A0A096MZR9_PAPAN Loading...

Killer cell lectin-like receptor subfamily F member 1

Functions as an activating receptor involved in immunosurveillance upon binding to various ligands displayed at the surface of myeloid cells. Upon interaction with CLEC2B ligand, stimulates NK-cell cytotoxicity and cytokine production leading to the cytolysis of malignant CLEC2B-expressing myeloid cells. Actviation of the common cytotoxicity pathway involves SRC and SYK kinases.

AlphaFold DB , UniProt , Accession A0A096MZR9, Species PAPAN (Papio anubis, Olive baboon), Gene KLRF1, Length 231 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.7	Very low	40	Very low	232 Å²	232	180.8 Å²	180.8	100%	1.143	87%	0.87	S	S	*	*				0	108.1	0	-153.8	-171.6	-55.2	0	0	105.5
2	Q	40.1	Very low	40.1	Very low	166 Å²	166	175.9 Å²	175.9	78%	0.776	86%	0.859	S	S	*	*			cis	-174.4	105.1	-4.3	-159.2	145	-16.5	0	0	101.9
3	D	39.7	Very low	40.3	Very low	173 Å²	173	176.8 Å²	176.8	93%	0.925	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-85.7	118.6	178.8	-75.9	-29.5	0	0	0	109
4	E	51.1	Low	40	Very low	190 Å²	190	172.6 Å²	172.6	89%	0.888	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-74.4	139	-177	-77.5	-162.1	148.6	0	0	113.1
5	E	44.5	Very low	39.8	Very low	158 Å²	158	175 Å²	175	74%	0.738	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-67.4	121.8	177.3	-60.5	-179.4	143.6	0	0	112	Y7	E5-Y7 HydrophobicContact CB-CD2 4.2Å; E5-Y7 HydrophobicContact CB-CE2 4.09Å; E5-Y7 WeakPolarHBondContact OE2-CE2 3.3Å
6	R	39.5	Very low	39.8	Very low	239 Å²	239	177.2 Å²	177.2	90%	0.902	86%	0.864	S	S	*	*			trans	-93.5	98.4	167.5	-176.6	-176.9	-80.2	-176.4	-4.1	109.7
7	Y	41.9	Very low	39.5	Very low	186 Å²	186	181.4 Å²	181.4	73%	0.729	87%	0.869	S	S	*	*	P	Polyproline II helix	trans	-79.5	138.5	165.9	-82	-92.9	0	0	0	111.3	E5	E5-Y7 HydrophobicContact CB-CD2 4.2Å; E5-Y7 HydrophobicContact CB-CE2 4.09Å; E5-Y7 WeakPolarHBondContact OE2-CE2 3.3Å
8	M	36.8	Very low	39.7	Very low	179 Å²	179	178.8 Å²	178.8	88%	0.882	87%	0.866	S	S	*	*	P	Polyproline II helix	trans	-96.8	125.8	168.7	-80.8	-174.2	-82.2	0	0	110
9	T	37.4	Very low	40.1	Very low	141 Å²	141	174.6 Å²	174.6	87%	0.865	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-95.3	127.4	167.3	47	0	0	0	0	109.8
10	L	36.3	Very low	40.3	Very low	169 Å²	169	172 Å²	172	89%	0.885	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-96.7	121.6	173	-91.6	161.1	0	0	0	109.4
11	N	36	Very low	40.5	Very low	156 Å²	156	172 Å²	172	83%	0.834	85%	0.849	S	S	*	*			trans	-109.7	122.1	174.4	-158	20.5	0	0	0	108.8
12	V	40.9	Very low	40.9	Very low	122 Å²	122	165.7 Å²	165.7	74%	0.739	82%	0.824	S	S	*	*			trans	-121.3	111.8	-179.5	175.5	0	0	0	0	109.1
13	Q	43.4	Very low	41.3	Very low	188 Å²	188	161 Å²	161	88%	0.879	81%	0.813	S	S	*	*			trans	-88.9	125.8	163.3	-82.3	-159.2	-25.8	0	0	109.9
14	S	35.5	Very low	41.5	Very low	118 Å²	118	160.4 Å²	160.4	83%	0.825	81%	0.805	S	S	*	*			trans	-90	123.6	173.6	65.2	0	0	0	0	111
15	K	37	Very low	41.4	Very low	208 Å²	208	157.4 Å²	157.4	90%	0.904	79%	0.794	S	S	*	*			trans	-94.9	113.9	173.9	-172.5	172	-177.4	174.4	0	109.1
16	K	39.9	Very low	41.9	Very low	210 Å²	210	154 Å²	154	91%	0.913	78%	0.784	S	S	*	*			trans	-71.7	134.2	176.9	-113.9	175.1	177.9	176.6	0	111.1
17	R	35.1	Very low	42.6	Very low	249 Å²	249	150.2 Å²	150.2	94%	0.94	78%	0.775	S	S	*	*			trans	-124.1	139.2	168	-140.6	176.2	-172.4	177.8	1	109.7
18	T	42.2	Very low	43.1	Very low	134 Å²	134	148.8 Å²	148.8	82%	0.822	77%	0.773	S	S	*	*			trans	-82.8	154.7	-155.4	-22.9	0	0	0	0	115.3	T20	T18-T20 PolarHBondContact O-N 3.43Å
19	S	47.7	Very low	44.2	Very low	99 Å²	99	145 Å²	145	69%	0.692	76%	0.756	S	S	*	*	S	Bend	trans	-82.6	0.5	-156.3	-172.6	0	0	0	0	118.8
20	T	44	Very low	45.7	Very low	122 Å²	122	145.5 Å²	145.5	75%	0.748	74%	0.743	S	S	*	*	S	Bend	trans	-92.7	-17.6	-159.5	-30	0	0	0	0	115.1	T18	T18-T20 PolarHBondContact O-N 3.43Å
21	Q	45.5	Very low	47.5	Very low	173 Å²	173	141 Å²	141	81%	0.808	73%	0.726	S	S	*	*	S	Bend	trans	-85.6	-23.5	-178.3	-102.5	173.9	-5.1	0	0	114.4
22	T	44.1	Very low	49.5	Very low	100 Å²	100	137 Å²	137	61%	0.613	71%	0.707	S	S	*	*	H	α-helix	trans	-77.5	-23.8	-172.8	-26.3	0	0	0	0	113.5	T26	T22-T26 WeakPolarHBondContact O-CG2 3.35Å; T22-T26 PolarHBondContact O-OG1 2.93Å
23	A	49.2	Very low	51.4	Low	66 Å²	66	135.7 Å²	135.7	55%	0.545	70%	0.699	S	S	.	*	H	α-helix	trans	-80.2	-25	-172.8	0	0	0	0	0	114.5	T26	A23-T26 PolarHBondContact O-OG1 3.01Å
24	Q	44.7	Very low	53	Low	161 Å²	161	129.9 Å²	129.9	75%	0.752	67%	0.673	S	S	*	*	H	α-helix	trans	-78.7	-34.5	-179.2	-79	-81	-32.7	0	0	112.3
25	L	48	Very low	55.3	Low	127 Å²	127	129.8 Å²	129.8	67%	0.665	66%	0.66	S	S	*	*	H	α-helix	trans	-69.6	-40.6	178	-88.9	142.4	0	0	0	111.9	F27	L25-F27 PolarHBondContact O-N 3.13Å
26	T	56	Low	57.4	Low	86 Å²	86	127.2 Å²	127.2	53%	0.528	64%	0.644	S	S	.	*	H	α-helix	trans	-71.6	-26.2	-176.8	55.6	0	0	0	0	114.3	T22 A23 Y30	T22-T26 WeakPolarHBondContact O-CG2 3.35Å; T22-T26 PolarHBondContact O-OG1 2.93Å; A23-T26 PolarHBondContact O-OG1 3.01Å; T26-Y30 PolarHBondContact O-N 3.08Å
27	F	54	Low	59.4	Low	160 Å²	160	123.5 Å²	123.5	70%	0.702	63%	0.625	S	S	*	*	H	α-helix	trans	-72.9	-38.7	-179	-174	-99.1	0	0	0	112.7	L25 D29 Y30 S31	L25-F27 PolarHBondContact O-N 3.13Å; F27-D29 VanDerWaalsContact C-N 3.35Å; F27-Y30 PolarHBondContact O-N 2.92Å; F27-S31 PolarHBondContact O-N 3.11Å
28	K	51.3	Low	61.7	Low	157 Å²	157	118.2 Å²	118.2	68%	0.683	61%	0.609	S	S	*	*	H	α-helix	trans	-69.5	-36.8	179.1	-162	169.7	-176.8	177.2	0	111.3	S31 V32	K28-S31 PolarHBondContact O-N 3.12Å; K28-V32 WeakPolarHBondContact O-CG2 3.29Å; K28-V32 PolarHBondContact O-N 3.03Å
29	D	61.1	Low	63.6	Low	98 Å²	98	115 Å²	115	52%	0.524	59%	0.586	S	S	.	*	H	α-helix	trans	-67.2	-36.9	176.8	-66	-29.9	0	0	0	112	F27 V32 V33	F27-D29 VanDerWaalsContact C-N 3.35Å; D29-V32 PolarHBondContact O-N 3.33Å; D29-V33 WeakPolarHBondContact O-CB 3.42Å; D29-V33 WeakPolarHBondContact O-CG2 3.36Å; D29-V33 PolarHBondContact O-N 2.92Å
30	Y	69	Low	65	Low	153 Å²	153	115.6 Å²	115.6	60%	0.6	58%	0.581	S	S	*	*	H	α-helix	trans	-64	-42.9	175.9	-176	-100.8	0	0	0	112.9	T26 F27 V32 V33 L34	T26-Y30 PolarHBondContact O-N 3.08Å; F27-Y30 PolarHBondContact O-N 2.92Å; Y30-V32 VanDerWaalsContact C-N 3.3Å; Y30-V32 PolarHBondContact O-N 2.9Å; Y30-V33 PolarHBondContact O-N 2.92Å; Y30-L34 HydrophobicContact CE1-CD2 4.31Å; Y30-L34 WeakPolarHBondContact O-CB 3.3Å; Y30-L34 PolarHBondContact O-N 3.43Å
31	S	72.9	Confident	66.5	Low	75 Å²	75	114.2 Å²	114.2	52%	0.524	57%	0.569	S	S	.	*	H	α-helix	trans	-63.6	-37.1	178.3	-174	0	0	0	0	112.1	F27 K28 H35	F27-S31 PolarHBondContact O-N 3.11Å; K28-S31 PolarHBondContact O-N 3.12Å; S31-H35 WeakPolarHBondContact O-CB 3.33Å; S31-H35 PolarHBondContact O-N 2.78Å
32	V	78.8	Confident	68	Low	71 Å²	71	107.9 Å²	107.9	43%	0.43	55%	0.55	S	S	.	.	H	α-helix	trans	-72.1	-45.1	178.3	174.2	0	0	0	0	110.3	K28 D29 Y30 L34 H35 W36	K28-V32 WeakPolarHBondContact O-CG2 3.29Å; K28-V32 PolarHBondContact O-N 3.03Å; D29-V32 PolarHBondContact O-N 3.33Å; Y30-V32 VanDerWaalsContact C-N 3.3Å; Y30-V32 PolarHBondContact O-N 2.9Å; V32-L34 PolarHBondContact O-N 3.26Å; V32-H35 WeakPolarHBondContact O-CB 3.43Å; V32-H35 PolarHBondContact O-N 3.31Å; V32-W36 VanDerWaalsContact CG1-CD1 3.47Å; V32-W36 VanDerWaalsContact CG1-NE1 3.34Å; V32-W36 PolarHBondContact O-N 2.93Å
33	V	79.6	Confident	69.6	Low	95 Å²	95	107 Å²	107	58%	0.576	54%	0.541	S	S	*	.	H	α-helix	trans	-60.4	-43.2	177	170.7	0	0	0	0	111.7	D29 Y30 H35 W36 Y37	D29-V33 WeakPolarHBondContact O-CB 3.42Å; D29-V33 WeakPolarHBondContact O-CG2 3.36Å; D29-V33 PolarHBondContact O-N 2.92Å; Y30-V33 PolarHBondContact O-N 2.92Å; V33-H35 VanDerWaalsContact C-N 3.31Å; V33-H35 PolarHBondContact O-N 3.46Å; V33-W36 PolarHBondContact O-N 3.33Å; V33-Y37 WeakPolarHBondContact O-CB 3.49Å; V33-Y37 PolarHBondContact O-N 2.76Å
34	L	77.3	Confident	70.9	Confident	66 Å²	66	106.8 Å²	106.8	35%	0.346	54%	0.535	S	S	.	.	H	α-helix	trans	-65.6	-35.3	177.5	-171.8	66	0	0	0	112.1	Y30 V32 K38	Y30-L34 HydrophobicContact CE1-CD2 4.31Å; Y30-L34 WeakPolarHBondContact O-CB 3.3Å; Y30-L34 PolarHBondContact O-N 3.43Å; V32-L34 PolarHBondContact O-N 3.26Å; L34-K38 WeakPolarHBondContact O-CG 3.48Å; L34-K38 PolarHBondContact O-N 3.3Å; L34-K38 VanDerWaalsContact O-N 3.12Å
35	H	83.1	Confident	72.5	Confident	116 Å²	116	101.2 Å²	101.2	54%	0.537	52%	0.521	S	S	.	.	H	α-helix	trans	-66.2	-47.3	175.4	-170.9	-99.2	0	0	0	111.5	S31 V32 V33 Y37 K38 I39	S31-H35 WeakPolarHBondContact O-CB 3.33Å; S31-H35 PolarHBondContact O-N 2.78Å; V32-H35 WeakPolarHBondContact O-CB 3.43Å; V32-H35 PolarHBondContact O-N 3.31Å; V33-H35 VanDerWaalsContact C-N 3.31Å; V33-H35 PolarHBondContact O-N 3.46Å; H35-Y37 PolarHBondContact O-N 2.91Å; H35-K38 PolarHBondContact O-N 3.47Å; H35-I39 WeakPolarHBondContact O-CG1 3.47Å; H35-I39 PolarHBondContact O-N 3.39Å
36	W	82.3	Confident	74.2	Confident	153 Å²	153	99.1 Å²	99.1	58%	0.58	51%	0.513	S	S	*	.	H	α-helix	trans	-65.8	-36.1	176.2	-68.5	112.9	0	0	0	113	V32 V33 K38 I39 L40	V32-W36 VanDerWaalsContact CG1-CD1 3.47Å; V32-W36 VanDerWaalsContact CG1-NE1 3.34Å; V32-W36 PolarHBondContact O-N 2.93Å; V33-W36 PolarHBondContact O-N 3.33Å; W36-K38 PolarHBondContact O-N 2.96Å; W36-I39 HydrophobicContact CE3-CD1 4.02Å; W36-I39 HydrophobicContact CZ3-CD1 4.29Å; W36-I39 PolarHBondContact O-N 3.39Å; W36-L40 WeakPolarHBondContact O-CG 3.48Å; W36-L40 PolarHBondContact O-N 3.28Å
37	Y	82.5	Confident	75.4	Confident	132 Å²	132	100.3 Å²	100.3	52%	0.518	52%	0.516	S	S	.	.	H	α-helix	trans	-62	-41.8	174.4	176.8	-104.9	0	0	0	112.3	V33 H35 I39 L40 L41	V33-Y37 WeakPolarHBondContact O-CB 3.49Å; V33-Y37 PolarHBondContact O-N 2.76Å; H35-Y37 PolarHBondContact O-N 2.91Å; Y37-I39 VanDerWaalsContact C-N 3.34Å; Y37-I39 PolarHBondContact O-N 2.77Å; Y37-L40 PolarHBondContact O-N 3.43Å; Y37-L41 HydrophobicContact CD1-CD1 3.9Å; Y37-L41 HydrophobicContact CD1-CG 4.43Å; Y37-L41 HydrophobicContact CE1-CD1 3.29Å; Y37-L41 HydrophobicContact CE1-CG 4.02Å; Y37-L41 HydrophobicContact CE2-CD1 4.32Å; Y37-L41 HydrophobicContact CE2-CD2 4.4Å; Y37-L41 HydrophobicContact CE2-CG 4.19Å; Y37-L41 WeakPolarHBondContact O-CG 3.24Å; Y37-L41 PolarHBondContact O-N 3.47Å
38	K	82.2	Confident	76.7	Confident	138 Å²	138	97.3 Å²	97.3	60%	0.6	51%	0.507	S	S	*	.	H	α-helix	trans	-62.9	-38.9	174.4	-74.4	178.6	177.9	-175.9	0	112.3	L34 H35 W36 G42	L34-K38 WeakPolarHBondContact O-CG 3.48Å; L34-K38 PolarHBondContact O-N 3.3Å; L34-K38 VanDerWaalsContact O-N 3.12Å; H35-K38 PolarHBondContact O-N 3.47Å; W36-K38 PolarHBondContact O-N 2.96Å; K38-G42 PolarHBondContact O-N 2.9Å; K38-G42 VanDerWaalsContact O-N 3.11Å
39	I	82.6	Confident	78.5	Confident	66 Å²	66	91.4 Å²	91.4	34%	0.338	49%	0.491	S	S	.	.	H	α-helix	trans	-65	-45.8	175.3	-65.8	168	0	0	0	110.6	H35 W36 Y37 L41 G42 I43	H35-I39 WeakPolarHBondContact O-CG1 3.47Å; H35-I39 PolarHBondContact O-N 3.39Å; W36-I39 HydrophobicContact CE3-CD1 4.02Å; W36-I39 HydrophobicContact CZ3-CD1 4.29Å; W36-I39 PolarHBondContact O-N 3.39Å; Y37-I39 VanDerWaalsContact C-N 3.34Å; Y37-I39 PolarHBondContact O-N 2.77Å; I39-L41 PolarHBondContact O-N 2.84Å; I39-G42 PolarHBondContact O-N 3.48Å; I39-G42 VanDerWaalsContact O-N 3.16Å; I39-I43 HydrophobicContact CG2-CD1 3.76Å; I39-I43 HydrophobicContact CG2-CG1 4.43Å; I39-I43 WeakPolarHBondContact O-CG1 3.27Å; I39-I43 PolarHBondContact O-N 2.88Å
40	L	77.9	Confident	80	Confident	113 Å²	113	92 Å²	92	59%	0.592	49%	0.493	S	S	*	.	H	α-helix	trans	-63.3	-40.2	178.9	-72.5	170.4	0	0	0	112.7	W36 Y37 G42 I43 S44	W36-L40 WeakPolarHBondContact O-CG 3.48Å; W36-L40 PolarHBondContact O-N 3.28Å; Y37-L40 PolarHBondContact O-N 3.43Å; L40-G42 VanDerWaalsContact C-N 3.32Å; L40-G42 PolarHBondContact O-N 3.44Å; L40-I43 PolarHBondContact O-N 3.31Å; L40-S44 WeakPolarHBondContact O-CB 3.44Å; L40-S44 PolarHBondContact O-N 3.37Å
41	L	74	Confident	81.1	Confident	92 Å²	92	89.6 Å²	89.6	48%	0.482	49%	0.49	S	S	.	.	H	α-helix	trans	-62	-40.5	173	-76.7	179.7	0	0	0	111.8	Y37 I39 G45	Y37-L41 HydrophobicContact CD1-CD1 3.9Å; Y37-L41 HydrophobicContact CD1-CG 4.43Å; Y37-L41 HydrophobicContact CE1-CD1 3.29Å; Y37-L41 HydrophobicContact CE1-CG 4.02Å; Y37-L41 HydrophobicContact CE2-CD1 4.32Å; Y37-L41 HydrophobicContact CE2-CD2 4.4Å; Y37-L41 HydrophobicContact CE2-CG 4.19Å; Y37-L41 WeakPolarHBondContact O-CG 3.24Å; Y37-L41 PolarHBondContact O-N 3.47Å; I39-L41 PolarHBondContact O-N 2.84Å; L41-G45 PolarHBondContact O-N 3.44Å
42	G	77.8	Confident	82	Confident	40 Å²	40	88.1 Å²	88.1	41%	0.412	48%	0.482	S	S	.	.	H	α-helix	trans	-61.3	-48.4	175	0	0	0	0	0	112.4	K38 I39 L40 G45 T46	K38-G42 PolarHBondContact O-N 2.9Å; K38-G42 VanDerWaalsContact O-N 3.11Å; I39-G42 PolarHBondContact O-N 3.48Å; I39-G42 VanDerWaalsContact O-N 3.16Å; L40-G42 VanDerWaalsContact C-N 3.32Å; L40-G42 PolarHBondContact O-N 3.44Å; G42-G45 PolarHBondContact O-N 3.01Å; G42-T46 WeakPolarHBondContact O-CG2 3.49Å; G42-T46 PolarHBondContact O-N 2.9Å
43	I	78.3	Confident	82.8	Confident	83 Å²	83	90.2 Å²	90.2	43%	0.426	49%	0.49	S	S	.	.	H	α-helix	trans	-64.5	-44.3	-179.8	-64.1	166.4	0	0	0	110.8	I39 L40 G45 T46 L47	I39-I43 HydrophobicContact CG2-CD1 3.76Å; I39-I43 HydrophobicContact CG2-CG1 4.43Å; I39-I43 WeakPolarHBondContact O-CG1 3.27Å; I39-I43 PolarHBondContact O-N 2.88Å; L40-I43 PolarHBondContact O-N 3.31Å; I43-G45 VanDerWaalsContact C-N 3.3Å; I43-G45 PolarHBondContact O-N 3.49Å; I43-T46 WeakPolarHBondContact CA-OG1 3.32Å; I43-T46 PolarHBondContact O-N 2.99Å; I43-T46 PolarHBondContact O-OG1 3.33Å; I43-L47 HydrophobicContact CG2-CD1 4.06Å; I43-L47 PolarHBondContact O-N 2.91Å
44	S	75.4	Confident	83.4	Confident	61 Å²	61	88.3 Å²	88.3	43%	0.427	49%	0.485	S	S	.	.	H	α-helix	trans	-59.2	-41.4	175.7	-176.1	0	0	0	0	111.7	L40 N48	L40-S44 WeakPolarHBondContact O-CB 3.44Å; L40-S44 PolarHBondContact O-N 3.37Å; S44-N48 PolarHBondContact O-N 2.93Å; S44-N48 VanDerWaalsContact O-N 3.17Å; S44-N48 PolarHBondContact O-ND2 2.91Å
45	G	77.6	Confident	84.2	Confident	44 Å²	44	89.7 Å²	89.7	45%	0.454	49%	0.492	S	S	.	.	H	α-helix	trans	-62.3	-43.8	174.9	0	0	0	0	0	113.2	L41 G42 I43 N48 G49	L41-G45 PolarHBondContact O-N 3.44Å; G42-G45 PolarHBondContact O-N 3.01Å; I43-G45 VanDerWaalsContact C-N 3.3Å; I43-G45 PolarHBondContact O-N 3.49Å; G45-N48 PolarHBondContact O-N 3.5Å; G45-G49 PolarHBondContact O-N 3.34Å
46	T	83.6	Confident	84.6	Confident	82 Å²	82	88.5 Å²	88.5	50%	0.503	49%	0.489	S	S	.	.	H	α-helix	trans	-65.7	-41	-180	57.8	0	0	0	0	113	G42 I43 G49 I50	G42-T46 WeakPolarHBondContact O-CG2 3.49Å; G42-T46 PolarHBondContact O-N 2.9Å; I43-T46 WeakPolarHBondContact CA-OG1 3.32Å; I43-T46 PolarHBondContact O-N 2.99Å; I43-T46 PolarHBondContact O-OG1 3.33Å; T46-G49 PolarHBondContact O-N 3.5Å; T46-I50 VanDerWaalsContact O-CG1 3.27Å; T46-I50 WeakPolarHBondContact O-CG1 3.49Å; T46-I50 PolarHBondContact O-N 2.94Å
47	L	82.6	Confident	85	Confident	112 Å²	112	84.2 Å²	84.2	59%	0.586	48%	0.482	S	S	*	.	H	α-helix	trans	-64.5	-44.1	177.9	-73	168.1	0	0	0	111.7	I43 I50 L51	I43-L47 HydrophobicContact CG2-CD1 4.06Å; I43-L47 PolarHBondContact O-N 2.91Å; L47-I50 PolarHBondContact O-N 3.25Å; L47-L51 WeakPolarHBondContact O-CB 3.24Å; L47-L51 PolarHBondContact O-N 3.25Å
48	N	80.6	Confident	85.3	Confident	97 Å²	97	82.9 Å²	82.9	52%	0.519	48%	0.484	S	S	.	.	H	α-helix	trans	-66.4	-37.2	176.5	-75.3	-63.6	0	0	0	112.2	S44 G45 L51 A52	S44-N48 PolarHBondContact O-N 2.93Å; S44-N48 VanDerWaalsContact O-N 3.17Å; S44-N48 PolarHBondContact O-ND2 2.91Å; G45-N48 PolarHBondContact O-N 3.5Å; N48-L51 PolarHBondContact O-N 2.95Å; N48-A52 WeakPolarHBondContact O-CB 3.45Å; N48-A52 PolarHBondContact O-N 3.34Å
