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E3 ubiquitin-protein ligase RNF144B

E3 ubiquitin-protein ligase which accepts ubiquitin from E2 ubiquitin-conjugating enzymes UBE2L3 and UBE2L6 in the form of a thioester and then directly transfers the ubiquitin to targeted substrates such as LCMT2, thereby promoting their degradation. Induces apoptosis via a p53/TP53-dependent but caspase-independent mechanism. Plays a crucial role in maintaining the genomic stability by controlling the degradation of multiple proteins involved in mitotic progression and DNA damage. Regulates epithelial homeostasis by mediating degradation of CDKN1A and isoform 2 of TP63. Plays a regulatory role in innate immunity by negatively regulating IRF3 activation and IFN-beta production. Mechanistically, inhibits TBK1 phosphorylation and 'Lys-63'-linked polyubiquitination independently of its E3 ligase activity. Alternatively, promotes 'Lys-27' and 'Lys-33'-linked ubiquitination of IFIH1/MDA5, promoting selective autophagic degradation of IFIH1/MDA5 to inhibit antiviral response.

AlphaFold DB , UniProt , Accession A0A093I964, Species STRCA (Struthio camelus australis), Gene n/a, Length 303 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	40.2	Very low	33	Very low	249 Å²	249	140.6 Å²	140.6	100%	1.227	84%	0.841	S	S	*	*				0	88.8	0	-65.3	160.7	127.5	0	0	105.5
2	G	29.6	Very low	33.6	Very low	73 Å²	73	144.3 Å²	144.3	75%	0.753	85%	0.846	S	S	*	*				100.6	88.1	57.1	0	0	0	0	0	108.1
3	S	28.9	Very low	33.4	Very low	132 Å²	132	143.4 Å²	143.4	92%	0.923	84%	0.844	S	S	*	*			trans	54.9	140.7	143.2	-61.5	0	0	0	0	119.5
4	A	34.6	Very low	33.3	Very low	105 Å²	105	139.6 Å²	139.6	87%	0.868	84%	0.837	S	S	*	*			cis	-156.7	159.7	30.5	0	0	0	0	0	109
5	G	30.6	Very low	34	Very low	68 Å²	68	139.4 Å²	139.4	70%	0.701	83%	0.83	S	S	*	*			cis	136.9	113.3	9.6	0	0	0	0	0	109.9
6	K	34.6	Very low	34	Very low	216 Å²	216	141.6 Å²	141.6	94%	0.939	83%	0.829	S	S	*	*			trans	58.1	151.9	145.8	-88.5	169.3	177.1	175.6	0	118.5
7	A	30.1	Very low	34.8	Very low	86 Å²	86	139.5 Å²	139.5	71%	0.711	82%	0.823	S	S	*	*			cis	-161.5	161.3	14.2	0	0	0	0	0	109.7
8	Y	32.9	Very low	35.1	Very low	205 Å²	205	141.9 Å²	141.9	80%	0.804	82%	0.822	S	S	*	*			trans	-66.5	155.5	160	-78.5	-95	0	0	0	111
9	P	36.3	Very low	35.8	Very low	115 Å²	115	140.2 Å²	140.2	75%	0.747	83%	0.826	S	S	*	*				-130.3	142.2	116.2	20.1	-2.5	0	0	0	113.1
10	H	35.5	Very low	36.1	Very low	167 Å²	167	136.4 Å²	136.4	77%	0.773	82%	0.818	S	S	*	*			trans	-64.7	131.3	161.9	-73.1	-89.9	0	0	0	110.1
11	T	29.8	Very low	36.6	Very low	131 Å²	131	138.2 Å²	138.2	80%	0.804	82%	0.818	S	S	*	*			trans	-135.1	111.6	155.3	10.9	0	0	0	0	107.9
12	M	40.3	Very low	37.4	Very low	184 Å²	184	134.7 Å²	134.7	91%	0.906	80%	0.803	S	S	*	*			trans	-73.2	125.4	163.9	-65.8	-170.2	-179.4	0	0	108.2
13	T	31.5	Very low	39	Very low	133 Å²	133	135.5 Å²	135.5	82%	0.816	80%	0.802	S	S	*	*			trans	-137.8	109.5	154.6	48.6	0	0	0	0	108.6
14	A	31.8	Very low	41	Very low	90 Å²	90	137.1 Å²	137.1	74%	0.744	80%	0.8	S	S	*	*			trans	23.7	118.9	149.7	0	0	0	0	0	119.2	E16	A14-E16 PolarHBondContact O-N 3.32Å
15	D	42.8	Very low	42.9	Very low	137 Å²	137	139 Å²	139	73%	0.733	79%	0.791	S	S	*	*			trans	-0.9	102.8	130.2	-166.4	1.1	0	0	0	115.2	S17	D15-S17 PolarHBondContact OD1-N 3.28Å; D15-S17 VanDerWaalsContact OD1-N 3.13Å; D15-S17 PolarHBondContact OD1-OG 2.84Å
16	E	34.1	Very low	45.5	Very low	175 Å²	175	140.9 Å²	140.9	82%	0.818	79%	0.79	S	S	*	*			trans	-123.1	86.1	148.2	-81.6	-168	136.6	0	0	107.7	A14 K18	A14-E16 PolarHBondContact O-N 3.32Å; E16-K18 VanDerWaalsContact C-N 3.34Å; E16-K18 PolarHBondContact O-N 3.13Å
17	S	48.6	Very low	48.2	Very low	105 Å²	105	135.2 Å²	135.2	73%	0.734	77%	0.77	S	S	*	*			trans	-37	92.2	152.6	-61.8	0	0	0	0	112	D15	D15-S17 PolarHBondContact OD1-N 3.28Å; D15-S17 VanDerWaalsContact OD1-N 3.13Å; D15-S17 PolarHBondContact OD1-OG 2.84Å
18	K	39.3	Very low	51.2	Low	184 Å²	184	134 Å²	134	80%	0.8	75%	0.751	S	S	*	*			trans	-101.2	100	162.8	-90.6	-173.9	177.1	173.9	0	109.4	E16 G20	E16-K18 VanDerWaalsContact C-N 3.34Å; E16-K18 PolarHBondContact O-N 3.13Å; K18-G20 PolarHBondContact O-N 3.21Å; K18-G20 VanDerWaalsContact O-N 3.09Å
19	A	49.8	Very low	54.3	Low	109 Å²	109	128.1 Å²	128.1	90%	0.901	74%	0.737	S	S	*	*			trans	-50.6	110.2	148.9	0	0	0	0	0	107.7
20	G	40	Very low	57.2	Low	64 Å²	64	122.6 Å²	122.6	66%	0.66	70%	0.701	S	S	*	*			trans	-125.6	108.9	-176.7	0	0	0	0	0	109.7	K18	K18-G20 PolarHBondContact O-N 3.21Å; K18-G20 VanDerWaalsContact O-N 3.09Å
21	E	48.2	Very low	60	Low	175 Å²	175	120.5 Å²	120.5	82%	0.818	69%	0.69	S	S	*	*			trans	24.3	111.3	154.6	-130.4	86.9	178.8	0	0	116.9	A23	E21-A23 PolarHBondContact O-N 3.09Å
22	L	56.4	Low	63.1	Low	175 Å²	175	117.8 Å²	117.8	92%	0.916	67%	0.67	S	S	*	*			trans	-61.5	91.3	157.8	-72.8	165.2	0	0	0	107.7	L24	L22-L24 PolarHBondContact O-N 3.35Å
23	A	63.8	Low	65.8	Low	89 Å²	89	111 Å²	111	74%	0.736	64%	0.64	S	S	*	*			trans	-61.7	105.2	171.9	0	0	0	0	0	107.5	E21 E25	E21-A23 PolarHBondContact O-N 3.09Å; A23-E25 PolarHBondContact O-N 2.87Å; A23-E25 VanDerWaalsContact O-N 3.13Å
24	L	69.6	Low	68.9	Low	167 Å²	167	111 Å²	111	87%	0.874	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-56.5	118.8	171.5	-72.6	164.8	0	0	0	107.5	L22	L22-L24 PolarHBondContact O-N 3.35Å
25	E	75.2	Confident	72	Confident	145 Å²	145	109.6 Å²	109.6	68%	0.678	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-57.5	132.3	177.5	-70	-175	152.9	0	0	109.5	A23 L27	A23-E25 PolarHBondContact O-N 2.87Å; A23-E25 VanDerWaalsContact O-N 3.13Å; E25-L27 PolarHBondContact O-N 2.79Å
26	P	84.3	Confident	74.6	Confident	106 Å²	106	109.1 Å²	109.1	69%	0.688	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-63.8	121.4	-178.9	22.8	-30	0	0	0	109.9
27	L	91.8	Very high	77.5	Confident	97 Å²	97	103.4 Å²	103.4	51%	0.508	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-84	142.8	173	-60.7	177	0	0	0	110	E25 E36 Y37	E25-L27 PolarHBondContact O-N 2.79Å; L27-E36 HydrophobicContact CB-CB 4.22Å; L27-E36 HydrophobicContact CD1-CB 4.29Å; L27-Y37 WeakPolarHBondContact CA-O 3.37Å
28	L	94.4	Very high	79.7	Confident	62 Å²	62	99.3 Å²	99.3	33%	0.325	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.3	142.7	175.7	-65.9	171.8	0	0	0	109.3	E36 Y37 L39 M42 I51	L28-E36 CarbonylContact O-C 3.57Å; L28-E36 WeakPolarHBondContact O-CA 3.02Å; L28-Y37 PolarHBondContact N-O 3.18Å; L28-Y37 PolarHBondContact O-N 3.49Å; L28-L39 HydrophobicContact CD1-CD1 3.62Å; L28-M42 VanDerWaalsContact C-CE 3.41Å; L28-M42 HydrophobicContact CB-CE 3.38Å; L28-M42 HydrophobicContact CB-CG 4.22Å; L28-M42 HydrophobicContact CD1-CG 4.11Å; L28-M42 WeakPolarHBondContact O-CE 3.45Å; L28-I51 HydrophobicContact CD1-CG2 4.49Å
29	T	96.5	Very high	82.2	Confident	80 Å²	80	96.1 Å²	96.1	49%	0.491	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	124.9	177	-46.8	0	0	0	0	110.6
30	C	97.1	Very high	84.3	Confident	0 Å²	0	96.6 Å²	96.6	0%	0	53%	0.533	C	S	.	.			trans	-75.1	128.3	173.6	176.7	0	0	0	0	110.4	L32 L34 C35 Y37 M42 C53	C30-L32 VanDerWaalsContact C-N 3.27Å; C30-L32 PolarHBondContact O-N 3.42Å; C30-L32 PolarHBondContact SG-N 3.31Å; C30-L34 WeakPolarHBondContact O-CA 3.48Å; C30-L34 PolarHBondContact O-N 3.27Å; C30-C35 PolarHBondContact N-O 2.97Å; C30-Y37 HydrophobicContact CB-CD2 4.08Å; C30-Y37 HydrophobicContact CB-CE2 3.91Å; C30-M42 HydrophobicContact CB-CE 4.28Å; C30-C53 HydrophobicContact CB-CB 3.95Å; C30-C53 PolarHBondContact SG-N 2.99Å; C30-C53 VanDerWaalsContact SG-N 3.35Å; C30-C53 PolarHBondContact SG-SG 3.07Å
31	K	94.4	Very high	87	Confident	123 Å²	123	99 Å²	99	54%	0.535	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-14.3	-179.9	-59.4	-175	-173.9	-174.9	0	114.9	F52 D77	K31-F52 HydrophobicContact CB-CD1 4.37Å; K31-F52 HydrophobicContact CB-CE1 4.12Å; K31-D77 IonicContact NZ-OD2 2.76Å; K31-D77 PolarHBondContact NZ-OD2 3.46Å
32	L	96.1	Very high	89.3	Confident	73 Å²	73	91.5 Å²	91.5	38%	0.382	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-47.9	-178.9	-68.9	173.5	0	0	0	112.5	C30 F52 C56 P76	C30-L32 VanDerWaalsContact C-N 3.27Å; C30-L32 PolarHBondContact O-N 3.42Å; C30-L32 PolarHBondContact SG-N 3.31Å; L32-F52 HydrophobicContact CD1-CB 4.48Å; L32-F52 HydrophobicContact CD1-CD1 3.84Å; L32-F52 HydrophobicContact CD1-CE1 4.35Å; L32-F52 HydrophobicContact CD1-CG 4.28Å; L32-F52 HydrophobicContact CG-CD1 3.73Å; L32-F52 HydrophobicContact CG-CE1 4.05Å; L32-C56 HydrophobicContact CB-CB 3.87Å; L32-C56 HydrophobicContact CD1-CB 3.74Å; L32-C56 HydrophobicContact CG-CB 4.46Å; L32-P76 HydrophobicContact CD1-CB 4.05Å; L32-P76 HydrophobicContact CD1-CG 4.23Å; L32-P76 HydrophobicContact CD2-CB 3.85Å; L32-P76 HydrophobicContact CG-CB 4.37Å
33	C	97	Very high	91.2	Very high	43 Å²	43	84.6 Å²	84.6	29%	0.291	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-6.2	178.8	70.4	0	0	0	0	114	C35 Y37 C56	C33-C35 PolarHBondContact O-N 3.29Å; C33-C35 VanDerWaalsContact O-N 3.16Å; C33-C35 PolarHBondContact O-SG 3.13Å; C33-C35 VanDerWaalsContact O-SG 3.35Å; C33-C35 VanDerWaalsContact SG-SG 3.67Å; C33-Y37 VanDerWaalsContact SG-CE2 3.6Å; C33-Y37 PolarHBondContact SG-OH 3.04Å; C33-Y37 VanDerWaalsContact SG-OH 3.38Å; C33-C56 VanDerWaalsContact CB-SG 3.53Å
34	L	96.3	Very high	92.7	Very high	133 Å²	133	83.7 Å²	83.7	70%	0.696	44%	0.441	S	S	*	.			trans	61.3	18.6	-179.3	-48.8	178.4	0	0	0	114.5	C30	C30-L34 WeakPolarHBondContact O-CA 3.48Å; C30-L34 PolarHBondContact O-N 3.27Å
35	C	96.9	Very high	94	Very high	59 Å²	59	75.9 Å²	75.9	40%	0.399	40%	0.4	S	S	.	.			trans	-96.7	156.7	176.4	-48.6	0	0	0	0	111.5	C30 C33 Y37	C30-C35 PolarHBondContact N-O 2.97Å; C33-C35 PolarHBondContact O-N 3.29Å; C33-C35 VanDerWaalsContact O-N 3.16Å; C33-C35 PolarHBondContact O-SG 3.13Å; C33-C35 VanDerWaalsContact O-SG 3.35Å; C33-C35 VanDerWaalsContact SG-SG 3.67Å; C35-Y37 HydrophobicContact CB-CD2 4.43Å; C35-Y37 HydrophobicContact CB-CE2 3.57Å; C35-Y37 WeakPolarHBondContact O-CD2 3.43Å; C35-Y37 WeakPolarHBondContact O-CE2 3.48Å
36	E	96.4	Very high	94.9	Very high	128 Å²	128	74.3 Å²	74.3	60%	0.598	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	137.5	176.8	-65.9	-177.3	166.1	0	0	111.6	L27 L28	L27-E36 HydrophobicContact CB-CB 4.22Å; L27-E36 HydrophobicContact CD1-CB 4.29Å; L28-E36 CarbonylContact O-C 3.57Å; L28-E36 WeakPolarHBondContact O-CA 3.02Å
37	Y	95.5	Very high	95.5	Very high	54 Å²	54	74 Å²	74	21%	0.212	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	151.9	-180	-59.9	-88.1	0	0	0	111	L27 L28 C30 C33 C35 K41 M42 C53	L27-Y37 WeakPolarHBondContact CA-O 3.37Å; L28-Y37 PolarHBondContact N-O 3.18Å; L28-Y37 PolarHBondContact O-N 3.49Å; C30-Y37 HydrophobicContact CB-CD2 4.08Å; C30-Y37 HydrophobicContact CB-CE2 3.91Å; C33-Y37 VanDerWaalsContact SG-CE2 3.6Å; C33-Y37 PolarHBondContact SG-OH 3.04Å; C33-Y37 VanDerWaalsContact SG-OH 3.38Å; C35-Y37 HydrophobicContact CB-CD2 4.43Å; C35-Y37 HydrophobicContact CB-CE2 3.57Å; C35-Y37 WeakPolarHBondContact O-CD2 3.43Å; C35-Y37 WeakPolarHBondContact O-CE2 3.48Å; Y37-K41 HydrophobicContact CD1-CB 4.33Å; Y37-K41 HydrophobicContact CD1-CD 4.22Å; Y37-M42 HydrophobicContact CD2-CE 4.12Å; Y37-M42 HydrophobicContact CD2-SD 4.33Å; Y37-C53 HydrophobicContact CD1-CB 4.4Å; Y37-C53 HydrophobicContact CD2-CB 3.51Å; Y37-C53 HydrophobicContact CE1-CB 4.39Å; Y37-C53 HydrophobicContact CE2-CB 3.48Å; Y37-C53 VanDerWaalsContact CE2-CB 3.48Å; Y37-C53 HydrophobicContact CG-CB 3.98Å
38	S	94.8	Very high	95.7	Very high	19 Å²	19	69.8 Å²	69.8	13%	0.133	36%	0.36	C	S	.	.			trans	-67.1	157.7	166.9	50.5	0	0	0	0	111.1	D40 K41	S38-D40 VanDerWaalsContact C-N 3.26Å; S38-D40 WeakPolarHBondContact CB-OD1 3.43Å; S38-D40 PolarHBondContact O-N 2.97Å; S38-D40 PolarHBondContact OG-OD1 3.28Å; S38-K41 PolarHBondContact O-N 2.5Å; S38-K41 VanDerWaalsContact O-N 3.08Å
39	L	92.8	Very high	95.7	Very high	117 Å²	117	70.7 Å²	70.7	61%	0.613	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-60	-33.1	-174	-173.7	67.6	0	0	0	113.3	L28 K41 M42	L28-L39 HydrophobicContact CD1-CD1 3.62Å; L39-K41 PolarHBondContact O-N 3.46Å; L39-M42 WeakPolarHBondContact O-CB 3.45Å; L39-M42 PolarHBondContact O-N 3.31Å; L39-M42 VanDerWaalsContact O-N 3.07Å
40	D	93.9	Very high	95.7	Very high	119 Å²	119	67.8 Å²	67.8	64%	0.636	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-63.6	-24.6	177.6	65.5	-59.1	0	0	0	113.4	S38	S38-D40 VanDerWaalsContact C-N 3.26Å; S38-D40 WeakPolarHBondContact CB-OD1 3.43Å; S38-D40 PolarHBondContact O-N 2.97Å; S38-D40 PolarHBondContact OG-OD1 3.28Å
41	K	95.4	Very high	95.6	Very high	115 Å²	115	70.8 Å²	70.8	50%	0.5	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-93.3	-2.5	177.2	-64.9	179.9	-174.4	170.7	0	112.5	Y37 S38 L39 T54	Y37-K41 HydrophobicContact CD1-CB 4.33Å; Y37-K41 HydrophobicContact CD1-CD 4.22Å; S38-K41 PolarHBondContact O-N 2.5Å; S38-K41 VanDerWaalsContact O-N 3.08Å; L39-K41 PolarHBondContact O-N 3.46Å; K41-T54 WeakPolarHBondContact O-CB 3.35Å; K41-T54 PolarHBondContact O-N 3.17Å; K41-T54 PolarHBondContact O-OG1 2.83Å
42	M	96.7	Very high	95.8	Very high	18 Å²	18	65 Å²	65	9%	0.089	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	147.6	178.4	-65.2	-58.9	-145.9	0	0	111.3	L28 C30 Y37 L39 I51 F52 C53	L28-M42 VanDerWaalsContact C-CE 3.41Å; L28-M42 HydrophobicContact CB-CE 3.38Å; L28-M42 HydrophobicContact CB-CG 4.22Å; L28-M42 HydrophobicContact CD1-CG 4.11Å; L28-M42 WeakPolarHBondContact O-CE 3.45Å; C30-M42 HydrophobicContact CB-CE 4.28Å; Y37-M42 HydrophobicContact CD2-CE 4.12Å; Y37-M42 HydrophobicContact CD2-SD 4.33Å; L39-M42 WeakPolarHBondContact O-CB 3.45Å; L39-M42 PolarHBondContact O-N 3.31Å; L39-M42 VanDerWaalsContact O-N 3.07Å; M42-I51 HydrophobicContact CB-CG2 3.77Å; M42-I51 HydrophobicContact CG-CG2 4.22Å; M42-I51 HydrophobicContact SD-CG2 4.48Å; M42-F52 CarbonylContact C-O 3.58Å; M42-F52 WeakPolarHBondContact CA-O 3.26Å; M42-C53 WeakPolarHBondContact SD-CA 3.28Å; M42-C53 HydrophobicContact SD-CB 3.78Å; M42-C53 PolarHBondContact SD-N 3.25Å
43	T	96.5	Very high	95.9	Very high	29 Å²	29	61.5 Å²	61.5	18%	0.178	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	131.3	172.5	-55.9	0	0	0	0	108.7	I51 F52 T54 L57 L94	T43-I51 WeakPolarHBondContact O-CA 3.36Å; T43-F52 PolarHBondContact N-O 3.2Å; T43-F52 PolarHBondContact O-N 3.41Å; T43-T54 PolarHBondContact OG1-OG1 2.98Å; T43-L57 HydrophobicContact CG2-CD2 3.75Å; T43-L94 HydrophobicContact CG2-CD1 4.33Å
44	T	95.9	Very high	95.9	Very high	70 Å²	70	61 Å²	61	43%	0.429	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	126.6	175.6	-56.1	0	0	0	0	109.1	I51	T44-I51 HydrophobicContact CG2-CG1 4.08Å
45	L	96.1	Very high	95.9	Very high	4 Å²	4	57.6 Å²	57.6	2%	0.021	31%	0.31	C	S	.	.			trans	-71.6	137.6	176	-63.4	-174	0	0	0	111.2	S49 C50 F52 L57 C75 L86 E90	L45-S49 WeakPolarHBondContact O-CA 3.33Å; L45-S49 PolarHBondContact O-N 3.4Å; L45-C50 HydrophobicContact CD1-CB 4.39Å; L45-C50 PolarHBondContact N-O 3.43Å; L45-F52 HydrophobicContact CD1-CD2 4.42Å; L45-F52 HydrophobicContact CD1-CE2 3.88Å; L45-F52 HydrophobicContact CG-CD2 4.47Å; L45-F52 HydrophobicContact CG-CE2 4.34Å; L45-L57 HydrophobicContact CD2-CD1 4.16Å; L45-L57 HydrophobicContact CD2-CD2 3.69Å; L45-C75 HydrophobicContact CD1-CB 4.17Å; L45-L86 HydrophobicContact CD1-CD1 4.23Å; L45-L86 HydrophobicContact CD2-CD2 4.05Å; L45-L86 HydrophobicContact CD2-CG 4.03Å; L45-E90 WeakPolarHBondContact CA-OE1 3.44Å
46	Q	95.1	Very high	96	Very high	112 Å²	112	55.5 Å²	55.5	52%	0.523	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-45.5	-171.7	-68.8	-179.2	16.8	0	0	113.5	Q87 E90	Q46-Q87 VanDerWaalsContact OE1-OE1 3.11Å; Q46-E90 HydrophobicContact CG-CG 4.07Å; Q46-E90 WeakPolarHBondContact CG-OE1 3.43Å; Q46-E90 PolarHBondContact N-OE1 3.18Å
47	E	95.5	Very high	96	Very high	99 Å²	99	49.4 Å²	49.4	46%	0.463	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-36.5	-175	-70.4	-170.8	-178	0	0	113.4	T85 Q87	E47-T85 PolarHBondContact OE2-N 2.88Å; E47-Q87 HydrophobicContact CG-CG 4.44Å
48	C	96.1	Very high	96.1	Very high	8 Å²	8	51 Å²	51	5%	0.054	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-7.4	-172.7	61.6	0	0	0	0	115.1	C50 C80 N82	C48-C50 PolarHBondContact O-N 2.92Å; C48-C50 VanDerWaalsContact O-N 3.12Å; C48-C50 VanDerWaalsContact SG-SG 3.69Å; C48-C80 WeakPolarHBondContact CB-SG 3.49Å; C48-N82 HydrophobicContact CB-CB 3.74Å; C48-N82 PolarHBondContact O-ND2 3.06Å
49	S	95.3	Very high	96.2	Very high	82 Å²	82	56.2 Å²	56.2	57%	0.573	30%	0.297	S	S	*	.			trans	58.6	15.5	-176.1	-56.5	0	0	0	0	114.9	L45	L45-S49 WeakPolarHBondContact O-CA 3.33Å; L45-S49 PolarHBondContact O-N 3.4Å
50	C	96	Very high	96.4	Very high	19 Å²	19	53.6 Å²	53.6	13%	0.128	28%	0.28	C	S	.	.			trans	-68.1	141.9	172.4	-65.8	0	0	0	0	110.4	L45 C48 F52 C80	L45-C50 HydrophobicContact CD1-CB 4.39Å; L45-C50 PolarHBondContact N-O 3.43Å; C48-C50 PolarHBondContact O-N 2.92Å; C48-C50 VanDerWaalsContact O-N 3.12Å; C48-C50 VanDerWaalsContact SG-SG 3.69Å; C50-F52 HydrophobicContact CB-CE2 3.63Å; C50-F52 HydrophobicContact CB-CZ 4.04Å; C50-C80 VanDerWaalsContact SG-SG 3.62Å
51	I	95.8	Very high	96.5	Very high	62 Å²	62	47.9 Å²	47.9	32%	0.318	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	132	-173.2	-51.6	-179.1	0	0	0	109.9	L28 M42 T43 T44	L28-I51 HydrophobicContact CD1-CG2 4.49Å; M42-I51 HydrophobicContact CB-CG2 3.77Å; M42-I51 HydrophobicContact CG-CG2 4.22Å; M42-I51 HydrophobicContact SD-CG2 4.48Å; T43-I51 WeakPolarHBondContact O-CA 3.36Å; T44-I51 HydrophobicContact CG2-CG1 4.08Å
52	F	97.5	Very high	96.5	Very high	1 Å²	1	45.3 Å²	45.3	0%	0.004	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	159.8	176.5	-53.4	-86.4	0	0	0	110.1	K31 L32 M42 T43 L45 C50 L57 P76 D77	K31-F52 HydrophobicContact CB-CD1 4.37Å; K31-F52 HydrophobicContact CB-CE1 4.12Å; L32-F52 HydrophobicContact CD1-CB 4.48Å; L32-F52 HydrophobicContact CD1-CD1 3.84Å; L32-F52 HydrophobicContact CD1-CE1 4.35Å; L32-F52 HydrophobicContact CD1-CG 4.28Å; L32-F52 HydrophobicContact CG-CD1 3.73Å; L32-F52 HydrophobicContact CG-CE1 4.05Å; M42-F52 CarbonylContact C-O 3.58Å; M42-F52 WeakPolarHBondContact CA-O 3.26Å; T43-F52 PolarHBondContact N-O 3.2Å; T43-F52 PolarHBondContact O-N 3.41Å; L45-F52 HydrophobicContact CD1-CD2 4.42Å; L45-F52 HydrophobicContact CD1-CE2 3.88Å; L45-F52 HydrophobicContact CG-CD2 4.47Å; L45-F52 HydrophobicContact CG-CE2 4.34Å; C50-F52 HydrophobicContact CB-CE2 3.63Å; C50-F52 HydrophobicContact CB-CZ 4.04Å; F52-L57 HydrophobicContact CD2-CD1 4.42Å; F52-P76 HydrophobicContact CE1-CB 4.22Å; F52-P76 HydrophobicContact CE1-CG 4.47Å; F52-P76 HydrophobicContact CE2-CG 4.1Å; F52-P76 HydrophobicContact CZ-CB 4.04Å; F52-P76 HydrophobicContact CZ-CG 4.04Å; F52-D77 HydrophobicContact CE1-CB 4.44Å; F52-D77 HydrophobicContact CZ-CB 3.88Å
