A0A087YBH0_POEFO Loading...

Nipsnap homolog 1 (C. elegans)

Protein involved in mitophagy. Accumulates on the mitochondria surface in response to mitochondrial depolarization and acts as a 'eat me' signal by recruiting proteins involved in selective autophagy.

AlphaFold DB , UniProt , Accession A0A087YBH0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 278 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	33.4	Very low	28.1	Very low	245 Å²	245	150.3 Å²	150.3	100%	1.207	83%	0.832	S	S	*	*				0	131.3	0	-79.1	-178.4	-167.1	0	0	108.4
2	A	27.1	Very low	28.1	Very low	90 Å²	90	143.8 Å²	143.8	74%	0.744	82%	0.824	S	S	*	*			trans	47.9	113.1	151.3	0	0	0	0	0	119.6
3	V	26.7	Very low	28.2	Very low	145 Å²	145	146.5 Å²	146.5	88%	0.879	83%	0.833	S	S	*	*				69.9	129	78.2	174.9	0	0	0	0	109.6
4	S	26.6	Very low	28.3	Very low	95 Å²	95	144.2 Å²	144.2	66%	0.664	82%	0.823	S	S	*	*			cis	-177	153.1	19.2	140	0	0	0	0	107.3
5	C	26.2	Very low	28.4	Very low	123 Å²	123	145.5 Å²	145.5	83%	0.831	83%	0.825	S	S	*	*				-175.7	135.9	116.9	-128.7	0	0	0	0	112.7
6	R	27.4	Very low	28.4	Very low	233 Å²	233	150.8 Å²	150.8	88%	0.879	83%	0.83	S	S	*	*			trans	-72.5	167.8	168.1	-53	175.1	172.9	-162.6	-3.1	108.1
7	S	27.3	Very low	28.4	Very low	96 Å²	96	156.4 Å²	156.4	67%	0.671	84%	0.836	S	S	*	*			cis	178.1	150.4	37	55.5	0	0	0	0	110
8	V	27.4	Very low	28.3	Very low	122 Å²	122	154.8 Å²	154.8	74%	0.739	84%	0.838	S	S	*	*			trans	75	129.6	140.5	179.2	0	0	0	0	115.6
9	Q	27.9	Very low	28.2	Very low	161 Å²	161	152.2 Å²	152.2	75%	0.752	83%	0.832	S	S	*	*			cis	-169.8	140	49.5	-142.5	150.9	27.5	0	0	113.3
10	R	27.9	Very low	28.4	Very low	235 Å²	235	151.3 Å²	151.3	89%	0.887	83%	0.831	S	S	*	*			trans	38.2	125.7	140.2	-70.8	-178.9	170.9	-179.4	-3.1	123.5
11	A	31.6	Very low	28.5	Very low	108 Å²	108	154.2 Å²	154.2	89%	0.893	83%	0.831	S	S	*	*				-166.2	139.5	109.7	0	0	0	0	0	106.3
12	G	28.2	Very low	28.3	Very low	72 Å²	72	150.5 Å²	150.5	74%	0.742	82%	0.815	S	S	*	*			cis	142.5	107.9	16	0	0	0	0	0	105.1
13	L	29.4	Very low	28.5	Very low	180 Å²	180	155 Å²	155	94%	0.942	82%	0.821	S	S	*	*			trans	-153.7	137	165.3	-111.7	145.2	0	0	0	111
14	V	29.6	Very low	28.8	Very low	114 Å²	114	157.3 Å²	157.3	69%	0.691	82%	0.822	S	S	*	*			trans	-81.2	135.1	-158	172	0	0	0	0	111.2	Y16	V14-Y16 HydrophobicContact CG1-CD2 4.24Å; V14-Y16 HydrophobicContact CG1-CE2 4.17Å
15	L	28.9	Very low	29.1	Very low	164 Å²	164	157.8 Å²	157.8	86%	0.859	83%	0.831	S	S	*	*			trans	-116.3	119.6	166.5	-75.6	170.7	0	0	0	109	R17	L15-R17 PolarHBondContact O-N 3.04Å
16	Y	28.7	Very low	29.5	Very low	229 Å²	229	157.6 Å²	157.6	90%	0.898	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-70.4	120.3	172.8	-83.9	-94.2	0	0	0	110.1	V14	V14-Y16 HydrophobicContact CG1-CD2 4.24Å; V14-Y16 HydrophobicContact CG1-CE2 4.17Å
17	R	27.7	Very low	29.8	Very low	247 Å²	247	158.6 Å²	158.6	93%	0.932	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-93.3	124.8	168.2	-85.7	-175.8	164.1	-160.2	-3.7	109.1	L15	L15-R17 PolarHBondContact O-N 3.04Å
18	C	26.6	Very low	29.9	Very low	128 Å²	128	164.9 Å²	164.9	87%	0.865	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-101.5	121.2	161.9	-151.3	0	0	0	0	108
19	S	27.9	Very low	30	Very low	104 Å²	104	167.6 Å²	167.6	73%	0.727	85%	0.846	S	S	*	*			trans	-104.7	130.5	179.9	-164.5	0	0	0	0	108.5
20	V	32.4	Very low	30.1	Very low	135 Å²	135	165.4 Å²	165.4	82%	0.818	85%	0.849	S	S	*	*			trans	-128.1	130.6	169	-176.2	0	0	0	0	108.7
21	Y	30	Very low	30.6	Very low	213 Å²	213	163.1 Å²	163.1	84%	0.835	85%	0.848	S	S	*	*			trans	-68.1	140.9	-170.1	-85.5	-103.3	0	0	0	113.6
22	L	28.6	Very low	30.6	Very low	166 Å²	166	163.4 Å²	163.4	87%	0.869	84%	0.843	S	S	*	*			trans	-79.1	121.4	167.2	-87.8	150.6	0	0	0	110
23	H	32.3	Very low	30.9	Very low	185 Å²	185	165.3 Å²	165.3	86%	0.856	85%	0.845	S	S	*	*			trans	-110	116.1	156.6	-96.3	-55	0	0	0	109.7
24	Q	32.2	Very low	31.1	Very low	194 Å²	194	164.7 Å²	164.7	91%	0.907	84%	0.843	S	S	*	*			trans	-71.5	125.6	166.3	-82.6	172.4	-27.1	0	0	109.6
25	A	33.5	Very low	31.4	Very low	104 Å²	104	169.3 Å²	169.3	86%	0.86	85%	0.854	S	S	*	*			trans	-131.9	113.7	157.9	0	0	0	0	0	108.4
26	S	33.6	Very low	31.5	Very low	119 Å²	119	164.4 Å²	164.4	83%	0.832	84%	0.843	S	S	*	*			trans	-85.5	118.9	175	42.4	0	0	0	0	110
27	R	33.3	Very low	32.2	Very low	254 Å²	254	164.5 Å²	164.5	96%	0.958	84%	0.842	S	S	*	*			trans	-141.6	141.6	155	-77.9	-166.1	176.6	174.3	-1.3	110.8
28	R	29.7	Very low	32.8	Very low	229 Å²	229	160.9 Å²	160.9	86%	0.864	83%	0.833	S	S	*	*			trans	-95.9	148.7	-164.2	-113.6	177.8	-177	179.9	0.9	111.2
29	F	29.5	Very low	33.2	Very low	178 Å²	178	166.2 Å²	166.2	78%	0.781	84%	0.835	S	S	*	*			trans	66.8	109.8	158.4	-75.5	-78.3	0	0	0	120.7
30	S	29.8	Very low	34	Very low	115 Å²	115	166.7 Å²	166.7	80%	0.804	84%	0.838	S	S	*	*				-155.2	129.5	110.3	68.4	0	0	0	0	110	S32	S30-S32 PolarHBondContact O-N 3.38Å
31	E	38.3	Very low	34.3	Very low	188 Å²	188	167.5 Å²	167.5	88%	0.879	84%	0.837	S	S	*	*			trans	-61.9	126.5	170	-75.3	172.2	131.3	0	0	110.9
32	S	31.6	Very low	34.8	Very low	113 Å²	113	166.6 Å²	166.6	79%	0.79	84%	0.838	S	S	*	*			trans	-149.4	105.1	144.1	74	0	0	0	0	108.7	S30 D34	S30-S32 PolarHBondContact O-N 3.38Å; S32-D34 PolarHBondContact O-N 2.92Å
33	S	35.4	Very low	35.4	Very low	112 Å²	112	164 Å²	164	78%	0.783	83%	0.829	S	S	*	*			trans	-66.2	118.8	172.4	53.3	0	0	0	0	110.5
34	D	33.4	Very low	35.5	Very low	168 Å²	168	163.1 Å²	163.1	90%	0.898	83%	0.825	S	S	*	*			trans	-142.2	81.2	153.8	-107.6	-19.2	0	0	0	110.1	S32	S32-D34 PolarHBondContact O-N 2.92Å
35	K	35	Very low	35.6	Very low	210 Å²	210	163.1 Å²	163.1	91%	0.913	82%	0.822	S	S	*	*			trans	-106.4	120.3	159.3	-73.4	-177.4	178.6	178.5	0	106.3
36	G	31.1	Very low	36.2	Very low	61 Å²	61	163.7 Å²	163.7	63%	0.629	81%	0.814	S	S	*	*			trans	168.8	57.1	169	0	0	0	0	0	117.6	F38	G36-F38 PolarHBondContact O-N 3.39Å
37	W	44.3	Very low	36.3	Very low	232 Å²	232	164.5 Å²	164.5	88%	0.879	81%	0.809	S	S	*	*			trans	-65.4	38.9	158.6	170.2	55.6	0	0	0	112.5
38	F	39.6	Very low	37	Very low	170 Å²	170	156.8 Å²	156.8	75%	0.746	80%	0.8	S	S	*	*			trans	-144.6	72	179.9	-70.2	-73.7	0	0	0	110.7	G36	G36-F38 PolarHBondContact O-N 3.39Å
39	R	35.9	Very low	38	Very low	241 Å²	241	154 Å²	154	91%	0.909	79%	0.79	S	S	*	*			trans	-140.6	67.1	159.3	-79.5	-166.3	174.6	-176.1	-0.6	111.1
40	S	43.6	Very low	39	Very low	114 Å²	114	155.3 Å²	155.3	80%	0.797	80%	0.795	S	S	*	*			trans	-129.9	66.5	155.8	172.8	0	0	0	0	108.5
41	L	40.3	Very low	40	Very low	152 Å²	152	155 Å²	155	80%	0.796	78%	0.784	S	S	*	*			trans	-134.8	54.4	167.7	-76.9	172.9	0	0	0	108.9	V43	L41-V43 HydrophobicContact CD2-CG2 4.27Å; L41-V43 PolarHBondContact O-N 3.01Å
42	F	39.1	Very low	41	Very low	193 Å²	193	148.6 Å²	148.6	85%	0.846	76%	0.763	S	S	*	*			trans	-86.2	75.1	150	-73	-76.6	0	0	0	107.1	H44	F42-H44 VanDerWaalsContact C-N 3.33Å; F42-H44 PolarHBondContact O-N 2.96Å
43	V	42.5	Very low	42.2	Very low	113 Å²	113	148.2 Å²	148.2	69%	0.685	75%	0.749	S	S	*	*			trans	-56.6	107.2	155.1	174.5	0	0	0	0	104.3	L41 K45	L41-V43 HydrophobicContact CD2-CG2 4.27Å; L41-V43 PolarHBondContact O-N 3.01Å; V43-K45 PolarHBondContact O-N 3.38Å
44	H	34.5	Very low	43.3	Very low	165 Å²	165	143.7 Å²	143.7	76%	0.764	72%	0.718	S	S	*	*			trans	-50.7	112.9	162.7	-92.2	47.6	0	0	0	105.4	F42 V46	F42-H44 VanDerWaalsContact C-N 3.33Å; F42-H44 PolarHBondContact O-N 2.96Å; H44-V46 PolarHBondContact O-N 3.46Å
45	K	34.4	Very low	44.8	Very low	195 Å²	195	138.8 Å²	138.8	85%	0.848	69%	0.691	S	S	*	*			trans	-61.1	91.5	166.3	-93.3	-177.8	173.3	179.2	0	105.5	V43 D47	V43-K45 PolarHBondContact O-N 3.38Å; K45-D47 PolarHBondContact O-N 3.23Å
46	V	45.1	Very low	46.4	Very low	115 Å²	115	133 Å²	133	70%	0.697	67%	0.67	S	S	*	*			trans	-71.2	106.3	163.8	178.6	0	0	0	0	103.7	H44 A48	H44-V46 PolarHBondContact O-N 3.46Å; V46-A48 PolarHBondContact O-N 3.46Å
47	D	35.3	Very low	48.5	Very low	136 Å²	136	130.1 Å²	130.1	73%	0.727	64%	0.64	S	S	*	*			trans	-50.9	126.7	169.9	-73.2	-42.5	0	0	0	108.1	K45 R49	K45-D47 PolarHBondContact O-N 3.23Å; D47-R49 PolarHBondContact O-N 3.46Å
48	A	47.9	Very low	50	Low	93 Å²	93	119.5 Å²	119.5	77%	0.769	60%	0.601	S	S	*	*			trans	-59.4	104	176.4	0	0	0	0	0	107.7	V46 K50	V46-A48 PolarHBondContact O-N 3.46Å; A48-K50 PolarHBondContact O-N 3.12Å
49	R	51.9	Low	51.4	Low	170 Å²	170	114.3 Å²	114.3	64%	0.642	58%	0.578	S	S	*	*			trans	-62	132.1	-179.4	-67.8	-179	179	174.3	-0.4	108.5	D47	D47-R49 PolarHBondContact O-N 3.46Å
50	K	50.1	Low	52.6	Low	205 Å²	205	111.4 Å²	111.4	89%	0.891	57%	0.572	S	S	*	*			trans	-84.1	-10.8	-174.2	-67.6	-175.8	178.5	179.6	0	114	A48	A48-K50 PolarHBondContact O-N 3.12Å
51	D	51.2	Low	53.1	Low	109 Å²	109	113.2 Å²	113.2	58%	0.583	57%	0.568	S	S	*	*	S	Bend	trans	-94.8	138.7	-179.8	-60.9	-36.5	0	0	0	111.6	H53	D51-H53 PolarHBondContact O-N 3.01Å
52	A	58.8	Low	53.7	Low	53 Å²	53	112 Å²	112	44%	0.438	57%	0.567	S	S	.	*			trans	-57.5	130.1	173.1	0	0	0	0	0	110	S54 N55	A52-S54 PolarHBondContact O-N 2.66Å; A52-N55 PolarHBondContact O-N 3.32Å
53	H	56.9	Low	55.2	Low	105 Å²	105	103.6 Å²	103.6	49%	0.486	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-25.2	-177.9	-79.2	-83.4	0	0	0	114.1	D51	D51-H53 PolarHBondContact O-N 3.01Å
54	S	59.3	Low	57.4	Low	18 Å²	18	99 Å²	99	13%	0.126	50%	0.504	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-42.9	176	47.5	0	0	0	0	113.2	A52 L56 L57 S58	A52-S54 PolarHBondContact O-N 2.66Å; S54-L56 VanDerWaalsContact C-N 3.25Å; S54-L56 PolarHBondContact O-N 3.38Å; S54-L57 PolarHBondContact O-N 3.23Å; S54-S58 PolarHBondContact O-N 3.33Å; S54-S58 PolarHBondContact O-OG 2.87Å; S54-S58 VanDerWaalsContact O-OG 3.07Å
55	N	64.1	Low	60.2	Low	64 Å²	64	91.2 Å²	91.2	34%	0.342	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-24.3	-170	-69.1	-2.1	0	0	0	113.3	A52 E61	A52-N55 PolarHBondContact O-N 3.32Å; N55-E61 PolarHBondContact ND2-OE1 3.13Å; N55-E61 PolarHBondContact OD1-OE1 3.4Å
56	L	68.1	Low	63.2	Low	88 Å²	88	82 Å²	82	46%	0.461	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-22.2	176.1	-66.1	173.3	0	0	0	112.8	S54 L192	S54-L56 VanDerWaalsContact C-N 3.25Å; S54-L56 PolarHBondContact O-N 3.38Å; L56-L192 HydrophobicContact CB-CD1 4.13Å; L56-L192 HydrophobicContact CD1-CD1 4.34Å; L56-L192 HydrophobicContact CD1-CD2 4.01Å
57	L	74.8	Confident	65.7	Low	2 Å²	2	77.5 Å²	77.5	1%	0.01	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-28.7	-173.1	-69.2	172.5	0	0	0	112.7	S54 F164 S165 F166 M191 L192 F216	S54-L57 PolarHBondContact O-N 3.23Å; L57-F164 HydrophobicContact CB-CD1 4.13Å; L57-F164 HydrophobicContact CB-CE1 4.26Å; L57-F164 HydrophobicContact CD1-CE1 4.24Å; L57-F164 HydrophobicContact CD2-CE1 4.44Å; L57-F164 CarbonylContact O-C 3.59Å; L57-F164 WeakPolarHBondContact O-CA 3.26Å; L57-S165 PolarHBondContact O-N 3.45Å; L57-S165 PolarHBondContact O-OG 2.89Å; L57-F166 HydrophobicContact CD2-CE1 4.33Å; L57-M191 HydrophobicContact CD1-CG 3.88Å; L57-L192 HydrophobicContact CD1-CD1 4.17Å; L57-L192 HydrophobicContact CD2-CD1 3.82Å; L57-L192 HydrophobicContact CG-CD1 3.85Å; L57-F216 HydrophobicContact CB-CE1 4.04Å; L57-F216 HydrophobicContact CB-CZ 3.96Å
58	S	76.7	Confident	68.7	Low	9 Å²	9	71.3 Å²	71.3	6%	0.063	37%	0.366	C	S	.	.	B	Isolated β-bridge	trans	-87.8	158.5	-179.2	66.4	0	0	0	0	112.8	S54 E163	S54-S58 PolarHBondContact O-N 3.33Å; S54-S58 PolarHBondContact O-OG 2.87Å; S54-S58 VanDerWaalsContact O-OG 3.07Å; S58-E163 VanDerWaalsContact CA-O 3.32Å; S58-E163 WeakPolarHBondContact CA-O 3.48Å
59	K	68.1	Low	71.1	Confident	61 Å²	61	67.7 Å²	67.7	27%	0.265	33%	0.333	S	S	.	.	S	Bend	trans	-59	144.7	158.3	-57.6	-176.7	-173.6	167.5	0	107.1	S63 E163 W167	K59-S63 WeakPolarHBondContact O-CB 3.25Å; K59-S63 PolarHBondContact O-OG 3.29Å; K59-E163 HydrophobicContact CD-CG 4.19Å; K59-E163 HydrophobicContact CG-CG 4.27Å; K59-W167 PolarHBondContact NZ-O 2.93Å
60	K	62.1	Low	73.3	Confident	180 Å²	180	60.6 Å²	60.6	78%	0.783	31%	0.307	S	S	*	.			trans	-38.9	154.5	-170.7	-71.3	-177.6	175.8	-178.9	0	114.2	T62 S63	K60-T62 PolarHBondContact O-N 2.94Å; K60-S63 WeakPolarHBondContact O-CA 3.49Å; K60-S63 WeakPolarHBondContact O-CB 3.32Å; K60-S63 PolarHBondContact O-N 3.29Å; K60-S63 PolarHBondContact O-OG 3.48Å
61	E	53.6	Low	75.6	Confident	152 Å²	152	51 Å²	51	71%	0.71	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-13.2	-174.5	-71.5	-179.7	157.8	0	0	117.1	N55 S63	N55-E61 PolarHBondContact ND2-OE1 3.13Å; N55-E61 PolarHBondContact OD1-OE1 3.4Å; E61-S63 PolarHBondContact O-N 2.92Å
62	T	53.9	Low	77.9	Confident	127 Å²	127	47.6 Å²	47.6	78%	0.779	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	9.1	168.7	57.5	0	0	0	0	113.7	K60	K60-T62 PolarHBondContact O-N 2.94Å
63	S	70.1	Confident	79.8	Confident	16 Å²	16	45.1 Å²	45.1	11%	0.112	23%	0.226	C	C	.	.	S	Bend	trans	-78.5	168.1	-173.8	58.7	0	0	0	0	113.9	K59 K60 E61 L65	K59-S63 WeakPolarHBondContact O-CB 3.25Å; K59-S63 PolarHBondContact O-OG 3.29Å; K60-S63 WeakPolarHBondContact O-CA 3.49Å; K60-S63 WeakPolarHBondContact O-CB 3.32Å; K60-S63 PolarHBondContact O-N 3.29Å; K60-S63 PolarHBondContact O-OG 3.48Å; E61-S63 PolarHBondContact O-N 2.92Å; S63-L65 PolarHBondContact O-N 3.48Å
64	N	88.6	Confident	81.8	Confident	16 Å²	16	43.7 Å²	43.7	9%	0.086	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-59.6	124.6	178.3	-60.8	-47.9	0	0	0	110.6	Y66 R121 R123 E163	N64-Y66 HydrophobicContact CB-CD2 4.24Å; N64-Y66 HydrophobicContact CB-CE2 3.45Å; N64-Y66 VanDerWaalsContact CB-CE2 3.45Å; N64-R121 HydrophobicContact CB-CG 3.96Å; N64-R123 PolarHBondContact OD1-NH1 3.08Å; N64-E163 PolarHBondContact ND2-OE1 2.86Å
65	L	94.3	Very high	83.6	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	131.9	165.7	-177.3	71.1	0	0	0	108.3	S63 Y122 Y126 L129 L160 L162	S63-L65 PolarHBondContact O-N 3.48Å; L65-Y122 PolarHBondContact N-O 3.29Å; L65-Y122 PolarHBondContact O-N 2.89Å; L65-Y126 HydrophobicContact CD1-CE1 4.27Å; L65-Y126 HydrophobicContact CD2-CD1 3.67Å; L65-Y126 HydrophobicContact CD2-CE1 3.87Å; L65-Y126 HydrophobicContact CD2-CG 4.11Å; L65-L129 HydrophobicContact CD2-CB 4.07Å; L65-L129 HydrophobicContact CD2-CD2 3.6Å; L65-L129 HydrophobicContact CD2-CG 4.47Å; L65-L160 HydrophobicContact CD1-CB 4.38Å; L65-L160 HydrophobicContact CD2-CD1 4.5Å; L65-L160 HydrophobicContact CD2-CD2 4.33Å; L65-L162 HydrophobicContact CD1-CD2 4.21Å
66	Y	96.6	Very high	85.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	150.8	177.9	-66.3	-97.8	0	0	0	110.9	N64 V103 L119 W120 R121 L160 L161 E163 P170 F215	N64-Y66 HydrophobicContact CB-CD2 4.24Å; N64-Y66 HydrophobicContact CB-CE2 3.45Å; N64-Y66 VanDerWaalsContact CB-CE2 3.45Å; Y66-V103 HydrophobicContact CD1-CG2 4.18Å; Y66-V103 HydrophobicContact CE1-CG2 3.94Å; Y66-L119 HydrophobicContact CD1-CD1 4.14Å; Y66-L119 HydrophobicContact CD1-CD2 4.45Å; Y66-L119 HydrophobicContact CD1-CG 4.24Å; Y66-W120 CarbonylContact C-O 3.55Å; Y66-W120 WeakPolarHBondContact CA-O 3.25Å; Y66-R121 HydrophobicContact CD1-CB 3.99Å; Y66-R121 HydrophobicContact CE1-CB 3.8Å; Y66-R121 HydrophobicContact CE1-CG 4.02Å; Y66-L160 CarbonylContact O-C 3.52Å; Y66-L160 WeakPolarHBondContact O-CA 3.46Å; Y66-L161 PolarHBondContact N-O 3.11Å; Y66-L161 PolarHBondContact O-N 3.44Å; Y66-E163 HydrophobicContact CD2-CB 4.39Å; Y66-E163 HydrophobicContact CE2-CB 3.84Å; Y66-E163 HydrophobicContact CE2-CG 4.11Å; Y66-E163 WeakPolarHBondContact CE2-OE2 3.43Å; Y66-E163 PolarHBondContact OH-OE2 3.23Å; Y66-P170 HydrophobicContact CE1-CG 3.96Å; Y66-F215 HydrophobicContact CD1-CD1 4.48Å; Y66-F215 AromaticContact CD1-CE1 3.77Å; Y66-F215 HydrophobicContact CD1-CE1 3.77Å; Y66-F215 HydrophobicContact CD1-CZ 4.43Å; Y66-F215 HydrophobicContact CD2-CD1 4.04Å; Y66-F215 AromaticContact CD2-CE1 3.88Å; Y66-F215 HydrophobicContact CD2-CE1 3.88Å; Y66-F215 AromaticContact CE1-CE1 3.83Å; Y66-F215 HydrophobicContact CE1-CE1 3.83Å; Y66-F215 HydrophobicContact CE1-CZ 4.41Å; Y66-F215 HydrophobicContact CE2-CD1 4.42Å; Y66-F215 AromaticContact CE2-CE1 3.95Å; Y66-F215 HydrophobicContact CE2-CE1 3.95Å; Y66-F215 HydrophobicContact CG-CD1 4.05Å; Y66-F215 AromaticContact CG-CE1 3.78Å; Y66-F215 HydrophobicContact CG-CE1 3.78Å; Y66-F215 AromaticContact CZ-CE1 3.92Å
67	K	97.8	Very high	86.7	Confident	22 Å²	22	47 Å²	47	10%	0.096	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	115.6	169.5	-177	-173.4	70.8	-171.1	0	108.6	Q69 W120 Y122 N158 Q159 L160	K67-Q69 HydrophobicContact CD-CG 4.32Å; K67-Q69 HydrophobicContact CG-CG 4.2Å; K67-W120 HydrophobicContact CB-CB 4.35Å; K67-W120 PolarHBondContact N-O 2.84Å; K67-W120 PolarHBondContact O-N 3.3Å; K67-Y122 HydrophobicContact CB-CE2 3.82Å; K67-Y122 WeakPolarHBondContact CE-OH 3.32Å; K67-Y122 PolarHBondContact NZ-OH 3.2Å; K67-N158 HydrophobicContact CG-CB 4.47Å; K67-Q159 VanDerWaalsContact CA-O 3.31Å; K67-Q159 WeakPolarHBondContact CA-O 3.45Å; K67-L160 HydrophobicContact CB-CD2 3.8Å; K67-L160 HydrophobicContact CD-CD2 4.5Å; K67-L160 HydrophobicContact CG-CD2 3.99Å
68	I	98.4	Very high	87.8	Confident	6 Å²	6	48.5 Å²	48.5	3%	0.031	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	138.9	169	-164.6	163.2	0	0	0	109.1	F70 V117 H118 L119 N158 Q159 L161 L181	I68-F70 HydrophobicContact CB-CE2 4.47Å; I68-F70 HydrophobicContact CD1-CE1 4.34Å; I68-F70 HydrophobicContact CD1-CE2 4.08Å; I68-F70 HydrophobicContact CD1-CZ 3.61Å; I68-F70 HydrophobicContact CG1-CE2 3.92Å; I68-F70 HydrophobicContact CG1-CZ 3.89Å; I68-F70 HydrophobicContact CG2-CE2 3.81Å; I68-F70 HydrophobicContact CG2-CZ 4.42Å; I68-V117 HydrophobicContact CD1-CG1 4.13Å; I68-V117 HydrophobicContact CG1-CG1 4.07Å; I68-H118 CarbonylContact C-O 3.58Å; I68-H118 WeakPolarHBondContact CA-O 3.43Å; I68-L119 HydrophobicContact CB-CD1 4.12Å; I68-N158 CarbonylContact O-C 3.54Å; I68-N158 WeakPolarHBondContact O-CA 3.47Å; I68-N158 VanDerWaalsContact O-CB 3.24Å; I68-N158 WeakPolarHBondContact O-CB 3.46Å; I68-Q159 HydrophobicContact CG2-CB 3.93Å; I68-Q159 PolarHBondContact N-O 2.92Å; I68-Q159 PolarHBondContact O-N 3.42Å; I68-L161 HydrophobicContact CB-CD1 3.87Å; I68-L161 HydrophobicContact CG2-CD1 3.64Å; I68-L161 HydrophobicContact CG2-CD2 4.25Å; I68-L161 HydrophobicContact CG2-CG 4.09Å; I68-L181 HydrophobicContact CD1-CD1 4.34Å; I68-L181 HydrophobicContact CD1-CD2 3.91Å
69	Q	98.3	Very high	88.8	Confident	17 Å²	17	54.2 Å²	54.2	8%	0.079	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	136.8	178	-53.8	-173.8	-111.9	0	0	109.4	K67 H71 V117 H118 W120 Q157 N158	K67-Q69 HydrophobicContact CD-CG 4.32Å; K67-Q69 HydrophobicContact CG-CG 4.2Å; Q69-H71 PolarHBondContact NE2-NE2 3.17Å; Q69-H71 VanDerWaalsContact NE2-NE2 3.17Å; Q69-V117 CarbonylContact O-C 3.54Å; Q69-V117 VanDerWaalsContact O-CA 3.28Å; Q69-V117 WeakPolarHBondContact O-CA 3.14Å; Q69-H118 HydrophobicContact CB-CB 4.31Å; Q69-H118 PolarHBondContact N-O 2.86Å; Q69-H118 PolarHBondContact O-N 3.08Å; Q69-W120 VanDerWaalsContact OE1-CD1 3.26Å; Q69-Q157 WeakPolarHBondContact CA-O 3.47Å; Q69-N158 HydrophobicContact CB-CB 4.37Å; Q69-N158 HydrophobicContact CG-CB 3.91Å
70	F	98.4	Very high	90.2	Very high	21 Å²	21	57.1 Å²	57.1	9%	0.092	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	115.5	173	-58.8	-88.2	0	0	0	107.2	I68 V117 R156 Q157 L181	I68-F70 HydrophobicContact CB-CE2 4.47Å; I68-F70 HydrophobicContact CD1-CE1 4.34Å; I68-F70 HydrophobicContact CD1-CE2 4.08Å; I68-F70 HydrophobicContact CD1-CZ 3.61Å; I68-F70 HydrophobicContact CG1-CE2 3.92Å; I68-F70 HydrophobicContact CG1-CZ 3.89Å; I68-F70 HydrophobicContact CG2-CE2 3.81Å; I68-F70 HydrophobicContact CG2-CZ 4.42Å; F70-V117 HydrophobicContact CD1-CG1 4.18Å; F70-V117 HydrophobicContact CD1-CG2 3.78Å; F70-V117 HydrophobicContact CE1-CG1 3.96Å; F70-V117 HydrophobicContact CE1-CG2 4.05Å; F70-R156 CarbonylContact O-C 3.54Å; F70-R156 WeakPolarHBondContact O-CA 3.4Å; F70-Q157 PolarHBondContact N-O 3.33Å; F70-Q157 PolarHBondContact O-N 2.86Å; F70-L181 HydrophobicContact CE1-CD2 3.7Å; F70-L181 HydrophobicContact CZ-CD2 3.89Å
71	H	98.6	Very high	91.9	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.009	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	112.9	-179.5	-70	177.2	0	0	0	108	Q69 V73 Y81 Q115 A116 L153	Q69-H71 PolarHBondContact NE2-NE2 3.17Å; Q69-H71 VanDerWaalsContact NE2-NE2 3.17Å; H71-V73 PolarHBondContact O-N 2.62Å; H71-Y81 WeakPolarHBondContact CB-OH 3.41Å; H71-Y81 AromaticContact ND1-CZ 3.79Å; H71-Y81 PolarHBondContact ND1-OH 3.36Å; H71-Q115 CarbonylContact O-C 3.55Å; H71-Q115 WeakPolarHBondContact O-CA 3.48Å; H71-A116 PolarHBondContact N-O 3.23Å; H71-A116 PolarHBondContact O-N 3.01Å; H71-L153 HydrophobicContact CB-CD2 3.77Å
72	N	98.6	Very high	94	Very high	38 Å²	38	42.6 Å²	42.6	20%	0.203	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	115	170.7	-69.1	-4.8	0	0	0	107.3	Q115 I154 S155	N72-Q115 VanDerWaalsContact OD1-CG 3.31Å; N72-Q115 WeakPolarHBondContact OD1-CG 3.36Å; N72-Q115 PolarHBondContact OD1-NE2 3.25Å; N72-I154 HydrophobicContact CB-CB 4.29Å; N72-I154 PolarHBondContact O-N 3.06Å; N72-S155 WeakPolarHBondContact CB-OG 3.23Å; N72-S155 PolarHBondContact N-O 2.88Å; N72-S155 PolarHBondContact ND2-OG 3.22Å; N72-S155 PolarHBondContact O-N 2.71Å