49	G	89.6	Confident	85.4	Confident	32 Å²	32	81.7 Å²	81.7	33%	0.33	48%	0.482	S	S	.	.	H	α-helix	trans	-64.3	-45.6	175.1	0	0	0	0	0	112.8	G45 T46 L51 A52 L53	G45-G49 PolarHBondContact O-N 3.34Å; T46-G49 PolarHBondContact O-N 3.5Å; G49-L51 VanDerWaalsContact C-N 3.33Å; G49-L51 PolarHBondContact O-N 3.46Å; G49-A52 PolarHBondContact O-N 2.93Å; G49-L53 WeakPolarHBondContact O-CG 3.22Å; G49-L53 PolarHBondContact O-N 3.47Å
50	I	91.4	Very high	85.6	Confident	112 Å²	112	82.8 Å²	82.8	57%	0.574	49%	0.489	S	S	*	.	H	α-helix	trans	-62.2	-42.8	176.2	-67.2	164.4	0	0	0	110.5	T46 L47 A52 L53 A54	T46-I50 VanDerWaalsContact O-CG1 3.27Å; T46-I50 WeakPolarHBondContact O-CG1 3.49Å; T46-I50 PolarHBondContact O-N 2.94Å; L47-I50 PolarHBondContact O-N 3.25Å; I50-A52 PolarHBondContact O-N 2.76Å; I50-L53 PolarHBondContact O-N 3.01Å; I50-A54 WeakPolarHBondContact O-CB 3.47Å; I50-A54 PolarHBondContact O-N 3.19Å
51	L	92.4	Very high	85.7	Confident	101 Å²	101	83 Å²	83	53%	0.529	49%	0.489	S	S	.	.	H	α-helix	trans	-61.3	-44.5	176.9	-176.4	63	0	0	0	111.6	L47 N48 G49 A54 L55	L47-L51 WeakPolarHBondContact O-CB 3.24Å; L47-L51 PolarHBondContact O-N 3.25Å; N48-L51 PolarHBondContact O-N 2.95Å; G49-L51 VanDerWaalsContact C-N 3.33Å; G49-L51 PolarHBondContact O-N 3.46Å; L51-A54 PolarHBondContact O-N 2.96Å; L51-L55 HydrophobicContact CG-CD1 4.4Å; L51-L55 VanDerWaalsContact O-CG 3.32Å; L51-L55 WeakPolarHBondContact O-CG 3.43Å; L51-L55 PolarHBondContact O-N 2.93Å
52	A	93.1	Very high	85.9	Confident	45 Å²	45	83 Å²	83	37%	0.372	49%	0.494	S	S	.	.	H	α-helix	trans	-62.5	-42.8	176.5	0	0	0	0	0	112.1	N48 G49 I50 A54 L55 I56	N48-A52 WeakPolarHBondContact O-CB 3.45Å; N48-A52 PolarHBondContact O-N 3.34Å; G49-A52 PolarHBondContact O-N 2.93Å; I50-A52 PolarHBondContact O-N 2.76Å; A52-A54 PolarHBondContact O-N 3.3Å; A52-L55 PolarHBondContact O-N 2.73Å; A52-I56 WeakPolarHBondContact O-CB 3.38Å; A52-I56 WeakPolarHBondContact O-CD1 3.32Å; A52-I56 VanDerWaalsContact O-CG1 3.22Å; A52-I56 WeakPolarHBondContact O-CG1 3.42Å; A52-I56 PolarHBondContact O-N 3.11Å
53	L	93.9	Very high	85.6	Confident	114 Å²	114	84.3 Å²	84.3	60%	0.597	50%	0.496	S	S	*	.	H	α-helix	trans	-64.7	-38.8	176.7	-71.5	173.6	0	0	0	112.4	G49 I50 I56 S57	G49-L53 WeakPolarHBondContact O-CG 3.22Å; G49-L53 PolarHBondContact O-N 3.47Å; I50-L53 PolarHBondContact O-N 3.01Å; L53-I56 PolarHBondContact O-N 3.16Å; L53-S57 WeakPolarHBondContact O-CB 3.38Å; L53-S57 PolarHBondContact O-N 2.92Å; L53-S57 PolarHBondContact O-OG 3.17Å
54	A	93.6	Very high	85	Confident	56 Å²	56	87.2 Å²	87.2	46%	0.463	51%	0.508	S	S	.	.	H	α-helix	trans	-64.6	-42.4	175.1	0	0	0	0	0	111.7	I50 L51 A52 S57 L58	I50-A54 WeakPolarHBondContact O-CB 3.47Å; I50-A54 PolarHBondContact O-N 3.19Å; L51-A54 PolarHBondContact O-N 2.96Å; A52-A54 PolarHBondContact O-N 3.3Å; A54-S57 PolarHBondContact O-N 3.38Å; A54-L58 WeakPolarHBondContact O-CB 3.37Å; A54-L58 PolarHBondContact O-N 2.95Å
55	L	93	Very high	84.3	Confident	94 Å²	94	87 Å²	87	49%	0.492	52%	0.515	S	S	.	.	H	α-helix	trans	-65	-44.8	175.9	-70.2	173.7	0	0	0	112	L51 A52 S57 L58 I59	L51-L55 HydrophobicContact CG-CD1 4.4Å; L51-L55 VanDerWaalsContact O-CG 3.32Å; L51-L55 WeakPolarHBondContact O-CG 3.43Å; L51-L55 PolarHBondContact O-N 2.93Å; A52-L55 PolarHBondContact O-N 2.73Å; L55-S57 VanDerWaalsContact C-N 3.3Å; L55-S57 PolarHBondContact O-N 3.06Å; L55-L58 PolarHBondContact O-N 2.77Å; L55-I59 WeakPolarHBondContact O-CD1 3.44Å; L55-I59 VanDerWaalsContact O-CG1 3.24Å; L55-I59 WeakPolarHBondContact O-CG1 3.34Å; L55-I59 PolarHBondContact O-N 3.17Å
56	I	92.1	Very high	83.4	Confident	91 Å²	91	90.6 Å²	90.6	47%	0.467	53%	0.528	S	S	.	.	H	α-helix	trans	-60.6	-43.3	175.8	-68.3	164.1	0	0	0	110.2	A52 L53 L58 I59 L60	A52-I56 WeakPolarHBondContact O-CB 3.38Å; A52-I56 WeakPolarHBondContact O-CD1 3.32Å; A52-I56 VanDerWaalsContact O-CG1 3.22Å; A52-I56 WeakPolarHBondContact O-CG1 3.42Å; A52-I56 PolarHBondContact O-N 3.11Å; L53-I56 PolarHBondContact O-N 3.16Å; I56-L58 PolarHBondContact O-N 3.48Å; I56-I59 PolarHBondContact O-N 2.95Å; I56-L60 HydrophobicContact CG2-CD1 4.06Å; I56-L60 HydrophobicContact CG2-CG 4.43Å; I56-L60 VanDerWaalsContact O-CG 3.3Å; I56-L60 WeakPolarHBondContact O-CG 3.35Å; I56-L60 PolarHBondContact O-N 3.43Å
57	S	90.8	Very high	81.8	Confident	64 Å²	64	93.1 Å²	93.1	45%	0.448	54%	0.538	S	S	.	.	H	α-helix	trans	-62.6	-41.5	177.2	-58.3	0	0	0	0	111.9	L53 A54 L55 L60 L61	L53-S57 WeakPolarHBondContact O-CB 3.38Å; L53-S57 PolarHBondContact O-N 2.92Å; L53-S57 PolarHBondContact O-OG 3.17Å; A54-S57 PolarHBondContact O-N 3.38Å; L55-S57 VanDerWaalsContact C-N 3.3Å; L55-S57 PolarHBondContact O-N 3.06Å; S57-L60 PolarHBondContact O-N 3.39Å; S57-L61 VanDerWaalsContact O-CG 3.29Å; S57-L61 WeakPolarHBondContact O-CG 3.33Å; S57-L61 PolarHBondContact O-N 3.32Å
58	L	88.1	Confident	80	Confident	104 Å²	104	95.6 Å²	95.6	55%	0.545	55%	0.551	S	S	.	*	H	α-helix	trans	-64.3	-42	176.1	-172.9	67.1	0	0	0	111.8	A54 L55 I56 L60 L61 V62	A54-L58 WeakPolarHBondContact O-CB 3.37Å; A54-L58 PolarHBondContact O-N 2.95Å; L55-L58 PolarHBondContact O-N 2.77Å; I56-L58 PolarHBondContact O-N 3.48Å; L58-L60 VanDerWaalsContact C-N 3.33Å; L58-L60 PolarHBondContact O-N 2.75Å; L58-L61 PolarHBondContact O-N 3.12Å; L58-V62 WeakPolarHBondContact O-CB 3.44Å; L58-V62 VanDerWaalsContact O-CG2 3.24Å; L58-V62 WeakPolarHBondContact O-CG2 3.43Å; L58-V62 PolarHBondContact O-N 2.76Å
59	I	86.1	Confident	77.9	Confident	112 Å²	112	98 Å²	98	57%	0.574	56%	0.557	S	S	*	*	H	α-helix	trans	-63.1	-40.5	175.7	-67.4	163.3	0	0	0	110.8	L55 I56 V62 S63	L55-I59 WeakPolarHBondContact O-CD1 3.44Å; L55-I59 VanDerWaalsContact O-CG1 3.24Å; L55-I59 WeakPolarHBondContact O-CG1 3.34Å; L55-I59 PolarHBondContact O-N 3.17Å; I56-I59 PolarHBondContact O-N 2.95Å; I59-V62 PolarHBondContact O-N 2.89Å; I59-S63 WeakPolarHBondContact O-CB 3.34Å; I59-S63 PolarHBondContact O-N 2.92Å; I59-S63 PolarHBondContact O-OG 3.24Å
60	L	85.4	Confident	75.6	Confident	90 Å²	90	103 Å²	103	47%	0.471	59%	0.585	S	S	.	*	H	α-helix	trans	-65.4	-40.2	174.7	-70.2	174.3	0	0	0	112	I56 S57 L58 S63 Q64	I56-L60 HydrophobicContact CG2-CD1 4.06Å; I56-L60 HydrophobicContact CG2-CG 4.43Å; I56-L60 VanDerWaalsContact O-CG 3.3Å; I56-L60 WeakPolarHBondContact O-CG 3.35Å; I56-L60 PolarHBondContact O-N 3.43Å; S57-L60 PolarHBondContact O-N 3.39Å; L58-L60 VanDerWaalsContact C-N 3.33Å; L58-L60 PolarHBondContact O-N 2.75Å; L60-S63 WeakPolarHBondContact CA-OG 3.45Å; L60-S63 PolarHBondContact O-N 2.99Å; L60-S63 PolarHBondContact O-OG 3.49Å; L60-Q64 WeakPolarHBondContact O-CB 3.19Å; L60-Q64 VanDerWaalsContact O-CG 3.3Å; L60-Q64 WeakPolarHBondContact O-CG 3.32Å; L60-Q64 PolarHBondContact O-N 3.38Å
61	L	80.3	Confident	72.7	Confident	116 Å²	116	105.1 Å²	105.1	61%	0.607	59%	0.593	S	S	*	*	H	α-helix	trans	-66.6	-39.4	175.2	-70.6	171.7	0	0	0	112.3	S57 L58 G65	S57-L61 VanDerWaalsContact O-CG 3.29Å; S57-L61 WeakPolarHBondContact O-CG 3.33Å; S57-L61 PolarHBondContact O-N 3.32Å; L58-L61 PolarHBondContact O-N 3.12Å; L61-G65 PolarHBondContact O-N 3.48Å
62	V	78.6	Confident	70.1	Confident	94 Å²	94	110 Å²	110	57%	0.57	61%	0.609	S	S	*	*	H	α-helix	trans	-67.3	-40.3	176	172.1	0	0	0	0	111	L58 I59 G65 V66	L58-V62 WeakPolarHBondContact O-CB 3.44Å; L58-V62 VanDerWaalsContact O-CG2 3.24Å; L58-V62 WeakPolarHBondContact O-CG2 3.43Å; L58-V62 PolarHBondContact O-N 2.76Å; I59-V62 PolarHBondContact O-N 2.89Å; V62-G65 PolarHBondContact O-N 3.18Å; V62-V66 WeakPolarHBondContact O-CG2 3.17Å; V62-V66 PolarHBondContact O-N 3.49Å
63	S	71.4	Confident	67	Low	67 Å²	67	111.3 Å²	111.3	47%	0.469	63%	0.628	S	S	.	*	H	α-helix	trans	-70.3	-36.2	176.8	56.1	0	0	0	0	113.3	I59 L60 G65 V66	I59-S63 WeakPolarHBondContact O-CB 3.34Å; I59-S63 PolarHBondContact O-N 2.92Å; I59-S63 PolarHBondContact O-OG 3.24Å; L60-S63 WeakPolarHBondContact CA-OG 3.45Å; L60-S63 PolarHBondContact O-N 2.99Å; L60-S63 PolarHBondContact O-OG 3.49Å; S63-G65 VanDerWaalsContact C-N 3.29Å; S63-V66 PolarHBondContact O-N 2.93Å
64	Q	65.7	Low	63.9	Low	143 Å²	143	110.8 Å²	110.8	67%	0.668	63%	0.634	S	S	*	*	H	α-helix	trans	-70.7	-26.7	171.5	-69.4	177.8	11.7	0	0	112.1	L60 V66 L67	L60-Q64 WeakPolarHBondContact O-CB 3.19Å; L60-Q64 VanDerWaalsContact O-CG 3.3Å; L60-Q64 WeakPolarHBondContact O-CG 3.32Å; L60-Q64 PolarHBondContact O-N 3.38Å; Q64-V66 VanDerWaalsContact C-N 3.26Å; Q64-V66 PolarHBondContact O-N 3.32Å; Q64-L67 PolarHBondContact O-N 3.47Å
65	G	61.1	Low	60.8	Low	57 Å²	57	116.4 Å²	116.4	59%	0.588	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-7.6	172.2	0	0	0	0	0	115.6	L61 V62 S63	L61-G65 PolarHBondContact O-N 3.48Å; V62-G65 PolarHBondContact O-N 3.18Å; S63-G65 VanDerWaalsContact C-N 3.29Å
66	V	57.8	Low	57.9	Low	120 Å²	120	115.5 Å²	115.5	73%	0.727	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-0.3	175.6	173.6	0	0	0	0	112.5	V62 S63 Q64 L68	V62-V66 WeakPolarHBondContact O-CG2 3.17Å; V62-V66 PolarHBondContact O-N 3.49Å; S63-V66 PolarHBondContact O-N 2.93Å; Q64-V66 VanDerWaalsContact C-N 3.26Å; Q64-V66 PolarHBondContact O-N 3.32Å; V66-L68 PolarHBondContact O-N 2.99Å
67	L	49.5	Very low	54.7	Low	134 Å²	134	117.9 Å²	117.9	70%	0.702	67%	0.665	S	S	*	*			trans	-96.7	55.4	174.2	-157.5	76	0	0	0	112.7	Q64 K69	Q64-L67 PolarHBondContact O-N 3.47Å; L67-K69 HydrophobicContact CG-CG 4.33Å; L67-K69 PolarHBondContact O-N 3.41Å; L67-K69 VanDerWaalsContact O-N 3.08Å
68	L	45.8	Very low	51.7	Low	165 Å²	165	120.3 Å²	120.3	86%	0.864	68%	0.678	S	S	*	*			trans	-75.6	91.5	151.4	-99.6	157.4	0	0	0	107.4	V66 C70	V66-L68 PolarHBondContact O-N 2.99Å; L68-C70 PolarHBondContact O-N 3.36Å; L68-C70 VanDerWaalsContact O-N 3.12Å
69	K	36.6	Very low	48.7	Very low	147 Å²	147	120.3 Å²	120.3	64%	0.639	68%	0.682	S	S	*	*			trans	-43	112.4	169.8	-70	175.6	174.3	177.7	0	110.3	L67 Q71	L67-K69 HydrophobicContact CG-CG 4.33Å; L67-K69 PolarHBondContact O-N 3.41Å; L67-K69 VanDerWaalsContact O-N 3.08Å; K69-Q71 PolarHBondContact O-N 3.17Å
70	C	42.2	Very low	45.8	Very low	136 Å²	136	123 Å²	123	92%	0.919	69%	0.692	S	S	*	*			trans	-69.4	84	146.8	-79.8	0	0	0	0	106.9	L68 K72	L68-C70 PolarHBondContact O-N 3.36Å; L68-C70 VanDerWaalsContact O-N 3.12Å; C70-K72 PolarHBondContact O-N 3.28Å; C70-K72 VanDerWaalsContact O-N 3.11Å
71	Q	30.2	Very low	43.1	Very low	158 Å²	158	125.4 Å²	125.4	74%	0.738	70%	0.701	S	S	*	*			trans	-70.8	106	170.9	-171.3	145.2	-62.4	0	0	107.8	K69 G73	K69-Q71 PolarHBondContact O-N 3.17Å; Q71-G73 VanDerWaalsContact C-N 3.34Å; Q71-G73 PolarHBondContact O-N 3.45Å
72	K	36.7	Very low	40.6	Very low	202 Å²	202	127.4 Å²	127.4	88%	0.878	71%	0.707	S	S	*	*			trans	-68.9	94.6	167	-163.9	170.1	-172.4	176.1	0	107.5	C70	C70-K72 PolarHBondContact O-N 3.28Å; C70-K72 VanDerWaalsContact O-N 3.11Å
73	G	28.6	Very low	38.4	Very low	74 Å²	74	130.3 Å²	130.3	76%	0.763	72%	0.719	S	S	*	*			trans	-83.7	116.1	169.4	0	0	0	0	0	109.9	Q71	Q71-G73 VanDerWaalsContact C-N 3.34Å; Q71-G73 PolarHBondContact O-N 3.45Å
74	S	29	Very low	36.5	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	74%	0.736	S	S	*	*			trans	-133.9	106.5	164.4	171.9	0	0	0	0	107.7
75	H	27.3	Very low	35	Very low	173 Å²	173	131.5 Å²	131.5	80%	0.801	74%	0.742	S	S	*	*			trans	-175.7	108.3	139.3	-120.6	-96.2	0	0	0	112.7
76	S	32.1	Very low	33.4	Very low	76 Å²	76	135.8 Å²	135.8	53%	0.531	75%	0.751	S	S	.	*				55.5	122.2	121.3	80.6	0	0	0	0	123.7
77	N	26.2	Very low	32.4	Very low	140 Å²	140	138.7 Å²	138.7	75%	0.749	76%	0.761	S	S	*	*				142.4	111.9	119	-72.5	-18.5	0	0	0	112
78	T	26.5	Very low	31.3	Very low	116 Å²	116	141.5 Å²	141.5	71%	0.712	77%	0.768	S	S	*	*				77.3	126.1	95.8	-42.2	0	0	0	0	110.7
79	T	25.9	Very low	30.6	Very low	104 Å²	104	142 Å²	142	64%	0.638	77%	0.768	S	S	*	*				-169.4	143.8	61	-22.6	0	0	0	0	112.1
80	E	25.9	Very low	30.5	Very low	167 Å²	167	140.9 Å²	140.9	78%	0.78	77%	0.769	S	S	*	*			trans	60.7	142	144	-76.9	160.5	-157.3	0	0	121.7
81	H	27.3	Very low	30.1	Very low	142 Å²	142	142.4 Å²	142.4	66%	0.657	77%	0.768	S	S	*	*			cis	-160.6	143.9	34.1	-141.7	-92.5	0	0	0	112.6
82	E	28.3	Very low	30.1	Very low	157 Å²	157	138.4 Å²	138.4	73%	0.734	77%	0.769	S	S	*	*			trans	40.6	123.9	154.1	-71.9	171.7	170.7	0	0	124.5
83	D	31.6	Very low	29.8	Very low	155 Å²	155	134.7 Å²	134.7	83%	0.829	76%	0.764	S	S	*	*				-166	159.7	92.3	-136.7	-20.6	0	0	0	113.7
84	I	33.2	Very low	30	Very low	160 Å²	160	141.5 Å²	141.5	82%	0.821	77%	0.766	S	S	*	*			trans	-86.2	148.9	-158.8	-71	165.9	0	0	0	115.2
85	G	33.2	Very low	30.1	Very low	76 Å²	76	147 Å²	147	78%	0.784	77%	0.771	S	S	*	*			trans	178.6	93.8	162.4	0	0	0	0	0	114.9
86	D	27.9	Very low	30.6	Very low	147 Å²	147	147 Å²	147	79%	0.786	78%	0.777	S	S	*	*			trans	-58	146.8	178.6	-111.9	-33.6	0	0	0	115.1
87	L	35.5	Very low	30.8	Very low	180 Å²	180	148.9 Å²	148.9	94%	0.942	79%	0.786	S	S	*	*				-174.7	123.7	122.5	-94.1	172.3	0	0	0	110.2
88	K	27.9	Very low	31.4	Very low	193 Å²	193	147 Å²	147	84%	0.839	78%	0.783	S	S	*	*			trans	-106.8	138.6	-169	-164.4	-179.6	-164.1	171.7	0	109.4
89	M	30.3	Very low	32.2	Very low	175 Å²	175	149.4 Å²	149.4	86%	0.862	79%	0.792	S	S	*	*			trans	-150.8	104.9	151.9	-151.8	141	117.4	0	0	113.7
90	N	34.3	Very low	33.1	Very low	125 Å²	125	153.1 Å²	153.1	67%	0.668	80%	0.799	S	S	*	*			trans	8.8	117.6	152.8	55.5	15.7	0	0	0	124.8
91	N	33.7	Very low	34.2	Very low	167 Å²	167	152.8 Å²	152.8	89%	0.893	80%	0.803	S	S	*	*				35.5	123.9	118.7	-131.7	14.7	0	0	0	122.8
92	G	31	Very low	34.7	Very low	74 Å²	74	153 Å²	153	76%	0.763	81%	0.808	S	S	*	*			trans	-161.1	119.3	163.2	0	0	0	0	0	112.4
93	T	29.2	Very low	35.3	Very low	125 Å²	125	151.4 Å²	151.4	77%	0.767	81%	0.813	S	S	*	*			trans	-71.9	156.9	-159.3	-38.2	0	0	0	0	117.1
94	R	33	Very low	35.7	Very low	217 Å²	217	148.8 Å²	148.8	82%	0.819	80%	0.802	S	S	*	*			trans	102.4	104.5	133.5	-128.7	177.3	-156.7	-175.5	4.8	118.9
95	R	31.2	Very low	36.3	Very low	218 Å²	218	146.2 Å²	146.2	82%	0.823	80%	0.799	S	S	*	*				174.3	120.6	107.7	-97.9	179.3	-100.8	115.2	-3.4	111.2
96	N	38.7	Very low	36.7	Very low	172 Å²	172	153.6 Å²	153.6	92%	0.92	80%	0.803	S	S	*	*			trans	-80.8	118.5	162.6	-68.2	-15.6	0	0	0	108
97	T	35.5	Very low	37.7	Very low	117 Å²	117	151.7 Å²	151.7	72%	0.718	80%	0.801	S	S	*	*			trans	-142.6	103.2	163.3	-31.6	0	0	0	0	109.9	N99	T97-N99 PolarHBondContact O-N 3.34Å
98	S	39.7	Very low	38.3	Very low	99 Å²	99	146.9 Å²	146.9	69%	0.692	79%	0.787	S	S	*	*			trans	16.2	98.5	150.7	-165.2	0	0	0	0	116.3	K100	S98-K100 VanDerWaalsContact C-N 3.33Å; S98-K100 PolarHBondContact O-N 3.44Å
99	N	42.6	Very low	39.2	Very low	167 Å²	167	143.7 Å²	143.7	89%	0.893	78%	0.78	S	S	*	*			trans	-65.9	96	161.2	-76.7	-26.7	0	0	0	108.2	T97	T97-N99 PolarHBondContact O-N 3.34Å
100	K	44.5	Very low	40.6	Very low	182 Å²	182	143.4 Å²	143.4	79%	0.791	78%	0.776	S	S	*	*			trans	-72.9	130.3	163	-88	-178	173.6	178.2	0	108.1	S98 L102	S98-K100 VanDerWaalsContact C-N 3.33Å; S98-K100 PolarHBondContact O-N 3.44Å; K100-L102 PolarHBondContact O-N 2.92Å; K100-L102 VanDerWaalsContact O-N 3.13Å
101	D	49.9	Very low	42.4	Very low	160 Å²	160	141.4 Å²	141.4	86%	0.856	77%	0.769	S	S	*	*			trans	-47	115.1	170.5	-60.1	-62.4	0	0	0	110.9