53	C	97.8	Very high	96.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	142.8	170	71.9	0	0	0	0	110	C30 Y37 M42 S55 C56 L57	C30-C53 HydrophobicContact CB-CB 3.95Å; C30-C53 PolarHBondContact SG-N 2.99Å; C30-C53 VanDerWaalsContact SG-N 3.35Å; C30-C53 PolarHBondContact SG-SG 3.07Å; Y37-C53 HydrophobicContact CD1-CB 4.4Å; Y37-C53 HydrophobicContact CD2-CB 3.51Å; Y37-C53 HydrophobicContact CE1-CB 4.39Å; Y37-C53 HydrophobicContact CE2-CB 3.48Å; Y37-C53 VanDerWaalsContact CE2-CB 3.48Å; Y37-C53 HydrophobicContact CG-CB 3.98Å; M42-C53 WeakPolarHBondContact SD-CA 3.28Å; M42-C53 HydrophobicContact SD-CB 3.78Å; M42-C53 PolarHBondContact SD-N 3.25Å; C53-S55 PolarHBondContact O-N 3.08Å; C53-S55 PolarHBondContact SG-OG 2.83Å; C53-S55 VanDerWaalsContact SG-OG 3.36Å; C53-C56 PolarHBondContact O-N 3.36Å; C53-C56 VanDerWaalsContact SG-CB 3.57Å; C53-C56 PolarHBondContact SG-SG 3.38Å; C53-L57 PolarHBondContact O-N 2.86Å; C53-L57 VanDerWaalsContact O-N 3.12Å
54	T	97.3	Very high	96.3	Very high	34 Å²	34	48.1 Å²	48.1	21%	0.209	26%	0.256	C	S	.	.	H	α-helix	trans	-57.6	-39.6	-174.4	-53.8	0	0	0	0	110.9	K41 T43 L57 K58 L94	K41-T54 WeakPolarHBondContact O-CB 3.35Å; K41-T54 PolarHBondContact O-N 3.17Å; K41-T54 PolarHBondContact O-OG1 2.83Å; T43-T54 PolarHBondContact OG1-OG1 2.98Å; T54-L57 PolarHBondContact O-N 3.28Å; T54-K58 HydrophobicContact CG2-CD 4.39Å; T54-K58 HydrophobicContact CG2-CG 4.45Å; T54-K58 VanDerWaalsContact O-CG 3.26Å; T54-K58 WeakPolarHBondContact O-CG 3.46Å; T54-K58 PolarHBondContact O-N 2.8Å; T54-L94 HydrophobicContact CG2-CD2 3.99Å
55	S	97.4	Very high	96.3	Very high	60 Å²	60	44.9 Å²	44.9	42%	0.42	24%	0.236	S	C	.	.	H	α-helix	trans	-61.7	-47.5	179.9	52.3	0	0	0	0	113	C53 L57 K58 Q59	C53-S55 PolarHBondContact O-N 3.08Å; C53-S55 PolarHBondContact SG-OG 2.83Å; C53-S55 VanDerWaalsContact SG-OG 3.36Å; S55-L57 VanDerWaalsContact C-N 3.34Å; S55-K58 PolarHBondContact O-N 3.35Å; S55-Q59 PolarHBondContact O-N 2.87Å
56	C	98	Very high	96.1	Very high	15 Å²	15	50.4 Å²	50.4	10%	0.101	26%	0.261	C	S	.	.	H	α-helix	trans	-64.7	-40.3	177.5	-73.9	0	0	0	0	111.8	L32 C33 C53 K58 Q59 Y60	L32-C56 HydrophobicContact CB-CB 3.87Å; L32-C56 HydrophobicContact CD1-CB 3.74Å; L32-C56 HydrophobicContact CG-CB 4.46Å; C33-C56 VanDerWaalsContact CB-SG 3.53Å; C53-C56 PolarHBondContact O-N 3.36Å; C53-C56 VanDerWaalsContact SG-CB 3.57Å; C53-C56 PolarHBondContact SG-SG 3.38Å; C56-K58 VanDerWaalsContact C-N 3.35Å; C56-K58 PolarHBondContact O-N 3.19Å; C56-Q59 PolarHBondContact O-N 3.46Å; C56-Y60 WeakPolarHBondContact O-CB 3.02Å; C56-Y60 PolarHBondContact O-N 2.96Å
57	L	97.1	Very high	95.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.7	-41.5	179.9	-166.9	61.5	0	0	0	111.3	T43 L45 F52 C53 T54 S55 Q59 Y60 M61 P76 L86 L94	T43-L57 HydrophobicContact CG2-CD2 3.75Å; L45-L57 HydrophobicContact CD2-CD1 4.16Å; L45-L57 HydrophobicContact CD2-CD2 3.69Å; F52-L57 HydrophobicContact CD2-CD1 4.42Å; C53-L57 PolarHBondContact O-N 2.86Å; C53-L57 VanDerWaalsContact O-N 3.12Å; T54-L57 PolarHBondContact O-N 3.28Å; S55-L57 VanDerWaalsContact C-N 3.34Å; L57-Q59 PolarHBondContact O-N 3.36Å; L57-Y60 HydrophobicContact CD1-CD1 4.37Å; L57-Y60 PolarHBondContact O-N 3.33Å; L57-M61 HydrophobicContact CD1-SD 4.48Å; L57-M61 HydrophobicContact CG-SD 3.98Å; L57-M61 WeakPolarHBondContact O-CG 3.49Å; L57-M61 PolarHBondContact O-N 3.43Å; L57-P76 HydrophobicContact CD1-CG 4.04Å; L57-L86 HydrophobicContact CD1-CD2 4.25Å; L57-L94 HydrophobicContact CD2-CD1 3.55Å; L57-L94 HydrophobicContact CG-CD1 4.01Å
58	K	97.2	Very high	95.3	Very high	88 Å²	88	46.7 Å²	46.7	38%	0.383	25%	0.248	S	C	.	.	H	α-helix	trans	-57.4	-49.5	173.8	-70.9	-172.7	171.9	-179.1	0	112.6	T54 S55 C56 M61 Q62 L94	T54-K58 HydrophobicContact CG2-CD 4.39Å; T54-K58 HydrophobicContact CG2-CG 4.45Å; T54-K58 VanDerWaalsContact O-CG 3.26Å; T54-K58 WeakPolarHBondContact O-CG 3.46Å; T54-K58 PolarHBondContact O-N 2.8Å; S55-K58 PolarHBondContact O-N 3.35Å; C56-K58 VanDerWaalsContact C-N 3.35Å; C56-K58 PolarHBondContact O-N 3.19Å; K58-M61 PolarHBondContact O-N 2.95Å; K58-Q62 VanDerWaalsContact O-CG 3.31Å; K58-Q62 WeakPolarHBondContact O-CG 3.37Å; K58-Q62 PolarHBondContact O-N 3.14Å; K58-L94 WeakPolarHBondContact CD-O 3.47Å; K58-L94 WeakPolarHBondContact CE-O 3.42Å; K58-L94 HydrophobicContact CG-CB 4.23Å; K58-L94 HydrophobicContact CG-CD2 4.18Å; K58-L94 WeakPolarHBondContact CG-O 3.5Å
59	Q	97	Very high	94.9	Very high	128 Å²	128	48.6 Å²	48.6	60%	0.598	26%	0.26	S	S	*	.	H	α-helix	trans	-62.4	-45.1	179	-72.6	175.8	-14.8	0	0	111.7	S55 C56 L57 M61 Q62 L63	S55-Q59 PolarHBondContact O-N 2.87Å; C56-Q59 PolarHBondContact O-N 3.46Å; L57-Q59 PolarHBondContact O-N 3.36Å; Q59-M61 VanDerWaalsContact C-N 3.33Å; Q59-M61 PolarHBondContact O-N 3.28Å; Q59-Q62 PolarHBondContact O-N 3.3Å; Q59-L63 PolarHBondContact O-N 3.21Å
60	Y	96.9	Very high	94.6	Very high	62 Å²	62	45 Å²	45	24%	0.243	24%	0.236	C	C	.	.	H	α-helix	trans	-56.3	-48	176.3	170.5	-100.6	0	0	0	111.6	C56 L57 L63 A64 I73 T74 P76	C56-Y60 WeakPolarHBondContact O-CB 3.02Å; C56-Y60 PolarHBondContact O-N 2.96Å; L57-Y60 HydrophobicContact CD1-CD1 4.37Å; L57-Y60 PolarHBondContact O-N 3.33Å; Y60-L63 PolarHBondContact O-N 3.34Å; Y60-A64 VanDerWaalsContact O-CB 3.31Å; Y60-A64 WeakPolarHBondContact O-CB 3.26Å; Y60-A64 PolarHBondContact O-N 3.06Å; Y60-I73 HydrophobicContact CD1-CG2 4.43Å; Y60-I73 HydrophobicContact CE1-CG2 3.62Å; Y60-T74 WeakPolarHBondContact CE1-O 3.45Å; Y60-T74 PolarHBondContact OH-O 3.49Å; Y60-P76 HydrophobicContact CD1-CG 3.67Å; Y60-P76 HydrophobicContact CD2-CB 4.32Å; Y60-P76 HydrophobicContact CD2-CG 4.32Å; Y60-P76 HydrophobicContact CE1-CB 4.42Å; Y60-P76 HydrophobicContact CE1-CG 3.69Å; Y60-P76 HydrophobicContact CE2-CB 4.25Å; Y60-P76 HydrophobicContact CE2-CG 4.36Å; Y60-P76 HydrophobicContact CG-CB 4.45Å; Y60-P76 HydrophobicContact CG-CG 3.99Å
61	M	95.9	Very high	94.3	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.1	-40.5	-178.3	-66.4	172.2	85.8	0	0	111.9	L57 K58 Q59 L63 A64 I65 L86 I91 L94 V95	L57-M61 HydrophobicContact CD1-SD 4.48Å; L57-M61 HydrophobicContact CG-SD 3.98Å; L57-M61 WeakPolarHBondContact O-CG 3.49Å; L57-M61 PolarHBondContact O-N 3.43Å; K58-M61 PolarHBondContact O-N 2.95Å; Q59-M61 VanDerWaalsContact C-N 3.33Å; Q59-M61 PolarHBondContact O-N 3.28Å; M61-L63 VanDerWaalsContact C-N 3.33Å; M61-L63 PolarHBondContact O-N 2.94Å; M61-A64 PolarHBondContact O-N 3.27Å; M61-I65 WeakPolarHBondContact O-CD1 3.01Å; M61-I65 WeakPolarHBondContact O-CG1 3.43Å; M61-I65 PolarHBondContact O-N 3.09Å; M61-L86 HydrophobicContact CE-CB 4.33Å; M61-L86 HydrophobicContact CE-CD2 3.38Å; M61-L86 HydrophobicContact CE-CG 4.47Å; M61-L86 HydrophobicContact CG-CD2 3.76Å; M61-L86 HydrophobicContact SD-CD2 3.6Å; M61-I91 HydrophobicContact CE-CB 3.75Å; M61-I91 HydrophobicContact CE-CG1 3.32Å; M61-I91 HydrophobicContact CE-CG2 4.11Å; M61-L94 HydrophobicContact CE-CB 4.36Å; M61-L94 HydrophobicContact CE-CD1 4.15Å; M61-L94 HydrophobicContact SD-CB 3.7Å; M61-L94 HydrophobicContact SD-CD1 3.42Å; M61-L94 WeakPolarHBondContact SD-CD1 3.32Å; M61-L94 HydrophobicContact SD-CG 4.21Å; M61-V95 HydrophobicContact CB-CG1 3.62Å
62	Q	96	Very high	94.1	Very high	60 Å²	60	45.3 Å²	45.3	28%	0.28	24%	0.242	S	C	.	.	H	α-helix	trans	-59.3	-45.1	175	-73.5	174.1	-31.8	0	0	111.7	K58 Q59 I65 Q66 V95 P96 Q99	K58-Q62 VanDerWaalsContact O-CG 3.31Å; K58-Q62 WeakPolarHBondContact O-CG 3.37Å; K58-Q62 PolarHBondContact O-N 3.14Å; Q59-Q62 PolarHBondContact O-N 3.3Å; Q62-I65 PolarHBondContact O-N 3.13Å; Q62-Q66 WeakPolarHBondContact O-CG 3.34Å; Q62-Q66 PolarHBondContact O-N 3.13Å; Q62-Q66 VanDerWaalsContact O-N 3.14Å; Q62-V95 HydrophobicContact CG-CG1 4.35Å; Q62-P96 VanDerWaalsContact NE2-CD 3.29Å; Q62-Q99 PolarHBondContact O-NE2 3.45Å
63	L	95.1	Very high	94	Very high	84 Å²	84	45.5 Å²	45.5	44%	0.44	24%	0.243	S	C	.	.	H	α-helix	trans	-65.4	-45.2	176.7	-175.2	66.3	0	0	0	111.5	Q59 Y60 M61 I65 Q66 E67	Q59-L63 PolarHBondContact O-N 3.21Å; Y60-L63 PolarHBondContact O-N 3.34Å; M61-L63 VanDerWaalsContact C-N 3.33Å; M61-L63 PolarHBondContact O-N 2.94Å; L63-I65 VanDerWaalsContact C-N 3.28Å; L63-I65 PolarHBondContact O-N 2.99Å; L63-Q66 PolarHBondContact O-N 3.36Å; L63-Q66 VanDerWaalsContact O-N 3.14Å; L63-E67 HydrophobicContact CD1-CG 3.96Å; L63-E67 WeakPolarHBondContact CD1-OE1 3.19Å; L63-E67 HydrophobicContact CG-CG 4.41Å; L63-E67 PolarHBondContact O-N 3.35Å
64	A	94.3	Very high	93.8	Very high	22 Å²	22	49 Å²	49	18%	0.182	26%	0.264	C	S	.	.	H	α-helix	trans	-61.5	-35.1	179.1	0	0	0	0	0	112.6	Y60 M61 G68 I73	Y60-A64 VanDerWaalsContact O-CB 3.31Å; Y60-A64 WeakPolarHBondContact O-CB 3.26Å; Y60-A64 PolarHBondContact O-N 3.06Å; M61-A64 PolarHBondContact O-N 3.27Å; A64-G68 WeakPolarHBondContact O-CA 3.41Å; A64-G68 PolarHBondContact O-N 3Å; A64-I73 HydrophobicContact CB-CD1 4.26Å; A64-I73 HydrophobicContact CB-CG1 4.15Å; A64-I73 HydrophobicContact CB-CG2 3.83Å
65	I	95.4	Very high	93.8	Very high	3 Å²	3	47.9 Å²	47.9	2%	0.015	26%	0.258	C	S	.	.	H	α-helix	trans	-67.5	-45.9	173.9	-68.2	165.8	0	0	0	110.7	M61 Q62 L63 I73 I91 V95 Q99 L102 Y103	M61-I65 WeakPolarHBondContact O-CD1 3.01Å; M61-I65 WeakPolarHBondContact O-CG1 3.43Å; M61-I65 PolarHBondContact O-N 3.09Å; Q62-I65 PolarHBondContact O-N 3.13Å; L63-I65 VanDerWaalsContact C-N 3.28Å; L63-I65 PolarHBondContact O-N 2.99Å; I65-I73 HydrophobicContact CD1-CD1 4.36Å; I65-I73 HydrophobicContact CG1-CD1 3.69Å; I65-I91 HydrophobicContact CD1-CG2 4.05Å; I65-V95 HydrophobicContact CD1-CB 4.41Å; I65-V95 HydrophobicContact CD1-CG1 4.02Å; I65-V95 HydrophobicContact CD1-CG2 4.03Å; I65-Q99 HydrophobicContact CD1-CB 4.48Å; I65-L102 HydrophobicContact CG2-CB 4.47Å; I65-L102 HydrophobicContact CG2-CD2 4.12Å; I65-L102 HydrophobicContact CG2-CG 4.17Å; I65-Y103 HydrophobicContact CG1-CD2 4.04Å; I65-Y103 HydrophobicContact CG1-CG 4.29Å
66	Q	91.8	Very high	93.7	Very high	119 Å²	119	46 Å²	46	56%	0.556	25%	0.245	S	C	*	.	H	α-helix	trans	-66.5	-40.6	-177.2	-73.6	175.3	-15.8	0	0	112.6	Q62 L63	Q62-Q66 WeakPolarHBondContact O-CG 3.34Å; Q62-Q66 PolarHBondContact O-N 3.13Å; Q62-Q66 VanDerWaalsContact O-N 3.14Å; L63-Q66 PolarHBondContact O-N 3.36Å; L63-Q66 VanDerWaalsContact O-N 3.14Å
67	E	88.8	Confident	93.6	Very high	122 Å²	122	46.4 Å²	46.4	57%	0.57	25%	0.246	S	C	*	.	H	α-helix	trans	-97.9	-19	-174.6	-61.3	-171	159	0	0	114.1	L63 C69	L63-E67 HydrophobicContact CD1-CG 3.96Å; L63-E67 WeakPolarHBondContact CD1-OE1 3.19Å; L63-E67 HydrophobicContact CG-CG 4.41Å; L63-E67 PolarHBondContact O-N 3.35Å; E67-C69 VanDerWaalsContact C-N 3.33Å; E67-C69 PolarHBondContact O-N 2.8Å
68	G	85.8	Confident	93.1	Very high	12 Å²	12	53.1 Å²	53.1	12%	0.124	29%	0.287	C	S	.	.	S	Bend	trans	-79.7	-9.4	-169.9	0	0	0	0	0	115.1	A64 G70 S71	A64-G68 WeakPolarHBondContact O-CA 3.41Å; A64-G68 PolarHBondContact O-N 3Å; G68-G70 PolarHBondContact O-N 3.17Å; G68-S71 VanDerWaalsContact O-CB 3.29Å; G68-S71 WeakPolarHBondContact O-CB 3.08Å; G68-S71 PolarHBondContact O-N 3.48Å; G68-S71 PolarHBondContact O-OG 3.34Å
69	C	85.8	Confident	92.8	Very high	48 Å²	48	54 Å²	54	32%	0.324	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	44.7	-176.7	-55.9	0	0	0	0	112.4	E67 S71 N213	E67-C69 VanDerWaalsContact C-N 3.33Å; E67-C69 PolarHBondContact O-N 2.8Å; C69-S71 VanDerWaalsContact C-N 3.31Å; C69-S71 PolarHBondContact O-N 3.36Å; C69-N213 PolarHBondContact O-OD1 2.74Å
70	G	89.3	Confident	92.7	Very high	5 Å²	5	48.3 Å²	48.3	5%	0.052	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	7	179.2	0	0	0	0	0	115.6	G68 R110	G68-G70 PolarHBondContact O-N 3.17Å; G70-R110 WeakPolarHBondContact O-CD 3.44Å
71	S	89.4	Confident	92.4	Very high	18 Å²	18	52.9 Å²	52.9	13%	0.126	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-63.4	151.4	172.6	67.9	0	0	0	0	111.8	G68 C69 I73	G68-S71 VanDerWaalsContact O-CB 3.29Å; G68-S71 WeakPolarHBondContact O-CB 3.08Å; G68-S71 PolarHBondContact O-N 3.48Å; G68-S71 PolarHBondContact O-OG 3.34Å; C69-S71 VanDerWaalsContact C-N 3.31Å; C69-S71 PolarHBondContact O-N 3.36Å; S71-I73 PolarHBondContact O-N 3.42Å
72	P	92.1	Very high	92.3	Very high	71 Å²	71	58 Å²	58	46%	0.461	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-53.7	135.2	171.4	-23.5	33.3	0	0	0	111.3	T85	P72-T85 HydrophobicContact CB-CG2 3.77Å
73	I	95	Very high	92.1	Very high	4 Å²	4	62.2 Å²	62.2	2%	0.021	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-84.9	116.5	177.5	-54.3	177.4	0	0	0	107	Y60 A64 I65 S71 T85 L86 I91 Y103	Y60-I73 HydrophobicContact CD1-CG2 4.43Å; Y60-I73 HydrophobicContact CE1-CG2 3.62Å; A64-I73 HydrophobicContact CB-CD1 4.26Å; A64-I73 HydrophobicContact CB-CG1 4.15Å; A64-I73 HydrophobicContact CB-CG2 3.83Å; I65-I73 HydrophobicContact CD1-CD1 4.36Å; I65-I73 HydrophobicContact CG1-CD1 3.69Å; S71-I73 PolarHBondContact O-N 3.42Å; I73-T85 WeakPolarHBondContact O-CG2 3.46Å; I73-L86 HydrophobicContact CB-CB 4.37Å; I73-L86 HydrophobicContact CG2-CD1 4.1Å; I73-L86 HydrophobicContact CG2-CD2 4.26Å; I73-L86 WeakPolarHBondContact O-CD1 3.42Å; I73-L86 PolarHBondContact O-N 3.27Å; I73-I91 HydrophobicContact CD1-CD1 4.01Å; I73-I91 HydrophobicContact CD1-CG1 4.3Å; I73-Y103 HydrophobicContact CD1-CD2 4.27Å; I73-Y103 HydrophobicContact CD1-CE2 4.19Å; I73-Y103 HydrophobicContact CG1-CE2 4.18Å
74	T	95	Very high	92.1	Very high	73 Å²	73	58.2 Å²	58.2	45%	0.448	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-93.2	167	-178.2	58.5	0	0	0	0	111.7	Y60 G84 L86	Y60-T74 WeakPolarHBondContact CE1-O 3.45Å; Y60-T74 PolarHBondContact OH-O 3.49Å; T74-G84 CarbonylContact C-O 3.56Å; T74-L86 VanDerWaalsContact C-CD1 3.41Å; T74-L86 VanDerWaalsContact O-CD1 3.26Å; T74-L86 WeakPolarHBondContact O-CD1 3.3Å
75	C	96.8	Very high	92.1	Very high	12 Å²	12	59.4 Å²	59.4	8%	0.081	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-52.9	135.1	173.2	-176.2	0	0	0	0	110.8	L45 D77 C80 G84	L45-C75 HydrophobicContact CD1-CB 4.17Å; C75-D77 PolarHBondContact O-N 3.24Å; C75-D77 PolarHBondContact SG-N 3.12Å; C75-C80 HydrophobicContact CB-CB 4.12Å; C75-G84 WeakPolarHBondContact CB-O 3.17Å; C75-G84 PolarHBondContact N-O 3.3Å
76	P	95.9	Very high	92.1	Very high	21 Å²	21	59.5 Å²	59.5	14%	0.136	33%	0.332	C	S	.	.	S	Bend	trans	-66.2	-20	176	-17.4	27.3	0	0	0	114	L32 F52 L57 Y60 V78	L32-P76 HydrophobicContact CD1-CB 4.05Å; L32-P76 HydrophobicContact CD1-CG 4.23Å; L32-P76 HydrophobicContact CD2-CB 3.85Å; L32-P76 HydrophobicContact CG-CB 4.37Å; F52-P76 HydrophobicContact CE1-CB 4.22Å; F52-P76 HydrophobicContact CE1-CG 4.47Å; F52-P76 HydrophobicContact CE2-CG 4.1Å; F52-P76 HydrophobicContact CZ-CB 4.04Å; F52-P76 HydrophobicContact CZ-CG 4.04Å; L57-P76 HydrophobicContact CD1-CG 4.04Å; Y60-P76 HydrophobicContact CD1-CG 3.67Å; Y60-P76 HydrophobicContact CD2-CB 4.32Å; Y60-P76 HydrophobicContact CD2-CG 4.32Å; Y60-P76 HydrophobicContact CE1-CB 4.42Å; Y60-P76 HydrophobicContact CE1-CG 3.69Å; Y60-P76 HydrophobicContact CE2-CB 4.25Å; Y60-P76 HydrophobicContact CE2-CG 4.36Å; Y60-P76 HydrophobicContact CG-CB 4.45Å; Y60-P76 HydrophobicContact CG-CG 3.99Å; P76-V78 PolarHBondContact O-N 3.24Å
77	D	94.6	Very high	92.3	Very high	23 Å²	23	57.4 Å²	57.4	12%	0.123	32%	0.323	C	S	.	.			trans	-80	112	-179.4	-170.6	-11	0	0	0	110.5	K31 F52 C75 V79 C80	K31-D77 IonicContact NZ-OD2 2.76Å; K31-D77 PolarHBondContact NZ-OD2 3.46Å; F52-D77 HydrophobicContact CE1-CB 4.44Å; F52-D77 HydrophobicContact CZ-CB 3.88Å; C75-D77 PolarHBondContact O-N 3.24Å; C75-D77 PolarHBondContact SG-N 3.12Å; D77-V79 PolarHBondContact O-N 2.87Å; D77-V79 WeakPolarHBondContact OD1-CG2 3.35Å; D77-V79 PolarHBondContact OD1-N 3.37Å; D77-C80 HydrophobicContact CB-CB 4.17Å; D77-C80 WeakPolarHBondContact O-CB 3.42Å; D77-C80 PolarHBondContact O-N 3.46Å
78	V	87.9	Confident	92.6	Very high	141 Å²	141	55.5 Å²	55.5	86%	0.855	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.5	179.6	-60.4	0	0	0	0	113.5	P76	P76-V78 PolarHBondContact O-N 3.24Å
79	V	91	Very high	93	Very high	106 Å²	106	57.7 Å²	57.7	64%	0.642	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	19.2	174.3	-61.6	0	0	0	0	112.2	D77 L81	D77-V79 PolarHBondContact O-N 2.87Å; D77-V79 WeakPolarHBondContact OD1-CG2 3.35Å; D77-V79 PolarHBondContact OD1-N 3.37Å; V79-L81 PolarHBondContact O-N 3.33Å; V79-L81 VanDerWaalsContact O-N 3.09Å
80	C	94.2	Very high	93.5	Very high	8 Å²	8	56 Å²	56	5%	0.054	32%	0.318	C	S	.	.			trans	-62.3	110.3	174.6	-176.1	0	0	0	0	111	C48 C50 C75 D77 N82 H83	C48-C80 WeakPolarHBondContact CB-SG 3.49Å; C50-C80 VanDerWaalsContact SG-SG 3.62Å; C75-C80 HydrophobicContact CB-CB 4.12Å; D77-C80 HydrophobicContact CB-CB 4.17Å; D77-C80 WeakPolarHBondContact O-CB 3.42Å; D77-C80 PolarHBondContact O-N 3.46Å; C80-N82 VanDerWaalsContact C-N 3.25Å; C80-N82 PolarHBondContact O-N 2.85Å; C80-H83 PolarHBondContact O-N 3.16Å
81	L	91.4	Very high	93.8	Very high	159 Å²	159	55.7 Å²	55.7	83%	0.832	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-31	-179.1	-63.5	174.4	0	0	0	113.4	V79	V79-L81 PolarHBondContact O-N 3.33Å; V79-L81 VanDerWaalsContact O-N 3.09Å
82	N	93.2	Very high	94.2	Very high	107 Å²	107	56.9 Å²	56.9	57%	0.572	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-3.6	-176.7	-64.6	-32.5	0	0	0	112.8	C48 C80 G84	C48-N82 HydrophobicContact CB-CB 3.74Å; C48-N82 PolarHBondContact O-ND2 3.06Å; C80-N82 VanDerWaalsContact C-N 3.25Å; C80-N82 PolarHBondContact O-N 2.85Å; N82-G84 PolarHBondContact O-N 2.86Å
83	H	91.8	Very high	94.3	Very high	148 Å²	148	58.7 Å²	58.7	69%	0.685	34%	0.339	S	S	*	.			trans	45.3	40	-178.3	-59.9	-73.6	0	0	0	113.8	C80	C80-H83 PolarHBondContact O-N 3.16Å
84	G	93.9	Very high	94.3	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.01	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-60.3	144	-169.4	0	0	0	0	0	112.8	T74 C75 N82	T74-G84 CarbonylContact C-O 3.56Å; C75-G84 WeakPolarHBondContact CB-O 3.17Å; C75-G84 PolarHBondContact N-O 3.3Å; N82-G84 PolarHBondContact O-N 2.86Å
