A0A087XYC3_POEFO Loading...

Nipsnap homolog 2

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 A0A087XYC3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 276 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	33.9	Very low	32	Very low	251 Å²	251	162.4 Å²	162.4	100%	1.236	87%	0.871	S	S	*	*				0	118.2	0	-67.2	-164.4	-92.2	0	0	106.7
2	A	33.9	Very low	31.6	Very low	105 Å²	105	154.7 Å²	154.7	87%	0.868	86%	0.859	S	S	*	*			cis	-145.4	146	11.4	0	0	0	0	0	109.1
3	S	26.8	Very low	31.6	Very low	109 Å²	109	155.5 Å²	155.5	76%	0.762	86%	0.859	S	S	*	*			trans	-104.1	137	172	-175.5	0	0	0	0	108.2
4	R	33.1	Very low	31.4	Very low	254 Å²	254	156.7 Å²	156.7	96%	0.958	86%	0.855	S	S	*	*			trans	-137	108	164.8	-91.2	-169.1	176.4	-166.6	-0.5	110.7
5	V	32.6	Very low	31.3	Very low	115 Å²	115	162.1 Å²	162.1	70%	0.697	86%	0.858	S	S	*	*			trans	-73.5	144	159.7	170.5	0	0	0	0	108.6
6	L	33.9	Very low	31.2	Very low	171 Å²	171	164.3 Å²	164.3	90%	0.895	85%	0.851	S	S	*	*			trans	-151.1	137.5	146.8	-104.8	167.1	0	0	0	111
7	Q	32.2	Very low	31.1	Very low	168 Å²	168	167.4 Å²	167.4	79%	0.785	85%	0.849	S	S	*	*			trans	-83.2	159	-161.9	-73.2	158	-62.6	0	0	114.3
8	R	30.5	Very low	31.1	Very low	244 Å²	244	163.7 Å²	163.7	92%	0.921	85%	0.848	S	S	*	*			trans	-65.4	145.4	163.4	-71.2	175.7	168.3	-160.1	-3.9	111.5
9	V	32.3	Very low	30.9	Very low	139 Å²	139	158.5 Å²	158.5	84%	0.842	84%	0.838	S	S	*	*			trans	-121.9	125.8	156.3	176.4	0	0	0	0	107.7
10	A	30.1	Very low	31	Very low	96 Å²	96	159.7 Å²	159.7	79%	0.793	84%	0.844	S	S	*	*			trans	-112.7	135.2	172.9	0	0	0	0	0	108.4
11	T	33	Very low	31.1	Very low	134 Å²	134	161.3 Å²	161.3	82%	0.822	85%	0.847	S	S	*	*			trans	-135.6	113.8	165.6	40.9	0	0	0	0	107.6
12	G	27.3	Very low	31	Very low	70 Å²	70	154.1 Å²	154.1	72%	0.722	83%	0.827	S	S	*	*			trans	-87.9	158.9	169.4	0	0	0	0	0	111.2
13	L	31.9	Very low	30.8	Very low	166 Å²	166	157.1 Å²	157.1	87%	0.869	83%	0.829	S	S	*	*			trans	-145.6	122.9	153	-120.6	108.8	0	0	0	109.4
14	H	28.6	Very low	31.2	Very low	172 Å²	172	158.3 Å²	158.3	80%	0.796	83%	0.831	S	S	*	*			trans	-80.4	144	172.1	-100.2	-60.4	0	0	0	110.7
15	W	29.4	Very low	31.3	Very low	237 Å²	237	152.4 Å²	152.4	90%	0.898	83%	0.826	S	S	*	*			trans	-140	130.1	143.1	-86.8	94.9	0	0	0	110.8
16	R	29.3	Very low	31.3	Very low	198 Å²	198	151 Å²	151	75%	0.747	83%	0.827	S	S	*	*			trans	-78.4	167.8	166.4	-65.1	177	167.5	-156.6	-4.4	108.1
17	R	29.6	Very low	31.5	Very low	217 Å²	217	148.1 Å²	148.1	82%	0.819	83%	0.827	S	S	*	*			cis	-175.2	166.3	30.3	-145.9	172.1	-167.6	-170.9	2	109.7
18	A	30.8	Very low	31.6	Very low	100 Å²	100	147.3 Å²	147.3	83%	0.826	83%	0.827	S	S	*	*			trans	79.8	131.8	156.3	0	0	0	0	0	116.7
19	G	28.8	Very low	31.6	Very low	65 Å²	65	141.8 Å²	141.8	67%	0.67	82%	0.82	S	S	*	*			cis	129	109.8	10	0	0	0	0	0	108.5
20	L	32.2	Very low	31.6	Very low	182 Å²	182	140.2 Å²	140.2	95%	0.953	82%	0.822	S	S	*	*			trans	179.6	126.6	154.6	-99.6	148.3	0	0	0	110.4
21	Q	32	Very low	31.7	Very low	195 Å²	195	147.1 Å²	147.1	91%	0.911	83%	0.827	S	S	*	*			trans	-81.2	141.7	170.8	-77.9	169.9	-40.5	0	0	110.4
22	A	32.6	Very low	31.8	Very low	99 Å²	99	143.7 Å²	143.7	82%	0.818	82%	0.819	S	S	*	*			trans	-152.2	122.6	151.8	0	0	0	0	0	109.8
23	N	30.8	Very low	32.2	Very low	168 Å²	168	150.6 Å²	150.6	90%	0.898	83%	0.829	S	S	*	*			trans	-88	124.3	171.4	-97.9	-15.9	0	0	0	109.5
24	V	34.5	Very low	32.3	Very low	135 Å²	135	147.3 Å²	147.3	82%	0.818	82%	0.82	S	S	*	*			trans	-151.7	134.3	151.2	-170.5	0	0	0	0	108.1
25	P	36	Very low	32.6	Very low	129 Å²	129	142.7 Å²	142.7	84%	0.838	82%	0.819	S	S	*	*			trans	-87.5	133.1	-174	34	-30.5	0	0	0	111.3
26	A	31.9	Very low	33.3	Very low	87 Å²	87	138.5 Å²	138.5	72%	0.719	81%	0.813	S	S	*	*			trans	-136	113	166.6	0	0	0	0	0	109.1	I28	A26-I28 PolarHBondContact O-N 3.33Å
27	A	36.8	Very low	33.9	Very low	109 Å²	109	138.2 Å²	138.2	90%	0.901	82%	0.818	S	S	*	*			trans	-59	119.8	173.3	0	0	0	0	0	109.9
28	I	34.3	Very low	34.3	Very low	152 Å²	152	132 Å²	132	78%	0.779	81%	0.808	S	S	*	*			trans	-128.9	125.4	166.1	-61.1	179.6	0	0	0	107.8	A26 A30	A26-I28 PolarHBondContact O-N 3.33Å; I28-A30 PolarHBondContact O-N 3.31Å
29	T	30.9	Very low	35.1	Very low	127 Å²	127	134.2 Å²	134.2	78%	0.779	81%	0.805	S	S	*	*			trans	-53.1	121.5	-176.1	35.2	0	0	0	0	113	R31	T29-R31 PolarHBondContact O-N 2.83Å
30	A	32.7	Very low	35.8	Very low	106 Å²	106	140 Å²	140	88%	0.876	81%	0.812	S	S	*	*			trans	-68.1	101.2	170.2	0	0	0	0	0	109.9	I28	I28-A30 PolarHBondContact O-N 3.31Å
31	R	33.1	Very low	36.5	Very low	242 Å²	242	137 Å²	137	91%	0.913	80%	0.8	S	S	*	*			trans	-75.6	121.7	160.7	-81.8	-175.8	173.1	-166.6	-1.3	108.3	T29	T29-R31 PolarHBondContact O-N 2.83Å
32	G	34.5	Very low	36.9	Very low	62 Å²	62	138.4 Å²	138.4	64%	0.639	80%	0.797	S	S	*	*			trans	-70.9	156.5	-170.1	0	0	0	0	0	115.4
33	F	34.6	Very low	37.5	Very low	214 Å²	214	142.9 Å²	142.9	94%	0.939	80%	0.799	S	S	*	*			trans	-134	84.8	142.8	-91.5	-85.2	0	0	0	107.2	G35	F33-G35 PolarHBondContact O-N 2.98Å
34	S	35	Very low	38.4	Very low	97 Å²	97	140.5 Å²	140.5	68%	0.678	79%	0.79	S	S	*	*			trans	-78.5	93.7	161.3	-177.8	0	0	0	0	107.1	L36	S34-L36 PolarHBondContact O-N 2.95Å
35	G	35.2	Very low	38.8	Very low	76 Å²	76	140.6 Å²	140.6	78%	0.784	79%	0.786	S	S	*	*			trans	-72.5	73.9	170.6	0	0	0	0	0	110.1	F33 K37	F33-G35 PolarHBondContact O-N 2.98Å; G35-K37 PolarHBondContact O-N 3.1Å; G35-K37 VanDerWaalsContact O-N 3.17Å
36	L	43	Very low	39.5	Very low	148 Å²	148	139.6 Å²	139.6	78%	0.775	78%	0.779	S	S	*	*			trans	-62.5	113.9	172.5	-79.8	160.6	0	0	0	109.1	S34 S38	S34-L36 PolarHBondContact O-N 2.95Å; L36-S38 PolarHBondContact O-N 2.94Å
37	K	43.1	Very low	40.6	Very low	192 Å²	192	143.6 Å²	143.6	84%	0.835	78%	0.776	S	S	*	*			trans	-54.9	104.8	163	-67.8	179.4	178.3	-178.3	0	108.1	G35 L39	G35-K37 PolarHBondContact O-N 3.1Å; G35-K37 VanDerWaalsContact O-N 3.17Å; K37-L39 VanDerWaalsContact C-N 3.29Å; K37-L39 PolarHBondContact O-N 3.05Å
38	S	38.3	Very low	41.5	Very low	87 Å²	87	147.9 Å²	147.9	61%	0.608	77%	0.774	S	S	*	*			trans	-73.8	89.7	169.1	-175.4	0	0	0	0	108.8	L36 F40	L36-S38 PolarHBondContact O-N 2.94Å; S38-F40 PolarHBondContact O-N 3.26Å; S38-F40 VanDerWaalsContact O-N 3.08Å; S38-F40 WeakPolarHBondContact OG-CD2 3.15Å; S38-F40 WeakPolarHBondContact OG-CE2 3.48Å
39	L	47.8	Very low	42.4	Very low	147 Å²	147	145.3 Å²	145.3	77%	0.77	76%	0.762	S	S	*	*			trans	-74.5	74	162.3	-73	165.2	0	0	0	108	K37 V41	K37-L39 VanDerWaalsContact C-N 3.29Å; K37-L39 PolarHBondContact O-N 3.05Å; L39-V41 PolarHBondContact O-N 3.34Å
40	F	42.2	Very low	43.7	Very low	186 Å²	186	141.6 Å²	141.6	82%	0.816	74%	0.744	S	S	*	*			trans	-72.7	79.4	155.4	-77.2	-69.6	0	0	0	107.3	S38 R42	S38-F40 PolarHBondContact O-N 3.26Å; S38-F40 VanDerWaalsContact O-N 3.08Å; S38-F40 WeakPolarHBondContact OG-CD2 3.15Å; S38-F40 WeakPolarHBondContact OG-CE2 3.48Å; F40-R42 VanDerWaalsContact C-N 3.26Å; F40-R42 PolarHBondContact O-N 3.03Å
41	V	47.3	Very low	45	Very low	118 Å²	118	141.3 Å²	141.3	72%	0.715	72%	0.724	S	S	*	*			trans	-60.2	101.9	156.2	177.6	0	0	0	0	104.5	L39 K43	L39-V41 PolarHBondContact O-N 3.34Å; V41-K43 PolarHBondContact O-N 3.43Å
42	R	41.2	Very low	46.5	Very low	225 Å²	225	130.7 Å²	130.7	85%	0.849	69%	0.687	S	S	*	*			trans	-51.3	111.4	170.6	-162.5	175.7	-177.1	177.8	0.9	105.5	F40 V44	F40-R42 VanDerWaalsContact C-N 3.26Å; F40-R42 PolarHBondContact O-N 3.03Å; R42-V44 PolarHBondContact O-N 3.07Å
43	K	44	Very low	48	Very low	194 Å²	194	132.2 Å²	132.2	84%	0.843	68%	0.678	S	S	*	*			trans	-56.1	107.4	173.9	-85.5	-177.9	175.7	178.4	0	105.6	V41 D45	V41-K43 PolarHBondContact O-N 3.43Å; K43-D45 PolarHBondContact O-N 2.83Å
44	V	49.6	Very low	49.7	Very low	118 Å²	118	126.8 Å²	126.8	72%	0.715	66%	0.657	S	S	*	*			trans	-70.2	111.9	172.3	177.7	0	0	0	0	104.3	R42	R42-V44 PolarHBondContact O-N 3.07Å
45	D	44	Very low	51.6	Low	136 Å²	136	122.5 Å²	122.5	73%	0.727	63%	0.627	S	S	*	*			trans	-53.4	128.6	169.9	-75.8	-43.6	0	0	0	107.8	K43 R47	K43-D45 PolarHBondContact O-N 2.83Å; D45-R47 PolarHBondContact O-N 2.61Å
46	P	50.5	Low	53.7	Low	108 Å²	108	119.7 Å²	119.7	70%	0.701	60%	0.595	S	S	*	*			trans	-61.2	107.8	-177.2	21.3	-29.3	0	0	0	108.5	K48	P46-K48 PolarHBondContact O-N 3.01Å
47	R	55.1	Low	55.2	Low	172 Å²	172	115.1 Å²	115.1	65%	0.649	57%	0.569	S	S	*	*			trans	-61.1	119.5	170.6	-68.5	-178.8	-177.1	170.1	-1.7	107	D45	D45-R47 PolarHBondContact O-N 2.61Å
48	K	55.3	Low	56.3	Low	198 Å²	198	111.9 Å²	111.9	86%	0.861	56%	0.555	S	S	*	*			trans	-83	-15.4	-177.6	-64.5	-174.9	-179.7	179.1	0	113	P46	P46-K48 PolarHBondContact O-N 3.01Å
49	D	52.6	Low	57.3	Low	98 Å²	98	116.6 Å²	116.6	52%	0.524	57%	0.568	S	S	.	*	S	Bend	trans	-98.2	137.7	-179.5	-63.1	-45.9	0	0	0	112.2
50	A	59.4	Low	58.1	Low	49 Å²	49	112.7 Å²	112.7	41%	0.405	55%	0.547	S	S	.	.			trans	-61.1	137.7	172.7	0	0	0	0	0	110.5	S52 H53	A50-S52 PolarHBondContact O-N 3.12Å; A50-H53 WeakPolarHBondContact O-CB 3.22Å; A50-H53 PolarHBondContact O-N 3.11Å
51	H	60.1	Low	59.9	Low	101 Å²	101	109 Å²	109	47%	0.468	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-28.3	-177.9	-68.6	153.1	0	0	0	114	I190	H51-I190 HydrophobicContact CB-CD1 4.14Å
52	S	63	Low	62	Low	18 Å²	18	103.5 Å²	103.5	13%	0.126	50%	0.503	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-35.5	175.6	45.2	0	0	0	0	113.1	A50 L54 L55 S56 Q216	A50-S52 PolarHBondContact O-N 3.12Å; S52-L54 PolarHBondContact O-N 3.17Å; S52-L55 PolarHBondContact O-N 2.8Å; S52-L55 VanDerWaalsContact O-N 3.14Å; S52-S56 PolarHBondContact O-N 3.34Å; S52-S56 PolarHBondContact O-OG 3.05Å; S52-S56 VanDerWaalsContact O-OG 3.09Å; S52-Q216 PolarHBondContact OG-OE1 2.73Å
53	H	67.1	Low	64.5	Low	95 Å²	95	92.9 Å²	92.9	44%	0.44	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-22.8	-175.4	-74.7	-149.9	0	0	0	113.5	A50 K58	A50-H53 WeakPolarHBondContact O-CB 3.22Å; A50-H53 PolarHBondContact O-N 3.11Å; H53-K58 WeakPolarHBondContact O-CE 3.49Å