73	V	98.8	Very high	96.1	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	150.2	-176.5	-166.6	0	0	0	0	108.1	H71 C77 L78 Y81 D114 A116 M152 L153 I154	H71-V73 PolarHBondContact O-N 2.62Å; V73-C77 HydrophobicContact CG1-CB 4.2Å; V73-L78 HydrophobicContact CB-CD1 4.15Å; V73-L78 HydrophobicContact CG1-CD1 4.46Å; V73-L78 HydrophobicContact CG2-CD1 4.1Å; V73-Y81 HydrophobicContact CG1-CD1 4.42Å; V73-Y81 HydrophobicContact CG1-CD2 4.19Å; V73-Y81 HydrophobicContact CG1-CG 3.86Å; V73-Y81 HydrophobicContact CG2-CD1 3.79Å; V73-Y81 HydrophobicContact CG2-CD2 4.03Å; V73-Y81 HydrophobicContact CG2-CE1 3.92Å; V73-Y81 HydrophobicContact CG2-CE2 4.12Å; V73-Y81 HydrophobicContact CG2-CG 3.86Å; V73-D114 WeakPolarHBondContact CB-O 3.42Å; V73-D114 PolarHBondContact N-O 3.27Å; V73-A116 HydrophobicContact CG2-CB 4.42Å; V73-M152 HydrophobicContact CG1-CB 4.35Å; V73-M152 VanDerWaalsContact CG1-O 3.3Å; V73-M152 WeakPolarHBondContact CG1-O 3.17Å; V73-L153 HydrophobicContact CG2-CD2 4.18Å; V73-I154 WeakPolarHBondContact O-CD1 3.34Å
74	K	98.6	Very high	97.4	Very high	75 Å²	75	41.3 Å²	41.3	33%	0.326	22%	0.217	S	C	.	.			trans	-61.2	130.9	166.8	-66.7	174.7	-178.6	173.3	0	108.4	E76 C77 L78 K151 M152 I154	K74-E76 PolarHBondContact O-N 3.38Å; K74-E76 VanDerWaalsContact O-N 3.17Å; K74-C77 HydrophobicContact CB-CB 4.17Å; K74-C77 PolarHBondContact O-N 3.37Å; K74-L78 PolarHBondContact O-N 2.77Å; K74-K151 WeakPolarHBondContact CE-O 3.28Å; K74-K151 PolarHBondContact NZ-O 2.89Å; K74-M152 WeakPolarHBondContact CG-O 3.31Å; K74-M152 PolarHBondContact N-O 2.95Å; K74-I154 HydrophobicContact CG-CG1 3.82Å
75	P	97.9	Very high	97.8	Very high	71 Å²	71	40.7 Å²	40.7	46%	0.461	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-52.8	-41.1	-175.2	-26.9	33.2	0	0	0	113	C77 L78 D114	P75-C77 PolarHBondContact O-N 3.3Å; P75-L78 PolarHBondContact O-N 2.73Å; P75-D114 HydrophobicContact CG-CB 4.3Å; P75-D114 WeakPolarHBondContact CG-OD2 3.25Å
76	E	98.2	Very high	97.8	Very high	150 Å²	150	41.3 Å²	41.3	70%	0.701	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-69.4	-13.1	179.4	69.3	-84.2	-163.8	0	0	114.6	K74	K74-E76 PolarHBondContact O-N 3.38Å; K74-E76 VanDerWaalsContact O-N 3.17Å
77	C	98.4	Very high	97.8	Very high	20 Å²	20	45.4 Å²	45.4	14%	0.135	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-107.5	-0.1	-177.1	-62.9	0	0	0	0	113.7	V73 K74 P75 D79 E80 Y81 M152	V73-C77 HydrophobicContact CG1-CB 4.2Å; K74-C77 HydrophobicContact CB-CB 4.17Å; K74-C77 PolarHBondContact O-N 3.37Å; P75-C77 PolarHBondContact O-N 3.3Å; C77-D79 VanDerWaalsContact C-N 3.34Å; C77-D79 PolarHBondContact O-N 2.91Å; C77-E80 PolarHBondContact O-N 2.83Å; C77-Y81 VanDerWaalsContact O-CB 3.23Å; C77-Y81 WeakPolarHBondContact O-CB 3.43Å; C77-Y81 PolarHBondContact O-N 3.36Å; C77-M152 HydrophobicContact CB-CB 3.75Å; C77-M152 HydrophobicContact CB-CG 3.97Å
78	L	97.7	Very high	97.6	Very high	32 Å²	32	44.7 Å²	44.7	17%	0.168	24%	0.236	C	C	.	.	H	α-helix	trans	-58.8	-42.7	-169	-174.3	60.5	0	0	0	112.8	V73 K74 P75 N82	V73-L78 HydrophobicContact CB-CD1 4.15Å; V73-L78 HydrophobicContact CG1-CD1 4.46Å; V73-L78 HydrophobicContact CG2-CD1 4.1Å; K74-L78 PolarHBondContact O-N 2.77Å; P75-L78 PolarHBondContact O-N 2.73Å; L78-N82 WeakPolarHBondContact O-CB 3.38Å; L78-N82 PolarHBondContact O-N 3.12Å; L78-N82 PolarHBondContact O-ND2 3Å
79	D	97.2	Very high	97.5	Very high	130 Å²	130	44.6 Å²	44.6	70%	0.695	24%	0.236	S	C	*	.	H	α-helix	trans	-68.7	-42	-179.8	-73.3	-24.3	0	0	0	113.2	C77 N82 S83	C77-D79 VanDerWaalsContact C-N 3.34Å; C77-D79 PolarHBondContact O-N 2.91Å; D79-N82 PolarHBondContact O-N 2.96Å; D79-S83 PolarHBondContact O-N 3.3Å; D79-S83 PolarHBondContact O-OG 3.2Å
80	E	98.1	Very high	97.2	Very high	121 Å²	121	49.8 Å²	49.8	57%	0.565	26%	0.255	S	S	*	.	H	α-helix	trans	-64.3	-45.6	175.8	-171.8	-176.7	173.8	0	0	110.6	C77 N82 S83 L84 M152	C77-E80 PolarHBondContact O-N 2.83Å; E80-N82 VanDerWaalsContact C-N 3.34Å; E80-N82 PolarHBondContact O-N 3.35Å; E80-S83 PolarHBondContact O-N 3.19Å; E80-L84 WeakPolarHBondContact O-CB 3.35Å; E80-L84 PolarHBondContact O-N 2.91Å; E80-M152 HydrophobicContact CG-CE 3.84Å; E80-M152 HydrophobicContact CG-SD 4.3Å; E80-M152 WeakPolarHBondContact OE1-CE 3.42Å
81	Y	98.3	Very high	97	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-57	-46.3	174.7	169.4	-85.9	0	0	0	111.7	H71 V73 C77 S83 L84 E85 A116 H118 R149 M152 L153	H71-Y81 WeakPolarHBondContact CB-OH 3.41Å; H71-Y81 AromaticContact ND1-CZ 3.79Å; H71-Y81 PolarHBondContact ND1-OH 3.36Å; V73-Y81 HydrophobicContact CG1-CD1 4.42Å; V73-Y81 HydrophobicContact CG1-CD2 4.19Å; V73-Y81 HydrophobicContact CG1-CG 3.86Å; V73-Y81 HydrophobicContact CG2-CD1 3.79Å; V73-Y81 HydrophobicContact CG2-CD2 4.03Å; V73-Y81 HydrophobicContact CG2-CE1 3.92Å; V73-Y81 HydrophobicContact CG2-CE2 4.12Å; V73-Y81 HydrophobicContact CG2-CG 3.86Å; C77-Y81 VanDerWaalsContact O-CB 3.23Å; C77-Y81 WeakPolarHBondContact O-CB 3.43Å; C77-Y81 PolarHBondContact O-N 3.36Å; Y81-S83 VanDerWaalsContact C-N 3.32Å; Y81-S83 PolarHBondContact O-N 3.43Å; Y81-L84 PolarHBondContact O-N 3.31Å; Y81-E85 HydrophobicContact CE1-CB 4.39Å; Y81-E85 VanDerWaalsContact O-CB 3.25Å; Y81-E85 WeakPolarHBondContact O-CB 3.22Å; Y81-E85 PolarHBondContact O-N 3.31Å; Y81-A116 HydrophobicContact CD1-CB 4.34Å; Y81-A116 HydrophobicContact CE1-CB 3.4Å; Y81-A116 VanDerWaalsContact CE1-CB 3.4Å; Y81-H118 AromaticContact CZ-NE2 3.89Å; Y81-H118 PolarHBondContact OH-NE2 2.89Å; Y81-R149 HydrophobicContact CD2-CG 3.75Å; Y81-R149 HydrophobicContact CE2-CG 3.58Å; Y81-M152 VanDerWaalsContact CA-SD 3.54Å; Y81-M152 HydrophobicContact CD2-CB 4.5Å; Y81-M152 HydrophobicContact CD2-SD 4.49Å; Y81-L153 HydrophobicContact CD2-CD2 4.23Å; Y81-L153 HydrophobicContact CE2-CD2 3.77Å
82	N	97.8	Very high	96.7	Very high	27 Å²	27	54 Å²	54	14%	0.144	27%	0.27	C	S	.	.	H	α-helix	trans	-63.1	-40.1	179.5	-72.8	-34.5	0	0	0	111.9	L78 D79 E80 A86 N107	L78-N82 WeakPolarHBondContact O-CB 3.38Å; L78-N82 PolarHBondContact O-N 3.12Å; L78-N82 PolarHBondContact O-ND2 3Å; D79-N82 PolarHBondContact O-N 2.96Å; E80-N82 VanDerWaalsContact C-N 3.34Å; E80-N82 PolarHBondContact O-N 3.35Å; N82-A86 WeakPolarHBondContact O-CB 3.17Å; N82-A86 PolarHBondContact O-N 3.34Å; N82-N107 PolarHBondContact ND2-ND2 2.88Å; N82-N107 PolarHBondContact OD1-ND2 2.94Å; N82-N107 PolarHBondContact OD1-OD1 2.93Å
83	S	97.3	Very high	96.4	Very high	84 Å²	84	55.9 Å²	55.9	59%	0.587	28%	0.278	S	S	*	.	H	α-helix	trans	-64.8	-47.6	178.3	-59	0	0	0	0	111.2	D79 E80 Y81 A86 E87	D79-S83 PolarHBondContact O-N 3.3Å; D79-S83 PolarHBondContact O-OG 3.2Å; E80-S83 PolarHBondContact O-N 3.19Å; Y81-S83 VanDerWaalsContact C-N 3.32Å; Y81-S83 PolarHBondContact O-N 3.43Å; S83-A86 PolarHBondContact O-N 2.93Å; S83-E87 PolarHBondContact O-N 3.02Å
84	L	97.1	Very high	96	Very high	32 Å²	32	62.4 Å²	62.4	17%	0.168	31%	0.309	C	S	.	.	H	α-helix	trans	-63.6	-45.2	178.7	-176.7	65.1	0	0	0	111.8	E80 Y81 E87 V88 F145 E148 R149 M152	E80-L84 WeakPolarHBondContact O-CB 3.35Å; E80-L84 PolarHBondContact O-N 2.91Å; Y81-L84 PolarHBondContact O-N 3.31Å; L84-E87 PolarHBondContact O-N 3.33Å; L84-V88 PolarHBondContact O-N 2.91Å; L84-F145 HydrophobicContact CD1-CD2 3.8Å; L84-F145 HydrophobicContact CD1-CE2 4.36Å; L84-F145 HydrophobicContact CD2-CD2 3.98Å; L84-F145 HydrophobicContact CD2-CE2 4.17Å; L84-F145 HydrophobicContact CG-CD2 3.58Å; L84-F145 HydrophobicContact CG-CE2 3.69Å; L84-E148 HydrophobicContact CD2-CB 4.01Å; L84-R149 HydrophobicContact CD2-CB 3.96Å; L84-M152 HydrophobicContact CD2-CE 3.69Å; L84-M152 HydrophobicContact CD2-SD 4.31Å
85	E	96.9	Very high	95.7	Very high	3 Å²	3	61.9 Å²	61.9	1%	0.014	31%	0.309	C	S	.	.	H	α-helix	trans	-68	-39.4	179.5	-171.7	74.9	-149.8	0	0	111.4	Y81 E87 V88 Q89 F145 R149	Y81-E85 HydrophobicContact CE1-CB 4.39Å; Y81-E85 VanDerWaalsContact O-CB 3.25Å; Y81-E85 WeakPolarHBondContact O-CB 3.22Å; Y81-E85 PolarHBondContact O-N 3.31Å; E85-E87 VanDerWaalsContact C-N 3.32Å; E85-E87 PolarHBondContact O-N 3.01Å; E85-V88 PolarHBondContact O-N 3.23Å; E85-Q89 HydrophobicContact CG-CG 4.17Å; E85-Q89 VanDerWaalsContact O-CB 3.23Å; E85-Q89 WeakPolarHBondContact O-CB 3.29Å; E85-Q89 VanDerWaalsContact O-CG 3.23Å; E85-Q89 WeakPolarHBondContact O-CG 3.31Å; E85-Q89 PolarHBondContact O-N 3.46Å; E85-Q89 PolarHBondContact OE1-NE2 3.34Å; E85-F145 WeakPolarHBondContact OE2-CZ 3.41Å; E85-R149 IonicContact OE1-NH1 3.65Å; E85-R149 WeakPolarHBondContact OE2-CD 3.45Å; E85-R149 IonicContact OE2-CZ 2.71Å; E85-R149 IonicContact OE2-NE 2.8Å; E85-R149 IonicContact OE2-NH1 2.62Å; E85-R149 PolarHBondContact OE2-NH1 2.8Å
86	A	96	Very high	95.3	Very high	16 Å²	16	67.7 Å²	67.7	13%	0.132	33%	0.33	C	S	.	.	H	α-helix	trans	-60.2	-39.2	176.4	0	0	0	0	0	112.8	N82 S83 R90 S274	N82-A86 WeakPolarHBondContact O-CB 3.17Å; N82-A86 PolarHBondContact O-N 3.34Å; S83-A86 PolarHBondContact O-N 2.93Å; A86-R90 VanDerWaalsContact O-CB 3.32Å; A86-R90 WeakPolarHBondContact O-CB 3.49Å; A86-R90 PolarHBondContact O-N 2.8Å; A86-S274 VanDerWaalsContact CB-OG 3.25Å; A86-S274 WeakPolarHBondContact CB-OG 3.23Å
87	E	94.9	Very high	94.9	Very high	85 Å²	85	65.6 Å²	65.6	40%	0.397	32%	0.324	S	S	.	.	H	α-helix	trans	-64.8	-44.9	178.1	-167.7	-169.7	155.1	0	0	111.9	S83 L84 E85 R91	S83-E87 PolarHBondContact O-N 3.02Å; L84-E87 PolarHBondContact O-N 3.33Å; E85-E87 VanDerWaalsContact C-N 3.32Å; E85-E87 PolarHBondContact O-N 3.01Å; E87-R91 WeakPolarHBondContact O-CG 3.23Å; E87-R91 PolarHBondContact O-N 3.24Å; E87-R91 VanDerWaalsContact O-N 3.12Å; E87-R91 PolarHBondContact O-NE 3.34Å; E87-R91 IonicContact OE1-CZ 3.72Å; E87-R91 IonicContact OE1-NE 2.66Å; E87-R91 IonicContact OE1-NH1 3.66Å; E87-R91 IonicContact OE1-NH2 3.21Å; E87-R91 PolarHBondContact OE1-NH2 2.93Å; E87-R91 IonicContact OE2-NH2 3.9Å
88	V	94.3	Very high	94.6	Very high	7 Å²	7	65.5 Å²	65.5	4%	0.042	32%	0.321	C	S	.	.	H	α-helix	trans	-73.7	-39.3	179.3	171.1	0	0	0	0	112.1	L84 E85 R90 R91 L92 Y142 F145	L84-V88 PolarHBondContact O-N 2.91Å; E85-V88 PolarHBondContact O-N 3.23Å; V88-R90 VanDerWaalsContact C-N 3.31Å; V88-R90 PolarHBondContact O-N 3.45Å; V88-R91 PolarHBondContact O-N 3.38Å; V88-L92 HydrophobicContact CG1-CD1 3.71Å; V88-L92 HydrophobicContact CG1-CG 4.06Å; V88-L92 WeakPolarHBondContact O-CB 3.39Å; V88-L92 WeakPolarHBondContact O-CG 3.31Å; V88-L92 PolarHBondContact O-N 3.07Å; V88-Y142 HydrophobicContact CG1-CD2 3.96Å; V88-Y142 HydrophobicContact CG1-CE2 4.06Å; V88-F145 HydrophobicContact CB-CD1 4.37Å; V88-F145 HydrophobicContact CB-CD2 3.99Å; V88-F145 HydrophobicContact CB-CE1 4.17Å; V88-F145 HydrophobicContact CB-CE2 3.73Å; V88-F145 HydrophobicContact CB-CG 4.29Å; V88-F145 HydrophobicContact CB-CZ 3.82Å; V88-F145 HydrophobicContact CG1-CD1 4.03Å; V88-F145 HydrophobicContact CG1-CE1 3.81Å; V88-F145 HydrophobicContact CG1-CE2 4.3Å; V88-F145 HydrophobicContact CG1-CG 4.38Å; V88-F145 HydrophobicContact CG1-CZ 3.93Å; V88-F145 HydrophobicContact CG2-CB 4Å; V88-F145 HydrophobicContact CG2-CD1 3.98Å; V88-F145 HydrophobicContact CG2-CD2 3.22Å; V88-F145 HydrophobicContact CG2-CE1 4.23Å; V88-F145 HydrophobicContact CG2-CE2 3.5Å; V88-F145 VanDerWaalsContact CG2-CE2 3.5Å; V88-F145 HydrophobicContact CG2-CG 3.47Å; V88-F145 VanDerWaalsContact CG2-CG 3.47Å; V88-F145 HydrophobicContact CG2-CZ 4Å
89	Q	95.3	Very high	94.4	Very high	5 Å²	5	65.8 Å²	65.8	2%	0.023	33%	0.325	C	S	.	.	H	α-helix	trans	-56.4	-47	173.1	-80.3	-178.5	-2.7	0	0	111.2	E85 H93 V102 S105 H118 W120	E85-Q89 HydrophobicContact CG-CG 4.17Å; E85-Q89 VanDerWaalsContact O-CB 3.23Å; E85-Q89 WeakPolarHBondContact O-CB 3.29Å; E85-Q89 VanDerWaalsContact O-CG 3.23Å; E85-Q89 WeakPolarHBondContact O-CG 3.31Å; E85-Q89 PolarHBondContact O-N 3.46Å; E85-Q89 PolarHBondContact OE1-NE2 3.34Å; Q89-H93 WeakPolarHBondContact O-CB 3.4Å; Q89-H93 PolarHBondContact O-N 2.93Å; Q89-V102 HydrophobicContact CB-CG2 3.86Å; Q89-V102 HydrophobicContact CG-CG2 3.95Å; Q89-S105 VanDerWaalsContact OE1-CB 3.26Å; Q89-S105 PolarHBondContact OE1-OG 3.02Å; Q89-H118 PolarHBondContact NE2-CE1 3Å; Q89-H118 PolarHBondContact NE2-ND1 3.36Å; Q89-W120 HydrophobicContact CB-CH2 4.47Å; Q89-W120 HydrophobicContact CG-CH2 3.83Å; Q89-W120 HydrophobicContact CG-CZ2 3.7Å
90	R	93.6	Very high	94.2	Very high	126 Å²	126	59.8 Å²	59.8	48%	0.475	29%	0.293	S	S	.	.	H	α-helix	trans	-60.9	-48.7	177.2	-169.4	-170.7	-50.1	118.9	6.8	111.9	A86 V88 H93 Q94	A86-R90 VanDerWaalsContact O-CB 3.32Å; A86-R90 WeakPolarHBondContact O-CB 3.49Å; A86-R90 PolarHBondContact O-N 2.8Å; V88-R90 VanDerWaalsContact C-N 3.31Å; V88-R90 PolarHBondContact O-N 3.45Å; R90-H93 PolarHBondContact O-N 3.3Å; R90-Q94 WeakPolarHBondContact O-CB 3.35Å; R90-Q94 WeakPolarHBondContact O-CG 3.4Å; R90-Q94 PolarHBondContact O-N 3.03Å; R90-Q94 VanDerWaalsContact O-N 3.13Å
91	R	92.9	Very high	94	Very high	97 Å²	97	56.4 Å²	56.4	37%	0.366	28%	0.277	S	S	.	.	H	α-helix	trans	-58.3	-53.5	179.1	-79.1	-175.4	-83.7	-176.1	-10.5	111.6	E87 V88 H93 Q94 D95 E141	E87-R91 WeakPolarHBondContact O-CG 3.23Å; E87-R91 PolarHBondContact O-N 3.24Å; E87-R91 VanDerWaalsContact O-N 3.12Å; E87-R91 PolarHBondContact O-NE 3.34Å; E87-R91 IonicContact OE1-CZ 3.72Å; E87-R91 IonicContact OE1-NE 2.66Å; E87-R91 IonicContact OE1-NH1 3.66Å; E87-R91 IonicContact OE1-NH2 3.21Å; E87-R91 PolarHBondContact OE1-NH2 2.93Å; E87-R91 IonicContact OE2-NH2 3.9Å; V88-R91 PolarHBondContact O-N 3.38Å; R91-H93 VanDerWaalsContact C-N 3.31Å; R91-H93 PolarHBondContact O-N 2.85Å; R91-Q94 PolarHBondContact O-N 3.17Å; R91-D95 VanDerWaalsContact O-CB 3.27Å; R91-D95 WeakPolarHBondContact O-CB 3.34Å; R91-D95 PolarHBondContact O-N 3.4Å; R91-E141 IonicContact NH1-OE2 3.76Å; R91-E141 PolarHBondContact NH1-OE2 3.2Å
92	L	93.5	Very high	93.9	Very high	13 Å²	13	56.7 Å²	56.7	7%	0.068	28%	0.279	C	S	.	.	H	α-helix	trans	-66.7	-31.5	-178.3	-66	-179.8	0	0	0	113.3	V88 F98 W120 L136 Y142	V88-L92 HydrophobicContact CG1-CD1 3.71Å; V88-L92 HydrophobicContact CG1-CG 4.06Å; V88-L92 WeakPolarHBondContact O-CB 3.39Å; V88-L92 WeakPolarHBondContact O-CG 3.31Å; V88-L92 PolarHBondContact O-N 3.07Å; L92-F98 HydrophobicContact CD2-CD1 4.01Å; L92-F98 HydrophobicContact CD2-CD2 3.95Å; L92-F98 HydrophobicContact CD2-CE1 4.2Å; L92-F98 HydrophobicContact CD2-CE2 4.15Å; L92-F98 HydrophobicContact CD2-CG 3.87Å; L92-F98 HydrophobicContact CD2-CZ 4.28Å; L92-W120 HydrophobicContact CB-CH2 4.39Å; L92-W120 HydrophobicContact CB-CZ3 4.25Å; L92-W120 HydrophobicContact CD1-CH2 4.09Å; L92-W120 HydrophobicContact CD1-CZ3 4.43Å; L92-L136 HydrophobicContact CD1-CD2 3.96Å; L92-L136 HydrophobicContact CD2-CD2 3.62Å; L92-L136 HydrophobicContact CG-CD2 4.47Å; L92-Y142 HydrophobicContact CD1-CD2 4.29Å; L92-Y142 HydrophobicContact CD1-CE2 4.08Å
93	H	91.7	Very high	93.8	Very high	78 Å²	78	55.8 Å²	55.8	36%	0.361	27%	0.274	S	S	.	.	H	α-helix	trans	-74	-30.2	179.3	-174.3	52.8	0	0	0	113.2	Q89 R90 R91 V102	Q89-H93 WeakPolarHBondContact O-CB 3.4Å; Q89-H93 PolarHBondContact O-N 2.93Å; R90-H93 PolarHBondContact O-N 3.3Å; R91-H93 VanDerWaalsContact C-N 3.31Å; R91-H93 PolarHBondContact O-N 2.85Å; H93-V102 HydrophobicContact CB-CG2 4.13Å; H93-V102 PolarHBondContact ND1-N 3.4Å
94	Q	90.7	Very high	93.7	Very high	139 Å²	139	51.8 Å²	51.8	65%	0.65	25%	0.246	S	C	*	.	H	α-helix	trans	-91.2	-22.3	-178.3	-69.2	176.1	-21.1	0	0	113	R90 R91 Q96	R90-Q94 WeakPolarHBondContact O-CB 3.35Å; R90-Q94 WeakPolarHBondContact O-CG 3.4Å; R90-Q94 PolarHBondContact O-N 3.03Å; R90-Q94 VanDerWaalsContact O-N 3.13Å; R91-Q94 PolarHBondContact O-N 3.17Å; Q94-Q96 PolarHBondContact O-N 3.47Å
95	D	92.1	Very high	93.8	Very high	64 Å²	64	50.3 Å²	50.3	34%	0.342	24%	0.239	S	C	.	.			trans	-79.9	110.4	-178.5	-171.1	-13.5	0	0	0	111.1	R91 D97 F98	R91-D95 VanDerWaalsContact O-CB 3.27Å; R91-D95 WeakPolarHBondContact O-CB 3.34Å; R91-D95 PolarHBondContact O-N 3.4Å; D95-D97 PolarHBondContact O-N 3.43Å; D95-D97 VanDerWaalsContact OD1-CB 3.32Å; D95-D97 WeakPolarHBondContact OD1-CB 3.43Å; D95-D97 PolarHBondContact OD1-N 3.32Å; D95-F98 HydrophobicContact CB-CD2 3.93Å; D95-F98 PolarHBondContact O-N 3.23Å; D95-F98 VanDerWaalsContact OD2-CD2 3.32Å; D95-F98 WeakPolarHBondContact OD2-CD2 3.09Å; D95-F98 VanDerWaalsContact OD2-CE2 3.32Å; D95-F98 WeakPolarHBondContact OD2-CE2 3.45Å
96	Q	89.2	Confident	93.8	Very high	192 Å²	192	50.3 Å²	50.3	90%	0.897	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-19	-179.9	-63.1	-175.9	15.4	0	0	112.9	Q94 F98	Q94-Q96 PolarHBondContact O-N 3.47Å; Q96-F98 PolarHBondContact O-N 3.02Å
97	D	90.8	Very high	93.9	Very high	107 Å²	107	51 Å²	51	57%	0.572	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-18.9	174.6	-71.8	-23.2	0	0	0	111.8	D95 P99 K135	D95-D97 PolarHBondContact O-N 3.43Å; D95-D97 VanDerWaalsContact OD1-CB 3.32Å; D95-D97 WeakPolarHBondContact OD1-CB 3.43Å; D95-D97 PolarHBondContact OD1-N 3.32Å; D97-P99 WeakPolarHBondContact O-CD 3.36Å; D97-K135 WeakPolarHBondContact O-CD 3.48Å; D97-K135 WeakPolarHBondContact O-CE 3.36Å; D97-K135 PolarHBondContact O-NZ 3.08Å
98	F	92.2	Very high	94.1	Very high	18 Å²	18	47.6 Å²	47.6	8%	0.079	23%	0.225	C	C	.	.	S	Bend	trans	-101.4	111.2	174.4	-68.8	-87.4	0	0	0	109.8	L92 D95 Q96 C100 K135 L136	L92-F98 HydrophobicContact CD2-CD1 4.01Å; L92-F98 HydrophobicContact CD2-CD2 3.95Å; L92-F98 HydrophobicContact CD2-CE1 4.2Å; L92-F98 HydrophobicContact CD2-CE2 4.15Å; L92-F98 HydrophobicContact CD2-CG 3.87Å; L92-F98 HydrophobicContact CD2-CZ 4.28Å; D95-F98 HydrophobicContact CB-CD2 3.93Å; D95-F98 PolarHBondContact O-N 3.23Å; D95-F98 VanDerWaalsContact OD2-CD2 3.32Å; D95-F98 WeakPolarHBondContact OD2-CD2 3.09Å; D95-F98 VanDerWaalsContact OD2-CE2 3.32Å; D95-F98 WeakPolarHBondContact OD2-CE2 3.45Å; Q96-F98 PolarHBondContact O-N 3.02Å; F98-C100 PolarHBondContact O-N 3.13Å; F98-K135 HydrophobicContact CD1-CB 4.08Å; F98-K135 HydrophobicContact CE1-CB 3.52Å; F98-K135 HydrophobicContact CZ-CB 4.15Å; F98-L136 HydrophobicContact CD1-CD2 3.84Å; F98-L136 HydrophobicContact CD1-CG 3.97Å; F98-L136 HydrophobicContact CE1-CD2 3.47Å; F98-L136 VanDerWaalsContact CE1-CD2 3.47Å; F98-L136 HydrophobicContact CE1-CG 3.72Å; F98-L136 HydrophobicContact CZ-CD2 4.26Å
99	P	91.7	Very high	94.2	Very high	37 Å²	37	52.4 Å²	52.4	24%	0.24	24%	0.243	C	C	.	.			trans	-78.1	56.1	179.8	33.5	-37.2	0	0	0	111.2	D97 Y122 A128 E131 C132	D97-P99 WeakPolarHBondContact O-CD 3.36Å; P99-Y122 WeakPolarHBondContact O-CD1 3.37Å; P99-A128 HydrophobicContact CB-CB 4.18Å; P99-A128 HydrophobicContact CG-CB 4.33Å; P99-A128 WeakPolarHBondContact CG-O 3.46Å; P99-E131 HydrophobicContact CG-CB 4.4Å; P99-C132 HydrophobicContact CG-CB 4.04Å
100	C	93.8	Very high	94.2	Very high	5 Å²	5	57.9 Å²	57.9	3%	0.034	26%	0.264	C	S	.	.			trans	-140.1	140.1	179.3	70.1	0	0	0	0	111.7	F98 W120 R121 Y122	F98-C100 PolarHBondContact O-N 3.13Å; C100-W120 HydrophobicContact CB-CE3 4.41Å; C100-R121 CarbonylContact C-O 3.41Å; C100-R121 WeakPolarHBondContact CA-O 3.33Å; C100-Y122 HydrophobicContact CB-CD1 3.71Å; C100-Y122 HydrophobicContact CB-CE1 3.35Å
101	E	94.1	Very high	94.3	Very high	50 Å²	50	54.2 Å²	54.2	23%	0.234	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	134.8	179.4	-63.7	170.6	-165	0	0	109.3	V103 W120 R121 R123	E101-V103 PolarHBondContact O-N 2.82Å; E101-W120 CarbonylContact O-C 3.55Å; E101-W120 VanDerWaalsContact O-CA 3.27Å; E101-W120 WeakPolarHBondContact O-CA 3.43Å; E101-R121 HydrophobicContact CB-CB 4.34Å; E101-R121 PolarHBondContact N-O 3.08Å; E101-R121 PolarHBondContact O-N 2.85Å; E101-R121 IonicContact OE2-CZ 3.68Å; E101-R121 IonicContact OE2-NE 3.52Å; E101-R121 PolarHBondContact OE2-NE 2.93Å; E101-R121 IonicContact OE2-NH2 2.84Å; E101-R121 PolarHBondContact OE2-NH2 3.22Å; E101-R123 WeakPolarHBondContact OE1-CD 3.4Å; E101-R123 IonicContact OE1-CZ 3.18Å; E101-R123 IonicContact OE1-NE 3.55Å; E101-R123 PolarHBondContact OE1-NE 3.41Å; E101-R123 IonicContact OE1-NH2 3.86Å; E101-R123 IonicContact OE2-CZ 3.88Å; E101-R123 IonicContact OE2-NE 3.78Å; E101-R123 IonicContact OE2-NH2 3.75Å
102	V	95.4	Very high	94.4	Very high	6 Å²	6	54.7 Å²	54.7	4%	0.036	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	120.7	165.8	-178.5	0	0	0	0	106.6	Q89 H93 W120 P276	Q89-V102 HydrophobicContact CB-CG2 3.86Å; Q89-V102 HydrophobicContact CG-CG2 3.95Å; H93-V102 HydrophobicContact CB-CG2 4.13Å; H93-V102 PolarHBondContact ND1-N 3.4Å; V102-W120 HydrophobicContact CB-CZ3 4.49Å; V102-W120 HydrophobicContact CG2-CD2 4.24Å; V102-W120 HydrophobicContact CG2-CE3 3.69Å; V102-W120 HydrophobicContact CG2-CH2 3.46Å; V102-W120 VanDerWaalsContact CG2-CH2 3.46Å; V102-W120 HydrophobicContact CG2-CZ2 4.01Å; V102-W120 HydrophobicContact CG2-CZ3 3.27Å; V102-P276 HydrophobicContact CB-CG 4.36Å; V102-P276 HydrophobicContact CG1-CG 4.32Å; V102-P276 WeakPolarHBondContact O-CG 3.44Å
103	V	95.8	Very high	94.6	Very high	7 Å²	7	60.2 Å²	60.2	4%	0.042	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-44.7	173.9	179.7	0	0	0	0	109.1	Y66 E101 L119 R121 P170 L277	Y66-V103 HydrophobicContact CD1-CG2 4.18Å; Y66-V103 HydrophobicContact CE1-CG2 3.94Å; E101-V103 PolarHBondContact O-N 2.82Å; V103-L119 WeakPolarHBondContact CA-O 3.27Å; V103-L119 HydrophobicContact CB-CB 4.14Å; V103-L119 HydrophobicContact CB-CD2 3.99Å; V103-L119 HydrophobicContact CB-CG 3.9Å; V103-L119 WeakPolarHBondContact CB-O 3.33Å; V103-L119 HydrophobicContact CG1-CD2 3.72Å; V103-L119 HydrophobicContact CG1-CG 4.22Å; V103-L119 HydrophobicContact CG2-CG 4.29Å; V103-L119 PolarHBondContact N-O 3.4Å; V103-R121 HydrophobicContact CG2-CB 3.48Å; V103-R121 VanDerWaalsContact CG2-CB 3.48Å; V103-P170 HydrophobicContact CG1-CB 3.56Å; V103-P170 HydrophobicContact CG1-CG 3.64Å; V103-L277 HydrophobicContact CG1-CD1 3.96Å; V103-L277 VanDerWaalsContact O-CD1 3.31Å; V103-L277 WeakPolarHBondContact O-CD1 3.13Å; V103-L277 WeakPolarHBondContact O-CG 3.49Å