102	L	37.1	Very low	44.7	Very low	146 Å²	146	135.7 Å²	135.7	76%	0.764	74%	0.739	S	S	*	*			trans	-127.6	98.1	159.2	-166.4	69.1	0	0	0	106.8	K100 V104	K100-L102 PolarHBondContact O-N 2.92Å; K100-L102 VanDerWaalsContact O-N 3.13Å; L102-V104 HydrophobicContact CD2-CG2 3.62Å; L102-V104 HydrophobicContact CG-CG2 3.81Å; L102-V104 PolarHBondContact O-N 3.03Å
103	C	40.3	Very low	47.6	Very low	124 Å²	124	139.2 Å²	139.2	84%	0.838	74%	0.74	S	S	*	*			trans	-65.4	77.8	162.8	-44.4	0	0	0	0	107.1	S105	C103-S105 PolarHBondContact O-N 2.77Å
104	V	40.4	Very low	50.7	Low	100 Å²	100	135 Å²	135	61%	0.606	72%	0.715	S	S	*	*			trans	-64.7	109.1	162	178.3	0	0	0	0	104.4	L102 R106	L102-V104 HydrophobicContact CD2-CG2 3.62Å; L102-V104 HydrophobicContact CG-CG2 3.81Å; L102-V104 PolarHBondContact O-N 3.03Å; V104-R106 PolarHBondContact O-N 3.41Å
105	S	46	Very low	53.5	Low	107 Å²	107	130 Å²	130	75%	0.748	70%	0.701	S	S	*	*			trans	-53.3	94.4	162.2	45.6	0	0	0	0	107	C103 S107	C103-S105 PolarHBondContact O-N 2.77Å; S105-S107 PolarHBondContact O-N 2.79Å
106	R	41.7	Very low	56.3	Low	230 Å²	230	124.7 Å²	124.7	87%	0.868	70%	0.698	S	S	*	*			trans	-64.7	90.7	164.2	-77.6	179.2	173.6	166.7	-2.5	105.2	V104 A108	V104-R106 PolarHBondContact O-N 3.41Å; R106-A108 PolarHBondContact O-N 3.4Å
107	S	49	Very low	58.8	Low	108 Å²	108	124.1 Å²	124.1	76%	0.755	69%	0.689	S	S	*	*			trans	-55.3	100.6	135.3	56.8	0	0	0	0	103.1	S105 D109	S105-S107 PolarHBondContact O-N 2.79Å; S107-D109 PolarHBondContact O-N 2.93Å
108	A	48.4	Very low	61.7	Low	79 Å²	79	119.4 Å²	119.4	65%	0.653	66%	0.658	S	S	*	*			trans	-57.3	96.9	163	0	0	0	0	0	103.8	R106 Q110	R106-A108 PolarHBondContact O-N 3.4Å; A108-Q110 PolarHBondContact O-N 3.43Å
109	D	46.3	Very low	64.3	Low	126 Å²	126	118 Å²	118	67%	0.674	64%	0.643	S	S	*	*			trans	-57.8	89.3	155.6	-177.8	29.1	0	0	0	103.1	S107 T111	S107-D109 PolarHBondContact O-N 2.93Å; D109-T111 PolarHBondContact O-N 3.24Å; D109-T111 WeakPolarHBondContact OD2-CG2 3.41Å
110	Q	59.6	Low	66.9	Low	168 Å²	168	115.3 Å²	115.3	79%	0.785	62%	0.623	S	S	*	*			trans	-61	88.8	165.1	-86.9	174.8	-36.4	0	0	103.6	A108 V112	A108-Q110 PolarHBondContact O-N 3.43Å; Q110-V112 PolarHBondContact O-N 3.25Å
111	T	72.4	Confident	69.3	Low	84 Å²	84	109.4 Å²	109.4	52%	0.515	60%	0.596	S	S	.	*			trans	-64.9	93	175.5	33.4	0	0	0	0	105.8	D109 L113	D109-T111 PolarHBondContact O-N 3.24Å; D109-T111 WeakPolarHBondContact OD2-CG2 3.41Å; T111-L113 PolarHBondContact O-N 2.03Å
112	V	82.1	Confident	71.4	Confident	46 Å²	46	107.6 Å²	107.6	28%	0.279	58%	0.582	S	S	.	*			trans	-57.5	116.9	176.5	176.7	0	0	0	0	107.3	Q110 K120 G123	Q110-V112 PolarHBondContact O-N 3.25Å; V112-K120 WeakPolarHBondContact O-CE 3.35Å; V112-K120 PolarHBondContact O-NZ 3.14Å; V112-G123 WeakPolarHBondContact CB-O 3.47Å; V112-G123 WeakPolarHBondContact CG1-O 3.02Å; V112-G123 WeakPolarHBondContact CG2-O 3.27Å
113	L	91.3	Very high	74.1	Confident	148 Å²	148	102.3 Å²	102.3	78%	0.775	56%	0.563	S	S	*	*			trans	-91.8	115.4	177.7	-66.6	180	0	0	0	107.7	T111	T111-L113 PolarHBondContact O-N 2.03Å
114	C	95	Very high	76.7	Confident	37 Å²	37	97.8 Å²	97.8	25%	0.25	53%	0.529	C	S	.	.	P	Polyproline II helix	trans	-83.3	139.6	174.5	-58.4	0	0	0	0	110.1	W118 K120 C125	C114-W118 HydrophobicContact CB-CB 3.96Å; C114-K120 VanDerWaalsContact SG-CB 3.55Å; C114-C125 WeakPolarHBondContact CA-SG 3.36Å; C114-C125 HydrophobicContact CB-CB 3.82Å; C114-C125 WeakPolarHBondContact CB-SG 3.4Å; C114-C125 VanDerWaalsContact SG-CA 3.52Å; C114-C125 WeakPolarHBondContact SG-CB 3.06Å; C114-C125 CovalentContact SG-SG 2.03Å; C114-C125 PolarHBondContact SG-SG 3.39Å
115	Q	92.3	Very high	79.4	Confident	113 Å²	113	93 Å²	93	53%	0.528	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-59.8	159.4	170.3	-66.9	174.6	-14	0	0	111	W118 Y231	Q115-W118 HydrophobicContact CB-CG 4.34Å; Q115-W118 WeakPolarHBondContact O-CB 3.48Å; Q115-W118 PolarHBondContact O-N 3.35Å; Q115-W118 VanDerWaalsContact O-N 3.12Å; Q115-Y231 PolarHBondContact N-OH 2.89Å; Q115-Y231 VanDerWaalsContact N-OH 3.14Å
116	S	89.9	Confident	81.9	Confident	106 Å²	106	88 Å²	88	74%	0.741	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	141.8	170.7	-177.6	0	0	0	0	110.3	W118	S116-W118 VanDerWaalsContact C-N 3.27Å; S116-W118 PolarHBondContact O-N 3.09Å
117	E	90.6	Very high	84.5	Confident	159 Å²	159	78.5 Å²	78.5	74%	0.743	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	-0.3	-173.3	-50.3	-60.7	116.6	0	0	116.6
118	W	96	Very high	86.8	Confident	19 Å²	19	75.3 Å²	75.3	7%	0.072	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-97.8	136.7	172.4	-66	67.2	0	0	0	111	C114 Q115 S116 C125 Y126 W127 C229 Y231	C114-W118 HydrophobicContact CB-CB 3.96Å; Q115-W118 HydrophobicContact CB-CG 4.34Å; Q115-W118 WeakPolarHBondContact O-CB 3.48Å; Q115-W118 PolarHBondContact O-N 3.35Å; Q115-W118 VanDerWaalsContact O-N 3.12Å; S116-W118 VanDerWaalsContact C-N 3.27Å; S116-W118 PolarHBondContact O-N 3.09Å; W118-C125 HydrophobicContact CB-CB 4.26Å; W118-C125 HydrophobicContact CD2-CB 4.45Å; W118-C125 HydrophobicContact CE3-CB 3.86Å; W118-Y126 CarbonylContact C-O 3.59Å; W118-Y126 WeakPolarHBondContact CA-O 3.44Å; W118-Y126 VanDerWaalsContact CE3-C 3.4Å; W118-W127 HydrophobicContact CD2-CB 3.5Å; W118-W127 HydrophobicContact CD2-CG 4.34Å; W118-W127 HydrophobicContact CE3-CB 3.51Å; W118-W127 HydrophobicContact CG-CB 4.2Å; W118-W127 HydrophobicContact CH2-CB 3.6Å; W118-W127 HydrophobicContact CZ2-CB 3.61Å; W118-W127 HydrophobicContact CZ2-CG 4.13Å; W118-W127 HydrophobicContact CZ3-CB 3.55Å; W118-C229 HydrophobicContact CH2-CB 3.73Å; W118-C229 HydrophobicContact CZ3-CB 4.13Å; W118-Y231 HydrophobicContact CD2-CD1 4.46Å; W118-Y231 AromaticContact CD2-CE1 3.59Å; W118-Y231 HydrophobicContact CD2-CE1 3.59Å; W118-Y231 AromaticContact CE2-CE1 3.79Å; W118-Y231 AromaticContact CE3-CD1 3.85Å; W118-Y231 HydrophobicContact CE3-CD1 3.85Å; W118-Y231 AromaticContact CE3-CE1 3.36Å; W118-Y231 HydrophobicContact CE3-CE1 3.36Å; W118-Y231 HydrophobicContact CG-CE1 4.44Å; W118-Y231 AromaticContact CH2-CD1 3.69Å; W118-Y231 HydrophobicContact CH2-CD1 3.69Å; W118-Y231 AromaticContact CH2-CE1 3.65Å; W118-Y231 HydrophobicContact CH2-CE1 3.65Å; W118-Y231 HydrophobicContact CZ2-CD1 4.29Å; W118-Y231 AromaticContact CZ2-CE1 3.83Å; W118-Y231 HydrophobicContact CZ2-CE1 3.83Å; W118-Y231 AromaticContact CZ3-CD1 3.44Å; W118-Y231 HydrophobicContact CZ3-CD1 3.44Å; W118-Y231 VanDerWaalsContact CZ3-CD1 3.44Å; W118-Y231 AromaticContact CZ3-CE1 3.41Å; W118-Y231 HydrophobicContact CZ3-CE1 3.41Å; W118-Y231 VanDerWaalsContact CZ3-CE1 3.41Å
119	L	95.9	Very high	89	Confident	70 Å²	70	71.8 Å²	71.8	37%	0.366	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	134.4	174.2	-59.4	-176.6	0	0	0	109.9	C125 Y126 F128 F160 N164	L119-C125 CarbonylContact O-C 3.47Å; L119-C125 WeakPolarHBondContact O-CA 3.15Å; L119-Y126 PolarHBondContact N-O 3.48Å; L119-Y126 WeakPolarHBondContact O-CD2 3.45Å; L119-Y126 PolarHBondContact O-N 3.12Å; L119-F128 HydrophobicContact CD1-CD2 4.26Å; L119-F128 HydrophobicContact CD1-CE2 3.82Å; L119-F128 HydrophobicContact CG-CE2 4.46Å; L119-F160 HydrophobicContact CB-CZ 4Å; L119-F160 HydrophobicContact CD1-CZ 4.45Å; L119-N164 HydrophobicContact CD1-CB 3.96Å; L119-N164 WeakPolarHBondContact CD1-OD1 3.49Å
120	K	95.6	Very high	91.2	Very high	110 Å²	110	72.6 Å²	72.6	48%	0.478	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	130.5	175.7	-172.6	171.8	175.3	171.6	0	110.8	V112 C114 K124	V112-K120 WeakPolarHBondContact O-CE 3.35Å; V112-K120 PolarHBondContact O-NZ 3.14Å; C114-K120 VanDerWaalsContact SG-CB 3.55Å; K120-K124 WeakPolarHBondContact CA-O 3.4Å
121	Y	95.8	Very high	93	Very high	58 Å²	58	69.4 Å²	69.4	23%	0.227	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	130.3	170.3	-179.9	-100.9	0	0	0	110.5	G123 K124 Y126 E157 F160	Y121-G123 PolarHBondContact O-N 3.46Å; Y121-G123 VanDerWaalsContact O-N 3.09Å; Y121-K124 PolarHBondContact N-O 2.97Å; Y121-K124 PolarHBondContact O-N 2.91Å; Y121-Y126 HydrophobicContact CD1-CE2 4.48Å; Y121-E157 HydrophobicContact CE1-CB 4.48Å; Y121-F160 HydrophobicContact CD1-CB 3.96Å; Y121-F160 AromaticContact CD1-CD1 3.87Å; Y121-F160 HydrophobicContact CD1-CD1 3.87Å; Y121-F160 HydrophobicContact CD1-CD2 4.31Å; Y121-F160 AromaticContact CD1-CG 3.76Å; Y121-F160 HydrophobicContact CD1-CG 3.76Å; Y121-F160 HydrophobicContact CD2-CB 4.14Å; Y121-F160 HydrophobicContact CD2-CD1 4.49Å; Y121-F160 AromaticContact CD2-CD2 3.48Å; Y121-F160 HydrophobicContact CD2-CD2 3.48Å; Y121-F160 VanDerWaalsContact CD2-CD2 3.48Å; Y121-F160 AromaticContact CD2-CE2 3.99Å; Y121-F160 HydrophobicContact CD2-CE2 3.99Å; Y121-F160 AromaticContact CD2-CG 3.77Å; Y121-F160 HydrophobicContact CD2-CG 3.77Å; Y121-F160 HydrophobicContact CE1-CB 3.84Å; Y121-F160 HydrophobicContact CE1-CG 4.17Å; Y121-F160 HydrophobicContact CE2-CB 4.03Å; Y121-F160 HydrophobicContact CE2-CD2 4.07Å; Y121-F160 HydrophobicContact CE2-CG 4.18Å; Y121-F160 HydrophobicContact CG-CB 4.1Å; Y121-F160 AromaticContact CG-CD1 3.82Å; Y121-F160 HydrophobicContact CG-CD1 3.82Å; Y121-F160 AromaticContact CG-CD2 3.61Å; Y121-F160 HydrophobicContact CG-CD2 3.61Å; Y121-F160 HydrophobicContact CG-CE1 4.16Å; Y121-F160 AromaticContact CG-CE2 3.96Å; Y121-F160 HydrophobicContact CG-CE2 3.96Å; Y121-F160 AromaticContact CG-CG 3.54Å; Y121-F160 HydrophobicContact CG-CG 3.54Å; Y121-F160 HydrophobicContact CG-CZ 4.22Å
122	Q	93.7	Very high	94.1	Very high	121 Å²	121	71.2 Å²	71.2	57%	0.565	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.2	42.2	179.9	-63.5	-166.2	35	0	0	115.3	K124	Q122-K124 VanDerWaalsContact C-N 3.26Å; Q122-K124 PolarHBondContact O-N 3.47Å
123	G	93.2	Very high	94.9	Very high	35 Å²	35	71.7 Å²	71.7	36%	0.361	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	5.1	178.8	0	0	0	0	0	115	V112 Y121	V112-G123 WeakPolarHBondContact CB-O 3.47Å; V112-G123 WeakPolarHBondContact CG1-O 3.02Å; V112-G123 WeakPolarHBondContact CG2-O 3.27Å; Y121-G123 PolarHBondContact O-N 3.46Å; Y121-G123 VanDerWaalsContact O-N 3.09Å
124	K	95.6	Very high	95.3	Very high	29 Å²	29	65.4 Å²	65.4	13%	0.126	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	158.4	170.7	-61.6	176	-166.2	166.1	0	111.1	K120 Y121 Q122 Y126 Q153 E157 Y231	K120-K124 WeakPolarHBondContact CA-O 3.4Å; Y121-K124 PolarHBondContact N-O 2.97Å; Y121-K124 PolarHBondContact O-N 2.91Å; Q122-K124 VanDerWaalsContact C-N 3.26Å; Q122-K124 PolarHBondContact O-N 3.47Å; K124-Y126 HydrophobicContact CB-CD2 4.49Å; K124-Y126 HydrophobicContact CB-CE2 3.63Å; K124-Y126 WeakPolarHBondContact CD-OH 3.43Å; K124-Q153 VanDerWaalsContact NZ-NE2 3.13Å; K124-E157 IonicContact NZ-OE1 2.75Å; K124-E157 PolarHBondContact NZ-OE1 2.91Å; K124-E157 IonicContact NZ-OE2 2.78Å; K124-E157 PolarHBondContact NZ-OE2 3.3Å; K124-Y231 WeakPolarHBondContact CA-O 3.49Å
125	C	97.2	Very high	95.4	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	135.3	174.9	-58.9	0	0	0	0	109.7	C114 W118 L119 Q230 Y231	C114-C125 WeakPolarHBondContact CA-SG 3.36Å; C114-C125 HydrophobicContact CB-CB 3.82Å; C114-C125 WeakPolarHBondContact CB-SG 3.4Å; C114-C125 VanDerWaalsContact SG-CA 3.52Å; C114-C125 WeakPolarHBondContact SG-CB 3.06Å; C114-C125 CovalentContact SG-SG 2.03Å; C114-C125 PolarHBondContact SG-SG 3.39Å; W118-C125 HydrophobicContact CB-CB 4.26Å; W118-C125 HydrophobicContact CD2-CB 4.45Å; W118-C125 HydrophobicContact CE3-CB 3.86Å; L119-C125 CarbonylContact O-C 3.47Å; L119-C125 WeakPolarHBondContact O-CA 3.15Å; C125-Q230 WeakPolarHBondContact O-CA 3.39Å; C125-Y231 HydrophobicContact CB-CD1 4.21Å; C125-Y231 HydrophobicContact CB-CD2 4.11Å; C125-Y231 HydrophobicContact CB-CE1 3.76Å; C125-Y231 HydrophobicContact CB-CE2 3.63Å; C125-Y231 HydrophobicContact CB-CG 4.37Å; C125-Y231 VanDerWaalsContact CB-CZ 3.43Å; C125-Y231 PolarHBondContact N-O 2.89Å; C125-Y231 PolarHBondContact O-N 2.77Å; C125-Y231 VanDerWaalsContact O-N 3.17Å; C125-Y231 VanDerWaalsContact SG-CE2 3.51Å
126	Y	97.8	Very high	95.7	Very high	1 Å²	1	62.3 Å²	62.3	0%	0.004	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	134.4	-177.5	-55	-97	0	0	0	111.5	W118 L119 Y121 K124 L150 E157 F160 I161 I228 C229 Q230	W118-Y126 CarbonylContact C-O 3.59Å; W118-Y126 WeakPolarHBondContact CA-O 3.44Å; W118-Y126 VanDerWaalsContact CE3-C 3.4Å; L119-Y126 PolarHBondContact N-O 3.48Å; L119-Y126 WeakPolarHBondContact O-CD2 3.45Å; L119-Y126 PolarHBondContact O-N 3.12Å; Y121-Y126 HydrophobicContact CD1-CE2 4.48Å; K124-Y126 HydrophobicContact CB-CD2 4.49Å; K124-Y126 HydrophobicContact CB-CE2 3.63Å; K124-Y126 WeakPolarHBondContact CD-OH 3.43Å; Y126-L150 HydrophobicContact CD1-CD1 3.81Å; Y126-L150 HydrophobicContact CE1-CD1 3.73Å; Y126-E157 PolarHBondContact OH-OE1 2.93Å; Y126-F160 HydrophobicContact CD1-CE1 4.44Å; Y126-F160 HydrophobicContact CD2-CD1 4.46Å; Y126-F160 AromaticContact CD2-CE1 3.54Å; Y126-F160 HydrophobicContact CD2-CE1 3.54Å; Y126-F160 HydrophobicContact CD2-CZ 4.14Å; Y126-F160 HydrophobicContact CE2-CD1 4.35Å; Y126-F160 AromaticContact CE2-CE1 3.81Å; Y126-F160 HydrophobicContact CE2-CE1 3.81Å; Y126-F160 AromaticContact CG-CE1 3.88Å; Y126-F160 HydrophobicContact CG-CE1 3.88Å; Y126-I161 HydrophobicContact CD1-CD1 3.71Å; Y126-I161 HydrophobicContact CE1-CD1 3.97Å; Y126-I161 HydrophobicContact CG-CD1 4.35Å; Y126-I228 HydrophobicContact CD1-CG2 4.46Å; Y126-C229 WeakPolarHBondContact CA-O 3.32Å; Y126-Q230 HydrophobicContact CD1-CB 3.97Å; Y126-Q230 HydrophobicContact CE1-CB 4.22Å
127	W	97.3	Very high	96.2	Very high	31 Å²	31	61.6 Å²	61.6	12%	0.117	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	130.2	175.2	-176.8	84.8	0	0	0	110.9	W118 Y141 W227 I228 C229	W118-W127 HydrophobicContact CD2-CB 3.5Å; W118-W127 HydrophobicContact CD2-CG 4.34Å; W118-W127 HydrophobicContact CE3-CB 3.51Å; W118-W127 HydrophobicContact CG-CB 4.2Å; W118-W127 HydrophobicContact CH2-CB 3.6Å; W118-W127 HydrophobicContact CZ2-CB 3.61Å; W118-W127 HydrophobicContact CZ2-CG 4.13Å; W118-W127 HydrophobicContact CZ3-CB 3.55Å; W127-Y141 HydrophobicContact CE3-CE1 4.07Å; W127-Y141 AromaticContact CH2-CE1 3.48Å; W127-Y141 HydrophobicContact CH2-CE1 3.48Å; W127-Y141 VanDerWaalsContact CH2-CE1 3.48Å; W127-Y141 AromaticContact CH2-CZ 3.62Å; W127-Y141 WeakPolarHBondContact CH2-OH 3.1Å; W127-Y141 HydrophobicContact CZ2-CE1 4.37Å; W127-Y141 HydrophobicContact CZ3-CD1 4.09Å; W127-Y141 AromaticContact CZ3-CE1 3.31Å; W127-Y141 HydrophobicContact CZ3-CE1 3.31Å; W127-Y141 AromaticContact CZ3-CZ 3.96Å; W127-W227 HydrophobicContact CH2-CZ2 4.21Å; W127-W227 AromaticContact CZ3-CE2 3.94Å; W127-W227 AromaticContact CZ3-CZ2 3.84Å; W127-W227 HydrophobicContact CZ3-CZ2 3.84Å; W127-W227 AromaticContact CZ3-NE1 3.88Å; W127-I228 VanDerWaalsContact O-CA 3.31Å; W127-I228 WeakPolarHBondContact O-CA 3.37Å; W127-C229 PolarHBondContact N-O 2.85Å; W127-C229 PolarHBondContact O-N 3.33Å
128	F	96	Very high	96.5	Very high	41 Å²	41	54 Å²	54	18%	0.18	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.5	-175.3	-66.4	-104.2	0	0	0	109.1	L119 I161 N164 L165 I228	L119-F128 HydrophobicContact CD1-CD2 4.26Å; L119-F128 HydrophobicContact CD1-CE2 3.82Å; L119-F128 HydrophobicContact CG-CE2 4.46Å; F128-I161 HydrophobicContact CE1-CG2 4.47Å; F128-I161 HydrophobicContact CZ-CD1 3.99Å; F128-N164 HydrophobicContact CE1-CB 4.08Å; F128-N164 HydrophobicContact CE2-CB 4.19Å; F128-N164 HydrophobicContact CZ-CB 3.69Å; F128-L165 HydrophobicContact CD1-CD2 3.92Å; F128-L165 HydrophobicContact CE1-CD2 3.92Å; F128-L165 HydrophobicContact CE1-CG 4.45Å; F128-I228 HydrophobicContact CD1-CD1 3.81Å; F128-I228 HydrophobicContact CD1-CG1 3.63Å; F128-I228 HydrophobicContact CE1-CD1 3.52Å; F128-I228 HydrophobicContact CE1-CG1 3.82Å; F128-I228 HydrophobicContact CG-CG1 4.26Å; F128-I228 HydrophobicContact CZ-CD1 4.31Å