54	L	69.9	Low	67.1	Low	99 Å²	99	83.7 Å²	83.7	52%	0.518	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-23.1	177.7	-66.2	173.9	0	0	0	112.3	S52 I190	S52-L54 PolarHBondContact O-N 3.17Å; L54-I190 HydrophobicContact CD1-CD1 4.2Å
55	L	75.2	Confident	69.4	Low	7 Å²	7	79 Å²	79	4%	0.037	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-18.8	-172.1	-64.9	174	0	0	0	113	S52 F162 S163 M189 I190 F214	S52-L55 PolarHBondContact O-N 2.8Å; S52-L55 VanDerWaalsContact O-N 3.14Å; L55-F162 HydrophobicContact CB-CD1 4.17Å; L55-F162 HydrophobicContact CB-CE1 4.35Å; L55-F162 HydrophobicContact CD1-CE1 4.32Å; L55-F162 CarbonylContact O-C 3.49Å; L55-F162 WeakPolarHBondContact O-CA 3.46Å; L55-S163 PolarHBondContact O-N 3.02Å; L55-S163 PolarHBondContact O-OG 2.89Å; L55-M189 HydrophobicContact CD1-CG 3.66Å; L55-I190 HydrophobicContact CD1-CG1 4.13Å; L55-F214 HydrophobicContact CB-CE1 3.99Å; L55-F214 HydrophobicContact CB-CZ 3.96Å
56	S	78.9	Confident	72	Confident	17 Å²	17	72.8 Å²	72.8	12%	0.119	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-93.7	148.5	-176.4	61	0	0	0	0	114.1	S52 K58 E161	S52-S56 PolarHBondContact O-N 3.34Å; S52-S56 PolarHBondContact O-OG 3.05Å; S52-S56 VanDerWaalsContact O-OG 3.09Å; S56-K58 PolarHBondContact O-N 3.07Å; S56-E161 VanDerWaalsContact CA-O 3.32Å; S56-E161 WeakPolarHBondContact CA-O 3.5Å
57	K	73.6	Confident	74.3	Confident	53 Å²	53	68.6 Å²	68.6	23%	0.23	33%	0.331	C	S	.	.			trans	-62.2	118.4	163.1	-64.7	-170.5	-176.2	174.5	0	109.4	E161 S163 W165	K57-E161 HydrophobicContact CB-CG 4.3Å; K57-E161 HydrophobicContact CD-CG 4.3Å; K57-E161 HydrophobicContact CG-CG 4.2Å; K57-S163 WeakPolarHBondContact CE-O 3.39Å; K57-W165 WeakPolarHBondContact CE-O 3.28Å; K57-W165 PolarHBondContact NZ-O 2.82Å
58	K	66.1	Low	76.3	Confident	124 Å²	124	60.6 Å²	60.6	54%	0.539	30%	0.301	S	S	.	.	S	Bend	trans	-84.6	-24.8	-179.9	-70.9	-175.5	180	176.3	0	113.1	H53 S56 D60	H53-K58 WeakPolarHBondContact O-CE 3.49Å; S56-K58 PolarHBondContact O-N 3.07Å; K58-D60 PolarHBondContact O-N 3.35Å
59	E	60.9	Low	78.4	Confident	186 Å²	186	51.3 Å²	51.3	87%	0.869	26%	0.26	S	S	*	.	S	Bend	trans	-71.8	-34.2	-166.6	-67.4	170.2	-169.4	0	0	112.1
60	D	64.2	Low	80.6	Confident	64 Å²	64	48.6 Å²	48.6	34%	0.342	25%	0.246	S	C	.	.	S	Bend	trans	-98.8	-10.8	-173	-57.5	-55.1	0	0	0	114.5	K58 N62	K58-D60 PolarHBondContact O-N 3.35Å; D60-N62 VanDerWaalsContact CB-ND2 3.32Å; D60-N62 WeakPolarHBondContact CB-ND2 3.49Å; D60-N62 PolarHBondContact O-N 3.33Å
61	N	79.9	Confident	82.5	Confident	108 Å²	108	46.3 Å²	46.3	58%	0.578	23%	0.227	S	C	*	.			trans	45.2	36.4	-173.7	-73.3	-43.9	0	0	0	113.2	L63 G123	N61-L63 PolarHBondContact O-N 3.3Å; N61-G123 WeakPolarHBondContact O-CA 3.46Å; N61-G123 PolarHBondContact O-N 3.37Å
62	N	90.4	Very high	84.3	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.021	22%	0.218	C	C	.	.			trans	-71.3	120.4	-178.8	-71.8	-34.6	0	0	0	110.2	D60 Y64 E161 E167	D60-N62 VanDerWaalsContact CB-ND2 3.32Å; D60-N62 WeakPolarHBondContact CB-ND2 3.49Å; D60-N62 PolarHBondContact O-N 3.33Å; N62-Y64 HydrophobicContact CB-CD2 4.34Å; N62-Y64 HydrophobicContact CB-CE2 3.66Å; N62-E161 PolarHBondContact ND2-OE1 3.17Å; N62-E167 PolarHBondContact ND2-OE1 2.92Å
63	L	95.5	Very high	86	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	127.6	166.2	-177.1	71.5	0	0	0	108.8	N61 Y120 Y124 L127 L158 L160	N61-L63 PolarHBondContact O-N 3.3Å; L63-Y120 PolarHBondContact N-O 3.05Å; L63-Y120 VanDerWaalsContact N-O 3.08Å; L63-Y120 PolarHBondContact O-N 2.93Å; L63-Y124 HydrophobicContact CD1-CE1 4.18Å; L63-Y124 HydrophobicContact CD2-CD1 3.64Å; L63-Y124 HydrophobicContact CD2-CE1 3.91Å; L63-Y124 HydrophobicContact CD2-CG 4.06Å; L63-L127 HydrophobicContact CD2-CB 4.11Å; L63-L127 HydrophobicContact CD2-CD2 3.71Å; L63-L158 HydrophobicContact CD1-CB 4.23Å; L63-L158 HydrophobicContact CD2-CD1 4.4Å; L63-L158 HydrophobicContact CD2-CD2 4.36Å; L63-L160 HydrophobicContact CD1-CD2 4.34Å
64	Y	97.6	Very high	87.4	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	146.1	176.7	-67.2	-96.7	0	0	0	110.6	N62 V101 L117 W118 R119 L158 L159 E161 P168 F213	N62-Y64 HydrophobicContact CB-CD2 4.34Å; N62-Y64 HydrophobicContact CB-CE2 3.66Å; Y64-V101 HydrophobicContact CD1-CG2 4.28Å; Y64-V101 HydrophobicContact CE1-CG2 4.04Å; Y64-L117 HydrophobicContact CD1-CD1 4.23Å; Y64-L117 HydrophobicContact CD1-CG 4.37Å; Y64-W118 CarbonylContact C-O 3.51Å; Y64-W118 VanDerWaalsContact CA-O 3.23Å; Y64-W118 WeakPolarHBondContact CA-O 3.15Å; Y64-R119 HydrophobicContact CD1-CB 3.96Å; Y64-R119 HydrophobicContact CD1-CG 4.47Å; Y64-R119 HydrophobicContact CE1-CB 3.8Å; Y64-R119 HydrophobicContact CE1-CG 4.04Å; Y64-R119 PolarHBondContact OH-NH1 3.39Å; Y64-L158 CarbonylContact O-C 3.55Å; Y64-L158 WeakPolarHBondContact O-CA 3.3Å; Y64-L159 PolarHBondContact N-O 3.39Å; Y64-L159 PolarHBondContact O-N 3.46Å; Y64-E161 HydrophobicContact CD2-CB 4.37Å; Y64-E161 HydrophobicContact CE2-CB 3.8Å; Y64-E161 HydrophobicContact CE2-CG 4.07Å; Y64-E161 VanDerWaalsContact CE2-OE2 3.3Å; Y64-E161 WeakPolarHBondContact CE2-OE2 3.3Å; Y64-E161 PolarHBondContact OH-OE2 3.33Å; Y64-P168 HydrophobicContact CE1-CG 4.5Å; Y64-F213 HydrophobicContact CD1-CD1 4.41Å; Y64-F213 AromaticContact CD1-CE1 3.72Å; Y64-F213 HydrophobicContact CD1-CE1 3.72Å; Y64-F213 HydrophobicContact CD1-CZ 4.4Å; Y64-F213 AromaticContact CD2-CD1 4Å; Y64-F213 HydrophobicContact CD2-CD1 4Å; Y64-F213 AromaticContact CD2-CE1 3.88Å; Y64-F213 HydrophobicContact CD2-CE1 3.88Å; Y64-F213 AromaticContact CE1-CE1 3.75Å; Y64-F213 HydrophobicContact CE1-CE1 3.75Å; Y64-F213 HydrophobicContact CE1-CZ 4.36Å; Y64-F213 HydrophobicContact CE2-CD1 4.34Å; Y64-F213 AromaticContact CE2-CE1 3.91Å; Y64-F213 HydrophobicContact CE2-CE1 3.91Å; Y64-F213 HydrophobicContact CG-CD1 4.03Å; Y64-F213 AromaticContact CG-CE1 3.77Å; Y64-F213 HydrophobicContact CG-CE1 3.77Å; Y64-F213 AromaticContact CZ-CE1 3.84Å
65	K	98.2	Very high	88.8	Confident	21 Å²	21	46.7 Å²	46.7	9%	0.091	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	113.8	170.1	-175.8	-178.5	72.5	-169.1	0	108.7	Q67 W118 Y120 Q157 L158	K65-Q67 HydrophobicContact CD-CG 4.39Å; K65-Q67 HydrophobicContact CG-CG 4.14Å; K65-W118 HydrophobicContact CB-CB 4.36Å; K65-W118 PolarHBondContact N-O 3.33Å; K65-W118 PolarHBondContact O-N 2.79Å; K65-Y120 HydrophobicContact CB-CE2 3.77Å; K65-Y120 HydrophobicContact CD-CE2 4.48Å; K65-Y120 WeakPolarHBondContact CE-OH 3.28Å; K65-Y120 PolarHBondContact NZ-OH 3.23Å; K65-Q157 WeakPolarHBondContact CA-O 3.49Å; K65-L158 HydrophobicContact CB-CD2 3.77Å; K65-L158 HydrophobicContact CD-CD2 4.36Å; K65-L158 HydrophobicContact CG-CD2 3.89Å
66	I	98.6	Very high	89.9	Confident	5 Å²	5	48 Å²	48	3%	0.026	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	135.3	169.7	-166.6	165	0	0	0	109.3	F68 V115 H116 L117 N156 Q157 L159 L179	I66-F68 HydrophobicContact CB-CE2 4.41Å; I66-F68 HydrophobicContact CD1-CE1 4.4Å; I66-F68 HydrophobicContact CD1-CE2 3.98Å; I66-F68 HydrophobicContact CD1-CZ 3.61Å; I66-F68 HydrophobicContact CG1-CE2 3.81Å; I66-F68 HydrophobicContact CG1-CZ 3.91Å; I66-F68 HydrophobicContact CG2-CE2 3.82Å; I66-F68 HydrophobicContact CG2-CZ 4.49Å; I66-V115 HydrophobicContact CD1-CG1 4.06Å; I66-V115 HydrophobicContact CG1-CG1 3.99Å; I66-H116 CarbonylContact C-O 3.4Å; I66-H116 WeakPolarHBondContact CA-O 3.41Å; I66-L117 HydrophobicContact CB-CD1 4.03Å; I66-L117 HydrophobicContact CG1-CD1 4.45Å; I66-N156 CarbonylContact O-C 3.55Å; I66-N156 WeakPolarHBondContact O-CA 3.3Å; I66-Q157 HydrophobicContact CG2-CB 3.78Å; I66-Q157 HydrophobicContact CG2-CG 4.39Å; I66-Q157 PolarHBondContact N-O 2.83Å; I66-Q157 PolarHBondContact O-N 3.39Å; I66-L159 HydrophobicContact CB-CD1 3.93Å; I66-L159 HydrophobicContact CG2-CD1 3.62Å; I66-L159 HydrophobicContact CG2-CD2 4.15Å; I66-L159 HydrophobicContact CG2-CG 4.02Å; I66-L179 HydrophobicContact CD1-CD1 4.37Å; I66-L179 HydrophobicContact CD1-CD2 3.85Å
67	Q	98.4	Very high	90.8	Very high	20 Å²	20	53 Å²	53	9%	0.093	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	132.8	-178.6	-45.4	-166.5	-99.1	0	0	109.1	K65 V115 H116 R155 N156	K65-Q67 HydrophobicContact CD-CG 4.39Å; K65-Q67 HydrophobicContact CG-CG 4.14Å; Q67-V115 CarbonylContact O-C 3.56Å; Q67-V115 VanDerWaalsContact O-CA 3.28Å; Q67-V115 WeakPolarHBondContact O-CA 3.32Å; Q67-H116 HydrophobicContact CB-CB 4.21Å; Q67-H116 HydrophobicContact CG-CB 4.49Å; Q67-H116 PolarHBondContact N-O 2.96Å; Q67-H116 PolarHBondContact O-N 3.45Å; Q67-R155 WeakPolarHBondContact CA-O 3.31Å; Q67-N156 VanDerWaalsContact CB-OD1 3.25Å; Q67-N156 WeakPolarHBondContact CB-OD1 3.48Å; Q67-N156 WeakPolarHBondContact CG-OD1 3.18Å; Q67-N156 PolarHBondContact NE2-OD1 2.89Å
68	F	98.4	Very high	92	Very high	4 Å²	4	52.7 Å²	52.7	2%	0.018	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	118.3	173.8	-59.8	-92.9	0	0	0	107.4	I66 V115 R154 R155 L179	I66-F68 HydrophobicContact CB-CE2 4.41Å; I66-F68 HydrophobicContact CD1-CE1 4.4Å; I66-F68 HydrophobicContact CD1-CE2 3.98Å; I66-F68 HydrophobicContact CD1-CZ 3.61Å; I66-F68 HydrophobicContact CG1-CE2 3.81Å; I66-F68 HydrophobicContact CG1-CZ 3.91Å; I66-F68 HydrophobicContact CG2-CE2 3.82Å; I66-F68 HydrophobicContact CG2-CZ 4.49Å; F68-V115 HydrophobicContact CD1-CG1 4.38Å; F68-V115 HydrophobicContact CD1-CG2 3.82Å; F68-V115 HydrophobicContact CE1-CG1 4.17Å; F68-V115 HydrophobicContact CE1-CG2 4.06Å; F68-R154 CarbonylContact O-C 3.58Å; F68-R154 VanDerWaalsContact O-CA 3.31Å; F68-R154 WeakPolarHBondContact O-CA 3.47Å; F68-R155 HydrophobicContact CB-CB 4.48Å; F68-R155 VanDerWaalsContact CD2-NH2 3.28Å; F68-R155 PolarHBondContact N-O 3.01Å; F68-R155 PolarHBondContact O-N 3.41Å; F68-L179 HydrophobicContact CE1-CD2 3.77Å; F68-L179 HydrophobicContact CZ-CD2 3.9Å