104	G	96.5	Very high	94.9	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171	162.4	173.3	0	0	0	0	0	112.7	W106 L119 S275	G104-W106 VanDerWaalsContact O-CZ3 3.26Å; G104-W106 WeakPolarHBondContact O-CZ3 3.32Å; G104-L119 PolarHBondContact N-O 2.79Å; G104-L119 PolarHBondContact O-N 2.75Å; G104-S275 WeakPolarHBondContact CA-OG 3.37Å
105	S	97.5	Very high	95.2	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.014	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	127.6	-175.3	171.5	0	0	0	0	107.9	Q89 V117 H118 P271 T272 S275	Q89-S105 VanDerWaalsContact OE1-CB 3.26Å; Q89-S105 PolarHBondContact OE1-OG 3.02Å; S105-V117 WeakPolarHBondContact CA-O 3.32Å; S105-H118 PolarHBondContact OG-CE1 2.92Å; S105-H118 VanDerWaalsContact OG-CE1 3.23Å; S105-H118 PolarHBondContact OG-ND1 2.84Å; S105-H118 VanDerWaalsContact OG-ND1 3.08Å; S105-P271 WeakPolarHBondContact O-CA 3.41Å; S105-T272 VanDerWaalsContact CB-OG1 3.31Å; S105-T272 WeakPolarHBondContact CB-OG1 3.28Å; S105-T272 PolarHBondContact O-N 3.42Å; S105-T272 PolarHBondContact O-OG1 3.43Å; S105-T272 PolarHBondContact OG-OG1 3.17Å; S105-S275 PolarHBondContact N-OG 3.29Å; S105-S275 VanDerWaalsContact O-CB 3.29Å; S105-S275 WeakPolarHBondContact O-CB 3.45Å; S105-S275 PolarHBondContact O-OG 3Å
106	W	97.9	Very high	95.5	Very high	3 Å²	3	50.1 Å²	50.1	1%	0.011	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	156.1	-174.2	-52.7	-100	0	0	0	112	G104 A116 V117 L119 Y179 L228 M269 I270 L277	G104-W106 VanDerWaalsContact O-CZ3 3.26Å; G104-W106 WeakPolarHBondContact O-CZ3 3.32Å; W106-A116 CarbonylContact O-C 3.57Å; W106-A116 WeakPolarHBondContact O-CA 3.32Å; W106-V117 PolarHBondContact N-O 2.88Å; W106-V117 PolarHBondContact O-N 2.81Å; W106-L119 HydrophobicContact CH2-CB 4.2Å; W106-L119 HydrophobicContact CZ3-CB 3.88Å; W106-Y179 AromaticContact CD1-CD2 3.6Å; W106-Y179 AromaticContact CD1-CG 3.76Å; W106-Y179 AromaticContact CE2-CG 3.97Å; W106-Y179 HydrophobicContact CZ2-CD1 4.07Å; W106-Y179 HydrophobicContact CZ2-CE1 4.2Å; W106-Y179 HydrophobicContact CZ2-CG 4.43Å; W106-Y179 AromaticContact NE1-CD1 3.63Å; W106-Y179 AromaticContact NE1-CD2 3.08Å; W106-Y179 AromaticContact NE1-CE2 3.57Å; W106-Y179 AromaticContact NE1-CG 3.14Å; W106-L228 HydrophobicContact CH2-CD2 3.82Å; W106-L228 HydrophobicContact CZ2-CD2 3.97Å; W106-M269 HydrophobicContact CB-CB 3.64Å; W106-M269 HydrophobicContact CB-CE 4.29Å; W106-M269 HydrophobicContact CB-CG 4.49Å; W106-M269 HydrophobicContact CB-SD 4.28Å; W106-M269 HydrophobicContact CD2-CE 3.99Å; W106-M269 HydrophobicContact CE3-CE 4.23Å; W106-M269 HydrophobicContact CG-CB 4.08Å; W106-M269 HydrophobicContact CG-CE 4.01Å; W106-I270 CarbonylContact C-O 3.52Å; W106-I270 VanDerWaalsContact CA-O 3.25Å; W106-I270 WeakPolarHBondContact CA-O 3.49Å; W106-I270 WeakPolarHBondContact CB-O 3.33Å; W106-L277 HydrophobicContact CH2-CD1 3.81Å; W106-L277 HydrophobicContact CZ2-CB 4.18Å; W106-L277 HydrophobicContact CZ2-CD1 3.51Å; W106-L277 HydrophobicContact CZ2-CG 4.47Å
107	N	98	Very high	96	Very high	31 Å²	31	41 Å²	41	17%	0.166	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	140.6	163.7	-66.9	-36.5	0	0	0	110.3	N82 M269 I270	N82-N107 PolarHBondContact ND2-ND2 2.88Å; N82-N107 PolarHBondContact OD1-ND2 2.94Å; N82-N107 PolarHBondContact OD1-OD1 2.93Å; N107-M269 CarbonylContact O-C 3.56Å; N107-M269 WeakPolarHBondContact O-CA 3.34Å; N107-I270 PolarHBondContact N-O 3.06Å; N107-I270 PolarHBondContact O-N 3.41Å
108	T	98.2	Very high	96.3	Very high	13 Å²	13	36 Å²	36	8%	0.08	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	128.7	176.5	-56.3	0	0	0	0	110.4	E112 Q115 R267	T108-E112 WeakPolarHBondContact CB-O 3.22Å; T108-E112 WeakPolarHBondContact CG2-O 3.3Å; T108-Q115 WeakPolarHBondContact CB-O 3.4Å; T108-Q115 PolarHBondContact N-O 3.48Å; T108-Q115 PolarHBondContact OG1-O 2.74Å; T108-R267 HydrophobicContact CG2-CG 3.41Å; T108-R267 VanDerWaalsContact CG2-CG 3.41Å; T108-R267 WeakPolarHBondContact OG1-CD 3.46Å; T108-R267 PolarHBondContact OG1-NE 2.72Å
109	W	96.4	Very high	96.6	Very high	108 Å²	108	35.3 Å²	35.3	41%	0.409	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-48.3	175.1	-170.5	29.6	0	0	0	112.1	Q113 L178 L234 L268 I270	W109-Q113 PolarHBondContact O-NE2 3.33Å; W109-L178 HydrophobicContact CE3-CD1 4.29Å; W109-L234 HydrophobicContact CH2-CD1 4.33Å; W109-L234 HydrophobicContact CZ3-CD1 4.05Å; W109-L268 PolarHBondContact N-O 2.81Å; W109-I270 HydrophobicContact CB-CD1 3.99Å; W109-I270 HydrophobicContact CB-CG1 4.13Å; W109-I270 HydrophobicContact CD2-CD1 3.93Å; W109-I270 HydrophobicContact CE3-CD1 4.13Å; W109-I270 HydrophobicContact CE3-CG1 4.44Å; W109-I270 HydrophobicContact CG-CD1 3.88Å; W109-I270 HydrophobicContact CG-CG1 4.48Å
110	Y	97.1	Very high	96.9	Very high	120 Å²	120	34 Å²	34	47%	0.471	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.2	171.2	-63.7	-85.7	0	0	0	110.3	R267 L268	Y110-R267 WeakPolarHBondContact O-CA 3.41Å; Y110-L268 HydrophobicContact CD2-CB 4.12Å; Y110-L268 HydrophobicContact CD2-CD1 3.73Å; Y110-L268 HydrophobicContact CG-CD1 4.32Å; Y110-L268 PolarHBondContact N-O 3.12Å; Y110-L268 PolarHBondContact O-N 2.7Å
111	G	95.6	Very high	97	Very high	49 Å²	49	34.8 Å²	34.8	51%	0.505	17%	0.17	S	C	.	.	S	Bend	trans	121.3	-141.4	-169.1	0	0	0	0	0	110	Q113	G111-Q113 PolarHBondContact O-N 3.25Å; G111-Q113 VanDerWaalsContact O-N 3.11Å
112	E	95.2	Very high	97	Very high	106 Å²	106	32.5 Å²	32.5	50%	0.495	16%	0.159	S	C	.	.	S	Bend	trans	-68.5	101.4	170.4	-63.1	-72	141.7	0	0	110.1	T108 Q115	T108-E112 WeakPolarHBondContact CB-O 3.22Å; T108-E112 WeakPolarHBondContact CG2-O 3.3Å; E112-Q115 HydrophobicContact CB-CB 4.35Å; E112-Q115 VanDerWaalsContact O-CB 3.28Å; E112-Q115 WeakPolarHBondContact O-CB 3.47Å
113	Q	96.4	Very high	96.8	Very high	130 Å²	130	37.7 Å²	37.7	61%	0.607	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	163.6	178.2	-65	-172	-50	0	0	111.6	W109 G111 Q115	W109-Q113 PolarHBondContact O-NE2 3.33Å; G111-Q113 PolarHBondContact O-N 3.25Å; G111-Q113 VanDerWaalsContact O-N 3.11Å; Q113-Q115 PolarHBondContact O-N 3.14Å; Q113-Q115 VanDerWaalsContact O-N 3.08Å
114	D	97.6	Very high	96.5	Very high	55 Å²	55	39.5 Å²	39.5	29%	0.294	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	23.3	-176.5	-48.7	-58.7	0	0	0	113.6	V73 P75	V73-D114 WeakPolarHBondContact CB-O 3.42Å; V73-D114 PolarHBondContact N-O 3.27Å; P75-D114 HydrophobicContact CG-CB 4.3Å; P75-D114 WeakPolarHBondContact CG-OD2 3.25Å
115	Q	98.4	Very high	96.3	Very high	13 Å²	13	39.9 Å²	39.9	6%	0.061	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	123.1	178.3	-175.2	-178.6	87.4	0	0	111.3	H71 N72 T108 E112 Q113 V117	H71-Q115 CarbonylContact O-C 3.55Å; H71-Q115 WeakPolarHBondContact O-CA 3.48Å; N72-Q115 VanDerWaalsContact OD1-CG 3.31Å; N72-Q115 WeakPolarHBondContact OD1-CG 3.36Å; N72-Q115 PolarHBondContact OD1-NE2 3.25Å; T108-Q115 WeakPolarHBondContact CB-O 3.4Å; T108-Q115 PolarHBondContact N-O 3.48Å; T108-Q115 PolarHBondContact OG1-O 2.74Å; E112-Q115 HydrophobicContact CB-CB 4.35Å; E112-Q115 VanDerWaalsContact O-CB 3.28Å; E112-Q115 WeakPolarHBondContact O-CB 3.47Å; Q113-Q115 PolarHBondContact O-N 3.14Å; Q113-Q115 VanDerWaalsContact O-N 3.08Å; Q115-V117 HydrophobicContact CG-CG2 4.49Å
116	A	98.4	Very high	96	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	137.8	168.6	0	0	0	0	0	110.8	H71 V73 Y81 W106	H71-A116 PolarHBondContact N-O 3.23Å; H71-A116 PolarHBondContact O-N 3.01Å; V73-A116 HydrophobicContact CG2-CB 4.42Å; Y81-A116 HydrophobicContact CD1-CB 4.34Å; Y81-A116 HydrophobicContact CE1-CB 3.4Å; Y81-A116 VanDerWaalsContact CE1-CB 3.4Å; W106-A116 CarbonylContact O-C 3.57Å; W106-A116 WeakPolarHBondContact O-CA 3.32Å
117	V	98.5	Very high	95.8	Very high	1 Å²	1	49 Å²	49	1%	0.006	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	128.2	178	-174.1	0	0	0	0	109.3	I68 Q69 F70 S105 W106 Q115 L181 M269	I68-V117 HydrophobicContact CD1-CG1 4.13Å; I68-V117 HydrophobicContact CG1-CG1 4.07Å; Q69-V117 CarbonylContact O-C 3.54Å; Q69-V117 VanDerWaalsContact O-CA 3.28Å; Q69-V117 WeakPolarHBondContact O-CA 3.14Å; F70-V117 HydrophobicContact CD1-CG1 4.18Å; F70-V117 HydrophobicContact CD1-CG2 3.78Å; F70-V117 HydrophobicContact CE1-CG1 3.96Å; F70-V117 HydrophobicContact CE1-CG2 4.05Å; S105-V117 WeakPolarHBondContact CA-O 3.32Å; W106-V117 PolarHBondContact N-O 2.88Å; W106-V117 PolarHBondContact O-N 2.81Å; Q115-V117 HydrophobicContact CG-CG2 4.49Å; V117-L181 HydrophobicContact CG1-CD2 4.26Å; V117-M269 HydrophobicContact CB-SD 3.9Å; V117-M269 HydrophobicContact CG1-SD 4.23Å; V117-M269 HydrophobicContact CG2-SD 3.75Å
118	H	98.3	Very high	95.6	Very high	1 Å²	1	48 Å²	48	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	132.5	-179.8	-54.3	-57	0	0	0	110.6	I68 Q69 Y81 Q89 S105	I68-H118 CarbonylContact C-O 3.58Å; I68-H118 WeakPolarHBondContact CA-O 3.43Å; Q69-H118 HydrophobicContact CB-CB 4.31Å; Q69-H118 PolarHBondContact N-O 2.86Å; Q69-H118 PolarHBondContact O-N 3.08Å; Y81-H118 AromaticContact CZ-NE2 3.89Å; Y81-H118 PolarHBondContact OH-NE2 2.89Å; Q89-H118 PolarHBondContact NE2-CE1 3Å; Q89-H118 PolarHBondContact NE2-ND1 3.36Å; S105-H118 PolarHBondContact OG-CE1 2.92Å; S105-H118 VanDerWaalsContact OG-CE1 3.23Å; S105-H118 PolarHBondContact OG-ND1 2.84Å; S105-H118 VanDerWaalsContact OG-ND1 3.08Å
119	L	98	Very high	95.5	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.021	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	122.3	174.4	-175.1	64.3	0	0	0	109.3	Y66 I68 V103 G104 W106 F215 L228	Y66-L119 HydrophobicContact CD1-CD1 4.14Å; Y66-L119 HydrophobicContact CD1-CD2 4.45Å; Y66-L119 HydrophobicContact CD1-CG 4.24Å; I68-L119 HydrophobicContact CB-CD1 4.12Å; V103-L119 WeakPolarHBondContact CA-O 3.27Å; V103-L119 HydrophobicContact CB-CB 4.14Å; V103-L119 HydrophobicContact CB-CD2 3.99Å; V103-L119 HydrophobicContact CB-CG 3.9Å; V103-L119 WeakPolarHBondContact CB-O 3.33Å; V103-L119 HydrophobicContact CG1-CD2 3.72Å; V103-L119 HydrophobicContact CG1-CG 4.22Å; V103-L119 HydrophobicContact CG2-CG 4.29Å; V103-L119 PolarHBondContact N-O 3.4Å; G104-L119 PolarHBondContact N-O 2.79Å; G104-L119 PolarHBondContact O-N 2.75Å; W106-L119 HydrophobicContact CH2-CB 4.2Å; W106-L119 HydrophobicContact CZ3-CB 3.88Å; L119-F215 HydrophobicContact CD2-CE1 4.5Å; L119-F215 HydrophobicContact CD2-CE2 3.98Å; L119-F215 HydrophobicContact CD2-CZ 3.73Å; L119-L228 HydrophobicContact CD2-CD2 4.46Å
120	W	97.3	Very high	95.4	Very high	11 Å²	11	46 Å²	46	4%	0.042	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	149.8	176.9	-61.3	79.2	0	0	0	110.4	Y66 K67 Q69 Q89 L92 C100 E101 V102 Y122	Y66-W120 CarbonylContact C-O 3.55Å; Y66-W120 WeakPolarHBondContact CA-O 3.25Å; K67-W120 HydrophobicContact CB-CB 4.35Å; K67-W120 PolarHBondContact N-O 2.84Å; K67-W120 PolarHBondContact O-N 3.3Å; Q69-W120 VanDerWaalsContact OE1-CD1 3.26Å; Q89-W120 HydrophobicContact CB-CH2 4.47Å; Q89-W120 HydrophobicContact CG-CH2 3.83Å; Q89-W120 HydrophobicContact CG-CZ2 3.7Å; L92-W120 HydrophobicContact CB-CH2 4.39Å; L92-W120 HydrophobicContact CB-CZ3 4.25Å; L92-W120 HydrophobicContact CD1-CH2 4.09Å; L92-W120 HydrophobicContact CD1-CZ3 4.43Å; C100-W120 HydrophobicContact CB-CE3 4.41Å; E101-W120 CarbonylContact O-C 3.55Å; E101-W120 VanDerWaalsContact O-CA 3.27Å; E101-W120 WeakPolarHBondContact O-CA 3.43Å; V102-W120 HydrophobicContact CB-CZ3 4.49Å; V102-W120 HydrophobicContact CG2-CD2 4.24Å; V102-W120 HydrophobicContact CG2-CE3 3.69Å; V102-W120 HydrophobicContact CG2-CH2 3.46Å; V102-W120 VanDerWaalsContact CG2-CH2 3.46Å; V102-W120 HydrophobicContact CG2-CZ2 4.01Å; V102-W120 HydrophobicContact CG2-CZ3 3.27Å; W120-Y122 HydrophobicContact CB-CE2 3.95Å
121	R	95.6	Very high	95.4	Very high	20 Å²	20	44.3 Å²	44.3	8%	0.075	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	139.1	175.2	173.3	165.9	65.3	-153.9	-4.9	110.5	N64 Y66 C100 E101 V103 R123 E169 P170	N64-R121 HydrophobicContact CB-CG 3.96Å; Y66-R121 HydrophobicContact CD1-CB 3.99Å; Y66-R121 HydrophobicContact CE1-CB 3.8Å; Y66-R121 HydrophobicContact CE1-CG 4.02Å; C100-R121 CarbonylContact C-O 3.41Å; C100-R121 WeakPolarHBondContact CA-O 3.33Å; E101-R121 HydrophobicContact CB-CB 4.34Å; E101-R121 PolarHBondContact N-O 3.08Å; E101-R121 PolarHBondContact O-N 2.85Å; E101-R121 IonicContact OE2-CZ 3.68Å; E101-R121 IonicContact OE2-NE 3.52Å; E101-R121 PolarHBondContact OE2-NE 2.93Å; E101-R121 IonicContact OE2-NH2 2.84Å; E101-R121 PolarHBondContact OE2-NH2 3.22Å; V103-R121 HydrophobicContact CG2-CB 3.48Å; V103-R121 VanDerWaalsContact CG2-CB 3.48Å; R121-R123 HydrophobicContact CG-CG 4.46Å; R121-R123 VanDerWaalsContact NH2-NH2 3.18Å; R121-E169 IonicContact CZ-OE1 3.77Å; R121-E169 IonicContact NH1-OE1 3.96Å; R121-E169 PolarHBondContact NH1-OE1 3.35Å; R121-P170 PolarHBondContact NH1-O 3.31Å
122	Y	95	Very high	95.4	Very high	2 Å²	2	42 Å²	42	1%	0.008	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	103.8	176.3	-59.2	-89.6	0	0	0	108.4	L65 K67 P99 C100 W120 G125 L129 C132	L65-Y122 PolarHBondContact N-O 3.29Å; L65-Y122 PolarHBondContact O-N 2.89Å; K67-Y122 HydrophobicContact CB-CE2 3.82Å; K67-Y122 WeakPolarHBondContact CE-OH 3.32Å; K67-Y122 PolarHBondContact NZ-OH 3.2Å; P99-Y122 WeakPolarHBondContact O-CD1 3.37Å; C100-Y122 HydrophobicContact CB-CD1 3.71Å; C100-Y122 HydrophobicContact CB-CE1 3.35Å; W120-Y122 HydrophobicContact CB-CE2 3.95Å; Y122-G125 PolarHBondContact O-N 2.79Å; Y122-L129 HydrophobicContact CD1-CB 4.1Å; Y122-L129 HydrophobicContact CD1-CD1 4.01Å; Y122-L129 HydrophobicContact CD2-CB 4.47Å; Y122-L129 HydrophobicContact CD2-CD1 4.08Å; Y122-L129 HydrophobicContact CE1-CD1 3.62Å; Y122-L129 HydrophobicContact CE2-CD1 3.72Å; Y122-L129 HydrophobicContact CG-CB 4.06Å; Y122-L129 HydrophobicContact CG-CD1 4.23Å; Y122-L129 VanDerWaalsContact CZ-CD1 3.48Å; Y122-C132 HydrophobicContact CD1-CB 4.3Å; Y122-C132 HydrophobicContact CE1-CB 3.98Å
123	R	90.9	Very high	95.4	Very high	115 Å²	115	40 Å²	40	43%	0.434	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	129.1	176.8	-59	-162.8	-179.1	-91.6	7.2	108.9	N64 E101 R121 A128 E169	N64-R123 PolarHBondContact OD1-NH1 3.08Å; E101-R123 WeakPolarHBondContact OE1-CD 3.4Å; E101-R123 IonicContact OE1-CZ 3.18Å; E101-R123 IonicContact OE1-NE 3.55Å; E101-R123 PolarHBondContact OE1-NE 3.41Å; E101-R123 IonicContact OE1-NH2 3.86Å; E101-R123 IonicContact OE2-CZ 3.88Å; E101-R123 IonicContact OE2-NE 3.78Å; E101-R123 IonicContact OE2-NH2 3.75Å; R121-R123 HydrophobicContact CG-CG 4.46Å; R121-R123 VanDerWaalsContact NH2-NH2 3.18Å; R123-A128 WeakPolarHBondContact O-CB 3.44Å; R123-E169 IonicContact NH1-OE1 2.67Å; R123-E169 IonicContact NH2-OE1 2.7Å
124	G	89.6	Confident	95.4	Very high	45 Å²	45	39.5 Å²	39.5	46%	0.464	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.6	11.3	-170.1	0	0	0	0	0	114	P127	G124-P127 WeakPolarHBondContact O-CD 3.36Å
125	G	91.5	Very high	95.3	Very high	9 Å²	9	40.3 Å²	40.3	9%	0.093	21%	0.209	C	C	.	.	H	α-helix	trans	69.9	-141.6	164	0	0	0	0	0	115	Y122 A128 L129	Y122-G125 PolarHBondContact O-N 2.79Å; G125-A128 PolarHBondContact O-N 3.41Å; G125-L129 PolarHBondContact O-N 3.19Å; G125-L129 VanDerWaalsContact O-N 3.11Å
126	Y	92.6	Very high	95.2	Very high	101 Å²	101	40 Å²	40	40%	0.396	21%	0.207	S	C	.	.	H	α-helix	trans	-60.2	-40.2	-179.6	-69.7	-75	0	0	0	114.5	L65 L129 T130 L160 I219	L65-Y126 HydrophobicContact CD1-CE1 4.27Å; L65-Y126 HydrophobicContact CD2-CD1 3.67Å; L65-Y126 HydrophobicContact CD2-CE1 3.87Å; L65-Y126 HydrophobicContact CD2-CG 4.11Å; Y126-L129 PolarHBondContact O-N 2.79Å; Y126-T130 WeakPolarHBondContact O-CB 3.37Å; Y126-T130 PolarHBondContact O-N 2.7Å; Y126-T130 PolarHBondContact O-OG1 2.81Å; Y126-L160 HydrophobicContact CE1-CD1 4.15Å; Y126-I219 HydrophobicContact CE1-CD1 3.99Å
127	P	93.8	Very high	95.1	Very high	96 Å²	96	48.4 Å²	48.4	62%	0.623	24%	0.239	S	C	*	.	H	α-helix	trans	-55.2	-50.4	173.2	-29.4	35.1	0	0	0	113.3	G124 L129 T130 E131	G124-P127 WeakPolarHBondContact O-CD 3.36Å; P127-L129 PolarHBondContact O-N 2.74Å; P127-T130 WeakPolarHBondContact O-CB 3.1Å; P127-T130 PolarHBondContact O-N 3.43Å; P127-T130 VanDerWaalsContact O-N 3.1Å; P127-E131 PolarHBondContact O-N 3.34Å
128	A	94.1	Very high	95	Very high	8 Å²	8	52.2 Å²	52.2	7%	0.066	27%	0.271	C	S	.	.	H	α-helix	trans	-62.1	-42.9	179	0	0	0	0	0	112.2	P99 R123 G125 T130 E131 C132	P99-A128 HydrophobicContact CB-CB 4.18Å; P99-A128 HydrophobicContact CG-CB 4.33Å; P99-A128 WeakPolarHBondContact CG-O 3.46Å; R123-A128 WeakPolarHBondContact O-CB 3.44Å; G125-A128 PolarHBondContact O-N 3.41Å; A128-T130 VanDerWaalsContact C-N 3.31Å; A128-T130 PolarHBondContact O-N 2.82Å; A128-E131 PolarHBondContact O-N 3.02Å; A128-C132 VanDerWaalsContact O-CB 3.31Å; A128-C132 WeakPolarHBondContact O-CB 3.26Å; A128-C132 PolarHBondContact O-N 3.32Å
129	L	95	Very high	94.8	Very high	11 Å²	11	54.4 Å²	54.4	6%	0.058	28%	0.282	C	S	.	.	H	α-helix	trans	-58.5	-44.6	172.7	172.3	63.7	0	0	0	111.5	L65 Y122 G125 Y126 P127 C132 L133 L160	L65-L129 HydrophobicContact CD2-CB 4.07Å; L65-L129 HydrophobicContact CD2-CD2 3.6Å; L65-L129 HydrophobicContact CD2-CG 4.47Å; Y122-L129 HydrophobicContact CD1-CB 4.1Å; Y122-L129 HydrophobicContact CD1-CD1 4.01Å; Y122-L129 HydrophobicContact CD2-CB 4.47Å; Y122-L129 HydrophobicContact CD2-CD1 4.08Å; Y122-L129 HydrophobicContact CE1-CD1 3.62Å; Y122-L129 HydrophobicContact CE2-CD1 3.72Å; Y122-L129 HydrophobicContact CG-CB 4.06Å; Y122-L129 HydrophobicContact CG-CD1 4.23Å; Y122-L129 VanDerWaalsContact CZ-CD1 3.48Å; G125-L129 PolarHBondContact O-N 3.19Å; G125-L129 VanDerWaalsContact O-N 3.11Å; Y126-L129 PolarHBondContact O-N 2.79Å; P127-L129 PolarHBondContact O-N 2.74Å; L129-C132 PolarHBondContact O-N 3.06Å; L129-L133 HydrophobicContact CD1-CD1 3.9Å; L129-L133 HydrophobicContact CD1-CD2 4.49Å; L129-L133 HydrophobicContact CD1-CG 3.93Å; L129-L133 HydrophobicContact CG-CD1 3.99Å; L129-L133 HydrophobicContact CG-CG 4.39Å; L129-L133 WeakPolarHBondContact O-CB 3.31Å; L129-L133 VanDerWaalsContact O-CG 3.23Å; L129-L133 WeakPolarHBondContact O-CG 3.36Å; L129-L133 PolarHBondContact O-N 2.69Å; L129-L160 HydrophobicContact CD2-CD1 3.66Å; L129-L160 HydrophobicContact CD2-CD2 3.67Å; L129-L160 HydrophobicContact CD2-CG 4.34Å
130	T	95.1	Very high	94.7	Very high	69 Å²	69	62.8 Å²	62.8	42%	0.423	32%	0.318	S	S	.	.	H	α-helix	trans	-64.4	-46.1	-177.7	-59.1	0	0	0	0	111.1	Y126 P127 A128 L133 Q134	Y126-T130 WeakPolarHBondContact O-CB 3.37Å; Y126-T130 PolarHBondContact O-N 2.7Å; Y126-T130 PolarHBondContact O-OG1 2.81Å; P127-T130 WeakPolarHBondContact O-CB 3.1Å; P127-T130 PolarHBondContact O-N 3.43Å; P127-T130 VanDerWaalsContact O-N 3.1Å; A128-T130 VanDerWaalsContact C-N 3.31Å; A128-T130 PolarHBondContact O-N 2.82Å; T130-L133 PolarHBondContact O-N 2.68Å; T130-Q134 WeakPolarHBondContact O-CG 2.97Å; T130-Q134 PolarHBondContact O-N 2.89Å
131	E	95.6	Very high	94.6	Very high	84 Å²	84	68.3 Å²	68.3	39%	0.393	35%	0.345	S	S	.	.	H	α-helix	trans	-59	-50.1	175.1	-174.8	-170.8	160.7	0	0	111.3	P99 P127 A128 L133 Q134 K135	P99-E131 HydrophobicContact CG-CB 4.4Å; P127-E131 PolarHBondContact O-N 3.34Å; A128-E131 PolarHBondContact O-N 3.02Å; E131-L133 VanDerWaalsContact C-N 3.31Å; E131-L133 PolarHBondContact O-N 3.02Å; E131-Q134 PolarHBondContact O-N 3.47Å; E131-Q134 VanDerWaalsContact O-N 3.14Å; E131-K135 HydrophobicContact CG-CD 4.32Å; E131-K135 PolarHBondContact O-N 3.26Å; E131-K135 WeakPolarHBondContact OE1-CE 3.47Å; E131-K135 IonicContact OE1-NZ 3.6Å; E131-K135 PolarHBondContact OE1-NZ 2.92Å
132	C	96.2	Very high	94.6	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-55.6	-46.8	176.5	179.6	0	0	0	0	111.2	P99 Y122 A128 L129 Q134 K135 L136	P99-C132 HydrophobicContact CG-CB 4.04Å; Y122-C132 HydrophobicContact CD1-CB 4.3Å; Y122-C132 HydrophobicContact CE1-CB 3.98Å; A128-C132 VanDerWaalsContact O-CB 3.31Å; A128-C132 WeakPolarHBondContact O-CB 3.26Å; A128-C132 PolarHBondContact O-N 3.32Å; L129-C132 PolarHBondContact O-N 3.06Å; C132-Q134 VanDerWaalsContact C-N 3.35Å; C132-Q134 PolarHBondContact O-N 3.13Å; C132-K135 PolarHBondContact O-N 2.97Å; C132-L136 WeakPolarHBondContact O-CB 3.48Å; C132-L136 VanDerWaalsContact O-CG 3.23Å; C132-L136 WeakPolarHBondContact O-CG 3.23Å; C132-L136 PolarHBondContact O-N 3.27Å
133	L	95.4	Very high	94.7	Very high	64 Å²	64	72.1 Å²	72.1	34%	0.335	36%	0.364	S	S	.	.	H	α-helix	trans	-64.2	-37	178.7	-71.8	176.3	0	0	0	112.8	L129 T130 E131 R137	L129-L133 HydrophobicContact CD1-CD1 3.9Å; L129-L133 HydrophobicContact CD1-CD2 4.49Å; L129-L133 HydrophobicContact CD1-CG 3.93Å; L129-L133 HydrophobicContact CG-CD1 3.99Å; L129-L133 HydrophobicContact CG-CG 4.39Å; L129-L133 WeakPolarHBondContact O-CB 3.31Å; L129-L133 VanDerWaalsContact O-CG 3.23Å; L129-L133 WeakPolarHBondContact O-CG 3.36Å; L129-L133 PolarHBondContact O-N 2.69Å; T130-L133 PolarHBondContact O-N 2.68Å; E131-L133 VanDerWaalsContact C-N 3.31Å; E131-L133 PolarHBondContact O-N 3.02Å; L133-R137 WeakPolarHBondContact O-CB 3.21Å; L133-R137 WeakPolarHBondContact O-CD 3.38Å; L133-R137 WeakPolarHBondContact O-CG 3.37Å; L133-R137 PolarHBondContact O-N 2.95Å