85	T	95.8	Very high	94.4	Very high	46 Å²	46	56.4 Å²	56.4	28%	0.282	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-104	143.6	170.9	-57.5	0	0	0	0	109	E47 P72 I73	E47-T85 PolarHBondContact OE2-N 2.88Å; P72-T85 HydrophobicContact CB-CG2 3.77Å; I73-T85 WeakPolarHBondContact O-CG2 3.46Å
86	L	95.4	Very high	94.4	Very high	5 Å²	5	58.4 Å²	58.4	3%	0.026	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-79.5	127.6	179.1	-74.3	76.8	0	0	0	109.3	L45 L57 M61 I73 T74 I91	L45-L86 HydrophobicContact CD1-CD1 4.23Å; L45-L86 HydrophobicContact CD2-CD2 4.05Å; L45-L86 HydrophobicContact CD2-CG 4.03Å; L57-L86 HydrophobicContact CD1-CD2 4.25Å; M61-L86 HydrophobicContact CE-CB 4.33Å; M61-L86 HydrophobicContact CE-CD2 3.38Å; M61-L86 HydrophobicContact CE-CG 4.47Å; M61-L86 HydrophobicContact CG-CD2 3.76Å; M61-L86 HydrophobicContact SD-CD2 3.6Å; I73-L86 HydrophobicContact CB-CB 4.37Å; I73-L86 HydrophobicContact CG2-CD1 4.1Å; I73-L86 HydrophobicContact CG2-CD2 4.26Å; I73-L86 WeakPolarHBondContact O-CD1 3.42Å; I73-L86 PolarHBondContact O-N 3.27Å; T74-L86 VanDerWaalsContact C-CD1 3.41Å; T74-L86 VanDerWaalsContact O-CD1 3.26Å; T74-L86 WeakPolarHBondContact O-CD1 3.3Å; L86-I91 HydrophobicContact CB-CG1 4.29Å
87	Q	94.9	Very high	94.4	Very high	76 Å²	76	62.6 Å²	62.6	36%	0.355	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-76.3	155.3	-178.2	-60.1	-173.1	13.7	0	0	111.6	Q46 E47 A89 E90 I91	Q46-Q87 VanDerWaalsContact OE1-OE1 3.11Å; E47-Q87 HydrophobicContact CG-CG 4.44Å; Q87-A89 PolarHBondContact O-N 3.34Å; Q87-E90 HydrophobicContact CB-CG 4.33Å; Q87-E90 PolarHBondContact N-OE2 2.84Å; Q87-E90 WeakPolarHBondContact O-CB 3.31Å; Q87-E90 PolarHBondContact O-N 3.19Å; Q87-I91 WeakPolarHBondContact O-CG1 3.44Å; Q87-I91 PolarHBondContact O-N 3.01Å
88	E	95.1	Very high	94.5	Very high	82 Å²	82	66.7 Å²	66.7	38%	0.383	38%	0.384	S	S	.	.	H	α-helix	trans	-57	-35.8	178.7	-70.7	-168.6	-172.3	0	0	113.1	I91 A92 F100 Y103 K107	E88-I91 PolarHBondContact O-N 3.35Å; E88-A92 VanDerWaalsContact O-CB 3.31Å; E88-A92 WeakPolarHBondContact O-CB 3.48Å; E88-A92 PolarHBondContact O-N 3Å; E88-F100 HydrophobicContact CB-CE2 4.4Å; E88-F100 HydrophobicContact CB-CZ 4.49Å; E88-Y103 HydrophobicContact CG-CE1 4.27Å; E88-K107 IonicContact OE1-NZ 3.99Å; E88-K107 PolarHBondContact OE1-NZ 2.93Å
89	A	95.3	Very high	94.9	Very high	57 Å²	57	60.9 Å²	60.9	47%	0.471	35%	0.348	S	S	.	.	H	α-helix	trans	-65	-40.3	176.3	0	0	0	0	0	112	Q87 C93	Q87-A89 PolarHBondContact O-N 3.34Å; A89-C93 PolarHBondContact O-N 3.09Å; A89-C93 PolarHBondContact O-SG 3.31Å
90	E	95.5	Very high	95.2	Very high	12 Å²	12	57.2 Å²	57.2	6%	0.056	32%	0.323	C	S	.	.	H	α-helix	trans	-65.5	-43.2	175.1	-63.6	176.2	106.4	0	0	110.6	L45 Q46 Q87 C93 L94	L45-E90 WeakPolarHBondContact CA-OE1 3.44Å; Q46-E90 HydrophobicContact CG-CG 4.07Å; Q46-E90 WeakPolarHBondContact CG-OE1 3.43Å; Q46-E90 PolarHBondContact N-OE1 3.18Å; Q87-E90 HydrophobicContact CB-CG 4.33Å; Q87-E90 PolarHBondContact N-OE2 2.84Å; Q87-E90 WeakPolarHBondContact O-CB 3.31Å; Q87-E90 PolarHBondContact O-N 3.19Å; E90-C93 PolarHBondContact O-N 2.87Å; E90-L94 WeakPolarHBondContact O-CB 3.34Å; E90-L94 WeakPolarHBondContact O-CG 3.17Å; E90-L94 PolarHBondContact O-N 2.94Å; E90-L94 VanDerWaalsContact O-N 3.13Å
91	I	96.6	Very high	95.4	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-60.4	-51	177	-56.9	163.4	0	0	0	110.5	M61 I65 I73 L86 Q87 E88 C93 L94 V95 F100 Y103	M61-I91 HydrophobicContact CE-CB 3.75Å; M61-I91 HydrophobicContact CE-CG1 3.32Å; M61-I91 HydrophobicContact CE-CG2 4.11Å; I65-I91 HydrophobicContact CD1-CG2 4.05Å; I73-I91 HydrophobicContact CD1-CD1 4.01Å; I73-I91 HydrophobicContact CD1-CG1 4.3Å; L86-I91 HydrophobicContact CB-CG1 4.29Å; Q87-I91 WeakPolarHBondContact O-CG1 3.44Å; Q87-I91 PolarHBondContact O-N 3.01Å; E88-I91 PolarHBondContact O-N 3.35Å; I91-C93 PolarHBondContact O-N 2.87Å; I91-L94 PolarHBondContact O-N 2.91Å; I91-L94 VanDerWaalsContact O-N 3.13Å; I91-V95 HydrophobicContact CG2-CG1 4.38Å; I91-V95 HydrophobicContact CG2-CG2 3.92Å; I91-V95 WeakPolarHBondContact O-CG2 3.41Å; I91-V95 PolarHBondContact O-N 2.97Å; I91-F100 HydrophobicContact CB-CD2 4.28Å; I91-F100 HydrophobicContact CB-CE2 4.38Å; I91-F100 HydrophobicContact CG2-CD2 3.81Å; I91-F100 HydrophobicContact CG2-CE2 4.35Å; I91-Y103 HydrophobicContact CD1-CD1 4.14Å; I91-Y103 HydrophobicContact CD1-CE1 3.6Å; I91-Y103 HydrophobicContact CD1-CE2 4.22Å; I91-Y103 HydrophobicContact CG2-CD1 4.38Å
92	A	96.6	Very high	95.6	Very high	43 Å²	43	56.4 Å²	56.4	36%	0.355	32%	0.316	S	S	.	.	H	α-helix	trans	-57.5	-34	-179.8	0	0	0	0	0	113.4	E88 F100	E88-A92 VanDerWaalsContact O-CB 3.31Å; E88-A92 WeakPolarHBondContact O-CB 3.48Å; E88-A92 PolarHBondContact O-N 3Å; A92-F100 HydrophobicContact CB-CD1 3.95Å; A92-F100 HydrophobicContact CB-CD2 4.16Å; A92-F100 HydrophobicContact CB-CE1 3.71Å; A92-F100 HydrophobicContact CB-CE2 3.95Å; A92-F100 HydrophobicContact CB-CG 4.17Å; A92-F100 HydrophobicContact CB-CZ 3.72Å
93	C	94.8	Very high	95.8	Very high	108 Å²	108	51.9 Å²	51.9	73%	0.73	29%	0.291	S	S	*	.	H	α-helix	trans	-79.3	-29.4	179.6	-73.1	0	0	0	0	113.5	A89 E90 I91	A89-C93 PolarHBondContact O-N 3.09Å; A89-C93 PolarHBondContact O-SG 3.31Å; E90-C93 PolarHBondContact O-N 2.87Å; I91-C93 PolarHBondContact O-N 2.87Å
94	L	94.8	Very high	96	Very high	20 Å²	20	48.2 Å²	48.2	11%	0.105	27%	0.273	C	S	.	.	H	α-helix	trans	-96.5	-32.3	-171.3	-70	169.3	0	0	0	112.8	T43 T54 L57 K58 M61 E90 I91	T43-L94 HydrophobicContact CG2-CD1 4.33Å; T54-L94 HydrophobicContact CG2-CD2 3.99Å; L57-L94 HydrophobicContact CD2-CD1 3.55Å; L57-L94 HydrophobicContact CG-CD1 4.01Å; K58-L94 WeakPolarHBondContact CD-O 3.47Å; K58-L94 WeakPolarHBondContact CE-O 3.42Å; K58-L94 HydrophobicContact CG-CB 4.23Å; K58-L94 HydrophobicContact CG-CD2 4.18Å; K58-L94 WeakPolarHBondContact CG-O 3.5Å; M61-L94 HydrophobicContact CE-CB 4.36Å; M61-L94 HydrophobicContact CE-CD1 4.15Å; M61-L94 HydrophobicContact SD-CB 3.7Å; M61-L94 HydrophobicContact SD-CD1 3.42Å; M61-L94 WeakPolarHBondContact SD-CD1 3.32Å; M61-L94 HydrophobicContact SD-CG 4.21Å; E90-L94 WeakPolarHBondContact O-CB 3.34Å; E90-L94 WeakPolarHBondContact O-CG 3.17Å; E90-L94 PolarHBondContact O-N 2.94Å; E90-L94 VanDerWaalsContact O-N 3.13Å; I91-L94 PolarHBondContact O-N 2.91Å; I91-L94 VanDerWaalsContact O-N 3.13Å
95	V	96.6	Very high	96	Very high	10 Å²	10	55.4 Å²	55.4	6%	0.061	30%	0.3	C	S	.	.	S	Bend	trans	-102.4	154.2	-177.4	-48.5	0	0	0	0	112.4	M61 Q62 I65 I91 Q99 F100	M61-V95 HydrophobicContact CB-CG1 3.62Å; Q62-V95 HydrophobicContact CG-CG1 4.35Å; I65-V95 HydrophobicContact CD1-CB 4.41Å; I65-V95 HydrophobicContact CD1-CG1 4.02Å; I65-V95 HydrophobicContact CD1-CG2 4.03Å; I91-V95 HydrophobicContact CG2-CG1 4.38Å; I91-V95 HydrophobicContact CG2-CG2 3.92Å; I91-V95 WeakPolarHBondContact O-CG2 3.41Å; I91-V95 PolarHBondContact O-N 2.97Å; V95-Q99 HydrophobicContact CB-CB 4.13Å; V95-Q99 HydrophobicContact CG2-CB 3.97Å; V95-F100 HydrophobicContact CG2-CB 3.8Å
96	P	96.8	Very high	95.9	Very high	54 Å²	54	54.9 Å²	54.9	35%	0.351	30%	0.295	S	S	.	.			trans	-54.4	152.2	170	-28.5	38.2	0	0	0	113.1	Q62 D98 Q99 F100	Q62-P96 VanDerWaalsContact NE2-CD 3.29Å; P96-D98 VanDerWaalsContact C-N 3.29Å; P96-D98 WeakPolarHBondContact CB-OD1 3.28Å; P96-D98 PolarHBondContact O-N 3.39Å; P96-Q99 HydrophobicContact CB-CG 4.46Å; P96-Q99 WeakPolarHBondContact O-CB 3.31Å; P96-Q99 PolarHBondContact O-N 3.48Å; P96-Q99 VanDerWaalsContact O-N 3.09Å; P96-F100 PolarHBondContact O-N 3.26Å
97	V	96.7	Very high	95.8	Very high	109 Å²	109	57.2 Å²	57.2	66%	0.661	31%	0.305	S	S	*	.	H	α-helix	trans	-57.8	-41.9	-174.5	179.3	0	0	0	0	111.9	F100 Q101	V97-F100 PolarHBondContact O-N 2.9Å; V97-Q101 HydrophobicContact CG1-CG 4.42Å; V97-Q101 VanDerWaalsContact O-CG 3.3Å; V97-Q101 WeakPolarHBondContact O-CG 3.47Å; V97-Q101 PolarHBondContact O-N 3.33Å
98	D	96.9	Very high	95.7	Very high	109 Å²	109	58 Å²	58	58%	0.583	31%	0.307	S	S	*	.	H	α-helix	trans	-59.2	-45.2	176.2	57.1	-53.6	0	0	0	112.3	P96 F100 Q101 L102	P96-D98 VanDerWaalsContact C-N 3.29Å; P96-D98 WeakPolarHBondContact CB-OD1 3.28Å; P96-D98 PolarHBondContact O-N 3.39Å; D98-F100 PolarHBondContact O-N 3.43Å; D98-Q101 PolarHBondContact O-N 3.35Å; D98-L102 WeakPolarHBondContact O-CB 3.33Å; D98-L102 PolarHBondContact O-N 3.14Å
99	Q	96.6	Very high	95.5	Very high	19 Å²	19	57.3 Å²	57.3	9%	0.089	30%	0.304	C	S	.	.	H	α-helix	trans	-65.3	-37.9	176.2	-70.6	-81.2	88.3	0	0	111.7	Q62 I65 V95 P96 L102 Y103	Q62-Q99 PolarHBondContact O-NE2 3.45Å; I65-Q99 HydrophobicContact CD1-CB 4.48Å; V95-Q99 HydrophobicContact CB-CB 4.13Å; V95-Q99 HydrophobicContact CG2-CB 3.97Å; P96-Q99 HydrophobicContact CB-CG 4.46Å; P96-Q99 WeakPolarHBondContact O-CB 3.31Å; P96-Q99 PolarHBondContact O-N 3.48Å; P96-Q99 VanDerWaalsContact O-N 3.09Å; Q99-L102 WeakPolarHBondContact O-CB 3.48Å; Q99-L102 PolarHBondContact O-N 3.47Å; Q99-Y103 PolarHBondContact O-N 3.03Å
100	F	97.4	Very high	95.1	Very high	29 Å²	29	56.1 Å²	56.1	13%	0.127	29%	0.287	C	S	.	.	H	α-helix	trans	-68.3	-37.6	175.8	-178.5	-124.5	0	0	0	112.4	E88 I91 A92 V95 P96 V97 D98 Y103 K104	E88-F100 HydrophobicContact CB-CE2 4.4Å; E88-F100 HydrophobicContact CB-CZ 4.49Å; I91-F100 HydrophobicContact CB-CD2 4.28Å; I91-F100 HydrophobicContact CB-CE2 4.38Å; I91-F100 HydrophobicContact CG2-CD2 3.81Å; I91-F100 HydrophobicContact CG2-CE2 4.35Å; A92-F100 HydrophobicContact CB-CD1 3.95Å; A92-F100 HydrophobicContact CB-CD2 4.16Å; A92-F100 HydrophobicContact CB-CE1 3.71Å; A92-F100 HydrophobicContact CB-CE2 3.95Å; A92-F100 HydrophobicContact CB-CG 4.17Å; A92-F100 HydrophobicContact CB-CZ 3.72Å; V95-F100 HydrophobicContact CG2-CB 3.8Å; P96-F100 PolarHBondContact O-N 3.26Å; V97-F100 PolarHBondContact O-N 2.9Å; D98-F100 PolarHBondContact O-N 3.43Å; F100-Y103 HydrophobicContact CD2-CD1 4.32Å; F100-Y103 HydrophobicContact CE2-CD1 4.3Å; F100-Y103 PolarHBondContact O-N 3.42Å; F100-K104 HydrophobicContact CD1-CD 4.47Å; F100-K104 HydrophobicContact CE1-CD 3.87Å; F100-K104 VanDerWaalsContact CE1-NZ 3.35Å; F100-K104 HydrophobicContact CE2-CD 4.3Å; F100-K104 HydrophobicContact CE2-CG 4.23Å; F100-K104 HydrophobicContact CZ-CD 3.77Å; F100-K104 HydrophobicContact CZ-CG 4.19Å; F100-K104 PolarHBondContact O-N 3.35Å
101	Q	97.3	Very high	94.9	Very high	94 Å²	94	59.9 Å²	59.9	44%	0.439	31%	0.305	S	S	.	.	H	α-helix	trans	-67.4	-38.9	173.7	-64.6	-60.4	-16.6	0	0	111.7	V97 D98 K104 R105	V97-Q101 HydrophobicContact CG1-CG 4.42Å; V97-Q101 VanDerWaalsContact O-CG 3.3Å; V97-Q101 WeakPolarHBondContact O-CG 3.47Å; V97-Q101 PolarHBondContact O-N 3.33Å; D98-Q101 PolarHBondContact O-N 3.35Å; Q101-K104 PolarHBondContact O-N 2.95Å; Q101-K104 VanDerWaalsContact OE1-CE 3.27Å; Q101-R105 PolarHBondContact O-N 2.9Å
102	L	96.2	Very high	94.5	Very high	55 Å²	55	60 Å²	60	29%	0.288	31%	0.305	S	S	.	.	H	α-helix	trans	-59.3	-47.8	172.1	177.9	62.3	0	0	0	111	I65 D98 Q99 K104 R105 L106	I65-L102 HydrophobicContact CG2-CB 4.47Å; I65-L102 HydrophobicContact CG2-CD2 4.12Å; I65-L102 HydrophobicContact CG2-CG 4.17Å; D98-L102 WeakPolarHBondContact O-CB 3.33Å; D98-L102 PolarHBondContact O-N 3.14Å; Q99-L102 WeakPolarHBondContact O-CB 3.48Å; Q99-L102 PolarHBondContact O-N 3.47Å; L102-K104 PolarHBondContact O-N 3.36Å; L102-R105 PolarHBondContact O-N 2.84Å; L102-L106 HydrophobicContact CD1-CD1 3.91Å; L102-L106 HydrophobicContact CD1-CD2 4.49Å; L102-L106 HydrophobicContact CD1-CG 3.96Å; L102-L106 HydrophobicContact CD2-CD1 4.49Å; L102-L106 HydrophobicContact CG-CD1 3.84Å; L102-L106 HydrophobicContact CG-CG 4.3Å; L102-L106 WeakPolarHBondContact O-CB 3.37Å; L102-L106 WeakPolarHBondContact O-CG 3.5Å; L102-L106 PolarHBondContact O-N 3Å
103	Y	96.6	Very high	93.9	Very high	13 Å²	13	61.9 Å²	61.9	5%	0.051	31%	0.307	C	S	.	.	H	α-helix	trans	-55.4	-49	176.1	172.4	-105.7	0	0	0	112.2	I65 I73 E88 I91 Q99 F100 R105 L106 K107	I65-Y103 HydrophobicContact CG1-CD2 4.04Å; I65-Y103 HydrophobicContact CG1-CG 4.29Å; I73-Y103 HydrophobicContact CD1-CD2 4.27Å; I73-Y103 HydrophobicContact CD1-CE2 4.19Å; I73-Y103 HydrophobicContact CG1-CE2 4.18Å; E88-Y103 HydrophobicContact CG-CE1 4.27Å; I91-Y103 HydrophobicContact CD1-CD1 4.14Å; I91-Y103 HydrophobicContact CD1-CE1 3.6Å; I91-Y103 HydrophobicContact CD1-CE2 4.22Å; I91-Y103 HydrophobicContact CG2-CD1 4.38Å; Q99-Y103 PolarHBondContact O-N 3.03Å; F100-Y103 HydrophobicContact CD2-CD1 4.32Å; F100-Y103 HydrophobicContact CE2-CD1 4.3Å; F100-Y103 PolarHBondContact O-N 3.42Å; Y103-R105 VanDerWaalsContact C-N 3.34Å; Y103-R105 PolarHBondContact O-N 3.5Å; Y103-L106 PolarHBondContact O-N 2.91Å; Y103-K107 HydrophobicContact CE1-CD 4.17Å; Y103-K107 VanDerWaalsContact O-CB 3.23Å; Y103-K107 WeakPolarHBondContact O-CB 3.3Å; Y103-K107 PolarHBondContact O-N 2.88Å
104	K	96.3	Very high	93.4	Very high	70 Å²	70	60.4 Å²	60.4	30%	0.304	29%	0.291	S	S	.	.	H	α-helix	trans	-60.9	-42.1	178.8	-76.7	-174.8	-73.3	179.4	0	112.5	F100 Q101 L102 F108	F100-K104 HydrophobicContact CD1-CD 4.47Å; F100-K104 HydrophobicContact CE1-CD 3.87Å; F100-K104 VanDerWaalsContact CE1-NZ 3.35Å; F100-K104 HydrophobicContact CE2-CD 4.3Å; F100-K104 HydrophobicContact CE2-CG 4.23Å; F100-K104 HydrophobicContact CZ-CD 3.77Å; F100-K104 HydrophobicContact CZ-CG 4.19Å; F100-K104 PolarHBondContact O-N 3.35Å; Q101-K104 PolarHBondContact O-N 2.95Å; Q101-K104 VanDerWaalsContact OE1-CE 3.27Å; L102-K104 PolarHBondContact O-N 3.36Å; K104-F108 WeakPolarHBondContact O-CB 3.4Å; K104-F108 PolarHBondContact O-N 3.49Å
105	R	94.5	Very high	93	Very high	153 Å²	153	61.5 Å²	61.5	58%	0.577	30%	0.297	S	S	*	.	H	α-helix	trans	-61.2	-53	175.5	-174.3	-171.5	-55.8	173.6	2.6	111.3	Q101 L102 Y103 K107 F108 E109	Q101-R105 PolarHBondContact O-N 2.9Å; L102-R105 PolarHBondContact O-N 2.84Å; Y103-R105 VanDerWaalsContact C-N 3.34Å; Y103-R105 PolarHBondContact O-N 3.5Å; R105-K107 VanDerWaalsContact C-N 3.31Å; R105-K107 PolarHBondContact O-N 3.12Å; R105-F108 PolarHBondContact O-N 3.23Å; R105-E109 WeakPolarHBondContact CG-OE1 3.34Å; R105-E109 WeakPolarHBondContact O-CG 3.5Å; R105-E109 PolarHBondContact O-N 3.36Å
106	L	92.9	Very high	92.4	Very high	35 Å²	35	65.8 Å²	65.8	18%	0.183	33%	0.325	C	S	.	.	H	α-helix	trans	-62.3	-39	-179.3	-68	173.9	0	0	0	112	L102 Y103 E109 R110	L102-L106 HydrophobicContact CD1-CD1 3.91Å; L102-L106 HydrophobicContact CD1-CD2 4.49Å; L102-L106 HydrophobicContact CD1-CG 3.96Å; L102-L106 HydrophobicContact CD2-CD1 4.49Å; L102-L106 HydrophobicContact CG-CD1 3.84Å; L102-L106 HydrophobicContact CG-CG 4.3Å; L102-L106 WeakPolarHBondContact O-CB 3.37Å; L102-L106 WeakPolarHBondContact O-CG 3.5Å; L102-L106 PolarHBondContact O-N 3Å; Y103-L106 PolarHBondContact O-N 2.91Å; L106-E109 PolarHBondContact O-N 2.86Å; L106-R110 WeakPolarHBondContact O-CB 3.26Å; L106-R110 PolarHBondContact O-N 2.81Å
107	K	93.6	Very high	92	Very high	54 Å²	54	67.5 Å²	67.5	24%	0.235	33%	0.329	C	S	.	.	H	α-helix	trans	-60.9	-48.6	174.9	178.7	-179.2	170.5	-179.6	0	110.9	E88 Y103 R105 R110 E111	E88-K107 IonicContact OE1-NZ 3.99Å; E88-K107 PolarHBondContact OE1-NZ 2.93Å; Y103-K107 HydrophobicContact CE1-CD 4.17Å; Y103-K107 VanDerWaalsContact O-CB 3.23Å; Y103-K107 WeakPolarHBondContact O-CB 3.3Å; Y103-K107 PolarHBondContact O-N 2.88Å; R105-K107 VanDerWaalsContact C-N 3.31Å; R105-K107 PolarHBondContact O-N 3.12Å; K107-R110 WeakPolarHBondContact O-CB 3.34Å; K107-R110 PolarHBondContact O-N 3.4Å; K107-E111 WeakPolarHBondContact CE-OE1 3.13Å; K107-E111 WeakPolarHBondContact O-CG 3.26Å; K107-E111 PolarHBondContact O-N 3.46Å
108	F	93.5	Very high	91.7	Very high	91 Å²	91	67.4 Å²	67.4	40%	0.399	32%	0.316	S	S	.	.	H	α-helix	trans	-62.3	-44.5	176.4	178.9	-107.7	0	0	0	112	K104 R105 R110 E111 V112 W120 V129	K104-F108 WeakPolarHBondContact O-CB 3.4Å; K104-F108 PolarHBondContact O-N 3.49Å; R105-F108 PolarHBondContact O-N 3.23Å; F108-R110 VanDerWaalsContact C-N 3.3Å; F108-R110 PolarHBondContact O-N 3Å; F108-E111 PolarHBondContact O-N 3.43Å; F108-V112 HydrophobicContact CD1-CG2 4.41Å; F108-V112 HydrophobicContact CE1-CG2 4.02Å; F108-V112 HydrophobicContact CE2-CG2 4.15Å; F108-V112 HydrophobicContact CZ-CG2 3.89Å; F108-V112 WeakPolarHBondContact O-CG2 3.33Å; F108-V112 PolarHBondContact O-N 3.41Å; F108-W120 AromaticContact CD1-CH2 3.92Å; F108-W120 HydrophobicContact CD1-CH2 3.92Å; F108-W120 HydrophobicContact CD1-CZ2 4.21Å; F108-W120 AromaticContact CE1-CH2 3.59Å; F108-W120 HydrophobicContact CE1-CH2 3.59Å; F108-W120 HydrophobicContact CE1-CZ2 4.09Å; F108-V129 HydrophobicContact CE1-CG2 3.88Å; F108-V129 HydrophobicContact CZ-CG2 3.83Å
109	E	89.9	Confident	91.4	Very high	68 Å²	68	62.9 Å²	62.9	32%	0.318	29%	0.293	S	S	.	.	H	α-helix	trans	-55.8	-47	174.6	-75	172.8	-164.7	0	0	111.7	R105 L106 V112 H113 W120	R105-E109 WeakPolarHBondContact CG-OE1 3.34Å; R105-E109 WeakPolarHBondContact O-CG 3.5Å; R105-E109 PolarHBondContact O-N 3.36Å; L106-E109 PolarHBondContact O-N 2.86Å; E109-V112 PolarHBondContact O-N 2.92Å; E109-H113 PolarHBondContact O-N 3.38Å; E109-H113 PolarHBondContact O-ND1 3.04Å; E109-W120 HydrophobicContact CB-CZ2 4.39Å; E109-W120 HydrophobicContact CG-CH2 4.37Å; E109-W120 HydrophobicContact CG-CZ2 3.89Å
110	R	88.1	Confident	91.1	Very high	32 Å²	32	64.9 Å²	64.9	12%	0.121	30%	0.299	C	S	.	.	H	α-helix	trans	-59.6	-47.3	175.4	177.3	-170.2	-177.4	84.9	5.3	112.1	G70 L106 K107 F108 V112 H113 L114 N213	G70-R110 WeakPolarHBondContact O-CD 3.44Å; L106-R110 WeakPolarHBondContact O-CB 3.26Å; L106-R110 PolarHBondContact O-N 2.81Å; K107-R110 WeakPolarHBondContact O-CB 3.34Å; K107-R110 PolarHBondContact O-N 3.4Å; F108-R110 VanDerWaalsContact C-N 3.3Å; F108-R110 PolarHBondContact O-N 3Å; R110-V112 VanDerWaalsContact C-N 3.29Å; R110-V112 PolarHBondContact O-N 3.33Å; R110-H113 PolarHBondContact O-N 2.89Å; R110-H113 VanDerWaalsContact O-N 3.14Å; R110-L114 HydrophobicContact CG-CD1 3.78Å; R110-L114 HydrophobicContact CG-CG 4.26Å; R110-L114 WeakPolarHBondContact O-CG 3.18Å; R110-L114 PolarHBondContact O-N 3.33Å; R110-N213 PolarHBondContact NH1-O 2.89Å; R110-N213 PolarHBondContact NH1-OD1 2.84Å; R110-N213 PolarHBondContact NH2-O 2.88Å