129	S	95.5	Very high	96.7	Very high	5 Å²	5	56.7 Å²	56.7	4%	0.035	28%	0.284	C	S	.	.			trans	-70.5	143.6	-177.9	81.1	0	0	0	0	112.5	E131 K226 W227	S129-E131 PolarHBondContact OG-O 2.91Å; S129-K226 VanDerWaalsContact OG-CA 3.27Å; S129-K226 WeakPolarHBondContact OG-CA 3.45Å; S129-K226 WeakPolarHBondContact OG-CB 3.38Å; S129-W227 VanDerWaalsContact CB-CD2 3.41Å; S129-W227 VanDerWaalsContact CB-CE3 3.42Å; S129-W227 WeakPolarHBondContact CB-O 3.21Å; S129-W227 PolarHBondContact N-O 3.24Å; S129-W227 WeakPolarHBondContact OG-CZ3 3.36Å; S129-W227 PolarHBondContact OG-N 3.02Å; S129-W227 PolarHBondContact OG-O 3.19Å
130	N	93.5	Very high	96.8	Very high	143 Å²	143	56.8 Å²	56.8	77%	0.765	29%	0.287	S	S	*	.	S	Bend	trans	-93	-17.2	167.6	-68.5	-37.6	0	0	0	112.3
131	E	95.4	Very high	96.9	Very high	101 Å²	101	53.2 Å²	53.2	47%	0.472	27%	0.271	S	S	.	.	S	Bend	trans	-97	167.3	177	-66	173.2	-152	0	0	111.8	S129 K133 K226 W227	S129-E131 PolarHBondContact OG-O 2.91Å; E131-K133 VanDerWaalsContact OE2-CE 3.26Å; E131-K133 WeakPolarHBondContact OE2-CE 3.31Å; E131-K133 IonicContact OE2-NZ 3.2Å; E131-K133 PolarHBondContact OE2-NZ 2.81Å; E131-K226 WeakPolarHBondContact O-CG 3.41Å; E131-W227 HydrophobicContact CB-CH2 3.86Å; E131-W227 HydrophobicContact CB-CZ3 3.93Å; E131-W227 WeakPolarHBondContact O-CZ3 3.44Å
132	M	97.4	Very high	97.1	Very high	123 Å²	123	50.4 Å²	50.4	61%	0.606	26%	0.26	S	S	*	.			trans	-115	135.5	172	-64.8	-179.2	-81.3	0	0	110.1	V224 F225 K226	M132-V224 HydrophobicContact CB-CB 4.41Å; M132-F225 CarbonylContact C-O 3.58Å; M132-F225 VanDerWaalsContact CA-O 3.29Å; M132-F225 WeakPolarHBondContact CA-O 3.41Å; M132-K226 HydrophobicContact CG-CG 3.99Å
133	K	98.4	Very high	97.3	Very high	56 Å²	56	48.7 Å²	48.7	24%	0.243	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-145.7	164	-178	-72.2	-168.5	-162.4	-54.4	0	111.2	E131 D137 W172 V224 F225 W227	E131-K133 VanDerWaalsContact OE2-CE 3.26Å; E131-K133 WeakPolarHBondContact OE2-CE 3.31Å; E131-K133 IonicContact OE2-NZ 3.2Å; E131-K133 PolarHBondContact OE2-NZ 2.81Å; K133-D137 HydrophobicContact CB-CB 4Å; K133-D137 HydrophobicContact CD-CB 4Å; K133-D137 HydrophobicContact CG-CB 4.43Å; K133-W172 PolarHBondContact O-NE1 2.75Å; K133-V224 WeakPolarHBondContact O-CA 3.21Å; K133-F225 PolarHBondContact N-O 2.85Å; K133-F225 PolarHBondContact O-N 3.17Å; K133-W227 HydrophobicContact CB-CE3 4.08Å; K133-W227 HydrophobicContact CB-CH2 4.47Å; K133-W227 HydrophobicContact CB-CZ3 3.79Å; K133-W227 HydrophobicContact CD-CH2 3.71Å; K133-W227 HydrophobicContact CD-CZ2 4.34Å; K133-W227 HydrophobicContact CD-CZ3 3.91Å; K133-W227 HydrophobicContact CG-CE3 4.38Å; K133-W227 HydrophobicContact CG-CH2 3.92Å; K133-W227 HydrophobicContact CG-CZ3 3.6Å
134	S	98.7	Very high	97.5	Very high	16 Å²	16	54 Å²	54	11%	0.112	27%	0.27	C	S	.	.			trans	-63.2	159.8	168.8	75.9	0	0	0	0	110.3	S136 D137 S138 S223	S134-S136 PolarHBondContact O-N 3.4Å; S134-D137 PolarHBondContact O-N 2.98Å; S134-D137 WeakPolarHBondContact OG-CB 3.46Å; S134-D137 PolarHBondContact OG-N 2.78Å; S134-D137 VanDerWaalsContact OG-N 3.16Å; S134-D137 PolarHBondContact OG-OD2 2.54Å; S134-S138 WeakPolarHBondContact O-CB 3.48Å; S134-S138 PolarHBondContact O-N 3.2Å; S134-S138 PolarHBondContact O-OG 2.89Å; S134-S138 VanDerWaalsContact O-OG 3.07Å; S134-S223 WeakPolarHBondContact CA-O 3.37Å
135	W	98.6	Very high	97.5	Very high	19 Å²	19	57.6 Å²	57.6	7%	0.072	28%	0.283	C	S	.	.	H	α-helix	trans	-57.6	-41.9	178.9	-174.8	92.4	0	0	0	111.6	S138 Y139 L149 W172 M173 N176 V187 C208 C221	W135-S138 PolarHBondContact O-N 2.76Å; W135-Y139 HydrophobicContact CZ3-CG 4.48Å; W135-Y139 WeakPolarHBondContact O-CB 3.42Å; W135-Y139 PolarHBondContact O-N 3.13Å; W135-L149 HydrophobicContact CD2-CD1 4.28Å; W135-L149 HydrophobicContact CZ2-CD1 3.95Å; W135-W172 HydrophobicContact CB-CD2 4.11Å; W135-W172 HydrophobicContact CB-CE3 4.48Å; W135-W172 HydrophobicContact CB-CG 4.46Å; W135-W172 HydrophobicContact CB-CZ2 4.25Å; W135-W172 AromaticContact CD1-CD2 3.85Å; W135-W172 AromaticContact CD1-CE3 3.75Å; W135-W172 HydrophobicContact CG-CD2 4.42Å; W135-M173 PolarHBondContact NE1-O 2.83Å; W135-N176 HydrophobicContact CH2-CB 4.14Å; W135-N176 HydrophobicContact CZ2-CB 3.97Å; W135-V187 HydrophobicContact CH2-CG1 3.92Å; W135-V187 HydrophobicContact CZ2-CG1 3.78Å; W135-C208 HydrophobicContact CB-CB 3.97Å; W135-C208 HydrophobicContact CD2-CB 4.28Å; W135-C208 HydrophobicContact CG-CB 3.67Å; W135-C221 HydrophobicContact CB-CB 4.21Å; W135-C221 PolarHBondContact N-O 3.47Å
136	S	98.4	Very high	97.5	Very high	65 Å²	65	67 Å²	67	46%	0.455	32%	0.323	S	S	.	.	H	α-helix	trans	-65.1	-43.9	179.4	-57.2	0	0	0	0	112.3	S134 S138 Y139 V140	S134-S136 PolarHBondContact O-N 3.4Å; S136-S138 VanDerWaalsContact C-N 3.35Å; S136-Y139 WeakPolarHBondContact O-CB 3.48Å; S136-Y139 PolarHBondContact O-N 3.49Å; S136-V140 WeakPolarHBondContact O-CG2 3.42Å; S136-V140 PolarHBondContact O-N 3.1Å
137	D	98.7	Very high	97.5	Very high	92 Å²	92	67.2 Å²	67.2	49%	0.492	33%	0.326	S	S	.	.	H	α-helix	trans	-68.3	-37.4	178.1	-61.5	-36.9	0	0	0	111.3	K133 S134 Y139 V140 Y141	K133-D137 HydrophobicContact CB-CB 4Å; K133-D137 HydrophobicContact CD-CB 4Å; K133-D137 HydrophobicContact CG-CB 4.43Å; S134-D137 PolarHBondContact O-N 2.98Å; S134-D137 WeakPolarHBondContact OG-CB 3.46Å; S134-D137 PolarHBondContact OG-N 2.78Å; S134-D137 VanDerWaalsContact OG-N 3.16Å; S134-D137 PolarHBondContact OG-OD2 2.54Å; D137-Y139 VanDerWaalsContact C-N 3.32Å; D137-V140 PolarHBondContact O-N 2.98Å; D137-Y141 WeakPolarHBondContact O-CB 3.29Å; D137-Y141 PolarHBondContact O-N 2.84Å
138	S	98.7	Very high	97.5	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.7	-38.5	172.8	-66.8	0	0	0	0	112.1	S134 W135 S136 Y141 C142 W227	S134-S138 WeakPolarHBondContact O-CB 3.48Å; S134-S138 PolarHBondContact O-N 3.2Å; S134-S138 PolarHBondContact O-OG 2.89Å; S134-S138 VanDerWaalsContact O-OG 3.07Å; W135-S138 PolarHBondContact O-N 2.76Å; S136-S138 VanDerWaalsContact C-N 3.35Å; S138-Y141 PolarHBondContact O-N 2.69Å; S138-C142 PolarHBondContact O-N 3.12Å; S138-C142 VanDerWaalsContact O-N 3.14Å; S138-C142 PolarHBondContact O-SG 3.35Å; S138-C142 VanDerWaalsContact O-SG 3.35Å; S138-W227 VanDerWaalsContact CB-CG 3.45Å; S138-W227 VanDerWaalsContact OG-CD2 3.23Å; S138-W227 VanDerWaalsContact OG-CE3 3.24Å
139	Y	98.6	Very high	97.7	Very high	74 Å²	74	66.4 Å²	66.4	29%	0.29	32%	0.324	S	S	.	.	H	α-helix	trans	-61.6	-52.1	174.7	176	-107.9	0	0	0	111.6	W135 S136 D137 Y141 C142 L143 L149 V187	W135-Y139 HydrophobicContact CZ3-CG 4.48Å; W135-Y139 WeakPolarHBondContact O-CB 3.42Å; W135-Y139 PolarHBondContact O-N 3.13Å; S136-Y139 WeakPolarHBondContact O-CB 3.48Å; S136-Y139 PolarHBondContact O-N 3.49Å; D137-Y139 VanDerWaalsContact C-N 3.32Å; Y139-Y141 VanDerWaalsContact C-N 3.29Å; Y139-Y141 PolarHBondContact O-N 3.38Å; Y139-C142 PolarHBondContact O-N 3.16Å; Y139-L143 HydrophobicContact CD1-CD1 4Å; Y139-L143 HydrophobicContact CE1-CD1 3.43Å; Y139-L143 VanDerWaalsContact CE1-CD1 3.43Å; Y139-L143 HydrophobicContact CE1-CG 4.24Å; Y139-L143 HydrophobicContact CE2-CD1 4.32Å; Y139-L143 HydrophobicContact CE2-CD2 4.37Å; Y139-L143 HydrophobicContact CE2-CG 4.34Å; Y139-L143 WeakPolarHBondContact O-CG 3.42Å; Y139-L143 PolarHBondContact O-N 2.76Å; Y139-L143 VanDerWaalsContact O-N 3.12Å; Y139-L149 HydrophobicContact CD2-CD1 4.14Å; Y139-L149 HydrophobicContact CD2-CG 4.46Å; Y139-L149 HydrophobicContact CG-CD1 4.44Å; Y139-V187 HydrophobicContact CD2-CB 4.34Å; Y139-V187 HydrophobicContact CD2-CG1 3.68Å; Y139-V187 HydrophobicContact CE2-CB 3.87Å; Y139-V187 HydrophobicContact CE2-CG1 3.65Å
140	V	98.6	Very high	97.8	Very high	72 Å²	72	66.2 Å²	66.2	44%	0.436	32%	0.322	S	S	.	.	H	α-helix	trans	-57.9	-43.6	177	173.9	0	0	0	0	111	S136 D137 C142 L143 E144	S136-V140 WeakPolarHBondContact O-CG2 3.42Å; S136-V140 PolarHBondContact O-N 3.1Å; D137-V140 PolarHBondContact O-N 2.98Å; V140-C142 VanDerWaalsContact C-N 3.33Å; V140-C142 PolarHBondContact O-N 3.47Å; V140-L143 WeakPolarHBondContact O-CB 3.38Å; V140-L143 PolarHBondContact O-N 3.24Å; V140-L143 VanDerWaalsContact O-N 3.1Å; V140-E144 HydrophobicContact CG1-CG 4.38Å; V140-E144 WeakPolarHBondContact O-CG 3.49Å; V140-E144 PolarHBondContact O-N 2.9Å
141	Y	98.6	Very high	98	Very high	35 Å²	35	59.9 Å²	59.9	14%	0.137	29%	0.288	C	S	.	.	H	α-helix	trans	-57	-43.7	177.8	-173.4	-82.1	0	0	0	113.1	W127 D137 S138 Y139 R145 W227	W127-Y141 HydrophobicContact CE3-CE1 4.07Å; W127-Y141 AromaticContact CH2-CE1 3.48Å; W127-Y141 HydrophobicContact CH2-CE1 3.48Å; W127-Y141 VanDerWaalsContact CH2-CE1 3.48Å; W127-Y141 AromaticContact CH2-CZ 3.62Å; W127-Y141 WeakPolarHBondContact CH2-OH 3.1Å; W127-Y141 HydrophobicContact CZ2-CE1 4.37Å; W127-Y141 HydrophobicContact CZ3-CD1 4.09Å; W127-Y141 AromaticContact CZ3-CE1 3.31Å; W127-Y141 HydrophobicContact CZ3-CE1 3.31Å; W127-Y141 AromaticContact CZ3-CZ 3.96Å; D137-Y141 WeakPolarHBondContact O-CB 3.29Å; D137-Y141 PolarHBondContact O-N 2.84Å; S138-Y141 PolarHBondContact O-N 2.69Å; Y139-Y141 VanDerWaalsContact C-N 3.29Å; Y139-Y141 PolarHBondContact O-N 3.38Å; Y141-R145 VanDerWaalsContact CE1-CD 3.46Å; Y141-R145 PolarHBondContact O-N 2.64Å; Y141-R145 PolarHBondContact OH-NE 2.86Å; Y141-R145 PolarHBondContact OH-NH2 3.21Å; Y141-W227 AromaticContact CD1-CE2 3.82Å; Y141-W227 AromaticContact CD1-CZ2 3.5Å; Y141-W227 HydrophobicContact CD1-CZ2 3.5Å; Y141-W227 VanDerWaalsContact CD1-CZ2 3.5Å; Y141-W227 AromaticContact CD1-NE1 3.53Å; Y141-W227 HydrophobicContact CD2-CH2 4.49Å; Y141-W227 AromaticContact CD2-CZ2 3.85Å; Y141-W227 HydrophobicContact CD2-CZ2 3.85Å; Y141-W227 AromaticContact CE1-CZ2 3.71Å; Y141-W227 HydrophobicContact CE1-CZ2 3.71Å; Y141-W227 HydrophobicContact CE2-CZ2 4.03Å; Y141-W227 AromaticContact CG-CZ2 3.55Å; Y141-W227 HydrophobicContact CG-CZ2 3.55Å; Y141-W227 AromaticContact CZ-CZ2 3.95Å
142	C	98.4	Very high	97.9	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.7	-40.4	177.4	-62.2	0	0	0	0	111.2	S138 Y139 V140 E144 R145 K146 S147 C229	S138-C142 PolarHBondContact O-N 3.12Å; S138-C142 VanDerWaalsContact O-N 3.14Å; S138-C142 PolarHBondContact O-SG 3.35Å; S138-C142 VanDerWaalsContact O-SG 3.35Å; Y139-C142 PolarHBondContact O-N 3.16Å; V140-C142 VanDerWaalsContact C-N 3.33Å; V140-C142 PolarHBondContact O-N 3.47Å; C142-E144 PolarHBondContact O-N 3.16Å; C142-R145 CarbonylContact O-C 3.4Å; C142-R145 PolarHBondContact O-N 2.83Å; C142-R145 VanDerWaalsContact O-N 3.1Å; C142-K146 PolarHBondContact O-N 3.49Å; C142-S147 CarbonylContact C-O 3.54Å; C142-S147 WeakPolarHBondContact CA-OG 3.46Å; C142-S147 CarbonylContact O-C 3.58Å; C142-S147 WeakPolarHBondContact O-CA 3.26Å; C142-S147 PolarHBondContact O-N 3.4Å; C142-S147 PolarHBondContact O-OG 3.23Å; C142-C229 WeakPolarHBondContact CA-SG 3.45Å; C142-C229 HydrophobicContact CB-CB 3.83Å; C142-C229 WeakPolarHBondContact CB-SG 3.48Å; C142-C229 WeakPolarHBondContact SG-CA 3.24Å; C142-C229 WeakPolarHBondContact SG-CB 3.26Å; C142-C229 CovalentContact SG-SG 2.04Å; C142-C229 PolarHBondContact SG-SG 3.18Å
143	L	98.2	Very high	97.7	Very high	84 Å²	84	54.7 Å²	54.7	44%	0.44	26%	0.262	S	S	.	.	H	α-helix	trans	-61.4	-43	178.2	-68.6	-177.2	0	0	0	112.6	Y139 V140 R145 K146 S147	Y139-L143 HydrophobicContact CD1-CD1 4Å; Y139-L143 HydrophobicContact CE1-CD1 3.43Å; Y139-L143 VanDerWaalsContact CE1-CD1 3.43Å; Y139-L143 HydrophobicContact CE1-CG 4.24Å; Y139-L143 HydrophobicContact CE2-CD1 4.32Å; Y139-L143 HydrophobicContact CE2-CD2 4.37Å; Y139-L143 HydrophobicContact CE2-CG 4.34Å; Y139-L143 WeakPolarHBondContact O-CG 3.42Å; Y139-L143 PolarHBondContact O-N 2.76Å; Y139-L143 VanDerWaalsContact O-N 3.12Å; V140-L143 WeakPolarHBondContact O-CB 3.38Å; V140-L143 PolarHBondContact O-N 3.24Å; V140-L143 VanDerWaalsContact O-N 3.1Å; L143-R145 PolarHBondContact O-N 2.88Å; L143-R145 VanDerWaalsContact O-N 3.13Å; L143-K146 PolarHBondContact O-N 2.75Å; L143-S147 WeakPolarHBondContact CA-O 3.34Å; L143-S147 PolarHBondContact N-O 2.92Å
144	E	97.9	Very high	97.4	Very high	148 Å²	148	54.5 Å²	54.5	69%	0.692	26%	0.264	S	S	*	.	H	α-helix	trans	-58.8	-26.4	176.5	-71.8	176.6	169.7	0	0	112.5	V140 C142 K146	V140-E144 HydrophobicContact CG1-CG 4.38Å; V140-E144 WeakPolarHBondContact O-CG 3.49Å; V140-E144 PolarHBondContact O-N 2.9Å; C142-E144 PolarHBondContact O-N 3.16Å; E144-K146 VanDerWaalsContact C-N 3.34Å
145	R	95.9	Very high	97	Very high	103 Å²	103	61 Å²	61	39%	0.389	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	13.7	176.3	-67.7	177.3	172.3	-94.6	0.8	113.8	Y141 C142 L143 S147	Y141-R145 VanDerWaalsContact CE1-CD 3.46Å; Y141-R145 PolarHBondContact O-N 2.64Å; Y141-R145 PolarHBondContact OH-NE 2.86Å; Y141-R145 PolarHBondContact OH-NH2 3.21Å; C142-R145 CarbonylContact O-C 3.4Å; C142-R145 PolarHBondContact O-N 2.83Å; C142-R145 VanDerWaalsContact O-N 3.1Å; L143-R145 PolarHBondContact O-N 2.88Å; L143-R145 VanDerWaalsContact O-N 3.13Å; R145-S147 PolarHBondContact O-N 3.22Å
146	K	96.6	Very high	96.8	Very high	197 Å²	197	65.2 Å²	65.2	86%	0.857	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	36.9	-176.1	-53.8	179	-179.5	178.6	0	112.1	C142 L143 E144	C142-K146 PolarHBondContact O-N 3.49Å; L143-K146 PolarHBondContact O-N 2.75Å; E144-K146 VanDerWaalsContact C-N 3.34Å
147	S	97.6	Very high	96.6	Very high	7 Å²	7	62.3 Å²	62.3	5%	0.049	30%	0.295	C	S	.	.			trans	-133.1	-178.6	-179.6	69.7	0	0	0	0	108.9	C142 L143 R145 C229 Q230	C142-S147 CarbonylContact C-O 3.54Å; C142-S147 WeakPolarHBondContact CA-OG 3.46Å; C142-S147 CarbonylContact O-C 3.58Å; C142-S147 WeakPolarHBondContact O-CA 3.26Å; C142-S147 PolarHBondContact O-N 3.4Å; C142-S147 PolarHBondContact O-OG 3.23Å; L143-S147 WeakPolarHBondContact CA-O 3.34Å; L143-S147 PolarHBondContact N-O 2.92Å; R145-S147 PolarHBondContact O-N 3.22Å; S147-C229 WeakPolarHBondContact OG-CB 3.5Å; S147-Q230 WeakPolarHBondContact CA-O 3.44Å; S147-Q230 VanDerWaalsContact CB-O 3.29Å; S147-Q230 WeakPolarHBondContact CB-O 3.22Å
148	H	98.4	Very high	96.3	Very high	55 Å²	55	58.6 Å²	58.6	26%	0.255	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	165.8	174.5	60.4	86.2	0	0	0	110.7	V187 C229 Q230	H148-V187 HydrophobicContact CB-CG2 4.16Å; H148-C229 CarbonylContact O-C 3.54Å; H148-C229 VanDerWaalsContact O-CA 3.26Å; H148-C229 WeakPolarHBondContact O-CA 3.47Å; H148-Q230 VanDerWaalsContact CE1-CD 3.48Å; H148-Q230 WeakPolarHBondContact CE1-CG 3.31Å; H148-Q230 PolarHBondContact CE1-NE2 3.5Å; H148-Q230 PolarHBondContact N-O 3.07Å; H148-Q230 PolarHBondContact O-N 3.38Å
149	L	98.5	Very high	96.1	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	148.5	173.1	-76.8	171	0	0	0	110.8	W135 Y139 I151 V187 W227 I228	W135-L149 HydrophobicContact CD2-CD1 4.28Å; W135-L149 HydrophobicContact CZ2-CD1 3.95Å; Y139-L149 HydrophobicContact CD2-CD1 4.14Å; Y139-L149 HydrophobicContact CD2-CG 4.46Å; Y139-L149 HydrophobicContact CG-CD1 4.44Å; L149-I151 PolarHBondContact O-N 3.35Å; L149-V187 HydrophobicContact CB-CG1 4.35Å; L149-V187 HydrophobicContact CB-CG2 4.4Å; L149-V187 WeakPolarHBondContact O-CG2 3.48Å; L149-W227 HydrophobicContact CD2-CB 3.95Å; L149-W227 HydrophobicContact CD2-CG 4.22Å; L149-I228 WeakPolarHBondContact CA-O 3.32Å
