE2-CE 4.2Å; Y81-M431 HydrophobicContact CG-CE 4.31Å; L330-M431 HydrophobicContact CD1-CB 4.01Å; L330-M431 HydrophobicContact CD1-CG 4.38Å; L330-M431 HydrophobicContact CD1-SD 4.48Å; Q331-M431 CarbonylContact O-C 3.56Å; Q331-M431 WeakPolarHBondContact O-CA 3.5Å; V332-M431 HydrophobicContact CG2-CG 4.44Å; I429-M431 HydrophobicContact CG2-CG 4.06Å
432	R	79.4	Confident	61	Low	94 Å²	94	82.4 Å²	82.4	36%	0.355	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	135.3	173.7	-72.1	-173.6	-179.3	168.6	2.8	111.1	Q331 F434	Q331-R432 HydrophobicContact CB-CB 4.49Å; Q331-R432 PolarHBondContact N-O 2.8Å; Q331-R432 PolarHBondContact O-N 2.83Å; R432-F434 HydrophobicContact CB-CE2 4.29Å; R432-F434 HydrophobicContact CB-CZ 4.31Å
433	V	79.9	Confident	60.9	Low	6 Å²	6	84.1 Å²	84.1	4%	0.036	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	145.1	177.8	-174.3	0	0	0	0	110.2	L39 F44 A328 L329 L330	L39-V433 HydrophobicContact CB-CG2 4.08Å; L39-V433 HydrophobicContact CD2-CG1 4.13Å; L39-V433 HydrophobicContact CD2-CG2 3.71Å; L39-V433 HydrophobicContact CG-CG2 3.57Å; L39-V433 WeakPolarHBondContact O-CG2 3.43Å; F44-V433 HydrophobicContact CE1-CG1 4.35Å; F44-V433 HydrophobicContact CE2-CB 4.46Å; F44-V433 HydrophobicContact CE2-CG1 4.41Å; F44-V433 HydrophobicContact CE2-CG2 4.3Å; F44-V433 HydrophobicContact CZ-CB 3.88Å; F44-V433 HydrophobicContact CZ-CG1 3.65Å; F44-V433 HydrophobicContact CZ-CG2 4.21Å; A328-V433 HydrophobicContact CB-CG1 4.04Å; L329-V433 CarbonylContact O-C 3.52Å; L330-V433 HydrophobicContact CD1-CG2 4.13Å
434	F	79.2	Confident	60.6	Low	50 Å²	50	87.7 Å²	87.7	22%	0.219	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	107.6	168.7	-57	-75.8	0	0	0	108.5	A328 L329 Q331 R432	A328-F434 WeakPolarHBondContact CA-O 3.3Å; L329-F434 HydrophobicContact CB-CB 4.39Å; L329-F434 PolarHBondContact N-O 2.72Å; L329-F434 PolarHBondContact O-N 2.79Å; Q331-F434 HydrophobicContact CB-CE2 3.87Å; R432-F434 HydrophobicContact CB-CE2 4.29Å; R432-F434 HydrophobicContact CB-CZ 4.31Å
435	E	76	Confident	60	Low	88 Å²	88	93.7 Å²	93.7	41%	0.411	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	160.2	170.7	-62.9	-159.1	134.2	0	0	111.8	F44 F52 S437	F44-E435 WeakPolarHBondContact CD1-OE1 3.48Å; F44-E435 HydrophobicContact CE1-CG 3.9Å; F52-E435 WeakPolarHBondContact CZ-OE1 3.17Å; E435-S437 PolarHBondContact O-N 2.89Å; E435-S437 VanDerWaalsContact O-N 3.13Å