111	E	89.8	Confident	90.9	Very high	92 Å²	92	63.9 Å²	63.9	43%	0.43	30%	0.296	S	S	.	.	H	α-helix	trans	-57.7	-43.1	179.3	-74.2	169.1	-175.3	0	0	111.5	K107 F108 H113 L114 D115	K107-E111 WeakPolarHBondContact CE-OE1 3.13Å; K107-E111 WeakPolarHBondContact O-CG 3.26Å; K107-E111 PolarHBondContact O-N 3.46Å; F108-E111 PolarHBondContact O-N 3.43Å; E111-H113 PolarHBondContact O-N 2.7Å; E111-L114 PolarHBondContact O-N 3.14Å; E111-D115 WeakPolarHBondContact O-CB 3.44Å; E111-D115 PolarHBondContact O-N 2.84Å; E111-D115 VanDerWaalsContact O-N 3.1Å
112	V	89.8	Confident	90.7	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-63.9	-40.1	175.5	175.8	0	0	0	0	111.9	F108 E109 R110 L114 R118 W120 V129	F108-V112 HydrophobicContact CD1-CG2 4.41Å; F108-V112 HydrophobicContact CE1-CG2 4.02Å; F108-V112 HydrophobicContact CE2-CG2 4.15Å; F108-V112 HydrophobicContact CZ-CG2 3.89Å; F108-V112 WeakPolarHBondContact O-CG2 3.33Å; F108-V112 PolarHBondContact O-N 3.41Å; E109-V112 PolarHBondContact O-N 2.92Å; R110-V112 VanDerWaalsContact C-N 3.29Å; R110-V112 PolarHBondContact O-N 3.33Å; V112-L114 VanDerWaalsContact C-N 3.33Å; V112-R118 HydrophobicContact CG1-CB 4.08Å; V112-W120 HydrophobicContact CB-CZ2 4Å; V112-W120 HydrophobicContact CG1-CD2 4.3Å; V112-W120 HydrophobicContact CG1-CG 4.35Å; V112-W120 HydrophobicContact CG1-CZ2 4.14Å; V112-W120 VanDerWaalsContact CG1-NE1 3.34Å; V112-W120 HydrophobicContact CG2-CZ2 3.93Å; V112-V129 HydrophobicContact CG1-CG1 3.87Å; V112-V129 HydrophobicContact CG1-CG2 4.19Å; V112-V129 HydrophobicContact CG2-CG1 4.05Å; V112-V129 HydrophobicContact CG2-CG2 3.77Å
113	H	84	Confident	90.6	Very high	83 Å²	83	60.7 Å²	60.7	38%	0.384	29%	0.29	S	S	.	.	H	α-helix	trans	-71.9	-25.2	179	-76.6	89.6	0	0	0	114	E109 R110 E111 W120	E109-H113 PolarHBondContact O-N 3.38Å; E109-H113 PolarHBondContact O-ND1 3.04Å; R110-H113 PolarHBondContact O-N 2.89Å; R110-H113 VanDerWaalsContact O-N 3.14Å; E111-H113 PolarHBondContact O-N 2.7Å; H113-W120 AromaticContact CE1-CD1 3.64Å; H113-W120 AromaticContact CE1-NE1 3.38Å; H113-W120 PolarHBondContact CE1-NE1 3.01Å; H113-W120 AromaticContact ND1-NE1 3.61Å; H113-W120 AromaticContact NE2-CD1 3.99Å
114	L	83.9	Confident	90.2	Very high	78 Å²	78	66.2 Å²	66.2	41%	0.408	32%	0.324	S	S	.	.	H	α-helix	trans	-88.9	-20.5	179.5	-67.8	177.8	0	0	0	112.7	R110 E111 V112 P116 C214	R110-L114 HydrophobicContact CG-CD1 3.78Å; R110-L114 HydrophobicContact CG-CG 4.26Å; R110-L114 WeakPolarHBondContact O-CG 3.18Å; R110-L114 PolarHBondContact O-N 3.33Å; E111-L114 PolarHBondContact O-N 3.14Å; V112-L114 VanDerWaalsContact C-N 3.33Å; L114-P116 WeakPolarHBondContact O-CD 3.47Å; L114-C214 HydrophobicContact CD2-CB 3.64Å
115	D	86.3	Confident	89.9	Confident	43 Å²	43	70.2 Å²	70.2	23%	0.23	35%	0.349	C	S	.	.			trans	-84.1	112.6	177.9	-173.8	-15.4	0	0	0	110.5	E111 Q117 R118	E111-D115 WeakPolarHBondContact O-CB 3.44Å; E111-D115 PolarHBondContact O-N 2.84Å; E111-D115 VanDerWaalsContact O-N 3.1Å; D115-Q117 PolarHBondContact O-N 3.29Å; D115-Q117 VanDerWaalsContact O-N 3.12Å; D115-Q117 WeakPolarHBondContact OD1-CB 3.19Å; D115-Q117 PolarHBondContact OD1-N 3.38Å; D115-R118 HydrophobicContact CB-CB 4.13Å; D115-R118 HydrophobicContact CB-CG 4.08Å; D115-R118 PolarHBondContact O-N 2.97Å; D115-R118 VanDerWaalsContact O-N 3.09Å; D115-R118 WeakPolarHBondContact OD2-CD 3.07Å; D115-R118 WeakPolarHBondContact OD2-CG 3.31Å; D115-R118 IonicContact OD2-CZ 2.64Å; D115-R118 IonicContact OD2-NE 2.7Å; D115-R118 PolarHBondContact OD2-NE 2.91Å
116	P	83.4	Confident	89.9	Confident	100 Å²	100	64.4 Å²	64.4	65%	0.649	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-15.8	-179.6	28.7	-35.6	0	0	0	113.4	L114	L114-P116 WeakPolarHBondContact O-CD 3.47Å
117	Q	88.8	Confident	89.7	Confident	89 Å²	89	70 Å²	70	42%	0.416	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	4.6	178.5	-56.2	-172	-73.5	0	0	112.9	D115 C131 I132 L134	D115-Q117 PolarHBondContact O-N 3.29Å; D115-Q117 VanDerWaalsContact O-N 3.12Å; D115-Q117 WeakPolarHBondContact OD1-CB 3.19Å; D115-Q117 PolarHBondContact OD1-N 3.38Å; Q117-C131 CarbonylContact O-C 3.51Å; Q117-C131 WeakPolarHBondContact O-CA 3.29Å; Q117-I132 PolarHBondContact O-N 3.44Å; Q117-L134 HydrophobicContact CG-CD1 4.2Å; Q117-L134 HydrophobicContact CG-CD2 3.68Å; Q117-L134 HydrophobicContact CG-CG 3.83Å
118	R	90.3	Very high	89.7	Confident	108 Å²	108	68.5 Å²	68.5	41%	0.408	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	149.1	-179.2	-63.2	-178.8	-170.7	-154.1	-6.6	111.5	V112 D115 V129 C130	V112-R118 HydrophobicContact CG1-CB 4.08Å; D115-R118 HydrophobicContact CB-CB 4.13Å; D115-R118 HydrophobicContact CB-CG 4.08Å; D115-R118 PolarHBondContact O-N 2.97Å; D115-R118 VanDerWaalsContact O-N 3.09Å; D115-R118 WeakPolarHBondContact OD2-CD 3.07Å; D115-R118 WeakPolarHBondContact OD2-CG 3.31Å; D115-R118 IonicContact OD2-CZ 2.64Å; D115-R118 IonicContact OD2-NE 2.7Å; D115-R118 PolarHBondContact OD2-NE 2.91Å; R118-V129 HydrophobicContact CB-CG1 3.99Å; R118-V129 HydrophobicContact CG-CG1 4.33Å; R118-C130 WeakPolarHBondContact CA-O 3.44Å
119	T	89.9	Confident	89.7	Confident	13 Å²	13	66.7 Å²	66.7	8%	0.08	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	155.6	172	-160.6	0	0	0	0	113.4	V129 C130 I132 A143 F152 K157	T119-V129 CarbonylContact O-C 3.56Å; T119-V129 WeakPolarHBondContact O-CA 3.32Å; T119-C130 HydrophobicContact CG2-CB 4.2Å; T119-C130 PolarHBondContact N-O 3.33Å; T119-C130 PolarHBondContact O-N 3.29Å; T119-I132 HydrophobicContact CG2-CD1 3.63Å; T119-I132 HydrophobicContact CG2-CG1 3.82Å; T119-A143 HydrophobicContact CG2-CB 4.45Å; T119-F152 HydrophobicContact CG2-CE2 3.7Å; T119-F152 HydrophobicContact CG2-CZ 3.76Å; T119-K157 PolarHBondContact OG1-NZ 2.83Å
120	W	91.6	Very high	89.9	Confident	61 Å²	61	63.7 Å²	63.7	23%	0.231	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	139.5	174	-65.4	99.8	0	0	0	111.3	F108 E109 V112 H113 Q127 V129	F108-W120 AromaticContact CD1-CH2 3.92Å; F108-W120 HydrophobicContact CD1-CH2 3.92Å; F108-W120 HydrophobicContact CD1-CZ2 4.21Å; F108-W120 AromaticContact CE1-CH2 3.59Å; F108-W120 HydrophobicContact CE1-CH2 3.59Å; F108-W120 HydrophobicContact CE1-CZ2 4.09Å; E109-W120 HydrophobicContact CB-CZ2 4.39Å; E109-W120 HydrophobicContact CG-CH2 4.37Å; E109-W120 HydrophobicContact CG-CZ2 3.89Å; V112-W120 HydrophobicContact CB-CZ2 4Å; V112-W120 HydrophobicContact CG1-CD2 4.3Å; V112-W120 HydrophobicContact CG1-CG 4.35Å; V112-W120 HydrophobicContact CG1-CZ2 4.14Å; V112-W120 VanDerWaalsContact CG1-NE1 3.34Å; V112-W120 HydrophobicContact CG2-CZ2 3.93Å; H113-W120 AromaticContact CE1-CD1 3.64Å; H113-W120 AromaticContact CE1-NE1 3.38Å; H113-W120 PolarHBondContact CE1-NE1 3.01Å; H113-W120 AromaticContact ND1-NE1 3.61Å; H113-W120 AromaticContact NE2-CD1 3.99Å; W120-Q127 WeakPolarHBondContact CZ3-O 3.12Å; W120-V129 HydrophobicContact CD2-CG2 4.31Å; W120-V129 HydrophobicContact CE3-CG2 3.94Å; W120-V129 HydrophobicContact CH2-CG2 3.79Å; W120-V129 HydrophobicContact CZ2-CG2 4.09Å; W120-V129 HydrophobicContact CZ3-CG2 3.69Å
121	C	93.4	Very high	90.1	Very high	9 Å²	9	67.2 Å²	67.2	6%	0.061	37%	0.366	C	S	.	.			trans	-62.4	129.6	167.1	-177.2	0	0	0	0	109.4	A123 C126 A128 C145	C121-A123 PolarHBondContact O-N 3.37Å; C121-C126 HydrophobicContact CB-CB 4.13Å; C121-A128 HydrophobicContact CB-CB 4.41Å; C121-A128 WeakPolarHBondContact CB-O 3.34Å; C121-A128 PolarHBondContact N-O 2.91Å; C121-C145 HydrophobicContact CB-CB 4.33Å
122	P	92.2	Very high	90	Very high	50 Å²	50	64 Å²	64	33%	0.325	35%	0.351	S	S	.	.			trans	-74.9	-9.9	-179.1	27.3	-32.8	0	0	0	114.4	V124 L150 F152 K157	P122-V124 PolarHBondContact O-N 3.42Å; P122-L150 HydrophobicContact CG-CD2 3.89Å; P122-F152 HydrophobicContact CG-CB 4.07Å; P122-F152 HydrophobicContact CG-CD1 4.15Å; P122-F152 HydrophobicContact CG-CD2 3.93Å; P122-F152 HydrophobicContact CG-CE2 4.39Å; P122-F152 HydrophobicContact CG-CG 3.79Å; P122-K157 HydrophobicContact CB-CB 4Å; P122-K157 HydrophobicContact CG-CB 4.37Å; P122-K157 WeakPolarHBondContact CG-O 3.49Å
123	A	93.2	Very high	89.7	Confident	32 Å²	32	71.4 Å²	71.4	26%	0.264	39%	0.386	S	S	.	.	S	Bend	trans	-66.2	123.1	175.7	0	0	0	0	0	110.2	C121 D125 C126 L150	C121-A123 PolarHBondContact O-N 3.37Å; A123-D125 PolarHBondContact O-N 3.03Å; A123-C126 HydrophobicContact CB-CB 3.77Å; A123-C126 PolarHBondContact O-N 3.49Å; A123-L150 HydrophobicContact CB-CD2 4.18Å
124	V	88	Confident	89.1	Confident	129 Å²	129	73 Å²	73	78%	0.782	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	-35.2	-169.2	178.1	0	0	0	0	113.7	P122	P122-V124 PolarHBondContact O-N 3.42Å
125	D	91.2	Very high	88.4	Confident	153 Å²	153	71.4 Å²	71.4	82%	0.818	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	3.5	-176.5	-61.1	-45.2	0	0	0	114.4	A123	A123-D125 PolarHBondContact O-N 3.03Å
126	C	93.5	Very high	87.2	Confident	32 Å²	32	77.9 Å²	77.9	22%	0.216	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-49	-175.9	-175.9	0	0	0	0	112.1	C121 A123 A128 C145 C148	C121-C126 HydrophobicContact CB-CB 4.13Å; A123-C126 HydrophobicContact CB-CB 3.77Å; A123-C126 PolarHBondContact O-N 3.49Å; C126-A128 PolarHBondContact O-N 2.65Å; C126-A128 VanDerWaalsContact SG-CB 3.54Å; C126-C145 PolarHBondContact SG-SG 3.34Å; C126-C148 VanDerWaalsContact SG-SG 3.69Å
127	Q	89.3	Confident	86.3	Confident	152 Å²	152	77 Å²	77	71%	0.71	42%	0.422	S	S	*	.			trans	51.3	19.8	-177.6	-55.5	-175.9	-0.7	0	0	114.6	W120	W120-Q127 WeakPolarHBondContact CZ3-O 3.12Å
128	A	93.4	Very high	85.1	Confident	22 Å²	22	76 Å²	76	18%	0.182	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-79.9	141.8	177.4	0	0	0	0	0	110.9	C121 C126 A147	C121-A128 HydrophobicContact CB-CB 4.41Å; C121-A128 WeakPolarHBondContact CB-O 3.34Å; C121-A128 PolarHBondContact N-O 2.91Å; C126-A128 PolarHBondContact O-N 2.65Å; C126-A128 VanDerWaalsContact SG-CB 3.54Å; A128-A147 HydrophobicContact CB-CB 3.87Å
129	V	94.8	Very high	84.3	Confident	53 Å²	53	76.5 Å²	76.5	32%	0.321	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	123.9	169.4	-177.8	0	0	0	0	108.7	F108 V112 R118 T119 W120	F108-V129 HydrophobicContact CE1-CG2 3.88Å; F108-V129 HydrophobicContact CZ-CG2 3.83Å; V112-V129 HydrophobicContact CG1-CG1 3.87Å; V112-V129 HydrophobicContact CG1-CG2 4.19Å; V112-V129 HydrophobicContact CG2-CG1 4.05Å; V112-V129 HydrophobicContact CG2-CG2 3.77Å; R118-V129 HydrophobicContact CB-CG1 3.99Å; R118-V129 HydrophobicContact CG-CG1 4.33Å; T119-V129 CarbonylContact O-C 3.56Å; T119-V129 WeakPolarHBondContact O-CA 3.32Å; W120-V129 HydrophobicContact CD2-CG2 4.31Å; W120-V129 HydrophobicContact CE3-CG2 3.94Å; W120-V129 HydrophobicContact CH2-CG2 3.79Å; W120-V129 HydrophobicContact CZ2-CG2 4.09Å; W120-V129 HydrophobicContact CZ3-CG2 3.69Å
130	C	93.5	Very high	83.7	Confident	5 Å²	5	77.6 Å²	77.6	3%	0.034	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	145.7	179.6	-51.5	0	0	0	0	109.7	R118 T119 C145 F152	R118-C130 WeakPolarHBondContact CA-O 3.44Å; T119-C130 HydrophobicContact CG2-CB 4.2Å; T119-C130 PolarHBondContact N-O 3.33Å; T119-C130 PolarHBondContact O-N 3.29Å; C130-C145 VanDerWaalsContact SG-CA 3.58Å; C130-F152 HydrophobicContact CB-CE1 4.47Å; C130-F152 HydrophobicContact CB-CZ 4.1Å
131	C	91.2	Very high	83.5	Confident	107 Å²	107	75.8 Å²	75.8	72%	0.723	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	143	172.1	-63	0	0	0	0	110.4	Q117	Q117-C131 CarbonylContact O-C 3.51Å; Q117-C131 WeakPolarHBondContact O-CA 3.29Å
132	I	87.7	Confident	83.4	Confident	23 Å²	23	78.5 Å²	78.5	12%	0.118	46%	0.464	C	S	.	.			trans	-112.6	129.8	175.2	-64.3	175	0	0	0	107.7	Q117 T119 V141	Q117-I132 PolarHBondContact O-N 3.44Å; T119-I132 HydrophobicContact CG2-CD1 3.63Å; T119-I132 HydrophobicContact CG2-CG1 3.82Å; I132-V141 HydrophobicContact CG2-CG2 3.37Å
133	E	83.2	Confident	83.4	Confident	158 Å²	158	76.2 Å²	76.2	74%	0.738	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-71.7	133.1	169.6	-64.3	-172	162.1	0	0	110.1	S135	E133-S135 PolarHBondContact O-N 3Å
134	L	72.5	Confident	83.4	Confident	116 Å²	116	78.1 Å²	78.1	61%	0.607	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-67.4	127.4	178.2	-72.1	169.8	0	0	0	109.7	Q117	Q117-L134 HydrophobicContact CG-CD1 4.2Å; Q117-L134 HydrophobicContact CG-CD2 3.68Å; Q117-L134 HydrophobicContact CG-CG 3.83Å
135	S	68.3	Low	83.8	Confident	44 Å²	44	72 Å²	72	31%	0.308	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-99.4	127.1	166.2	175.8	0	0	0	0	109.2	E133 S137 G138	E133-S135 PolarHBondContact O-N 3Å; S135-S137 PolarHBondContact O-N 2.64Å; S135-S137 PolarHBondContact OG-N 3.22Å; S135-S137 PolarHBondContact OG-OG 2.78Å; S135-G138 PolarHBondContact O-N 3Å
136	D	62.9	Low	83.9	Confident	179 Å²	179	71.8 Å²	71.8	96%	0.957	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-14.5	177.5	-72.3	-23.2	0	0	0	113.5
137	S	63.7	Low	84	Confident	81 Å²	81	73.7 Å²	73.7	57%	0.566	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	8.1	-171.8	52.4	0	0	0	0	114.2	S135 Q139	S135-S137 PolarHBondContact O-N 2.64Å; S135-S137 PolarHBondContact OG-N 3.22Å; S135-S137 PolarHBondContact OG-OG 2.78Å; S137-Q139 PolarHBondContact O-N 3.04Å; S137-Q139 VanDerWaalsContact O-N 3.15Å; S137-Q139 VanDerWaalsContact OG-CG 3.32Å; S137-Q139 WeakPolarHBondContact OG-CG 3.32Å
138	G	64.1	Low	84.2	Confident	69 Å²	69	69.1 Å²	69.1	71%	0.711	41%	0.412	S	S	*	.			trans	62.7	18	-178.5	0	0	0	0	0	113.9	S135	S135-G138 PolarHBondContact O-N 3Å
139	Q	72.4	Confident	84.3	Confident	118 Å²	118	74 Å²	74	55%	0.551	43%	0.43	S	S	*	.			trans	-76.4	151.6	179.3	-66.4	-59.2	-56.1	0	0	111.3	S137 V141	S137-Q139 PolarHBondContact O-N 3.04Å; S137-Q139 VanDerWaalsContact O-N 3.15Å; S137-Q139 VanDerWaalsContact OG-CG 3.32Å; S137-Q139 WeakPolarHBondContact OG-CG 3.32Å; Q139-V141 PolarHBondContact O-N 3.25Å
140	P	78.8	Confident	84.2	Confident	37 Å²	37	74.7 Å²	74.7	24%	0.24	43%	0.432	C	S	.	.			trans	-58.7	136.5	171.9	-16.9	29.1	0	0	0	110.6
141	V	87.3	Confident	84.2	Confident	23 Å²	23	80 Å²	80	14%	0.139	46%	0.455	C	S	.	.			trans	-123.4	154	179.2	-66.4	0	0	0	0	110.1	I132 Q139 A143 S154 W160	I132-V141 HydrophobicContact CG2-CG2 3.37Å; Q139-V141 PolarHBondContact O-N 3.25Å; V141-A143 PolarHBondContact O-N 3.31Å; V141-S154 WeakPolarHBondContact CG2-OG 3.06Å; V141-S154 PolarHBondContact N-OG 2.91Å; V141-S154 VanDerWaalsContact O-CB 3.26Å; V141-S154 WeakPolarHBondContact O-CB 3.44Å; V141-S154 PolarHBondContact O-N 3.26Å; V141-S154 PolarHBondContact O-OG 3.42Å; V141-W160 WeakPolarHBondContact O-CZ3 3.44Å
142	P	90	Very high	84.3	Confident	66 Å²	66	75 Å²	75	43%	0.429	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	133.1	175	26.2	-29	0	0	0	109.6	W160	P142-W160 VanDerWaalsContact CA-CE3 3.44Å; P142-W160 HydrophobicContact CB-CD2 3.56Å; P142-W160 HydrophobicContact CB-CE3 3.75Å; P142-W160 HydrophobicContact CB-CG 3.98Å; P142-W160 HydrophobicContact CB-CH2 4.38Å; P142-W160 HydrophobicContact CB-CZ2 4.2Å; P142-W160 HydrophobicContact CB-CZ3 4.17Å; P142-W160 VanDerWaalsContact CD-CH2 3.42Å; P142-W160 HydrophobicContact CG-CD2 4.34Å; P142-W160 HydrophobicContact CG-CH2 4.28Å; P142-W160 HydrophobicContact CG-CZ2 4.06Å
143	A	91.9	Very high	84.4	Confident	2 Å²	2	73.9 Å²	73.9	2%	0.017	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	137.4	167.2	0	0	0	0	0	109.1	T119 V141 K151 F152	T119-A143 HydrophobicContact CG2-CB 4.45Å; V141-A143 PolarHBondContact O-N 3.31Å; A143-K151 WeakPolarHBondContact O-CA 3.23Å; A143-F152 HydrophobicContact CB-CD1 4.4Å; A143-F152 HydrophobicContact CB-CD2 4.23Å; A143-F152 HydrophobicContact CB-CE1 3.95Å; A143-F152 HydrophobicContact CB-CE2 3.79Å; A143-F152 HydrophobicContact CB-CZ 3.63Å; A143-F152 PolarHBondContact N-O 3.39Å; A143-F152 WeakPolarHBondContact O-CD1 3.4Å; A143-F152 PolarHBondContact O-N 2.83Å
144	E	94.4	Very high	84.6	Confident	72 Å²	72	67.2 Å²	67.2	34%	0.336	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	124.6	177	-176.8	168.9	-174.8	0	0	110.3	K151	E144-K151 HydrophobicContact CB-CG 4.12Å; E144-K151 HydrophobicContact CG-CG 3.95Å; E144-K151 WeakPolarHBondContact OE1-CE 3.33Å; E144-K151 WeakPolarHBondContact OE2-CE 3.39Å; E144-K151 IonicContact OE2-NZ 3.34Å; E144-K151 PolarHBondContact OE2-NZ 2.89Å
145	C	95	Very high	85.1	Confident	0 Å²	0	64 Å²	64	0%	0	37%	0.373	C	S	.	.			trans	-77.6	123.1	175.6	-176	0	0	0	0	110.9	C121 C126 C130 A147 H149 L150 F152	C121-C145 HydrophobicContact CB-CB 4.33Å; C126-C145 PolarHBondContact SG-SG 3.34Å; C130-C145 VanDerWaalsContact SG-CA 3.58Å; C145-A147 VanDerWaalsContact C-N 3.26Å; C145-A147 PolarHBondContact O-N 3.43Å; C145-A147 PolarHBondContact SG-N 2.86Å; C145-H149 WeakPolarHBondContact O-CA 3.33Å; C145-H149 PolarHBondContact O-N 3.36Å; C145-L150 PolarHBondContact N-O 2.75Å; C145-F152 HydrophobicContact CB-CE1 4.46Å
146	Q	94.6	Very high	85.8	Confident	148 Å²	148	62.8 Å²	62.8	69%	0.692	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-14.4	178.5	-58.8	-57.8	-35.7	0	0	113.8
147	A	94.8	Very high	87	Confident	72 Å²	72	57.8 Å²	57.8	60%	0.595	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-40.3	-179.2	0	0	0	0	0	113.1	A128 C145	A128-A147 HydrophobicContact CB-CB 3.87Å; C145-A147 VanDerWaalsContact C-N 3.26Å; C145-A147 PolarHBondContact O-N 3.43Å; C145-A147 PolarHBondContact SG-N 2.86Å
148	C	94.9	Very high	88.2	Confident	56 Å²	56	59.9 Å²	59.9	38%	0.378	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	1.8	-178.4	69.6	0	0	0	0	114.4	C126 L150	C126-C148 VanDerWaalsContact SG-SG 3.69Å; C148-L150 PolarHBondContact O-N 3.39Å
149	H	93.9	Very high	89.4	Confident	124 Å²	124	60 Å²	60	57%	0.574	33%	0.329	S	S	*	.			trans	58.6	15.9	180	-54.8	-63.7	0	0	0	115.4	C145 K151	C145-H149 WeakPolarHBondContact O-CA 3.33Å; C145-H149 PolarHBondContact O-N 3.36Å; H149-K151 PolarHBondContact O-N 2.96Å
150	L	93.8	Very high	90.2	Very high	69 Å²	69	58.8 Å²	58.8	36%	0.361	32%	0.319	S	S	.	.			trans	-68.7	127	173.8	-178	63.5	0	0	0	110.2	P122 A123 C145 C148 F152	P122-L150 HydrophobicContact CG-CD2 3.89Å; A123-L150 HydrophobicContact CB-CD2 4.18Å; C145-L150 PolarHBondContact N-O 2.75Å; C148-L150 PolarHBondContact O-N 3.39Å; L150-F152 HydrophobicContact CG-CD1 4.4Å