150	L	98.2	Very high	95.9	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.289	C	S	.	.			trans	-46.2	126	-178.2	177.3	76	0	0	0	113.2	Y126 I152 I161 M173 G174 I211 I228	Y126-L150 HydrophobicContact CD1-CD1 3.81Å; Y126-L150 HydrophobicContact CE1-CD1 3.73Å; L150-I152 HydrophobicContact CD1-CG1 4.37Å; L150-I152 HydrophobicContact CD2-CD1 4Å; L150-I152 HydrophobicContact CD2-CG1 3.84Å; L150-I152 HydrophobicContact CG-CG1 3.89Å; L150-I161 HydrophobicContact CD1-CD1 3.6Å; L150-I161 HydrophobicContact CD1-CG1 3.9Å; L150-I161 HydrophobicContact CD2-CD1 4.24Å; L150-I161 HydrophobicContact CD2-CG1 4.02Å; L150-I161 HydrophobicContact CD2-CG2 4.1Å; L150-M173 HydrophobicContact CB-CB 4.28Å; L150-M173 HydrophobicContact CD2-CB 4.22Å; L150-G174 WeakPolarHBondContact O-CA 3.23Å; L150-G174 PolarHBondContact O-N 3.21Å; L150-I211 HydrophobicContact CD2-CD1 3.55Å; L150-I228 HydrophobicContact CB-CB 3.95Å; L150-I228 HydrophobicContact CB-CG2 4.01Å; L150-I228 HydrophobicContact CD1-CG2 4.07Å; L150-I228 HydrophobicContact CD2-CB 4.31Å; L150-I228 HydrophobicContact CD2-CD1 3.92Å; L150-I228 HydrophobicContact CD2-CG2 4.45Å; L150-I228 HydrophobicContact CG-CG2 4.42Å; L150-I228 PolarHBondContact N-O 3.16Å
151	I	97.3	Very high	95.7	Very high	10 Å²	10	55.6 Å²	55.6	5%	0.051	27%	0.268	C	S	.	.			trans	-114.8	113.1	170.2	-60.7	178.7	0	0	0	106.8	L149 W186 V187 D188 Q230	L149-I151 PolarHBondContact O-N 3.35Å; I151-W186 HydrophobicContact CB-CE3 4.09Å; I151-W186 HydrophobicContact CB-CZ3 4.47Å; I151-W186 HydrophobicContact CD1-CB 4.33Å; I151-W186 HydrophobicContact CG1-CB 4.45Å; I151-W186 HydrophobicContact CG1-CE3 4.02Å; I151-W186 HydrophobicContact CG2-CD2 3.82Å; I151-W186 HydrophobicContact CG2-CE3 3.86Å; I151-W186 HydrophobicContact CG2-CG 4.13Å; I151-W186 HydrophobicContact CG2-CZ3 4.36Å; I151-V187 HydrophobicContact CD1-CG2 3.85Å; I151-V187 HydrophobicContact CG1-CG2 3.86Å; I151-D188 HydrophobicContact CD1-CB 3.72Å; I151-Q230 PolarHBondContact O-OE1 2.57Å
152	I	94.9	Very high	95.3	Very high	3 Å²	3	55.6 Å²	55.6	2%	0.015	27%	0.269	C	S	.	.			trans	-89.3	126.8	178.6	-54.5	-174.1	0	0	0	108.9	L150 D154 E157 M158 M173 W186 F197 I211	L150-I152 HydrophobicContact CD1-CG1 4.37Å; L150-I152 HydrophobicContact CD2-CD1 4Å; L150-I152 HydrophobicContact CD2-CG1 3.84Å; L150-I152 HydrophobicContact CG-CG1 3.89Å; I152-D154 VanDerWaalsContact CG2-O 3.31Å; I152-D154 WeakPolarHBondContact CG2-O 3.38Å; I152-E157 WeakPolarHBondContact CA-OE2 3.21Å; I152-E157 HydrophobicContact CG2-CB 4.24Å; I152-E157 HydrophobicContact CG2-CG 4.3Å; I152-M158 HydrophobicContact CD1-CB 4.44Å; I152-M158 HydrophobicContact CD1-CE 3.49Å; I152-M158 VanDerWaalsContact CD1-CE 3.49Å; I152-M158 HydrophobicContact CD1-SD 3.62Å; I152-M158 HydrophobicContact CG2-CB 4.08Å; I152-M173 HydrophobicContact CB-CE 4.25Å; I152-M173 HydrophobicContact CD1-CE 3.4Å; I152-M173 HydrophobicContact CG1-CE 3.57Å; I152-W186 HydrophobicContact CB-CH2 4.21Å; I152-W186 WeakPolarHBondContact O-CZ2 3.48Å; I152-F197 HydrophobicContact CB-CE2 4.03Å; I152-F197 HydrophobicContact CB-CZ 4.06Å; I152-F197 HydrophobicContact CG2-CE1 4.16Å; I152-F197 HydrophobicContact CG2-CE2 3.77Å; I152-F197 HydrophobicContact CG2-CZ 3.31Å; I152-F197 WeakPolarHBondContact O-CE2 3.43Å; I152-I211 HydrophobicContact CD1-CD1 3.8Å
153	Q	92.3	Very high	95	Very high	112 Å²	112	64.2 Å²	64.2	52%	0.523	31%	0.307	S	S	.	.			trans	-98	-33.7	-178.7	-66.6	174.4	-11.7	0	0	112.4	K124 E157	K124-Q153 VanDerWaalsContact NZ-NE2 3.13Å; Q153-E157 WeakPolarHBondContact CB-OE2 3.44Å; Q153-E157 PolarHBondContact N-OE2 3.37Å
154	D	91.8	Very high	94.7	Very high	52 Å²	52	62.7 Å²	62.7	28%	0.278	30%	0.299	S	S	.	.	S	Bend	trans	-152	174.5	-175.7	63.6	48.5	0	0	0	113.4	I152 L156 E157 M158	I152-D154 VanDerWaalsContact CG2-O 3.31Å; I152-D154 WeakPolarHBondContact CG2-O 3.38Å; D154-L156 VanDerWaalsContact C-N 3.28Å; D154-L156 PolarHBondContact O-N 2.79Å; D154-L156 WeakPolarHBondContact OD1-CA 3.39Å; D154-L156 VanDerWaalsContact OD1-CB 3.31Å; D154-L156 WeakPolarHBondContact OD1-CB 3.45Å; D154-L156 PolarHBondContact OD1-N 3.42Å; D154-E157 PolarHBondContact O-N 3.04Å; D154-E157 PolarHBondContact OD1-N 3.31Å; D154-M158 PolarHBondContact O-N 3.48Å
155	E	90.9	Very high	94.2	Very high	152 Å²	152	57 Å²	57	71%	0.71	27%	0.273	S	S	*	.	H	α-helix	trans	-67	-26.5	179.8	-64	-171	160.6	0	0	113.3	M158 A159	E155-M158 PolarHBondContact O-N 3.46Å; E155-A159 WeakPolarHBondContact O-CB 3.28Å; E155-A159 PolarHBondContact O-N 3.34Å
156	L	93.6	Very high	93.1	Very high	108 Å²	108	64 Å²	64	57%	0.565	30%	0.3	S	S	*	.	H	α-helix	trans	-72.7	-42.2	178.7	-62.5	176.5	0	0	0	110.6	D154 M158 A159 F160	D154-L156 VanDerWaalsContact C-N 3.28Å; D154-L156 PolarHBondContact O-N 2.79Å; D154-L156 WeakPolarHBondContact OD1-CA 3.39Å; D154-L156 VanDerWaalsContact OD1-CB 3.31Å; D154-L156 WeakPolarHBondContact OD1-CB 3.45Å; D154-L156 PolarHBondContact OD1-N 3.42Å; L156-M158 VanDerWaalsContact C-N 3.35Å; L156-A159 PolarHBondContact O-N 3.1Å; L156-F160 PolarHBondContact O-N 2.87Å
157	E	95.1	Very high	91.9	Very high	4 Å²	4	59.3 Å²	59.3	2%	0.019	28%	0.281	C	S	.	.	H	α-helix	trans	-61.5	-44.4	170.5	-175	167.4	-141.3	0	0	110.2	Y121 K124 Y126 I152 Q153 D154 A159 F160 I161	Y121-E157 HydrophobicContact CE1-CB 4.48Å; K124-E157 IonicContact NZ-OE1 2.75Å; K124-E157 PolarHBondContact NZ-OE1 2.91Å; K124-E157 IonicContact NZ-OE2 2.78Å; K124-E157 PolarHBondContact NZ-OE2 3.3Å; Y126-E157 PolarHBondContact OH-OE1 2.93Å; I152-E157 WeakPolarHBondContact CA-OE2 3.21Å; I152-E157 HydrophobicContact CG2-CB 4.24Å; I152-E157 HydrophobicContact CG2-CG 4.3Å; Q153-E157 WeakPolarHBondContact CB-OE2 3.44Å; Q153-E157 PolarHBondContact N-OE2 3.37Å; D154-E157 PolarHBondContact O-N 3.04Å; D154-E157 PolarHBondContact OD1-N 3.31Å; E157-A159 VanDerWaalsContact C-N 3.35Å; E157-A159 PolarHBondContact O-N 3.44Å; E157-F160 WeakPolarHBondContact O-CB 3.45Å; E157-F160 PolarHBondContact O-N 2.89Å; E157-I161 VanDerWaalsContact O-CG1 3.32Å; E157-I161 WeakPolarHBondContact O-CG1 3.35Å; E157-I161 PolarHBondContact O-N 3.44Å
158	M	93.2	Very high	90.7	Very high	14 Å²	14	62.9 Å²	62.9	7%	0.069	31%	0.306	C	S	.	.	H	α-helix	trans	-57.5	-47.1	173.8	180	74.8	-74.1	0	0	111.6	I152 D154 E155 L156 F160 I161 Q162 F197 I211	I152-M158 HydrophobicContact CD1-CB 4.44Å; I152-M158 HydrophobicContact CD1-CE 3.49Å; I152-M158 VanDerWaalsContact CD1-CE 3.49Å; I152-M158 HydrophobicContact CD1-SD 3.62Å; I152-M158 HydrophobicContact CG2-CB 4.08Å; D154-M158 PolarHBondContact O-N 3.48Å; E155-M158 PolarHBondContact O-N 3.46Å; L156-M158 VanDerWaalsContact C-N 3.35Å; M158-F160 VanDerWaalsContact C-N 3.34Å; M158-F160 PolarHBondContact O-N 3.35Å; M158-I161 HydrophobicContact CE-CB 3.9Å; M158-I161 HydrophobicContact CE-CG2 3.95Å; M158-I161 PolarHBondContact O-N 3.05Å; M158-Q162 HydrophobicContact CE-CG 4.02Å; M158-Q162 VanDerWaalsContact CE-NE2 3.29Å; M158-Q162 WeakPolarHBondContact O-CG 3.41Å; M158-Q162 PolarHBondContact O-N 3.26Å; M158-F197 HydrophobicContact CB-CE1 4.44Å; M158-I211 HydrophobicContact CE-CD1 3.9Å; M158-I211 HydrophobicContact CE-CG1 4.26Å; M158-I211 HydrophobicContact CE-CG2 3.78Å; M158-I211 HydrophobicContact SD-CG2 4.44Å
159	A	92.8	Very high	90.2	Very high	55 Å²	55	64.5 Å²	64.5	46%	0.455	32%	0.316	S	S	.	.	H	α-helix	trans	-62.4	-39.9	178.3	0	0	0	0	0	112.4	E155 L156 E157 Q162 K163	E155-A159 WeakPolarHBondContact O-CB 3.28Å; E155-A159 PolarHBondContact O-N 3.34Å; L156-A159 PolarHBondContact O-N 3.1Å; E157-A159 VanDerWaalsContact C-N 3.35Å; E157-A159 PolarHBondContact O-N 3.44Å; A159-Q162 PolarHBondContact O-N 3.47Å; A159-K163 WeakPolarHBondContact O-CB 3.47Å; A159-K163 PolarHBondContact O-N 2.93Å
160	F	94.6	Very high	90.1	Very high	28 Å²	28	67.1 Å²	67.1	12%	0.123	33%	0.326	C	S	.	.	H	α-helix	trans	-60	-47	173.4	167.6	-99.4	0	0	0	111.5	L119 Y121 Y126 L156 E157 M158 Q162 K163 N164	L119-F160 HydrophobicContact CB-CZ 4Å; L119-F160 HydrophobicContact CD1-CZ 4.45Å; Y121-F160 HydrophobicContact CD1-CB 3.96Å; Y121-F160 AromaticContact CD1-CD1 3.87Å; Y121-F160 HydrophobicContact CD1-CD1 3.87Å; Y121-F160 HydrophobicContact CD1-CD2 4.31Å; Y121-F160 AromaticContact CD1-CG 3.76Å; Y121-F160 HydrophobicContact CD1-CG 3.76Å; Y121-F160 HydrophobicContact CD2-CB 4.14Å; Y121-F160 HydrophobicContact CD2-CD1 4.49Å; Y121-F160 AromaticContact CD2-CD2 3.48Å; Y121-F160 HydrophobicContact CD2-CD2 3.48Å; Y121-F160 VanDerWaalsContact CD2-CD2 3.48Å; Y121-F160 AromaticContact CD2-CE2 3.99Å; Y121-F160 HydrophobicContact CD2-CE2 3.99Å; Y121-F160 AromaticContact CD2-CG 3.77Å; Y121-F160 HydrophobicContact CD2-CG 3.77Å; Y121-F160 HydrophobicContact CE1-CB 3.84Å; Y121-F160 HydrophobicContact CE1-CG 4.17Å; Y121-F160 HydrophobicContact CE2-CB 4.03Å; Y121-F160 HydrophobicContact CE2-CD2 4.07Å; Y121-F160 HydrophobicContact CE2-CG 4.18Å; Y121-F160 HydrophobicContact CG-CB 4.1Å; Y121-F160 AromaticContact CG-CD1 3.82Å; Y121-F160 HydrophobicContact CG-CD1 3.82Å; Y121-F160 AromaticContact CG-CD2 3.61Å; Y121-F160 HydrophobicContact CG-CD2 3.61Å; Y121-F160 HydrophobicContact CG-CE1 4.16Å; Y121-F160 AromaticContact CG-CE2 3.96Å; Y121-F160 HydrophobicContact CG-CE2 3.96Å; Y121-F160 AromaticContact CG-CG 3.54Å; Y121-F160 HydrophobicContact CG-CG 3.54Å; Y121-F160 HydrophobicContact CG-CZ 4.22Å; Y126-F160 HydrophobicContact CD1-CE1 4.44Å; Y126-F160 HydrophobicContact CD2-CD1 4.46Å; Y126-F160 AromaticContact CD2-CE1 3.54Å; Y126-F160 HydrophobicContact CD2-CE1 3.54Å; Y126-F160 HydrophobicContact CD2-CZ 4.14Å; Y126-F160 HydrophobicContact CE2-CD1 4.35Å; Y126-F160 AromaticContact CE2-CE1 3.81Å; Y126-F160 HydrophobicContact CE2-CE1 3.81Å; Y126-F160 AromaticContact CG-CE1 3.88Å; Y126-F160 HydrophobicContact CG-CE1 3.88Å; L156-F160 PolarHBondContact O-N 2.87Å; E157-F160 WeakPolarHBondContact O-CB 3.45Å; E157-F160 PolarHBondContact O-N 2.89Å; M158-F160 VanDerWaalsContact C-N 3.34Å; M158-F160 PolarHBondContact O-N 3.35Å; F160-Q162 PolarHBondContact O-N 2.04Å; F160-K163 PolarHBondContact O-N 3.19Å; F160-N164 WeakPolarHBondContact CD2-ND2 3.08Å; F160-N164 WeakPolarHBondContact CE2-ND2 3.5Å; F160-N164 PolarHBondContact O-N 3.14Å; F160-N164 PolarHBondContact O-ND2 3.46Å
161	I	94.6	Very high	90	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-59.5	-49.7	177.4	-65.2	-57.4	0	0	0	110.3	Y126 F128 L150 E157 M158 K163 N164 L165 I211 I228	Y126-I161 HydrophobicContact CD1-CD1 3.71Å; Y126-I161 HydrophobicContact CE1-CD1 3.97Å; Y126-I161 HydrophobicContact CG-CD1 4.35Å; F128-I161 HydrophobicContact CE1-CG2 4.47Å; F128-I161 HydrophobicContact CZ-CD1 3.99Å; L150-I161 HydrophobicContact CD1-CD1 3.6Å; L150-I161 HydrophobicContact CD1-CG1 3.9Å; L150-I161 HydrophobicContact CD2-CD1 4.24Å; L150-I161 HydrophobicContact CD2-CG1 4.02Å; L150-I161 HydrophobicContact CD2-CG2 4.1Å; E157-I161 VanDerWaalsContact O-CG1 3.32Å; E157-I161 WeakPolarHBondContact O-CG1 3.35Å; E157-I161 PolarHBondContact O-N 3.44Å; M158-I161 HydrophobicContact CE-CB 3.9Å; M158-I161 HydrophobicContact CE-CG2 3.95Å; M158-I161 PolarHBondContact O-N 3.05Å; I161-K163 VanDerWaalsContact C-N 3.34Å; I161-K163 PolarHBondContact O-N 3.46Å; I161-N164 PolarHBondContact O-N 2.9Å; I161-N164 VanDerWaalsContact O-N 3.08Å; I161-L165 HydrophobicContact CG2-CD1 4.23Å; I161-L165 HydrophobicContact CG2-CG 4.32Å; I161-L165 WeakPolarHBondContact O-CG 3.46Å; I161-L165 PolarHBondContact O-N 2.96Å; I161-L165 VanDerWaalsContact O-N 3.07Å; I161-I211 HydrophobicContact CG2-CD1 4.26Å; I161-I228 HydrophobicContact CD1-CD1 4.42Å; I161-I228 HydrophobicContact CG2-CD1 3.54Å
162	Q	91	Very high	90.1	Very high	36 Å²	36	66.9 Å²	66.9	17%	0.168	33%	0.326	C	S	.	.	H	α-helix	trans	-56.8	-45.1	179.1	-68.9	-60.1	-41.1	0	0	113.2	M158 A159 F160 N164 L165 S214	M158-Q162 HydrophobicContact CE-CG 4.02Å; M158-Q162 VanDerWaalsContact CE-NE2 3.29Å; M158-Q162 WeakPolarHBondContact O-CG 3.41Å; M158-Q162 PolarHBondContact O-N 3.26Å; A159-Q162 PolarHBondContact O-N 3.47Å; F160-Q162 PolarHBondContact O-N 2.04Å; Q162-N164 PolarHBondContact O-N 2.93Å; Q162-N164 VanDerWaalsContact O-N 3.17Å; Q162-L165 PolarHBondContact O-N 3.47Å; Q162-L165 VanDerWaalsContact O-N 3.13Å; Q162-S214 VanDerWaalsContact CD-CA 3.47Å; Q162-S214 WeakPolarHBondContact CG-OG 3.47Å; Q162-S214 VanDerWaalsContact OE1-N 3.09Å
163	K	91.7	Very high	90.2	Very high	181 Å²	181	66.8 Å²	66.8	79%	0.787	33%	0.325	S	S	*	.	H	α-helix	trans	-58.5	-30.9	-179.9	-178.3	179.9	175.5	-176.6	0	112.4	A159 F160 I161	A159-K163 WeakPolarHBondContact O-CB 3.47Å; A159-K163 PolarHBondContact O-N 2.93Å; F160-K163 PolarHBondContact O-N 3.19Å; I161-K163 VanDerWaalsContact C-N 3.34Å; I161-K163 PolarHBondContact O-N 3.46Å
164	N	91.6	Very high	90.5	Very high	51 Å²	51	61.4 Å²	61.4	27%	0.273	30%	0.3	S	S	.	.	H	α-helix	trans	-96.6	-7.3	-177.8	-67.5	-74.7	0	0	0	113.5	L119 F128 F160 I161 Q162 R166	L119-N164 HydrophobicContact CD1-CB 3.96Å; L119-N164 WeakPolarHBondContact CD1-OD1 3.49Å; F128-N164 HydrophobicContact CE1-CB 4.08Å; F128-N164 HydrophobicContact CE2-CB 4.19Å; F128-N164 HydrophobicContact CZ-CB 3.69Å; F160-N164 WeakPolarHBondContact CD2-ND2 3.08Å; F160-N164 WeakPolarHBondContact CE2-ND2 3.5Å; F160-N164 PolarHBondContact O-N 3.14Å; F160-N164 PolarHBondContact O-ND2 3.46Å; I161-N164 PolarHBondContact O-N 2.9Å; I161-N164 VanDerWaalsContact O-N 3.08Å; Q162-N164 PolarHBondContact O-N 2.93Å; Q162-N164 VanDerWaalsContact O-N 3.17Å; N164-R166 PolarHBondContact O-N 3.38Å
165	L	88	Confident	90.8	Very high	30 Å²	30	59 Å²	59	16%	0.157	29%	0.287	C	S	.	.			trans	-73.5	107	169.1	-70.7	-179.9	0	0	0	109.6	F128 I161 Q162 Q167 V171 I211 I228	F128-L165 HydrophobicContact CD1-CD2 3.92Å; F128-L165 HydrophobicContact CE1-CD2 3.92Å; F128-L165 HydrophobicContact CE1-CG 4.45Å; I161-L165 HydrophobicContact CG2-CD1 4.23Å; I161-L165 HydrophobicContact CG2-CG 4.32Å; I161-L165 WeakPolarHBondContact O-CG 3.46Å; I161-L165 PolarHBondContact O-N 2.96Å; I161-L165 VanDerWaalsContact O-N 3.07Å; Q162-L165 PolarHBondContact O-N 3.47Å; Q162-L165 VanDerWaalsContact O-N 3.13Å; L165-Q167 PolarHBondContact O-N 3.27Å; L165-V171 HydrophobicContact CD1-CG2 4.27Å; L165-V171 HydrophobicContact CD2-CB 4.32Å; L165-V171 HydrophobicContact CD2-CG1 4.31Å; L165-V171 HydrophobicContact CD2-CG2 3.67Å; L165-I211 HydrophobicContact CD1-CG2 4.14Å; L165-I228 HydrophobicContact CD2-CD1 4.14Å
166	R	71.5	Confident	91.1	Very high	249 Å²	249	53.7 Å²	53.7	94%	0.94	26%	0.264	S	S	*	.			trans	-69.7	-9.8	-179.4	-63.5	-172.3	176.1	-170	0	114.3	N164	N164-R166 PolarHBondContact O-N 3.38Å
167	Q	72	Confident	91.2	Very high	98 Å²	98	50 Å²	50	46%	0.458	24%	0.243	S	C	.	.	S	Bend	trans	-143.4	146	-171.8	-66.5	174.5	-16.7	0	0	110.4	L165 N169	L165-Q167 PolarHBondContact O-N 3.27Å; Q167-N169 HydrophobicContact CB-CB 4.41Å; Q167-N169 PolarHBondContact O-N 3.08Å; Q167-N169 PolarHBondContact OE1-ND2 2.85Å; Q167-N169 VanDerWaalsContact OE1-ND2 3.07Å
168	S	73.9	Confident	91	Very high	82 Å²	82	51.4 Å²	51.4	57%	0.573	25%	0.252	S	S	*	.	S	Bend	trans	-76	27.5	173.7	-51.3	0	0	0	0	114.1	K212	S168-K212 WeakPolarHBondContact O-CE 3.45Å
169	N	87.8	Confident	90.5	Very high	89 Å²	89	53.1 Å²	53.1	48%	0.476	27%	0.266	S	S	.	.	S	Bend	trans	-85.8	159.4	178.5	-70.6	-33.7	0	0	0	110.7	Q167	Q167-N169 HydrophobicContact CB-CB 4.41Å; Q167-N169 PolarHBondContact O-N 3.08Å; Q167-N169 PolarHBondContact OE1-ND2 2.85Å; Q167-N169 VanDerWaalsContact OE1-ND2 3.07Å