69	H	98.6	Very high	93.5	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.009	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	110.1	179.9	-71.1	176.1	0	0	0	108.4	V71 Y79 Q113 A114 H116 L151 R154	H69-V71 PolarHBondContact O-N 3.17Å; H69-Y79 HydrophobicContact CB-CE2 4.46Å; H69-Y79 AromaticContact ND1-CZ 3.76Å; H69-Y79 PolarHBondContact ND1-OH 2.82Å; H69-Q113 WeakPolarHBondContact O-CA 3.33Å; H69-A114 HydrophobicContact CB-CB 4.47Å; H69-A114 PolarHBondContact N-O 3.17Å; H69-A114 PolarHBondContact O-N 3.03Å; H69-H116 AromaticContact ND1-CD2 3.81Å; H69-H116 AromaticContact ND1-NE2 3.86Å; H69-L151 HydrophobicContact CB-CD2 3.76Å; H69-R154 VanDerWaalsContact CD2-CG 3.47Å; H69-R154 WeakPolarHBondContact CD2-CG 3.22Å
70	N	98.6	Very high	95.3	Very high	41 Å²	41	38.8 Å²	38.8	22%	0.219	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	111	171.6	-69	-8.5	0	0	0	107.4	Q113 L151 L152 S153	N70-Q113 VanDerWaalsContact OD1-CG 3.3Å; N70-Q113 WeakPolarHBondContact OD1-CG 3.24Å; N70-Q113 PolarHBondContact OD1-NE2 3.32Å; N70-L151 WeakPolarHBondContact O-CA 3.49Å; N70-L151 WeakPolarHBondContact O-CD2 3.36Å; N70-L152 HydrophobicContact CB-CB 4.3Å; N70-L152 PolarHBondContact O-N 2.9Å; N70-S153 WeakPolarHBondContact CB-OG 3.38Å; N70-S153 PolarHBondContact N-O 3.47Å; N70-S153 PolarHBondContact ND2-OG 2.98Å; N70-S153 VanDerWaalsContact ND2-OG 3.13Å; N70-S153 PolarHBondContact O-N 3.37Å
71	V	98.7	Very high	96.9	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	149.1	-176.9	-165	0	0	0	0	108.4	H69 C75 L76 Y79 D112 M150 L151	H69-V71 PolarHBondContact O-N 3.17Å; V71-C75 HydrophobicContact CG1-CB 4.14Å; V71-L76 HydrophobicContact CB-CD1 4.25Å; V71-L76 HydrophobicContact CG2-CD1 4.19Å; V71-Y79 HydrophobicContact CG1-CD2 4.05Å; V71-Y79 HydrophobicContact CG1-CG 3.83Å; V71-Y79 HydrophobicContact CG2-CD1 3.85Å; V71-Y79 HydrophobicContact CG2-CD2 3.89Å; V71-Y79 HydrophobicContact CG2-CE1 4.13Å; V71-Y79 HydrophobicContact CG2-CE2 4.1Å; V71-Y79 HydrophobicContact CG2-CG 3.79Å; V71-D112 WeakPolarHBondContact CA-O 3.29Å; V71-D112 WeakPolarHBondContact CB-O 3.29Å; V71-D112 PolarHBondContact N-O 3.44Å; V71-M150 HydrophobicContact CG1-CB 4.45Å; V71-M150 VanDerWaalsContact CG1-O 3.32Å; V71-M150 WeakPolarHBondContact CG1-O 3.27Å; V71-L151 HydrophobicContact CB-CD2 4.49Å; V71-L151 HydrophobicContact CG2-CD2 4Å
72	K	98.6	Very high	97.8	Very high	68 Å²	68	38.4 Å²	38.4	30%	0.296	20%	0.203	S	C	.	.			trans	-63.2	131	166.7	-66.4	173.4	-179.2	175.1	0	108.1	E74 C75 L76 K149 M150 L152	K72-E74 PolarHBondContact O-N 2.93Å; K72-C75 HydrophobicContact CB-CB 4.14Å; K72-C75 WeakPolarHBondContact O-CA 3.5Å; K72-C75 WeakPolarHBondContact O-CB 3.42Å; K72-C75 PolarHBondContact O-N 3.46Å; K72-L76 PolarHBondContact O-N 2.93Å; K72-K149 WeakPolarHBondContact CE-O 3.35Å; K72-K149 PolarHBondContact NZ-O 3.48Å; K72-M150 WeakPolarHBondContact CG-O 3.32Å; K72-M150 PolarHBondContact N-O 2.56Å; K72-L152 HydrophobicContact CG-CD2 3.8Å; K72-L152 HydrophobicContact CG-CG 3.9Å
73	P	97.8	Very high	98.2	Very high	73 Å²	73	38.3 Å²	38.3	47%	0.474	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-52.9	-41.6	-175.1	-27.2	33.5	0	0	0	113.2	C75 L76 D112	P73-C75 PolarHBondContact O-N 3.45Å; P73-C75 VanDerWaalsContact O-N 3.16Å; P73-L76 PolarHBondContact O-N 3.29Å; P73-D112 HydrophobicContact CG-CB 4.42Å; P73-D112 WeakPolarHBondContact CG-OD2 3.45Å
74	E	98.3	Very high	98.2	Very high	153 Å²	153	40.6 Å²	40.6	72%	0.715	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-69.2	-9.4	178.9	69.5	-83.8	-166.2	0	0	114.6	K72	K72-E74 PolarHBondContact O-N 2.93Å
75	C	98.4	Very high	98.1	Very high	27 Å²	27	47.5 Å²	47.5	18%	0.182	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-110	-0.1	-178.1	-64.4	0	0	0	0	113.5	V71 K72 P73 D77 A78 Y79 M150	V71-C75 HydrophobicContact CG1-CB 4.14Å; K72-C75 HydrophobicContact CB-CB 4.14Å; K72-C75 WeakPolarHBondContact O-CA 3.5Å; K72-C75 WeakPolarHBondContact O-CB 3.42Å; K72-C75 PolarHBondContact O-N 3.46Å; P73-C75 PolarHBondContact O-N 3.45Å; P73-C75 VanDerWaalsContact O-N 3.16Å; C75-D77 VanDerWaalsContact C-N 3.34Å; C75-D77 PolarHBondContact O-N 2.9Å; C75-A78 PolarHBondContact O-N 3.4Å; C75-Y79 WeakPolarHBondContact O-CB 3.44Å; C75-Y79 PolarHBondContact O-N 3.41Å; C75-M150 HydrophobicContact CB-CB 3.78Å; C75-M150 HydrophobicContact CB-CG 4.02Å
76	L	97.8	Very high	98.1	Very high	36 Å²	36	47.5 Å²	47.5	19%	0.188	25%	0.247	C	C	.	.	H	α-helix	trans	-58.7	-43.6	-169.5	-174.9	61.2	0	0	0	112.7	V71 K72 P73 Y79 N80	V71-L76 HydrophobicContact CB-CD1 4.25Å; V71-L76 HydrophobicContact CG2-CD1 4.19Å; K72-L76 PolarHBondContact O-N 2.93Å; P73-L76 PolarHBondContact O-N 3.29Å; L76-Y79 PolarHBondContact O-N 3.39Å; L76-N80 WeakPolarHBondContact O-CB 3.4Å; L76-N80 PolarHBondContact O-N 3.09Å; L76-N80 PolarHBondContact O-ND2 2.74Å; L76-N80 VanDerWaalsContact O-ND2 3.1Å
77	D	97.9	Very high	98	Very high	121 Å²	121	47.6 Å²	47.6	65%	0.647	25%	0.247	S	C	*	.	H	α-helix	trans	-66.3	-49	179.7	-67.5	-24.9	0	0	0	111.9	C75 Y79 N80 E81	C75-D77 VanDerWaalsContact C-N 3.34Å; C75-D77 PolarHBondContact O-N 2.9Å; D77-Y79 VanDerWaalsContact C-N 3.28Å; D77-Y79 PolarHBondContact O-N 3.17Å; D77-N80 WeakPolarHBondContact O-CB 3.18Å; D77-N80 PolarHBondContact O-N 2.78Å; D77-E81 WeakPolarHBondContact O-CG 3.47Å; D77-E81 PolarHBondContact O-N 3.01Å
78	A	98.5	Very high	98	Very high	46 Å²	46	48.4 Å²	48.4	38%	0.38	26%	0.255	S	S	.	.	H	α-helix	trans	-61.6	-37	176.6	0	0	0	0	0	112.4	C75 N80 L82 M150	C75-A78 PolarHBondContact O-N 3.4Å; A78-N80 VanDerWaalsContact C-N 3.34Å; A78-L82 VanDerWaalsContact O-CB 3.3Å; A78-L82 WeakPolarHBondContact O-CB 3.31Å; A78-L82 PolarHBondContact O-N 3.16Å; A78-L82 VanDerWaalsContact O-N 3.07Å; A78-M150 HydrophobicContact CB-CE 4.45Å; A78-M150 HydrophobicContact CB-SD 4.48Å
79	Y	98.6	Very high	97.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62.7	-42.3	173.6	171.9	-82	0	0	0	111.3	H69 V71 C75 L76 D77 C83 A114 H116 R147 M150 L151	H69-Y79 HydrophobicContact CB-CE2 4.46Å; H69-Y79 AromaticContact ND1-CZ 3.76Å; H69-Y79 PolarHBondContact ND1-OH 2.82Å; V71-Y79 HydrophobicContact CG1-CD2 4.05Å; V71-Y79 HydrophobicContact CG1-CG 3.83Å; V71-Y79 HydrophobicContact CG2-CD1 3.85Å; V71-Y79 HydrophobicContact CG2-CD2 3.89Å; V71-Y79 HydrophobicContact CG2-CE1 4.13Å; V71-Y79 HydrophobicContact CG2-CE2 4.1Å; V71-Y79 HydrophobicContact CG2-CG 3.79Å; C75-Y79 WeakPolarHBondContact O-CB 3.44Å; C75-Y79 PolarHBondContact O-N 3.41Å; L76-Y79 PolarHBondContact O-N 3.39Å; D77-Y79 VanDerWaalsContact C-N 3.28Å; D77-Y79 PolarHBondContact O-N 3.17Å; Y79-C83 VanDerWaalsContact CE1-SG 3.51Å; Y79-C83 WeakPolarHBondContact O-CB 3.34Å; Y79-C83 PolarHBondContact O-N 3.48Å; Y79-C83 PolarHBondContact O-SG 2.87Å; Y79-C83 PolarHBondContact OH-SG 3.09Å; Y79-C83 VanDerWaalsContact OH-SG 3.36Å; Y79-A114 HydrophobicContact CD1-CB 4.36Å; Y79-A114 HydrophobicContact CE1-CB 3.48Å; Y79-A114 VanDerWaalsContact CE1-CB 3.48Å; Y79-H116 AromaticContact CZ-NE2 3.97Å; Y79-H116 PolarHBondContact OH-NE2 3.38Å; Y79-R147 HydrophobicContact CD2-CG 3.83Å; Y79-R147 HydrophobicContact CE2-CG 3.45Å; Y79-R147 VanDerWaalsContact CE2-CG 3.45Å; Y79-M150 HydrophobicContact CD2-CB 4.49Å; Y79-L151 HydrophobicContact CD2-CD2 4.12Å; Y79-L151 HydrophobicContact CE2-CD2 3.77Å; Y79-L151 HydrophobicContact CE2-CG 4.46Å
80	N	98.4	Very high	97.8	Very high	19 Å²	19	51.8 Å²	51.8	10%	0.102	28%	0.278	C	S	.	.	H	α-helix	trans	-64.7	-50.8	179.2	-70.6	-29.1	0	0	0	110.8	L76 D77 A78 L82 C83 E84 N105 M270	L76-N80 WeakPolarHBondContact O-CB 3.4Å; L76-N80 PolarHBondContact O-N 3.09Å; L76-N80 PolarHBondContact O-ND2 2.74Å; L76-N80 VanDerWaalsContact O-ND2 3.1Å; D77-N80 WeakPolarHBondContact O-CB 3.18Å; D77-N80 PolarHBondContact O-N 2.78Å; A78-N80 VanDerWaalsContact C-N 3.34Å; N80-L82 VanDerWaalsContact C-N 3.3Å; N80-L82 PolarHBondContact O-N 2.75Å; N80-C83 CarbonylContact O-C 3.51Å; N80-C83 PolarHBondContact O-N 3.34Å; N80-E84 WeakPolarHBondContact O-CB 3.46Å; N80-E84 VanDerWaalsContact O-CG 3.3Å; N80-E84 WeakPolarHBondContact O-CG 3.4Å; N80-E84 PolarHBondContact O-N 3.22Å; N80-N105 VanDerWaalsContact CG-ND2 3.27Å; N80-N105 PolarHBondContact ND2-ND2 3.47Å; N80-N105 PolarHBondContact OD1-ND2 3.29Å; N80-N105 PolarHBondContact OD1-OD1 3.02Å; N80-M270 HydrophobicContact CB-CE 3.75Å; N80-M270 WeakPolarHBondContact OD1-CE 3.31Å
81	E	98.3	Very high	97.6	Very high	137 Å²	137	53.2 Å²	53.2	64%	0.64	28%	0.283	S	S	*	.	H	α-helix	trans	-54	-48	177	-70.5	175.9	176.3	0	0	111.4	D77 C83 E84 E85	D77-E81 WeakPolarHBondContact O-CG 3.47Å; D77-E81 PolarHBondContact O-N 3.01Å; E81-C83 VanDerWaalsContact C-N 3.3Å; E81-C83 PolarHBondContact O-N 2.92Å; E81-E84 PolarHBondContact O-N 3.05Å; E81-E85 PolarHBondContact O-N 2.89Å
82	L	98.2	Very high	97.5	Very high	27 Å²	27	56.9 Å²	56.9	14%	0.141	31%	0.314	C	S	.	.	H	α-helix	trans	-61.1	-37.8	178.2	-179.3	63.8	0	0	0	112.4	A78 N80 V86 Y143 E146 R147 M150	A78-L82 VanDerWaalsContact O-CB 3.3Å; A78-L82 WeakPolarHBondContact O-CB 3.31Å; A78-L82 PolarHBondContact O-N 3.16Å; A78-L82 VanDerWaalsContact O-N 3.07Å; N80-L82 VanDerWaalsContact C-N 3.3Å; N80-L82 PolarHBondContact O-N 2.75Å; L82-V86 WeakPolarHBondContact O-CG2 3.49Å; L82-V86 PolarHBondContact O-N 2.83Å; L82-Y143 HydrophobicContact CD1-CD2 3.83Å; L82-Y143 HydrophobicContact CD2-CD2 4.04Å; L82-Y143 HydrophobicContact CD2-CE2 4.25Å; L82-Y143 HydrophobicContact CG-CD2 3.6Å; L82-Y143 HydrophobicContact CG-CE2 3.84Å; L82-E146 HydrophobicContact CD2-CB 3.9Å; L82-R147 HydrophobicContact CD2-CB 3.85Å; L82-M150 HydrophobicContact CD2-CE 3.96Å; L82-M150 HydrophobicContact CD2-SD 4.27Å