134	Q	96.6	Very high	95	Very high	121 Å²	121	70.6 Å²	70.6	57%	0.565	36%	0.362	S	S	*	.	H	α-helix	trans	-64.4	-47.8	175.4	-74.4	172.1	-11.8	0	0	111	T130 E131 C132 L136 R137 A138	T130-Q134 WeakPolarHBondContact O-CG 2.97Å; T130-Q134 PolarHBondContact O-N 2.89Å; E131-Q134 PolarHBondContact O-N 3.47Å; E131-Q134 VanDerWaalsContact O-N 3.14Å; C132-Q134 VanDerWaalsContact C-N 3.35Å; C132-Q134 PolarHBondContact O-N 3.13Å; Q134-L136 PolarHBondContact O-N 3.41Å; Q134-R137 PolarHBondContact O-N 3.01Å; Q134-A138 PolarHBondContact O-N 3.46Å
135	K	96.1	Very high	95.3	Very high	72 Å²	72	69 Å²	69	31%	0.313	34%	0.342	S	S	.	.	H	α-helix	trans	-59.3	-46.5	176.1	-70.9	177	168.8	172.5	0	111.5	D97 F98 E131 C132 R137 A138 N139	D97-K135 WeakPolarHBondContact O-CD 3.48Å; D97-K135 WeakPolarHBondContact O-CE 3.36Å; D97-K135 PolarHBondContact O-NZ 3.08Å; F98-K135 HydrophobicContact CD1-CB 4.08Å; F98-K135 HydrophobicContact CE1-CB 3.52Å; F98-K135 HydrophobicContact CZ-CB 4.15Å; E131-K135 HydrophobicContact CG-CD 4.32Å; E131-K135 PolarHBondContact O-N 3.26Å; E131-K135 WeakPolarHBondContact OE1-CE 3.47Å; E131-K135 IonicContact OE1-NZ 3.6Å; E131-K135 PolarHBondContact OE1-NZ 2.92Å; C132-K135 PolarHBondContact O-N 2.97Å; K135-R137 VanDerWaalsContact C-N 3.29Å; K135-R137 PolarHBondContact O-N 3.26Å; K135-A138 PolarHBondContact O-N 3.42Å; K135-A138 VanDerWaalsContact O-N 3.13Å; K135-N139 PolarHBondContact O-N 3.11Å
136	L	95.7	Very high	95.6	Very high	7 Å²	7	73.2 Å²	73.2	4%	0.037	36%	0.355	C	S	.	.	H	α-helix	trans	-62.9	-32.6	177.8	-72.6	175.5	0	0	0	113	L92 F98 C132 Q134 A138 Y142	L92-L136 HydrophobicContact CD1-CD2 3.96Å; L92-L136 HydrophobicContact CD2-CD2 3.62Å; L92-L136 HydrophobicContact CG-CD2 4.47Å; F98-L136 HydrophobicContact CD1-CD2 3.84Å; F98-L136 HydrophobicContact CD1-CG 3.97Å; F98-L136 HydrophobicContact CE1-CD2 3.47Å; F98-L136 VanDerWaalsContact CE1-CD2 3.47Å; F98-L136 HydrophobicContact CE1-CG 3.72Å; F98-L136 HydrophobicContact CZ-CD2 4.26Å; C132-L136 WeakPolarHBondContact O-CB 3.48Å; C132-L136 VanDerWaalsContact O-CG 3.23Å; C132-L136 WeakPolarHBondContact O-CG 3.23Å; C132-L136 PolarHBondContact O-N 3.27Å; Q134-L136 PolarHBondContact O-N 3.41Å; L136-A138 VanDerWaalsContact C-N 3.31Å; L136-Y142 HydrophobicContact CB-CD1 3.77Å; L136-Y142 HydrophobicContact CB-CE1 3.73Å; L136-Y142 HydrophobicContact CD1-CE1 4.09Å; L136-Y142 HydrophobicContact CD2-CD1 3.75Å; L136-Y142 HydrophobicContact CD2-CD2 3.83Å; L136-Y142 HydrophobicContact CD2-CE1 3.9Å; L136-Y142 HydrophobicContact CD2-CE2 4.02Å; L136-Y142 HydrophobicContact CD2-CG 3.68Å; L136-Y142 HydrophobicContact CG-CD1 4.26Å; L136-Y142 HydrophobicContact CG-CE1 4.12Å; L136-Y142 WeakPolarHBondContact O-CD1 3.37Å
137	R	95.8	Very high	95.8	Very high	176 Å²	176	74.2 Å²	74.2	66%	0.664	36%	0.362	S	S	*	.	H	α-helix	trans	-70	-28.3	176.4	-77	168.8	-176.1	-177.2	2.3	112.8	L133 Q134 K135	L133-R137 WeakPolarHBondContact O-CB 3.21Å; L133-R137 WeakPolarHBondContact O-CD 3.38Å; L133-R137 WeakPolarHBondContact O-CG 3.37Å; L133-R137 PolarHBondContact O-N 2.95Å; Q134-R137 PolarHBondContact O-N 3.01Å; K135-R137 VanDerWaalsContact C-N 3.29Å; K135-R137 PolarHBondContact O-N 3.26Å
138	A	95.9	Very high	96	Very high	81 Å²	81	72.5 Å²	72.5	67%	0.669	35%	0.346	S	S	*	.	H	α-helix	trans	-88.6	-18.7	177.4	0	0	0	0	0	113.2	Q134 K135 L136 K140	Q134-A138 PolarHBondContact O-N 3.46Å; K135-A138 PolarHBondContact O-N 3.42Å; K135-A138 VanDerWaalsContact O-N 3.13Å; L136-A138 VanDerWaalsContact C-N 3.31Å; A138-K140 PolarHBondContact O-N 2.78Å
139	N	95.6	Very high	96.2	Very high	47 Å²	47	72.6 Å²	72.6	25%	0.251	34%	0.344	S	S	.	.			trans	-76.9	109.3	-177.3	-175.9	-42.4	0	0	0	111.9	K135 E141 Y142 L143	K135-N139 PolarHBondContact O-N 3.11Å; N139-E141 PolarHBondContact O-N 2.8Å; N139-E141 WeakPolarHBondContact OD1-CB 3.4Å; N139-E141 PolarHBondContact OD1-N 2.74Å; N139-Y142 PolarHBondContact O-N 2.86Å; N139-Y142 PolarHBondContact OD1-N 3.19Å; N139-L143 WeakPolarHBondContact O-CG 3.38Å; N139-L143 PolarHBondContact O-N 2.85Å
140	K	96.4	Very high	96.4	Very high	179 Å²	179	74.4 Å²	74.4	78%	0.778	36%	0.361	S	S	*	.	H	α-helix	trans	-61.5	-40.4	-178.5	-67.8	-178.1	-179.3	176.8	0	113.5	A138 L143 E144	A138-K140 PolarHBondContact O-N 2.78Å; K140-L143 PolarHBondContact O-N 3.47Å; K140-E144 PolarHBondContact O-N 3.28Å
141	E	94.1	Very high	96.5	Very high	127 Å²	127	76.9 Å²	76.9	59%	0.593	37%	0.365	S	S	*	.	H	α-helix	trans	-64.8	-43.7	178.9	-63.8	-178.4	-169.9	0	0	111	R91 N139 L143 E144 F145	R91-E141 IonicContact NH1-OE2 3.76Å; R91-E141 PolarHBondContact NH1-OE2 3.2Å; N139-E141 PolarHBondContact O-N 2.8Å; N139-E141 WeakPolarHBondContact OD1-CB 3.4Å; N139-E141 PolarHBondContact OD1-N 2.74Å; E141-L143 VanDerWaalsContact C-N 3.33Å; E141-L143 PolarHBondContact O-N 3.01Å; E141-E144 PolarHBondContact O-N 3Å; E141-F145 PolarHBondContact O-N 2.9Å
142	Y	95.6	Very high	96.7	Very high	32 Å²	32	73.2 Å²	73.2	13%	0.125	35%	0.349	C	S	.	.	H	α-helix	trans	-65.1	-37.6	176.5	-178.8	-105.6	0	0	0	112.2	V88 L92 L136 N139 E144 F145 R146	V88-Y142 HydrophobicContact CG1-CD2 3.96Å; V88-Y142 HydrophobicContact CG1-CE2 4.06Å; L92-Y142 HydrophobicContact CD1-CD2 4.29Å; L92-Y142 HydrophobicContact CD1-CE2 4.08Å; L136-Y142 HydrophobicContact CB-CD1 3.77Å; L136-Y142 HydrophobicContact CB-CE1 3.73Å; L136-Y142 HydrophobicContact CD1-CE1 4.09Å; L136-Y142 HydrophobicContact CD2-CD1 3.75Å; L136-Y142 HydrophobicContact CD2-CD2 3.83Å; L136-Y142 HydrophobicContact CD2-CE1 3.9Å; L136-Y142 HydrophobicContact CD2-CE2 4.02Å; L136-Y142 HydrophobicContact CD2-CG 3.68Å; L136-Y142 HydrophobicContact CG-CD1 4.26Å; L136-Y142 HydrophobicContact CG-CE1 4.12Å; L136-Y142 WeakPolarHBondContact O-CD1 3.37Å; N139-Y142 PolarHBondContact O-N 2.86Å; N139-Y142 PolarHBondContact OD1-N 3.19Å; Y142-E144 VanDerWaalsContact C-N 3.32Å; Y142-F145 AromaticContact CD2-CD1 3.78Å; Y142-F145 HydrophobicContact CD2-CD1 3.78Å; Y142-F145 HydrophobicContact CD2-CE1 4.24Å; Y142-F145 AromaticContact CE2-CD1 3.76Å; Y142-F145 HydrophobicContact CE2-CD1 3.76Å; Y142-F145 AromaticContact CE2-CE1 3.78Å; Y142-F145 HydrophobicContact CE2-CE1 3.78Å; Y142-R146 HydrophobicContact CD1-CG 4.27Å; Y142-R146 HydrophobicContact CE1-CG 3.86Å; Y142-R146 HydrophobicContact CE2-CG 4.37Å; Y142-R146 WeakPolarHBondContact O-CB 3.48Å; Y142-R146 WeakPolarHBondContact O-CG 3.17Å; Y142-R146 PolarHBondContact O-N 3.36Å
143	L	97.1	Very high	96.8	Very high	70 Å²	70	74.3 Å²	74.3	37%	0.366	35%	0.354	S	S	.	.	H	α-helix	trans	-62.8	-39.9	174.3	-70.2	177.2	0	0	0	111.8	N139 K140 E141 R146 K147	N139-L143 WeakPolarHBondContact O-CG 3.38Å; N139-L143 PolarHBondContact O-N 2.85Å; K140-L143 PolarHBondContact O-N 3.47Å; E141-L143 VanDerWaalsContact C-N 3.33Å; E141-L143 PolarHBondContact O-N 3.01Å; L143-R146 WeakPolarHBondContact O-CB 3.43Å; L143-R146 PolarHBondContact O-N 3.08Å; L143-K147 PolarHBondContact O-N 3.15Å
144	E	97.1	Very high	96.9	Very high	84 Å²	84	76.9 Å²	76.9	39%	0.393	37%	0.367	S	S	.	.	H	α-helix	trans	-69	-46.4	177.1	-165.6	56.1	-150.7	0	0	111.8	K140 E141 Y142 R146 K147 E148	K140-E144 PolarHBondContact O-N 3.28Å; E141-E144 PolarHBondContact O-N 3Å; Y142-E144 VanDerWaalsContact C-N 3.32Å; E144-R146 PolarHBondContact O-N 2.81Å; E144-K147 WeakPolarHBondContact O-CA 3.37Å; E144-K147 WeakPolarHBondContact O-CB 3.07Å; E144-K147 PolarHBondContact O-N 2.87Å; E144-K147 IonicContact OE2-NZ 3.5Å; E144-K147 PolarHBondContact OE2-NZ 2.88Å; E144-E148 PolarHBondContact O-N 2.92Å
145	F	96.8	Very high	97	Very high	11 Å²	11	73.9 Å²	73.9	5%	0.048	36%	0.359	C	S	.	.	H	α-helix	trans	-49.5	-44.9	169.7	156.8	-100.5	0	0	0	111.9	L84 E85 V88 E141 Y142 K147 E148 R149	L84-F145 HydrophobicContact CD1-CD2 3.8Å; L84-F145 HydrophobicContact CD1-CE2 4.36Å; L84-F145 HydrophobicContact CD2-CD2 3.98Å; L84-F145 HydrophobicContact CD2-CE2 4.17Å; L84-F145 HydrophobicContact CG-CD2 3.58Å; L84-F145 HydrophobicContact CG-CE2 3.69Å; E85-F145 WeakPolarHBondContact OE2-CZ 3.41Å; V88-F145 HydrophobicContact CB-CD1 4.37Å; V88-F145 HydrophobicContact CB-CD2 3.99Å; V88-F145 HydrophobicContact CB-CE1 4.17Å; V88-F145 HydrophobicContact CB-CE2 3.73Å; V88-F145 HydrophobicContact CB-CG 4.29Å; V88-F145 HydrophobicContact CB-CZ 3.82Å; V88-F145 HydrophobicContact CG1-CD1 4.03Å; V88-F145 HydrophobicContact CG1-CE1 3.81Å; V88-F145 HydrophobicContact CG1-CE2 4.3Å; V88-F145 HydrophobicContact CG1-CG 4.38Å; V88-F145 HydrophobicContact CG1-CZ 3.93Å; V88-F145 HydrophobicContact CG2-CB 4Å; V88-F145 HydrophobicContact CG2-CD1 3.98Å; V88-F145 HydrophobicContact CG2-CD2 3.22Å; V88-F145 HydrophobicContact CG2-CE1 4.23Å; V88-F145 HydrophobicContact CG2-CE2 3.5Å; V88-F145 VanDerWaalsContact CG2-CE2 3.5Å; V88-F145 HydrophobicContact CG2-CG 3.47Å; V88-F145 VanDerWaalsContact CG2-CG 3.47Å; V88-F145 HydrophobicContact CG2-CZ 4Å; E141-F145 PolarHBondContact O-N 2.9Å; Y142-F145 AromaticContact CD2-CD1 3.78Å; Y142-F145 HydrophobicContact CD2-CD1 3.78Å; Y142-F145 HydrophobicContact CD2-CE1 4.24Å; Y142-F145 AromaticContact CE2-CD1 3.76Å; Y142-F145 HydrophobicContact CE2-CD1 3.76Å; Y142-F145 AromaticContact CE2-CE1 3.78Å; Y142-F145 HydrophobicContact CE2-CE1 3.78Å; F145-K147 VanDerWaalsContact C-N 3.27Å; F145-K147 PolarHBondContact O-N 2.92Å; F145-E148 PolarHBondContact O-N 3.42Å; F145-R149 HydrophobicContact CE2-CB 4.5Å; F145-R149 VanDerWaalsContact O-CB 3.31Å; F145-R149 WeakPolarHBondContact O-CB 3.47Å; F145-R149 PolarHBondContact O-N 3.41Å
146	R	96.8	Very high	97.1	Very high	97 Å²	97	76.8 Å²	76.8	37%	0.366	37%	0.368	S	S	.	.	H	α-helix	trans	-63.2	-32.7	179.3	-81.9	-170.6	65.9	176.1	3.9	112.9	Y142 L143 E144 A150	Y142-R146 HydrophobicContact CD1-CG 4.27Å; Y142-R146 HydrophobicContact CE1-CG 3.86Å; Y142-R146 HydrophobicContact CE2-CG 4.37Å; Y142-R146 WeakPolarHBondContact O-CB 3.48Å; Y142-R146 WeakPolarHBondContact O-CG 3.17Å; Y142-R146 PolarHBondContact O-N 3.36Å; L143-R146 WeakPolarHBondContact O-CB 3.43Å; L143-R146 PolarHBondContact O-N 3.08Å; E144-R146 PolarHBondContact O-N 2.81Å; R146-A150 WeakPolarHBondContact O-CB 3.03Å; R146-A150 PolarHBondContact O-N 2.95Å
147	K	97.9	Very high	97.2	Very high	123 Å²	123	80.6 Å²	80.6	54%	0.535	39%	0.386	S	S	.	.	H	α-helix	trans	-72.2	-47.7	175.7	-66.8	179.8	-158.6	153.7	0	110.8	L143 E144 F145 A150 K151	L143-K147 PolarHBondContact O-N 3.15Å; E144-K147 WeakPolarHBondContact O-CA 3.37Å; E144-K147 WeakPolarHBondContact O-CB 3.07Å; E144-K147 PolarHBondContact O-N 2.87Å; E144-K147 IonicContact OE2-NZ 3.5Å; E144-K147 PolarHBondContact OE2-NZ 2.88Å; F145-K147 VanDerWaalsContact C-N 3.27Å; F145-K147 PolarHBondContact O-N 2.92Å; K147-A150 WeakPolarHBondContact O-CB 3.11Å; K147-A150 PolarHBondContact O-N 3.17Å; K147-A150 VanDerWaalsContact O-N 3.14Å; K147-K151 PolarHBondContact O-N 3.01Å
148	E	98.3	Very high	97.2	Very high	60 Å²	60	76.3 Å²	76.3	28%	0.28	38%	0.376	S	S	.	.	H	α-helix	trans	-60.8	-49.7	179.1	-67.4	-48.7	117.9	0	0	111.3	L84 E144 F145 A150 K151	L84-E148 HydrophobicContact CD2-CB 4.01Å; E144-E148 PolarHBondContact O-N 2.92Å; F145-E148 PolarHBondContact O-N 3.42Å; E148-A150 PolarHBondContact O-N 3.27Å; E148-K151 WeakPolarHBondContact O-CB 3.38Å; E148-K151 PolarHBondContact O-N 2.97Å; E148-K151 WeakPolarHBondContact OE1-CE 3.13Å; E148-K151 IonicContact OE1-NZ 3.32Å; E148-K151 PolarHBondContact OE1-NZ 2.87Å; E148-K151 IonicContact OE2-NZ 3.84Å; E148-K151 PolarHBondContact OE2-NZ 2.87Å
149	R	97.8	Very high	97.3	Very high	10 Å²	10	72.7 Å²	72.7	4%	0.038	35%	0.346	C	S	.	.	H	α-helix	trans	-56.9	-36.2	175.4	-171.8	-176.3	65.5	-171.6	-8.4	112.3	Y81 L84 E85 F145 K151 M152 L153	Y81-R149 HydrophobicContact CD2-CG 3.75Å; Y81-R149 HydrophobicContact CE2-CG 3.58Å; L84-R149 HydrophobicContact CD2-CB 3.96Å; E85-R149 IonicContact OE1-NH1 3.65Å; E85-R149 WeakPolarHBondContact OE2-CD 3.45Å; E85-R149 IonicContact OE2-CZ 2.71Å; E85-R149 IonicContact OE2-NE 2.8Å; E85-R149 IonicContact OE2-NH1 2.62Å; E85-R149 PolarHBondContact OE2-NH1 2.8Å; F145-R149 HydrophobicContact CE2-CB 4.5Å; F145-R149 VanDerWaalsContact O-CB 3.31Å; F145-R149 WeakPolarHBondContact O-CB 3.47Å; F145-R149 PolarHBondContact O-N 3.41Å; R149-K151 PolarHBondContact O-N 2.69Å; R149-M152 PolarHBondContact O-N 2.99Å; R149-M152 VanDerWaalsContact O-N 3.12Å; R149-L153 HydrophobicContact CG-CD1 4.29Å; R149-L153 WeakPolarHBondContact O-CG 3.43Å
150	A	97.9	Very high	97.4	Very high	48 Å²	48	71.7 Å²	71.7	40%	0.397	34%	0.34	S	S	.	.	H	α-helix	trans	-63.8	-27	-178.8	0	0	0	0	0	113.1	R146 K147 E148 M152 L153	R146-A150 WeakPolarHBondContact O-CB 3.03Å; R146-A150 PolarHBondContact O-N 2.95Å; K147-A150 WeakPolarHBondContact O-CB 3.11Å; K147-A150 PolarHBondContact O-N 3.17Å; K147-A150 VanDerWaalsContact O-N 3.14Å; E148-A150 PolarHBondContact O-N 3.27Å; A150-M152 PolarHBondContact O-N 2.8Å; A150-L153 PolarHBondContact O-N 2.6Å
151	K	98.4	Very high	97.4	Very high	121 Å²	121	63.1 Å²	63.1	53%	0.526	30%	0.303	S	S	.	.	H	α-helix	trans	-66.3	-24.8	176.5	-59	174.7	-171.4	167.4	0	112.5	K74 K147 E148 R149	K74-K151 WeakPolarHBondContact CE-O 3.28Å; K74-K151 PolarHBondContact NZ-O 2.89Å; K147-K151 PolarHBondContact O-N 3.01Å; E148-K151 WeakPolarHBondContact O-CB 3.38Å; E148-K151 PolarHBondContact O-N 2.97Å; E148-K151 WeakPolarHBondContact OE1-CE 3.13Å; E148-K151 IonicContact OE1-NZ 3.32Å; E148-K151 PolarHBondContact OE1-NZ 2.87Å; E148-K151 IonicContact OE2-NZ 3.84Å; E148-K151 PolarHBondContact OE2-NZ 2.87Å; R149-K151 PolarHBondContact O-N 2.69Å
152	M	98.6	Very high	97.4	Very high	8 Å²	8	58 Å²	58	4%	0.039	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-10.7	-176.3	-53.8	166.8	-160.5	0	0	113	V73 K74 C77 E80 Y81 L84 R149 A150	V73-M152 HydrophobicContact CG1-CB 4.35Å; V73-M152 VanDerWaalsContact CG1-O 3.3Å; V73-M152 WeakPolarHBondContact CG1-O 3.17Å; K74-M152 WeakPolarHBondContact CG-O 3.31Å; K74-M152 PolarHBondContact N-O 2.95Å; C77-M152 HydrophobicContact CB-CB 3.75Å; C77-M152 HydrophobicContact CB-CG 3.97Å; E80-M152 HydrophobicContact CG-CE 3.84Å; E80-M152 HydrophobicContact CG-SD 4.3Å; E80-M152 WeakPolarHBondContact OE1-CE 3.42Å; Y81-M152 VanDerWaalsContact CA-SD 3.54Å; Y81-M152 HydrophobicContact CD2-CB 4.5Å; Y81-M152 HydrophobicContact CD2-SD 4.49Å; L84-M152 HydrophobicContact CD2-CE 3.69Å; L84-M152 HydrophobicContact CD2-SD 4.31Å; R149-M152 PolarHBondContact O-N 2.99Å; R149-M152 VanDerWaalsContact O-N 3.12Å; A150-M152 PolarHBondContact O-N 2.8Å
153	L	98.5	Very high	97.3	Very high	23 Å²	23	56.8 Å²	56.8	12%	0.12	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	140.7	-173.3	-67.9	174.2	0	0	0	112.2	H71 V73 Y81 R149 A150	H71-L153 HydrophobicContact CB-CD2 3.77Å; V73-L153 HydrophobicContact CG2-CD2 4.18Å; Y81-L153 HydrophobicContact CD2-CD2 4.23Å; Y81-L153 HydrophobicContact CE2-CD2 3.77Å; R149-L153 HydrophobicContact CG-CD1 4.29Å; R149-L153 WeakPolarHBondContact O-CG 3.43Å; A150-L153 PolarHBondContact O-N 2.6Å
154	I	98.5	Very high	97.1	Very high	117 Å²	117	53.5 Å²	53.5	60%	0.6	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	-50.5	163.9	-60.9	173.1	0	0	0	109	N72 V73 K74	N72-I154 HydrophobicContact CB-CB 4.29Å; N72-I154 PolarHBondContact O-N 3.06Å; V73-I154 WeakPolarHBondContact O-CD1 3.34Å; K74-I154 HydrophobicContact CG-CG1 3.82Å
155	S	98.3	Very high	96.8	Very high	58 Å²	58	52.2 Å²	52.2	41%	0.406	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	166.6	179.7	73.9	0	0	0	0	111.6	N72	N72-S155 WeakPolarHBondContact CB-OG 3.23Å; N72-S155 PolarHBondContact N-O 2.88Å; N72-S155 PolarHBondContact ND2-OG 3.22Å; N72-S155 PolarHBondContact O-N 2.71Å
156	R	97.6	Very high	96.4	Very high	133 Å²	133	53.5 Å²	53.5	50%	0.502	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	141.5	175.9	60.5	-177.4	-176	-152.3	-6.6	111.6	F70	F70-R156 CarbonylContact O-C 3.54Å; F70-R156 WeakPolarHBondContact O-CA 3.4Å
157	Q	97.6	Very high	96.1	Very high	87 Å²	87	49.3 Å²	49.3	41%	0.407	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	151.1	172.3	-174	176.2	-2	0	0	109.2	Q69 F70 D221	Q69-Q157 WeakPolarHBondContact CA-O 3.47Å; F70-Q157 PolarHBondContact N-O 3.33Å; F70-Q157 PolarHBondContact O-N 2.86Å; Q157-D221 PolarHBondContact NE2-OD2 2.83Å
158	N	97.1	Very high	95.4	Very high	87 Å²	87	45.9 Å²	45.9	47%	0.465	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	161.7	168.2	63.6	30.5	0	0	0	111.1	K67 I68 Q69	K67-N158 HydrophobicContact CG-CB 4.47Å; I68-N158 CarbonylContact O-C 3.54Å; I68-N158 WeakPolarHBondContact O-CA 3.47Å; I68-N158 VanDerWaalsContact O-CB 3.24Å; I68-N158 WeakPolarHBondContact O-CB 3.46Å; Q69-N158 HydrophobicContact CB-CB 4.37Å; Q69-N158 HydrophobicContact CG-CB 3.91Å
159	Q	97.9	Very high	94.9	Very high	5 Å²	5	46 Å²	46	2%	0.023	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	146.6	175.4	-64	167.2	-72.9	0	0	109.1	K67 I68 L161 I219 D221 H226	K67-Q159 VanDerWaalsContact CA-O 3.31Å; K67-Q159 WeakPolarHBondContact CA-O 3.45Å; I68-Q159 HydrophobicContact CG2-CB 3.93Å; I68-Q159 PolarHBondContact N-O 2.92Å; I68-Q159 PolarHBondContact O-N 3.42Å; Q159-L161 HydrophobicContact CB-CD2 3.73Å; Q159-I219 WeakPolarHBondContact CA-O 3.24Å; Q159-D221 PolarHBondContact NE2-O 3.06Å; Q159-H226 PolarHBondContact OE1-NE2 2.94Å
160	L	97.6	Very high	94.6	Very high	25 Å²	25	45.7 Å²	45.7	13%	0.131	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.8	166.6	-63.8	174.1	0	0	0	108.9	L65 Y66 K67 Y126 L129 Q218 I219	L65-L160 HydrophobicContact CD1-CB 4.38Å; L65-L160 HydrophobicContact CD2-CD1 4.5Å; L65-L160 HydrophobicContact CD2-CD2 4.33Å; Y66-L160 CarbonylContact O-C 3.52Å; Y66-L160 WeakPolarHBondContact O-CA 3.46Å; K67-L160 HydrophobicContact CB-CD2 3.8Å; K67-L160 HydrophobicContact CD-CD2 4.5Å; K67-L160 HydrophobicContact CG-CD2 3.99Å; Y126-L160 HydrophobicContact CE1-CD1 4.15Å; L129-L160 HydrophobicContact CD2-CD1 3.66Å; L129-L160 HydrophobicContact CD2-CD2 3.67Å; L129-L160 HydrophobicContact CD2-CG 4.34Å; L160-Q218 PolarHBondContact O-N 3.32Å; L160-I219 HydrophobicContact CB-CB 4.14Å; L160-I219 HydrophobicContact CD1-CB 4.33Å; L160-I219 HydrophobicContact CD1-CD1 3.97Å; L160-I219 PolarHBondContact N-O 3.15Å; L160-I219 PolarHBondContact O-N 3.4Å
161	L	96.3	Very high	94.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	151.7	-170.4	-43.3	176.2	0	0	0	110.7	Y66 I68 Q159 F215 F216	Y66-L161 PolarHBondContact N-O 3.11Å; Y66-L161 PolarHBondContact O-N 3.44Å; I68-L161 HydrophobicContact CB-CD1 3.87Å; I68-L161 HydrophobicContact CG2-CD1 3.64Å; I68-L161 HydrophobicContact CG2-CD2 4.25Å; I68-L161 HydrophobicContact CG2-CG 4.09Å; Q159-L161 HydrophobicContact CB-CD2 3.73Å; L161-F215 HydrophobicContact CB-CB 4Å; L161-F215 HydrophobicContact CD1-CB 3.68Å; L161-F215 HydrophobicContact CD1-CG 4.15Å; L161-F215 HydrophobicContact CG-CB 4.44Å; L161-F216 VanDerWaalsContact CA-O 3.3Å; L161-F216 WeakPolarHBondContact CA-O 3.5Å
162	L	94.3	Very high	93.7	Very high	20 Å²	20	47.3 Å²	47.3	11%	0.105	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	151.9	161.2	-67.5	172.6	0	0	0	109.5	L65 F215 F216 Q218	L65-L162 HydrophobicContact CD1-CD2 4.21Å; L162-F215 CarbonylContact O-C 3.49Å; L162-F215 WeakPolarHBondContact O-CA 3.21Å; L162-F216 HydrophobicContact CB-CD1 4.36Å; L162-F216 HydrophobicContact CB-CE1 3.75Å; L162-F216 HydrophobicContact CB-CE2 4.12Å; L162-F216 HydrophobicContact CB-CZ 3.63Å; L162-F216 HydrophobicContact CD1-CE2 4.2Å; L162-F216 HydrophobicContact CD1-CZ 4.02Å; L162-F216 HydrophobicContact CG-CZ 4.47Å; L162-F216 PolarHBondContact N-O 3.2Å; L162-F216 WeakPolarHBondContact O-CD1 3.15Å; L162-F216 PolarHBondContact O-N 2.81Å; L162-Q218 HydrophobicContact CB-CG 4.37Å; L162-Q218 HydrophobicContact CD1-CG 3.63Å; L162-Q218 HydrophobicContact CG-CG 3.56Å
163	E	93.1	Very high	93.2	Very high	6 Å²	6	48.7 Å²	48.7	3%	0.028	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	143.7	173.4	66.5	-160.2	169.9	0	0	111	S58 K59 N64 Y66 G214 F215	S58-E163 VanDerWaalsContact CA-O 3.32Å; S58-E163 WeakPolarHBondContact CA-O 3.48Å; K59-E163 HydrophobicContact CD-CG 4.19Å; K59-E163 HydrophobicContact CG-CG 4.27Å; N64-E163 PolarHBondContact ND2-OE1 2.86Å; Y66-E163 HydrophobicContact CD2-CB 4.39Å; Y66-E163 HydrophobicContact CE2-CB 3.84Å; Y66-E163 HydrophobicContact CE2-CG 4.11Å; Y66-E163 WeakPolarHBondContact CE2-OE2 3.43Å; Y66-E163 PolarHBondContact OH-OE2 3.23Å; E163-G214 CarbonylContact C-O 3.52Å; E163-G214 WeakPolarHBondContact CA-O 3.3Å; E163-F215 HydrophobicContact CB-CD1 4.11Å; E163-F215 HydrophobicContact CB-CE1 4.23Å