170	Y	94.8	Very high	90.1	Very high	55 Å²	55	58.7 Å²	58.7	22%	0.216	29%	0.287	C	S	.	.			trans	-63.1	140.3	171.2	-70.9	-86.2	0	0	0	110.8	A210 I211 K212 Y217 E219 F225	Y170-A210 HydrophobicContact CD1-CB 3.87Å; Y170-A210 HydrophobicContact CG-CB 4.48Å; Y170-I211 WeakPolarHBondContact CA-O 3.31Å; Y170-K212 HydrophobicContact CD1-CB 3.81Å; Y170-K212 HydrophobicContact CD1-CD 4.16Å; Y170-K212 HydrophobicContact CD2-CD 3.94Å; Y170-K212 HydrophobicContact CE1-CB 3.88Å; Y170-K212 HydrophobicContact CE1-CD 3.79Å; Y170-K212 HydrophobicContact CE2-CD 3.53Å; Y170-K212 HydrophobicContact CG-CB 4.33Å; Y170-K212 HydrophobicContact CG-CD 4.24Å; Y170-K212 VanDerWaalsContact CZ-CD 3.47Å; Y170-Y217 HydrophobicContact CD1-CD2 4.49Å; Y170-Y217 AromaticContact CE1-CD2 3.76Å; Y170-Y217 HydrophobicContact CE1-CD2 3.76Å; Y170-Y217 HydrophobicContact CE1-CE2 4.49Å; Y170-Y217 AromaticContact CE1-CG 3.77Å; Y170-Y217 HydrophobicContact CE1-CG 3.77Å; Y170-E219 HydrophobicContact CD1-CG 4.29Å; Y170-E219 HydrophobicContact CE1-CG 4.28Å; Y170-F225 HydrophobicContact CD2-CE1 4.23Å; Y170-F225 HydrophobicContact CD2-CZ 4.27Å; Y170-F225 HydrophobicContact CG-CE1 4.26Å; Y170-F225 HydrophobicContact CG-CE2 4.27Å; Y170-F225 HydrophobicContact CG-CZ 4.09Å
171	V	97	Very high	89.7	Confident	6 Å²	6	62.9 Å²	62.9	4%	0.036	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	125.7	176.5	-176.6	0	0	0	0	110.1	L165 A210 I211 K226 I228	L165-V171 HydrophobicContact CD1-CG2 4.27Å; L165-V171 HydrophobicContact CD2-CB 4.32Å; L165-V171 HydrophobicContact CD2-CG1 4.31Å; L165-V171 HydrophobicContact CD2-CG2 3.67Å; V171-A210 CarbonylContact O-C 3.33Å; V171-A210 VanDerWaalsContact O-CA 3.27Å; V171-A210 WeakPolarHBondContact O-CA 3.34Å; V171-I211 PolarHBondContact N-O 2.82Å; V171-I211 PolarHBondContact O-N 2.87Å; V171-K226 CarbonylContact C-O 3.56Å; V171-K226 VanDerWaalsContact CA-O 3.27Å; V171-K226 WeakPolarHBondContact CA-O 3.36Å; V171-K226 HydrophobicContact CG1-CB 4.5Å; V171-K226 HydrophobicContact CG2-CB 4.26Å; V171-I228 HydrophobicContact CG1-CD1 3.71Å; V171-I228 HydrophobicContact CG1-CG1 3.71Å
172	W	98.3	Very high	89.5	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	141.1	177.1	-69.2	135.7	0	0	0	112.2	K133 W135 C208 A210 E219 T220 S223 F225 K226 W227 I228	K133-W172 PolarHBondContact O-NE1 2.75Å; W135-W172 HydrophobicContact CB-CD2 4.11Å; W135-W172 HydrophobicContact CB-CE3 4.48Å; W135-W172 HydrophobicContact CB-CG 4.46Å; W135-W172 HydrophobicContact CB-CZ2 4.25Å; W135-W172 AromaticContact CD1-CD2 3.85Å; W135-W172 AromaticContact CD1-CE3 3.75Å; W135-W172 HydrophobicContact CG-CD2 4.42Å; W172-C208 HydrophobicContact CE3-CB 4.3Å; W172-C208 HydrophobicContact CH2-CB 4.1Å; W172-C208 HydrophobicContact CZ3-CB 3.74Å; W172-A210 HydrophobicContact CE3-CB 3.7Å; W172-A210 HydrophobicContact CZ3-CB 3.75Å; W172-E219 HydrophobicContact CH2-CB 3.6Å; W172-E219 HydrophobicContact CZ3-CB 3.82Å; W172-T220 WeakPolarHBondContact CH2-O 3.36Å; W172-S223 VanDerWaalsContact CZ2-O 3.3Å; W172-S223 WeakPolarHBondContact CZ2-O 3.3Å; W172-S223 PolarHBondContact NE1-O 3.48Å; W172-F225 HydrophobicContact CD2-CB 4.25Å; W172-F225 AromaticContact CD2-CD2 3.68Å; W172-F225 HydrophobicContact CD2-CD2 3.68Å; W172-F225 HydrophobicContact CD2-CG 4.45Å; W172-F225 AromaticContact CE2-CD2 3.33Å; W172-F225 AromaticContact CE3-CD2 3.93Å; W172-F225 HydrophobicContact CE3-CD2 3.93Å; W172-F225 HydrophobicContact CE3-CE2 4.5Å; W172-F225 HydrophobicContact CG-CB 4.17Å; W172-F225 HydrophobicContact CG-CD2 4.45Å; W172-F225 AromaticContact CH2-CD2 3.54Å; W172-F225 HydrophobicContact CH2-CD2 3.54Å; W172-F225 AromaticContact CH2-CE2 3.48Å; W172-F225 HydrophobicContact CH2-CE2 3.48Å; W172-F225 VanDerWaalsContact CH2-CE2 3.48Å; W172-F225 AromaticContact CZ2-CD2 3.28Å; W172-F225 HydrophobicContact CZ2-CD2 3.28Å; W172-F225 AromaticContact CZ2-CE2 3.57Å; W172-F225 HydrophobicContact CZ2-CE2 3.57Å; W172-F225 HydrophobicContact CZ2-CG 4.2Å; W172-F225 AromaticContact CZ3-CD2 3.85Å; W172-F225 HydrophobicContact CZ3-CD2 3.85Å; W172-F225 AromaticContact CZ3-CE2 3.98Å; W172-F225 HydrophobicContact CZ3-CE2 3.98Å; W172-F225 AromaticContact NE1-CD2 3.92Å; W172-K226 PolarHBondContact N-O 3.02Å; W172-W227 HydrophobicContact CB-CB 3.79Å; W172-I228 PolarHBondContact O-N 3.23Å
173	M	98	Very high	89.7	Confident	0 Å²	0	71 Å²	71	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	168.1	168.6	73.5	-162.6	-50.6	0	0	109.8	W135 L150 I152 L175 W186 A209 I211 I216	W135-M173 PolarHBondContact NE1-O 2.83Å; L150-M173 HydrophobicContact CB-CB 4.28Å; L150-M173 HydrophobicContact CD2-CB 4.22Å; I152-M173 HydrophobicContact CB-CE 4.25Å; I152-M173 HydrophobicContact CD1-CE 3.4Å; I152-M173 HydrophobicContact CG1-CE 3.57Å; M173-L175 HydrophobicContact CG-CB 3.97Å; M173-L175 PolarHBondContact O-N 2.94Å; M173-W186 HydrophobicContact CE-CH2 3.6Å; M173-W186 HydrophobicContact CE-CZ3 3.75Å; M173-W186 HydrophobicContact CG-CZ3 4.48Å; M173-A209 HydrophobicContact CG-CB 3.9Å; M173-A209 WeakPolarHBondContact CG-O 3.43Å; M173-A209 PolarHBondContact N-O 3.21Å; M173-A209 HydrophobicContact SD-CB 3.89Å; M173-I211 HydrophobicContact CB-CD1 4.09Å; M173-I211 HydrophobicContact CB-CG1 4.48Å; M173-I211 HydrophobicContact CE-CD1 3.95Å; M173-I211 HydrophobicContact CE-CG1 4.06Å; M173-I211 HydrophobicContact SD-CD1 4.18Å; M173-I211 HydrophobicContact SD-CG1 3.77Å; M173-I216 HydrophobicContact CE-CD1 3.99Å; M173-I216 HydrophobicContact SD-CD1 3.96Å; M173-I216 HydrophobicContact SD-CG1 4.26Å; M173-I216 HydrophobicContact SD-CG2 3.85Å
174	G	98.1	Very high	89.9	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	45.3	-175.3	0	0	0	0	0	113.7	L150 W186 V187	L150-G174 WeakPolarHBondContact O-CA 3.23Å; L150-G174 PolarHBondContact O-N 3.21Å; G174-W186 CarbonylContact O-C 3.52Å; G174-W186 VanDerWaalsContact O-CA 3.23Å; G174-W186 WeakPolarHBondContact O-CA 3.26Å; G174-V187 WeakPolarHBondContact O-CG1 3.39Å; G174-V187 PolarHBondContact O-N 2.92Å
175	L	97.8	Very high	90.1	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	127.6	-177.8	-172.6	77.2	0	0	0	110.3	M173 W184 T185 W186 L192 I199 A209	M173-L175 HydrophobicContact CG-CB 3.97Å; M173-L175 PolarHBondContact O-N 2.94Å; L175-W184 HydrophobicContact CD1-CB 4.18Å; L175-W184 HydrophobicContact CD2-CB 4.45Å; L175-W184 HydrophobicContact CD2-CE3 4.08Å; L175-W184 HydrophobicContact CG-CB 4.37Å; L175-W184 HydrophobicContact CG-CE3 3.89Å; L175-T185 WeakPolarHBondContact CD1-O 3.35Å; L175-W186 HydrophobicContact CB-CD2 4.35Å; L175-W186 HydrophobicContact CB-CE3 3.72Å; L175-W186 HydrophobicContact CB-CH2 4.31Å; L175-W186 HydrophobicContact CB-CZ3 3.7Å; L175-W186 HydrophobicContact CD1-CD2 3.47Å; L175-W186 VanDerWaalsContact CD1-CD2 3.47Å; L175-W186 HydrophobicContact CD1-CE3 3.75Å; L175-W186 HydrophobicContact CD1-CG 3.84Å; L175-W186 HydrophobicContact CD1-CH2 4.37Å; L175-W186 HydrophobicContact CD1-CZ2 4.15Å; L175-W186 HydrophobicContact CD1-CZ3 4.19Å; L175-W186 HydrophobicContact CD2-CH2 4.3Å; L175-W186 HydrophobicContact CD2-CZ2 4.46Å; L175-W186 HydrophobicContact CD2-CZ3 4.5Å; L175-W186 HydrophobicContact CG-CD2 4.45Å; L175-W186 HydrophobicContact CG-CE3 4.28Å; L175-W186 HydrophobicContact CG-CZ3 4.35Å; L175-L192 HydrophobicContact CD1-CB 4.2Å; L175-L192 HydrophobicContact CD2-CD2 4.23Å; L175-I199 HydrophobicContact CD2-CD1 3.6Å; L175-A209 HydrophobicContact CB-CB 3.8Å; L175-A209 HydrophobicContact CD2-CB 3.81Å; L175-A209 HydrophobicContact CG-CB 4.1Å; L175-A209 WeakPolarHBondContact O-CB 3.49Å; L175-A209 PolarHBondContact O-N 2.99Å
176	N	97.4	Very high	90.6	Very high	41 Å²	41	60.7 Å²	60.7	22%	0.219	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	159.4	177.6	73.3	-9.4	0	0	0	111.7	W135 T178 W184 T185	W135-N176 HydrophobicContact CH2-CB 4.14Å; W135-N176 HydrophobicContact CZ2-CB 3.97Å; N176-T178 PolarHBondContact OD1-OG1 3.34Å; N176-W184 CarbonylContact O-C 3.16Å; N176-W184 WeakPolarHBondContact O-CA 3.41Å; N176-T185 PolarHBondContact N-O 3.3Å; N176-T185 VanDerWaalsContact N-O 3.08Å; N176-T185 PolarHBondContact O-N 2.75Å; N176-T185 PolarHBondContact OD1-O 3.07Å
177	F	96.8	Very high	91.8	Very high	30 Å²	30	50.2 Å²	50.2	13%	0.132	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	119	171.5	-171.1	-91.3	0	0	0	109.5	M182 W184 A203 K204 S207	F177-M182 VanDerWaalsContact CZ-C 3.5Å; F177-W184 HydrophobicContact CB-CD2 4.29Å; F177-W184 HydrophobicContact CB-CE3 4.25Å; F177-W184 HydrophobicContact CB-CH2 4.46Å; F177-W184 HydrophobicContact CB-CZ2 4.45Å; F177-W184 HydrophobicContact CB-CZ3 4.35Å; F177-W184 HydrophobicContact CD2-CD2 4.34Å; F177-W184 HydrophobicContact CD2-CG 4.33Å; F177-A203 HydrophobicContact CD2-CB 3.72Å; F177-A203 HydrophobicContact CE2-CB 3.65Å; F177-A203 HydrophobicContact CZ-CB 4.46Å; F177-A203 WeakPolarHBondContact CZ-O 3.41Å; F177-K204 WeakPolarHBondContact CB-O 3.44Å; F177-K204 WeakPolarHBondContact CD1-O 3.4Å; F177-S207 PolarHBondContact N-O 3.13Å
178	T	90.3	Very high	92.9	Very high	34 Å²	34	50.3 Å²	50.3	21%	0.209	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	112.5	178.8	-63.4	0	0	0	0	109.8	N176 L180 K181 M182 T183	N176-T178 PolarHBondContact OD1-OG1 3.34Å; T178-L180 HydrophobicContact CG2-CB 4Å; T178-L180 PolarHBondContact O-N 3Å; T178-K181 HydrophobicContact CG2-CB 4.34Å; T178-K181 HydrophobicContact CG2-CG 4.22Å; T178-K181 PolarHBondContact O-N 3.17Å; T178-K181 VanDerWaalsContact O-N 3.12Å; T178-M182 WeakPolarHBondContact O-CA 3.32Å; T178-M182 PolarHBondContact O-N 3.08Å; T178-T183 PolarHBondContact N-O 3.05Å; T178-T183 PolarHBondContact O-N 3.07Å
179	S	82.4	Confident	93.9	Very high	51 Å²	51	48 Å²	48	36%	0.357	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-35	179.6	-54.9	0	0	0	0	113.1	K181 M182 E205	S179-K181 VanDerWaalsContact C-N 3.33Å; S179-K181 PolarHBondContact O-N 3.41Å; S179-M182 WeakPolarHBondContact O-CG 3.35Å; S179-M182 PolarHBondContact O-N 3.08Å; S179-E205 WeakPolarHBondContact OG-CB 3.37Å
180	L	85.5	Confident	94.2	Very high	172 Å²	172	45.9 Å²	45.9	90%	0.901	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-37.2	178.1	-66.6	172.2	0	0	0	113.2	T178	T178-L180 HydrophobicContact CG2-CB 4Å; T178-L180 PolarHBondContact O-N 3Å
181	K	86.1	Confident	94.1	Very high	115 Å²	115	47.6 Å²	47.6	50%	0.5	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-6	-179.9	-62.7	-178.9	178.8	177	0	112.3	T178 S179 T183 T185 G189	T178-K181 HydrophobicContact CG2-CB 4.34Å; T178-K181 HydrophobicContact CG2-CG 4.22Å; T178-K181 PolarHBondContact O-N 3.17Å; T178-K181 VanDerWaalsContact O-N 3.12Å; S179-K181 VanDerWaalsContact C-N 3.33Å; S179-K181 PolarHBondContact O-N 3.41Å; K181-T183 HydrophobicContact CB-CG2 3.72Å; K181-T183 PolarHBondContact O-N 2.95Å; K181-T183 VanDerWaalsContact O-N 3.14Å; K181-T185 HydrophobicContact CD-CG2 4.45Å; K181-G189 PolarHBondContact NZ-O 2.03Å; K181-G189 VanDerWaalsContact NZ-O 3.16Å
182	M	90.5	Very high	94	Very high	159 Å²	159	48.2 Å²	48.2	78%	0.783	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.4	37.4	-171.3	-62.3	-174.5	176.4	0	0	113.2	F177 T178 S179	F177-M182 VanDerWaalsContact CZ-C 3.5Å; T178-M182 WeakPolarHBondContact O-CA 3.32Å; T178-M182 PolarHBondContact O-N 3.08Å; S179-M182 WeakPolarHBondContact O-CG 3.35Å; S179-M182 PolarHBondContact O-N 3.08Å
183	T	94.1	Very high	93.6	Very high	47 Å²	47	51.5 Å²	51.5	29%	0.288	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	161.1	-175.1	-164.4	0	0	0	0	112.4	T178 K181 T185	T178-T183 PolarHBondContact N-O 3.05Å; T178-T183 PolarHBondContact O-N 3.07Å; K181-T183 HydrophobicContact CB-CG2 3.72Å; K181-T183 PolarHBondContact O-N 2.95Å; K181-T183 VanDerWaalsContact O-N 3.14Å; T183-T185 PolarHBondContact O-OG1 3.4Å
184	W	96.4	Very high	93	Very high	24 Å²	24	56.5 Å²	56.5	9%	0.091	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	125.5	169.1	-70.5	98	0	0	0	109.9	L175 N176 F177 L192 I199 A203 A209	L175-W184 HydrophobicContact CD1-CB 4.18Å; L175-W184 HydrophobicContact CD2-CB 4.45Å; L175-W184 HydrophobicContact CD2-CE3 4.08Å; L175-W184 HydrophobicContact CG-CB 4.37Å; L175-W184 HydrophobicContact CG-CE3 3.89Å; N176-W184 CarbonylContact O-C 3.16Å; N176-W184 WeakPolarHBondContact O-CA 3.41Å; F177-W184 HydrophobicContact CB-CD2 4.29Å; F177-W184 HydrophobicContact CB-CE3 4.25Å; F177-W184 HydrophobicContact CB-CH2 4.46Å; F177-W184 HydrophobicContact CB-CZ2 4.45Å; F177-W184 HydrophobicContact CB-CZ3 4.35Å; F177-W184 HydrophobicContact CD2-CD2 4.34Å; F177-W184 HydrophobicContact CD2-CG 4.33Å; W184-L192 HydrophobicContact CB-CB 3.86Å; W184-L192 HydrophobicContact CB-CD2 4.04Å; W184-L192 HydrophobicContact CG-CD2 4.46Å; W184-L192 PolarHBondContact O-N 2.9Å; W184-I199 HydrophobicContact CB-CD1 4.17Å; W184-I199 HydrophobicContact CD2-CD1 3.26Å; W184-I199 HydrophobicContact CE3-CD1 3.79Å; W184-I199 HydrophobicContact CG-CD1 3.44Å; W184-I199 VanDerWaalsContact CG-CD1 3.44Å; W184-I199 HydrophobicContact CH2-CD1 4.38Å; W184-I199 HydrophobicContact CH2-CG2 4.06Å; W184-I199 HydrophobicContact CZ2-CB 4.39Å; W184-I199 HydrophobicContact CZ2-CD1 3.98Å; W184-I199 HydrophobicContact CZ2-CG2 3.62Å; W184-I199 HydrophobicContact CZ3-CD1 4.3Å; W184-A203 HydrophobicContact CZ2-CB 4.48Å; W184-A209 HydrophobicContact CE3-CB 4.39Å; W184-A209 HydrophobicContact CH2-CB 4.42Å; W184-A209 HydrophobicContact CZ3-CB 3.8Å
185	T	96.3	Very high	92.5	Very high	5 Å²	5	65.5 Å²	65.5	3%	0.031	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.4	-175.5	-51.5	0	0	0	0	109.1	L175 N176 K181 T183 G189 S190	L175-T185 WeakPolarHBondContact CD1-O 3.35Å; N176-T185 PolarHBondContact N-O 3.3Å; N176-T185 VanDerWaalsContact N-O 3.08Å; N176-T185 PolarHBondContact O-N 2.75Å; N176-T185 PolarHBondContact OD1-O 3.07Å; K181-T185 HydrophobicContact CD-CG2 4.45Å; T183-T185 PolarHBondContact O-OG1 3.4Å; T185-G189 WeakPolarHBondContact CG2-O 3.47Å; T185-S190 WeakPolarHBondContact CA-O 3.27Å
186	W	97.1	Very high	92	Very high	17 Å²	17	69.1 Å²	69.1	6%	0.064	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	160.1	173.4	-66.3	108.8	0	0	0	110.9	I151 I152 M173 G174 L175 D188 G189 S190 L192 F197	I151-W186 HydrophobicContact CB-CE3 4.09Å; I151-W186 HydrophobicContact CB-CZ3 4.47Å; I151-W186 HydrophobicContact CD1-CB 4.33Å; I151-W186 HydrophobicContact CG1-CB 4.45Å; I151-W186 HydrophobicContact CG1-CE3 4.02Å; I151-W186 HydrophobicContact CG2-CD2 3.82Å; I151-W186 HydrophobicContact CG2-CE3 3.86Å; I151-W186 HydrophobicContact CG2-CG 4.13Å; I151-W186 HydrophobicContact CG2-CZ3 4.36Å; I152-W186 HydrophobicContact CB-CH2 4.21Å; I152-W186 WeakPolarHBondContact O-CZ2 3.48Å; M173-W186 HydrophobicContact CE-CH2 3.6Å; M173-W186 HydrophobicContact CE-CZ3 3.75Å; M173-W186 HydrophobicContact CG-CZ3 4.48Å; G174-W186 CarbonylContact O-C 3.52Å; G174-W186 VanDerWaalsContact O-CA 3.23Å; G174-W186 WeakPolarHBondContact O-CA 3.26Å; L175-W186 HydrophobicContact CB-CD2 4.35Å; L175-W186 HydrophobicContact CB-CE3 3.72Å; L175-W186 HydrophobicContact CB-CH2 4.31Å; L175-W186 HydrophobicContact CB-CZ3 3.7Å; L175-W186 HydrophobicContact CD1-CD2 3.47Å; L175-W186 VanDerWaalsContact CD1-CD2 3.47Å; L175-W186 HydrophobicContact CD1-CE3 3.75Å; L175-W186 HydrophobicContact CD1-CG 3.84Å; L175-W186 HydrophobicContact CD1-CH2 4.37Å; L175-W186 HydrophobicContact CD1-CZ2 4.15Å; L175-W186 HydrophobicContact CD1-CZ3 4.19Å; L175-W186 HydrophobicContact CD2-CH2 4.3Å; L175-W186 HydrophobicContact CD2-CZ2 4.46Å; L175-W186 HydrophobicContact CD2-CZ3 4.5Å; L175-W186 HydrophobicContact CG-CD2 4.45Å; L175-W186 HydrophobicContact CG-CE3 4.28Å; L175-W186 HydrophobicContact CG-CZ3 4.35Å; W186-D188 WeakPolarHBondContact CB-OD1 3.46Å; W186-D188 PolarHBondContact O-N 3.27Å; W186-D188 VanDerWaalsContact O-N 3.16Å; W186-G189 WeakPolarHBondContact O-CA 3.16Å; W186-G189 PolarHBondContact O-N 2.83Å; W186-S190 VanDerWaalsContact CD1-OG 3.28Å; W186-S190 PolarHBondContact N-O 2.88Å; W186-L192 HydrophobicContact CZ2-CD1 3.74Å; W186-F197 HydrophobicContact CZ2-CD2 4.45Å