83	C	98.1	Very high	97.4	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.007	31%	0.313	C	S	.	.	H	α-helix	trans	-74.4	-36.8	175.6	-70.1	0	0	0	0	112.4	Y79 N80 E81 E85 V86 L87 Y143 M270	Y79-C83 VanDerWaalsContact CE1-SG 3.51Å; Y79-C83 WeakPolarHBondContact O-CB 3.34Å; Y79-C83 PolarHBondContact O-N 3.48Å; Y79-C83 PolarHBondContact O-SG 2.87Å; Y79-C83 PolarHBondContact OH-SG 3.09Å; Y79-C83 VanDerWaalsContact OH-SG 3.36Å; N80-C83 CarbonylContact O-C 3.51Å; N80-C83 PolarHBondContact O-N 3.34Å; E81-C83 VanDerWaalsContact C-N 3.3Å; E81-C83 PolarHBondContact O-N 2.92Å; C83-E85 PolarHBondContact O-N 3.07Å; C83-V86 PolarHBondContact O-N 3.27Å; C83-L87 HydrophobicContact CB-CD1 3.82Å; C83-L87 HydrophobicContact CB-CG 4.11Å; C83-L87 WeakPolarHBondContact O-CB 3.32Å; C83-L87 VanDerWaalsContact O-CG 3.27Å; C83-L87 WeakPolarHBondContact O-CG 3.37Å; C83-L87 PolarHBondContact O-N 3.1Å; C83-Y143 PolarHBondContact SG-OH 3.32Å; C83-M270 HydrophobicContact CB-CE 3.97Å
84	E	96.8	Very high	97.2	Very high	50 Å²	50	58.6 Å²	58.6	23%	0.234	33%	0.329	C	S	.	.	H	α-helix	trans	-65.4	-29.3	178.5	-72.3	-175.6	179.1	0	0	112.4	N80 E81 P88 M270 K271 T272	N80-E84 WeakPolarHBondContact O-CB 3.46Å; N80-E84 VanDerWaalsContact O-CG 3.3Å; N80-E84 WeakPolarHBondContact O-CG 3.4Å; N80-E84 PolarHBondContact O-N 3.22Å; E81-E84 PolarHBondContact O-N 3.05Å; E84-P88 VanDerWaalsContact O-CD 3.24Å; E84-P88 WeakPolarHBondContact O-CD 3.25Å; E84-P88 VanDerWaalsContact O-CG 3.29Å; E84-P88 WeakPolarHBondContact O-CG 3.42Å; E84-M270 HydrophobicContact CG-CE 3.89Å; E84-K271 WeakPolarHBondContact OE1-CB 3.13Å; E84-K271 PolarHBondContact OE1-N 3.28Å; E84-K271 VanDerWaalsContact OE1-N 3.11Å; E84-T272 HydrophobicContact CB-CG2 3.98Å; E84-T272 HydrophobicContact CG-CG2 4.13Å
85	E	95.6	Very high	97	Very high	146 Å²	146	57 Å²	57	68%	0.682	32%	0.322	S	S	*	.	H	α-helix	trans	-74	-45.6	172.6	-174.5	-176	168.3	0	0	112.4	E81 C83	E81-E85 PolarHBondContact O-N 2.89Å; C83-E85 PolarHBondContact O-N 3.07Å
86	V	97.2	Very high	96.9	Very high	20 Å²	20	56.4 Å²	56.4	12%	0.121	32%	0.316	C	S	.	.	H	α-helix	trans	-96.3	-37.7	-164.3	178.2	0	0	0	0	113.9	L82 C83 S89 I90 Y143	L82-V86 WeakPolarHBondContact O-CG2 3.49Å; L82-V86 PolarHBondContact O-N 2.83Å; C83-V86 PolarHBondContact O-N 3.27Å; V86-S89 PolarHBondContact O-N 2.93Å; V86-S89 PolarHBondContact O-OG 2.78Å; V86-I90 HydrophobicContact CG1-CD1 3.94Å; V86-I90 HydrophobicContact CG1-CG1 4.45Å; V86-I90 WeakPolarHBondContact O-CG1 3.45Å; V86-I90 PolarHBondContact O-N 2.97Å; V86-Y143 HydrophobicContact CB-CD2 3.63Å; V86-Y143 HydrophobicContact CB-CE2 3.99Å; V86-Y143 HydrophobicContact CB-CG 3.99Å; V86-Y143 HydrophobicContact CG1-CD1 3.9Å; V86-Y143 HydrophobicContact CG1-CD2 3.82Å; V86-Y143 HydrophobicContact CG1-CE1 4.34Å; V86-Y143 HydrophobicContact CG1-CE2 4.28Å; V86-Y143 HydrophobicContact CG1-CG 3.63Å; V86-Y143 HydrophobicContact CG2-CD2 3.59Å; V86-Y143 HydrophobicContact CG2-CE2 4.36Å; V86-Y143 HydrophobicContact CG2-CG 3.96Å
87	L	97.4	Very high	96.7	Very high	7 Å²	7	57 Å²	57	4%	0.037	32%	0.321	C	S	.	.	H	α-helix	trans	-67.1	-41.3	-176.2	-51.5	178.5	0	0	0	112.6	C83 S89 I90 H91 L100 H116 W118	C83-L87 HydrophobicContact CB-CD1 3.82Å; C83-L87 HydrophobicContact CB-CG 4.11Å; C83-L87 WeakPolarHBondContact O-CB 3.32Å; C83-L87 VanDerWaalsContact O-CG 3.27Å; C83-L87 WeakPolarHBondContact O-CG 3.37Å; C83-L87 PolarHBondContact O-N 3.1Å; L87-S89 VanDerWaalsContact C-N 3.33Å; L87-S89 PolarHBondContact O-N 2.77Å; L87-I90 PolarHBondContact O-N 3.46Å; L87-H91 WeakPolarHBondContact O-CB 3.42Å; L87-H91 PolarHBondContact O-N 2.9Å; L87-L100 HydrophobicContact CB-CD2 3.89Å; L87-H116 WeakPolarHBondContact CD1-ND1 3.47Å; L87-W118 HydrophobicContact CB-CH2 4.33Å; L87-W118 HydrophobicContact CB-CZ2 4.06Å; L87-W118 HydrophobicContact CD2-CZ2 3.77Å; L87-W118 HydrophobicContact CG-CZ2 4.35Å
88	P	96.8	Very high	96.6	Very high	38 Å²	38	51.6 Å²	51.6	25%	0.247	29%	0.293	C	S	.	.	H	α-helix	trans	-64.7	-34.5	176.2	-25	37.7	0	0	0	113.4	E84 H91 A92 T272	E84-P88 VanDerWaalsContact O-CD 3.24Å; E84-P88 WeakPolarHBondContact O-CD 3.25Å; E84-P88 VanDerWaalsContact O-CG 3.29Å; E84-P88 WeakPolarHBondContact O-CG 3.42Å; P88-H91 PolarHBondContact O-N 3.08Å; P88-A92 WeakPolarHBondContact O-CB 3.3Å; P88-A92 PolarHBondContact O-N 2.92Å; P88-T272 HydrophobicContact CG-CG2 4.15Å
89	S	96.3	Very high	96.5	Very high	67 Å²	67	52 Å²	52	47%	0.469	29%	0.287	S	S	.	.	H	α-helix	trans	-67.3	-40.3	177.9	58.7	0	0	0	0	111.9	V86 L87 H91 A92 D93	V86-S89 PolarHBondContact O-N 2.93Å; V86-S89 PolarHBondContact O-OG 2.78Å; L87-S89 VanDerWaalsContact C-N 3.33Å; L87-S89 PolarHBondContact O-N 2.77Å; S89-H91 VanDerWaalsContact C-N 3.34Å; S89-A92 PolarHBondContact O-N 2.97Å; S89-D93 VanDerWaalsContact O-CB 3.31Å; S89-D93 WeakPolarHBondContact O-CB 3.22Å; S89-D93 PolarHBondContact O-N 3.36Å
90	I	96.6	Very high	96.4	Very high	10 Å²	10	52.2 Å²	52.2	5%	0.051	29%	0.288	C	S	.	.	H	α-helix	trans	-64.1	-41	172.4	-61.9	167.5	0	0	0	111.1	V86 L87 Y96 W118 L134 F140	V86-I90 HydrophobicContact CG1-CD1 3.94Å; V86-I90 HydrophobicContact CG1-CG1 4.45Å; V86-I90 WeakPolarHBondContact O-CG1 3.45Å; V86-I90 PolarHBondContact O-N 2.97Å; L87-I90 PolarHBondContact O-N 3.46Å; I90-Y96 HydrophobicContact CG2-CD2 4.02Å; I90-Y96 HydrophobicContact CG2-CG 4.29Å; I90-W118 HydrophobicContact CB-CH2 4.12Å; I90-W118 HydrophobicContact CG2-CH2 3.99Å; I90-W118 HydrophobicContact CG2-CZ3 4.04Å; I90-L134 HydrophobicContact CD1-CD2 4.12Å; I90-L134 HydrophobicContact CG1-CD2 4.19Å; I90-L134 HydrophobicContact CG2-CD2 4.34Å; I90-F140 HydrophobicContact CD1-CD2 3.57Å; I90-F140 HydrophobicContact CD1-CE2 3.69Å
91	H	96	Very high	96.4	Very high	70 Å²	70	51.8 Å²	51.8	32%	0.324	29%	0.286	S	S	.	.	H	α-helix	trans	-64.8	-37.8	179.7	171.9	40.5	0	0	0	113	L87 P88 S89 L100 W118	L87-H91 WeakPolarHBondContact O-CB 3.42Å; L87-H91 PolarHBondContact O-N 2.9Å; P88-H91 PolarHBondContact O-N 3.08Å; S89-H91 VanDerWaalsContact C-N 3.34Å; H91-L100 HydrophobicContact CB-CB 3.84Å; H91-L100 PolarHBondContact ND1-N 3.21Å; H91-W118 HydrophobicContact CB-CZ3 4.47Å
92	A	96	Very high	96.3	Very high	79 Å²	79	45.3 Å²	45.3	65%	0.653	26%	0.256	S	S	*	.	H	α-helix	trans	-84.3	-16.6	-176.6	0	0	0	0	0	113.7	P88 S89 P94	P88-A92 WeakPolarHBondContact O-CB 3.3Å; P88-A92 PolarHBondContact O-N 2.92Å; S89-A92 PolarHBondContact O-N 2.97Å; A92-P94 WeakPolarHBondContact O-CD 3.46Å
93	D	96.3	Very high	96.3	Very high	51 Å²	51	44 Å²	44	27%	0.273	25%	0.249	S	C	.	.			trans	-81.2	114.8	-175.9	-179.6	-10.2	0	0	0	111	S89 E95 Y96	S89-D93 VanDerWaalsContact O-CB 3.31Å; S89-D93 WeakPolarHBondContact O-CB 3.22Å; S89-D93 PolarHBondContact O-N 3.36Å; D93-E95 PolarHBondContact O-N 2.78Å; D93-E95 VanDerWaalsContact O-N 3.12Å; D93-E95 VanDerWaalsContact OD1-CB 3.31Å; D93-E95 WeakPolarHBondContact OD1-CB 3.27Å; D93-E95 PolarHBondContact OD1-N 2.95Å; D93-Y96 HydrophobicContact CB-CD2 3.77Å; D93-Y96 HydrophobicContact CB-CE2 3.99Å; D93-Y96 PolarHBondContact O-N 3.35Å; D93-Y96 WeakPolarHBondContact OD2-CE2 3.44Å
94	P	94.4	Very high	96.3	Very high	125 Å²	125	44.1 Å²	44.1	81%	0.812	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-13.1	-177.2	29.5	-36.3	0	0	0	113.5	A92 Y96	A92-P94 WeakPolarHBondContact O-CD 3.46Å; P94-Y96 PolarHBondContact O-N 3.15Å
95	E	94.2	Very high	96.4	Very high	121 Å²	121	43 Å²	43	57%	0.565	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-22.4	172.7	-66.2	-165.6	171.1	0	0	112.8	D93 P97 K133	D93-E95 PolarHBondContact O-N 2.78Å; D93-E95 VanDerWaalsContact O-N 3.12Å; D93-E95 VanDerWaalsContact OD1-CB 3.31Å; D93-E95 WeakPolarHBondContact OD1-CB 3.27Å; D93-E95 PolarHBondContact OD1-N 2.95Å; E95-P97 VanDerWaalsContact O-CD 3.32Å; E95-P97 WeakPolarHBondContact O-CD 3.27Å; E95-K133 WeakPolarHBondContact O-CD 3.29Å; E95-K133 PolarHBondContact O-NZ 3.37Å
96	Y	95.5	Very high	96.5	Very high	14 Å²	14	36.8 Å²	36.8	6%	0.055	22%	0.217	C	C	.	.	S	Bend	trans	-102	107.2	174.9	-52.8	-64.8	0	0	0	109.6	I90 D93 P94 C98 V130 K133 L134 N137	I90-Y96 HydrophobicContact CG2-CD2 4.02Å; I90-Y96 HydrophobicContact CG2-CG 4.29Å; D93-Y96 HydrophobicContact CB-CD2 3.77Å; D93-Y96 HydrophobicContact CB-CE2 3.99Å; D93-Y96 PolarHBondContact O-N 3.35Å; D93-Y96 WeakPolarHBondContact OD2-CE2 3.44Å; P94-Y96 PolarHBondContact O-N 3.15Å; Y96-C98 PolarHBondContact O-N 3.06Å; Y96-V130 HydrophobicContact CD1-CG1 4.22Å; Y96-K133 HydrophobicContact CD1-CB 4.1Å; Y96-K133 HydrophobicContact CD1-CD 4.43Å; Y96-K133 HydrophobicContact CE1-CB 3.65Å; Y96-K133 HydrophobicContact CE1-CD 4.5Å; Y96-L134 HydrophobicContact CD1-CD2 4.09Å; Y96-L134 HydrophobicContact CD1-CG 4.14Å; Y96-L134 HydrophobicContact CE1-CD2 3.62Å; Y96-L134 HydrophobicContact CE1-CG 3.89Å; Y96-L134 HydrophobicContact CE2-CD2 4.26Å; Y96-N137 PolarHBondContact OH-ND2 2.95Å
97	P	93.3	Very high	96.5	Very high	48 Å²	48	40.7 Å²	40.7	31%	0.312	23%	0.23	S	C	.	.			trans	-72.9	63.5	174.3	30.2	-37.1	0	0	0	111.4	E95 A126 V130	E95-P97 VanDerWaalsContact O-CD 3.32Å; E95-P97 WeakPolarHBondContact O-CD 3.27Å; P97-A126 HydrophobicContact CG-CB 4.34Å; P97-V130 VanDerWaalsContact CD-CG2 3.47Å; P97-V130 HydrophobicContact CG-CG2 3.81Å
98	C	95.7	Very high	96.5	Very high	7 Å²	7	46 Å²	46	5%	0.047	25%	0.25	C	C	.	.			trans	-146.7	152.4	177.4	68.6	0	0	0	0	111.9	Y96 W118 R119 Y120 V130	Y96-C98 PolarHBondContact O-N 3.06Å; C98-W118 HydrophobicContact CB-CE3 4.44Å; C98-R119 CarbonylContact C-O 3.51Å; C98-R119 WeakPolarHBondContact CA-O 3.42Å; C98-Y120 HydrophobicContact CB-CD1 3.48Å; C98-Y120 VanDerWaalsContact CB-CD1 3.48Å; C98-Y120 HydrophobicContact CB-CE1 3.36Å; C98-Y120 HydrophobicContact CB-CG 4.36Å; C98-V130 HydrophobicContact CB-CG2 4.12Å