436	L	72	Confident	59.1	Low	51 Å²	51	96.6 Å²	96.6	27%	0.267	49%	0.489	S	S	.	.			trans	-63.7	107.7	161.4	-78.2	170.2	0	0	0	108.8	R313 N317 F326 R327 D438	R313-L436 HydrophobicContact CB-CD2 4.17Å; R313-L436 WeakPolarHBondContact O-CD2 3.39Å; N317-L436 HydrophobicContact CB-CD1 3.84Å; N317-L436 HydrophobicContact CB-CD2 4.09Å; F326-L436 HydrophobicContact CD2-CD1 4.24Å; F326-L436 HydrophobicContact CD2-CD2 4.27Å; F326-L436 HydrophobicContact CD2-CG 4.11Å; F326-L436 HydrophobicContact CE2-CD1 4.26Å; F326-L436 HydrophobicContact CE2-CD2 3.48Å; F326-L436 VanDerWaalsContact CE2-CD2 3.48Å; F326-L436 HydrophobicContact CE2-CG 3.78Å; F326-L436 HydrophobicContact CZ-CD2 3.92Å; F326-L436 WeakPolarHBondContact O-CD1 2.97Å; R327-L436 PolarHBondContact O-N 2.57Å; L436-D438 PolarHBondContact O-N 2.96Å
437	S	66	Low	58.2	Low	57 Å²	57	104.2 Å²	104.2	40%	0.399	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-56.7	128.4	166.2	-49	0	0	0	0	108.8	E435 K439	E435-S437 PolarHBondContact O-N 2.89Å; E435-S437 VanDerWaalsContact O-N 3.13Å; S437-K439 PolarHBondContact O-N 3.13Å; S437-K439 VanDerWaalsContact O-N 3.12Å
438	D	52.6	Low	56.8	Low	160 Å²	160	107 Å²	107	86%	0.856	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-48.3	123.6	170.6	-93.3	-33.4	0	0	0	108.8	L436 P440	L436-D438 PolarHBondContact O-N 2.96Å; D438-P440 VanDerWaalsContact O-N 3.13Å
439	K	42.9	Very low	55	Low	155 Å²	155	110.9 Å²	110.9	67%	0.674	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-54.9	125.6	176.5	-78	-173.5	175.2	-176.8	0	107.2	S437 K441	S437-K439 PolarHBondContact O-N 3.13Å; S437-K439 VanDerWaalsContact O-N 3.12Å; K439-K441 PolarHBondContact O-N 2.94Å
440	P	36	Very low	53	Low	119 Å²	119	113.1 Å²	113.1	77%	0.773	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-55.8	124.1	172.6	23.7	-32.2	0	0	0	106.9	D438 C442	D438-P440 VanDerWaalsContact O-N 3.13Å; P440-C442 PolarHBondContact O-N 3.26Å; P440-C442 VanDerWaalsContact O-N 3.08Å
441	K	33.5	Very low	50.9	Low	180 Å²	180	121.9 Å²	121.9	78%	0.783	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-53.3	122	174.7	-68.9	178.3	-179.1	174.7	0	106.4	K439 F443	K439-K441 PolarHBondContact O-N 2.94Å; K441-F443 HydrophobicContact CB-CE2 4.4Å; K441-F443 PolarHBondContact O-N 3.19Å
442	C	31.9	Very low	48.3	Very low	129 Å²	129	124.7 Å²	124.7	87%	0.872	66%	0.658	S	S	*	*			trans	-58.6	105.8	170	-82.5	0	0	0	0	107.3	P440	P440-C442 PolarHBondContact O-N 3.26Å; P440-C442 VanDerWaalsContact O-N 3.08Å
443	F	35.3	Very low	46	Very low	185 Å²	185	126.4 Å²	126.4	81%	0.811	68%	0.68	S	S	*	*			trans	-82.7	124.5	155.2	-79.7	-88.3	0	0	0	105.6	K441 E445	K441-F443 HydrophobicContact CB-CE2 4.4Å; K441-F443 PolarHBondContact O-N 3.19Å; F443-E445 PolarHBondContact O-N 3.19Å
444	D	39	Very low	43.4	Very low	159 Å²	159	132.1 Å²	132.1	85%	0.85	72%	0.72	S	S	*	*			trans	-54.3	138	179.7	-70.1	-67.1	0	0	0	111	D446	D444-D446 PolarHBondContact O-N 3.28Å