164	F	92.9	Very high	92.4	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-68.9	138.1	170.4	-72	-67.1	0	0	0	111	L57 F166 W167 M191 W194 G214 F216 V225	L57-F164 HydrophobicContact CB-CD1 4.13Å; L57-F164 HydrophobicContact CB-CE1 4.26Å; L57-F164 HydrophobicContact CD1-CE1 4.24Å; L57-F164 HydrophobicContact CD2-CE1 4.44Å; L57-F164 CarbonylContact O-C 3.59Å; L57-F164 WeakPolarHBondContact O-CA 3.26Å; F164-F166 VanDerWaalsContact C-N 3.27Å; F164-F166 HydrophobicContact CB-CD1 4.23Å; F164-F166 HydrophobicContact CB-CD2 4.19Å; F164-F166 HydrophobicContact CB-CE1 3.9Å; F164-F166 HydrophobicContact CB-CE2 3.86Å; F164-F166 HydrophobicContact CB-CG 4.39Å; F164-F166 HydrophobicContact CB-CZ 3.71Å; F164-F166 AromaticContact CD1-CE1 3.61Å; F164-F166 HydrophobicContact CD1-CE1 3.61Å; F164-F166 HydrophobicContact CD1-CE2 4.37Å; F164-F166 AromaticContact CD1-CZ 3.46Å; F164-F166 HydrophobicContact CD1-CZ 3.46Å; F164-F166 VanDerWaalsContact CD1-CZ 3.46Å; F164-F166 HydrophobicContact CD2-CE2 4.41Å; F164-F166 HydrophobicContact CD2-CZ 4.17Å; F164-F166 HydrophobicContact CE1-CE1 4.39Å; F164-F166 HydrophobicContact CE1-CZ 4.07Å; F164-F166 AromaticContact CG-CE1 3.95Å; F164-F166 HydrophobicContact CG-CE1 3.95Å; F164-F166 AromaticContact CG-CE2 3.99Å; F164-F166 HydrophobicContact CG-CE2 3.99Å; F164-F166 AromaticContact CG-CZ 3.52Å; F164-F166 HydrophobicContact CG-CZ 3.52Å; F164-F166 PolarHBondContact O-N 3.42Å; F164-W167 HydrophobicContact CB-CB 4.1Å; F164-W167 PolarHBondContact O-N 3.46Å; F164-M191 HydrophobicContact CZ-SD 4.45Å; F164-W194 HydrophobicContact CE2-CZ3 4.36Å; F164-W194 HydrophobicContact CZ-CZ3 4.2Å; F164-G214 VanDerWaalsContact CD2-C 3.49Å; F164-G214 PolarHBondContact N-O 3.36Å; F164-F216 AromaticContact CD1-CD1 3.71Å; F164-F216 HydrophobicContact CD1-CD1 3.71Å; F164-F216 AromaticContact CD1-CE1 3.96Å; F164-F216 HydrophobicContact CD1-CE1 3.96Å; F164-F216 HydrophobicContact CD2-CD1 4.38Å; F164-F216 HydrophobicContact CE1-CB 4.28Å; F164-F216 AromaticContact CE1-CD1 3.51Å; F164-F216 HydrophobicContact CE1-CD1 3.51Å; F164-F216 HydrophobicContact CE1-CE1 4.09Å; F164-F216 HydrophobicContact CE1-CG 4.09Å; F164-F216 HydrophobicContact CE2-CB 4.29Å; F164-F216 HydrophobicContact CE2-CD1 4.21Å; F164-F216 HydrophobicContact CG-CD1 4.15Å; F164-F216 HydrophobicContact CZ-CB 3.8Å; F164-F216 AromaticContact CZ-CD1 3.78Å; F164-F216 HydrophobicContact CZ-CD1 3.78Å; F164-F216 HydrophobicContact CZ-CG 4.11Å; F164-V225 HydrophobicContact CE2-CG1 3.67Å; F164-V225 HydrophobicContact CE2-CG2 4.31Å; F164-V225 HydrophobicContact CZ-CG1 4.13Å; F164-V225 HydrophobicContact CZ-CG2 3.92Å
165	S	90.1	Very high	91.6	Very high	57 Å²	57	52.5 Å²	52.5	40%	0.399	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-30.5	179.4	60	0	0	0	0	113.7	L57 W167	L57-S165 PolarHBondContact O-N 3.45Å; L57-S165 PolarHBondContact O-OG 2.89Å; S165-W167 VanDerWaalsContact C-N 3.34Å
166	F	89.1	Confident	91	Very high	39 Å²	39	54.8 Å²	54.8	17%	0.171	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	3.1	179.6	55.4	-101.1	0	0	0	113.8	L57 F164 G195 W198 A199 I202	L57-F166 HydrophobicContact CD2-CE1 4.33Å; F164-F166 VanDerWaalsContact C-N 3.27Å; F164-F166 HydrophobicContact CB-CD1 4.23Å; F164-F166 HydrophobicContact CB-CD2 4.19Å; F164-F166 HydrophobicContact CB-CE1 3.9Å; F164-F166 HydrophobicContact CB-CE2 3.86Å; F164-F166 HydrophobicContact CB-CG 4.39Å; F164-F166 HydrophobicContact CB-CZ 3.71Å; F164-F166 AromaticContact CD1-CE1 3.61Å; F164-F166 HydrophobicContact CD1-CE1 3.61Å; F164-F166 HydrophobicContact CD1-CE2 4.37Å; F164-F166 AromaticContact CD1-CZ 3.46Å; F164-F166 HydrophobicContact CD1-CZ 3.46Å; F164-F166 VanDerWaalsContact CD1-CZ 3.46Å; F164-F166 HydrophobicContact CD2-CE2 4.41Å; F164-F166 HydrophobicContact CD2-CZ 4.17Å; F164-F166 HydrophobicContact CE1-CE1 4.39Å; F164-F166 HydrophobicContact CE1-CZ 4.07Å; F164-F166 AromaticContact CG-CE1 3.95Å; F164-F166 HydrophobicContact CG-CE1 3.95Å; F164-F166 AromaticContact CG-CE2 3.99Å; F164-F166 HydrophobicContact CG-CE2 3.99Å; F164-F166 AromaticContact CG-CZ 3.52Å; F164-F166 HydrophobicContact CG-CZ 3.52Å; F164-F166 PolarHBondContact O-N 3.42Å; F166-G195 WeakPolarHBondContact CZ-O 3.39Å; F166-W198 HydrophobicContact CE2-CB 4.15Å; F166-W198 HydrophobicContact CZ-CB 4.3Å; F166-A199 HydrophobicContact CB-CB 4.12Å; F166-A199 HydrophobicContact CD1-CB 3.55Å; F166-A199 HydrophobicContact CD2-CB 4.11Å; F166-A199 HydrophobicContact CE1-CB 3.89Å; F166-A199 HydrophobicContact CE2-CB 4.41Å; F166-A199 HydrophobicContact CG-CB 3.65Å; F166-A199 HydrophobicContact CZ-CB 4.3Å; F166-I202 HydrophobicContact CD2-CG2 4.06Å
167	W	89.6	Confident	90.8	Very high	8 Å²	8	49.6 Å²	49.6	3%	0.03	27%	0.267	C	S	.	.	S	Bend	trans	-103.9	155.1	178.2	-148.6	-74.4	0	0	0	112.1	K59 F164 S165 W198 I202 A211 G213 G214 H227 W229	K59-W167 PolarHBondContact NZ-O 2.93Å; F164-W167 HydrophobicContact CB-CB 4.1Å; F164-W167 PolarHBondContact O-N 3.46Å; S165-W167 VanDerWaalsContact C-N 3.34Å; W167-W198 HydrophobicContact CH2-CE3 4.48Å; W167-W198 HydrophobicContact CH2-CZ3 4.4Å; W167-W198 HydrophobicContact CZ3-CE3 4.16Å; W167-I202 HydrophobicContact CD2-CD1 4.08Å; W167-I202 HydrophobicContact CD2-CG1 4.1Å; W167-I202 HydrophobicContact CE3-CD1 3.9Å; W167-I202 HydrophobicContact CE3-CG1 3.86Å; W167-I202 HydrophobicContact CH2-CD1 3.38Å; W167-I202 HydrophobicContact CH2-CG1 4.26Å; W167-I202 HydrophobicContact CZ2-CD1 3.57Å; W167-I202 HydrophobicContact CZ2-CG1 4.48Å; W167-I202 HydrophobicContact CZ3-CB 4.49Å; W167-I202 HydrophobicContact CZ3-CD1 3.55Å; W167-I202 HydrophobicContact CZ3-CG1 3.94Å; W167-A211 HydrophobicContact CZ2-CB 4.29Å; W167-G213 VanDerWaalsContact NE1-CA 3.35Å; W167-G213 PolarHBondContact NE1-O 3.35Å; W167-G214 VanDerWaalsContact CG-N 3.31Å; W167-H227 HydrophobicContact CH2-CB 3.94Å; W167-H227 AromaticContact CH2-CD2 3.36Å; W167-H227 WeakPolarHBondContact CH2-CD2 3.28Å; W167-H227 AromaticContact CH2-CE1 3.59Å; W167-H227 AromaticContact CH2-CG 3.4Å; W167-H227 AromaticContact CH2-ND1 3.56Å; W167-H227 AromaticContact CH2-NE2 3.5Å; W167-H227 HydrophobicContact CZ2-CB 4.16Å; W167-H227 AromaticContact CZ3-CD2 3.46Å; W167-H227 VanDerWaalsContact CZ3-CD2 3.46Å; W167-H227 WeakPolarHBondContact CZ3-CD2 3.43Å; W167-H227 AromaticContact CZ3-CE1 3.6Å; W167-H227 AromaticContact CZ3-CG 3.97Å; W167-H227 AromaticContact CZ3-NE2 3.22Å; W167-H227 WeakPolarHBondContact CZ3-NE2 3.44Å; W167-W229 AromaticContact CH2-CH2 3.44Å; W167-W229 HydrophobicContact CH2-CH2 3.44Å; W167-W229 VanDerWaalsContact CH2-CH2 3.44Å; W167-W229 AromaticContact CH2-CZ2 3.46Å; W167-W229 HydrophobicContact CH2-CZ2 3.46Å; W167-W229 VanDerWaalsContact CH2-CZ2 3.46Å; W167-W229 HydrophobicContact CH2-CZ3 4.3Å; W167-W229 HydrophobicContact CZ2-CE3 4.4Å; W167-W229 AromaticContact CZ2-CH2 3.48Å; W167-W229 HydrophobicContact CZ2-CH2 3.48Å; W167-W229 VanDerWaalsContact CZ2-CH2 3.48Å; W167-W229 AromaticContact CZ2-CZ2 3.66Å; W167-W229 HydrophobicContact CZ2-CZ2 3.66Å; W167-W229 AromaticContact CZ2-CZ3 3.89Å; W167-W229 HydrophobicContact CZ2-CZ3 3.89Å
168	N	84.9	Confident	90.7	Very high	52 Å²	52	46.1 Å²	46.1	28%	0.278	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-57.9	142.7	172	-62.8	-8.4	0	0	0	111	Q206 A211	N168-Q206 PolarHBondContact OD1-NE2 3.38Å; N168-A211 PolarHBondContact ND2-O 3.37Å
169	E	86.5	Confident	90.7	Very high	62 Å²	62	42 Å²	42	29%	0.29	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-72.1	137	165	-173.3	173	178.3	0	0	108.5	R121 R123 L171	R121-E169 IonicContact CZ-OE1 3.77Å; R121-E169 IonicContact NH1-OE1 3.96Å; R121-E169 PolarHBondContact NH1-OE1 3.35Å; R123-E169 IonicContact NH1-OE1 2.67Å; R123-E169 IonicContact NH2-OE1 2.7Å; E169-L171 PolarHBondContact O-N 2.91Å; E169-L171 VanDerWaalsContact O-N 3.08Å
170	P	91	Very high	90.7	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.019	23%	0.228	C	C	.	.			trans	-67.8	110.8	173.6	28.6	-35.3	0	0	0	109.5	Y66 V103 R121 V212 F215	Y66-P170 HydrophobicContact CE1-CG 3.96Å; V103-P170 HydrophobicContact CG1-CB 3.56Å; V103-P170 HydrophobicContact CG1-CG 3.64Å; R121-P170 PolarHBondContact NH1-O 3.31Å; P170-V212 WeakPolarHBondContact CA-O 3.37Å; P170-V212 HydrophobicContact CB-CG1 4.11Å; P170-F215 HydrophobicContact CG-CZ 4.21Å
171	L	89.2	Confident	90.8	Very high	105 Å²	105	40.8 Å²	40.8	55%	0.55	22%	0.223	S	C	.	.			trans	-111.7	150.4	175	-62.7	177.8	0	0	0	110	E169 L277	E169-L171 PolarHBondContact O-N 2.91Å; E169-L171 VanDerWaalsContact O-N 3.08Å; L171-L277 WeakPolarHBondContact O-CD2 3.49Å
172	P	88.9	Confident	90.8	Very high	98 Å²	98	42.2 Å²	42.2	64%	0.636	23%	0.228	S	C	*	.			trans	-48.1	143.7	173.1	-29.5	36.9	0	0	0	112.9	P276	P172-P276 WeakPolarHBondContact CA-O 3.3Å; P172-P276 WeakPolarHBondContact CB-O 3.2Å
173	R	87.4	Confident	91	Very high	37 Å²	37	41.8 Å²	41.8	14%	0.14	23%	0.227	C	C	.	.			trans	-134	134.4	-174.5	-75	176.4	166.3	-119.7	-3.6	110	G175 N209 L277 Q278	R173-G175 PolarHBondContact O-N 3.14Å; R173-N209 PolarHBondContact NH1-O 3.42Å; R173-N209 PolarHBondContact NH2-O 3.38Å; R173-N209 PolarHBondContact NH2-OD1 2.88Å; R173-L277 HydrophobicContact CG-CD2 4.28Å; R173-Q278 CarbonylContact O-C 3.53Å; R173-Q278 WeakPolarHBondContact O-CA 3.5Å; R173-Q278 PolarHBondContact O-N 2.82Å; R173-Q278 VanDerWaalsContact O-OXT 3.06Å
174	K	83	Confident	91.3	Very high	194 Å²	194	42.4 Å²	42.4	84%	0.843	23%	0.229	S	C	*	.			trans	-66.9	125.7	172.8	-169.3	178.7	-179.7	-176.4	0	110	N177	K174-N177 PolarHBondContact O-ND2 2.92Å
175	G	81.4	Confident	91.5	Very high	26 Å²	26	46.8 Å²	46.8	27%	0.268	25%	0.248	S	C	.	.	S	Bend	trans	-90	-175.3	177.8	0	0	0	0	0	114.9	R173 Q278	R173-G175 PolarHBondContact O-N 3.14Å; G175-Q278 WeakPolarHBondContact CA-OXT 3.41Å; G175-Q278 PolarHBondContact N-OXT 2.95Å
176	P	85.8	Confident	91.9	Very high	107 Å²	107	44.2 Å²	44.2	70%	0.695	23%	0.23	S	C	*	.			cis	-73.1	142.6	1.6	30.4	-34.8	0	0	0	112.9
177	N	92.8	Very high	92.3	Very high	23 Å²	23	46.9 Å²	46.9	12%	0.123	24%	0.241	C	C	.	.			trans	-129.9	142.7	177.4	-71.9	-61.1	0	0	0	110.6	K174 Y179 P271	K174-N177 PolarHBondContact O-ND2 2.92Å; N177-Y179 HydrophobicContact CB-CD2 4.27Å; N177-Y179 HydrophobicContact CB-CE2 3.5Å; N177-Y179 VanDerWaalsContact CB-CE2 3.5Å; N177-P271 WeakPolarHBondContact O-CD 3.3Å; N177-P271 WeakPolarHBondContact O-CG 3.42Å
178	L	95.2	Very high	92.5	Very high	15 Å²	15	49.7 Å²	49.7	8%	0.079	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	134.3	165.7	179.7	71.6	0	0	0	109	W109 A230 Y231 L234 L268 I270	W109-L178 HydrophobicContact CE3-CD1 4.29Å; L178-A230 CarbonylContact O-C 2.9Å; L178-A230 WeakPolarHBondContact O-CA 3.35Å; L178-Y231 PolarHBondContact N-O 3.35Å; L178-Y231 PolarHBondContact O-N 3.22Å; L178-L234 HydrophobicContact CD2-CD2 3.41Å; L178-L234 VanDerWaalsContact CD2-CD2 3.41Å; L178-L234 HydrophobicContact CD2-CG 3.92Å; L178-L268 HydrophobicContact CD2-CD2 3.98Å; L178-L268 HydrophobicContact CG-CD2 4.26Å; L178-I270 HydrophobicContact CD1-CG1 4.36Å
179	Y	97.7	Very high	92.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	141.4	-179.5	-72.2	-99.6	0	0	0	111.5	W106 N177 V212 L228 W229 A230 L268 M269 P271 L277	W106-Y179 AromaticContact CD1-CD2 3.6Å; W106-Y179 AromaticContact CD1-CG 3.76Å; W106-Y179 AromaticContact CE2-CG 3.97Å; W106-Y179 HydrophobicContact CZ2-CD1 4.07Å; W106-Y179 HydrophobicContact CZ2-CE1 4.2Å; W106-Y179 HydrophobicContact CZ2-CG 4.43Å; W106-Y179 AromaticContact NE1-CD1 3.63Å; W106-Y179 AromaticContact NE1-CD2 3.08Å; W106-Y179 AromaticContact NE1-CE2 3.57Å; W106-Y179 AromaticContact NE1-CG 3.14Å; N177-Y179 HydrophobicContact CB-CD2 4.27Å; N177-Y179 HydrophobicContact CB-CE2 3.5Å; N177-Y179 VanDerWaalsContact CB-CE2 3.5Å; Y179-V212 HydrophobicContact CD1-CG2 4.35Å; Y179-V212 HydrophobicContact CE1-CG1 4.41Å; Y179-V212 HydrophobicContact CE1-CG2 3.94Å; Y179-L228 HydrophobicContact CD1-CD1 3.94Å; Y179-L228 HydrophobicContact CD1-CD2 4.46Å; Y179-L228 HydrophobicContact CD1-CG 4.15Å; Y179-W229 CarbonylContact C-O 3.55Å; Y179-W229 VanDerWaalsContact CA-O 3.26Å; Y179-W229 WeakPolarHBondContact CA-O 3.49Å; Y179-A230 HydrophobicContact CD1-CB 4Å; Y179-A230 HydrophobicContact CE1-CB 3.66Å; Y179-L268 CarbonylContact O-C 3.56Å; Y179-L268 WeakPolarHBondContact O-CA 3.43Å; Y179-M269 PolarHBondContact N-O 2.86Å; Y179-M269 PolarHBondContact O-N 3.27Å; Y179-P271 HydrophobicContact CD2-CB 4.46Å; Y179-P271 HydrophobicContact CD2-CG 4.24Å; Y179-P271 HydrophobicContact CE2-CB 4.31Å; Y179-P271 HydrophobicContact CE2-CG 4.1Å; Y179-L277 HydrophobicContact CE1-CB 4.25Å; Y179-L277 HydrophobicContact CE1-CD1 4.38Å; Y179-L277 WeakPolarHBondContact CE2-O 3.04Å; Y179-L277 PolarHBondContact OH-O 2.91Å
180	E	98.3	Very high	93.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	117.1	168.6	-172.1	-176.7	-172.5	0	0	109.3	R182 W229 Y231 R237 R241 S266 R267 L268	E180-R182 VanDerWaalsContact CD-NE 3.27Å; E180-R182 HydrophobicContact CG-CG 4.07Å; E180-R182 IonicContact OE1-CZ 3.99Å; E180-R182 IonicContact OE1-NE 2.94Å; E180-R182 PolarHBondContact OE1-NE 3.29Å; E180-R182 IonicContact OE1-NH2 3.53Å; E180-R182 PolarHBondContact OE1-NH2 3.04Å; E180-R182 VanDerWaalsContact OE1-NH2 3.15Å; E180-R182 IonicContact OE2-CZ 2.81Å; E180-R182 IonicContact OE2-NE 3.49Å; E180-R182 PolarHBondContact OE2-NE 3.44Å; E180-R182 IonicContact OE2-NH2 3.85Å; E180-R182 PolarHBondContact OE2-NH2 2.82Å; E180-W229 HydrophobicContact CB-CB 4.25Å; E180-W229 PolarHBondContact N-O 3.25Å; E180-W229 PolarHBondContact O-N 3.2Å; E180-Y231 HydrophobicContact CB-CE2 3.85Å; E180-Y231 PolarHBondContact OE2-OH 2.82Å; E180-R237 VanDerWaalsContact CD-NH2 3.29Å; E180-R237 IonicContact OE1-CZ 2.99Å; E180-R237 IonicContact OE1-NE 3.5Å; E180-R237 IonicContact OE1-NH2 3.58Å; E180-R237 PolarHBondContact OE1-NH2 3.21Å; E180-R237 IonicContact OE2-CZ 2.69Å; E180-R237 IonicContact OE2-NE 2.8Å; E180-R237 PolarHBondContact OE2-NE 2.8Å; E180-R237 IonicContact OE2-NH2 2.82Å; E180-R237 PolarHBondContact OE2-NH2 3.45Å; E180-R241 IonicContact OE1-NH1 2.79Å; E180-S266 WeakPolarHBondContact CG-OG 3.49Å; E180-S266 PolarHBondContact OE1-OG 3.16Å; E180-R267 CarbonylContact C-O 3.6Å; E180-R267 VanDerWaalsContact CA-O 3.27Å; E180-R267 WeakPolarHBondContact CA-O 3.35Å; E180-L268 HydrophobicContact CB-CD2 3.93Å; E180-L268 HydrophobicContact CG-CD2 4.13Å
181	L	98.5	Very high	93.3	Very high	4 Å²	4	48.3 Å²	48.3	2%	0.021	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	112.8	168.8	-175.7	69.1	0	0	0	108.6	I68 F70 V117 H226 H227 L228 R267 M269	I68-L181 HydrophobicContact CD1-CD1 4.34Å; I68-L181 HydrophobicContact CD1-CD2 3.91Å; F70-L181 HydrophobicContact CE1-CD2 3.7Å; F70-L181 HydrophobicContact CZ-CD2 3.89Å; V117-L181 HydrophobicContact CG1-CD2 4.26Å; L181-H226 HydrophobicContact CD1-CB 4Å; L181-H227 WeakPolarHBondContact CA-O 3.44Å; L181-L228 HydrophobicContact CB-CD1 4.5Å; L181-L228 HydrophobicContact CD1-CB 4.47Å; L181-L228 HydrophobicContact CD1-CD1 4.29Å; L181-R267 PolarHBondContact N-O 3.22Å; L181-R267 PolarHBondContact O-N 3.37Å; L181-M269 HydrophobicContact CB-CE 3.66Å; L181-M269 HydrophobicContact CB-SD 3.92Å; L181-M269 HydrophobicContact CD2-SD 4.35Å
182	R	98.1	Very high	93.4	Very high	30 Å²	30	43.9 Å²	43.9	11%	0.113	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	124.4	170.6	-64	-166.6	-175	159.2	17.7	110.4	E180 Y184 H226 H227 R241 E265	E180-R182 VanDerWaalsContact CD-NE 3.27Å; E180-R182 HydrophobicContact CG-CG 4.07Å; E180-R182 IonicContact OE1-CZ 3.99Å; E180-R182 IonicContact OE1-NE 2.94Å; E180-R182 PolarHBondContact OE1-NE 3.29Å; E180-R182 IonicContact OE1-NH2 3.53Å; E180-R182 PolarHBondContact OE1-NH2 3.04Å; E180-R182 VanDerWaalsContact OE1-NH2 3.15Å; E180-R182 IonicContact OE2-CZ 2.81Å; E180-R182 IonicContact OE2-NE 3.49Å; E180-R182 PolarHBondContact OE2-NE 3.44Å; E180-R182 IonicContact OE2-NH2 3.85Å; E180-R182 PolarHBondContact OE2-NH2 2.82Å; R182-Y184 HydrophobicContact CB-CE2 3.68Å; R182-Y184 VanDerWaalsContact CD-OH 3.24Å; R182-Y184 WeakPolarHBondContact CD-OH 3.23Å; R182-H226 CarbonylContact O-C 3.59Å; R182-H226 WeakPolarHBondContact O-CA 3.44Å; R182-H227 HydrophobicContact CB-CB 4.42Å; R182-H227 PolarHBondContact N-O 2.89Å; R182-H227 PolarHBondContact O-N 3.15Å; R182-R241 VanDerWaalsContact NH2-CD 3.32Å; R182-R241 VanDerWaalsContact NH2-CZ 3.35Å; R182-E265 CarbonylContact C-O 3.5Å; R182-E265 VanDerWaalsContact CA-O 3.29Å; R182-E265 WeakPolarHBondContact CA-O 3.45Å
183	T	98.3	Very high	93.7	Very high	12 Å²	12	43.2 Å²	43.2	7%	0.074	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	126.6	178.1	-60	0	0	0	0	109.1	V224 V225 H226 M264 E265	T183-V224 HydrophobicContact CG2-CG1 3.51Å; T183-V225 CarbonylContact C-O 3.54Å; T183-V225 WeakPolarHBondContact CA-O 3.27Å; T183-H226 VanDerWaalsContact CG2-CE1 3.42Å; T183-H226 WeakPolarHBondContact CG2-CE1 3.48Å; T183-H226 PolarHBondContact OG1-CE1 3.15Å; T183-H226 PolarHBondContact OG1-ND1 2.93Å; T183-M264 CarbonylContact O-C 3.55Å; T183-M264 VanDerWaalsContact O-CA 3.24Å; T183-M264 WeakPolarHBondContact O-CA 3.46Å; T183-E265 PolarHBondContact N-O 2.89Å; T183-E265 PolarHBondContact O-N 2.84Å
184	Y	98.2	Very high	94	Very high	18 Å²	18	41.5 Å²	41.5	7%	0.071	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	119.2	178.1	-56.4	-90.3	0	0	0	109.2	R182 W194 V224 V225 H227 V261 M264	R182-Y184 HydrophobicContact CB-CE2 3.68Å; R182-Y184 VanDerWaalsContact CD-OH 3.24Å; R182-Y184 WeakPolarHBondContact CD-OH 3.23Å; Y184-W194 HydrophobicContact CD1-CZ2 4.42Å; Y184-W194 HydrophobicContact CD2-CH2 4.24Å; Y184-W194 AromaticContact CD2-CZ2 3.99Å; Y184-W194 HydrophobicContact CD2-CZ2 3.99Å; Y184-W194 HydrophobicContact CE2-CZ2 4.42Å; Y184-W194 AromaticContact CG-CZ2 4Å; Y184-W194 HydrophobicContact CG-CZ2 4Å; Y184-V224 WeakPolarHBondContact O-CA 3.4Å; Y184-V225 HydrophobicContact CD2-CG1 4.43Å; Y184-V225 PolarHBondContact N-O 2.57Å; Y184-V225 PolarHBondContact O-N 2.84Å; Y184-H227 HydrophobicContact CE2-CB 4.45Å; Y184-H227 AromaticContact CE2-CG 3.97Å; Y184-H227 AromaticContact CE2-ND1 3.49Å; Y184-H227 WeakPolarHBondContact CE2-ND1 3.21Å; Y184-V261 HydrophobicContact CD1-CG1 4.35Å; Y184-V261 HydrophobicContact CD1-CG2 4.27Å; Y184-M264 HydrophobicContact CD1-CB 3.73Å; Y184-M264 HydrophobicContact CE1-CB 4.05Å; Y184-M264 HydrophobicContact CE1-SD 4.19Å
185	K	98.1	Very high	94.5	Very high	92 Å²	92	32.3 Å²	32.3	40%	0.4	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	108.2	169	-59.3	-164.8	177.7	-172	0	107.7	D221 V224 R262 S263	K185-D221 IonicContact NZ-OD2 3.27Å; K185-V224 HydrophobicContact CG-CG2 4.21Å; K185-R262 WeakPolarHBondContact O-CB 3Å; K185-R262 PolarHBondContact O-N 3.4Å; K185-S263 PolarHBondContact N-O 3.45Å; K185-S263 PolarHBondContact O-N 2.97Å
186	L	97.9	Very high	95	Very high	4 Å²	4	34.9 Å²	34.9	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	161.6	-176.8	-54.3	-174.3	0	0	0	111.6	M191 W194 Y223 V225 V261	L186-M191 HydrophobicContact CD1-CB 4.47Å; L186-M191 HydrophobicContact CD1-CE 3.94Å; L186-M191 HydrophobicContact CD1-SD 3.68Å; L186-W194 HydrophobicContact CD1-CB 3.88Å; L186-W194 HydrophobicContact CD1-CD2 3.94Å; L186-W194 HydrophobicContact CD1-CE3 4.27Å; L186-W194 HydrophobicContact CD1-CG 3.8Å; L186-W194 HydrophobicContact CD2-CD2 4.09Å; L186-W194 HydrophobicContact CD2-CG 3.93Å; L186-Y223 WeakPolarHBondContact CB-O 3.33Å; L186-Y223 PolarHBondContact N-O 3.04Å; L186-V225 HydrophobicContact CD1-CG2 3.89Å; L186-V225 HydrophobicContact CG-CG2 4.41Å; L186-V261 HydrophobicContact CD2-CG2 3.8Å
187	K	97.3	Very high	95.3	Very high	95 Å²	95	31.9 Å²	31.9	41%	0.413	17%	0.169	S	C	.	.	P	Polyproline II helix	trans	-66.8	132	166.1	-69.1	175.8	-179.8	174.5	0	108.5	G189 T190 P259 L260 R262	K187-G189 PolarHBondContact O-N 2.75Å; K187-T190 HydrophobicContact CB-CG2 3.79Å; K187-T190 WeakPolarHBondContact O-CB 3.19Å; K187-T190 PolarHBondContact O-N 3.44Å; K187-T190 PolarHBondContact O-OG1 2.87Å; K187-P259 WeakPolarHBondContact CD-O 3.15Å; K187-P259 WeakPolarHBondContact CE-O 3.4Å; K187-P259 PolarHBondContact NZ-O 3.23Å; K187-L260 WeakPolarHBondContact CG-O 3.49Å; K187-L260 PolarHBondContact N-O 3.21Å; K187-R262 HydrophobicContact CB-CG 4.48Å; K187-R262 HydrophobicContact CG-CG 3.66Å
188	P	94.9	Very high	95.3	Very high	67 Å²	67	31.5 Å²	31.5	44%	0.435	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.6	138.1	175.2	-29.8	36.2	0	0	0	112.1	T190 Y223	P188-T190 VanDerWaalsContact C-N 3.29Å; P188-T190 PolarHBondContact O-N 2.76Å; P188-Y223 HydrophobicContact CB-CD2 4.02Å; P188-Y223 HydrophobicContact CB-CE1 4.43Å; P188-Y223 HydrophobicContact CB-CE2 3.77Å; P188-Y223 HydrophobicContact CB-CG 4.45Å; P188-Y223 HydrophobicContact CG-CD2 4.12Å; P188-Y223 HydrophobicContact CG-CE2 4.27Å
189	G	91	Very high	95.2	Very high	51 Å²	51	32 Å²	32	53%	0.526	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	-10.9	-176.5	0	0	0	0	0	115.7	K187	K187-G189 PolarHBondContact O-N 2.75Å
190	T	94.7	Very high	94.8	Very high	21 Å²	21	38.4 Å²	38.4	13%	0.129	20%	0.196	C	C	.	.			trans	-95	-3.5	-175.1	68.3	0	0	0	0	115	K187 P188 L192 E193 W194 L260	K187-T190 HydrophobicContact CB-CG2 3.79Å; K187-T190 WeakPolarHBondContact O-CB 3.19Å; K187-T190 PolarHBondContact O-N 3.44Å; K187-T190 PolarHBondContact O-OG1 2.87Å; P188-T190 VanDerWaalsContact C-N 3.29Å; P188-T190 PolarHBondContact O-N 2.76Å; T190-L192 VanDerWaalsContact C-N 3.3Å; T190-L192 PolarHBondContact O-N 2.94Å; T190-E193 PolarHBondContact O-N 2.71Å; T190-E193 VanDerWaalsContact O-N 3.16Å; T190-W194 WeakPolarHBondContact O-CB 3.31Å; T190-W194 PolarHBondContact O-N 2.76Å; T190-L260 HydrophobicContact CG2-CD2 4.03Å
191	M	93.6	Very high	94.4	Very high	15 Å²	15	38.5 Å²	38.5	7%	0.074	20%	0.197	C	C	.	.	H	α-helix	trans	-52	-45.2	-176.1	-178.4	65.7	72.4	0	0	113	L57 F164 L186 G195 F216 Y223 V225	L57-M191 HydrophobicContact CD1-CG 3.88Å; F164-M191 HydrophobicContact CZ-SD 4.45Å; L186-M191 HydrophobicContact CD1-CB 4.47Å; L186-M191 HydrophobicContact CD1-CE 3.94Å; L186-M191 HydrophobicContact CD1-SD 3.68Å; M191-G195 PolarHBondContact O-N 3.24Å; M191-F216 HydrophobicContact CE-CB 4.15Å; M191-F216 HydrophobicContact SD-CB 4.04Å; M191-Y223 HydrophobicContact CB-CD1 4.39Å; M191-V225 HydrophobicContact CE-CG2 3.74Å; M191-V225 HydrophobicContact SD-CG2 3.45Å; M191-V225 WeakPolarHBondContact SD-CG2 3.4Å