187	V	97.3	Very high	91.6	Very high	30 Å²	30	68.2 Å²	68.2	18%	0.182	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-15.2	177.7	-72.7	0	0	0	0	114.1	W135 Y139 H148 L149 I151 G174 G189	W135-V187 HydrophobicContact CH2-CG1 3.92Å; W135-V187 HydrophobicContact CZ2-CG1 3.78Å; Y139-V187 HydrophobicContact CD2-CB 4.34Å; Y139-V187 HydrophobicContact CD2-CG1 3.68Å; Y139-V187 HydrophobicContact CE2-CB 3.87Å; Y139-V187 HydrophobicContact CE2-CG1 3.65Å; H148-V187 HydrophobicContact CB-CG2 4.16Å; L149-V187 HydrophobicContact CB-CG1 4.35Å; L149-V187 HydrophobicContact CB-CG2 4.4Å; L149-V187 WeakPolarHBondContact O-CG2 3.48Å; I151-V187 HydrophobicContact CD1-CG2 3.85Å; I151-V187 HydrophobicContact CG1-CG2 3.86Å; G174-V187 WeakPolarHBondContact O-CG1 3.39Å; G174-V187 PolarHBondContact O-N 2.92Å; V187-G189 VanDerWaalsContact C-N 3.28Å
188	D	95.3	Very high	91.4	Very high	99 Å²	99	74.4 Å²	74.4	53%	0.529	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-1.8	169.9	69.1	1.2	0	0	0	113.3	I151 W186 S190	I151-D188 HydrophobicContact CD1-CB 3.72Å; W186-D188 WeakPolarHBondContact CB-OD1 3.46Å; W186-D188 PolarHBondContact O-N 3.27Å; W186-D188 VanDerWaalsContact O-N 3.16Å; D188-S190 VanDerWaalsContact OD1-CB 3.26Å; D188-S190 WeakPolarHBondContact OD1-CB 3.03Å; D188-S190 PolarHBondContact OD1-N 2.79Å; D188-S190 PolarHBondContact OD1-OG 2.76Å; D188-S190 PolarHBondContact OD2-OG 3.16Å
189	G	94.4	Very high	91.6	Very high	35 Å²	35	73.7 Å²	73.7	36%	0.361	39%	0.392	S	S	.	.	S	Bend	trans	89.1	-6.7	179.7	0	0	0	0	0	115.1	K181 T185 W186 V187	K181-G189 PolarHBondContact NZ-O 2.03Å; K181-G189 VanDerWaalsContact NZ-O 3.16Å; T185-G189 WeakPolarHBondContact CG2-O 3.47Å; W186-G189 WeakPolarHBondContact O-CA 3.16Å; W186-G189 PolarHBondContact O-N 2.83Å; V187-G189 VanDerWaalsContact C-N 3.28Å
190	S	94.2	Very high	92.3	Very high	43 Å²	43	75 Å²	75	30%	0.301	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-72.1	143.1	177.4	68.7	0	0	0	0	111.4	T185 W186 D188	T185-S190 WeakPolarHBondContact CA-O 3.27Å; W186-S190 VanDerWaalsContact CD1-OG 3.28Å; W186-S190 PolarHBondContact N-O 2.88Å; D188-S190 VanDerWaalsContact OD1-CB 3.26Å; D188-S190 WeakPolarHBondContact OD1-CB 3.03Å; D188-S190 PolarHBondContact OD1-N 2.79Å; D188-S190 PolarHBondContact OD1-OG 2.76Å; D188-S190 PolarHBondContact OD2-OG 3.16Å
191	P	93.8	Very high	92.7	Very high	91 Å²	91	69.5 Å²	69.5	59%	0.591	38%	0.377	S	S	*	.	B	Isolated β-bridge	trans	-74.6	149.7	175.2	31.7	-34	0	0	0	110.8	D193	P191-D193 PolarHBondContact O-N 3.32Å
192	L	93.6	Very high	93.1	Very high	19 Å²	19	67.2 Å²	67.2	10%	0.099	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-66.7	131.7	168.3	177.9	70.2	0	0	0	110.3	L175 W184 W186 P194 F197 I199	L175-L192 HydrophobicContact CD1-CB 4.2Å; L175-L192 HydrophobicContact CD2-CD2 4.23Å; W184-L192 HydrophobicContact CB-CB 3.86Å; W184-L192 HydrophobicContact CB-CD2 4.04Å; W184-L192 HydrophobicContact CG-CD2 4.46Å; W184-L192 PolarHBondContact O-N 2.9Å; W186-L192 HydrophobicContact CZ2-CD1 3.74Å; L192-P194 WeakPolarHBondContact O-CD 3.27Å; L192-F197 HydrophobicContact CD1-CB 4.3Å; L192-F197 HydrophobicContact CD1-CD2 4.07Å; L192-I199 HydrophobicContact CD2-CD1 3.58Å; L192-I199 HydrophobicContact CD2-CG1 4.17Å
193	D	90.1	Very high	93.2	Very high	70 Å²	70	62.2 Å²	62.2	37%	0.374	36%	0.357	S	S	.	.			trans	-79.5	112.8	162.6	-175.2	-10.8	0	0	0	109.4	P191 K195 I196	P191-D193 PolarHBondContact O-N 3.32Å; D193-K195 PolarHBondContact O-N 3.43Å; D193-K195 VanDerWaalsContact O-N 3.08Å; D193-K195 VanDerWaalsContact OD1-CB 3.28Å; D193-K195 WeakPolarHBondContact OD1-CB 3.39Å; D193-K195 WeakPolarHBondContact OD1-CG 3.44Å; D193-K195 PolarHBondContact OD1-N 3.24Å; D193-I196 HydrophobicContact CB-CD1 3.84Å; D193-I196 HydrophobicContact CB-CG1 3.93Å; D193-I196 PolarHBondContact O-N 3.12Å
194	P	85.8	Confident	93.2	Very high	104 Å²	104	66.1 Å²	66.1	68%	0.675	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-11.8	-178.7	28.8	-36.6	0	0	0	113.6	L192 I196	L192-P194 WeakPolarHBondContact O-CD 3.27Å; P194-I196 VanDerWaalsContact C-N 3.33Å
195	K	87.7	Confident	93.1	Very high	189 Å²	189	72 Å²	72	82%	0.822	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-23.4	174.2	-62.4	175.3	-178	175.5	0	112.7	D193	D193-K195 PolarHBondContact O-N 3.43Å; D193-K195 VanDerWaalsContact O-N 3.08Å; D193-K195 VanDerWaalsContact OD1-CB 3.28Å; D193-K195 WeakPolarHBondContact OD1-CB 3.39Å; D193-K195 WeakPolarHBondContact OD1-CG 3.44Å; D193-K195 PolarHBondContact OD1-N 3.24Å
196	I	86.1	Confident	93	Very high	76 Å²	76	76.1 Å²	76.1	39%	0.39	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-48.9	-176.9	-52.8	178	0	0	0	109.9	D193 P194	D193-I196 HydrophobicContact CB-CD1 3.84Å; D193-I196 HydrophobicContact CB-CG1 3.93Å; D193-I196 PolarHBondContact O-N 3.12Å; P194-I196 VanDerWaalsContact C-N 3.33Å
197	F	89.8	Confident	93	Very high	23 Å²	23	75.5 Å²	75.5	10%	0.101	42%	0.419	C	S	.	.			trans	-133	136.2	-178.2	-57.2	-66.1	0	0	0	112.8	I152 M158 W186 L192 I216	I152-F197 HydrophobicContact CB-CE2 4.03Å; I152-F197 HydrophobicContact CB-CZ 4.06Å; I152-F197 HydrophobicContact CG2-CE1 4.16Å; I152-F197 HydrophobicContact CG2-CE2 3.77Å; I152-F197 HydrophobicContact CG2-CZ 3.31Å; I152-F197 WeakPolarHBondContact O-CE2 3.43Å; M158-F197 HydrophobicContact CB-CE1 4.44Å; W186-F197 HydrophobicContact CZ2-CD2 4.45Å; L192-F197 HydrophobicContact CD1-CB 4.3Å; L192-F197 HydrophobicContact CD1-CD2 4.07Å; F197-I216 HydrophobicContact CB-CD1 3.72Å; F197-I216 HydrophobicContact CD1-CD1 4.12Å; F197-I216 HydrophobicContact CD2-CD1 4.44Å; F197-I216 HydrophobicContact CG-CD1 3.84Å
198	F	92.1	Very high	93.1	Very high	159 Å²	159	74.1 Å²	74.1	70%	0.697	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-99.7	129.1	171.6	-179.8	-100.6	0	0	0	110.9	K200	F198-K200 HydrophobicContact CD1-CG 4.1Å; F198-K200 HydrophobicContact CE1-CG 3.89Å
199	I	95.8	Very high	93.2	Very high	19 Å²	19	69.4 Å²	69.4	10%	0.097	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	125.5	179.7	-57.5	172.2	0	0	0	109.8	L175 W184 L192 I216	L175-I199 HydrophobicContact CD2-CD1 3.6Å; W184-I199 HydrophobicContact CB-CD1 4.17Å; W184-I199 HydrophobicContact CD2-CD1 3.26Å; W184-I199 HydrophobicContact CE3-CD1 3.79Å; W184-I199 HydrophobicContact CG-CD1 3.44Å; W184-I199 VanDerWaalsContact CG-CD1 3.44Å; W184-I199 HydrophobicContact CH2-CD1 4.38Å; W184-I199 HydrophobicContact CH2-CG2 4.06Å; W184-I199 HydrophobicContact CZ2-CB 4.39Å; W184-I199 HydrophobicContact CZ2-CD1 3.98Å; W184-I199 HydrophobicContact CZ2-CG2 3.62Å; W184-I199 HydrophobicContact CZ3-CD1 4.3Å; L192-I199 HydrophobicContact CD2-CD1 3.58Å; L192-I199 HydrophobicContact CD2-CG1 4.17Å; I199-I216 HydrophobicContact CG1-CB 4.31Å; I199-I216 HydrophobicContact CG1-CG2 3.89Å; I199-I216 HydrophobicContact CG2-CG2 4.31Å
200	K	95.9	Very high	93.3	Very high	79 Å²	79	67.7 Å²	67.7	34%	0.343	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	123.9	177.5	-67.3	-175	173	-159.7	0	111	F198 I216 Y217 S218	F198-K200 HydrophobicContact CD1-CG 4.1Å; F198-K200 HydrophobicContact CE1-CG 3.89Å; K200-I216 PolarHBondContact N-O 2.97Å; K200-Y217 HydrophobicContact CB-CD1 3.69Å; K200-Y217 HydrophobicContact CB-CE1 3.96Å; K200-Y217 HydrophobicContact CB-CG 4.39Å; K200-Y217 HydrophobicContact CD-CD1 4.17Å; K200-Y217 HydrophobicContact CD-CE1 3.57Å; K200-Y217 HydrophobicContact CG-CE1 4.38Å; K200-Y217 CarbonylContact O-C 3.54Å; K200-Y217 WeakPolarHBondContact O-CA 3.3Å; K200-S218 PolarHBondContact O-N 3.31Å
201	G	95.6	Very high	93.4	Very high	57 Å²	57	65.7 Å²	65.7	59%	0.588	35%	0.354	S	S	*	.	S	Bend	trans	116.1	-171	176	0	0	0	0	0	112.7
202	P	92.7	Very high	93.4	Very high	66 Å²	66	64.1 Å²	64.1	43%	0.429	34%	0.338	S	S	.	.			trans	-72.9	142	-173.2	30.1	-34.6	0	0	0	111.8	K204 S207 S218	P202-K204 HydrophobicContact CB-CD 4.19Å; P202-K204 HydrophobicContact CB-CG 4.17Å; P202-S207 PolarHBondContact O-OG 2.88Å; P202-S218 WeakPolarHBondContact O-CB 3.5Å; P202-S218 PolarHBondContact O-OG 3.46Å
203	A	94.3	Very high	93.1	Very high	54 Å²	54	68.1 Å²	68.1	45%	0.446	36%	0.356	S	S	.	.			trans	-107.4	84.6	171.9	0	0	0	0	0	108.5	F177 W184	F177-A203 HydrophobicContact CD2-CB 3.72Å; F177-A203 HydrophobicContact CE2-CB 3.65Å; F177-A203 HydrophobicContact CZ-CB 4.46Å; F177-A203 WeakPolarHBondContact CZ-O 3.41Å; W184-A203 HydrophobicContact CZ2-CB 4.48Å
204	K	94.3	Very high	92.8	Very high	129 Å²	129	68.4 Å²	68.4	56%	0.561	36%	0.364	S	S	*	.	S	Bend	trans	-143.7	176.7	-174.4	66	179	-179.3	177.5	0	111.4	F177 P202 S207	F177-K204 WeakPolarHBondContact CB-O 3.44Å; F177-K204 WeakPolarHBondContact CD1-O 3.4Å; P202-K204 HydrophobicContact CB-CD 4.19Å; P202-K204 HydrophobicContact CB-CG 4.17Å; K204-S207 WeakPolarHBondContact O-CB 3.45Å; K204-S207 PolarHBondContact O-N 3.48Å; K204-S207 VanDerWaalsContact O-N 3.16Å; K204-S207 PolarHBondContact O-OG 2.86Å
205	E	92.5	Very high	93	Very high	149 Å²	149	67.9 Å²	67.9	70%	0.696	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	141.9	173.8	-170.5	168.1	-162.2	0	0	111.7	S179 S207	S179-E205 WeakPolarHBondContact OG-CB 3.37Å; E205-S207 PolarHBondContact O-N 2.85Å
206	N	94.9	Very high	93.4	Very high	90 Å²	90	59.1 Å²	59.1	48%	0.481	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.5	20.1	-177.5	-161.4	36	0	0	0	114.7	T220 C221	N206-T220 WeakPolarHBondContact ND2-CG2 3.34Å; N206-C221 PolarHBondContact O-N 3.28Å; N206-C221 PolarHBondContact O-SG 3.03Å; N206-C221 WeakPolarHBondContact OD1-CB 3.43Å
207	S	97.7	Very high	93.9	Very high	5 Å²	5	57.6 Å²	57.6	4%	0.035	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	127.2	169.3	-71.7	0	0	0	0	111.8	F177 P202 K204 E205 S218 E219	F177-S207 PolarHBondContact N-O 3.13Å; P202-S207 PolarHBondContact O-OG 2.88Å; K204-S207 WeakPolarHBondContact O-CB 3.45Å; K204-S207 PolarHBondContact O-N 3.48Å; K204-S207 VanDerWaalsContact O-N 3.16Å; K204-S207 PolarHBondContact O-OG 2.86Å; E205-S207 PolarHBondContact O-N 2.85Å; S207-S218 VanDerWaalsContact CB-OG 3.3Å; S207-S218 WeakPolarHBondContact CB-OG 3.42Å; S207-S218 PolarHBondContact OG-OG 3.28Å; S207-E219 WeakPolarHBondContact CA-O 3.27Å
208	C	98.3	Very high	94.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	147.6	176.2	-73.8	0	0	0	0	110	W135 W172 E219 C221	W135-C208 HydrophobicContact CB-CB 3.97Å; W135-C208 HydrophobicContact CD2-CB 4.28Å; W135-C208 HydrophobicContact CG-CB 3.67Å; W172-C208 HydrophobicContact CE3-CB 4.3Å; W172-C208 HydrophobicContact CH2-CB 4.1Å; W172-C208 HydrophobicContact CZ3-CB 3.74Å; C208-E219 PolarHBondContact N-O 2.92Å; C208-E219 PolarHBondContact O-N 2.68Å; C208-C221 HydrophobicContact CB-CB 3.91Å; C208-C221 WeakPolarHBondContact CB-SG 3.16Å; C208-C221 PolarHBondContact N-SG 3.24Å; C208-C221 VanDerWaalsContact N-SG 3.39Å; C208-C221 WeakPolarHBondContact SG-CB 3.38Å; C208-C221 CovalentContact SG-SG 2.03Å; C208-C221 PolarHBondContact SG-SG 2.81Å
209	A	97.9	Very high	94.6	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	133.2	-174	0	0	0	0	0	111.6	M173 L175 W184 I216 Y217	M173-A209 HydrophobicContact CG-CB 3.9Å; M173-A209 WeakPolarHBondContact CG-O 3.43Å; M173-A209 PolarHBondContact N-O 3.21Å; M173-A209 HydrophobicContact SD-CB 3.89Å; L175-A209 HydrophobicContact CB-CB 3.8Å; L175-A209 HydrophobicContact CD2-CB 3.81Å; L175-A209 HydrophobicContact CG-CB 4.1Å; L175-A209 WeakPolarHBondContact O-CB 3.49Å; L175-A209 PolarHBondContact O-N 2.99Å; W184-A209 HydrophobicContact CE3-CB 4.39Å; W184-A209 HydrophobicContact CH2-CB 4.42Å; W184-A209 HydrophobicContact CZ3-CB 3.8Å; A209-I216 HydrophobicContact CB-CG2 3.78Å; A209-Y217 CarbonylContact C-O 3.6Å; A209-Y217 WeakPolarHBondContact CA-O 3.29Å
210	A	97.4	Very high	94.7	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	147.1	172.9	0	0	0	0	0	111.1	Y170 V171 W172 I216 Y217 E219 F225	Y170-A210 HydrophobicContact CD1-CB 3.87Å; Y170-A210 HydrophobicContact CG-CB 4.48Å; V171-A210 CarbonylContact O-C 3.33Å; V171-A210 VanDerWaalsContact O-CA 3.27Å; V171-A210 WeakPolarHBondContact O-CA 3.34Å; W172-A210 HydrophobicContact CE3-CB 3.7Å; W172-A210 HydrophobicContact CZ3-CB 3.75Å; A210-I216 CarbonylContact O-C 3.46Å; A210-I216 WeakPolarHBondContact O-CA 3.1Å; A210-Y217 PolarHBondContact N-O 3.14Å; A210-Y217 PolarHBondContact O-N 2.8Å; A210-E219 HydrophobicContact CB-CG 4.22Å; A210-F225 HydrophobicContact CB-CD2 4.08Å; A210-F225 HydrophobicContact CB-CE2 4.22Å
211	I	95.6	Very high	94.8	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	134.4	177.5	-63.9	160.5	0	0	0	109	L150 I152 M158 I161 L165 Y170 V171 M173 K215	L150-I211 HydrophobicContact CD2-CD1 3.55Å; I152-I211 HydrophobicContact CD1-CD1 3.8Å; M158-I211 HydrophobicContact CE-CD1 3.9Å; M158-I211 HydrophobicContact CE-CG1 4.26Å; M158-I211 HydrophobicContact CE-CG2 3.78Å; M158-I211 HydrophobicContact SD-CG2 4.44Å; I161-I211 HydrophobicContact CG2-CD1 4.26Å; L165-I211 HydrophobicContact CD1-CG2 4.14Å; Y170-I211 WeakPolarHBondContact CA-O 3.31Å; V171-I211 PolarHBondContact N-O 2.82Å; V171-I211 PolarHBondContact O-N 2.87Å; M173-I211 HydrophobicContact CB-CD1 4.09Å; M173-I211 HydrophobicContact CB-CG1 4.48Å; M173-I211 HydrophobicContact CE-CD1 3.95Å; M173-I211 HydrophobicContact CE-CG1 4.06Å; M173-I211 HydrophobicContact SD-CD1 4.18Å; M173-I211 HydrophobicContact SD-CG1 3.77Å; I211-K215 WeakPolarHBondContact CA-O 3.24Å
212	K	93	Very high	94.9	Very high	58 Å²	58	52 Å²	52	25%	0.252	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	128.9	167.2	178	177	178.4	-175.9	0	110.2	S168 Y170 S214 K215 Y217	S168-K212 WeakPolarHBondContact O-CE 3.45Å; Y170-K212 HydrophobicContact CD1-CB 3.81Å; Y170-K212 HydrophobicContact CD1-CD 4.16Å; Y170-K212 HydrophobicContact CD2-CD 3.94Å; Y170-K212 HydrophobicContact CE1-CB 3.88Å; Y170-K212 HydrophobicContact CE1-CD 3.79Å; Y170-K212 HydrophobicContact CE2-CD 3.53Å; Y170-K212 HydrophobicContact CG-CB 4.33Å; Y170-K212 HydrophobicContact CG-CD 4.24Å; Y170-K212 VanDerWaalsContact CZ-CD 3.47Å; K212-S214 VanDerWaalsContact C-N 3.35Å; K212-S214 PolarHBondContact O-N 2.98Å; K212-K215 PolarHBondContact N-O 2.88Å; K212-K215 PolarHBondContact O-N 3.09Å; K212-Y217 HydrophobicContact CB-CD2 3.96Å; K212-Y217 HydrophobicContact CB-CE2 3.83Å; K212-Y217 HydrophobicContact CG-CE2 4.49Å
213	E	87.3	Confident	95.2	Very high	103 Å²	103	50.6 Å²	50.6	48%	0.481	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	49	51.6	177.1	-62	172	-174.7	0	0	113	K215	E213-K215 PolarHBondContact O-N 2.97Å; E213-K215 VanDerWaalsContact O-N 3.09Å
214	S	83.5	Confident	95.3	Very high	77 Å²	77	52.2 Å²	52.2	54%	0.538	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	12.6	-178.2	-45.6	0	0	0	0	116	Q162 K212	Q162-S214 VanDerWaalsContact CD-CA 3.47Å; Q162-S214 WeakPolarHBondContact CG-OG 3.47Å; Q162-S214 VanDerWaalsContact OE1-N 3.09Å; K212-S214 VanDerWaalsContact C-N 3.35Å; K212-S214 PolarHBondContact O-N 2.98Å