151	K	93.6	Very high	90.6	Very high	117 Å²	117	58.8 Å²	58.8	51%	0.509	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	123.8	171.1	-70.9	-177.6	175.1	-177.5	0	110.4	A143 E144 H149 W160	A143-K151 WeakPolarHBondContact O-CA 3.23Å; E144-K151 HydrophobicContact CB-CG 4.12Å; E144-K151 HydrophobicContact CG-CG 3.95Å; E144-K151 WeakPolarHBondContact OE1-CE 3.33Å; E144-K151 WeakPolarHBondContact OE2-CE 3.39Å; E144-K151 IonicContact OE2-NZ 3.34Å; E144-K151 PolarHBondContact OE2-NZ 2.89Å; H149-K151 PolarHBondContact O-N 2.96Å; K151-W160 PolarHBondContact O-N 3.09Å
152	F	92.1	Very high	89.9	Confident	1 Å²	1	62.5 Å²	62.5	0%	0.004	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	164.4	-173	63.3	-82.9	0	0	0	111.9	T119 P122 C130 A143 C145 L150 K157 E158	T119-F152 HydrophobicContact CG2-CE2 3.7Å; T119-F152 HydrophobicContact CG2-CZ 3.76Å; P122-F152 HydrophobicContact CG-CB 4.07Å; P122-F152 HydrophobicContact CG-CD1 4.15Å; P122-F152 HydrophobicContact CG-CD2 3.93Å; P122-F152 HydrophobicContact CG-CE2 4.39Å; P122-F152 HydrophobicContact CG-CG 3.79Å; C130-F152 HydrophobicContact CB-CE1 4.47Å; C130-F152 HydrophobicContact CB-CZ 4.1Å; A143-F152 HydrophobicContact CB-CD1 4.4Å; A143-F152 HydrophobicContact CB-CD2 4.23Å; A143-F152 HydrophobicContact CB-CE1 3.95Å; A143-F152 HydrophobicContact CB-CE2 3.79Å; A143-F152 HydrophobicContact CB-CZ 3.63Å; A143-F152 PolarHBondContact N-O 3.39Å; A143-F152 WeakPolarHBondContact O-CD1 3.4Å; A143-F152 PolarHBondContact O-N 2.83Å; C145-F152 HydrophobicContact CB-CE1 4.46Å; L150-F152 HydrophobicContact CG-CD1 4.4Å; F152-K157 HydrophobicContact CD2-CD 4.33Å; F152-K157 HydrophobicContact CE2-CD 4.24Å; F152-E158 CarbonylContact C-O 3.57Å; F152-E158 WeakPolarHBondContact CA-O 3.19Å; F152-E158 VanDerWaalsContact CB-O 3.29Å; F152-E158 WeakPolarHBondContact CB-O 3.06Å
153	C	90.1	Very high	88.7	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	127.5	176.8	177.6	0	0	0	0	111	S155 C156 K157 E158 W160 C166	C153-S155 PolarHBondContact O-N 3.18Å; C153-S155 VanDerWaalsContact O-N 3.09Å; C153-S155 PolarHBondContact SG-N 3.43Å; C153-C156 WeakPolarHBondContact CB-SG 2.91Å; C153-K157 VanDerWaalsContact O-CA 3.31Å; C153-K157 WeakPolarHBondContact O-CA 3.29Å; C153-K157 PolarHBondContact O-N 3.42Å; C153-E158 PolarHBondContact N-O 3.04Å; C153-W160 HydrophobicContact CB-CE3 4.35Å; C153-C166 PolarHBondContact SG-SG 3.01Å
154	S	87	Confident	87.3	Confident	17 Å²	17	74.7 Å²	74.7	12%	0.119	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-19.5	178.9	68.4	0	0	0	0	113.7	V141 K157	V141-S154 WeakPolarHBondContact CG2-OG 3.06Å; V141-S154 PolarHBondContact N-OG 2.91Å; V141-S154 VanDerWaalsContact O-CB 3.26Å; V141-S154 WeakPolarHBondContact O-CB 3.44Å; V141-S154 PolarHBondContact O-N 3.26Å; V141-S154 PolarHBondContact O-OG 3.42Å; S154-K157 PolarHBondContact O-NZ 3.45Å
155	S	83.1	Confident	86.1	Confident	50 Å²	50	77.8 Å²	77.8	35%	0.35	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-61	-177.8	-65.4	0	0	0	0	113.4	C153	C153-S155 PolarHBondContact O-N 3.18Å; C153-S155 VanDerWaalsContact O-N 3.09Å; C153-S155 PolarHBondContact SG-N 3.43Å
156	C	84.5	Confident	85.2	Confident	18 Å²	18	78 Å²	78	12%	0.122	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-10.7	-177.2	62.1	0	0	0	0	114.9	C153 E158 H161 C166	C153-C156 WeakPolarHBondContact CB-SG 2.91Å; C156-E158 HydrophobicContact CB-CG 4.49Å; C156-E158 PolarHBondContact O-N 3.3Å; C156-H161 PolarHBondContact SG-NE2 3.38Å; C156-C166 HydrophobicContact CB-CB 3.85Å; C156-C166 VanDerWaalsContact SG-SG 3.69Å
157	K	87.7	Confident	83.6	Confident	73 Å²	73	78.5 Å²	78.5	32%	0.317	41%	0.413	S	S	.	.			trans	66.3	5	-176.7	-43.5	-57	176.2	-165	0	116	T119 P122 F152 C153 S154	T119-K157 PolarHBondContact OG1-NZ 2.83Å; P122-K157 HydrophobicContact CB-CB 4Å; P122-K157 HydrophobicContact CG-CB 4.37Å; P122-K157 WeakPolarHBondContact CG-O 3.49Å; F152-K157 HydrophobicContact CD2-CD 4.33Å; F152-K157 HydrophobicContact CE2-CD 4.24Å; C153-K157 VanDerWaalsContact O-CA 3.31Å; C153-K157 WeakPolarHBondContact O-CA 3.29Å; C153-K157 PolarHBondContact O-N 3.42Å; S154-K157 PolarHBondContact O-NZ 3.45Å
158	E	88	Confident	81.6	Confident	126 Å²	126	81.4 Å²	81.4	59%	0.589	42%	0.419	S	S	*	.	S	Bend	trans	-76	172.5	169.6	-65.3	-58.1	146.1	0	0	112.3	F152 C153 C156 W160	F152-E158 CarbonylContact C-O 3.57Å; F152-E158 WeakPolarHBondContact CA-O 3.19Å; F152-E158 VanDerWaalsContact CB-O 3.29Å; F152-E158 WeakPolarHBondContact CB-O 3.06Å; C153-E158 PolarHBondContact N-O 3.04Å; C156-E158 HydrophobicContact CB-CG 4.49Å; C156-E158 PolarHBondContact O-N 3.3Å; E158-W160 PolarHBondContact O-N 3.23Å
159	A	89.4	Confident	79.2	Confident	71 Å²	71	83.5 Å²	83.5	59%	0.587	43%	0.426	S	S	*	.	B	Isolated β-bridge	trans	-50.7	139.3	172.6	0	0	0	0	0	111.3	H161	A159-H161 PolarHBondContact O-CD2 3.46Å; A159-H161 PolarHBondContact O-N 2.96Å
160	W	90.2	Very high	76.7	Confident	92 Å²	92	82.6 Å²	82.6	35%	0.348	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-55.4	131.7	-175	171.2	-111.8	0	0	0	112.1	V141 P142 K151 C153 E158	V141-W160 WeakPolarHBondContact O-CZ3 3.44Å; P142-W160 VanDerWaalsContact CA-CE3 3.44Å; P142-W160 HydrophobicContact CB-CD2 3.56Å; P142-W160 HydrophobicContact CB-CE3 3.75Å; P142-W160 HydrophobicContact CB-CG 3.98Å; P142-W160 HydrophobicContact CB-CH2 4.38Å; P142-W160 HydrophobicContact CB-CZ2 4.2Å; P142-W160 HydrophobicContact CB-CZ3 4.17Å; P142-W160 VanDerWaalsContact CD-CH2 3.42Å; P142-W160 HydrophobicContact CG-CD2 4.34Å; P142-W160 HydrophobicContact CG-CH2 4.28Å; P142-W160 HydrophobicContact CG-CZ2 4.06Å; K151-W160 PolarHBondContact O-N 3.09Å; C153-W160 HydrophobicContact CB-CE3 4.35Å; E158-W160 PolarHBondContact O-N 3.23Å
161	H	85.6	Confident	74.1	Confident	37 Å²	37	84.6 Å²	84.6	17%	0.171	44%	0.438	C	S	.	.			trans	-133.6	125.1	-179.5	57	76.7	0	0	0	110.7	C156 A159 H164	C156-H161 PolarHBondContact SG-NE2 3.38Å; A159-H161 PolarHBondContact O-CD2 3.46Å; A159-H161 PolarHBondContact O-N 2.96Å; H161-H164 PolarHBondContact CE1-O 2.92Å; H161-H164 PolarHBondContact ND1-O 2.97Å
162	P	73.3	Confident	71.3	Confident	101 Å²	101	84.3 Å²	84.3	66%	0.656	45%	0.446	S	S	*	.	S	Bend	trans	-82.4	-21.1	-174.2	26.5	-30.3	0	0	0	115.1
163	E	65.1	Low	68.6	Low	174 Å²	174	90 Å²	90	81%	0.813	48%	0.48	S	S	*	.	S	Bend	trans	-134.9	-0.4	-164	-58.2	-163.9	-154.7	0	0	115.9
164	H	62.3	Low	65.8	Low	150 Å²	150	94.8 Å²	94.8	69%	0.694	51%	0.509	S	S	*	.	S	Bend	trans	-104.6	135	176.4	-67.6	-78.3	0	0	0	110.9	H161 C166	H161-H164 PolarHBondContact CE1-O 2.92Å; H161-H164 PolarHBondContact ND1-O 2.97Å; H164-C166 PolarHBondContact O-N 3Å
165	L	70.1	Confident	63.2	Low	137 Å²	137	99.6 Å²	99.6	72%	0.717	54%	0.54	S	S	*	.			trans	-54.2	129.8	161.6	-71	163.6	0	0	0	107.1	Q167	L165-Q167 PolarHBondContact O-N 3.18Å
166	C	75.6	Confident	60.9	Low	6 Å²	6	102.2 Å²	102.2	4%	0.041	55%	0.554	C	S	.	*			trans	-43.3	127.1	173.5	-74	0	0	0	0	108.8	C153 C156 H164 D168 N169	C153-C166 PolarHBondContact SG-SG 3.01Å; C156-C166 HydrophobicContact CB-CB 3.85Å; C156-C166 VanDerWaalsContact SG-SG 3.69Å; H164-C166 PolarHBondContact O-N 3Å; C166-D168 PolarHBondContact O-N 3.38Å; C166-D168 VanDerWaalsContact O-N 3.12Å; C166-N169 HydrophobicContact CB-CB 4.1Å; C166-N169 WeakPolarHBondContact O-CA 3.31Å; C166-N169 WeakPolarHBondContact O-CB 3.45Å; C166-N169 PolarHBondContact O-N 2.99Å
167	Q	61.3	Low	58.9	Low	157 Å²	157	110 Å²	110	73%	0.734	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-58.9	-31.4	-170.3	-167.2	154.6	-9.1	0	0	112.3	L165 N169 Q170	L165-Q167 PolarHBondContact O-N 3.18Å; Q167-N169 VanDerWaalsContact C-N 3.32Å; Q167-N169 PolarHBondContact O-N 3.38Å; Q167-Q170 WeakPolarHBondContact O-CB 3.41Å; Q167-Q170 PolarHBondContact O-N 3.29Å
168	D	52.1	Low	56.6	Low	133 Å²	133	114.7 Å²	114.7	71%	0.711	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-78.2	-9	174.9	-62	-35.3	0	0	0	115	C166 Q170	C166-D168 PolarHBondContact O-N 3.38Å; C166-D168 VanDerWaalsContact O-N 3.12Å; D168-Q170 VanDerWaalsContact C-N 3.35Å
169	N	45.1	Very low	54.3	Low	100 Å²	100	112.9 Å²	112.9	54%	0.535	63%	0.627	S	S	.	*	G	3₁₀ helix	trans	-93.8	2.5	171.5	-119.3	23.6	0	0	0	111.8	C166 Q167 T171	C166-N169 HydrophobicContact CB-CB 4.1Å; C166-N169 WeakPolarHBondContact O-CA 3.31Å; C166-N169 WeakPolarHBondContact O-CB 3.45Å; C166-N169 PolarHBondContact O-N 2.99Å; Q167-N169 VanDerWaalsContact C-N 3.32Å; Q167-N169 PolarHBondContact O-N 3.38Å; N169-T171 PolarHBondContact O-N 2.94Å
170	Q	40.7	Very low	51.7	Low	106 Å²	106	113.8 Å²	113.8	50%	0.495	63%	0.629	S	S	.	*			trans	-72.7	81	162.3	-66.1	-175.8	64.7	0	0	108.2	Q167 D168 T172	Q167-Q170 WeakPolarHBondContact O-CB 3.41Å; Q167-Q170 PolarHBondContact O-N 3.29Å; D168-Q170 VanDerWaalsContact C-N 3.35Å; Q170-T172 PolarHBondContact O-N 2.72Å
171	T	40.1	Very low	49.3	Very low	111 Å²	111	117.2 Å²	117.2	68%	0.681	65%	0.654	S	S	*	*			trans	-52.9	103.8	133.6	-34.4	0	0	0	0	103.7	N169 V173	N169-T171 PolarHBondContact O-N 2.94Å; T171-V173 HydrophobicContact CG2-CG2 4.33Å; T171-V173 PolarHBondContact O-N 3.05Å
172	T	34.1	Very low	47.5	Very low	110 Å²	110	122.7 Å²	122.7	68%	0.675	68%	0.682	S	S	*	*			trans	-61.3	82.3	177.8	-59.6	0	0	0	0	108	Q170 V174	Q170-T172 PolarHBondContact O-N 2.72Å; T172-V174 VanDerWaalsContact C-N 3.27Å; T172-V174 HydrophobicContact CG2-CG2 3.66Å; T172-V174 PolarHBondContact O-N 2.82Å
173	V	35.5	Very low	45.8	Very low	121 Å²	121	120.3 Å²	120.3	73%	0.733	68%	0.676	S	S	*	*			trans	-86.1	81.9	170.4	-177.2	0	0	0	0	104.9	T171 P175	T171-V173 HydrophobicContact CG2-CG2 4.33Å; T171-V173 PolarHBondContact O-N 3.05Å; V173-P175 WeakPolarHBondContact O-CD 3.25Å
174	V	31.3	Very low	44.8	Very low	100 Å²	100	121.9 Å²	121.9	61%	0.606	69%	0.686	S	S	*	*			trans	-79.2	119.7	161.2	-178.3	0	0	0	0	105.9	T172 T176	T172-V174 VanDerWaalsContact C-N 3.27Å; T172-V174 HydrophobicContact CG2-CG2 3.66Å; T172-V174 PolarHBondContact O-N 2.82Å; V174-T176 PolarHBondContact O-N 3.02Å; V174-T176 VanDerWaalsContact O-N 3.16Å
175	P	33.5	Very low	44.5	Very low	118 Å²	118	120.7 Å²	120.7	77%	0.766	68%	0.681	S	S	*	*			trans	-71.4	110.6	168	15.4	-4.9	0	0	0	107	V173	V173-P175 WeakPolarHBondContact O-CD 3.25Å
176	T	34.3	Very low	43.8	Very low	105 Å²	105	117.2 Å²	117.2	64%	0.644	66%	0.662	S	S	*	*			trans	-125.1	133.7	158.1	-0.9	0	0	0	0	108.3	V174 Q178	V174-T176 PolarHBondContact O-N 3.02Å; V174-T176 VanDerWaalsContact O-N 3.16Å; T176-Q178 PolarHBondContact O-N 3.29Å
177	E	42.3	Very low	43.3	Very low	181 Å²	181	125.1 Å²	125.1	85%	0.846	70%	0.699	S	S	*	*	S	Bend	trans	-62	17.5	-166.5	45.4	-127.9	109.7	0	0	116.9
178	Q	38.9	Very low	43.9	Very low	172 Å²	172	119.1 Å²	119.1	80%	0.804	68%	0.676	S	S	*	*	S	Bend	trans	-141.6	59.7	-174.6	-68.3	162.7	5.1	0	0	112	T176 S180	T176-Q178 PolarHBondContact O-N 3.29Å; Q178-S180 VanDerWaalsContact C-N 3.26Å; Q178-S180 PolarHBondContact O-N 2.85Å
179	G	39.6	Very low	45.4	Very low	88 Å²	88	116.7 Å²	116.7	91%	0.907	67%	0.668	S	S	*	*			trans	48.1	11.6	137.7	0	0	0	0	0	122.6
180	S	35.2	Very low	47.4	Very low	91 Å²	91	116.3 Å²	116.3	64%	0.636	67%	0.665	S	S	*	*			trans	-123.3	101.7	179.3	-168.9	0	0	0	0	110.2	Q178 I182	Q178-S180 VanDerWaalsContact C-N 3.26Å; Q178-S180 PolarHBondContact O-N 2.85Å; S180-I182 PolarHBondContact O-N 3.38Å
181	L	40.3	Very low	49.6	Very low	164 Å²	164	112.2 Å²	112.2	86%	0.859	65%	0.645	S	S	*	*			trans	-82.4	97.8	179	-61.4	172	0	0	0	109.3
182	I	46.3	Very low	51.8	Low	151 Å²	151	110.1 Å²	110.1	77%	0.774	63%	0.628	S	S	*	*			trans	-126.7	97.6	170.7	-45.2	174.4	0	0	0	107.5	S180	S180-I182 PolarHBondContact O-N 3.38Å
183	G	38.9	Very low	54.3	Low	51 Å²	51	104.9 Å²	104.9	53%	0.526	60%	0.595	S	S	.	*			trans	-126.1	130.3	172.4	0	0	0	0	0	109	E185	G183-E185 PolarHBondContact O-N 3.47Å
184	M	44.8	Very low	56.7	Low	207 Å²	207	101.2 Å²	101.2	100%	1.02	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.3	-0.5	-167.2	-84.2	165.6	150.4	0	0	119.7
185	E	54	Low	59.1	Low	125 Å²	125	100.5 Å²	100.5	58%	0.584	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	-8.2	-168.6	-138.4	-174.2	164.7	0	0	114.7	G183 E187 A188 K191	G183-E185 PolarHBondContact O-N 3.47Å; E185-E187 PolarHBondContact O-N 3.23Å; E185-A188 PolarHBondContact O-N 2.65Å; E185-K191 WeakPolarHBondContact O-CE 3.27Å; E185-K191 PolarHBondContact O-NZ 3.3Å
186	I	56.6	Low	61.3	Low	65 Å²	65	95 Å²	95	33%	0.333	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-26.4	-173.6	-61.7	176.9	0	0	0	112.1	Y221	I186-Y221 HydrophobicContact CG2-CD1 3.62Å; I186-Y221 HydrophobicContact CG2-CE1 4Å
187	E	65.5	Low	63.3	Low	171 Å²	171	95.7 Å²	95.7	80%	0.799	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.3	8.9	-173.8	-65.8	-176.9	169.8	0	0	114.2	E185	E185-E187 PolarHBondContact O-N 3.23Å
188	A	73.1	Confident	65.2	Low	31 Å²	31	89.9 Å²	89.9	26%	0.256	50%	0.499	S	S	.	.			trans	-55.1	129.2	174.6	0	0	0	0	0	109.5	E185 I190 W220	E185-A188 PolarHBondContact O-N 2.65Å; A188-I190 PolarHBondContact O-N 2.97Å; A188-W220 WeakPolarHBondContact O-CZ2 3.44Å
189	P	82.8	Confident	67.5	Low	83 Å²	83	89.5 Å²	89.5	54%	0.539	49%	0.491	S	S	.	.	S	Bend	trans	-71	-18.4	-176.4	27.3	-34.4	0	0	0	112.5	E201 R202	P189-E201 CarbonylContact O-C 3.59Å; P189-E201 WeakPolarHBondContact O-CA 3.35Å; P189-R202 PolarHBondContact O-N 2.84Å
190	I	86.9	Confident	69.8	Low	92 Å²	92	86.3 Å²	86.3	47%	0.472	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	130.9	-177.9	-58.6	172.6	0	0	0	108.9	A188 Y199 I200 E201	A188-I190 PolarHBondContact O-N 2.97Å; I190-Y199 HydrophobicContact CG2-CD1 3.83Å; I190-Y199 HydrophobicContact CG2-CG 4.36Å; I190-I200 WeakPolarHBondContact CA-O 3.43Å; I190-E201 HydrophobicContact CG1-CB 4.31Å; I190-E201 HydrophobicContact CG1-CG 4.29Å
191	K	88.1	Confident	72.3	Confident	20 Å²	20	88 Å²	88	9%	0.087	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	159.9	174	-65.8	-176.9	174.8	-73.3	0	111.1	E185 I200 W220 L223	E185-K191 WeakPolarHBondContact O-CE 3.27Å; E185-K191 PolarHBondContact O-NZ 3.3Å; K191-I200 PolarHBondContact N-O 2.93Å; K191-I200 PolarHBondContact O-N 2.94Å; K191-W220 HydrophobicContact CB-CE3 4.19Å; K191-W220 HydrophobicContact CB-CH2 3.62Å; K191-W220 HydrophobicContact CB-CZ2 4.21Å; K191-W220 HydrophobicContact CB-CZ3 3.59Å; K191-W220 HydrophobicContact CD-CD2 3.77Å; K191-W220 HydrophobicContact CD-CE3 3.87Å; K191-W220 HydrophobicContact CD-CG 4.48Å; K191-W220 HydrophobicContact CD-CH2 4.04Å; K191-W220 HydrophobicContact CD-CZ2 3.84Å; K191-W220 HydrophobicContact CD-CZ3 4.03Å; K191-W220 WeakPolarHBondContact CD-O 3.32Å; K191-W220 HydrophobicContact CG-CD2 4.47Å; K191-W220 HydrophobicContact CG-CE3 4.32Å; K191-W220 HydrophobicContact CG-CH2 3.65Å; K191-W220 HydrophobicContact CG-CZ2 3.71Å; K191-W220 HydrophobicContact CG-CZ3 3.95Å; K191-L223 HydrophobicContact CD-CD2 4.33Å
192	Q	85.7	Confident	74.5	Confident	67 Å²	67	82.6 Å²	82.6	31%	0.313	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	144.5	173.9	-69	-176.2	-21.7	0	0	111.8	R197 I198 Y199	Q192-R197 WeakPolarHBondContact CG-O 3.35Å; Q192-I198 CarbonylContact C-O 3.56Å; Q192-I198 WeakPolarHBondContact CA-O 3.47Å; Q192-Y199 HydrophobicContact CG-CD1 3.73Å; Q192-Y199 HydrophobicContact CG-CE1 3.57Å; Q192-Y199 HydrophobicContact CG-CG 4.33Å; Q192-Y199 VanDerWaalsContact NE2-CZ 3.3Å; Q192-Y199 PolarHBondContact NE2-OH 2.95Å
193	C	87.1	Confident	75.8	Confident	0 Å²	0	81.5 Å²	81.5	0%	0	42%	0.415	C	S	.	.			trans	-60.6	131.6	167.7	179.3	0	0	0	0	110.6	V195 C196 R197 I198 I200 C211 C214	C193-V195 PolarHBondContact O-N 3.44Å; C193-C196 VanDerWaalsContact SG-SG 3.61Å; C193-R197 WeakPolarHBondContact O-CA 3.38Å; C193-R197 WeakPolarHBondContact O-CD 3.43Å; C193-R197 PolarHBondContact O-N 2.84Å; C193-I198 HydrophobicContact CB-CG2 4.12Å; C193-I198 PolarHBondContact N-O 2.91Å; C193-I200 HydrophobicContact CB-CD1 3.73Å; C193-C211 HydrophobicContact CB-CB 4.37Å; C193-C214 PolarHBondContact SG-SG 3.37Å
194	P	85.4	Confident	77.5	Confident	44 Å²	44	87.5 Å²	87.5	29%	0.286	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-20.2	-177.8	26	-34.4	0	0	0	113.8	F218 L223	P194-F218 HydrophobicContact CG-CB 4.01Å; P194-F218 HydrophobicContact CG-CD1 4.29Å; P194-F218 HydrophobicContact CG-CD2 4.21Å; P194-F218 HydrophobicContact CG-CG 3.91Å; P194-L223 HydrophobicContact CB-CB 4.4Å
195	V	81.9	Confident	79.2	Confident	84 Å²	84	79.8 Å²	79.8	51%	0.509	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-62.7	178.7	173.9	0	0	0	0	111.2	C193 C214 H216	C193-V195 PolarHBondContact O-N 3.44Å; V195-C214 HydrophobicContact CG1-CB 4.49Å; V195-H216 HydrophobicContact CB-CB 4.28Å; V195-H216 HydrophobicContact CG2-CB 4.04Å; V195-H216 WeakPolarHBondContact CG2-CD2 3.19Å; V195-H216 VanDerWaalsContact CG2-CG 3.46Å
196	C	79.1	Confident	80.8	Confident	3 Å²	3	76 Å²	76	2%	0.02	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	2.8	-171.8	70.7	0	0	0	0	114.9	C193 I198 C211 C214	C193-C196 VanDerWaalsContact SG-SG 3.61Å; C196-I198 PolarHBondContact O-N 3.26Å; C196-C211 PolarHBondContact SG-SG 3.49Å; C196-C214 HydrophobicContact CB-CB 3.92Å; C196-C214 PolarHBondContact SG-SG 3.35Å
197	R	77.9	Confident	82.4	Confident	119 Å²	119	72.9 Å²	72.9	45%	0.449	37%	0.373	S	S	.	.			trans	58	4.7	176.7	-57.6	-61.8	-170.9	126.2	-0.7	117.4	Q192 C193	Q192-R197 WeakPolarHBondContact CG-O 3.35Å; C193-R197 WeakPolarHBondContact O-CA 3.38Å; C193-R197 WeakPolarHBondContact O-CD 3.43Å; C193-R197 PolarHBondContact O-N 2.84Å
198	I	82	Confident	83.5	Confident	59 Å²	59	67 Å²	67	30%	0.303	35%	0.346	S	S	.	.			trans	-61.5	140	172.9	-158.3	165.4	0	0	0	110.5	Q192 C193 C196 I200 N213	Q192-I198 CarbonylContact C-O 3.56Å; Q192-I198 WeakPolarHBondContact CA-O 3.47Å; C193-I198 HydrophobicContact CB-CG2 4.12Å; C193-I198 PolarHBondContact N-O 2.91Å; C196-I198 PolarHBondContact O-N 3.26Å; I198-I200 HydrophobicContact CG2-CG1 4.15Å; I198-N213 HydrophobicContact CD1-CB 4.22Å; I198-N213 HydrophobicContact CG2-CB 4.11Å
199	Y	86	Confident	84.3	Confident	164 Å²	164	66.8 Å²	66.8	64%	0.643	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.5	134.4	173.4	-69.1	-79.8	0	0	0	110.4	I190 Q192	I190-Y199 HydrophobicContact CG2-CD1 3.83Å; I190-Y199 HydrophobicContact CG2-CG 4.36Å; Q192-Y199 HydrophobicContact CG-CD1 3.73Å; Q192-Y199 HydrophobicContact CG-CE1 3.57Å; Q192-Y199 HydrophobicContact CG-CG 4.33Å; Q192-Y199 VanDerWaalsContact NE2-CZ 3.3Å; Q192-Y199 PolarHBondContact NE2-OH 2.95Å