192	L	91.1	Very high	94.1	Very high	13 Å²	13	38.4 Å²	38.4	7%	0.068	20%	0.196	C	C	.	.	H	α-helix	trans	-70.4	-41.7	-178.3	-176.7	61.9	0	0	0	112.4	L56 L57 T190 G195 N196	L56-L192 HydrophobicContact CB-CD1 4.13Å; L56-L192 HydrophobicContact CD1-CD1 4.34Å; L56-L192 HydrophobicContact CD1-CD2 4.01Å; L57-L192 HydrophobicContact CD1-CD1 4.17Å; L57-L192 HydrophobicContact CD2-CD1 3.82Å; L57-L192 HydrophobicContact CG-CD1 3.85Å; T190-L192 VanDerWaalsContact C-N 3.3Å; T190-L192 PolarHBondContact O-N 2.94Å; L192-G195 PolarHBondContact O-N 3.3Å; L192-N196 WeakPolarHBondContact O-CB 3.39Å; L192-N196 PolarHBondContact O-N 3.04Å; L192-N196 PolarHBondContact O-ND2 2.75Å
193	E	93.5	Very high	93.7	Very high	84 Å²	84	43.5 Å²	43.5	39%	0.393	22%	0.219	S	C	.	.	H	α-helix	trans	-62.1	-47.2	175.5	-173.2	-172.6	163.8	0	0	110.6	T190 N196 R197 L260	T190-E193 PolarHBondContact O-N 2.71Å; T190-E193 VanDerWaalsContact O-N 3.16Å; E193-N196 PolarHBondContact O-N 3.26Å; E193-R197 WeakPolarHBondContact O-CG 3.43Å; E193-R197 PolarHBondContact O-N 2.95Å; E193-R197 IonicContact OE1-CZ 2.75Å; E193-R197 IonicContact OE1-NE 3.3Å; E193-R197 PolarHBondContact OE1-NE 2.88Å; E193-R197 IonicContact OE1-NH2 2.71Å; E193-R197 PolarHBondContact OE1-NH2 2.83Å; E193-L260 HydrophobicContact CB-CD1 4.17Å; E193-L260 HydrophobicContact CG-CD1 3.94Å
194	W	94.9	Very high	93.2	Very high	1 Å²	1	45 Å²	45	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-61.3	-45.9	178.3	-171.1	96.2	0	0	0	111.4	F164 Y184 L186 T190 N196 R197 W198 V225 H227 L260	F164-W194 HydrophobicContact CE2-CZ3 4.36Å; F164-W194 HydrophobicContact CZ-CZ3 4.2Å; Y184-W194 HydrophobicContact CD1-CZ2 4.42Å; Y184-W194 HydrophobicContact CD2-CH2 4.24Å; Y184-W194 AromaticContact CD2-CZ2 3.99Å; Y184-W194 HydrophobicContact CD2-CZ2 3.99Å; Y184-W194 HydrophobicContact CE2-CZ2 4.42Å; Y184-W194 AromaticContact CG-CZ2 4Å; Y184-W194 HydrophobicContact CG-CZ2 4Å; L186-W194 HydrophobicContact CD1-CB 3.88Å; L186-W194 HydrophobicContact CD1-CD2 3.94Å; L186-W194 HydrophobicContact CD1-CE3 4.27Å; L186-W194 HydrophobicContact CD1-CG 3.8Å; L186-W194 HydrophobicContact CD2-CD2 4.09Å; L186-W194 HydrophobicContact CD2-CG 3.93Å; T190-W194 WeakPolarHBondContact O-CB 3.31Å; T190-W194 PolarHBondContact O-N 2.76Å; W194-N196 PolarHBondContact O-N 3.3Å; W194-R197 PolarHBondContact O-N 3.45Å; W194-W198 AromaticContact CD2-CD1 3.41Å; W194-W198 VanDerWaalsContact CD2-CD1 3.41Å; W194-W198 HydrophobicContact CD2-CG 4.47Å; W194-W198 AromaticContact CD2-NE1 3.88Å; W194-W198 AromaticContact CE2-CD1 3.29Å; W194-W198 AromaticContact CE2-NE1 3.22Å; W194-W198 HydrophobicContact CE3-CB 4.43Å; W194-W198 AromaticContact CE3-CD1 3.45Å; W194-W198 VanDerWaalsContact CE3-CD1 3.45Å; W194-W198 HydrophobicContact CE3-CG 4.14Å; W194-W198 AromaticContact CH2-CD1 3.38Å; W194-W198 HydrophobicContact CH2-CD2 4.28Å; W194-W198 AromaticContact CH2-CE2 3.98Å; W194-W198 AromaticContact CH2-CG 3.91Å; W194-W198 HydrophobicContact CH2-CG 3.91Å; W194-W198 AromaticContact CH2-NE1 3.42Å; W194-W198 AromaticContact CZ2-CD1 3.33Å; W194-W198 AromaticContact CZ2-CE2 3.82Å; W194-W198 HydrophobicContact CZ2-CG 4.24Å; W194-W198 AromaticContact CZ2-NE1 3.01Å; W194-W198 HydrophobicContact CZ3-CB 4.21Å; W194-W198 AromaticContact CZ3-CD1 3.4Å; W194-W198 AromaticContact CZ3-CG 3.81Å; W194-W198 HydrophobicContact CZ3-CG 3.81Å; W194-W198 AromaticContact CZ3-NE1 3.96Å; W194-W198 AromaticContact NE1-CD1 3.97Å; W194-W198 AromaticContact NE1-NE1 3.72Å; W194-W198 PolarHBondContact O-N 2.85Å; W194-V225 HydrophobicContact CE3-CG2 4.23Å; W194-V225 HydrophobicContact CH2-CB 3.99Å; W194-V225 HydrophobicContact CH2-CG1 3.43Å; W194-V225 VanDerWaalsContact CH2-CG1 3.43Å; W194-V225 HydrophobicContact CH2-CG2 4.24Å; W194-V225 HydrophobicContact CZ2-CG1 4.44Å; W194-V225 HydrophobicContact CZ3-CB 4.13Å; W194-V225 HydrophobicContact CZ3-CG1 3.61Å; W194-V225 HydrophobicContact CZ3-CG2 3.9Å; W194-H227 AromaticContact CH2-CE1 3.32Å; W194-H227 WeakPolarHBondContact CH2-CE1 3.5Å; W194-H227 AromaticContact CH2-NE2 3.31Å; W194-H227 VanDerWaalsContact CH2-NE2 3.31Å; W194-H227 WeakPolarHBondContact CH2-NE2 3.33Å; W194-H227 AromaticContact CZ3-NE2 3.8Å; W194-L260 HydrophobicContact CB-CD1 3.92Å
195	G	93.3	Very high	92.7	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.6	-43.7	177.3	0	0	0	0	0	113	F166 M191 L192 R197 W198 A199	F166-G195 WeakPolarHBondContact CZ-O 3.39Å; M191-G195 PolarHBondContact O-N 3.24Å; L192-G195 PolarHBondContact O-N 3.3Å; G195-R197 VanDerWaalsContact C-N 3.27Å; G195-R197 PolarHBondContact O-N 3.03Å; G195-W198 PolarHBondContact O-N 2.67Å; G195-W198 VanDerWaalsContact O-N 3.17Å; G195-A199 PolarHBondContact O-N 2.94Å
196	N	91.4	Very high	92.1	Very high	81 Å²	81	42.9 Å²	42.9	43%	0.433	22%	0.217	S	C	.	.	H	α-helix	trans	-64.9	-28.7	177.8	-73.8	-17	0	0	0	113.4	L192 E193 W194 R200	L192-N196 WeakPolarHBondContact O-CB 3.39Å; L192-N196 PolarHBondContact O-N 3.04Å; L192-N196 PolarHBondContact O-ND2 2.75Å; E193-N196 PolarHBondContact O-N 3.26Å; W194-N196 PolarHBondContact O-N 3.3Å; N196-R200 PolarHBondContact O-NE 2.86Å; N196-R200 VanDerWaalsContact O-NE 3.13Å; N196-R200 PolarHBondContact O-NH2 3.19Å
197	R	92.3	Very high	91.4	Very high	44 Å²	44	49.1 Å²	49.1	17%	0.166	25%	0.247	C	C	.	.	H	α-helix	trans	-73.8	-46	172	-66.6	176.1	-172	-75.7	6.3	110.2	E193 W194 G195 A199 R200 A201 N253 T257	E193-R197 WeakPolarHBondContact O-CG 3.43Å; E193-R197 PolarHBondContact O-N 2.95Å; E193-R197 IonicContact OE1-CZ 2.75Å; E193-R197 IonicContact OE1-NE 3.3Å; E193-R197 PolarHBondContact OE1-NE 2.88Å; E193-R197 IonicContact OE1-NH2 2.71Å; E193-R197 PolarHBondContact OE1-NH2 2.83Å; W194-R197 PolarHBondContact O-N 3.45Å; G195-R197 VanDerWaalsContact C-N 3.27Å; G195-R197 PolarHBondContact O-N 3.03Å; R197-A199 VanDerWaalsContact C-N 3.33Å; R197-A199 PolarHBondContact O-N 3.5Å; R197-R200 WeakPolarHBondContact O-CB 3.34Å; R197-R200 PolarHBondContact O-N 2.79Å; R197-R200 VanDerWaalsContact O-N 3.09Å; R197-A201 PolarHBondContact O-N 3.2Å; R197-N253 PolarHBondContact O-OD1 3.16Å; R197-T257 HydrophobicContact CB-CG2 3.51Å; R197-T257 HydrophobicContact CG-CG2 4.31Å
198	W	93.8	Very high	90.8	Very high	14 Å²	14	48.6 Å²	48.6	5%	0.053	25%	0.248	C	C	.	.	H	α-helix	trans	-64	-32.8	177.2	-89.6	95.9	0	0	0	114.6	F166 W167 W194 G195 R200 A201 I202 H227 W229 W250	F166-W198 HydrophobicContact CE2-CB 4.15Å; F166-W198 HydrophobicContact CZ-CB 4.3Å; W167-W198 HydrophobicContact CH2-CE3 4.48Å; W167-W198 HydrophobicContact CH2-CZ3 4.4Å; W167-W198 HydrophobicContact CZ3-CE3 4.16Å; W194-W198 AromaticContact CD2-CD1 3.41Å; W194-W198 VanDerWaalsContact CD2-CD1 3.41Å; W194-W198 HydrophobicContact CD2-CG 4.47Å; W194-W198 AromaticContact CD2-NE1 3.88Å; W194-W198 AromaticContact CE2-CD1 3.29Å; W194-W198 AromaticContact CE2-NE1 3.22Å; W194-W198 HydrophobicContact CE3-CB 4.43Å; W194-W198 AromaticContact CE3-CD1 3.45Å; W194-W198 VanDerWaalsContact CE3-CD1 3.45Å; W194-W198 HydrophobicContact CE3-CG 4.14Å; W194-W198 AromaticContact CH2-CD1 3.38Å; W194-W198 HydrophobicContact CH2-CD2 4.28Å; W194-W198 AromaticContact CH2-CE2 3.98Å; W194-W198 AromaticContact CH2-CG 3.91Å; W194-W198 HydrophobicContact CH2-CG 3.91Å; W194-W198 AromaticContact CH2-NE1 3.42Å; W194-W198 AromaticContact CZ2-CD1 3.33Å; W194-W198 AromaticContact CZ2-CE2 3.82Å; W194-W198 HydrophobicContact CZ2-CG 4.24Å; W194-W198 AromaticContact CZ2-NE1 3.01Å; W194-W198 HydrophobicContact CZ3-CB 4.21Å; W194-W198 AromaticContact CZ3-CD1 3.4Å; W194-W198 AromaticContact CZ3-CG 3.81Å; W194-W198 HydrophobicContact CZ3-CG 3.81Å; W194-W198 AromaticContact CZ3-NE1 3.96Å; W194-W198 AromaticContact NE1-CD1 3.97Å; W194-W198 AromaticContact NE1-NE1 3.72Å; W194-W198 PolarHBondContact O-N 2.85Å; G195-W198 PolarHBondContact O-N 2.67Å; G195-W198 VanDerWaalsContact O-N 3.17Å; W198-R200 PolarHBondContact O-N 3.32Å; W198-R200 VanDerWaalsContact O-N 3.12Å; W198-A201 HydrophobicContact CE3-CB 4.21Å; W198-A201 PolarHBondContact O-N 2.8Å; W198-A201 VanDerWaalsContact O-N 3.14Å; W198-I202 WeakPolarHBondContact O-CB 3.47Å; W198-I202 WeakPolarHBondContact O-CG2 3.02Å; W198-I202 PolarHBondContact O-N 2.97Å; W198-H227 AromaticContact CD2-CE1 3.62Å; W198-H227 AromaticContact CE2-CE1 3.62Å; W198-H227 AromaticContact CE3-CE1 3.73Å; W198-H227 AromaticContact CH2-CE1 3.82Å; W198-H227 AromaticContact CH2-ND1 3.94Å; W198-H227 AromaticContact CZ2-CE1 3.72Å; W198-H227 AromaticContact CZ3-CE1 3.83Å; W198-W229 HydrophobicContact CH2-CZ2 4.42Å; W198-W229 HydrophobicContact CZ3-CH2 4.29Å; W198-W229 HydrophobicContact CZ3-CZ2 4.29Å; W198-W250 AromaticContact CH2-CH2 3.77Å; W198-W250 HydrophobicContact CH2-CH2 3.77Å; W198-W250 HydrophobicContact CH2-CZ3 4.41Å; W198-W250 HydrophobicContact CZ3-CH2 4.02Å; W198-W250 HydrophobicContact CZ3-CZ3 4.24Å
199	A	91.9	Very high	90.4	Very high	27 Å²	27	50.1 Å²	50.1	22%	0.223	25%	0.253	C	S	.	.	H	α-helix	trans	-57.5	-26	173.6	0	0	0	0	0	113.3	F166 G195 R197	F166-A199 HydrophobicContact CB-CB 4.12Å; F166-A199 HydrophobicContact CD1-CB 3.55Å; F166-A199 HydrophobicContact CD2-CB 4.11Å; F166-A199 HydrophobicContact CE1-CB 3.89Å; F166-A199 HydrophobicContact CE2-CB 4.41Å; F166-A199 HydrophobicContact CG-CB 3.65Å; F166-A199 HydrophobicContact CZ-CB 4.3Å; G195-A199 PolarHBondContact O-N 2.94Å; R197-A199 VanDerWaalsContact C-N 3.33Å; R197-A199 PolarHBondContact O-N 3.5Å
200	R	90.1	Very high	90.5	Very high	134 Å²	134	47.9 Å²	47.9	51%	0.506	23%	0.228	S	C	.	.	H	α-helix	trans	-88.1	-48.1	172.1	-68.4	172	-77.4	-169.8	-1.2	110.9	N196 R197 W198 I202 K203	N196-R200 PolarHBondContact O-NE 2.86Å; N196-R200 VanDerWaalsContact O-NE 3.13Å; N196-R200 PolarHBondContact O-NH2 3.19Å; R197-R200 WeakPolarHBondContact O-CB 3.34Å; R197-R200 PolarHBondContact O-N 2.79Å; R197-R200 VanDerWaalsContact O-N 3.09Å; W198-R200 PolarHBondContact O-N 3.32Å; W198-R200 VanDerWaalsContact O-N 3.12Å; R200-I202 VanDerWaalsContact C-N 3.33Å; R200-I202 PolarHBondContact O-N 2.9Å; R200-K203 PolarHBondContact O-N 3.36Å
201	A	90.3	Very high	90.5	Very high	2 Å²	2	46.9 Å²	46.9	2%	0.017	22%	0.222	C	C	.	.	H	α-helix	trans	-63.2	-35.7	-174.3	0	0	0	0	0	113.8	R197 W198 K203 H204 W250 N253	R197-A201 PolarHBondContact O-N 3.2Å; W198-A201 HydrophobicContact CE3-CB 4.21Å; W198-A201 PolarHBondContact O-N 2.8Å; W198-A201 VanDerWaalsContact O-N 3.14Å; A201-K203 PolarHBondContact O-N 2.83Å; A201-K203 VanDerWaalsContact O-N 3.17Å; A201-H204 WeakPolarHBondContact O-CB 3.45Å; A201-H204 PolarHBondContact O-CD2 2.93Å; A201-H204 PolarHBondContact O-N 3.03Å; A201-H204 VanDerWaalsContact O-N 3.15Å; A201-W250 HydrophobicContact CB-CE3 4.29Å; A201-W250 HydrophobicContact CB-CZ3 3.99Å; A201-N253 HydrophobicContact CB-CB 3.66Å
202	I	91.3	Very high	90.6	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-61.9	-27	-174.8	-167.9	52.6	0	0	0	112.7	F166 W167 W198 R200 H204 R205 Q206 A211 W229	F166-I202 HydrophobicContact CD2-CG2 4.06Å; W167-I202 HydrophobicContact CD2-CD1 4.08Å; W167-I202 HydrophobicContact CD2-CG1 4.1Å; W167-I202 HydrophobicContact CE3-CD1 3.9Å; W167-I202 HydrophobicContact CE3-CG1 3.86Å; W167-I202 HydrophobicContact CH2-CD1 3.38Å; W167-I202 HydrophobicContact CH2-CG1 4.26Å; W167-I202 HydrophobicContact CZ2-CD1 3.57Å; W167-I202 HydrophobicContact CZ2-CG1 4.48Å; W167-I202 HydrophobicContact CZ3-CB 4.49Å; W167-I202 HydrophobicContact CZ3-CD1 3.55Å; W167-I202 HydrophobicContact CZ3-CG1 3.94Å; W198-I202 WeakPolarHBondContact O-CB 3.47Å; W198-I202 WeakPolarHBondContact O-CG2 3.02Å; W198-I202 PolarHBondContact O-N 2.97Å; R200-I202 VanDerWaalsContact C-N 3.33Å; R200-I202 PolarHBondContact O-N 2.9Å; I202-H204 PolarHBondContact O-N 3.44Å; I202-R205 HydrophobicContact CD1-CB 4.3Å; I202-R205 CarbonylContact O-C 3.52Å; I202-R205 WeakPolarHBondContact O-CA 3.39Å; I202-R205 PolarHBondContact O-N 2.8Å; I202-Q206 HydrophobicContact CG1-CG 4.16Å; I202-Q206 WeakPolarHBondContact O-CG 3.23Å; I202-Q206 PolarHBondContact O-N 2.89Å; I202-A211 HydrophobicContact CD1-CB 4.15Å; I202-W229 HydrophobicContact CD1-CH2 3.59Å; I202-W229 HydrophobicContact CD1-CZ3 3.99Å
203	K	89.3	Confident	90.8	Very high	138 Å²	138	45.7 Å²	45.7	60%	0.6	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-58.7	-34.3	178.7	-62.4	-177.2	179.5	-175.1	0	111.9	R200 A201 R205	R200-K203 PolarHBondContact O-N 3.36Å; A201-K203 PolarHBondContact O-N 2.83Å; A201-K203 VanDerWaalsContact O-N 3.17Å; K203-R205 PolarHBondContact O-N 3.36Å
204	H	88.1	Confident	90.9	Very high	44 Å²	44	41.7 Å²	41.7	20%	0.204	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-69.4	-10.7	176.3	-56.7	-67.9	0	0	0	113.4	A201 I202 K247 E248 W250	A201-H204 WeakPolarHBondContact O-CB 3.45Å; A201-H204 PolarHBondContact O-CD2 2.93Å; A201-H204 PolarHBondContact O-N 3.03Å; A201-H204 VanDerWaalsContact O-N 3.15Å; I202-H204 PolarHBondContact O-N 3.44Å; H204-K247 HydrophobicContact CB-CB 4.45Å; H204-K247 HydrophobicContact CB-CD 3.76Å; H204-K247 WeakPolarHBondContact O-CD 3.39Å; H204-K247 WeakPolarHBondContact O-CE 3.4Å; H204-K247 PolarHBondContact O-NZ 3.35Å; H204-E248 PolarHBondContact CE1-O 2.81Å; H204-W250 HydrophobicContact CB-CE3 4.19Å
205	R	88.1	Confident	91	Very high	3 Å²	3	41.9 Å²	41.9	1%	0.011	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-127.7	21.5	-172	-63.6	-155.1	66.1	-158.9	0.8	113.5	I202 K203 E210 W229 Y231 A244 W250	I202-R205 HydrophobicContact CD1-CB 4.3Å; I202-R205 CarbonylContact O-C 3.52Å; I202-R205 WeakPolarHBondContact O-CA 3.39Å; I202-R205 PolarHBondContact O-N 2.8Å; K203-R205 PolarHBondContact O-N 3.36Å; R205-E210 WeakPolarHBondContact CA-OE1 3.27Å; R205-E210 VanDerWaalsContact CB-OE1 3.3Å; R205-E210 WeakPolarHBondContact CB-OE1 3.46Å; R205-E210 IonicContact CZ-OE1 3.44Å; R205-E210 IonicContact NE-OE1 2.75Å; R205-E210 PolarHBondContact NE-OE1 2.79Å; R205-E210 IonicContact NH2-OE1 2.76Å; R205-W229 HydrophobicContact CB-CH2 4.23Å; R205-W229 HydrophobicContact CB-CZ3 4.02Å; R205-W229 VanDerWaalsContact NH1-CH2 3.25Å; R205-Y231 PolarHBondContact NH2-OH 3.24Å; R205-A244 HydrophobicContact CG-CB 4.44Å; R205-W250 HydrophobicContact CG-CE3 4.34Å; R205-W250 HydrophobicContact CG-CH2 4.05Å; R205-W250 HydrophobicContact CG-CZ3 3.77Å
206	Q	86.1	Confident	91.1	Very high	61 Å²	61	42.1 Å²	42.1	29%	0.285	20%	0.2	S	C	.	.	S	Bend	trans	-107.5	-20	174.9	-78.2	172.9	-51.7	0	0	112.3	N168 I202 N208 N209 A211	N168-Q206 PolarHBondContact OD1-NE2 3.38Å; I202-Q206 HydrophobicContact CG1-CG 4.16Å; I202-Q206 WeakPolarHBondContact O-CG 3.23Å; I202-Q206 PolarHBondContact O-N 2.89Å; Q206-N208 PolarHBondContact O-N 2.77Å; Q206-N209 PolarHBondContact O-N 3.17Å; Q206-N209 VanDerWaalsContact O-N 3.15Å; Q206-A211 HydrophobicContact CG-CB 4.2Å
207	E	83.1	Confident	91.3	Very high	136 Å²	136	38.6 Å²	38.6	64%	0.636	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-36.3	-177.8	-68.8	162.4	-137	0	0	113.3	N209 K247	E207-N209 PolarHBondContact O-N 3.1Å; E207-K247 IonicContact OE1-NZ 3.13Å; E207-K247 PolarHBondContact OE1-NZ 2.98Å; E207-K247 IonicContact OE2-NZ 3.39Å; E207-K247 PolarHBondContact OE2-NZ 2.75Å
208	N	84.1	Confident	91.4	Very high	84 Å²	84	39 Å²	39	45%	0.449	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	11.3	179.7	-54.7	-40.9	0	0	0	112.2	Q206 E210 T240	Q206-N208 PolarHBondContact O-N 2.77Å; N208-E210 VanDerWaalsContact CB-OE2 3.3Å; N208-E210 WeakPolarHBondContact CB-OE2 3.32Å; N208-E210 PolarHBondContact N-OE2 3.47Å; N208-E210 PolarHBondContact O-N 3.2Å; N208-E210 VanDerWaalsContact O-N 3.08Å; N208-T240 HydrophobicContact CB-CG2 4.41Å
209	N	86.9	Confident	91.4	Very high	98 Å²	98	42.7 Å²	42.7	52%	0.524	21%	0.206	S	C	.	.	S	Bend	trans	50.8	32.3	-176.1	-167.5	26.4	0	0	0	112.4	R173 Q206 E207	R173-N209 PolarHBondContact NH1-O 3.42Å; R173-N209 PolarHBondContact NH2-O 3.38Å; R173-N209 PolarHBondContact NH2-OD1 2.88Å; Q206-N209 PolarHBondContact O-N 3.17Å; Q206-N209 VanDerWaalsContact O-N 3.15Å; E207-N209 PolarHBondContact O-N 3.1Å
210	E	92.9	Very high	91.6	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.019	22%	0.216	C	C	.	.			trans	-85.8	-22.4	-179.8	75.6	-87.4	-147.8	0	0	112.5	R205 N208 V212 W229 A230 Y231 T240	R205-E210 WeakPolarHBondContact CA-OE1 3.27Å; R205-E210 VanDerWaalsContact CB-OE1 3.3Å; R205-E210 WeakPolarHBondContact CB-OE1 3.46Å; R205-E210 IonicContact CZ-OE1 3.44Å; R205-E210 IonicContact NE-OE1 2.75Å; R205-E210 PolarHBondContact NE-OE1 2.79Å; R205-E210 IonicContact NH2-OE1 2.76Å; N208-E210 VanDerWaalsContact CB-OE2 3.3Å; N208-E210 WeakPolarHBondContact CB-OE2 3.32Å; N208-E210 PolarHBondContact N-OE2 3.47Å; N208-E210 PolarHBondContact O-N 3.2Å; N208-E210 VanDerWaalsContact O-N 3.08Å; E210-V212 PolarHBondContact O-N 2.86Å; E210-W229 HydrophobicContact CG-CE3 3.69Å; E210-W229 HydrophobicContact CG-CZ3 4Å; E210-W229 CarbonylContact O-C 3.51Å; E210-W229 WeakPolarHBondContact O-CA 3.41Å; E210-A230 WeakPolarHBondContact CA-O 3.29Å; E210-A230 WeakPolarHBondContact CB-O 3.32Å; E210-A230 PolarHBondContact O-N 2.99Å; E210-Y231 HydrophobicContact CB-CD1 4.2Å; E210-Y231 HydrophobicContact CB-CE1 3.84Å; E210-Y231 HydrophobicContact CG-CE1 4.18Å; E210-T240 HydrophobicContact CB-CG2 4.39Å; E210-T240 HydrophobicContact CG-CG2 4.01Å; E210-T240 WeakPolarHBondContact OE1-CG2 3.44Å
211	A	94.6	Very high	91.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	105.8	-178.8	0	0	0	0	0	111.4	W167 N168 I202 Q206 W229	W167-A211 HydrophobicContact CZ2-CB 4.29Å; N168-A211 PolarHBondContact ND2-O 3.37Å; I202-A211 HydrophobicContact CD1-CB 4.15Å; Q206-A211 HydrophobicContact CG-CB 4.2Å; A211-W229 HydrophobicContact CB-CE3 4.17Å; A211-W229 HydrophobicContact CB-CZ3 3.77Å
212	V	95.3	Very high	92	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-49.9	-179.1	-176.2	0	0	0	0	111.3	P170 Y179 E210 L228 A230 L277	P170-V212 WeakPolarHBondContact CA-O 3.37Å; P170-V212 HydrophobicContact CB-CG1 4.11Å; Y179-V212 HydrophobicContact CD1-CG2 4.35Å; Y179-V212 HydrophobicContact CE1-CG1 4.41Å; Y179-V212 HydrophobicContact CE1-CG2 3.94Å; E210-V212 PolarHBondContact O-N 2.86Å; V212-L228 WeakPolarHBondContact CA-O 3.24Å; V212-L228 HydrophobicContact CB-CB 4.23Å; V212-L228 HydrophobicContact CB-CD2 4.15Å; V212-L228 HydrophobicContact CB-CG 3.94Å; V212-L228 VanDerWaalsContact CB-O 3.3Å; V212-L228 WeakPolarHBondContact CB-O 3.47Å; V212-L228 HydrophobicContact CG1-CD2 3.73Å; V212-L228 HydrophobicContact CG1-CG 4.1Å; V212-L228 HydrophobicContact CG2-CG 4.45Å; V212-L228 PolarHBondContact N-O 2.89Å; V212-A230 HydrophobicContact CG2-CB 3.43Å; V212-A230 VanDerWaalsContact CG2-CB 3.43Å; V212-L277 HydrophobicContact CG1-CD1 4.11Å; V212-L277 HydrophobicContact CG1-CD2 4.21Å
213	G	95.3	Very high	92.2	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.1	148.4	-175.7	0	0	0	0	0	112.1	W167 L228	W167-G213 VanDerWaalsContact NE1-CA 3.35Å; W167-G213 PolarHBondContact NE1-O 3.35Å; G213-L228 PolarHBondContact N-O 2.81Å; G213-L228 PolarHBondContact O-N 2.98Å
214	G	96.1	Very high	92.5	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	124.9	177.4	0	0	0	0	0	109	E163 F164 W167 H226	E163-G214 CarbonylContact C-O 3.52Å; E163-G214 WeakPolarHBondContact CA-O 3.3Å; F164-G214 VanDerWaalsContact CD2-C 3.49Å; F164-G214 PolarHBondContact N-O 3.36Å; W167-G214 VanDerWaalsContact CG-N 3.31Å; G214-H226 WeakPolarHBondContact CA-O 3.33Å
215	F	96.4	Very high	93	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.018	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	152.6	-169	-49.3	-85	0	0	0	111.8	Y66 L119 L161 L162 E163 P170 V225 H226 L228	Y66-F215 HydrophobicContact CD1-CD1 4.48Å; Y66-F215 AromaticContact CD1-CE1 3.77Å; Y66-F215 HydrophobicContact CD1-CE1 3.77Å; Y66-F215 HydrophobicContact CD1-CZ 4.43Å; Y66-F215 HydrophobicContact CD2-CD1 4.04Å; Y66-F215 AromaticContact CD2-CE1 3.88Å; Y66-F215 HydrophobicContact CD2-CE1 3.88Å; Y66-F215 AromaticContact CE1-CE1 3.83Å; Y66-F215 HydrophobicContact CE1-CE1 3.83Å; Y66-F215 HydrophobicContact CE1-CZ 4.41Å; Y66-F215 HydrophobicContact CE2-CD1 4.42Å; Y66-F215 AromaticContact CE2-CE1 3.95Å; Y66-F215 HydrophobicContact CE2-CE1 3.95Å; Y66-F215 HydrophobicContact CG-CD1 4.05Å; Y66-F215 AromaticContact CG-CE1 3.78Å; Y66-F215 HydrophobicContact CG-CE1 3.78Å; Y66-F215 AromaticContact CZ-CE1 3.92Å; L119-F215 HydrophobicContact CD2-CE1 4.5Å; L119-F215 HydrophobicContact CD2-CE2 3.98Å; L119-F215 HydrophobicContact CD2-CZ 3.73Å; L161-F215 HydrophobicContact CB-CB 4Å; L161-F215 HydrophobicContact CD1-CB 3.68Å; L161-F215 HydrophobicContact CD1-CG 4.15Å; L161-F215 HydrophobicContact CG-CB 4.44Å; L162-F215 CarbonylContact O-C 3.49Å; L162-F215 WeakPolarHBondContact O-CA 3.21Å; E163-F215 HydrophobicContact CB-CD1 4.11Å; E163-F215 HydrophobicContact CB-CE1 4.23Å; P170-F215 HydrophobicContact CG-CZ 4.21Å; F215-V225 CarbonylContact O-C 3.6Å; F215-V225 VanDerWaalsContact O-CA 3.31Å; F215-V225 WeakPolarHBondContact O-CA 2.99Å; F215-V225 WeakPolarHBondContact O-CG1 3.43Å; F215-H226 HydrophobicContact CB-CB 4.47Å; F215-H226 PolarHBondContact N-O 2.87Å; F215-H226 PolarHBondContact O-N 2.88Å; F215-L228 HydrophobicContact CE2-CB 4.45Å