99	E	96.3	Very high	96.5	Very high	55 Å²	55	46.4 Å²	46.4	26%	0.257	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130.2	-179.1	-62.2	167.6	-159	0	0	109	V101 W118 R119 R121	E99-V101 PolarHBondContact O-N 2.84Å; E99-W118 CarbonylContact O-C 3.49Å; E99-W118 WeakPolarHBondContact O-CA 3.32Å; E99-R119 HydrophobicContact CB-CB 4.37Å; E99-R119 PolarHBondContact N-O 3.49Å; E99-R119 PolarHBondContact O-N 3.32Å; E99-R119 IonicContact OE2-CZ 3.71Å; E99-R119 IonicContact OE2-NE 2.65Å; E99-R119 PolarHBondContact OE2-NE 3.23Å; E99-R119 IonicContact OE2-NH2 3.98Å; E99-R119 PolarHBondContact OE2-NH2 3.5Å; E99-R121 IonicContact OE1-CZ 2.77Å; E99-R121 IonicContact OE1-NE 3.17Å; E99-R121 PolarHBondContact OE1-NE 2.84Å; E99-R121 IonicContact OE1-NH2 2.74Å
100	L	97.6	Very high	96.3	Very high	5 Å²	5	47.6 Å²	47.6	3%	0.026	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	111.9	165.5	179.3	63.9	0	0	0	106.7	L87 H91 T103 W118 P274	L87-L100 HydrophobicContact CB-CD2 3.89Å; H91-L100 HydrophobicContact CB-CB 3.84Å; H91-L100 PolarHBondContact ND1-N 3.21Å; L100-T103 HydrophobicContact CD2-CG2 4.19Å; L100-W118 HydrophobicContact CB-CD2 4.49Å; L100-W118 HydrophobicContact CB-CE3 4.1Å; L100-W118 HydrophobicContact CB-CH2 3.89Å; L100-W118 HydrophobicContact CB-CZ2 4.29Å; L100-W118 HydrophobicContact CB-CZ3 3.79Å; L100-W118 HydrophobicContact CD1-CD2 4.07Å; L100-W118 HydrophobicContact CD1-CH2 4.21Å; L100-W118 HydrophobicContact CD1-CZ2 3.72Å; L100-W118 HydrophobicContact CG-CH2 4.49Å; L100-W118 HydrophobicContact CG-CZ2 4.45Å; L100-P274 HydrophobicContact CB-CG 4.39Å; L100-P274 HydrophobicContact CD2-CG 4.3Å; L100-P274 HydrophobicContact CG-CG 4.25Å; L100-P274 WeakPolarHBondContact O-CG 3.49Å
101	V	97.1	Very high	96.3	Very high	10 Å²	10	53.5 Å²	53.5	6%	0.061	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	-44.7	177.5	177.8	0	0	0	0	109.3	Y64 E99 L117 R119 P168 L275	Y64-V101 HydrophobicContact CD1-CG2 4.28Å; Y64-V101 HydrophobicContact CE1-CG2 4.04Å; E99-V101 PolarHBondContact O-N 2.84Å; V101-L117 WeakPolarHBondContact CA-O 3.06Å; V101-L117 HydrophobicContact CB-CB 4.15Å; V101-L117 HydrophobicContact CB-CD2 4Å; V101-L117 HydrophobicContact CB-CG 3.9Å; V101-L117 WeakPolarHBondContact CB-O 3.31Å; V101-L117 HydrophobicContact CG1-CD2 3.73Å; V101-L117 HydrophobicContact CG1-CG 4.22Å; V101-L117 HydrophobicContact CG2-CG 4.28Å; V101-L117 PolarHBondContact N-O 2.81Å; V101-R119 HydrophobicContact CG2-CB 3.62Å; V101-P168 HydrophobicContact CG1-CB 3.5Å; V101-P168 HydrophobicContact CG1-CG 3.99Å; V101-L275 HydrophobicContact CG1-CD1 3.8Å; V101-L275 VanDerWaalsContact O-CD1 3.26Å; V101-L275 WeakPolarHBondContact O-CD1 3.45Å; V101-L275 WeakPolarHBondContact O-CG 3.49Å
102	G	97.6	Very high	96.3	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.7	160.2	175.9	0	0	0	0	0	112.6	W104 L117	G102-W104 VanDerWaalsContact O-CZ3 3.24Å; G102-W104 WeakPolarHBondContact O-CZ3 3.47Å; G102-L117 PolarHBondContact N-O 3.42Å; G102-L117 PolarHBondContact O-N 3.16Å
103	T	98.2	Very high	96.4	Very high	1 Å²	1	49 Å²	49	1%	0.006	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	132.7	177.8	-179.9	0	0	0	0	110.1	L100 V115 H116 P269 M270 S273	L100-T103 HydrophobicContact CD2-CG2 4.19Å; T103-V115 WeakPolarHBondContact CA-O 3.14Å; T103-H116 WeakPolarHBondContact CB-ND1 3.48Å; T103-H116 PolarHBondContact OG1-CE1 2.99Å; T103-H116 PolarHBondContact OG1-ND1 3.04Å; T103-P269 WeakPolarHBondContact O-CA 3.5Å; T103-M270 HydrophobicContact CG2-CB 3.98Å; T103-M270 HydrophobicContact CG2-CG 4.39Å; T103-M270 HydrophobicContact CG2-SD 4.22Å; T103-M270 PolarHBondContact O-N 2.99Å; T103-M270 PolarHBondContact OG1-SD 2.96Å; T103-S273 PolarHBondContact N-OG 3.49Å; T103-S273 VanDerWaalsContact O-CB 3.25Å; T103-S273 WeakPolarHBondContact O-CB 3.25Å; T103-S273 PolarHBondContact O-OG 2.82Å; T103-S273 VanDerWaalsContact O-OG 3.1Å
104	W	98.3	Very high	96.5	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.008	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	152.8	-171.9	-51.7	-99.2	0	0	0	111.8	G102 A114 V115 L117 Y177 L226 M267 I268 P269 L275	G102-W104 VanDerWaalsContact O-CZ3 3.24Å; G102-W104 WeakPolarHBondContact O-CZ3 3.47Å; W104-A114 CarbonylContact O-C 3.49Å; W104-A114 VanDerWaalsContact O-CA 3.31Å; W104-A114 WeakPolarHBondContact O-CA 3.46Å; W104-V115 PolarHBondContact N-O 2.96Å; W104-V115 PolarHBondContact O-N 2.78Å; W104-L117 HydrophobicContact CH2-CB 4.21Å; W104-L117 HydrophobicContact CZ3-CB 3.88Å; W104-Y177 AromaticContact CD1-CD2 3.62Å; W104-Y177 AromaticContact CD1-CG 3.81Å; W104-Y177 HydrophobicContact CZ2-CD1 4.13Å; W104-Y177 HydrophobicContact CZ2-CE1 4.27Å; W104-Y177 AromaticContact NE1-CD1 3.66Å; W104-Y177 AromaticContact NE1-CD2 3.17Å; W104-Y177 AromaticContact NE1-CE2 3.62Å; W104-Y177 AromaticContact NE1-CG 3.23Å; W104-L226 HydrophobicContact CH2-CD2 3.87Å; W104-L226 HydrophobicContact CZ2-CD2 4.05Å; W104-M267 HydrophobicContact CB-CB 3.63Å; W104-M267 HydrophobicContact CB-CE 4.36Å; W104-M267 HydrophobicContact CB-CG 4.47Å; W104-M267 HydrophobicContact CB-SD 4.27Å; W104-M267 HydrophobicContact CD2-CE 4.02Å; W104-M267 HydrophobicContact CE3-CE 4.22Å; W104-M267 HydrophobicContact CG-CB 4.09Å; W104-M267 HydrophobicContact CG-CE 4.08Å; W104-I268 CarbonylContact C-O 3.58Å; W104-I268 VanDerWaalsContact CA-O 3.25Å; W104-I268 WeakPolarHBondContact CA-O 3.35Å; W104-I268 WeakPolarHBondContact CB-O 3.39Å; W104-P269 VanDerWaalsContact CD1-CA 3.4Å; W104-L275 HydrophobicContact CH2-CD1 4.08Å; W104-L275 HydrophobicContact CZ2-CB 4.1Å; W104-L275 HydrophobicContact CZ2-CD1 3.74Å
105	N	98.3	Very high	96.7	Very high	28 Å²	28	40.7 Å²	40.7	15%	0.15	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	140.8	163.4	-74	-38	0	0	0	110.5	N80 W107 M267 I268	N80-N105 VanDerWaalsContact CG-ND2 3.27Å; N80-N105 PolarHBondContact ND2-ND2 3.47Å; N80-N105 PolarHBondContact OD1-ND2 3.29Å; N80-N105 PolarHBondContact OD1-OD1 3.02Å; N105-W107 PolarHBondContact O-N 3.38Å; N105-M267 CarbonylContact O-C 3.56Å; N105-M267 WeakPolarHBondContact O-CA 3.37Å; N105-I268 PolarHBondContact N-O 2.92Å; N105-I268 PolarHBondContact O-N 2.93Å
106	T	98.3	Very high	96.9	Very high	14 Å²	14	35 Å²	35	9%	0.086	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	124.9	175.9	-56.7	0	0	0	0	110.3	E110 Q113 R265	T106-E110 WeakPolarHBondContact CB-O 3.43Å; T106-E110 WeakPolarHBondContact CG2-O 3.15Å; T106-Q113 WeakPolarHBondContact CB-O 3.43Å; T106-Q113 PolarHBondContact N-O 3.22Å; T106-Q113 PolarHBondContact OG1-O 3.4Å; T106-R265 HydrophobicContact CG2-CG 3.39Å; T106-R265 WeakPolarHBondContact OG1-CD 3.32Å; T106-R265 PolarHBondContact OG1-NE 2.94Å
107	W	97.2	Very high	97.1	Very high	103 Å²	103	34.5 Å²	34.5	39%	0.39	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-50.5	173.6	-174.2	26.3	0	0	0	111.9	N105 L232 I266 I268	N105-W107 PolarHBondContact O-N 3.38Å; W107-L232 HydrophobicContact CH2-CD1 3.85Å; W107-L232 HydrophobicContact CZ3-CD1 3.68Å; W107-L232 HydrophobicContact CZ3-CG 4.04Å; W107-I266 HydrophobicContact CE3-CG2 4.03Å; W107-I266 PolarHBondContact N-O 3.32Å; W107-I268 HydrophobicContact CB-CD1 3.87Å; W107-I268 HydrophobicContact CB-CG1 4.02Å; W107-I268 HydrophobicContact CD2-CD1 3.91Å; W107-I268 HydrophobicContact CE3-CD1 4.1Å; W107-I268 HydrophobicContact CE3-CG1 4.37Å; W107-I268 HydrophobicContact CG-CD1 3.82Å; W107-I268 HydrophobicContact CG-CG1 4.41Å
108	Y	97.2	Very high	97.3	Very high	117 Å²	117	32.7 Å²	32.7	46%	0.459	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	130.5	173.1	-64.2	-81.3	0	0	0	110.2	L232 R265 I266	Y108-L232 HydrophobicContact CE2-CD1 3.85Å; Y108-R265 CarbonylContact O-C 3.51Å; Y108-R265 WeakPolarHBondContact O-CA 3.44Å; Y108-I266 HydrophobicContact CD2-CB 4.08Å; Y108-I266 HydrophobicContact CD2-CG1 4.31Å; Y108-I266 HydrophobicContact CD2-CG2 4.38Å; Y108-I266 PolarHBondContact N-O 3.3Å; Y108-I266 PolarHBondContact O-N 3.15Å
109	G	95.3	Very high	97.4	Very high	48 Å²	48	33.2 Å²	33.2	50%	0.495	16%	0.163	S	C	.	.	S	Bend	trans	126.6	-141.6	-169.7	0	0	0	0	0	110.2	Q111	G109-Q111 PolarHBondContact O-N 3.12Å; G109-Q111 VanDerWaalsContact O-N 3.11Å
110	E	93.8	Very high	97.4	Very high	91 Å²	91	30.8 Å²	30.8	43%	0.425	15%	0.151	S	C	.	.	S	Bend	trans	-68.6	101.9	169.4	-66.3	-174.9	151.6	0	0	110.1	T106 Q113 R265	T106-E110 WeakPolarHBondContact CB-O 3.43Å; T106-E110 WeakPolarHBondContact CG2-O 3.15Å; E110-Q113 HydrophobicContact CB-CB 4.42Å; E110-Q113 VanDerWaalsContact O-CB 3.31Å; E110-Q113 WeakPolarHBondContact O-CB 3.32Å; E110-Q113 PolarHBondContact OE2-NE2 3.06Å; E110-R265 IonicContact OE2-NH2 2.68Å; E110-R265 PolarHBondContact OE2-NH2 3.2Å
111	Q	94.8	Very high	97	Very high	135 Å²	135	35.2 Å²	35.2	63%	0.631	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	161.5	177.6	-67.3	-173.2	-38	0	0	111.7	G109 Q113	G109-Q111 PolarHBondContact O-N 3.12Å; G109-Q111 VanDerWaalsContact O-N 3.11Å; Q111-Q113 PolarHBondContact O-N 2.75Å; Q111-Q113 VanDerWaalsContact O-N 3.16Å
112	D	97.4	Very high	96.7	Very high	50 Å²	50	36.6 Å²	36.6	27%	0.267	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	26.9	-176.9	-47.9	-59	0	0	0	113.4	V71 P73	V71-D112 WeakPolarHBondContact CA-O 3.29Å; V71-D112 WeakPolarHBondContact CB-O 3.29Å; V71-D112 PolarHBondContact N-O 3.44Å; P73-D112 HydrophobicContact CG-CB 4.42Å; P73-D112 WeakPolarHBondContact CG-OD2 3.45Å
113	Q	98.3	Very high	96.5	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.019	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	125.1	178.1	-175.9	-177.4	79.7	0	0	111.8	H69 N70 T106 E110 Q111	H69-Q113 WeakPolarHBondContact O-CA 3.33Å; N70-Q113 VanDerWaalsContact OD1-CG 3.3Å; N70-Q113 WeakPolarHBondContact OD1-CG 3.24Å; N70-Q113 PolarHBondContact OD1-NE2 3.32Å; T106-Q113 WeakPolarHBondContact CB-O 3.43Å; T106-Q113 PolarHBondContact N-O 3.22Å; T106-Q113 PolarHBondContact OG1-O 3.4Å; E110-Q113 HydrophobicContact CB-CB 4.42Å; E110-Q113 VanDerWaalsContact O-CB 3.31Å; E110-Q113 WeakPolarHBondContact O-CB 3.32Å; E110-Q113 PolarHBondContact OE2-NE2 3.06Å; Q111-Q113 PolarHBondContact O-N 2.75Å; Q111-Q113 VanDerWaalsContact O-N 3.16Å