200	I	88.1	Confident	84.7	Confident	22 Å²	22	68.5 Å²	68.5	11%	0.113	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	125	-178.9	-62.6	171.9	0	0	0	106.7	I190 K191 C193 I198 M209 C211 F218 W220	I190-I200 WeakPolarHBondContact CA-O 3.43Å; K191-I200 PolarHBondContact N-O 2.93Å; K191-I200 PolarHBondContact O-N 2.94Å; C193-I200 HydrophobicContact CB-CD1 3.73Å; I198-I200 HydrophobicContact CG2-CG1 4.15Å; I200-M209 HydrophobicContact CG2-CE 3.42Å; I200-M209 VanDerWaalsContact CG2-CE 3.42Å; I200-C211 HydrophobicContact CD1-CB 3.97Å; I200-F218 HydrophobicContact CD1-CE1 3.76Å; I200-F218 HydrophobicContact CD1-CZ 3.67Å; I200-W220 HydrophobicContact CG2-CZ3 4.33Å; I200-W220 WeakPolarHBondContact O-CH2 3.39Å
201	E	88.2	Confident	84.8	Confident	126 Å²	126	64.2 Å²	64.2	59%	0.589	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	140.2	169.3	-172.7	-179.4	-175.7	0	0	110.2	P189 I190	P189-E201 CarbonylContact O-C 3.59Å; P189-E201 WeakPolarHBondContact O-CA 3.35Å; I190-E201 HydrophobicContact CG1-CB 4.31Å; I190-E201 HydrophobicContact CG1-CG 4.29Å
202	R	85.7	Confident	84.6	Confident	50 Å²	50	70.3 Å²	70.3	19%	0.189	35%	0.347	C	S	.	.			trans	-97.9	109.6	173.9	-179.4	178	176.6	-157.3	-2.8	110.4	P189 E204 G205 M209 W220 Y221	P189-R202 PolarHBondContact O-N 2.84Å; R202-E204 PolarHBondContact O-N 3.45Å; R202-G205 PolarHBondContact NH2-O 2.85Å; R202-M209 HydrophobicContact CB-CE 4.08Å; R202-M209 HydrophobicContact CB-SD 4.07Å; R202-M209 HydrophobicContact CG-CE 4.39Å; R202-M209 HydrophobicContact CG-SD 4.1Å; R202-W220 HydrophobicContact CB-CD2 4.25Å; R202-W220 HydrophobicContact CB-CH2 3.67Å; R202-W220 HydrophobicContact CB-CZ2 3.41Å; R202-W220 VanDerWaalsContact CB-CZ2 3.41Å; R202-W220 HydrophobicContact CB-CZ3 4.25Å; R202-W220 HydrophobicContact CG-CZ2 4.41Å; R202-W220 VanDerWaalsContact NH1-CD1 3.33Å; R202-Y221 PolarHBondContact NH1-OH 3.29Å; R202-Y221 PolarHBondContact NH2-OH 3.23Å
203	N	73.9	Confident	84.5	Confident	128 Å²	128	67.4 Å²	67.4	68%	0.684	33%	0.334	S	S	*	.			trans	-85.7	42.8	-179.3	-57.9	-5	0	0	0	112.9
204	E	74.1	Confident	84.3	Confident	178 Å²	178	68.6 Å²	68.6	83%	0.832	34%	0.341	S	S	*	.	S	Bend	trans	63.1	176.2	-173.7	-52.6	-176.3	159.6	0	0	115.1	R202	R202-E204 PolarHBondContact O-N 3.45Å
205	G	82	Confident	84.3	Confident	44 Å²	44	71.3 Å²	71.3	45%	0.454	35%	0.349	S	S	.	.	S	Bend	trans	82.3	-130.8	178.1	0	0	0	0	0	114.8	R202	R202-G205 PolarHBondContact NH2-O 2.85Å
206	C	86.6	Confident	84.7	Confident	45 Å²	45	67.9 Å²	67.9	30%	0.304	33%	0.327	S	S	.	.			trans	-62.2	132.5	-167.7	-170.3	0	0	0	0	112.7	Q208 L244	C206-Q208 PolarHBondContact SG-N 2.85Å; C206-Q208 VanDerWaalsContact SG-N 3.43Å; C206-L244 CarbonylContact C-O 3.48Å; C206-L244 VanDerWaalsContact CA-O 3.24Å; C206-L244 WeakPolarHBondContact CA-O 3.35Å; C206-L244 VanDerWaalsContact SG-CD1 3.57Å
207	A	89.4	Confident	85.3	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	33%	0.33	C	S	.	.	S	Bend	trans	-82	-13.5	176.9	0	0	0	0	0	114	M209 W220 Y221 Y235 K243 L244	A207-M209 PolarHBondContact O-N 2.84Å; A207-W220 WeakPolarHBondContact O-CB 3.45Å; A207-W220 PolarHBondContact O-N 3.38Å; A207-Y221 HydrophobicContact CB-CD2 3.97Å; A207-Y221 HydrophobicContact CB-CE2 3.39Å; A207-Y235 HydrophobicContact CB-CE1 3.91Å; A207-Y235 PolarHBondContact O-OH 2.85Å; A207-K243 WeakPolarHBondContact CB-O 3.26Å; A207-L244 PolarHBondContact N-O 3.28Å
208	Q	90	Very high	86	Confident	49 Å²	49	62.7 Å²	62.7	23%	0.229	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	108.8	169.6	179.3	166.7	-43.1	0	0	108.5	C206 T217 L226 Y235 L244	C206-Q208 PolarHBondContact SG-N 2.85Å; C206-Q208 VanDerWaalsContact SG-N 3.43Å; Q208-T217 HydrophobicContact CG-CG2 3.49Å; Q208-T217 VanDerWaalsContact CG-CG2 3.49Å; Q208-L226 HydrophobicContact CB-CD1 4.43Å; Q208-L226 HydrophobicContact CG-CD1 4.05Å; Q208-Y235 WeakPolarHBondContact CA-OH 3.28Å; Q208-Y235 HydrophobicContact CB-CE2 4.17Å; Q208-Y235 PolarHBondContact N-OH 3.07Å; Q208-Y235 VanDerWaalsContact N-OH 3.11Å; Q208-L244 HydrophobicContact CB-CD1 4.21Å
209	M	89.8	Confident	86.4	Confident	25 Å²	25	59.9 Å²	59.9	12%	0.123	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	147.7	-176.6	-63.9	-167.7	70.5	0	0	110.3	I200 R202 A207 T217 F218 W220	I200-M209 HydrophobicContact CG2-CE 3.42Å; I200-M209 VanDerWaalsContact CG2-CE 3.42Å; R202-M209 HydrophobicContact CB-CE 4.08Å; R202-M209 HydrophobicContact CB-SD 4.07Å; R202-M209 HydrophobicContact CG-CE 4.39Å; R202-M209 HydrophobicContact CG-SD 4.1Å; A207-M209 PolarHBondContact O-N 2.84Å; M209-T217 CarbonylContact O-C 3.5Å; M209-T217 VanDerWaalsContact O-CA 3.25Å; M209-T217 WeakPolarHBondContact O-CA 3.39Å; M209-F218 HydrophobicContact CB-CE1 4.18Å; M209-F218 HydrophobicContact CB-CE2 4.44Å; M209-F218 HydrophobicContact CB-CZ 4.05Å; M209-F218 PolarHBondContact N-O 3.44Å; M209-F218 PolarHBondContact O-N 3.43Å; M209-W220 HydrophobicContact CE-CE3 4.17Å; M209-W220 HydrophobicContact CE-CZ3 3.99Å; M209-W220 HydrophobicContact CG-CB 4.42Å; M209-W220 HydrophobicContact CG-CE3 4.36Å; M209-W220 HydrophobicContact SD-CB 4.11Å; M209-W220 HydrophobicContact SD-CD2 3.56Å; M209-W220 VanDerWaalsContact SD-CD2 3.56Å; M209-W220 HydrophobicContact SD-CE3 2.99Å; M209-W220 HydrophobicContact SD-CG 4.08Å; M209-W220 HydrophobicContact SD-CH2 4.3Å; M209-W220 HydrophobicContact SD-CZ3 3.42Å; M209-W220 WeakPolarHBondContact SD-CZ3 3.33Å
210	M	90.8	Very high	86.7	Confident	120 Å²	120	52.2 Å²	52.2	59%	0.591	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	122.9	172.3	-179.1	-176.4	-70.6	0	0	108.3	K212	M210-K212 PolarHBondContact O-N 3.46Å
211	C	88.2	Confident	86.7	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.007	27%	0.27	C	S	.	.			trans	-65.1	119.8	176	-179.8	0	0	0	0	110	C193 C196 I200 N213 C214 K215 H216 F218	C193-C211 HydrophobicContact CB-CB 4.37Å; C196-C211 PolarHBondContact SG-SG 3.49Å; I200-C211 HydrophobicContact CD1-CB 3.97Å; C211-N213 PolarHBondContact O-N 3.49Å; C211-N213 PolarHBondContact SG-N 2.92Å; C211-C214 PolarHBondContact SG-N 3.1Å; C211-C214 VanDerWaalsContact SG-N 3.44Å; C211-K215 WeakPolarHBondContact O-CA 3.41Å; C211-K215 PolarHBondContact O-N 3.49Å; C211-H216 PolarHBondContact N-O 3.37Å; C211-F218 HydrophobicContact CB-CE1 4.45Å
212	K	84.5	Confident	86.7	Confident	148 Å²	148	50.2 Å²	50.2	64%	0.643	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-31.1	177.4	-69.8	-171.6	179	-176.5	0	112.6	M210 K215	M210-K212 PolarHBondContact O-N 3.46Å; K212-K215 WeakPolarHBondContact O-CE 3.46Å; K212-K215 PolarHBondContact O-NZ 3.14Å
213	N	82.9	Confident	86.8	Confident	7 Å²	7	51.1 Å²	51.1	4%	0.037	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-87.5	173.7	-167.9	35	0	0	0	110	C69 R110 I198 C211 K215	C69-N213 PolarHBondContact O-OD1 2.74Å; R110-N213 PolarHBondContact NH1-O 2.89Å; R110-N213 PolarHBondContact NH1-OD1 2.84Å; R110-N213 PolarHBondContact NH2-O 2.88Å; I198-N213 HydrophobicContact CD1-CB 4.22Å; I198-N213 HydrophobicContact CG2-CB 4.11Å; C211-N213 PolarHBondContact O-N 3.49Å; C211-N213 PolarHBondContact SG-N 2.92Å; N213-K215 VanDerWaalsContact C-N 3.26Å; N213-K215 PolarHBondContact O-N 3.34Å; N213-K215 VanDerWaalsContact O-N 3.12Å
214	C	83.4	Confident	87.5	Confident	24 Å²	24	50.6 Å²	50.6	16%	0.162	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-1.6	-171.4	65	0	0	0	0	116.4	L114 C193 V195 C196 C211 H216	L114-C214 HydrophobicContact CD2-CB 3.64Å; C193-C214 PolarHBondContact SG-SG 3.37Å; V195-C214 HydrophobicContact CG1-CB 4.49Å; C196-C214 HydrophobicContact CB-CB 3.92Å; C196-C214 PolarHBondContact SG-SG 3.35Å; C211-C214 PolarHBondContact SG-N 3.1Å; C211-C214 VanDerWaalsContact SG-N 3.44Å; C214-H216 PolarHBondContact O-N 3.4Å; C214-H216 WeakPolarHBondContact SG-CB 3.07Å
215	K	86.8	Confident	88.2	Confident	102 Å²	102	46.6 Å²	46.6	44%	0.443	24%	0.243	S	C	.	.			trans	61.2	3.3	-174.5	-51.2	-53.3	-173.4	-164.5	0	115.4	C211 K212 N213 T217	C211-K215 WeakPolarHBondContact O-CA 3.41Å; C211-K215 PolarHBondContact O-N 3.49Å; K212-K215 WeakPolarHBondContact O-CE 3.46Å; K212-K215 PolarHBondContact O-NZ 3.14Å; N213-K215 VanDerWaalsContact C-N 3.26Å; N213-K215 PolarHBondContact O-N 3.34Å; N213-K215 VanDerWaalsContact O-N 3.12Å; K215-T217 PolarHBondContact O-N 2.98Å
216	H	89.1	Confident	88.6	Confident	11 Å²	11	44.8 Å²	44.8	5%	0.051	22%	0.223	C	C	.	.			trans	-59.9	128.8	173.2	-177.6	50.4	0	0	0	111.1	V195 C211 C214 N225 D227	V195-H216 HydrophobicContact CB-CB 4.28Å; V195-H216 HydrophobicContact CG2-CB 4.04Å; V195-H216 WeakPolarHBondContact CG2-CD2 3.19Å; V195-H216 VanDerWaalsContact CG2-CG 3.46Å; C211-H216 PolarHBondContact N-O 3.37Å; C214-H216 PolarHBondContact O-N 3.4Å; C214-H216 WeakPolarHBondContact SG-CB 3.07Å; H216-N225 PolarHBondContact CE1-ND2 3.18Å; H216-D227 WeakPolarHBondContact CA-OD1 3.38Å; H216-D227 IonicContact CE1-OD1 2.73Å; H216-D227 IonicContact CE1-OD2 2.72Å; H216-D227 PolarHBondContact CE1-OD2 3.49Å; H216-D227 IonicContact CG-OD1 3.65Å; H216-D227 IonicContact CG-OD2 3.78Å; H216-D227 VanDerWaalsContact ND1-CG 3.28Å; H216-D227 IonicContact ND1-OD1 3.75Å; H216-D227 PolarHBondContact ND1-OD1 2.92Å; H216-D227 VanDerWaalsContact ND1-OD1 3.16Å; H216-D227 IonicContact ND1-OD2 2.85Å; H216-D227 PolarHBondContact ND1-OD2 2.89Å
217	T	92.3	Very high	88.6	Confident	14 Å²	14	45.8 Å²	45.8	9%	0.086	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	129.6	178.1	-55.6	0	0	0	0	109.4	Q208 M209 K215 L226 D227	Q208-T217 HydrophobicContact CG-CG2 3.49Å; Q208-T217 VanDerWaalsContact CG-CG2 3.49Å; M209-T217 CarbonylContact O-C 3.5Å; M209-T217 VanDerWaalsContact O-CA 3.25Å; M209-T217 WeakPolarHBondContact O-CA 3.39Å; K215-T217 PolarHBondContact O-N 2.98Å; T217-L226 HydrophobicContact CG2-CB 4.13Å; T217-L226 CarbonylContact O-C 3.52Å; T217-L226 WeakPolarHBondContact O-CA 3.18Å; T217-L226 PolarHBondContact O-N 3.24Å; T217-D227 PolarHBondContact N-OD1 2.74Å; T217-D227 PolarHBondContact O-N 3.49Å
218	F	92.3	Very high	88.4	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	162.4	-175.4	65.3	-80.7	0	0	0	112.8	P194 I200 M209 C211 W220 L223 Q224	P194-F218 HydrophobicContact CG-CB 4.01Å; P194-F218 HydrophobicContact CG-CD1 4.29Å; P194-F218 HydrophobicContact CG-CD2 4.21Å; P194-F218 HydrophobicContact CG-CG 3.91Å; I200-F218 HydrophobicContact CD1-CE1 3.76Å; I200-F218 HydrophobicContact CD1-CZ 3.67Å; M209-F218 HydrophobicContact CB-CE1 4.18Å; M209-F218 HydrophobicContact CB-CE2 4.44Å; M209-F218 HydrophobicContact CB-CZ 4.05Å; M209-F218 PolarHBondContact N-O 3.44Å; M209-F218 PolarHBondContact O-N 3.43Å; C211-F218 HydrophobicContact CB-CE1 4.45Å; F218-W220 HydrophobicContact CE2-CE3 4.3Å; F218-L223 HydrophobicContact CD2-CD2 3.93Å; F218-L223 HydrophobicContact CE2-CD2 3.88Å; F218-Q224 WeakPolarHBondContact CA-O 3.34Å; F218-Q224 VanDerWaalsContact CB-O 3.27Å; F218-Q224 WeakPolarHBondContact CB-O 3.1Å
219	C	91.1	Very high	88.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	127.5	173	179.5	0	0	0	0	110.7	Y221 C222 L223 Q224 L226 H234	C219-Y221 VanDerWaalsContact C-N 3.25Å; C219-Y221 PolarHBondContact O-N 3.46Å; C219-C222 WeakPolarHBondContact CB-SG 3.33Å; C219-L223 WeakPolarHBondContact O-CA 3.37Å; C219-L223 PolarHBondContact O-N 3.12Å; C219-Q224 PolarHBondContact N-O 3.02Å; C219-Q224 VanDerWaalsContact N-O 3.09Å; C219-L226 HydrophobicContact CB-CD1 3.88Å; C219-L226 HydrophobicContact CB-CG 4.44Å; C219-H234 PolarHBondContact SG-NE2 3.41Å; C219-H234 VanDerWaalsContact SG-NE2 3.42Å
220	W	90.7	Very high	87.5	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.008	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-35.5	179.2	-176.9	-109.7	0	0	0	114	A188 K191 I200 R202 A207 M209 F218	A188-W220 WeakPolarHBondContact O-CZ2 3.44Å; K191-W220 HydrophobicContact CB-CE3 4.19Å; K191-W220 HydrophobicContact CB-CH2 3.62Å; K191-W220 HydrophobicContact CB-CZ2 4.21Å; K191-W220 HydrophobicContact CB-CZ3 3.59Å; K191-W220 HydrophobicContact CD-CD2 3.77Å; K191-W220 HydrophobicContact CD-CE3 3.87Å; K191-W220 HydrophobicContact CD-CG 4.48Å; K191-W220 HydrophobicContact CD-CH2 4.04Å; K191-W220 HydrophobicContact CD-CZ2 3.84Å; K191-W220 HydrophobicContact CD-CZ3 4.03Å; K191-W220 WeakPolarHBondContact CD-O 3.32Å; K191-W220 HydrophobicContact CG-CD2 4.47Å; K191-W220 HydrophobicContact CG-CE3 4.32Å; K191-W220 HydrophobicContact CG-CH2 3.65Å; K191-W220 HydrophobicContact CG-CZ2 3.71Å; K191-W220 HydrophobicContact CG-CZ3 3.95Å; I200-W220 HydrophobicContact CG2-CZ3 4.33Å; I200-W220 WeakPolarHBondContact O-CH2 3.39Å; R202-W220 HydrophobicContact CB-CD2 4.25Å; R202-W220 HydrophobicContact CB-CH2 3.67Å; R202-W220 HydrophobicContact CB-CZ2 3.41Å; R202-W220 VanDerWaalsContact CB-CZ2 3.41Å; R202-W220 HydrophobicContact CB-CZ3 4.25Å; R202-W220 HydrophobicContact CG-CZ2 4.41Å; R202-W220 VanDerWaalsContact NH1-CD1 3.33Å; A207-W220 WeakPolarHBondContact O-CB 3.45Å; A207-W220 PolarHBondContact O-N 3.38Å; M209-W220 HydrophobicContact CE-CE3 4.17Å; M209-W220 HydrophobicContact CE-CZ3 3.99Å; M209-W220 HydrophobicContact CG-CB 4.42Å; M209-W220 HydrophobicContact CG-CE3 4.36Å; M209-W220 HydrophobicContact SD-CB 4.11Å; M209-W220 HydrophobicContact SD-CD2 3.56Å; M209-W220 VanDerWaalsContact SD-CD2 3.56Å; M209-W220 HydrophobicContact SD-CE3 2.99Å; M209-W220 HydrophobicContact SD-CG 4.08Å; M209-W220 HydrophobicContact SD-CH2 4.3Å; M209-W220 HydrophobicContact SD-CZ3 3.42Å; M209-W220 WeakPolarHBondContact SD-CZ3 3.33Å; F218-W220 HydrophobicContact CE2-CE3 4.3Å
221	Y	88.2	Confident	87.1	Confident	58 Å²	58	56.8 Å²	56.8	23%	0.227	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-36.4	-172	-58.5	-69.4	0	0	0	113.7	I186 R202 A207 C219 K243	I186-Y221 HydrophobicContact CG2-CD1 3.62Å; I186-Y221 HydrophobicContact CG2-CE1 4Å; R202-Y221 PolarHBondContact NH1-OH 3.29Å; R202-Y221 PolarHBondContact NH2-OH 3.23Å; A207-Y221 HydrophobicContact CB-CD2 3.97Å; A207-Y221 HydrophobicContact CB-CE2 3.39Å; C219-Y221 VanDerWaalsContact C-N 3.25Å; C219-Y221 PolarHBondContact O-N 3.46Å; Y221-K243 HydrophobicContact CD2-CB 3.81Å; Y221-K243 HydrophobicContact CD2-CD 3.96Å; Y221-K243 HydrophobicContact CE2-CB 3.46Å; Y221-K243 VanDerWaalsContact CE2-CB 3.46Å; Y221-K243 HydrophobicContact CE2-CD 4.11Å; Y221-K243 HydrophobicContact CE2-CG 4.37Å; Y221-K243 WeakPolarHBondContact CE2-O 3.18Å; Y221-K243 HydrophobicContact CG-CD 4.22Å
222	C	88.2	Confident	87	Confident	48 Å²	48	58 Å²	58	32%	0.324	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-1.9	-175.2	71	0	0	0	0	113.7	C219 Q224 H234 C240	C219-C222 WeakPolarHBondContact CB-SG 3.33Å; C222-Q224 PolarHBondContact O-N 2.85Å; C222-H234 PolarHBondContact SG-CE1 2.95Å; C222-H234 PolarHBondContact SG-NE2 2.91Å; C222-C240 VanDerWaalsContact SG-SG 3.69Å
223	L	88.9	Confident	87.1	Confident	70 Å²	70	59.2 Å²	59.2	37%	0.366	29%	0.288	S	S	.	.			trans	57.3	15.4	179.8	-53.2	179.3	0	0	0	114.8	K191 P194 F218 C219	K191-L223 HydrophobicContact CD-CD2 4.33Å; P194-L223 HydrophobicContact CB-CB 4.4Å; F218-L223 HydrophobicContact CD2-CD2 3.93Å; F218-L223 HydrophobicContact CE2-CD2 3.88Å; C219-L223 WeakPolarHBondContact O-CA 3.37Å; C219-L223 PolarHBondContact O-N 3.12Å
224	Q	88.3	Confident	87.4	Confident	117 Å²	117	60.6 Å²	60.6	55%	0.547	29%	0.294	S	S	.	.			trans	-66.7	144.2	176.7	-81	-137.3	-31.8	0	0	112.3	F218 C219 C222 L226	F218-Q224 WeakPolarHBondContact CA-O 3.34Å; F218-Q224 VanDerWaalsContact CB-O 3.27Å; F218-Q224 WeakPolarHBondContact CB-O 3.1Å; C219-Q224 PolarHBondContact N-O 3.02Å; C219-Q224 VanDerWaalsContact N-O 3.09Å; C222-Q224 PolarHBondContact O-N 2.85Å; Q224-L226 PolarHBondContact O-N 2.85Å
225	N	89.4	Confident	87.6	Confident	93 Å²	93	59.7 Å²	59.7	50%	0.497	29%	0.287	S	S	.	.	B	Isolated β-bridge	trans	-62.9	123.4	171.5	-178.7	-34.2	0	0	0	110.6	H216 D227	H216-N225 PolarHBondContact CE1-ND2 3.18Å; N225-D227 PolarHBondContact ND2-OD2 3.09Å; N225-D227 VanDerWaalsContact ND2-OD2 3.16Å; N225-D227 WeakPolarHBondContact OD1-CB 3.41Å; N225-D227 PolarHBondContact OD1-N 2.86Å; N225-D227 PolarHBondContact OD1-OD2 3.45Å
226	L	90.8	Very high	87.7	Confident	7 Å²	7	58.1 Å²	58.1	4%	0.037	28%	0.284	C	S	.	.			trans	-122.2	18.1	178	-61.2	-174.9	0	0	0	112.8	Q208 T217 C219 Q224 N228 D229 H234 Y235	Q208-L226 HydrophobicContact CB-CD1 4.43Å; Q208-L226 HydrophobicContact CG-CD1 4.05Å; T217-L226 HydrophobicContact CG2-CB 4.13Å; T217-L226 CarbonylContact O-C 3.52Å; T217-L226 WeakPolarHBondContact O-CA 3.18Å; T217-L226 PolarHBondContact O-N 3.24Å; C219-L226 HydrophobicContact CB-CD1 3.88Å; C219-L226 HydrophobicContact CB-CG 4.44Å; Q224-L226 PolarHBondContact O-N 2.85Å; L226-N228 PolarHBondContact O-N 3.32Å; L226-N228 VanDerWaalsContact O-N 3.1Å; L226-D229 HydrophobicContact CB-CB 4.23Å; L226-D229 HydrophobicContact CD2-CB 4.01Å; L226-D229 PolarHBondContact O-N 2.85Å; L226-H234 HydrophobicContact CD1-CB 4.49Å; L226-H234 HydrophobicContact CD2-CB 3.59Å; L226-Y235 HydrophobicContact CD1-CE2 4.04Å
227	D	85.6	Confident	87.4	Confident	66 Å²	66	65.7 Å²	65.7	35%	0.353	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-34.8	-178.5	-69.6	-35.2	0	0	0	112.3	H216 T217 N225	H216-D227 WeakPolarHBondContact CA-OD1 3.38Å; H216-D227 IonicContact CE1-OD1 2.73Å; H216-D227 IonicContact CE1-OD2 2.72Å; H216-D227 PolarHBondContact CE1-OD2 3.49Å; H216-D227 IonicContact CG-OD1 3.65Å; H216-D227 IonicContact CG-OD2 3.78Å; H216-D227 VanDerWaalsContact ND1-CG 3.28Å; H216-D227 IonicContact ND1-OD1 3.75Å; H216-D227 PolarHBondContact ND1-OD1 2.92Å; H216-D227 VanDerWaalsContact ND1-OD1 3.16Å; H216-D227 IonicContact ND1-OD2 2.85Å; H216-D227 PolarHBondContact ND1-OD2 2.89Å; T217-D227 PolarHBondContact N-OD1 2.74Å; T217-D227 PolarHBondContact O-N 3.49Å; N225-D227 PolarHBondContact ND2-OD2 3.09Å; N225-D227 VanDerWaalsContact ND2-OD2 3.16Å; N225-D227 WeakPolarHBondContact OD1-CB 3.41Å; N225-D227 PolarHBondContact OD1-N 2.86Å; N225-D227 PolarHBondContact OD1-OD2 3.45Å
228	N	85.7	Confident	87.1	Confident	149 Å²	149	67.7 Å²	67.7	80%	0.797	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	0.3	-179.7	-62.8	-45.8	0	0	0	113.8	L226 I230	L226-N228 PolarHBondContact O-N 3.32Å; L226-N228 VanDerWaalsContact O-N 3.1Å; N228-I230 VanDerWaalsContact C-N 3.26Å; N228-I230 PolarHBondContact O-N 3.47Å; N228-I230 VanDerWaalsContact O-N 3.13Å