216	F	95.8	Very high	93.5	Very high	5 Å²	5	41.1 Å²	41.1	2%	0.022	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	142.7	174.1	63	-81.9	0	0	0	111.8	L57 L161 L162 F164 M191 Q218 V224 V225	L57-F216 HydrophobicContact CB-CE1 4.04Å; L57-F216 HydrophobicContact CB-CZ 3.96Å; L161-F216 VanDerWaalsContact CA-O 3.3Å; L161-F216 WeakPolarHBondContact CA-O 3.5Å; L162-F216 HydrophobicContact CB-CD1 4.36Å; L162-F216 HydrophobicContact CB-CE1 3.75Å; L162-F216 HydrophobicContact CB-CE2 4.12Å; L162-F216 HydrophobicContact CB-CZ 3.63Å; L162-F216 HydrophobicContact CD1-CE2 4.2Å; L162-F216 HydrophobicContact CD1-CZ 4.02Å; L162-F216 HydrophobicContact CG-CZ 4.47Å; L162-F216 PolarHBondContact N-O 3.2Å; L162-F216 WeakPolarHBondContact O-CD1 3.15Å; L162-F216 PolarHBondContact O-N 2.81Å; F164-F216 AromaticContact CD1-CD1 3.71Å; F164-F216 HydrophobicContact CD1-CD1 3.71Å; F164-F216 AromaticContact CD1-CE1 3.96Å; F164-F216 HydrophobicContact CD1-CE1 3.96Å; F164-F216 HydrophobicContact CD2-CD1 4.38Å; F164-F216 HydrophobicContact CE1-CB 4.28Å; F164-F216 AromaticContact CE1-CD1 3.51Å; F164-F216 HydrophobicContact CE1-CD1 3.51Å; F164-F216 HydrophobicContact CE1-CE1 4.09Å; F164-F216 HydrophobicContact CE1-CG 4.09Å; F164-F216 HydrophobicContact CE2-CB 4.29Å; F164-F216 HydrophobicContact CE2-CD1 4.21Å; F164-F216 HydrophobicContact CG-CD1 4.15Å; F164-F216 HydrophobicContact CZ-CB 3.8Å; F164-F216 AromaticContact CZ-CD1 3.78Å; F164-F216 HydrophobicContact CZ-CD1 3.78Å; F164-F216 HydrophobicContact CZ-CG 4.11Å; M191-F216 HydrophobicContact CE-CB 4.15Å; M191-F216 HydrophobicContact SD-CB 4.04Å; F216-Q218 VanDerWaalsContact CD2-NE2 3.33Å; F216-V224 WeakPolarHBondContact CA-O 3.4Å; F216-V225 HydrophobicContact CB-CG2 4.2Å
217	S	95.3	Very high	94	Very high	8 Å²	8	38.2 Å²	38.2	6%	0.056	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	131.3	-175.1	60.8	0	0	0	0	112.9	D221 L222 Y223 V224	S217-D221 WeakPolarHBondContact CB-O 3.49Å; S217-D221 PolarHBondContact OG-O 3.17Å; S217-D221 VanDerWaalsContact OG-O 3.05Å; S217-L222 WeakPolarHBondContact OG-CA 3.31Å; S217-Y223 PolarHBondContact OG-N 3.22Å; S217-V224 PolarHBondContact N-O 3.32Å; S217-V224 PolarHBondContact OG-N 3.17Å; S217-V224 VanDerWaalsContact OG-N 3.15Å; S217-V224 PolarHBondContact OG-O 3.36Å
218	Q	93.8	Very high	94.7	Very high	52 Å²	52	31.9 Å²	31.9	24%	0.243	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	-42	164.6	-66.6	-55	-69.5	0	0	112.2	L160 L162 F216 L222	L160-Q218 PolarHBondContact O-N 3.32Å; L162-Q218 HydrophobicContact CB-CG 4.37Å; L162-Q218 HydrophobicContact CD1-CG 3.63Å; L162-Q218 HydrophobicContact CG-CG 3.56Å; F216-Q218 VanDerWaalsContact CD2-NE2 3.33Å; Q218-L222 WeakPolarHBondContact O-CD2 3.07Å
219	I	95.1	Very high	95.3	Very high	91 Å²	91	27.9 Å²	27.9	47%	0.467	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	139.7	-178.8	-60.3	175.1	0	0	0	109.1	Y126 Q159 L160	Y126-I219 HydrophobicContact CE1-CD1 3.99Å; Q159-I219 WeakPolarHBondContact CA-O 3.24Å; L160-I219 HydrophobicContact CB-CB 4.14Å; L160-I219 HydrophobicContact CD1-CB 4.33Å; L160-I219 HydrophobicContact CD1-CD1 3.97Å; L160-I219 PolarHBondContact N-O 3.15Å; L160-I219 PolarHBondContact O-N 3.4Å
220	G	95.5	Very high	95.8	Very high	43 Å²	43	23.4 Å²	23.4	44%	0.443	13%	0.127	S	C	.	.	S	Bend	trans	106.2	-140.1	-169.8	0	0	0	0	0	110.4	L222	G220-L222 PolarHBondContact O-N 2.83Å
221	D	93.3	Very high	95.9	Very high	66 Å²	66	23.7 Å²	23.7	35%	0.353	13%	0.128	S	C	.	.	S	Bend	trans	-67.5	114.9	174.4	-68.8	-8.8	0	0	0	109.7	Q157 Q159 K185 S217 V224	Q157-D221 PolarHBondContact NE2-OD2 2.83Å; Q159-D221 PolarHBondContact NE2-O 3.06Å; K185-D221 IonicContact NZ-OD2 3.27Å; S217-D221 WeakPolarHBondContact CB-O 3.49Å; S217-D221 PolarHBondContact OG-O 3.17Å; S217-D221 VanDerWaalsContact OG-O 3.05Å; D221-V224 HydrophobicContact CB-CG2 3.72Å; D221-V224 WeakPolarHBondContact O-CG2 3.36Å
222	L	94.8	Very high	95.8	Very high	107 Å²	107	31.1 Å²	31.1	56%	0.56	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	159.8	-177.9	-59.3	-178	0	0	0	112.3	S217 Q218 G220 V224	S217-L222 WeakPolarHBondContact OG-CA 3.31Å; Q218-L222 WeakPolarHBondContact O-CD2 3.07Å; G220-L222 PolarHBondContact O-N 2.83Å; L222-V224 PolarHBondContact O-N 3.42Å
223	Y	95.5	Very high	95.8	Very high	95 Å²	95	33.4 Å²	33.4	37%	0.373	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	29.7	-175.3	-55.2	-79.8	0	0	0	113.1	L186 P188 M191 S217	L186-Y223 WeakPolarHBondContact CB-O 3.33Å; L186-Y223 PolarHBondContact N-O 3.04Å; P188-Y223 HydrophobicContact CB-CD2 4.02Å; P188-Y223 HydrophobicContact CB-CE1 4.43Å; P188-Y223 HydrophobicContact CB-CE2 3.77Å; P188-Y223 HydrophobicContact CB-CG 4.45Å; P188-Y223 HydrophobicContact CG-CD2 4.12Å; P188-Y223 HydrophobicContact CG-CE2 4.27Å; M191-Y223 HydrophobicContact CB-CD1 4.39Å; S217-Y223 PolarHBondContact OG-N 3.22Å
224	V	97.5	Very high	95.8	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.024	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	135.5	176.5	-178.2	0	0	0	0	110	T183 Y184 K185 F216 S217 D221 L222 H226	T183-V224 HydrophobicContact CG2-CG1 3.51Å; Y184-V224 WeakPolarHBondContact O-CA 3.4Å; K185-V224 HydrophobicContact CG-CG2 4.21Å; F216-V224 WeakPolarHBondContact CA-O 3.4Å; S217-V224 PolarHBondContact N-O 3.32Å; S217-V224 PolarHBondContact OG-N 3.17Å; S217-V224 VanDerWaalsContact OG-N 3.15Å; S217-V224 PolarHBondContact OG-O 3.36Å; D221-V224 HydrophobicContact CB-CG2 3.72Å; D221-V224 WeakPolarHBondContact O-CG2 3.36Å; L222-V224 PolarHBondContact O-N 3.42Å; V224-H226 WeakPolarHBondContact CG1-NE2 3.46Å
225	V	97.6	Very high	95.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	138.6	172.9	172.3	0	0	0	0	109.7	F164 T183 Y184 L186 M191 W194 F215 F216	F164-V225 HydrophobicContact CE2-CG1 3.67Å; F164-V225 HydrophobicContact CE2-CG2 4.31Å; F164-V225 HydrophobicContact CZ-CG1 4.13Å; F164-V225 HydrophobicContact CZ-CG2 3.92Å; T183-V225 CarbonylContact C-O 3.54Å; T183-V225 WeakPolarHBondContact CA-O 3.27Å; Y184-V225 HydrophobicContact CD2-CG1 4.43Å; Y184-V225 PolarHBondContact N-O 2.57Å; Y184-V225 PolarHBondContact O-N 2.84Å; L186-V225 HydrophobicContact CD1-CG2 3.89Å; L186-V225 HydrophobicContact CG-CG2 4.41Å; M191-V225 HydrophobicContact CE-CG2 3.74Å; M191-V225 HydrophobicContact SD-CG2 3.45Å; M191-V225 WeakPolarHBondContact SD-CG2 3.4Å; W194-V225 HydrophobicContact CE3-CG2 4.23Å; W194-V225 HydrophobicContact CH2-CB 3.99Å; W194-V225 HydrophobicContact CH2-CG1 3.43Å; W194-V225 VanDerWaalsContact CH2-CG1 3.43Å; W194-V225 HydrophobicContact CH2-CG2 4.24Å; W194-V225 HydrophobicContact CZ2-CG1 4.44Å; W194-V225 HydrophobicContact CZ3-CB 4.13Å; W194-V225 HydrophobicContact CZ3-CG1 3.61Å; W194-V225 HydrophobicContact CZ3-CG2 3.9Å; F215-V225 CarbonylContact O-C 3.6Å; F215-V225 VanDerWaalsContact O-CA 3.31Å; F215-V225 WeakPolarHBondContact O-CA 2.99Å; F215-V225 WeakPolarHBondContact O-CG1 3.43Å; F216-V225 HydrophobicContact CB-CG2 4.2Å
226	H	98.2	Very high	95.7	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.009	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	125.8	172.2	-59.2	-75	0	0	0	110.3	Q159 L181 R182 T183 G214 F215 V224	Q159-H226 PolarHBondContact OE1-NE2 2.94Å; L181-H226 HydrophobicContact CD1-CB 4Å; R182-H226 CarbonylContact O-C 3.59Å; R182-H226 WeakPolarHBondContact O-CA 3.44Å; T183-H226 VanDerWaalsContact CG2-CE1 3.42Å; T183-H226 WeakPolarHBondContact CG2-CE1 3.48Å; T183-H226 PolarHBondContact OG1-CE1 3.15Å; T183-H226 PolarHBondContact OG1-ND1 2.93Å; G214-H226 WeakPolarHBondContact CA-O 3.33Å; F215-H226 HydrophobicContact CB-CB 4.47Å; F215-H226 PolarHBondContact N-O 2.87Å; F215-H226 PolarHBondContact O-N 2.88Å; V224-H226 WeakPolarHBondContact CG1-NE2 3.46Å
227	H	97.8	Very high	95.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	124.2	166.5	-63.8	168.5	0	0	0	109.2	W167 L181 R182 Y184 W194 W198 W229	W167-H227 HydrophobicContact CH2-CB 3.94Å; W167-H227 AromaticContact CH2-CD2 3.36Å; W167-H227 WeakPolarHBondContact CH2-CD2 3.28Å; W167-H227 AromaticContact CH2-CE1 3.59Å; W167-H227 AromaticContact CH2-CG 3.4Å; W167-H227 AromaticContact CH2-ND1 3.56Å; W167-H227 AromaticContact CH2-NE2 3.5Å; W167-H227 HydrophobicContact CZ2-CB 4.16Å; W167-H227 AromaticContact CZ3-CD2 3.46Å; W167-H227 VanDerWaalsContact CZ3-CD2 3.46Å; W167-H227 WeakPolarHBondContact CZ3-CD2 3.43Å; W167-H227 AromaticContact CZ3-CE1 3.6Å; W167-H227 AromaticContact CZ3-CG 3.97Å; W167-H227 AromaticContact CZ3-NE2 3.22Å; W167-H227 WeakPolarHBondContact CZ3-NE2 3.44Å; L181-H227 WeakPolarHBondContact CA-O 3.44Å; R182-H227 HydrophobicContact CB-CB 4.42Å; R182-H227 PolarHBondContact N-O 2.89Å; R182-H227 PolarHBondContact O-N 3.15Å; Y184-H227 HydrophobicContact CE2-CB 4.45Å; Y184-H227 AromaticContact CE2-CG 3.97Å; Y184-H227 AromaticContact CE2-ND1 3.49Å; Y184-H227 WeakPolarHBondContact CE2-ND1 3.21Å; W194-H227 AromaticContact CH2-CE1 3.32Å; W194-H227 WeakPolarHBondContact CH2-CE1 3.5Å; W194-H227 AromaticContact CH2-NE2 3.31Å; W194-H227 VanDerWaalsContact CH2-NE2 3.31Å; W194-H227 WeakPolarHBondContact CH2-NE2 3.33Å; W194-H227 AromaticContact CZ3-NE2 3.8Å; W198-H227 AromaticContact CD2-CE1 3.62Å; W198-H227 AromaticContact CE2-CE1 3.62Å; W198-H227 AromaticContact CE3-CE1 3.73Å; W198-H227 AromaticContact CH2-CE1 3.82Å; W198-H227 AromaticContact CH2-ND1 3.94Å; W198-H227 AromaticContact CZ2-CE1 3.72Å; W198-H227 AromaticContact CZ3-CE1 3.83Å; H227-W229 HydrophobicContact CB-CZ2 3.94Å; H227-W229 VanDerWaalsContact CB-NE1 3.27Å; H227-W229 AromaticContact ND1-CZ2 3.82Å
228	L	97.7	Very high	95.6	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.016	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	122.2	173	-173.8	63.5	0	0	0	108.8	W106 L119 Y179 L181 V212 G213 F215 M269 L277	W106-L228 HydrophobicContact CH2-CD2 3.82Å; W106-L228 HydrophobicContact CZ2-CD2 3.97Å; L119-L228 HydrophobicContact CD2-CD2 4.46Å; Y179-L228 HydrophobicContact CD1-CD1 3.94Å; Y179-L228 HydrophobicContact CD1-CD2 4.46Å; Y179-L228 HydrophobicContact CD1-CG 4.15Å; L181-L228 HydrophobicContact CB-CD1 4.5Å; L181-L228 HydrophobicContact CD1-CB 4.47Å; L181-L228 HydrophobicContact CD1-CD1 4.29Å; V212-L228 WeakPolarHBondContact CA-O 3.24Å; V212-L228 HydrophobicContact CB-CB 4.23Å; V212-L228 HydrophobicContact CB-CD2 4.15Å; V212-L228 HydrophobicContact CB-CG 3.94Å; V212-L228 VanDerWaalsContact CB-O 3.3Å; V212-L228 WeakPolarHBondContact CB-O 3.47Å; V212-L228 HydrophobicContact CG1-CD2 3.73Å; V212-L228 HydrophobicContact CG1-CG 4.1Å; V212-L228 HydrophobicContact CG2-CG 4.45Å; V212-L228 PolarHBondContact N-O 2.89Å; G213-L228 PolarHBondContact N-O 2.81Å; G213-L228 PolarHBondContact O-N 2.98Å; F215-L228 HydrophobicContact CE2-CB 4.45Å; L228-M269 HydrophobicContact CD1-CE 3.84Å; L228-L277 HydrophobicContact CD2-CD1 4.35Å
229	W	97.1	Very high	95.7	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	152.5	177.8	-49.2	92.4	0	0	0	110	W167 Y179 E180 W198 I202 R205 E210 A211 H227 Y231	W167-W229 AromaticContact CH2-CH2 3.44Å; W167-W229 HydrophobicContact CH2-CH2 3.44Å; W167-W229 VanDerWaalsContact CH2-CH2 3.44Å; W167-W229 AromaticContact CH2-CZ2 3.46Å; W167-W229 HydrophobicContact CH2-CZ2 3.46Å; W167-W229 VanDerWaalsContact CH2-CZ2 3.46Å; W167-W229 HydrophobicContact CH2-CZ3 4.3Å; W167-W229 HydrophobicContact CZ2-CE3 4.4Å; W167-W229 AromaticContact CZ2-CH2 3.48Å; W167-W229 HydrophobicContact CZ2-CH2 3.48Å; W167-W229 VanDerWaalsContact CZ2-CH2 3.48Å; W167-W229 AromaticContact CZ2-CZ2 3.66Å; W167-W229 HydrophobicContact CZ2-CZ2 3.66Å; W167-W229 AromaticContact CZ2-CZ3 3.89Å; W167-W229 HydrophobicContact CZ2-CZ3 3.89Å; Y179-W229 CarbonylContact C-O 3.55Å; Y179-W229 VanDerWaalsContact CA-O 3.26Å; Y179-W229 WeakPolarHBondContact CA-O 3.49Å; E180-W229 HydrophobicContact CB-CB 4.25Å; E180-W229 PolarHBondContact N-O 3.25Å; E180-W229 PolarHBondContact O-N 3.2Å; W198-W229 HydrophobicContact CH2-CZ2 4.42Å; W198-W229 HydrophobicContact CZ3-CH2 4.29Å; W198-W229 HydrophobicContact CZ3-CZ2 4.29Å; I202-W229 HydrophobicContact CD1-CH2 3.59Å; I202-W229 HydrophobicContact CD1-CZ3 3.99Å; R205-W229 HydrophobicContact CB-CH2 4.23Å; R205-W229 HydrophobicContact CB-CZ3 4.02Å; R205-W229 VanDerWaalsContact NH1-CH2 3.25Å; E210-W229 HydrophobicContact CG-CE3 3.69Å; E210-W229 HydrophobicContact CG-CZ3 4Å; E210-W229 CarbonylContact O-C 3.51Å; E210-W229 WeakPolarHBondContact O-CA 3.41Å; A211-W229 HydrophobicContact CB-CE3 4.17Å; A211-W229 HydrophobicContact CB-CZ3 3.77Å; H227-W229 HydrophobicContact CB-CZ2 3.94Å; H227-W229 VanDerWaalsContact CB-NE1 3.27Å; H227-W229 AromaticContact ND1-CZ2 3.82Å; W229-Y231 HydrophobicContact CB-CE2 3.6Å
230	A	96.1	Very high	95.6	Very high	4 Å²	4	47.5 Å²	47.5	3%	0.033	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	141.6	173.3	0	0	0	0	0	110.5	L178 Y179 E210 V212	L178-A230 CarbonylContact O-C 2.9Å; L178-A230 WeakPolarHBondContact O-CA 3.35Å; Y179-A230 HydrophobicContact CD1-CB 4Å; Y179-A230 HydrophobicContact CE1-CB 3.66Å; E210-A230 WeakPolarHBondContact CA-O 3.29Å; E210-A230 WeakPolarHBondContact CB-O 3.32Å; E210-A230 PolarHBondContact O-N 2.99Å; V212-A230 HydrophobicContact CG2-CB 3.43Å; V212-A230 VanDerWaalsContact CG2-CB 3.43Å
231	Y	95.4	Very high	95.5	Very high	9 Å²	9	49.6 Å²	49.6	4%	0.035	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	152	179.9	-50.9	-81.6	0	0	0	109.2	L178 E180 R205 E210 W229 S233 R237 T240	L178-Y231 PolarHBondContact N-O 3.35Å; L178-Y231 PolarHBondContact O-N 3.22Å; E180-Y231 HydrophobicContact CB-CE2 3.85Å; E180-Y231 PolarHBondContact OE2-OH 2.82Å; R205-Y231 PolarHBondContact NH2-OH 3.24Å; E210-Y231 HydrophobicContact CB-CD1 4.2Å; E210-Y231 HydrophobicContact CB-CE1 3.84Å; E210-Y231 HydrophobicContact CG-CE1 4.18Å; W229-Y231 HydrophobicContact CB-CE2 3.6Å; Y231-S233 VanDerWaalsContact C-N 3.33Å; Y231-R237 HydrophobicContact CD1-CB 3.85Å; Y231-R237 HydrophobicContact CD1-CG 4.24Å; Y231-R237 HydrophobicContact CD2-CB 3.76Å; Y231-R237 HydrophobicContact CD2-CG 3.78Å; Y231-R237 HydrophobicContact CE1-CB 4.24Å; Y231-R237 HydrophobicContact CE1-CG 4.15Å; Y231-R237 HydrophobicContact CE2-CB 4.16Å; Y231-R237 HydrophobicContact CE2-CG 3.67Å; Y231-R237 HydrophobicContact CG-CB 3.58Å; Y231-R237 HydrophobicContact CG-CG 4.05Å; Y231-T240 HydrophobicContact CE1-CG2 4.05Å
232	E	93.5	Very high	95.4	Very high	157 Å²	157	50.4 Å²	50.4	73%	0.734	24%	0.244	S	C	*	.	S	Bend	trans	-69.7	-32.1	175.8	-62.2	178	174.6	0	0	112.3	S236	E232-S236 PolarHBondContact N-OG 3.36Å
233	S	94.1	Very high	95.2	Very high	49 Å²	49	47.6 Å²	47.6	34%	0.343	23%	0.233	S	C	.	.	S	Bend	trans	-156.8	174.5	-178.1	69.4	0	0	0	0	112	Y231 Q235 S236 R237	Y231-S233 VanDerWaalsContact C-N 3.33Å; S233-Q235 VanDerWaalsContact C-N 3.28Å; S233-Q235 PolarHBondContact OG-N 2.82Å; S233-S236 PolarHBondContact N-OG 2.97Å; S233-S236 PolarHBondContact O-OG 3.18Å; S233-S236 PolarHBondContact OG-N 3.48Å; S233-S236 VanDerWaalsContact OG-N 3.13Å; S233-S236 PolarHBondContact OG-OG 3.39Å; S233-R237 WeakPolarHBondContact O-CB 3.33Å; S233-R237 PolarHBondContact O-N 2.82Å; S233-R237 VanDerWaalsContact O-N 3.08Å
234	L	95.3	Very high	94.9	Very high	67 Å²	67	43.2 Å²	43.2	35%	0.351	22%	0.217	S	C	.	.	H	α-helix	trans	-64.6	-34.3	171.6	-68.3	174.9	0	0	0	112.4	W109 L178 R237 E238 L268	W109-L234 HydrophobicContact CH2-CD1 4.33Å; W109-L234 HydrophobicContact CZ3-CD1 4.05Å; L178-L234 HydrophobicContact CD2-CD2 3.41Å; L178-L234 VanDerWaalsContact CD2-CD2 3.41Å; L178-L234 HydrophobicContact CD2-CG 3.92Å; L234-R237 WeakPolarHBondContact O-CB 3.42Å; L234-R237 PolarHBondContact O-N 2.86Å; L234-E238 PolarHBondContact O-N 3.07Å; L234-L268 HydrophobicContact CD2-CD1 3.45Å; L234-L268 VanDerWaalsContact CD2-CD1 3.45Å; L234-L268 HydrophobicContact CD2-CD2 4.45Å
235	Q	95.6	Very high	94.6	Very high	103 Å²	103	49.4 Å²	49.4	48%	0.481	24%	0.24	S	C	.	.	H	α-helix	trans	-66.9	-50.5	178	-175.9	61.6	37.4	0	0	110.6	S233 R237 E238 E239	S233-Q235 VanDerWaalsContact C-N 3.28Å; S233-Q235 PolarHBondContact OG-N 2.82Å; Q235-R237 PolarHBondContact O-N 2.86Å; Q235-E238 WeakPolarHBondContact O-CB 3.31Å; Q235-E238 PolarHBondContact O-N 3.19Å; Q235-E239 WeakPolarHBondContact CG-OE1 3.46Å; Q235-E239 PolarHBondContact NE2-OE1 3.15Å; Q235-E239 WeakPolarHBondContact O-CG 3.32Å; Q235-E239 PolarHBondContact O-N 2.79Å
236	S	94.3	Very high	94.2	Very high	21 Å²	21	57.6 Å²	57.6	15%	0.147	28%	0.278	C	S	.	.	H	α-helix	trans	-64.8	-30.2	178.3	66.1	0	0	0	0	112.2	E232 S233 T240	E232-S236 PolarHBondContact N-OG 3.36Å; S233-S236 PolarHBondContact N-OG 2.97Å; S233-S236 PolarHBondContact O-OG 3.18Å; S233-S236 PolarHBondContact OG-N 3.48Å; S233-S236 VanDerWaalsContact OG-N 3.13Å; S233-S236 PolarHBondContact OG-OG 3.39Å; S236-T240 WeakPolarHBondContact O-CB 3.45Å; S236-T240 PolarHBondContact O-N 3.05Å; S236-T240 PolarHBondContact O-OG1 3.19Å
237	R	95.2	Very high	93.8	Very high	40 Å²	40	59.4 Å²	59.4	15%	0.151	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-47.5	169	175	179.8	173.5	-88.9	11.3	112.3	E180 Y231 S233 L234 Q235 R241	E180-R237 VanDerWaalsContact CD-NH2 3.29Å; E180-R237 IonicContact OE1-CZ 2.99Å; E180-R237 IonicContact OE1-NE 3.5Å; E180-R237 IonicContact OE1-NH2 3.58Å; E180-R237 PolarHBondContact OE1-NH2 3.21Å; E180-R237 IonicContact OE2-CZ 2.69Å; E180-R237 IonicContact OE2-NE 2.8Å; E180-R237 PolarHBondContact OE2-NE 2.8Å; E180-R237 IonicContact OE2-NH2 2.82Å; E180-R237 PolarHBondContact OE2-NH2 3.45Å; Y231-R237 HydrophobicContact CD1-CB 3.85Å; Y231-R237 HydrophobicContact CD1-CG 4.24Å; Y231-R237 HydrophobicContact CD2-CB 3.76Å; Y231-R237 HydrophobicContact CD2-CG 3.78Å; Y231-R237 HydrophobicContact CE1-CB 4.24Å; Y231-R237 HydrophobicContact CE1-CG 4.15Å; Y231-R237 HydrophobicContact CE2-CB 4.16Å; Y231-R237 HydrophobicContact CE2-CG 3.67Å; Y231-R237 HydrophobicContact CG-CB 3.58Å; Y231-R237 HydrophobicContact CG-CG 4.05Å; S233-R237 WeakPolarHBondContact O-CB 3.33Å; S233-R237 PolarHBondContact O-N 2.82Å; S233-R237 VanDerWaalsContact O-N 3.08Å; L234-R237 WeakPolarHBondContact O-CB 3.42Å; L234-R237 PolarHBondContact O-N 2.86Å; Q235-R237 PolarHBondContact O-N 2.86Å; R237-R241 WeakPolarHBondContact O-CB 3.45Å; R237-R241 VanDerWaalsContact O-CG 3.23Å; R237-R241 WeakPolarHBondContact O-CG 3.36Å; R237-R241 PolarHBondContact O-N 3.03Å
238	E	95.3	Very high	93.4	Very high	101 Å²	101	68.2 Å²	68.2	47%	0.472	33%	0.327	S	S	.	.	H	α-helix	trans	-62.3	-50.7	178.6	178.3	173.1	-168.2	0	0	111	L234 Q235 T240 R241 N242	L234-E238 PolarHBondContact O-N 3.07Å; Q235-E238 WeakPolarHBondContact O-CB 3.31Å; Q235-E238 PolarHBondContact O-N 3.19Å; E238-T240 PolarHBondContact O-N 3.17Å; E238-R241 PolarHBondContact O-N 3.14Å; E238-R241 VanDerWaalsContact O-N 3.15Å; E238-N242 WeakPolarHBondContact O-CB 3.31Å; E238-N242 VanDerWaalsContact O-CG 3.3Å; E238-N242 PolarHBondContact O-N 3.09Å
239	E	94.8	Very high	92.8	Very high	107 Å²	107	69.1 Å²	69.1	50%	0.5	34%	0.337	S	S	.	.	H	α-helix	trans	-58.3	-46.3	179.1	-70	166.4	-179.4	0	0	112	Q235 R241 N242 S243	Q235-E239 WeakPolarHBondContact CG-OE1 3.46Å; Q235-E239 PolarHBondContact NE2-OE1 3.15Å; Q235-E239 WeakPolarHBondContact O-CG 3.32Å; Q235-E239 PolarHBondContact O-N 2.79Å; E239-R241 VanDerWaalsContact C-N 3.34Å; E239-R241 PolarHBondContact O-N 2.92Å; E239-N242 PolarHBondContact O-N 2.83Å; E239-S243 WeakPolarHBondContact O-CB 3.22Å; E239-S243 PolarHBondContact O-N 2.84Å; E239-S243 PolarHBondContact O-OG 3.34Å
240	T	93.3	Very high	92.4	Very high	19 Å²	19	69.9 Å²	69.9	12%	0.117	34%	0.34	C	S	.	.	H	α-helix	trans	-62	-40.7	176.8	-63.1	0	0	0	0	111.8	N208 E210 Y231 S236 E238 S243 A244	N208-T240 HydrophobicContact CB-CG2 4.41Å; E210-T240 HydrophobicContact CB-CG2 4.39Å; E210-T240 HydrophobicContact CG-CG2 4.01Å; E210-T240 WeakPolarHBondContact OE1-CG2 3.44Å; Y231-T240 HydrophobicContact CE1-CG2 4.05Å; S236-T240 WeakPolarHBondContact O-CB 3.45Å; S236-T240 PolarHBondContact O-N 3.05Å; S236-T240 PolarHBondContact O-OG1 3.19Å; E238-T240 PolarHBondContact O-N 3.17Å; T240-S243 PolarHBondContact O-OG 3.32Å; T240-A244 PolarHBondContact O-N 3.32Å
241	R	92.4	Very high	92.1	Very high	87 Å²	87	73.6 Å²	73.6	33%	0.328	36%	0.359	S	S	.	.	H	α-helix	trans	-68.4	-39.4	177.8	-77.1	179.1	61.8	152.9	-3.5	111.9	E180 R182 R237 E238 E239 W245	E180-R241 IonicContact OE1-NH1 2.79Å; R182-R241 VanDerWaalsContact NH2-CD 3.32Å; R182-R241 VanDerWaalsContact NH2-CZ 3.35Å; R237-R241 WeakPolarHBondContact O-CB 3.45Å; R237-R241 VanDerWaalsContact O-CG 3.23Å; R237-R241 WeakPolarHBondContact O-CG 3.36Å; R237-R241 PolarHBondContact O-N 3.03Å; E238-R241 PolarHBondContact O-N 3.14Å; E238-R241 VanDerWaalsContact O-N 3.15Å; E239-R241 VanDerWaalsContact C-N 3.34Å; E239-R241 PolarHBondContact O-N 2.92Å; R241-W245 VanDerWaalsContact O-CD1 3.24Å
242	N	92.2	Very high	91.8	Very high	84 Å²	84	76.5 Å²	76.5	45%	0.449	38%	0.377	S	S	.	.	H	α-helix	trans	-73.3	-38.7	-178.7	-70.5	-13.7	0	0	0	111.4	E238 E239 A244 W245	E238-N242 WeakPolarHBondContact O-CB 3.31Å; E238-N242 VanDerWaalsContact O-CG 3.3Å; E238-N242 PolarHBondContact O-N 3.09Å; E239-N242 PolarHBondContact O-N 2.83Å; N242-A244 VanDerWaalsContact C-N 3.28Å; N242-A244 PolarHBondContact O-N 3.12Å; N242-W245 WeakPolarHBondContact O-CB 3.33Å; N242-W245 PolarHBondContact O-N 3.37Å