114	A	98.4	Very high	96.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	138.6	168.3	0	0	0	0	0	111.1	H69 Y79 W104	H69-A114 HydrophobicContact CB-CB 4.47Å; H69-A114 PolarHBondContact N-O 3.17Å; H69-A114 PolarHBondContact O-N 3.03Å; Y79-A114 HydrophobicContact CD1-CB 4.36Å; Y79-A114 HydrophobicContact CE1-CB 3.48Å; Y79-A114 VanDerWaalsContact CE1-CB 3.48Å; W104-A114 CarbonylContact O-C 3.49Å; W104-A114 VanDerWaalsContact O-CA 3.31Å; W104-A114 WeakPolarHBondContact O-CA 3.46Å
115	V	98.6	Very high	96.2	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.3	177	-175.2	0	0	0	0	109.2	I66 Q67 F68 T103 W104 L179 M267	I66-V115 HydrophobicContact CD1-CG1 4.06Å; I66-V115 HydrophobicContact CG1-CG1 3.99Å; Q67-V115 CarbonylContact O-C 3.56Å; Q67-V115 VanDerWaalsContact O-CA 3.28Å; Q67-V115 WeakPolarHBondContact O-CA 3.32Å; F68-V115 HydrophobicContact CD1-CG1 4.38Å; F68-V115 HydrophobicContact CD1-CG2 3.82Å; F68-V115 HydrophobicContact CE1-CG1 4.17Å; F68-V115 HydrophobicContact CE1-CG2 4.06Å; T103-V115 WeakPolarHBondContact CA-O 3.14Å; W104-V115 PolarHBondContact N-O 2.96Å; W104-V115 PolarHBondContact O-N 2.78Å; V115-L179 HydrophobicContact CG1-CD2 4.35Å; V115-M267 HydrophobicContact CB-SD 3.96Å; V115-M267 HydrophobicContact CG1-SD 4.33Å; V115-M267 HydrophobicContact CG2-SD 3.8Å
116	H	98.6	Very high	96	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	130.6	178.5	-50.7	-80.9	0	0	0	109.7	I66 Q67 H69 Y79 L87 T103	I66-H116 CarbonylContact C-O 3.4Å; I66-H116 WeakPolarHBondContact CA-O 3.41Å; Q67-H116 HydrophobicContact CB-CB 4.21Å; Q67-H116 HydrophobicContact CG-CB 4.49Å; Q67-H116 PolarHBondContact N-O 2.96Å; Q67-H116 PolarHBondContact O-N 3.45Å; H69-H116 AromaticContact ND1-CD2 3.81Å; H69-H116 AromaticContact ND1-NE2 3.86Å; Y79-H116 AromaticContact CZ-NE2 3.97Å; Y79-H116 PolarHBondContact OH-NE2 3.38Å; L87-H116 WeakPolarHBondContact CD1-ND1 3.47Å; T103-H116 WeakPolarHBondContact CB-ND1 3.48Å; T103-H116 PolarHBondContact OG1-CE1 2.99Å; T103-H116 PolarHBondContact OG1-ND1 3.04Å
117	L	98.5	Very high	96	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	121.6	175.2	-175.9	63.8	0	0	0	109.3	Y64 I66 V101 G102 W104 F213 L226	Y64-L117 HydrophobicContact CD1-CD1 4.23Å; Y64-L117 HydrophobicContact CD1-CG 4.37Å; I66-L117 HydrophobicContact CB-CD1 4.03Å; I66-L117 HydrophobicContact CG1-CD1 4.45Å; V101-L117 WeakPolarHBondContact CA-O 3.06Å; V101-L117 HydrophobicContact CB-CB 4.15Å; V101-L117 HydrophobicContact CB-CD2 4Å; V101-L117 HydrophobicContact CB-CG 3.9Å; V101-L117 WeakPolarHBondContact CB-O 3.31Å; V101-L117 HydrophobicContact CG1-CD2 3.73Å; V101-L117 HydrophobicContact CG1-CG 4.22Å; V101-L117 HydrophobicContact CG2-CG 4.28Å; V101-L117 PolarHBondContact N-O 2.81Å; G102-L117 PolarHBondContact N-O 3.42Å; G102-L117 PolarHBondContact O-N 3.16Å; W104-L117 HydrophobicContact CH2-CB 4.21Å; W104-L117 HydrophobicContact CZ3-CB 3.88Å; L117-F213 HydrophobicContact CD2-CE2 4.07Å; L117-F213 HydrophobicContact CD2-CZ 3.84Å; L117-L226 HydrophobicContact CD2-CD2 4.4Å
118	W	98.1	Very high	95.9	Very high	10 Å²	10	44.3 Å²	44.3	4%	0.038	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	146.7	177	-68	84.5	0	0	0	110.5	Y64 K65 L87 I90 H91 C98 E99 L100 Y120	Y64-W118 CarbonylContact C-O 3.51Å; Y64-W118 VanDerWaalsContact CA-O 3.23Å; Y64-W118 WeakPolarHBondContact CA-O 3.15Å; K65-W118 HydrophobicContact CB-CB 4.36Å; K65-W118 PolarHBondContact N-O 3.33Å; K65-W118 PolarHBondContact O-N 2.79Å; L87-W118 HydrophobicContact CB-CH2 4.33Å; L87-W118 HydrophobicContact CB-CZ2 4.06Å; L87-W118 HydrophobicContact CD2-CZ2 3.77Å; L87-W118 HydrophobicContact CG-CZ2 4.35Å; I90-W118 HydrophobicContact CB-CH2 4.12Å; I90-W118 HydrophobicContact CG2-CH2 3.99Å; I90-W118 HydrophobicContact CG2-CZ3 4.04Å; H91-W118 HydrophobicContact CB-CZ3 4.47Å; C98-W118 HydrophobicContact CB-CE3 4.44Å; E99-W118 CarbonylContact O-C 3.49Å; E99-W118 WeakPolarHBondContact O-CA 3.32Å; L100-W118 HydrophobicContact CB-CD2 4.49Å; L100-W118 HydrophobicContact CB-CE3 4.1Å; L100-W118 HydrophobicContact CB-CH2 3.89Å; L100-W118 HydrophobicContact CB-CZ2 4.29Å; L100-W118 HydrophobicContact CB-CZ3 3.79Å; L100-W118 HydrophobicContact CD1-CD2 4.07Å; L100-W118 HydrophobicContact CD1-CH2 4.21Å; L100-W118 HydrophobicContact CD1-CZ2 3.72Å; L100-W118 HydrophobicContact CG-CH2 4.49Å; L100-W118 HydrophobicContact CG-CZ2 4.45Å; W118-Y120 HydrophobicContact CB-CE2 3.81Å
119	R	96.9	Very high	95.9	Very high	19 Å²	19	42.9 Å²	42.9	7%	0.072	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	139.7	172.7	173.3	164.3	63.4	-173.6	4.4	110.2	Y64 C98 E99 V101 R121 E167	Y64-R119 HydrophobicContact CD1-CB 3.96Å; Y64-R119 HydrophobicContact CD1-CG 4.47Å; Y64-R119 HydrophobicContact CE1-CB 3.8Å; Y64-R119 HydrophobicContact CE1-CG 4.04Å; Y64-R119 PolarHBondContact OH-NH1 3.39Å; C98-R119 CarbonylContact C-O 3.51Å; C98-R119 WeakPolarHBondContact CA-O 3.42Å; E99-R119 HydrophobicContact CB-CB 4.37Å; E99-R119 PolarHBondContact N-O 3.49Å; E99-R119 PolarHBondContact O-N 3.32Å; E99-R119 IonicContact OE2-CZ 3.71Å; E99-R119 IonicContact OE2-NE 2.65Å; E99-R119 PolarHBondContact OE2-NE 3.23Å; E99-R119 IonicContact OE2-NH2 3.98Å; E99-R119 PolarHBondContact OE2-NH2 3.5Å; V101-R119 HydrophobicContact CG2-CB 3.62Å; R119-R121 VanDerWaalsContact CZ-NH2 3.31Å; R119-R121 VanDerWaalsContact NH2-NH2 3.18Å; R119-E167 IonicContact CZ-OE2 2.61Å; R119-E167 IonicContact NH1-OE1 3.87Å; R119-E167 IonicContact NH1-OE2 2.76Å; R119-E167 PolarHBondContact NH1-OE2 2.93Å; R119-E167 IonicContact NH2-OE2 3.14Å
120	Y	96.2	Very high	96	Very high	3 Å²	3	40.6 Å²	40.6	1%	0.012	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	105.5	176.3	-59.5	-88.3	0	0	0	108.4	L63 K65 C98 W118 G123 L127 V130	L63-Y120 PolarHBondContact N-O 3.05Å; L63-Y120 VanDerWaalsContact N-O 3.08Å; L63-Y120 PolarHBondContact O-N 2.93Å; K65-Y120 HydrophobicContact CB-CE2 3.77Å; K65-Y120 HydrophobicContact CD-CE2 4.48Å; K65-Y120 WeakPolarHBondContact CE-OH 3.28Å; K65-Y120 PolarHBondContact NZ-OH 3.23Å; C98-Y120 HydrophobicContact CB-CD1 3.48Å; C98-Y120 VanDerWaalsContact CB-CD1 3.48Å; C98-Y120 HydrophobicContact CB-CE1 3.36Å; C98-Y120 HydrophobicContact CB-CG 4.36Å; W118-Y120 HydrophobicContact CB-CE2 3.81Å; Y120-G123 PolarHBondContact O-N 2.9Å; Y120-L127 HydrophobicContact CD1-CB 4.09Å; Y120-L127 HydrophobicContact CD1-CD1 4.15Å; Y120-L127 HydrophobicContact CD2-CB 4.35Å; Y120-L127 HydrophobicContact CD2-CD1 4.05Å; Y120-L127 HydrophobicContact CE1-CB 4.5Å; Y120-L127 HydrophobicContact CE1-CD1 3.73Å; Y120-L127 HydrophobicContact CE2-CD1 3.64Å; Y120-L127 HydrophobicContact CG-CB 4.01Å; Y120-L127 HydrophobicContact CG-CD1 4.3Å; Y120-L127 VanDerWaalsContact CZ-CD1 3.47Å; Y120-V130 HydrophobicContact CD1-CB 4.48Å; Y120-V130 HydrophobicContact CD1-CG2 4.22Å; Y120-V130 HydrophobicContact CE1-CB 4.04Å; Y120-V130 HydrophobicContact CE1-CG1 4.01Å; Y120-V130 HydrophobicContact CE1-CG2 4.16Å
121	R	90.8	Very high	96.2	Very high	98 Å²	98	39.1 Å²	39.1	37%	0.37	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	127.7	174.4	-65.4	-170.1	-178.6	-89	1.7	108.5	E99 R119 A126 E167	E99-R121 IonicContact OE1-CZ 2.77Å; E99-R121 IonicContact OE1-NE 3.17Å; E99-R121 PolarHBondContact OE1-NE 2.84Å; E99-R121 IonicContact OE1-NH2 2.74Å; R119-R121 VanDerWaalsContact CZ-NH2 3.31Å; R119-R121 VanDerWaalsContact NH2-NH2 3.18Å; R121-A126 WeakPolarHBondContact O-CB 3.5Å; R121-E167 IonicContact NH2-OE2 3.58Å
122	G	90.4	Very high	96.3	Very high	39 Å²	39	36 Å²	36	40%	0.402	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.4	13	-170.2	0	0	0	0	0	114.2	P125	G122-P125 WeakPolarHBondContact O-CD 3.48Å
123	G	92.9	Very high	96.3	Very high	11 Å²	11	36.9 Å²	36.9	11%	0.113	19%	0.194	C	C	.	.	H	α-helix	trans	68.3	-142.9	163	0	0	0	0	0	115.7	N61 Y120 A126 L127	N61-G123 WeakPolarHBondContact O-CA 3.46Å; N61-G123 PolarHBondContact O-N 3.37Å; Y120-G123 PolarHBondContact O-N 2.9Å; G123-A126 PolarHBondContact O-N 2.89Å; G123-L127 PolarHBondContact O-N 2.86Å; G123-L127 VanDerWaalsContact O-N 3.11Å
124	Y	94.3	Very high	96.3	Very high	102 Å²	102	37.1 Å²	37.1	40%	0.4	20%	0.195	S	C	.	.	H	α-helix	trans	-59.6	-40	-179.4	-65.9	-76.6	0	0	0	114.4	L63 L127 T128 L158 I217	L63-Y124 HydrophobicContact CD1-CE1 4.18Å; L63-Y124 HydrophobicContact CD2-CD1 3.64Å; L63-Y124 HydrophobicContact CD2-CE1 3.91Å; L63-Y124 HydrophobicContact CD2-CG 4.06Å; Y124-L127 PolarHBondContact O-N 2.75Å; Y124-T128 WeakPolarHBondContact O-CB 3.5Å; Y124-T128 PolarHBondContact O-N 2.95Å; Y124-T128 PolarHBondContact O-OG1 3.44Å; Y124-L158 HydrophobicContact CD1-CD1 4.4Å; Y124-L158 HydrophobicContact CE1-CD1 3.89Å; Y124-I217 HydrophobicContact CE1-CD1 4.06Å
125	P	95.1	Very high	96.2	Very high	96 Å²	96	44 Å²	44	62%	0.623	22%	0.222	S	C	*	.	H	α-helix	trans	-55.9	-50.3	173.2	-28.8	35.3	0	0	0	113.4	G122 L127 T128 E129	G122-P125 WeakPolarHBondContact O-CD 3.48Å; P125-L127 PolarHBondContact O-N 2.81Å; P125-T128 WeakPolarHBondContact O-CB 3.46Å; P125-T128 PolarHBondContact O-N 2.86Å; P125-T128 VanDerWaalsContact O-N 3.11Å; P125-E129 PolarHBondContact O-N 2.88Å
126	A	95.8	Very high	96.1	Very high	8 Å²	8	51.9 Å²	51.9	7%	0.066	26%	0.258	C	S	.	.	H	α-helix	trans	-61.8	-44	179.4	0	0	0	0	0	111.9	P97 R121 G123 T128 E129 V130	P97-A126 HydrophobicContact CG-CB 4.34Å; R121-A126 WeakPolarHBondContact O-CB 3.5Å; G123-A126 PolarHBondContact O-N 2.89Å; A126-T128 VanDerWaalsContact C-N 3.32Å; A126-T128 PolarHBondContact O-N 3.25Å; A126-E129 PolarHBondContact O-N 2.92Å; A126-V130 VanDerWaalsContact O-CG2 3.31Å; A126-V130 WeakPolarHBondContact O-CG2 3.5Å; A126-V130 PolarHBondContact O-N 2.86Å