445	E	34.4	Very low	41.1	Very low	196 Å²	196	133.7 Å²	133.7	92%	0.916	74%	0.737	S	S	*	*			trans	-67.3	113.8	-179.3	-67.7	-176.5	101	0	0	110.8	F443	F443-E445 PolarHBondContact O-N 3.19Å
446	D	37.8	Very low	38.6	Very low	152 Å²	152	138 Å²	138	81%	0.813	76%	0.762	S	S	*	*			trans	-128.8	113.4	153.6	-117.3	-29.3	0	0	0	112.2	D444	D444-D446 PolarHBondContact O-N 3.28Å
447	K	41.1	Very low	36.4	Very low	176 Å²	176	145.1 Å²	145.1	77%	0.765	79%	0.787	S	S	*	*			trans	-34.3	123.2	-178.5	-61.3	149.3	-178.4	163.4	0	115.2
448	N	39	Very low	34.2	Very low	150 Å²	150	151 Å²	151	80%	0.802	81%	0.807	S	S	*	*				171.3	138.1	102.3	-89.4	-44.7	0	0	0	115.2
449	S	39.3	Very low	32.8	Very low	117 Å²	117	149.2 Å²	149.2	82%	0.818	80%	0.802	S	S	*	*			trans	77.8	152	153.7	83.3	0	0	0	0	121
450	A	38.3	Very low	31.7	Very low	84 Å²	84	146.6 Å²	146.6	69%	0.694	80%	0.804	S	S	*	*			trans	74.4	91.8	159.3	0	0	0	0	0	120.3
451	Q	33.5	Very low	31.1	Very low	196 Å²	196	152.6 Å²	152.6	92%	0.916	83%	0.828	S	S	*	*				59.4	131.3	126.8	-73.4	173.4	-30.8	0	0	121.7
452	S	26.9	Very low	31	Very low	114 Å²	114	151.3 Å²	151.3	80%	0.797	83%	0.83	S	S	*	*			trans	-73.6	134	174.4	53	0	0	0	0	114.3
453	T	31.7	Very low	30.9	Very low	131 Å²	131	152.4 Å²	152.4	80%	0.804	83%	0.828	S	S	*	*			trans	-141.6	118.7	146.4	47.5	0	0	0	0	110.6
454	S	25.7	Very low	30.7	Very low	125 Å²	125	150.6 Å²	150.6	87%	0.874	83%	0.829	S	S	*	*			trans	-77.7	119.9	164.8	53	0	0	0	0	109.1
455	S	29.1	Very low	30.2	Very low	83 Å²	83	150.1 Å²	150.1	58%	0.58	83%	0.828	S	S	*	*			trans	-110.8	106.9	172.3	45.9	0	0	0	0	110.7	Y457	S455-Y457 PolarHBondContact O-N 3.37Å
456	L	24.6	Very low	29.9	Very low	179 Å²	179	147.3 Å²	147.3	94%	0.937	82%	0.823	S	S	*	*			trans	-66.8	122.6	157.3	-76.9	155.1	0	0	0	107.5
457	Y	25.2	Very low	29.4	Very low	201 Å²	201	146.9 Å²	146.9	79%	0.788	82%	0.823	S	S	*	*			trans	-104.3	107.2	167.6	-85.2	-79.7	0	0	0	110	S455	S455-Y457 PolarHBondContact O-N 3.37Å
458	H	20.3	Very low	28.6	Very low	180 Å²	180	144.9 Å²	144.9	83%	0.833	83%	0.827	S	S	*	*			trans	-94	118.8	165.6	-167.6	-72.6	0	0	0	106.7
459	T	23.6	Very low	27.8	Very low	122 Å²	122	144.5 Å²	144.5	75%	0.748	83%	0.829	S	S	*	*			trans	-137.7	124.6	171.7	-49.8	0	0	0	0	109.7
460	S	19	Very low	26.8	Very low	101 Å²	101	146.8 Å²	146.8	71%	0.706	83%	0.83	S	S	*	*			trans	-75.9	139	177.1	51	0	0	0	0	112.6
461	L	23.9	Very low	25.8	Very low	245 Å²	245	152.5 Å²	152.5	100%	1.283	84%	0.843	S	S	*	*			trans	-155	0	136.2	-108.8	167.3	0	0	0	109.5

Retrieved 461 of 461 residues in 343.7 ms (Link to these results)

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