243	S	91.5	Very high	91.7	Very high	48 Å²	48	69.9 Å²	69.9	34%	0.336	35%	0.347	S	S	.	.	H	α-helix	trans	-64.6	-32.3	176.3	66.5	0	0	0	0	112.6	E239 T240 W245 Q246	E239-S243 WeakPolarHBondContact O-CB 3.22Å; E239-S243 PolarHBondContact O-N 2.84Å; E239-S243 PolarHBondContact O-OG 3.34Å; T240-S243 PolarHBondContact O-OG 3.32Å; S243-W245 PolarHBondContact O-N 3.17Å; S243-Q246 WeakPolarHBondContact O-CB 3.34Å; S243-Q246 PolarHBondContact O-N 3.01Å
244	A	89.3	Confident	91.4	Very high	3 Å²	3	69.1 Å²	69.1	3%	0.025	34%	0.34	C	S	.	.	H	α-helix	trans	-59.6	-32.2	174.9	0	0	0	0	0	112.9	R205 T240 N242 Q246 K247 W250	R205-A244 HydrophobicContact CG-CB 4.44Å; T240-A244 PolarHBondContact O-N 3.32Å; N242-A244 VanDerWaalsContact C-N 3.28Å; N242-A244 PolarHBondContact O-N 3.12Å; A244-Q246 PolarHBondContact O-N 3.3Å; A244-K247 WeakPolarHBondContact O-CB 3.39Å; A244-K247 PolarHBondContact O-N 2.86Å; A244-W250 HydrophobicContact CB-CD2 4.42Å; A244-W250 WeakPolarHBondContact O-CB 3.48Å; A244-W250 VanDerWaalsContact O-CG 3.31Å
245	W	89.3	Confident	91.2	Very high	134 Å²	134	73.9 Å²	73.9	51%	0.508	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-17.4	176.6	-73.2	103.4	0	0	0	114.2	R241 N242 S243 K247 W250 D251 V254	R241-W245 VanDerWaalsContact O-CD1 3.24Å; N242-W245 WeakPolarHBondContact O-CB 3.33Å; N242-W245 PolarHBondContact O-N 3.37Å; S243-W245 PolarHBondContact O-N 3.17Å; W245-K247 VanDerWaalsContact C-N 3.28Å; W245-W250 AromaticContact CD2-CD1 3.8Å; W245-W250 AromaticContact CD2-NE1 3.78Å; W245-W250 AromaticContact CE2-NE1 3.84Å; W245-W250 AromaticContact CE3-CD1 3.74Å; W245-D251 HydrophobicContact CE3-CB 4.39Å; W245-D251 HydrophobicContact CZ3-CB 4.18Å; W245-V254 HydrophobicContact CH2-CB 4.22Å; W245-V254 HydrophobicContact CH2-CG1 3.89Å; W245-V254 HydrophobicContact CH2-CG2 4.25Å
246	Q	91.1	Very high	91.1	Very high	171 Å²	171	74.2 Å²	74.2	80%	0.799	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-6.6	174.8	-56.9	-61.3	-30.9	0	0	112.3	S243 A244	S243-Q246 WeakPolarHBondContact O-CB 3.34Å; S243-Q246 PolarHBondContact O-N 3.01Å; A244-Q246 PolarHBondContact O-N 3.3Å
247	K	89.1	Confident	91	Very high	40 Å²	40	73.7 Å²	73.7	17%	0.174	35%	0.348	C	S	.	.	S	Bend	trans	-88	125.8	-179.3	-62.6	-175.4	172.8	-165.1	0	110.6	H204 E207 A244 W245 G249 W250	H204-K247 HydrophobicContact CB-CB 4.45Å; H204-K247 HydrophobicContact CB-CD 3.76Å; H204-K247 WeakPolarHBondContact O-CD 3.39Å; H204-K247 WeakPolarHBondContact O-CE 3.4Å; H204-K247 PolarHBondContact O-NZ 3.35Å; E207-K247 IonicContact OE1-NZ 3.13Å; E207-K247 PolarHBondContact OE1-NZ 2.98Å; E207-K247 IonicContact OE2-NZ 3.39Å; E207-K247 PolarHBondContact OE2-NZ 2.75Å; A244-K247 WeakPolarHBondContact O-CB 3.39Å; A244-K247 PolarHBondContact O-N 2.86Å; W245-K247 VanDerWaalsContact C-N 3.28Å; K247-G249 PolarHBondContact O-N 3.05Å; K247-W250 WeakPolarHBondContact O-CB 3.19Å; K247-W250 PolarHBondContact O-N 3.24Å
248	E	88.9	Confident	91	Very high	186 Å²	186	75.9 Å²	75.9	87%	0.869	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	129.9	178.4	-170.3	-177.6	175.9	0	0	111.5	H204 W250	H204-E248 PolarHBondContact CE1-O 2.81Å; E248-W250 VanDerWaalsContact C-N 3.32Å; E248-W250 PolarHBondContact O-N 3.19Å
249	G	85.9	Confident	91	Very high	21 Å²	21	74.6 Å²	74.6	22%	0.216	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.2	-8.9	177.9	0	0	0	0	0	115	K247 D251 N253	K247-G249 PolarHBondContact O-N 3.05Å; G249-D251 PolarHBondContact N-OD1 3.48Å; G249-N253 PolarHBondContact O-N 3.5Å; G249-N253 PolarHBondContact O-ND2 3.18Å
250	W	88.3	Confident	91.1	Very high	17 Å²	17	70.3 Å²	70.3	6%	0.064	35%	0.346	C	S	.	.	H	α-helix	trans	-62.9	-49.3	172.5	173.6	-103.5	0	0	0	111.3	W198 A201 H204 R205 A244 W245 K247 E248 V252 N253 V254	W198-W250 AromaticContact CH2-CH2 3.77Å; W198-W250 HydrophobicContact CH2-CH2 3.77Å; W198-W250 HydrophobicContact CH2-CZ3 4.41Å; W198-W250 HydrophobicContact CZ3-CH2 4.02Å; W198-W250 HydrophobicContact CZ3-CZ3 4.24Å; A201-W250 HydrophobicContact CB-CE3 4.29Å; A201-W250 HydrophobicContact CB-CZ3 3.99Å; H204-W250 HydrophobicContact CB-CE3 4.19Å; R205-W250 HydrophobicContact CG-CE3 4.34Å; R205-W250 HydrophobicContact CG-CH2 4.05Å; R205-W250 HydrophobicContact CG-CZ3 3.77Å; A244-W250 HydrophobicContact CB-CD2 4.42Å; A244-W250 WeakPolarHBondContact O-CB 3.48Å; A244-W250 VanDerWaalsContact O-CG 3.31Å; W245-W250 AromaticContact CD2-CD1 3.8Å; W245-W250 AromaticContact CD2-NE1 3.78Å; W245-W250 AromaticContact CE2-NE1 3.84Å; W245-W250 AromaticContact CE3-CD1 3.74Å; K247-W250 WeakPolarHBondContact O-CB 3.19Å; K247-W250 PolarHBondContact O-N 3.24Å; E248-W250 VanDerWaalsContact C-N 3.32Å; E248-W250 PolarHBondContact O-N 3.19Å; W250-V252 VanDerWaalsContact C-N 3.33Å; W250-V252 PolarHBondContact O-N 2.84Å; W250-N253 PolarHBondContact O-N 3.36Å; W250-V254 HydrophobicContact CD2-CG2 4.25Å; W250-V254 HydrophobicContact CZ2-CG2 3.9Å; W250-V254 WeakPolarHBondContact O-CG2 3.32Å; W250-V254 PolarHBondContact O-N 3.25Å
251	D	88.9	Confident	91.3	Very high	82 Å²	82	70.7 Å²	70.7	44%	0.439	35%	0.349	S	S	.	.	H	α-helix	trans	-55.6	-44.6	177.7	65.9	-45.6	0	0	0	112.3	W245 G249 N253 V254 Y255	W245-D251 HydrophobicContact CE3-CB 4.39Å; W245-D251 HydrophobicContact CZ3-CB 4.18Å; G249-D251 PolarHBondContact N-OD1 3.48Å; D251-N253 PolarHBondContact O-N 3.46Å; D251-V254 PolarHBondContact O-N 2.84Å; D251-Y255 WeakPolarHBondContact O-CB 3.24Å; D251-Y255 PolarHBondContact O-N 3.08Å
252	V	90.4	Very high	91.6	Very high	69 Å²	69	74.7 Å²	74.7	42%	0.418	36%	0.364	S	S	.	.	H	α-helix	trans	-62.2	-45.2	177.7	179.1	0	0	0	0	110.8	W250 V254 Y255 Y256	W250-V252 VanDerWaalsContact C-N 3.33Å; W250-V252 PolarHBondContact O-N 2.84Å; V252-V254 VanDerWaalsContact C-N 3.34Å; V252-V254 PolarHBondContact O-N 3.1Å; V252-Y255 PolarHBondContact O-N 3.07Å; V252-Y256 HydrophobicContact CG1-CD2 3.82Å; V252-Y256 HydrophobicContact CG1-CE2 3.63Å; V252-Y256 WeakPolarHBondContact O-CD2 3.3Å; V252-Y256 PolarHBondContact O-N 3.39Å
253	N	90.1	Very high	91.9	Very high	19 Å²	19	73.6 Å²	73.6	10%	0.102	36%	0.362	C	S	.	.	H	α-helix	trans	-64.1	-39.4	177.4	-77.4	-66.1	0	0	0	112	R197 A201 G249 W250 D251 Y256 T257	R197-N253 PolarHBondContact O-OD1 3.16Å; A201-N253 HydrophobicContact CB-CB 3.66Å; G249-N253 PolarHBondContact O-N 3.5Å; G249-N253 PolarHBondContact O-ND2 3.18Å; W250-N253 PolarHBondContact O-N 3.36Å; D251-N253 PolarHBondContact O-N 3.46Å; N253-Y256 PolarHBondContact O-N 2.76Å; N253-T257 WeakPolarHBondContact O-CB 3.35Å; N253-T257 VanDerWaalsContact O-CG2 3.28Å; N253-T257 WeakPolarHBondContact O-CG2 3.44Å; N253-T257 PolarHBondContact O-N 3.03Å; N253-T257 VanDerWaalsContact O-N 3.07Å; N253-T257 PolarHBondContact O-OG1 2.81Å
254	V	87.9	Confident	92.1	Very high	32 Å²	32	78 Å²	78	19%	0.194	38%	0.379	C	S	.	.	H	α-helix	trans	-63.5	-48.4	175	175.5	0	0	0	0	110.5	W245 W250 D251 V252 Y256 T257 V258	W245-V254 HydrophobicContact CH2-CB 4.22Å; W245-V254 HydrophobicContact CH2-CG1 3.89Å; W245-V254 HydrophobicContact CH2-CG2 4.25Å; W250-V254 HydrophobicContact CD2-CG2 4.25Å; W250-V254 HydrophobicContact CZ2-CG2 3.9Å; W250-V254 WeakPolarHBondContact O-CG2 3.32Å; W250-V254 PolarHBondContact O-N 3.25Å; D251-V254 PolarHBondContact O-N 2.84Å; V252-V254 VanDerWaalsContact C-N 3.34Å; V252-V254 PolarHBondContact O-N 3.1Å; V254-Y256 PolarHBondContact O-N 3.34Å; V254-T257 WeakPolarHBondContact CA-OG1 3.39Å; V254-T257 PolarHBondContact O-N 3.04Å; V254-T257 VanDerWaalsContact O-N 3.1Å; V254-T257 PolarHBondContact O-OG1 2.62Å; V254-V258 HydrophobicContact CG1-CG2 3.84Å; V254-V258 WeakPolarHBondContact O-CG2 3.4Å; V254-V258 PolarHBondContact O-N 3.4Å
255	Y	91	Very high	92.5	Very high	168 Å²	168	81.7 Å²	81.7	66%	0.659	40%	0.396	S	S	*	.	H	α-helix	trans	-52.2	-42.4	179.1	176.4	-98.2	0	0	0	112.4	D251 V252 P259	D251-Y255 WeakPolarHBondContact O-CB 3.24Å; D251-Y255 PolarHBondContact O-N 3.08Å; V252-Y255 PolarHBondContact O-N 3.07Å; Y255-P259 WeakPolarHBondContact O-CD 3.42Å; Y255-P259 WeakPolarHBondContact O-CG 3.36Å
256	Y	93.3	Very high	92.9	Very high	110 Å²	110	77.8 Å²	77.8	43%	0.431	39%	0.389	S	S	.	.	H	α-helix	trans	-83.8	-22.5	-179.4	-75.3	-66.5	0	0	0	115.2	V252 N253 V254	V252-Y256 HydrophobicContact CG1-CD2 3.82Å; V252-Y256 HydrophobicContact CG1-CE2 3.63Å; V252-Y256 WeakPolarHBondContact O-CD2 3.3Å; V252-Y256 PolarHBondContact O-N 3.39Å; N253-Y256 PolarHBondContact O-N 2.76Å; V254-Y256 PolarHBondContact O-N 3.34Å
257	T	93.3	Very high	93.2	Very high	9 Å²	9	69.9 Å²	69.9	6%	0.055	35%	0.352	C	S	.	.	H	α-helix	trans	-86.2	-34.5	-179.1	49.7	0	0	0	0	112.4	R197 N253 V254 L260	R197-T257 HydrophobicContact CB-CG2 3.51Å; R197-T257 HydrophobicContact CG-CG2 4.31Å; N253-T257 WeakPolarHBondContact O-CB 3.35Å; N253-T257 VanDerWaalsContact O-CG2 3.28Å; N253-T257 WeakPolarHBondContact O-CG2 3.44Å; N253-T257 PolarHBondContact O-N 3.03Å; N253-T257 VanDerWaalsContact O-N 3.07Å; N253-T257 PolarHBondContact O-OG1 2.81Å; V254-T257 WeakPolarHBondContact CA-OG1 3.39Å; V254-T257 PolarHBondContact O-N 3.04Å; V254-T257 VanDerWaalsContact O-N 3.1Å; V254-T257 PolarHBondContact O-OG1 2.62Å; T257-L260 WeakPolarHBondContact O-CB 3.35Å; T257-L260 PolarHBondContact O-N 3.07Å; T257-L260 VanDerWaalsContact O-N 3.07Å
258	V	94	Very high	93.6	Very high	87 Å²	87	68.7 Å²	68.7	53%	0.527	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-55.4	-46.5	-178.9	167.5	0	0	0	0	112.9	V254 L260 V261	V254-V258 HydrophobicContact CG1-CG2 3.84Å; V254-V258 WeakPolarHBondContact O-CG2 3.4Å; V254-V258 PolarHBondContact O-N 3.4Å; V258-L260 PolarHBondContact O-N 3.13Å; V258-L260 VanDerWaalsContact O-N 3.08Å; V258-V261 PolarHBondContact O-N 3.48Å
259	P	96.7	Very high	94.1	Very high	73 Å²	73	59.9 Å²	59.9	47%	0.474	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-63.2	-16.8	179.2	-25	35.6	0	0	0	114.7	K187 Y255	K187-P259 WeakPolarHBondContact CD-O 3.15Å; K187-P259 WeakPolarHBondContact CE-O 3.4Å; K187-P259 PolarHBondContact NZ-O 3.23Å; Y255-P259 WeakPolarHBondContact O-CD 3.42Å; Y255-P259 WeakPolarHBondContact O-CG 3.36Å
260	L	97.1	Very high	94.6	Very high	17 Å²	17	62.8 Å²	62.8	9%	0.089	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-86.8	-10.7	178.8	-51.3	178.9	0	0	0	112.2	K187 T190 E193 W194 T257 V258	K187-L260 WeakPolarHBondContact CG-O 3.49Å; K187-L260 PolarHBondContact N-O 3.21Å; T190-L260 HydrophobicContact CG2-CD2 4.03Å; E193-L260 HydrophobicContact CB-CD1 4.17Å; E193-L260 HydrophobicContact CG-CD1 3.94Å; W194-L260 HydrophobicContact CB-CD1 3.92Å; T257-L260 WeakPolarHBondContact O-CB 3.35Å; T257-L260 PolarHBondContact O-N 3.07Å; T257-L260 VanDerWaalsContact O-N 3.07Å; V258-L260 PolarHBondContact O-N 3.13Å; V258-L260 VanDerWaalsContact O-N 3.08Å
261	V	97.6	Very high	95	Very high	27 Å²	27	62.5 Å²	62.5	16%	0.164	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	136	-179	-177	0	0	0	0	109.8	Y184 L186 V258 S263 M264	Y184-V261 HydrophobicContact CD1-CG1 4.35Å; Y184-V261 HydrophobicContact CD1-CG2 4.27Å; L186-V261 HydrophobicContact CD2-CG2 3.8Å; V258-V261 PolarHBondContact O-N 3.48Å; V261-S263 WeakPolarHBondContact CG1-O 3.49Å; V261-M264 HydrophobicContact CG1-CB 4.25Å
262	R	97.4	Very high	95.2	Very high	172 Å²	172	59.4 Å²	59.4	65%	0.649	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	-45.6	171.4	-69.4	-178.6	164.8	-177	-5.1	111.4	K185 K187	K185-R262 WeakPolarHBondContact O-CB 3Å; K185-R262 PolarHBondContact O-N 3.4Å; K187-R262 HydrophobicContact CB-CG 4.48Å; K187-R262 HydrophobicContact CG-CG 3.66Å
263	S	97.8	Very high	95.2	Very high	60 Å²	60	66.4 Å²	66.4	42%	0.42	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	156.4	174.1	62.5	0	0	0	0	110	K185 V261	K185-S263 PolarHBondContact N-O 3.45Å; K185-S263 PolarHBondContact O-N 2.97Å; V261-S263 WeakPolarHBondContact CG1-O 3.49Å
264	M	96.9	Very high	95.1	Very high	140 Å²	140	67.3 Å²	67.3	69%	0.69	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.9	148.1	175	60.8	-177.9	174.8	0	0	110	T183 Y184 V261	T183-M264 CarbonylContact O-C 3.55Å; T183-M264 VanDerWaalsContact O-CA 3.24Å; T183-M264 WeakPolarHBondContact O-CA 3.46Å; Y184-M264 HydrophobicContact CD1-CB 3.73Å; Y184-M264 HydrophobicContact CE1-CB 4.05Å; Y184-M264 HydrophobicContact CE1-SD 4.19Å; V261-M264 HydrophobicContact CG1-CB 4.25Å
265	E	97.3	Very high	95.3	Very high	81 Å²	81	66.1 Å²	66.1	38%	0.379	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	141	178.6	-171.3	-173.3	152	0	0	108.3	R182 T183 R267	R182-E265 CarbonylContact C-O 3.5Å; R182-E265 VanDerWaalsContact CA-O 3.29Å; R182-E265 WeakPolarHBondContact CA-O 3.45Å; T183-E265 PolarHBondContact N-O 2.89Å; T183-E265 PolarHBondContact O-N 2.84Å; E265-R267 IonicContact OE1-CZ 3.56Å; E265-R267 IonicContact OE1-NH1 3.15Å; E265-R267 PolarHBondContact OE1-NH1 2.94Å; E265-R267 IonicContact OE1-NH2 2.93Å; E265-R267 PolarHBondContact OE1-NH2 3.32Å
266	S	97.6	Very high	95.2	Very high	52 Å²	52	59.8 Å²	59.8	36%	0.364	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	134.5	170.8	171.2	0	0	0	0	108.7	E180	E180-S266 WeakPolarHBondContact CG-OG 3.49Å; E180-S266 PolarHBondContact OE1-OG 3.16Å
267	R	97.9	Very high	94.8	Very high	6 Å²	6	54.6 Å²	54.6	2%	0.023	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	126.4	179.5	-179.1	-175.1	-89.4	78.5	10.1	109.5	T108 Y110 E180 L181 E265 M269	T108-R267 HydrophobicContact CG2-CG 3.41Å; T108-R267 VanDerWaalsContact CG2-CG 3.41Å; T108-R267 WeakPolarHBondContact OG1-CD 3.46Å; T108-R267 PolarHBondContact OG1-NE 2.72Å; Y110-R267 WeakPolarHBondContact O-CA 3.41Å; E180-R267 CarbonylContact C-O 3.6Å; E180-R267 VanDerWaalsContact CA-O 3.27Å; E180-R267 WeakPolarHBondContact CA-O 3.35Å; L181-R267 PolarHBondContact N-O 3.22Å; L181-R267 PolarHBondContact O-N 3.37Å; E265-R267 IonicContact OE1-CZ 3.56Å; E265-R267 IonicContact OE1-NH1 3.15Å; E265-R267 PolarHBondContact OE1-NH1 2.94Å; E265-R267 IonicContact OE1-NH2 2.93Å; E265-R267 PolarHBondContact OE1-NH2 3.32Å; R267-M269 HydrophobicContact CB-CG 4.48Å; R267-M269 HydrophobicContact CG-CG 3.66Å; R267-M269 HydrophobicContact CG-SD 4.21Å
268	L	98.3	Very high	93.9	Very high	15 Å²	15	59.1 Å²	59.1	8%	0.079	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	132	170.3	-70.4	170.2	0	0	0	109.2	W109 Y110 L178 Y179 E180 L234	W109-L268 PolarHBondContact N-O 2.81Å; Y110-L268 HydrophobicContact CD2-CB 4.12Å; Y110-L268 HydrophobicContact CD2-CD1 3.73Å; Y110-L268 HydrophobicContact CG-CD1 4.32Å; Y110-L268 PolarHBondContact N-O 3.12Å; Y110-L268 PolarHBondContact O-N 2.7Å; L178-L268 HydrophobicContact CD2-CD2 3.98Å; L178-L268 HydrophobicContact CG-CD2 4.26Å; Y179-L268 CarbonylContact O-C 3.56Å; Y179-L268 WeakPolarHBondContact O-CA 3.43Å; E180-L268 HydrophobicContact CB-CD2 3.93Å; E180-L268 HydrophobicContact CG-CD2 4.13Å; L234-L268 HydrophobicContact CD2-CD1 3.45Å; L234-L268 VanDerWaalsContact CD2-CD1 3.45Å; L234-L268 HydrophobicContact CD2-CD2 4.45Å
269	M	98.1	Very high	93.8	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	141.9	-170.9	-46.8	-179	-56.3	0	0	110.5	W106 N107 V117 Y179 L181 L228 R267	W106-M269 HydrophobicContact CB-CB 3.64Å; W106-M269 HydrophobicContact CB-CE 4.29Å; W106-M269 HydrophobicContact CB-CG 4.49Å; W106-M269 HydrophobicContact CB-SD 4.28Å; W106-M269 HydrophobicContact CD2-CE 3.99Å; W106-M269 HydrophobicContact CE3-CE 4.23Å; W106-M269 HydrophobicContact CG-CB 4.08Å; W106-M269 HydrophobicContact CG-CE 4.01Å; N107-M269 CarbonylContact O-C 3.56Å; N107-M269 WeakPolarHBondContact O-CA 3.34Å; V117-M269 HydrophobicContact CB-SD 3.9Å; V117-M269 HydrophobicContact CG1-SD 4.23Å; V117-M269 HydrophobicContact CG2-SD 3.75Å; Y179-M269 PolarHBondContact N-O 2.86Å; Y179-M269 PolarHBondContact O-N 3.27Å; L181-M269 HydrophobicContact CB-CE 3.66Å; L181-M269 HydrophobicContact CB-SD 3.92Å; L181-M269 HydrophobicContact CD2-SD 4.35Å; L228-M269 HydrophobicContact CD1-CE 3.84Å; R267-M269 HydrophobicContact CB-CG 4.48Å; R267-M269 HydrophobicContact CG-CG 3.66Å; R267-M269 HydrophobicContact CG-SD 4.21Å
270	I	96.8	Very high	93.7	Very high	82 Å²	82	56.9 Å²	56.9	42%	0.421	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	126.8	176.2	-60.3	172.4	0	0	0	107.3	W106 N107 W109 L178	W106-I270 CarbonylContact C-O 3.52Å; W106-I270 VanDerWaalsContact CA-O 3.25Å; W106-I270 WeakPolarHBondContact CA-O 3.49Å; W106-I270 WeakPolarHBondContact CB-O 3.33Å; N107-I270 PolarHBondContact N-O 3.06Å; N107-I270 PolarHBondContact O-N 3.41Å; W109-I270 HydrophobicContact CB-CD1 3.99Å; W109-I270 HydrophobicContact CB-CG1 4.13Å; W109-I270 HydrophobicContact CD2-CD1 3.93Å; W109-I270 HydrophobicContact CE3-CD1 4.13Å; W109-I270 HydrophobicContact CE3-CG1 4.44Å; W109-I270 HydrophobicContact CG-CD1 3.88Å; W109-I270 HydrophobicContact CG-CG1 4.48Å; L178-I270 HydrophobicContact CD1-CG1 4.36Å
271	P	96.1	Very high	93.5	Very high	11 Å²	11	59.1 Å²	59.1	7%	0.071	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	142.5	178.3	26.4	-32.1	0	0	0	110.4	S105 N177 Y179 Q278	S105-P271 WeakPolarHBondContact O-CA 3.41Å; N177-P271 WeakPolarHBondContact O-CD 3.3Å; N177-P271 WeakPolarHBondContact O-CG 3.42Å; Y179-P271 HydrophobicContact CD2-CB 4.46Å; Y179-P271 HydrophobicContact CD2-CG 4.24Å; Y179-P271 HydrophobicContact CE2-CB 4.31Å; Y179-P271 HydrophobicContact CE2-CG 4.1Å; P271-Q278 HydrophobicContact CB-CB 4.42Å; P271-Q278 HydrophobicContact CG-CB 4.45Å; P271-Q278 VanDerWaalsContact CG-OE1 3.31Å
272	T	94.6	Very high	93.3	Very high	16 Å²	16	61 Å²	61	10%	0.098	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-72.3	155.9	170.4	63.2	0	0	0	0	109.6	S105 S274 S275 Q278	S105-T272 VanDerWaalsContact CB-OG1 3.31Å; S105-T272 WeakPolarHBondContact CB-OG1 3.28Å; S105-T272 PolarHBondContact O-N 3.42Å; S105-T272 PolarHBondContact O-OG1 3.43Å; S105-T272 PolarHBondContact OG-OG1 3.17Å; T272-S274 PolarHBondContact O-N 2.75Å; T272-S275 WeakPolarHBondContact O-CB 3.16Å; T272-S275 PolarHBondContact O-N 2.86Å; T272-Q278 PolarHBondContact O-OE1 3.47Å
273	K	89.6	Confident	93	Very high	216 Å²	216	54.1 Å²	54.1	94%	0.939	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-25.7	-176.7	-66.2	-179.8	-179.6	174.7	0	114.2
274	S	87.1	Confident	92.7	Very high	39 Å²	39	53.7 Å²	53.7	27%	0.273	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	2.2	179.5	56.5	0	0	0	0	113.8	A86 T272 P276	A86-S274 VanDerWaalsContact CB-OG 3.25Å; A86-S274 WeakPolarHBondContact CB-OG 3.23Å; T272-S274 PolarHBondContact O-N 2.75Å; S274-P276 WeakPolarHBondContact O-CD 3.41Å
275	S	92.2	Very high	92.4	Very high	6 Å²	6	47.5 Å²	47.5	4%	0.042	24%	0.244	C	C	.	.			trans	-67.2	125.9	-179.8	-172.7	0	0	0	0	110.3	G104 S105 T272 L277 Q278	G104-S275 WeakPolarHBondContact CA-OG 3.37Å; S105-S275 PolarHBondContact N-OG 3.29Å; S105-S275 VanDerWaalsContact O-CB 3.29Å; S105-S275 WeakPolarHBondContact O-CB 3.45Å; S105-S275 PolarHBondContact O-OG 3Å; T272-S275 WeakPolarHBondContact O-CB 3.16Å; T272-S275 PolarHBondContact O-N 2.86Å; S275-L277 PolarHBondContact O-N 3.2Å; S275-L277 VanDerWaalsContact O-N 3.12Å; S275-Q278 PolarHBondContact O-N 3.42Å
276	P	88.8	Confident	92	Very high	35 Å²	35	44.9 Å²	44.9	23%	0.227	23%	0.233	C	C	.	.	S	Bend	trans	-64.1	-14.9	176.7	-28	39.9	0	0	0	114.4	V102 P172 S274 Q278	V102-P276 HydrophobicContact CB-CG 4.36Å; V102-P276 HydrophobicContact CG1-CG 4.32Å; V102-P276 WeakPolarHBondContact O-CG 3.44Å; P172-P276 WeakPolarHBondContact CA-O 3.3Å; P172-P276 WeakPolarHBondContact CB-O 3.2Å; S274-P276 WeakPolarHBondContact O-CD 3.41Å; P276-Q278 PolarHBondContact O-N 3.43Å
277	L	86.3	Confident	91.6	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.01	22%	0.222	C	C	.	.			trans	-89.7	46.9	173.5	-79	172.2	0	0	0	111.2	V103 W106 L171 R173 Y179 V212 L228 S275	V103-L277 HydrophobicContact CG1-CD1 3.96Å; V103-L277 VanDerWaalsContact O-CD1 3.31Å; V103-L277 WeakPolarHBondContact O-CD1 3.13Å; V103-L277 WeakPolarHBondContact O-CG 3.49Å; W106-L277 HydrophobicContact CH2-CD1 3.81Å; W106-L277 HydrophobicContact CZ2-CB 4.18Å; W106-L277 HydrophobicContact CZ2-CD1 3.51Å; W106-L277 HydrophobicContact CZ2-CG 4.47Å; L171-L277 WeakPolarHBondContact O-CD2 3.49Å; R173-L277 HydrophobicContact CG-CD2 4.28Å; Y179-L277 HydrophobicContact CE1-CB 4.25Å; Y179-L277 HydrophobicContact CE1-CD1 4.38Å; Y179-L277 WeakPolarHBondContact CE2-O 3.04Å; Y179-L277 PolarHBondContact OH-O 2.91Å; V212-L277 HydrophobicContact CG1-CD1 4.11Å; V212-L277 HydrophobicContact CG1-CD2 4.21Å; L228-L277 HydrophobicContact CD2-CD1 4.35Å; S275-L277 PolarHBondContact O-N 3.2Å; S275-L277 VanDerWaalsContact O-N 3.12Å
278	Q	72.9	Confident	91	Very high	103 Å²	103	47.8 Å²	47.8	48%	0.481	24%	0.241	S	C	.	.			trans	-150.7	0	173.8	-175.2	163.7	-1.4	0	0	112.2	R173 G175 P271 T272 S275 P276	R173-Q278 CarbonylContact O-C 3.53Å; R173-Q278 WeakPolarHBondContact O-CA 3.5Å; R173-Q278 PolarHBondContact O-N 2.82Å; R173-Q278 VanDerWaalsContact O-OXT 3.06Å; G175-Q278 WeakPolarHBondContact CA-OXT 3.41Å; G175-Q278 PolarHBondContact N-OXT 2.95Å; P271-Q278 HydrophobicContact CB-CB 4.42Å; P271-Q278 HydrophobicContact CG-CB 4.45Å; P271-Q278 VanDerWaalsContact CG-OE1 3.31Å; T272-Q278 PolarHBondContact O-OE1 3.47Å; S275-Q278 PolarHBondContact O-N 3.42Å; P276-Q278 PolarHBondContact O-N 3.43Å

Retrieved 278 of 278 residues in 83.2 ms (Link to these results)

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