127	L	96.6	Very high	96	Very high	19 Å²	19	54.4 Å²	54.4	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-56.7	-46.3	172.6	171.2	64.9	0	0	0	111.6	L63 Y120 G123 Y124 P125 V130 M131 L158	L63-L127 HydrophobicContact CD2-CB 4.11Å; L63-L127 HydrophobicContact CD2-CD2 3.71Å; Y120-L127 HydrophobicContact CD1-CB 4.09Å; Y120-L127 HydrophobicContact CD1-CD1 4.15Å; Y120-L127 HydrophobicContact CD2-CB 4.35Å; Y120-L127 HydrophobicContact CD2-CD1 4.05Å; Y120-L127 HydrophobicContact CE1-CB 4.5Å; Y120-L127 HydrophobicContact CE1-CD1 3.73Å; Y120-L127 HydrophobicContact CE2-CD1 3.64Å; Y120-L127 HydrophobicContact CG-CB 4.01Å; Y120-L127 HydrophobicContact CG-CD1 4.3Å; Y120-L127 VanDerWaalsContact CZ-CD1 3.47Å; G123-L127 PolarHBondContact O-N 2.86Å; G123-L127 VanDerWaalsContact O-N 3.11Å; Y124-L127 PolarHBondContact O-N 2.75Å; P125-L127 PolarHBondContact O-N 2.81Å; L127-V130 PolarHBondContact O-N 2.93Å; L127-M131 HydrophobicContact CD1-CG 3.8Å; L127-M131 HydrophobicContact CD1-SD 4.41Å; L127-M131 HydrophobicContact CG-CG 4.37Å; L127-M131 WeakPolarHBondContact O-CB 3.27Å; L127-M131 WeakPolarHBondContact O-CG 3.47Å; L127-M131 PolarHBondContact O-N 2.93Å; L127-L158 HydrophobicContact CD2-CD1 3.72Å; L127-L158 HydrophobicContact CD2-CD2 3.68Å; L127-L158 HydrophobicContact CD2-CG 4.39Å
128	T	96.6	Very high	95.9	Very high	75 Å²	75	63.1 Å²	63.1	46%	0.46	31%	0.309	S	S	.	.	H	α-helix	trans	-64.2	-43.8	-177.7	-58.8	0	0	0	0	111.2	Y124 P125 A126 M131 N132	Y124-T128 WeakPolarHBondContact O-CB 3.5Å; Y124-T128 PolarHBondContact O-N 2.95Å; Y124-T128 PolarHBondContact O-OG1 3.44Å; P125-T128 WeakPolarHBondContact O-CB 3.46Å; P125-T128 PolarHBondContact O-N 2.86Å; P125-T128 VanDerWaalsContact O-N 3.11Å; A126-T128 VanDerWaalsContact C-N 3.32Å; A126-T128 PolarHBondContact O-N 3.25Å; T128-M131 PolarHBondContact O-N 3.39Å; T128-N132 WeakPolarHBondContact O-CB 3.36Å; T128-N132 PolarHBondContact O-N 3.04Å; T128-N132 PolarHBondContact O-ND2 2.89Å
129	E	97	Very high	95.8	Very high	87 Å²	87	64.9 Å²	64.9	41%	0.407	33%	0.331	S	S	.	.	H	α-helix	trans	-58.3	-53.3	175.5	-177	-177.1	165.2	0	0	111.5	P125 A126 M131 N132 K133	P125-E129 PolarHBondContact O-N 2.88Å; A126-E129 PolarHBondContact O-N 2.92Å; E129-M131 VanDerWaalsContact C-N 3.32Å; E129-M131 PolarHBondContact O-N 2.93Å; E129-N132 PolarHBondContact O-N 2.87Å; E129-K133 HydrophobicContact CG-CD 4.29Å; E129-K133 PolarHBondContact O-N 3.3Å; E129-K133 WeakPolarHBondContact OE1-CE 3.33Å; E129-K133 IonicContact OE1-NZ 3.66Å; E129-K133 PolarHBondContact OE1-NZ 2.87Å
130	V	97.6	Very high	95.8	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-56.4	-48.1	178.4	171.8	0	0	0	0	110.6	Y96 P97 C98 Y120 A126 L127 N132 K133 L134	Y96-V130 HydrophobicContact CD1-CG1 4.22Å; P97-V130 VanDerWaalsContact CD-CG2 3.47Å; P97-V130 HydrophobicContact CG-CG2 3.81Å; C98-V130 HydrophobicContact CB-CG2 4.12Å; Y120-V130 HydrophobicContact CD1-CB 4.48Å; Y120-V130 HydrophobicContact CD1-CG2 4.22Å; Y120-V130 HydrophobicContact CE1-CB 4.04Å; Y120-V130 HydrophobicContact CE1-CG1 4.01Å; Y120-V130 HydrophobicContact CE1-CG2 4.16Å; A126-V130 VanDerWaalsContact O-CG2 3.31Å; A126-V130 WeakPolarHBondContact O-CG2 3.5Å; A126-V130 PolarHBondContact O-N 2.86Å; L127-V130 PolarHBondContact O-N 2.93Å; V130-N132 PolarHBondContact O-N 3.07Å; V130-K133 PolarHBondContact O-N 2.8Å; V130-L134 HydrophobicContact CG1-CD1 3.66Å; V130-L134 HydrophobicContact CG1-CG 4.1Å; V130-L134 WeakPolarHBondContact O-CB 3.31Å; V130-L134 VanDerWaalsContact O-CG 3.29Å; V130-L134 WeakPolarHBondContact O-CG 3.14Å; V130-L134 PolarHBondContact O-N 2.89Å
131	M	97	Very high	95.9	Very high	59 Å²	59	67.8 Å²	67.8	29%	0.291	35%	0.345	S	S	.	.	H	α-helix	trans	-66.3	-25.2	-179.4	-67.3	-55.9	-54	0	0	113.2	L127 T128 E129 R135	L127-M131 HydrophobicContact CD1-CG 3.8Å; L127-M131 HydrophobicContact CD1-SD 4.41Å; L127-M131 HydrophobicContact CG-CG 4.37Å; L127-M131 WeakPolarHBondContact O-CB 3.27Å; L127-M131 WeakPolarHBondContact O-CG 3.47Å; L127-M131 PolarHBondContact O-N 2.93Å; T128-M131 PolarHBondContact O-N 3.39Å; E129-M131 VanDerWaalsContact C-N 3.32Å; E129-M131 PolarHBondContact O-N 2.93Å; M131-R135 WeakPolarHBondContact O-CG 3.48Å; M131-R135 PolarHBondContact O-N 3.24Å; M131-R135 PolarHBondContact O-NE 2.77Å
132	N	97.8	Very high	96.3	Very high	71 Å²	71	67.7 Å²	67.7	38%	0.38	35%	0.352	S	S	.	.	H	α-helix	trans	-78	-45	174.3	-71.8	-15.5	0	0	0	111.4	T128 E129 V130 R135	T128-N132 WeakPolarHBondContact O-CB 3.36Å; T128-N132 PolarHBondContact O-N 3.04Å; T128-N132 PolarHBondContact O-ND2 2.89Å; E129-N132 PolarHBondContact O-N 2.87Å; V130-N132 PolarHBondContact O-N 3.07Å; N132-R135 WeakPolarHBondContact O-CB 3.42Å; N132-R135 PolarHBondContact O-N 2.82Å; N132-R135 PolarHBondContact OD1-NH2 3.2Å
133	K	97.7	Very high	96.6	Very high	68 Å²	68	66 Å²	66	30%	0.296	33%	0.334	S	S	.	.	H	α-helix	trans	-62.1	-47	175.8	-67.7	-179.6	177.8	174.7	0	111.5	E95 Y96 E129 V130 R135 Q136 N137	E95-K133 WeakPolarHBondContact O-CD 3.29Å; E95-K133 PolarHBondContact O-NZ 3.37Å; Y96-K133 HydrophobicContact CD1-CB 4.1Å; Y96-K133 HydrophobicContact CD1-CD 4.43Å; Y96-K133 HydrophobicContact CE1-CB 3.65Å; Y96-K133 HydrophobicContact CE1-CD 4.5Å; E129-K133 HydrophobicContact CG-CD 4.29Å; E129-K133 PolarHBondContact O-N 3.3Å; E129-K133 WeakPolarHBondContact OE1-CE 3.33Å; E129-K133 IonicContact OE1-NZ 3.66Å; E129-K133 PolarHBondContact OE1-NZ 2.87Å; V130-K133 PolarHBondContact O-N 2.8Å; K133-R135 PolarHBondContact O-N 3.47Å; K133-Q136 PolarHBondContact O-N 3.28Å; K133-N137 PolarHBondContact O-N 2.88Å; K133-N137 VanDerWaalsContact O-N 3.15Å
134	L	97.3	Very high	96.8	Very high	8 Å²	8	70.6 Å²	70.6	4%	0.042	35%	0.348	C	S	.	.	H	α-helix	trans	-59.7	-31.3	177.7	-73.4	177.6	0	0	0	112.9	I90 Y96 V130 Q136 N137 F140	I90-L134 HydrophobicContact CD1-CD2 4.12Å; I90-L134 HydrophobicContact CG1-CD2 4.19Å; I90-L134 HydrophobicContact CG2-CD2 4.34Å; Y96-L134 HydrophobicContact CD1-CD2 4.09Å; Y96-L134 HydrophobicContact CD1-CG 4.14Å; Y96-L134 HydrophobicContact CE1-CD2 3.62Å; Y96-L134 HydrophobicContact CE1-CG 3.89Å; Y96-L134 HydrophobicContact CE2-CD2 4.26Å; V130-L134 HydrophobicContact CG1-CD1 3.66Å; V130-L134 HydrophobicContact CG1-CG 4.1Å; V130-L134 WeakPolarHBondContact O-CB 3.31Å; V130-L134 VanDerWaalsContact O-CG 3.29Å; V130-L134 WeakPolarHBondContact O-CG 3.14Å; V130-L134 PolarHBondContact O-N 2.89Å; L134-Q136 PolarHBondContact O-N 3.24Å; L134-N137 PolarHBondContact O-N 3.25Å; L134-F140 HydrophobicContact CB-CD1 3.74Å; L134-F140 HydrophobicContact CB-CE1 3.87Å; L134-F140 HydrophobicContact CB-CG 4.17Å; L134-F140 HydrophobicContact CB-CZ 4.4Å; L134-F140 HydrophobicContact CD1-CE1 4.33Å; L134-F140 HydrophobicContact CD1-CE2 4.17Å; L134-F140 HydrophobicContact CD1-CZ 4.03Å; L134-F140 HydrophobicContact CD2-CB 4.2Å; L134-F140 HydrophobicContact CD2-CD1 4.31Å; L134-F140 HydrophobicContact CD2-CD2 3.9Å; L134-F140 HydrophobicContact CD2-CE2 4.31Å; L134-F140 HydrophobicContact CD2-CG 3.86Å; L134-F140 HydrophobicContact CG-CD1 4.47Å; L134-F140 HydrophobicContact CG-CG 4.49Å; L134-F140 VanDerWaalsContact O-CD1 3.29Å; L134-F140 WeakPolarHBondContact O-CD1 3.28Å
135	R	96.6	Very high	97	Very high	146 Å²	146	70 Å²	70	55%	0.551	35%	0.352	S	S	*	.	H	α-helix	trans	-67.9	-23.3	175.3	-85.2	-176.7	-94.5	-174.6	-4.2	113.6	M131 N132 K133	M131-R135 WeakPolarHBondContact O-CG 3.48Å; M131-R135 PolarHBondContact O-N 3.24Å; M131-R135 PolarHBondContact O-NE 2.77Å; N132-R135 WeakPolarHBondContact O-CB 3.42Å; N132-R135 PolarHBondContact O-N 2.82Å; N132-R135 PolarHBondContact OD1-NH2 3.2Å; K133-R135 PolarHBondContact O-N 3.47Å
136	Q	96.8	Very high	97.2	Very high	165 Å²	165	68.5 Å²	68.5	77%	0.771	34%	0.336	S	S	*	.	H	α-helix	trans	-93.4	-16.8	177.3	-61.4	177.3	0.7	0	0	112.1	K133 L134 K138	K133-Q136 PolarHBondContact O-N 3.28Å; L134-Q136 PolarHBondContact O-N 3.24Å; Q136-K138 PolarHBondContact O-N 2.84Å
137	N	96.8	Very high	97.3	Very high	55 Å²	55	68.9 Å²	68.9	29%	0.294	34%	0.336	S	S	.	.			trans	-75.5	110.1	177.6	-176.3	-39.5	0	0	0	111.2	Y96 K133 L134 G139 F140 M141	Y96-N137 PolarHBondContact OH-ND2 2.95Å; K133-N137 PolarHBondContact O-N 2.88Å; K133-N137 VanDerWaalsContact O-N 3.15Å; L134-N137 PolarHBondContact O-N 3.25Å; N137-G139 VanDerWaalsContact C-N 3.34Å; N137-G139 PolarHBondContact O-N 2.72Å; N137-G139 WeakPolarHBondContact OD1-CA 3.4Å; N137-G139 PolarHBondContact OD1-N 2.65Å; N137-F140 HydrophobicContact CB-CB 3.98Å; N137-F140 PolarHBondContact O-N 3.28Å; N137-F140 PolarHBondContact OD1-N 3.07Å; N137-M141 WeakPolarHBondContact O-CG 3.41Å; N137-M141 PolarHBondContact O-N 3.36Å
138	K	96.6	Very high	97.4	Very high	186 Å²	186	69.6 Å²	69.6	81%	0.809	35%	0.348	S	S	*	.	H	α-helix	trans	-60.7	-38.9	-179.6	-67.3	-177.1	179.8	178	0	113.4	Q136 M141 N142	Q136-K138 PolarHBondContact O-N 2.84Å; K138-M141 PolarHBondContact O-N 2.87Å; K138-N142 PolarHBondContact O-N 2.83Å
139	G	95.9	Very high	97.4	Very high	47 Å²	47	71.7 Å²	71.7	49%	0.485	35%	0.351	S	S	.	.	H	α-helix	trans	-64	-44.2	177.9	0	0	0	0	0	111.7	N137 M141 N142 Y143	N137-G139 VanDerWaalsContact C-N 3.34Å; N137-G139 PolarHBondContact O-N 2.72Å; N137-G139 WeakPolarHBondContact OD1-CA 3.4Å; N137-G139 PolarHBondContact OD1-N 2.65Å; G139-M141 VanDerWaalsContact C-N 3.35Å; G139-M141 PolarHBondContact O-N 3.31Å; G139-N142 PolarHBondContact O-N 2.94Å; G139-Y143 WeakPolarHBondContact O-CB 3.23Å; G139-Y143 PolarHBondContact O-N 2.68Å