215	K	91.4	Very high	95.5	Very high	93 Å²	93	47.7 Å²	47.7	40%	0.404	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	151.5	177.8	-69.4	159.6	-179.5	159.5	0	110.2	I211 K212 E213 Y217	I211-K215 WeakPolarHBondContact CA-O 3.24Å; K212-K215 PolarHBondContact N-O 2.88Å; K212-K215 PolarHBondContact O-N 3.09Å; E213-K215 PolarHBondContact O-N 2.97Å; E213-K215 VanDerWaalsContact O-N 3.09Å; K215-Y217 HydrophobicContact CB-CD2 4.36Å; K215-Y217 HydrophobicContact CB-CE2 3.62Å
216	I	95.5	Very high	95.7	Very high	4 Å²	4	43 Å²	43	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	129.5	175.7	-52.1	-177.7	0	0	0	108.7	M173 F197 I199 K200 A209 A210	M173-I216 HydrophobicContact CE-CD1 3.99Å; M173-I216 HydrophobicContact SD-CD1 3.96Å; M173-I216 HydrophobicContact SD-CG1 4.26Å; M173-I216 HydrophobicContact SD-CG2 3.85Å; F197-I216 HydrophobicContact CB-CD1 3.72Å; F197-I216 HydrophobicContact CD1-CD1 4.12Å; F197-I216 HydrophobicContact CD2-CD1 4.44Å; F197-I216 HydrophobicContact CG-CD1 3.84Å; I199-I216 HydrophobicContact CG1-CB 4.31Å; I199-I216 HydrophobicContact CG1-CG2 3.89Å; I199-I216 HydrophobicContact CG2-CG2 4.31Å; K200-I216 PolarHBondContact N-O 2.97Å; A209-I216 HydrophobicContact CB-CG2 3.78Å; A210-I216 CarbonylContact O-C 3.46Å; A210-I216 WeakPolarHBondContact O-CA 3.1Å
217	Y	97.1	Very high	95.9	Very high	44 Å²	44	38.8 Å²	38.8	17%	0.173	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	142.6	178.7	-65.8	-92.9	0	0	0	109.8	Y170 K200 A209 A210 K212 K215	Y170-Y217 HydrophobicContact CD1-CD2 4.49Å; Y170-Y217 AromaticContact CE1-CD2 3.76Å; Y170-Y217 HydrophobicContact CE1-CD2 3.76Å; Y170-Y217 HydrophobicContact CE1-CE2 4.49Å; Y170-Y217 AromaticContact CE1-CG 3.77Å; Y170-Y217 HydrophobicContact CE1-CG 3.77Å; K200-Y217 HydrophobicContact CB-CD1 3.69Å; K200-Y217 HydrophobicContact CB-CE1 3.96Å; K200-Y217 HydrophobicContact CB-CG 4.39Å; K200-Y217 HydrophobicContact CD-CD1 4.17Å; K200-Y217 HydrophobicContact CD-CE1 3.57Å; K200-Y217 HydrophobicContact CG-CE1 4.38Å; K200-Y217 CarbonylContact O-C 3.54Å; K200-Y217 WeakPolarHBondContact O-CA 3.3Å; A209-Y217 CarbonylContact C-O 3.6Å; A209-Y217 WeakPolarHBondContact CA-O 3.29Å; A210-Y217 PolarHBondContact N-O 3.14Å; A210-Y217 PolarHBondContact O-N 2.8Å; K212-Y217 HydrophobicContact CB-CD2 3.96Å; K212-Y217 HydrophobicContact CB-CE2 3.83Å; K212-Y217 HydrophobicContact CG-CE2 4.49Å; K215-Y217 HydrophobicContact CB-CD2 4.36Å; K215-Y217 HydrophobicContact CB-CE2 3.62Å
218	S	97.9	Very high	95.9	Very high	9 Å²	9	38.5 Å²	38.5	6%	0.063	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	120.1	167.2	179.2	0	0	0	0	109	K200 P202 S207	K200-S218 PolarHBondContact O-N 3.31Å; P202-S218 WeakPolarHBondContact O-CB 3.5Å; P202-S218 PolarHBondContact O-OG 3.46Å; S207-S218 VanDerWaalsContact CB-OG 3.3Å; S207-S218 WeakPolarHBondContact CB-OG 3.42Å; S207-S218 PolarHBondContact OG-OG 3.28Å
219	E	98.1	Very high	95.9	Very high	47 Å²	47	38.5 Å²	38.5	22%	0.22	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	163.5	-179.5	-68.7	-64.8	156.4	0	0	109.7	Y170 W172 S207 C208 A210 C221 F225	Y170-E219 HydrophobicContact CD1-CG 4.29Å; Y170-E219 HydrophobicContact CE1-CG 4.28Å; W172-E219 HydrophobicContact CH2-CB 3.6Å; W172-E219 HydrophobicContact CZ3-CB 3.82Å; S207-E219 WeakPolarHBondContact CA-O 3.27Å; C208-E219 PolarHBondContact N-O 2.92Å; C208-E219 PolarHBondContact O-N 2.68Å; A210-E219 HydrophobicContact CB-CG 4.22Å; E219-C221 PolarHBondContact O-N 3.04Å; E219-F225 HydrophobicContact CB-CE2 3.82Å; E219-F225 HydrophobicContact CB-CZ 4.44Å; E219-F225 HydrophobicContact CG-CE2 3.79Å; E219-F225 HydrophobicContact CG-CZ 4.2Å
220	T	97.7	Very high	95.9	Very high	67 Å²	67	38.9 Å²	38.9	41%	0.411	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	129.4	176.1	-52.7	0	0	0	0	109	W172 N206 S222 S223	W172-T220 WeakPolarHBondContact CH2-O 3.36Å; N206-T220 WeakPolarHBondContact ND2-CG2 3.34Å; T220-S222 WeakPolarHBondContact CG2-OG 3.16Å; T220-S222 PolarHBondContact O-N 2.9Å; T220-S223 VanDerWaalsContact O-CB 3.24Å; T220-S223 WeakPolarHBondContact O-CB 3.33Å; T220-S223 PolarHBondContact O-N 3.04Å; T220-S223 PolarHBondContact O-OG 3.39Å
221	C	98	Very high	95.8	Very high	14 Å²	14	42.9 Å²	42.9	10%	0.095	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-22.4	-175	-58.7	0	0	0	0	114.2	W135 N206 C208 E219 S223	W135-C221 HydrophobicContact CB-CB 4.21Å; W135-C221 PolarHBondContact N-O 3.47Å; N206-C221 PolarHBondContact O-N 3.28Å; N206-C221 PolarHBondContact O-SG 3.03Å; N206-C221 WeakPolarHBondContact OD1-CB 3.43Å; C208-C221 HydrophobicContact CB-CB 3.91Å; C208-C221 WeakPolarHBondContact CB-SG 3.16Å; C208-C221 PolarHBondContact N-SG 3.24Å; C208-C221 VanDerWaalsContact N-SG 3.39Å; C208-C221 WeakPolarHBondContact SG-CB 3.38Å; C208-C221 CovalentContact SG-SG 2.03Å; C208-C221 PolarHBondContact SG-SG 2.81Å; E219-C221 PolarHBondContact O-N 3.04Å; C221-S223 VanDerWaalsContact C-N 3.32Å
222	S	97.9	Very high	95.8	Very high	83 Å²	83	45 Å²	45	58%	0.58	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78	-11.1	175.4	61.4	0	0	0	0	114.3	T220	T220-S222 WeakPolarHBondContact CG2-OG 3.16Å; T220-S222 PolarHBondContact O-N 2.9Å
223	S	98.2	Very high	95.9	Very high	37 Å²	37	44.3 Å²	44.3	26%	0.259	24%	0.237	S	C	.	.	S	Bend	trans	-62.2	150.4	173.5	-66.2	0	0	0	0	110.6	S134 W172 T220 C221	S134-S223 WeakPolarHBondContact CA-O 3.37Å; W172-S223 VanDerWaalsContact CZ2-O 3.3Å; W172-S223 WeakPolarHBondContact CZ2-O 3.3Å; W172-S223 PolarHBondContact NE1-O 3.48Å; T220-S223 VanDerWaalsContact O-CB 3.24Å; T220-S223 WeakPolarHBondContact O-CB 3.33Å; T220-S223 PolarHBondContact O-N 3.04Å; T220-S223 PolarHBondContact O-OG 3.39Å; C221-S223 VanDerWaalsContact C-N 3.32Å
224	V	97.9	Very high	96.4	Very high	88 Å²	88	41.1 Å²	41.1	53%	0.533	22%	0.224	S	C	.	.			trans	-105.2	113.3	-178.4	-68.7	0	0	0	0	111	M132 K133	M132-V224 HydrophobicContact CB-CB 4.41Å; K133-V224 WeakPolarHBondContact O-CA 3.21Å
225	F	97.7	Very high	97.2	Very high	34 Å²	34	38.9 Å²	38.9	15%	0.149	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-131.6	165.2	178.9	-59.2	-39	0	0	0	110.8	M132 K133 Y170 W172 A210 E219	M132-F225 CarbonylContact C-O 3.58Å; M132-F225 VanDerWaalsContact CA-O 3.29Å; M132-F225 WeakPolarHBondContact CA-O 3.41Å; K133-F225 PolarHBondContact N-O 2.85Å; K133-F225 PolarHBondContact O-N 3.17Å; Y170-F225 HydrophobicContact CD2-CE1 4.23Å; Y170-F225 HydrophobicContact CD2-CZ 4.27Å; Y170-F225 HydrophobicContact CG-CE1 4.26Å; Y170-F225 HydrophobicContact CG-CE2 4.27Å; Y170-F225 HydrophobicContact CG-CZ 4.09Å; W172-F225 HydrophobicContact CD2-CB 4.25Å; W172-F225 AromaticContact CD2-CD2 3.68Å; W172-F225 HydrophobicContact CD2-CD2 3.68Å; W172-F225 HydrophobicContact CD2-CG 4.45Å; W172-F225 AromaticContact CE2-CD2 3.33Å; W172-F225 AromaticContact CE3-CD2 3.93Å; W172-F225 HydrophobicContact CE3-CD2 3.93Å; W172-F225 HydrophobicContact CE3-CE2 4.5Å; W172-F225 HydrophobicContact CG-CB 4.17Å; W172-F225 HydrophobicContact CG-CD2 4.45Å; W172-F225 AromaticContact CH2-CD2 3.54Å; W172-F225 HydrophobicContact CH2-CD2 3.54Å; W172-F225 AromaticContact CH2-CE2 3.48Å; W172-F225 HydrophobicContact CH2-CE2 3.48Å; W172-F225 VanDerWaalsContact CH2-CE2 3.48Å; W172-F225 AromaticContact CZ2-CD2 3.28Å; W172-F225 HydrophobicContact CZ2-CD2 3.28Å; W172-F225 AromaticContact CZ2-CE2 3.57Å; W172-F225 HydrophobicContact CZ2-CE2 3.57Å; W172-F225 HydrophobicContact CZ2-CG 4.2Å; W172-F225 AromaticContact CZ3-CD2 3.85Å; W172-F225 HydrophobicContact CZ3-CD2 3.85Å; W172-F225 AromaticContact CZ3-CE2 3.98Å; W172-F225 HydrophobicContact CZ3-CE2 3.98Å; W172-F225 AromaticContact NE1-CD2 3.92Å; A210-F225 HydrophobicContact CB-CD2 4.08Å; A210-F225 HydrophobicContact CB-CE2 4.22Å; E219-F225 HydrophobicContact CB-CE2 3.82Å; E219-F225 HydrophobicContact CB-CZ 4.44Å; E219-F225 HydrophobicContact CG-CE2 3.79Å; E219-F225 HydrophobicContact CG-CZ 4.2Å
226	K	97.1	Very high	97.5	Very high	50 Å²	50	35.6 Å²	35.6	22%	0.217	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	162.6	163.2	-70.8	-177.9	172.8	176.9	0	109.2	S129 E131 M132 V171 W172	S129-K226 VanDerWaalsContact OG-CA 3.27Å; S129-K226 WeakPolarHBondContact OG-CA 3.45Å; S129-K226 WeakPolarHBondContact OG-CB 3.38Å; E131-K226 WeakPolarHBondContact O-CG 3.41Å; M132-K226 HydrophobicContact CG-CG 3.99Å; V171-K226 CarbonylContact C-O 3.56Å; V171-K226 VanDerWaalsContact CA-O 3.27Å; V171-K226 WeakPolarHBondContact CA-O 3.36Å; V171-K226 HydrophobicContact CG1-CB 4.5Å; V171-K226 HydrophobicContact CG2-CB 4.26Å; W172-K226 PolarHBondContact N-O 3.02Å
227	W	98	Very high	97.7	Very high	1 Å²	1	37.7 Å²	37.7	0%	0.004	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	167.1	178.9	71.4	98.3	0	0	0	111	W127 S129 E131 K133 S138 Y141 L149 W172 C229	W127-W227 HydrophobicContact CH2-CZ2 4.21Å; W127-W227 AromaticContact CZ3-CE2 3.94Å; W127-W227 AromaticContact CZ3-CZ2 3.84Å; W127-W227 HydrophobicContact CZ3-CZ2 3.84Å; W127-W227 AromaticContact CZ3-NE1 3.88Å; S129-W227 VanDerWaalsContact CB-CD2 3.41Å; S129-W227 VanDerWaalsContact CB-CE3 3.42Å; S129-W227 WeakPolarHBondContact CB-O 3.21Å; S129-W227 PolarHBondContact N-O 3.24Å; S129-W227 WeakPolarHBondContact OG-CZ3 3.36Å; S129-W227 PolarHBondContact OG-N 3.02Å; S129-W227 PolarHBondContact OG-O 3.19Å; E131-W227 HydrophobicContact CB-CH2 3.86Å; E131-W227 HydrophobicContact CB-CZ3 3.93Å; E131-W227 WeakPolarHBondContact O-CZ3 3.44Å; K133-W227 HydrophobicContact CB-CE3 4.08Å; K133-W227 HydrophobicContact CB-CH2 4.47Å; K133-W227 HydrophobicContact CB-CZ3 3.79Å; K133-W227 HydrophobicContact CD-CH2 3.71Å; K133-W227 HydrophobicContact CD-CZ2 4.34Å; K133-W227 HydrophobicContact CD-CZ3 3.91Å; K133-W227 HydrophobicContact CG-CE3 4.38Å; K133-W227 HydrophobicContact CG-CH2 3.92Å; K133-W227 HydrophobicContact CG-CZ3 3.6Å; S138-W227 VanDerWaalsContact CB-CG 3.45Å; S138-W227 VanDerWaalsContact OG-CD2 3.23Å; S138-W227 VanDerWaalsContact OG-CE3 3.24Å; Y141-W227 AromaticContact CD1-CE2 3.82Å; Y141-W227 AromaticContact CD1-CZ2 3.5Å; Y141-W227 HydrophobicContact CD1-CZ2 3.5Å; Y141-W227 VanDerWaalsContact CD1-CZ2 3.5Å; Y141-W227 AromaticContact CD1-NE1 3.53Å; Y141-W227 HydrophobicContact CD2-CH2 4.49Å; Y141-W227 AromaticContact CD2-CZ2 3.85Å; Y141-W227 HydrophobicContact CD2-CZ2 3.85Å; Y141-W227 AromaticContact CE1-CZ2 3.71Å; Y141-W227 HydrophobicContact CE1-CZ2 3.71Å; Y141-W227 HydrophobicContact CE2-CZ2 4.03Å; Y141-W227 AromaticContact CG-CZ2 3.55Å; Y141-W227 HydrophobicContact CG-CZ2 3.55Å; Y141-W227 AromaticContact CZ-CZ2 3.95Å; L149-W227 HydrophobicContact CD2-CB 3.95Å; L149-W227 HydrophobicContact CD2-CG 4.22Å; W172-W227 HydrophobicContact CB-CB 3.79Å; W227-C229 PolarHBondContact NE1-SG 2.85Å
228	I	97.9	Very high	97.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129.9	176.9	-62.1	160.2	0	0	0	108.8	Y126 W127 F128 L149 L150 I161 L165 V171 W172	Y126-I228 HydrophobicContact CD1-CG2 4.46Å; W127-I228 VanDerWaalsContact O-CA 3.31Å; W127-I228 WeakPolarHBondContact O-CA 3.37Å; F128-I228 HydrophobicContact CD1-CD1 3.81Å; F128-I228 HydrophobicContact CD1-CG1 3.63Å; F128-I228 HydrophobicContact CE1-CD1 3.52Å; F128-I228 HydrophobicContact CE1-CG1 3.82Å; F128-I228 HydrophobicContact CG-CG1 4.26Å; F128-I228 HydrophobicContact CZ-CD1 4.31Å; L149-I228 WeakPolarHBondContact CA-O 3.32Å; L150-I228 HydrophobicContact CB-CB 3.95Å; L150-I228 HydrophobicContact CB-CG2 4.01Å; L150-I228 HydrophobicContact CD1-CG2 4.07Å; L150-I228 HydrophobicContact CD2-CB 4.31Å; L150-I228 HydrophobicContact CD2-CD1 3.92Å; L150-I228 HydrophobicContact CD2-CG2 4.45Å; L150-I228 HydrophobicContact CG-CG2 4.42Å; L150-I228 PolarHBondContact N-O 3.16Å; I161-I228 HydrophobicContact CD1-CD1 4.42Å; I161-I228 HydrophobicContact CG2-CD1 3.54Å; L165-I228 HydrophobicContact CD2-CD1 4.14Å; V171-I228 HydrophobicContact CG1-CD1 3.71Å; V171-I228 HydrophobicContact CG1-CG1 3.71Å; W172-I228 PolarHBondContact O-N 3.23Å
229	C	98.2	Very high	97.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	150.1	168.6	-55.8	0	0	0	0	110.2	W118 Y126 W127 C142 S147 H148 W227	W118-C229 HydrophobicContact CH2-CB 3.73Å; W118-C229 HydrophobicContact CZ3-CB 4.13Å; Y126-C229 WeakPolarHBondContact CA-O 3.32Å; W127-C229 PolarHBondContact N-O 2.85Å; W127-C229 PolarHBondContact O-N 3.33Å; C142-C229 WeakPolarHBondContact CA-SG 3.45Å; C142-C229 HydrophobicContact CB-CB 3.83Å; C142-C229 WeakPolarHBondContact CB-SG 3.48Å; C142-C229 WeakPolarHBondContact SG-CA 3.24Å; C142-C229 WeakPolarHBondContact SG-CB 3.26Å; C142-C229 CovalentContact SG-SG 2.04Å; C142-C229 PolarHBondContact SG-SG 3.18Å; S147-C229 WeakPolarHBondContact OG-CB 3.5Å; H148-C229 CarbonylContact O-C 3.54Å; H148-C229 VanDerWaalsContact O-CA 3.26Å; H148-C229 WeakPolarHBondContact O-CA 3.47Å; W227-C229 PolarHBondContact NE1-SG 2.85Å
230	Q	97.8	Very high	97.7	Very high	7 Å²	7	38.8 Å²	38.8	3%	0.033	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	157.4	171.7	77.1	176.4	53.9	0	0	112.8	C125 Y126 S147 H148 I151	C125-Q230 WeakPolarHBondContact O-CA 3.39Å; Y126-Q230 HydrophobicContact CD1-CB 3.97Å; Y126-Q230 HydrophobicContact CE1-CB 4.22Å; S147-Q230 WeakPolarHBondContact CA-O 3.44Å; S147-Q230 VanDerWaalsContact CB-O 3.29Å; S147-Q230 WeakPolarHBondContact CB-O 3.22Å; H148-Q230 VanDerWaalsContact CE1-CD 3.48Å; H148-Q230 WeakPolarHBondContact CE1-CG 3.31Å; H148-Q230 PolarHBondContact CE1-NE2 3.5Å; H148-Q230 PolarHBondContact N-O 3.07Å; H148-Q230 PolarHBondContact O-N 3.38Å; I151-Q230 PolarHBondContact O-OE1 2.57Å
231	Y	95.7	Very high	97.7	Very high	84 Å²	84	36.2 Å²	36.2	33%	0.329	20%	0.2	S	C	.	.			trans	-151.3	0	163.5	62.3	-93.3	0	0	0	111.1	Q115 W118 K124 C125	Q115-Y231 PolarHBondContact N-OH 2.89Å; Q115-Y231 VanDerWaalsContact N-OH 3.14Å; W118-Y231 HydrophobicContact CD2-CD1 4.46Å; W118-Y231 AromaticContact CD2-CE1 3.59Å; W118-Y231 HydrophobicContact CD2-CE1 3.59Å; W118-Y231 AromaticContact CE2-CE1 3.79Å; W118-Y231 AromaticContact CE3-CD1 3.85Å; W118-Y231 HydrophobicContact CE3-CD1 3.85Å; W118-Y231 AromaticContact CE3-CE1 3.36Å; W118-Y231 HydrophobicContact CE3-CE1 3.36Å; W118-Y231 HydrophobicContact CG-CE1 4.44Å; W118-Y231 AromaticContact CH2-CD1 3.69Å; W118-Y231 HydrophobicContact CH2-CD1 3.69Å; W118-Y231 AromaticContact CH2-CE1 3.65Å; W118-Y231 HydrophobicContact CH2-CE1 3.65Å; W118-Y231 HydrophobicContact CZ2-CD1 4.29Å; W118-Y231 AromaticContact CZ2-CE1 3.83Å; W118-Y231 HydrophobicContact CZ2-CE1 3.83Å; W118-Y231 AromaticContact CZ3-CD1 3.44Å; W118-Y231 HydrophobicContact CZ3-CD1 3.44Å; W118-Y231 VanDerWaalsContact CZ3-CD1 3.44Å; W118-Y231 AromaticContact CZ3-CE1 3.41Å; W118-Y231 HydrophobicContact CZ3-CE1 3.41Å; W118-Y231 VanDerWaalsContact CZ3-CE1 3.41Å; K124-Y231 WeakPolarHBondContact CA-O 3.49Å; C125-Y231 HydrophobicContact CB-CD1 4.21Å; C125-Y231 HydrophobicContact CB-CD2 4.11Å; C125-Y231 HydrophobicContact CB-CE1 3.76Å; C125-Y231 HydrophobicContact CB-CE2 3.63Å; C125-Y231 HydrophobicContact CB-CG 4.37Å; C125-Y231 VanDerWaalsContact CB-CZ 3.43Å; C125-Y231 PolarHBondContact N-O 2.89Å; C125-Y231 PolarHBondContact O-N 2.77Å; C125-Y231 VanDerWaalsContact O-N 3.17Å; C125-Y231 VanDerWaalsContact SG-CE2 3.51Å

Retrieved 231 of 231 residues in 264.9 ms (Link to these results)

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