229	D	83.5	Confident	86.8	Confident	26 Å²	26	72.7 Å²	72.7	14%	0.139	37%	0.372	C	S	.	.			trans	-90.5	57.6	179.8	-168.2	20	0	0	0	112.1	L226 F231 L232 R233 H234	L226-D229 HydrophobicContact CB-CB 4.23Å; L226-D229 HydrophobicContact CD2-CB 4.01Å; L226-D229 PolarHBondContact O-N 2.85Å; D229-F231 PolarHBondContact O-N 3.43Å; D229-F231 VanDerWaalsContact O-N 3.09Å; D229-L232 PolarHBondContact O-N 3.43Å; D229-L232 PolarHBondContact OD1-N 3.48Å; D229-R233 VanDerWaalsContact CG-N 3.32Å; D229-R233 PolarHBondContact OD1-N 2.8Å; D229-R233 PolarHBondContact OD2-N 3.4Å; D229-H234 WeakPolarHBondContact OD2-CB 3.37Å; D229-H234 PolarHBondContact OD2-N 3.04Å
230	I	77.6	Confident	86.7	Confident	116 Å²	116	72.9 Å²	72.9	60%	0.595	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-25.8	178.4	-54.6	169.1	0	0	0	111.2	N228	N228-I230 VanDerWaalsContact C-N 3.26Å; N228-I230 PolarHBondContact O-N 3.47Å; N228-I230 VanDerWaalsContact O-N 3.13Å
231	F	82.1	Confident	86.6	Confident	134 Å²	134	80 Å²	80	59%	0.588	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	6.6	-178.2	-64.7	-68.4	0	0	0	113.7	D229 R233 R248	D229-F231 PolarHBondContact O-N 3.43Å; D229-F231 VanDerWaalsContact O-N 3.09Å; F231-R233 HydrophobicContact CB-CG 3.79Å; F231-R233 PolarHBondContact O-N 3.36Å; F231-R233 VanDerWaalsContact O-N 3.1Å; F231-R248 PolarHBondContact O-NH1 3.02Å; F231-R248 VanDerWaalsContact O-NH1 3.09Å; F231-R248 PolarHBondContact O-NH2 2.97Å
232	L	85.1	Confident	86.4	Confident	25 Å²	25	83.7 Å²	83.7	13%	0.131	42%	0.424	C	S	.	.			trans	57.7	26.1	175.4	-48.5	169.3	0	0	0	113.2	D229 H234 Y235 L244 R248	D229-L232 PolarHBondContact O-N 3.43Å; D229-L232 PolarHBondContact OD1-N 3.48Å; L232-H234 PolarHBondContact O-N 3.49Å; L232-Y235 HydrophobicContact CB-CD2 4.35Å; L232-Y235 PolarHBondContact O-N 2.91Å; L232-L244 HydrophobicContact CB-CD2 4.49Å; L232-L244 HydrophobicContact CD1-CD2 3.79Å; L232-L244 HydrophobicContact CD2-CD1 4.34Å; L232-R248 HydrophobicContact CD1-CG 4.19Å; L232-R248 PolarHBondContact O-NH1 3.31Å; L232-R248 VanDerWaalsContact O-NH1 3.12Å
233	R	86.8	Confident	86.3	Confident	175 Å²	175	85 Å²	85	66%	0.66	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-67	-24.8	-173.9	-64.4	178.3	71.3	-179.2	1.7	111.9	D229 F231 Y235 D236	D229-R233 VanDerWaalsContact CG-N 3.32Å; D229-R233 PolarHBondContact OD1-N 2.8Å; D229-R233 PolarHBondContact OD2-N 3.4Å; F231-R233 HydrophobicContact CB-CG 3.79Å; F231-R233 PolarHBondContact O-N 3.36Å; F231-R233 VanDerWaalsContact O-N 3.1Å; R233-Y235 PolarHBondContact O-N 3.25Å; R233-Y235 VanDerWaalsContact O-N 3.16Å; R233-D236 WeakPolarHBondContact O-CB 3.34Å; R233-D236 PolarHBondContact O-N 2.85Å; R233-D236 VanDerWaalsContact O-N 3.09Å
234	H	89.3	Confident	86.2	Confident	36 Å²	36	82 Å²	82	17%	0.167	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-52.1	-33.3	173	-178.4	82.1	0	0	0	112.5	C219 C222 L226 D229 L232 C240	C219-H234 PolarHBondContact SG-NE2 3.41Å; C219-H234 VanDerWaalsContact SG-NE2 3.42Å; C222-H234 PolarHBondContact SG-CE1 2.95Å; C222-H234 PolarHBondContact SG-NE2 2.91Å; L226-H234 HydrophobicContact CD1-CB 4.49Å; L226-H234 HydrophobicContact CD2-CB 3.59Å; D229-H234 WeakPolarHBondContact OD2-CB 3.37Å; D229-H234 PolarHBondContact OD2-N 3.04Å; L232-H234 PolarHBondContact O-N 3.49Å; H234-C240 VanDerWaalsContact NE2-CB 3.27Å; H234-C240 WeakPolarHBondContact NE2-CB 3.43Å; H234-C240 PolarHBondContact NE2-SG 2.8Å; H234-C240 VanDerWaalsContact NE2-SG 3.4Å
235	Y	88.8	Confident	85.8	Confident	5 Å²	5	79.1 Å²	79.1	2%	0.02	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-89.8	2.4	-176.8	-59.3	-84.1	0	0	0	114.3	A207 Q208 L226 L232 R233 C240 R241 N242 L244	A207-Y235 HydrophobicContact CB-CE1 3.91Å; A207-Y235 PolarHBondContact O-OH 2.85Å; Q208-Y235 WeakPolarHBondContact CA-OH 3.28Å; Q208-Y235 HydrophobicContact CB-CE2 4.17Å; Q208-Y235 PolarHBondContact N-OH 3.07Å; Q208-Y235 VanDerWaalsContact N-OH 3.11Å; L226-Y235 HydrophobicContact CD1-CE2 4.04Å; L232-Y235 HydrophobicContact CB-CD2 4.35Å; L232-Y235 PolarHBondContact O-N 2.91Å; R233-Y235 PolarHBondContact O-N 3.25Å; R233-Y235 VanDerWaalsContact O-N 3.16Å; Y235-C240 HydrophobicContact CD1-CB 4.42Å; Y235-C240 WeakPolarHBondContact CD1-O 3.28Å; Y235-R241 VanDerWaalsContact O-CA 3.28Å; Y235-R241 WeakPolarHBondContact O-CA 3.36Å; Y235-N242 PolarHBondContact O-N 3.09Å; Y235-L244 HydrophobicContact CD1-CB 3.89Å; Y235-L244 HydrophobicContact CD1-CD1 4.38Å; Y235-L244 HydrophobicContact CD2-CB 4.29Å; Y235-L244 HydrophobicContact CD2-CD1 3.7Å; Y235-L244 HydrophobicContact CD2-CG 4.43Å; Y235-L244 HydrophobicContact CE1-CB 4.33Å; Y235-L244 HydrophobicContact CE1-CD1 4.22Å; Y235-L244 HydrophobicContact CE2-CD1 3.52Å; Y235-L244 HydrophobicContact CG-CB 3.85Å; Y235-L244 HydrophobicContact CG-CD1 4.13Å; Y235-L244 HydrophobicContact CG-CG 4.48Å
236	D	87.1	Confident	85.1	Confident	69 Å²	69	78.1 Å²	78.1	37%	0.369	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-24.7	179.7	-63.9	-23.9	0	0	0	112.5	R233 R241 R248	R233-D236 WeakPolarHBondContact O-CB 3.34Å; R233-D236 PolarHBondContact O-N 2.85Å; R233-D236 VanDerWaalsContact O-N 3.09Å; D236-R241 WeakPolarHBondContact O-CD 3.46Å; D236-R248 IonicContact OD1-CZ 3.16Å; D236-R248 IonicContact OD1-NH1 3.85Å; D236-R248 PolarHBondContact OD1-NH1 2.85Å; D236-R248 IonicContact OD2-CZ 3.49Å; D236-R248 IonicContact OD2-NH1 4Å; D236-R248 PolarHBondContact OD2-NH1 2.89Å
237	K	84.4	Confident	84.1	Confident	170 Å²	170	81.3 Å²	81.3	74%	0.739	43%	0.426	S	S	*	.	S	Bend	trans	-145.1	168.2	-172.2	-61.4	-174.3	-176.5	-177.4	0	111.5
238	G	85.8	Confident	83.2	Confident	55 Å²	55	81.6 Å²	81.6	57%	0.567	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	70.6	-162.1	174.5	0	0	0	0	0	114.2	C240 R241	G238-C240 PolarHBondContact O-N 3.12Å; G238-R241 VanDerWaalsContact O-CB 3.31Å; G238-R241 WeakPolarHBondContact O-CB 3.35Å; G238-R241 PolarHBondContact O-N 2.88Å
239	P	86.1	Confident	82.3	Confident	106 Å²	106	77.5 Å²	77.5	69%	0.688	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-70.4	-15.9	-169.5	27.7	-35.4	0	0	0	114.6	K243	P239-K243 WeakPolarHBondContact O-CE 2.93Å; P239-K243 PolarHBondContact O-NZ 3.17Å; P239-K243 VanDerWaalsContact O-NZ 3.17Å
240	C	88.8	Confident	81.6	Confident	4 Å²	4	79.2 Å²	79.2	3%	0.027	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-101.4	8	177.8	-63.2	0	0	0	0	113.3	C222 H234 Y235 G238 N242 K243	C222-C240 VanDerWaalsContact SG-SG 3.69Å; H234-C240 VanDerWaalsContact NE2-CB 3.27Å; H234-C240 WeakPolarHBondContact NE2-CB 3.43Å; H234-C240 PolarHBondContact NE2-SG 2.8Å; H234-C240 VanDerWaalsContact NE2-SG 3.4Å; Y235-C240 HydrophobicContact CD1-CB 4.42Å; Y235-C240 WeakPolarHBondContact CD1-O 3.28Å; G238-C240 PolarHBondContact O-N 3.12Å; C240-N242 PolarHBondContact O-N 3.43Å; C240-K243 WeakPolarHBondContact O-CB 3.25Å; C240-K243 PolarHBondContact O-N 2.69Å; C240-K243 VanDerWaalsContact O-N 3.11Å
241	R	87.8	Confident	81.1	Confident	152 Å²	152	76.4 Å²	76.4	57%	0.574	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	132.8	179.8	-177.1	177.2	177.3	-160.5	-0.9	111.5	Y235 D236 G238 K243	Y235-R241 VanDerWaalsContact O-CA 3.28Å; Y235-R241 WeakPolarHBondContact O-CA 3.36Å; D236-R241 WeakPolarHBondContact O-CD 3.46Å; G238-R241 VanDerWaalsContact O-CB 3.31Å; G238-R241 WeakPolarHBondContact O-CB 3.35Å; G238-R241 PolarHBondContact O-N 2.88Å; R241-K243 PolarHBondContact O-N 2.67Å; R241-K243 VanDerWaalsContact O-N 3.16Å
242	N	84.9	Confident	80.5	Confident	134 Å²	134	75.9 Å²	75.9	72%	0.717	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	10.6	-179.6	-56.9	-33.1	0	0	0	115.7	Y235 C240	Y235-N242 PolarHBondContact O-N 3.09Å; C240-N242 PolarHBondContact O-N 3.43Å
243	K	86.4	Confident	80	Confident	77 Å²	77	83.7 Å²	83.7	34%	0.335	44%	0.439	S	S	.	.			trans	-90.8	7.1	-179	-60.8	-169.4	177.5	167.2	0	114.6	A207 Y221 P239 C240 R241 G245	A207-K243 WeakPolarHBondContact CB-O 3.26Å; Y221-K243 HydrophobicContact CD2-CB 3.81Å; Y221-K243 HydrophobicContact CD2-CD 3.96Å; Y221-K243 HydrophobicContact CE2-CB 3.46Å; Y221-K243 VanDerWaalsContact CE2-CB 3.46Å; Y221-K243 HydrophobicContact CE2-CD 4.11Å; Y221-K243 HydrophobicContact CE2-CG 4.37Å; Y221-K243 WeakPolarHBondContact CE2-O 3.18Å; Y221-K243 HydrophobicContact CG-CD 4.22Å; P239-K243 WeakPolarHBondContact O-CE 2.93Å; P239-K243 PolarHBondContact O-NZ 3.17Å; P239-K243 VanDerWaalsContact O-NZ 3.17Å; C240-K243 WeakPolarHBondContact O-CB 3.25Å; C240-K243 PolarHBondContact O-N 2.69Å; C240-K243 VanDerWaalsContact O-N 3.11Å; R241-K243 PolarHBondContact O-N 2.67Å; R241-K243 VanDerWaalsContact O-N 3.16Å; K243-G245 PolarHBondContact O-N 2.91Å
244	L	85.5	Confident	79.4	Confident	6 Å²	6	80 Å²	80	3%	0.031	43%	0.433	C	S	.	.	S	Bend	trans	-61.1	-29.8	-176.1	-176.1	64.2	0	0	0	113.4	C206 A207 Q208 L232 Y235 H246 R248	C206-L244 CarbonylContact C-O 3.48Å; C206-L244 VanDerWaalsContact CA-O 3.24Å; C206-L244 WeakPolarHBondContact CA-O 3.35Å; C206-L244 VanDerWaalsContact SG-CD1 3.57Å; A207-L244 PolarHBondContact N-O 3.28Å; Q208-L244 HydrophobicContact CB-CD1 4.21Å; L232-L244 HydrophobicContact CB-CD2 4.49Å; L232-L244 HydrophobicContact CD1-CD2 3.79Å; L232-L244 HydrophobicContact CD2-CD1 4.34Å; Y235-L244 HydrophobicContact CD1-CB 3.89Å; Y235-L244 HydrophobicContact CD1-CD1 4.38Å; Y235-L244 HydrophobicContact CD2-CB 4.29Å; Y235-L244 HydrophobicContact CD2-CD1 3.7Å; Y235-L244 HydrophobicContact CD2-CG 4.43Å; Y235-L244 HydrophobicContact CE1-CB 4.33Å; Y235-L244 HydrophobicContact CE1-CD1 4.22Å; Y235-L244 HydrophobicContact CE2-CD1 3.52Å; Y235-L244 HydrophobicContact CG-CB 3.85Å; Y235-L244 HydrophobicContact CG-CD1 4.13Å; Y235-L244 HydrophobicContact CG-CG 4.48Å; L244-H246 VanDerWaalsContact CD2-CE1 3.41Å; L244-H246 WeakPolarHBondContact CD2-CE1 3.43Å; L244-R248 HydrophobicContact CD2-CG 4.12Å
245	G	79.7	Confident	79	Confident	57 Å²	57	85.9 Å²	85.9	59%	0.588	45%	0.453	S	S	*	.	S	Bend	trans	90.9	-5.4	-179.3	0	0	0	0	0	115	K243	K243-G245 PolarHBondContact O-N 2.91Å
246	H	75.3	Confident	78.8	Confident	71 Å²	71	90.4 Å²	90.4	33%	0.329	48%	0.482	S	S	.	.	S	Bend	trans	-147.9	159.1	169	63.9	76.7	0	0	0	111.3	L244	L244-H246 VanDerWaalsContact CD2-CE1 3.41Å; L244-H246 WeakPolarHBondContact CD2-CE1 3.43Å
247	S	70.1	Confident	78.8	Confident	75 Å²	75	91.6 Å²	91.6	52%	0.524	49%	0.485	S	S	.	.			trans	-72.7	129.6	176.5	-179.9	0	0	0	0	110.9	A249 S250	S247-A249 PolarHBondContact O-N 3.17Å; S247-A249 WeakPolarHBondContact OG-CB 3.38Å; S247-A249 PolarHBondContact OG-N 3.42Å; S247-S250 WeakPolarHBondContact O-CB 3.41Å; S247-S250 PolarHBondContact O-N 3.16Å; S247-S250 VanDerWaalsContact O-N 3.09Å; S247-S250 PolarHBondContact O-OG 2.72Å
248	R	67.4	Low	79.1	Confident	71 Å²	71	87 Å²	87	27%	0.268	47%	0.471	S	S	.	.	H	α-helix	trans	-58.8	-29.2	172.5	-71.1	176.8	58.2	151.2	3.1	112.7	F231 L232 D236 L244 S250 V251 M252	F231-R248 PolarHBondContact O-NH1 3.02Å; F231-R248 VanDerWaalsContact O-NH1 3.09Å; F231-R248 PolarHBondContact O-NH2 2.97Å; L232-R248 HydrophobicContact CD1-CG 4.19Å; L232-R248 PolarHBondContact O-NH1 3.31Å; L232-R248 VanDerWaalsContact O-NH1 3.12Å; D236-R248 IonicContact OD1-CZ 3.16Å; D236-R248 IonicContact OD1-NH1 3.85Å; D236-R248 PolarHBondContact OD1-NH1 2.85Å; D236-R248 IonicContact OD2-CZ 3.49Å; D236-R248 IonicContact OD2-NH1 4Å; D236-R248 PolarHBondContact OD2-NH1 2.89Å; L244-R248 HydrophobicContact CD2-CG 4.12Å; R248-S250 PolarHBondContact O-N 2.76Å; R248-V251 PolarHBondContact O-N 3.11Å; R248-V251 VanDerWaalsContact O-N 3.16Å; R248-M252 PolarHBondContact O-N 3.43Å
249	A	65.9	Low	79.3	Confident	63 Å²	63	88.6 Å²	88.6	52%	0.521	47%	0.47	S	S	.	.	H	α-helix	trans	-59.2	-35.3	176.7	0	0	0	0	0	111.4	S247 W253	S247-A249 PolarHBondContact O-N 3.17Å; S247-A249 WeakPolarHBondContact OG-CB 3.38Å; S247-A249 PolarHBondContact OG-N 3.42Å; A249-W253 WeakPolarHBondContact O-CA 3.41Å; A249-W253 WeakPolarHBondContact O-CB 3.38Å; A249-W253 PolarHBondContact O-N 2.87Å
250	S	68	Low	79.6	Confident	63 Å²	63	85.6 Å²	85.6	44%	0.441	46%	0.458	S	S	.	.	H	α-helix	trans	-64.7	-41.1	176.8	68.8	0	0	0	0	112.4	S247 R248 N254	S247-S250 WeakPolarHBondContact O-CB 3.41Å; S247-S250 PolarHBondContact O-N 3.16Å; S247-S250 VanDerWaalsContact O-N 3.09Å; S247-S250 PolarHBondContact O-OG 2.72Å; R248-S250 PolarHBondContact O-N 2.76Å; S250-N254 VanDerWaalsContact O-CB 3.25Å; S250-N254 WeakPolarHBondContact O-CB 3.29Å; S250-N254 PolarHBondContact O-N 3.31Å
251	V	67.9	Low	79.9	Confident	57 Å²	57	89.6 Å²	89.6	35%	0.345	48%	0.478	S	S	.	.	H	α-helix	trans	-69.8	-44.3	178.9	-179.3	0	0	0	0	111.1	R248 N254 R255	R248-V251 PolarHBondContact O-N 3.11Å; R248-V251 VanDerWaalsContact O-N 3.16Å; V251-N254 PolarHBondContact O-N 2.93Å; V251-R255 WeakPolarHBondContact O-CG 3.21Å; V251-R255 PolarHBondContact O-N 3.01Å
252	M	70.1	Confident	80.2	Confident	122 Å²	122	87.8 Å²	87.8	60%	0.601	48%	0.479	S	S	*	.	H	α-helix	trans	-66.4	-42.1	176.4	-69.1	-165.4	74	0	0	111.8	R248 R255 T256	R248-M252 PolarHBondContact O-N 3.43Å; M252-R255 PolarHBondContact O-N 2.99Å; M252-T256 PolarHBondContact O-N 2.62Å; M252-T256 PolarHBondContact O-OG1 3.19Å
253	W	73.4	Confident	80.6	Confident	189 Å²	189	85.4 Å²	85.4	72%	0.716	47%	0.469	S	S	*	.	H	α-helix	trans	-59.8	-47.4	175.4	-174.1	-89.5	0	0	0	111.1	A249 R255 T256 Q257	A249-W253 WeakPolarHBondContact O-CA 3.41Å; A249-W253 WeakPolarHBondContact O-CB 3.38Å; A249-W253 PolarHBondContact O-N 2.87Å; W253-R255 PolarHBondContact O-N 3.26Å; W253-T256 PolarHBondContact O-N 3.03Å; W253-Q257 WeakPolarHBondContact O-CB 3.4Å; W253-Q257 PolarHBondContact O-N 3.16Å
254	N	74.9	Confident	81	Confident	97 Å²	97	83 Å²	83	52%	0.519	47%	0.467	S	S	.	.	H	α-helix	trans	-63.3	-41	179.5	-153.7	32.1	0	0	0	111.6	S250 V251 Q257 V258	S250-N254 VanDerWaalsContact O-CB 3.25Å; S250-N254 WeakPolarHBondContact O-CB 3.29Å; S250-N254 PolarHBondContact O-N 3.31Å; V251-N254 PolarHBondContact O-N 2.93Å; N254-Q257 PolarHBondContact O-N 2.79Å; N254-V258 VanDerWaalsContact O-CG2 3.26Å; N254-V258 WeakPolarHBondContact O-CG2 3.37Å; N254-V258 PolarHBondContact O-N 2.99Å
255	R	80.3	Confident	81.4	Confident	160 Å²	160	87.8 Å²	87.8	60%	0.604	49%	0.492	S	S	*	.	H	α-helix	trans	-61.9	-48.9	174.3	-78.7	-178.2	135.5	175.8	-3.3	112.4	V251 M252 W253 Q257 V258 V259	V251-R255 WeakPolarHBondContact O-CG 3.21Å; V251-R255 PolarHBondContact O-N 3.01Å; M252-R255 PolarHBondContact O-N 2.99Å; W253-R255 PolarHBondContact O-N 3.26Å; R255-Q257 VanDerWaalsContact C-N 3.31Å; R255-Q257 PolarHBondContact O-N 3.21Å; R255-V258 PolarHBondContact O-N 3.24Å; R255-V259 WeakPolarHBondContact O-CG2 3.42Å; R255-V259 PolarHBondContact O-N 3.5Å; R255-V259 VanDerWaalsContact O-N 3.09Å
256	T	85.4	Confident	82.1	Confident	100 Å²	100	86.7 Å²	86.7	61%	0.613	48%	0.481	S	S	*	.	H	α-helix	trans	-65.4	-37.2	178.8	-54.1	0	0	0	0	111.5	M252 W253 V259 G260	M252-T256 PolarHBondContact O-N 2.62Å; M252-T256 PolarHBondContact O-OG1 3.19Å; W253-T256 PolarHBondContact O-N 3.03Å; T256-V259 PolarHBondContact O-N 3.33Å; T256-G260 PolarHBondContact O-N 2.79Å
257	Q	86.7	Confident	83	Confident	95 Å²	95	88 Å²	88	44%	0.444	49%	0.489	S	S	.	.	H	α-helix	trans	-64	-45.9	176.6	-175.9	-179.9	-5.7	0	0	111.5	W253 N254 R255 G260 I261	W253-Q257 WeakPolarHBondContact O-CB 3.4Å; W253-Q257 PolarHBondContact O-N 3.16Å; N254-Q257 PolarHBondContact O-N 2.79Å; R255-Q257 VanDerWaalsContact C-N 3.31Å; R255-Q257 PolarHBondContact O-N 3.21Å; Q257-G260 PolarHBondContact O-N 3.2Å; Q257-I261 HydrophobicContact CG-CD1 4.02Å; Q257-I261 VanDerWaalsContact O-CG1 3.28Å; Q257-I261 WeakPolarHBondContact O-CG1 3.5Å; Q257-I261 PolarHBondContact O-N 3.06Å
258	V	90.6	Very high	84.2	Confident	73 Å²	73	89.2 Å²	89.2	44%	0.442	49%	0.488	S	S	.	.	H	α-helix	trans	-62.3	-46	177.4	170.9	0	0	0	0	111.1	N254 R255 G260 I261 L262	N254-V258 VanDerWaalsContact O-CG2 3.26Å; N254-V258 WeakPolarHBondContact O-CG2 3.37Å; N254-V258 PolarHBondContact O-N 2.99Å; R255-V258 PolarHBondContact O-N 3.24Å; V258-G260 VanDerWaalsContact C-N 3.31Å; V258-G260 PolarHBondContact O-N 3.09Å; V258-I261 PolarHBondContact O-N 2.86Å; V258-L262 HydrophobicContact CG1-CD1 4.12Å; V258-L262 WeakPolarHBondContact O-CG 3.16Å; V258-L262 PolarHBondContact O-N 2.97Å
259	V	90.4	Very high	85.3	Confident	89 Å²	89	88.4 Å²	88.4	54%	0.539	50%	0.497	S	S	.	.	H	α-helix	trans	-60.1	-44.4	175.5	174.2	0	0	0	0	110.5	R255 T256 I261 L262 V263	R255-V259 WeakPolarHBondContact O-CG2 3.42Å; R255-V259 PolarHBondContact O-N 3.5Å; R255-V259 VanDerWaalsContact O-N 3.09Å; T256-V259 PolarHBondContact O-N 3.33Å; V259-I261 PolarHBondContact O-N 3.47Å; V259-L262 PolarHBondContact O-N 3.09Å; V259-V263 HydrophobicContact CG1-CG2 4.28Å; V259-V263 WeakPolarHBondContact O-CB 3.25Å; V259-V263 VanDerWaalsContact O-CG2 3.28Å; V259-V263 WeakPolarHBondContact O-CG2 3.42Å; V259-V263 PolarHBondContact O-N 3.45Å
260	G	92.6	Very high	86.6	Confident	42 Å²	42	91.8 Å²	91.8	43%	0.433	51%	0.505	S	S	.	.	H	α-helix	trans	-60	-41.9	176.6	0	0	0	0	0	113.1	T256 Q257 V258 G264	T256-G260 PolarHBondContact O-N 2.79Å; Q257-G260 PolarHBondContact O-N 3.2Å; V258-G260 VanDerWaalsContact C-N 3.31Å; V258-G260 PolarHBondContact O-N 3.09Å; G260-G264 PolarHBondContact O-N 3.33Å
261	I	94.6	Very high	87.8	Confident	89 Å²	89	92.8 Å²	92.8	46%	0.456	51%	0.509	S	S	.	.	H	α-helix	trans	-63.9	-47	176	-70	165.2	0	0	0	110.6	Q257 V258 V259 G264 L265	Q257-I261 HydrophobicContact CG-CD1 4.02Å; Q257-I261 VanDerWaalsContact O-CG1 3.28Å; Q257-I261 WeakPolarHBondContact O-CG1 3.5Å; Q257-I261 PolarHBondContact O-N 3.06Å; V258-I261 PolarHBondContact O-N 2.86Å; V259-I261 PolarHBondContact O-N 3.47Å; I261-G264 PolarHBondContact O-N 3.35Å; I261-L265 HydrophobicContact CG2-CD1 3.92Å; I261-L265 HydrophobicContact CG2-CG 4.32Å; I261-L265 WeakPolarHBondContact O-CB 3.35Å; I261-L265 VanDerWaalsContact O-CG 3.32Å; I261-L265 WeakPolarHBondContact O-CG 3.41Å; I261-L265 PolarHBondContact O-N 3.49Å
262	L	93.3	Very high	88.7	Confident	113 Å²	113	93 Å²	93	59%	0.592	51%	0.51	S	S	*	.	H	α-helix	trans	-63.2	-44.1	179.9	-70.6	173	0	0	0	112	V258 V259 L265 G266	V258-L262 HydrophobicContact CG1-CD1 4.12Å; V258-L262 WeakPolarHBondContact O-CG 3.16Å; V258-L262 PolarHBondContact O-N 2.97Å; V259-L262 PolarHBondContact O-N 3.09Å; L262-L265 PolarHBondContact O-N 3.47Å; L262-G266 PolarHBondContact O-N 3.02Å
263	V	94.4	Very high	89.6	Confident	84 Å²	84	90.1 Å²	90.1	51%	0.509	50%	0.502	S	S	.	.	H	α-helix	trans	-62.7	-45.1	174.9	172.1	0	0	0	0	110.5	V259 G266 I267	V259-V263 HydrophobicContact CG1-CG2 4.28Å; V259-V263 WeakPolarHBondContact O-CB 3.25Å; V259-V263 VanDerWaalsContact O-CG2 3.28Å; V259-V263 WeakPolarHBondContact O-CG2 3.42Å; V259-V263 PolarHBondContact O-N 3.45Å; V263-G266 PolarHBondContact O-N 3.16Å; V263-I267 HydrophobicContact CG1-CD1 3.92Å; V263-I267 WeakPolarHBondContact O-CG1 3.48Å; V263-I267 PolarHBondContact O-N 2.89Å
264	G	94.4	Very high	90.4	Very high	28 Å²	28	84.4 Å²	84.4	29%	0.289	49%	0.49	S	S	.	.	H	α-helix	trans	-59.9	-47.5	177.8	0	0	0	0	0	112.7	G260 I261 G266 I267 I268	G260-G264 PolarHBondContact O-N 3.33Å; I261-G264 PolarHBondContact O-N 3.35Å; G264-G266 VanDerWaalsContact C-N 3.32Å; G264-G266 PolarHBondContact O-N 3.34Å; G264-I267 PolarHBondContact O-N 3.22Å; G264-I268 VanDerWaalsContact O-CG1 3.27Å; G264-I268 WeakPolarHBondContact O-CG1 3.41Å; G264-I268 PolarHBondContact O-N 3.1Å
265	L	94.7	Very high	90.9	Very high	106 Å²	106	85.2 Å²	85.2	56%	0.555	49%	0.493	S	S	*	.	H	α-helix	trans	-62	-39.6	175.3	-71	175.6	0	0	0	111.8	I261 L262 I268 A269	I261-L265 HydrophobicContact CG2-CD1 3.92Å; I261-L265 HydrophobicContact CG2-CG 4.32Å; I261-L265 WeakPolarHBondContact O-CB 3.35Å; I261-L265 VanDerWaalsContact O-CG 3.32Å; I261-L265 WeakPolarHBondContact O-CG 3.41Å; I261-L265 PolarHBondContact O-N 3.49Å; L262-L265 PolarHBondContact O-N 3.47Å; L265-I268 PolarHBondContact O-N 3.29Å; L265-A269 WeakPolarHBondContact O-CB 3.17Å; L265-A269 PolarHBondContact O-N 3.12Å
266	G	93.8	Very high	91.1	Very high	34 Å²	34	82.9 Å²	82.9	35%	0.351	49%	0.492	S	S	.	.	H	α-helix	trans	-61.2	-44.6	174.8	0	0	0	0	0	112.8	L262 V263 G264 A269 L270	L262-G266 PolarHBondContact O-N 3.02Å; V263-G266 PolarHBondContact O-N 3.16Å; G264-G266 VanDerWaalsContact C-N 3.32Å; G264-G266 PolarHBondContact O-N 3.34Å; G266-A269 PolarHBondContact O-N 3.41Å; G266-L270 WeakPolarHBondContact O-CB 3.24Å; G266-L270 PolarHBondContact O-N 3.09Å
267	I	94.4	Very high	91.2	Very high	98 Å²	98	84 Å²	84	50%	0.503	49%	0.493	S	S	.	.	H	α-helix	trans	-64.2	-45.4	176.2	-66.7	167.7	0	0	0	110.5	V263 G264 A269 L270 V271	V263-I267 HydrophobicContact CG1-CD1 3.92Å; V263-I267 WeakPolarHBondContact O-CG1 3.48Å; V263-I267 PolarHBondContact O-N 2.89Å; G264-I267 PolarHBondContact O-N 3.22Å; I267-A269 VanDerWaalsContact C-N 3.33Å; I267-A269 PolarHBondContact O-N 2.78Å; I267-L270 PolarHBondContact O-N 3.47Å; I267-V271 HydrophobicContact CG2-CG2 4.32Å; I267-V271 WeakPolarHBondContact O-CG2 3.41Å; I267-V271 PolarHBondContact O-N 3.13Å
268	I	94	Very high	91.3	Very high	101 Å²	101	84.9 Å²	84.9	52%	0.518	51%	0.505	S	S	.	.	H	α-helix	trans	-59.2	-46.7	178	-68.6	165.2	0	0	0	110.1	G264 L265 L270 V271 T272	G264-I268 VanDerWaalsContact O-CG1 3.27Å; G264-I268 WeakPolarHBondContact O-CG1 3.41Å; G264-I268 PolarHBondContact O-N 3.1Å; L265-I268 PolarHBondContact O-N 3.29Å; I268-L270 PolarHBondContact O-N 3Å; I268-V271 PolarHBondContact O-N 3Å; I268-T272 HydrophobicContact CG2-CG2 3.92Å; I268-T272 VanDerWaalsContact O-CB 3.29Å; I268-T272 WeakPolarHBondContact O-CB 3.47Å; I268-T272 VanDerWaalsContact O-CG2 3.25Å; I268-T272 WeakPolarHBondContact O-CG2 3.12Å; I268-T272 PolarHBondContact O-N 3.23Å; I268-T272 PolarHBondContact O-OG1 3.18Å
269	A	91.8	Very high	91.1	Very high	54 Å²	54	83.1 Å²	83.1	45%	0.446	50%	0.499	S	S	.	.	H	α-helix	trans	-61.4	-42.4	177.6	0	0	0	0	0	112.2	L265 G266 I267 V271 T272 S273	L265-A269 WeakPolarHBondContact O-CB 3.17Å; L265-A269 PolarHBondContact O-N 3.12Å; G266-A269 PolarHBondContact O-N 3.41Å; I267-A269 VanDerWaalsContact C-N 3.33Å; I267-A269 PolarHBondContact O-N 2.78Å; A269-V271 VanDerWaalsContact C-N 3.34Å; A269-V271 PolarHBondContact O-N 2.82Å; A269-T272 PolarHBondContact O-OG1 3.1Å; A269-S273 WeakPolarHBondContact O-CB 3.49Å; A269-S273 PolarHBondContact O-N 3.09Å
270	L	93.1	Very high	90.8	Very high	133 Å²	133	81.2 Å²	81.2	70%	0.696	49%	0.489	S	S	*	.	H	α-helix	trans	-63.3	-35.8	177	-95	164.2	0	0	0	113.4	G266 I267 I268 P274	G266-L270 WeakPolarHBondContact O-CB 3.24Å; G266-L270 PolarHBondContact O-N 3.09Å; I267-L270 PolarHBondContact O-N 3.47Å; I268-L270 PolarHBondContact O-N 3Å; L270-P274 WeakPolarHBondContact O-CD 3.31Å; L270-P274 VanDerWaalsContact O-CG 3.31Å; L270-P274 WeakPolarHBondContact O-CG 3.26Å
271	V	92.4	Very high	90.4	Very high	84 Å²	84	82.9 Å²	82.9	51%	0.509	49%	0.492	S	S	.	.	H	α-helix	trans	-85.1	-40.2	-179.1	175.7	0	0	0	0	111.8	I267 I268 A269 P274 L275	I267-V271 HydrophobicContact CG2-CG2 4.32Å; I267-V271 WeakPolarHBondContact O-CG2 3.41Å; I267-V271 PolarHBondContact O-N 3.13Å; I268-V271 PolarHBondContact O-N 3Å; A269-V271 VanDerWaalsContact C-N 3.34Å; A269-V271 PolarHBondContact O-N 2.82Å; V271-P274 WeakPolarHBondContact O-CD 3.47Å; V271-L275 HydrophobicContact CG1-CD1 4.22Å; V271-L275 WeakPolarHBondContact O-CG 3.46Å
272	T	87.9	Confident	89.8	Confident	61 Å²	61	82.7 Å²	82.7	37%	0.374	50%	0.498	S	S	.	.	H	α-helix	trans	-73.2	-32.8	-178.2	54.5	0	0	0	0	112.5	I268 A269 L275 L276	I268-T272 HydrophobicContact CG2-CG2 3.92Å; I268-T272 VanDerWaalsContact O-CB 3.29Å; I268-T272 WeakPolarHBondContact O-CB 3.47Å; I268-T272 VanDerWaalsContact O-CG2 3.25Å; I268-T272 WeakPolarHBondContact O-CG2 3.12Å; I268-T272 PolarHBondContact O-N 3.23Å; I268-T272 PolarHBondContact O-OG1 3.18Å; A269-T272 PolarHBondContact O-OG1 3.1Å; T272-L275 PolarHBondContact O-N 2.85Å; T272-L276 WeakPolarHBondContact O-CB 3.02Å; T272-L276 VanDerWaalsContact O-CG 3.32Å; T272-L276 WeakPolarHBondContact O-CG 3.42Å; T272-L276 PolarHBondContact O-N 3.05Å
273	S	88.9	Confident	89.3	Confident	63 Å²	63	81.3 Å²	81.3	44%	0.441	49%	0.49	S	S	.	.	H	α-helix	trans	-59.8	-50	-179.8	175.9	0	0	0	0	113.2	A269 L275 L276 L277	A269-S273 WeakPolarHBondContact O-CB 3.49Å; A269-S273 PolarHBondContact O-N 3.09Å; S273-L275 PolarHBondContact O-N 2.69Å; S273-L276 PolarHBondContact O-N 3.09Å; S273-L277 WeakPolarHBondContact O-CG 3.27Å; S273-L277 PolarHBondContact O-N 2.73Å
274	P	89.7	Confident	88.8	Confident	69 Å²	69	81.7 Å²	81.7	45%	0.448	49%	0.488	S	S	.	.	H	α-helix	trans	-60.5	-40.6	173.5	-24.5	32.9	0	0	0	113.8	L270 V271 L277 V278	L270-P274 WeakPolarHBondContact O-CD 3.31Å; L270-P274 VanDerWaalsContact O-CG 3.31Å; L270-P274 WeakPolarHBondContact O-CG 3.26Å; V271-P274 WeakPolarHBondContact O-CD 3.47Å; P274-L277 PolarHBondContact O-N 2.73Å; P274-V278 WeakPolarHBondContact O-CG2 3.35Å; P274-V278 PolarHBondContact O-N 3.18Å
275	L	86.4	Confident	88	Confident	113 Å²	113	84 Å²	84	59%	0.592	50%	0.499	S	S	*	.	H	α-helix	trans	-65.8	-40.5	-179.9	-68.4	172.8	0	0	0	111.7	V271 T272 S273 V278 A279	V271-L275 HydrophobicContact CG1-CD1 4.22Å; V271-L275 WeakPolarHBondContact O-CG 3.46Å; T272-L275 PolarHBondContact O-N 2.85Å; S273-L275 PolarHBondContact O-N 2.69Å; L275-V278 PolarHBondContact O-N 3.45Å; L275-A279 VanDerWaalsContact O-CB 3.26Å; L275-A279 WeakPolarHBondContact O-CB 3.14Å; L275-A279 PolarHBondContact O-N 3.16Å
276	L	83.9	Confident	87.2	Confident	111 Å²	111	83 Å²	83	58%	0.581	50%	0.501	S	S	*	.	H	α-helix	trans	-66.9	-39.7	175.1	-72.8	172.1	0	0	0	111.8	T272 S273 V278 A279 S280	T272-L276 WeakPolarHBondContact O-CB 3.02Å; T272-L276 VanDerWaalsContact O-CG 3.32Å; T272-L276 WeakPolarHBondContact O-CG 3.42Å; T272-L276 PolarHBondContact O-N 3.05Å; S273-L276 PolarHBondContact O-N 3.09Å; L276-V278 PolarHBondContact O-N 3.12Å; L276-A279 PolarHBondContact O-N 3.17Å; L276-S280 WeakPolarHBondContact O-CA 3.17Å; L276-S280 VanDerWaalsContact O-CB 3.28Å; L276-S280 WeakPolarHBondContact O-CB 3.47Å; L276-S280 PolarHBondContact O-N 3.33Å
277	L	86.6	Confident	86.4	Confident	123 Å²	123	86.1 Å²	86.1	64%	0.644	51%	0.508	S	S	*	.	H	α-helix	trans	-62.7	-40.9	175.4	-72.7	172	0	0	0	112	S273 P274 S280 P281	S273-L277 WeakPolarHBondContact O-CG 3.27Å; S273-L277 PolarHBondContact O-N 2.73Å; P274-L277 PolarHBondContact O-N 2.73Å; L277-S280 WeakPolarHBondContact O-CB 3.42Å; L277-P281 WeakPolarHBondContact O-CD 3.33Å
278	V	89.7	Confident	85.3	Confident	115 Å²	115	84.8 Å²	84.8	70%	0.697	51%	0.507	S	S	*	.	H	α-helix	trans	-71.7	-35.7	176.8	174.7	0	0	0	0	112	P274 L275 L276 P281	P274-V278 WeakPolarHBondContact O-CG2 3.35Å; P274-V278 PolarHBondContact O-N 3.18Å; L275-V278 PolarHBondContact O-N 3.45Å; L276-V278 PolarHBondContact O-N 3.12Å; V278-P281 WeakPolarHBondContact O-CD 3.45Å
279	A	85.1	Confident	84.3	Confident	36 Å²	36	87.6 Å²	87.6	30%	0.298	52%	0.515	S	S	.	.	H	α-helix	trans	-78.1	-20.4	177.6	0	0	0	0	0	113.1	L275 L276 C282 I283	L275-A279 VanDerWaalsContact O-CB 3.26Å; L275-A279 WeakPolarHBondContact O-CB 3.14Å; L275-A279 PolarHBondContact O-N 3.16Å; L276-A279 PolarHBondContact O-N 3.17Å; A279-C282 WeakPolarHBondContact O-CB 3.41Å; A279-C282 PolarHBondContact O-N 3.14Å; A279-C282 VanDerWaalsContact O-N 3.09Å; A279-I283 HydrophobicContact CB-CD1 3.79Å; A279-I283 HydrophobicContact CB-CG1 4.37Å; A279-I283 VanDerWaalsContact O-CG1 3.3Å; A279-I283 WeakPolarHBondContact O-CG1 3.45Å; A279-I283 PolarHBondContact O-N 3.45Å
280	S	84.6	Confident	83	Confident	49 Å²	49	88.2 Å²	88.2	34%	0.343	52%	0.516	S	S	.	.	H	α-helix	trans	-53.6	-47.2	-175.1	-176.1	0	0	0	0	113.7	L276 L277 C282 I283 I284	L276-S280 WeakPolarHBondContact O-CA 3.17Å; L276-S280 VanDerWaalsContact O-CB 3.28Å; L276-S280 WeakPolarHBondContact O-CB 3.47Å; L276-S280 PolarHBondContact O-N 3.33Å; L277-S280 WeakPolarHBondContact O-CB 3.42Å; S280-C282 VanDerWaalsContact C-N 3.32Å; S280-C282 PolarHBondContact O-N 3.46Å; S280-I283 PolarHBondContact O-N 3.15Å; S280-I284 WeakPolarHBondContact O-CB 3.27Å; S280-I284 WeakPolarHBondContact O-CD1 3.48Å; S280-I284 WeakPolarHBondContact O-CG1 3.15Å; S280-I284 PolarHBondContact O-N 3.3Å; S280-I284 WeakPolarHBondContact OG-CD1 3.45Å
281	P	83.9	Confident	81.4	Confident	77 Å²	77	85.4 Å²	85.4	50%	0.5	51%	0.507	S	S	.	.	H	α-helix	trans	-61.6	-37.9	177.2	-21.3	33.2	0	0	0	113.2	L277 V278 C285	L277-P281 WeakPolarHBondContact O-CD 3.33Å; V278-P281 WeakPolarHBondContact O-CD 3.45Å; P281-C285 VanDerWaalsContact O-CB 3.28Å; P281-C285 WeakPolarHBondContact O-CB 3.28Å; P281-C285 PolarHBondContact O-N 3.17Å; P281-C285 PolarHBondContact O-SG 2.91Å
282	C	82.4	Confident	79.9	Confident	84 Å²	84	91.2 Å²	91.2	57%	0.568	52%	0.519	S	S	*	.	H	α-helix	trans	-70.6	-43.7	178	-66.5	0	0	0	0	111.5	A279 S280 C285 C286	A279-C282 WeakPolarHBondContact O-CB 3.41Å; A279-C282 PolarHBondContact O-N 3.14Å; A279-C282 VanDerWaalsContact O-N 3.09Å; S280-C282 VanDerWaalsContact C-N 3.32Å; S280-C282 PolarHBondContact O-N 3.46Å; C282-C285 PolarHBondContact O-N 2.91Å; C282-C286 WeakPolarHBondContact O-CB 3.44Å; C282-C286 PolarHBondContact O-N 3.03Å; C282-C286 PolarHBondContact O-SG 3.35Å
283	I	82.7	Confident	78.5	Confident	84 Å²	84	91.6 Å²	91.6	43%	0.431	53%	0.525	S	S	.	.	H	α-helix	trans	-63.2	-47.1	177.2	-66.6	167.2	0	0	0	109.9	A279 S280 C285 C286 I287	A279-I283 HydrophobicContact CB-CD1 3.79Å; A279-I283 HydrophobicContact CB-CG1 4.37Å; A279-I283 VanDerWaalsContact O-CG1 3.3Å; A279-I283 WeakPolarHBondContact O-CG1 3.45Å; A279-I283 PolarHBondContact O-N 3.45Å; S280-I283 PolarHBondContact O-N 3.15Å; I283-C285 PolarHBondContact O-N 3.29Å; I283-C286 PolarHBondContact O-N 3.07Å; I283-I287 HydrophobicContact CG2-CD1 3.72Å; I283-I287 HydrophobicContact CG2-CG1 4.48Å; I283-I287 VanDerWaalsContact O-CG1 3.26Å; I283-I287 WeakPolarHBondContact O-CG1 3.43Å; I283-I287 PolarHBondContact O-N 2.98Å
284	I	83.7	Confident	77	Confident	92 Å²	92	96 Å²	96	47%	0.472	54%	0.536	S	S	.	.	H	α-helix	trans	-60.1	-45.4	176.1	-67	165.7	0	0	0	110.4	S280 C286 I287 C288	S280-I284 WeakPolarHBondContact O-CB 3.27Å; S280-I284 WeakPolarHBondContact O-CD1 3.48Å; S280-I284 WeakPolarHBondContact O-CG1 3.15Å; S280-I284 PolarHBondContact O-N 3.3Å; S280-I284 WeakPolarHBondContact OG-CD1 3.45Å; I284-C286 PolarHBondContact O-N 2.81Å; I284-I287 PolarHBondContact O-N 3.46Å; I284-C288 WeakPolarHBondContact O-CB 3.31Å; I284-C288 PolarHBondContact O-N 3.26Å; I284-C288 PolarHBondContact O-SG 3.42Å
285	C	77.8	Confident	75.5	Confident	77 Å²	77	101.2 Å²	101.2	52%	0.52	55%	0.552	S	S	.	*	H	α-helix	trans	-62.4	-40.1	177.6	-76.9	0	0	0	0	113.2	P281 C282 I283 K289	P281-C285 VanDerWaalsContact O-CB 3.28Å; P281-C285 WeakPolarHBondContact O-CB 3.28Å; P281-C285 PolarHBondContact O-N 3.17Å; P281-C285 PolarHBondContact O-SG 2.91Å; C282-C285 PolarHBondContact O-N 2.91Å; I283-C285 PolarHBondContact O-N 3.29Å; C285-K289 WeakPolarHBondContact O-CB 3.46Å; C285-K289 WeakPolarHBondContact O-CG 3.32Å; C285-K289 PolarHBondContact O-N 3.3Å
286	C	79.3	Confident	74	Confident	86 Å²	86	104.2 Å²	104.2	58%	0.581	56%	0.56	S	S	*	*	H	α-helix	trans	-66.9	-41.8	176.9	-73.7	0	0	0	0	111.9	C282 I283 I284 K289 S290	C282-C286 WeakPolarHBondContact O-CB 3.44Å; C282-C286 PolarHBondContact O-N 3.03Å; C282-C286 PolarHBondContact O-SG 3.35Å; I283-C286 PolarHBondContact O-N 3.07Å; I284-C286 PolarHBondContact O-N 2.81Å; C286-K289 PolarHBondContact O-N 2.8Å; C286-S290 WeakPolarHBondContact O-CB 3.43Å; C286-S290 PolarHBondContact O-N 3.09Å
287	I	76.6	Confident	72.7	Confident	99 Å²	99	107.6 Å²	107.6	51%	0.508	57%	0.57	S	S	.	*	H	α-helix	trans	-64.6	-45.7	175.5	-66.3	168.7	0	0	0	110.2	I283 I284 K289 S290 C291	I283-I287 HydrophobicContact CG2-CD1 3.72Å; I283-I287 HydrophobicContact CG2-CG1 4.48Å; I283-I287 VanDerWaalsContact O-CG1 3.26Å; I283-I287 WeakPolarHBondContact O-CG1 3.43Å; I283-I287 PolarHBondContact O-N 2.98Å; I284-I287 PolarHBondContact O-N 3.46Å; I287-K289 PolarHBondContact O-N 3.29Å; I287-S290 PolarHBondContact O-N 3.16Å; I287-C291 PolarHBondContact O-N 2.98Å; I287-C291 PolarHBondContact O-SG 2.87Å; I287-C291 VanDerWaalsContact O-SG 3.41Å
288	C	71.6	Confident	71.3	Confident	70 Å²	70	110 Å²	110	47%	0.473	58%	0.577	S	S	.	*	H	α-helix	trans	-61.8	-38.5	177.2	-69.4	0	0	0	0	113	I284 R292	I284-C288 WeakPolarHBondContact O-CB 3.31Å; I284-C288 PolarHBondContact O-N 3.26Å; I284-C288 PolarHBondContact O-SG 3.42Å; C288-R292 PolarHBondContact O-N 3.4Å
289	K	72.4	Confident	69.4	Low	160 Å²	160	108.6 Å²	108.6	70%	0.696	57%	0.573	S	S	*	*	H	α-helix	trans	-66.6	-41.3	173.7	-79.4	-177.8	178.6	176.5	0	112.2	C285 C286 I287 R292 S293	C285-K289 WeakPolarHBondContact O-CB 3.46Å; C285-K289 WeakPolarHBondContact O-CG 3.32Å; C285-K289 PolarHBondContact O-N 3.3Å; C286-K289 PolarHBondContact O-N 2.8Å; I287-K289 PolarHBondContact O-N 3.29Å; K289-R292 PolarHBondContact O-N 3.36Å; K289-S293 PolarHBondContact O-N 3.11Å
290	S	64.7	Low	68	Low	67 Å²	67	111.9 Å²	111.9	47%	0.469	59%	0.591	S	S	.	*	H	α-helix	trans	-65.2	-39.5	177.6	-154.4	0	0	0	0	111.9	C286 I287 S293 K294	C286-S290 WeakPolarHBondContact O-CB 3.43Å; C286-S290 PolarHBondContact O-N 3.09Å; I287-S290 PolarHBondContact O-N 3.16Å; S290-S293 PolarHBondContact O-N 3.23Å; S290-K294 PolarHBondContact O-N 2.73Å
291	C	60	Low	66.4	Low	74 Å²	74	115.3 Å²	115.3	50%	0.5	61%	0.612	S	S	.	*	H	α-helix	trans	-64	-40	171.9	-71.1	0	0	0	0	113.1	I287 K295	I287-C291 PolarHBondContact O-N 2.98Å; I287-C291 PolarHBondContact O-SG 2.87Å; I287-C291 VanDerWaalsContact O-SG 3.41Å; C291-K295 PolarHBondContact O-N 3.17Å
292	R	59.6	Low	64.8	Low	205 Å²	205	118.4 Å²	118.4	77%	0.774	63%	0.63	S	S	*	*	H	α-helix	trans	-65.4	-36.6	173.7	-80.4	-173	-178.3	-134.8	2.2	112.6	C288 K289 K295 K296	C288-R292 PolarHBondContact O-N 3.4Å; K289-R292 PolarHBondContact O-N 3.36Å; R292-K295 PolarHBondContact O-N 2.65Å; R292-K296 PolarHBondContact O-N 3.19Å
293	S	58.7	Low	63.1	Low	70 Å²	70	124 Å²	124	49%	0.49	66%	0.662	S	S	.	*	H	α-helix	trans	-69.1	-39.2	177.9	-166.2	0	0	0	0	112.4	K289 S290 K296 K297	K289-S293 PolarHBondContact O-N 3.11Å; S290-S293 PolarHBondContact O-N 3.23Å; S293-K296 PolarHBondContact O-N 3.19Å; S293-K297 PolarHBondContact O-N 3.01Å
294	K	58.7	Low	62.1	Low	155 Å²	155	126 Å²	126	67%	0.674	67%	0.673	S	S	*	*	H	α-helix	trans	-65	-37.9	173.8	-74.2	-176.3	178.7	-177.8	0	112.9	S290 K296 K297	S290-K294 PolarHBondContact O-N 2.73Å; K294-K296 VanDerWaalsContact C-N 3.31Å; K294-K296 PolarHBondContact O-N 3.32Å; K294-K297 PolarHBondContact O-N 2.72Å
295	K	56.9	Low	61	Low	179 Å²	179	127.8 Å²	127.8	78%	0.778	68%	0.684	S	S	*	*	H	α-helix	trans	-63.4	-32.3	173.6	-81.1	-171.2	176.4	-175	0	113.3	C291 R292	C291-K295 PolarHBondContact O-N 3.17Å; R292-K295 PolarHBondContact O-N 2.65Å
296	K	55.6	Low	60.1	Low	176 Å²	176	130.6 Å²	130.6	77%	0.765	69%	0.693	S	S	*	*	H	α-helix	trans	-73.1	-20.5	176.7	-80.9	-172.1	174.5	-172.2	0	114.6	R292 S293 K294 S299	R292-K296 PolarHBondContact O-N 3.19Å; S293-K296 PolarHBondContact O-N 3.19Å; K294-K296 VanDerWaalsContact C-N 3.31Å; K294-K296 PolarHBondContact O-N 3.32Å; K296-S299 PolarHBondContact O-OG 3.16Å
297	K	56.5	Low	58.9	Low	182 Å²	182	133.2 Å²	133.2	79%	0.791	70%	0.699	S	S	*	*	H	α-helix	trans	-87.4	-12	178.7	-75.2	-171.5	177.2	-173.5	0	114.2	S293 K294	S293-K297 PolarHBondContact O-N 3.01Å; K294-K297 PolarHBondContact O-N 2.72Å
298	H	56.6	Low	57.8	Low	173 Å²	173	135.4 Å²	135.4	80%	0.801	71%	0.711	S	S	*	*	S	Bend	trans	-106.2	4	-176.5	-110.4	-60.9	0	0	0	114.5	P300	H298-P300 WeakPolarHBondContact O-CD 3.48Å
299	S	50	Low	56.9	Low	85 Å²	85	139.7 Å²	139.7	59%	0.594	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-73.4	120.4	170.4	45.9	0	0	0	0	109.9	K296	K296-S299 PolarHBondContact O-OG 3.16Å
300	P	55.5	Low	55.8	Low	105 Å²	105	138.3 Å²	138.3	68%	0.682	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-67.4	152.6	178.4	28.2	-32.4	0	0	0	110.9	H298 T302	H298-P300 WeakPolarHBondContact O-CD 3.48Å; P300-T302 PolarHBondContact O-N 2.77Å
301	P	50.8	Low	55.1	Low	122 Å²	122	143.8 Å²	143.8	79%	0.792	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-68.2	116.2	177.9	27.5	-30.6	0	0	0	109.5	T303	P301-T303 PolarHBondContact O-N 2.71Å
302	T	50.4	Low	54.7	Low	141 Å²	141	149.6 Å²	149.6	87%	0.865	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-70	117.6	171	-42.5	0	0	0	0	108.4	P300	P300-T302 PolarHBondContact O-N 2.77Å
303	T	47.3	Very low	54.3	Low	202 Å²	202	144.5 Å²	144.5	100%	1.239	77%	0.77	S	S	*	*			trans	-82.7	0	168.9	-22.7	0	0	0	0	109.6	P301	P301-T303 PolarHBondContact O-N 2.71Å

Retrieved 303 of 303 residues in 86.5 ms (Link to these results)

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