140	F	96.9	Very high	97.5	Very high	27 Å²	27	69 Å²	69	12%	0.118	34%	0.338	C	S	.	.	H	α-helix	trans	-64.5	-38.4	174.7	-178.6	-100.6	0	0	0	112.8	I90 L134 N137 Y143 R144	I90-F140 HydrophobicContact CD1-CD2 3.57Å; I90-F140 HydrophobicContact CD1-CE2 3.69Å; L134-F140 HydrophobicContact CB-CD1 3.74Å; L134-F140 HydrophobicContact CB-CE1 3.87Å; L134-F140 HydrophobicContact CB-CG 4.17Å; L134-F140 HydrophobicContact CB-CZ 4.4Å; L134-F140 HydrophobicContact CD1-CE1 4.33Å; L134-F140 HydrophobicContact CD1-CE2 4.17Å; L134-F140 HydrophobicContact CD1-CZ 4.03Å; L134-F140 HydrophobicContact CD2-CB 4.2Å; L134-F140 HydrophobicContact CD2-CD1 4.31Å; L134-F140 HydrophobicContact CD2-CD2 3.9Å; L134-F140 HydrophobicContact CD2-CE2 4.31Å; L134-F140 HydrophobicContact CD2-CG 3.86Å; L134-F140 HydrophobicContact CG-CD1 4.47Å; L134-F140 HydrophobicContact CG-CG 4.49Å; L134-F140 VanDerWaalsContact O-CD1 3.29Å; L134-F140 WeakPolarHBondContact O-CD1 3.28Å; N137-F140 HydrophobicContact CB-CB 3.98Å; N137-F140 PolarHBondContact O-N 3.28Å; N137-F140 PolarHBondContact OD1-N 3.07Å; F140-Y143 AromaticContact CD2-CD1 3.85Å; F140-Y143 HydrophobicContact CD2-CD1 3.85Å; F140-Y143 HydrophobicContact CD2-CE1 4.42Å; F140-Y143 AromaticContact CE2-CD1 3.83Å; F140-Y143 HydrophobicContact CE2-CD1 3.83Å; F140-Y143 AromaticContact CE2-CE1 3.97Å; F140-Y143 HydrophobicContact CE2-CE1 3.97Å; F140-Y143 WeakPolarHBondContact O-CB 3.26Å; F140-Y143 PolarHBondContact O-N 3.11Å; F140-R144 VanDerWaalsContact O-CB 3.32Å; F140-R144 WeakPolarHBondContact O-CB 3.16Å; F140-R144 PolarHBondContact O-N 3.17Å
141	M	97.9	Very high	97.6	Very high	56 Å²	56	69.9 Å²	69.9	28%	0.276	34%	0.343	S	S	.	.	H	α-helix	trans	-65.3	-42.4	177.3	-69	-58.4	-63.9	0	0	111.4	N137 K138 G139 R144 D145	N137-M141 WeakPolarHBondContact O-CG 3.41Å; N137-M141 PolarHBondContact O-N 3.36Å; K138-M141 PolarHBondContact O-N 2.87Å; G139-M141 VanDerWaalsContact C-N 3.35Å; G139-M141 PolarHBondContact O-N 3.31Å; M141-R144 WeakPolarHBondContact O-CB 3.24Å; M141-R144 PolarHBondContact O-N 3.13Å; M141-D145 PolarHBondContact O-N 2.78Å
142	N	97.9	Very high	97.6	Very high	97 Å²	97	72.8 Å²	72.8	52%	0.519	36%	0.359	S	S	.	.	H	α-helix	trans	-60.2	-48.4	172.6	-174	64.8	0	0	0	111.9	K138 G139 R144 D145 E146	K138-N142 PolarHBondContact O-N 2.83Å; G139-N142 PolarHBondContact O-N 2.94Å; N142-R144 VanDerWaalsContact C-N 3.28Å; N142-R144 PolarHBondContact O-N 3.26Å; N142-D145 PolarHBondContact O-N 2.9Å; N142-D145 VanDerWaalsContact O-N 3.15Å; N142-E146 PolarHBondContact O-N 2.77Å
143	Y	97.8	Very high	97.7	Very high	4 Å²	4	72.2 Å²	72.2	2%	0.016	36%	0.361	C	S	.	.	H	α-helix	trans	-52.7	-46.5	172.8	159.5	-100.1	0	0	0	112.2	L82 C83 V86 G139 F140 D145 R147	L82-Y143 HydrophobicContact CD1-CD2 3.83Å; L82-Y143 HydrophobicContact CD2-CD2 4.04Å; L82-Y143 HydrophobicContact CD2-CE2 4.25Å; L82-Y143 HydrophobicContact CG-CD2 3.6Å; L82-Y143 HydrophobicContact CG-CE2 3.84Å; C83-Y143 PolarHBondContact SG-OH 3.32Å; V86-Y143 HydrophobicContact CB-CD2 3.63Å; V86-Y143 HydrophobicContact CB-CE2 3.99Å; V86-Y143 HydrophobicContact CB-CG 3.99Å; V86-Y143 HydrophobicContact CG1-CD1 3.9Å; V86-Y143 HydrophobicContact CG1-CD2 3.82Å; V86-Y143 HydrophobicContact CG1-CE1 4.34Å; V86-Y143 HydrophobicContact CG1-CE2 4.28Å; V86-Y143 HydrophobicContact CG1-CG 3.63Å; V86-Y143 HydrophobicContact CG2-CD2 3.59Å; V86-Y143 HydrophobicContact CG2-CE2 4.36Å; V86-Y143 HydrophobicContact CG2-CG 3.96Å; G139-Y143 WeakPolarHBondContact O-CB 3.23Å; G139-Y143 PolarHBondContact O-N 2.68Å; F140-Y143 AromaticContact CD2-CD1 3.85Å; F140-Y143 HydrophobicContact CD2-CD1 3.85Å; F140-Y143 HydrophobicContact CD2-CE1 4.42Å; F140-Y143 AromaticContact CE2-CD1 3.83Å; F140-Y143 HydrophobicContact CE2-CD1 3.83Å; F140-Y143 AromaticContact CE2-CE1 3.97Å; F140-Y143 HydrophobicContact CE2-CE1 3.97Å; F140-Y143 WeakPolarHBondContact O-CB 3.26Å; F140-Y143 PolarHBondContact O-N 3.11Å; Y143-D145 VanDerWaalsContact C-N 3.27Å; Y143-D145 PolarHBondContact O-N 3.17Å; Y143-R147 HydrophobicContact CE2-CB 4.45Å; Y143-R147 WeakPolarHBondContact O-CB 3.36Å; Y143-R147 PolarHBondContact O-N 2.71Å; Y143-R147 WeakPolarHBondContact OH-CD 3.35Å; Y143-R147 PolarHBondContact OH-NH1 2.99Å
144	R	97.5	Very high	97.6	Very high	106 Å²	106	74.9 Å²	74.9	40%	0.4	37%	0.369	S	S	.	.	H	α-helix	trans	-60.9	-39.6	-178.8	167.2	-179.8	173.1	173.2	-0.5	111.4	F140 M141 N142 G148	F140-R144 VanDerWaalsContact O-CB 3.32Å; F140-R144 WeakPolarHBondContact O-CB 3.16Å; F140-R144 PolarHBondContact O-N 3.17Å; M141-R144 WeakPolarHBondContact O-CB 3.24Å; M141-R144 PolarHBondContact O-N 3.13Å; N142-R144 VanDerWaalsContact C-N 3.28Å; N142-R144 PolarHBondContact O-N 3.26Å; R144-G148 PolarHBondContact O-N 3.13Å
145	D	98.1	Very high	97.6	Very high	91 Å²	91	78.7 Å²	78.7	49%	0.487	38%	0.383	S	S	.	.	H	α-helix	trans	-74.2	-47.8	-178.3	-69.1	-14.5	0	0	0	111.3	M141 N142 Y143 G148 K149	M141-D145 PolarHBondContact O-N 2.78Å; N142-D145 PolarHBondContact O-N 2.9Å; N142-D145 VanDerWaalsContact O-N 3.15Å; Y143-D145 VanDerWaalsContact C-N 3.27Å; Y143-D145 PolarHBondContact O-N 3.17Å; D145-G148 WeakPolarHBondContact O-CA 3.48Å; D145-G148 PolarHBondContact O-N 2.85Å; D145-K149 PolarHBondContact O-N 3.35Å
146	E	98.4	Very high	97.6	Very high	63 Å²	63	75.6 Å²	75.6	29%	0.294	38%	0.377	S	S	.	.	H	α-helix	trans	-60.4	-48.7	175.9	-68.9	-48.2	133.3	0	0	111.7	L82 N142 G148 K149	L82-E146 HydrophobicContact CD2-CB 3.9Å; N142-E146 PolarHBondContact O-N 2.77Å; E146-G148 PolarHBondContact O-N 3.4Å; E146-K149 WeakPolarHBondContact O-CB 3.29Å; E146-K149 PolarHBondContact O-N 2.92Å; E146-K149 VanDerWaalsContact O-N 3.09Å; E146-K149 IonicContact OE1-NZ 2.83Å; E146-K149 PolarHBondContact OE1-NZ 3.23Å; E146-K149 IonicContact OE2-NZ 2.78Å; E146-K149 PolarHBondContact OE2-NZ 2.68Å
147	R	98.1	Very high	97.7	Very high	16 Å²	16	67.8 Å²	67.8	6%	0.06	34%	0.341	C	S	.	.	H	α-helix	trans	-56.7	-38.4	173.9	-174.1	-160.3	57.5	-151.5	-18.4	111	Y79 L82 Y143 K149 M150 L151	Y79-R147 HydrophobicContact CD2-CG 3.83Å; Y79-R147 HydrophobicContact CE2-CG 3.45Å; Y79-R147 VanDerWaalsContact CE2-CG 3.45Å; L82-R147 HydrophobicContact CD2-CB 3.85Å; Y143-R147 HydrophobicContact CE2-CB 4.45Å; Y143-R147 WeakPolarHBondContact O-CB 3.36Å; Y143-R147 PolarHBondContact O-N 2.71Å; Y143-R147 WeakPolarHBondContact OH-CD 3.35Å; Y143-R147 PolarHBondContact OH-NH1 2.99Å; R147-K149 PolarHBondContact O-N 3.41Å; R147-M150 PolarHBondContact O-N 3.07Å; R147-M150 VanDerWaalsContact O-N 3.09Å; R147-L151 HydrophobicContact CG-CD1 3.9Å; R147-L151 HydrophobicContact CG-CG 4.39Å; R147-L151 WeakPolarHBondContact O-CD1 3.41Å; R147-L151 VanDerWaalsContact O-CG 3.27Å; R147-L151 WeakPolarHBondContact O-CG 3.08Å
148	G	98	Very high	97.7	Very high	34 Å²	34	66.4 Å²	66.4	35%	0.351	33%	0.333	S	S	.	.	H	α-helix	trans	-56.8	-35.4	179.4	0	0	0	0	0	113.5	R144 D145 E146 M150	R144-G148 PolarHBondContact O-N 3.13Å; D145-G148 WeakPolarHBondContact O-CA 3.48Å; D145-G148 PolarHBondContact O-N 2.85Å; E146-G148 PolarHBondContact O-N 3.4Å; G148-M150 PolarHBondContact O-N 2.74Å
149	K	98.4	Very high	97.7	Very high	119 Å²	119	57.5 Å²	57.5	52%	0.517	30%	0.295	S	S	.	.	H	α-helix	trans	-69.6	-23.3	179.2	-58.8	171.6	-165.4	166.9	0	112.9	K72 D145 E146 R147	K72-K149 WeakPolarHBondContact CE-O 3.35Å; K72-K149 PolarHBondContact NZ-O 3.48Å; D145-K149 PolarHBondContact O-N 3.35Å; E146-K149 WeakPolarHBondContact O-CB 3.29Å; E146-K149 PolarHBondContact O-N 2.92Å; E146-K149 VanDerWaalsContact O-N 3.09Å; E146-K149 IonicContact OE1-NZ 2.83Å; E146-K149 PolarHBondContact OE1-NZ 3.23Å; E146-K149 IonicContact OE2-NZ 2.78Å; E146-K149 PolarHBondContact OE2-NZ 2.68Å; R147-K149 PolarHBondContact O-N 3.41Å
150	M	98.8	Very high	97.7	Very high	30 Å²	30	56.7 Å²	56.7	15%	0.148	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-4.6	-175.3	-57.8	171.5	-165.7	0	0	113.4	V71 K72 C75 A78 Y79 L82 R147 G148	V71-M150 HydrophobicContact CG1-CB 4.45Å; V71-M150 VanDerWaalsContact CG1-O 3.32Å; V71-M150 WeakPolarHBondContact CG1-O 3.27Å; K72-M150 WeakPolarHBondContact CG-O 3.32Å; K72-M150 PolarHBondContact N-O 2.56Å; C75-M150 HydrophobicContact CB-CB 3.78Å; C75-M150 HydrophobicContact CB-CG 4.02Å; A78-M150 HydrophobicContact CB-CE 4.45Å; A78-M150 HydrophobicContact CB-SD 4.48Å; Y79-M150 HydrophobicContact CD2-CB 4.49Å; L82-M150 HydrophobicContact CD2-CE 3.96Å; L82-M150 HydrophobicContact CD2-SD 4.27Å; R147-M150 PolarHBondContact O-N 3.07Å; R147-M150 VanDerWaalsContact O-N 3.09Å; G148-M150 PolarHBondContact O-N 2.74Å
151	L	98.4	Very high	97.6	Very high	19 Å²	19	55.7 Å²	55.7	10%	0.099	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	141.1	-170	-66.8	168.8	0	0	0	112.8	H69 N70 V71 Y79 R147 R154	H69-L151 HydrophobicContact CB-CD2 3.76Å; N70-L151 WeakPolarHBondContact O-CA 3.49Å; N70-L151 WeakPolarHBondContact O-CD2 3.36Å; V71-L151 HydrophobicContact CB-CD2 4.49Å; V71-L151 HydrophobicContact CG2-CD2 4Å; Y79-L151 HydrophobicContact CD2-CD2 4.12Å; Y79-L151 HydrophobicContact CE2-CD2 3.77Å; Y79-L151 HydrophobicContact CE2-CG 4.46Å; R147-L151 HydrophobicContact CG-CD1 3.9Å; R147-L151 HydrophobicContact CG-CG 4.39Å; R147-L151 WeakPolarHBondContact O-CD1 3.41Å; R147-L151 VanDerWaalsContact O-CG 3.27Å; R147-L151 WeakPolarHBondContact O-CG 3.08Å; L151-R154 VanDerWaalsContact CD1-CD 3.4Å; L151-R154 HydrophobicContact CD1-CG 3.66Å
152	L	98.3	Very high	97.3	Very high	120 Å²	120	53 Å²	53	63%	0.628	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	-46.8	166.9	-66.7	172.8	0	0	0	110.7	N70 K72	N70-L152 HydrophobicContact CB-CB 4.3Å; N70-L152 PolarHBondContact O-N 2.9Å; K72-L152 HydrophobicContact CG-CD2 3.8Å; K72-L152 HydrophobicContact CG-CG 3.9Å
153	S	98.3	Very high	97	Very high	60 Å²	60	51.2 Å²	51.2	42%	0.42	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	166.7	178.8	72.8	0	0	0	0	111.9	N70	N70-S153 WeakPolarHBondContact CB-OG 3.38Å; N70-S153 PolarHBondContact N-O 3.47Å; N70-S153 PolarHBondContact ND2-OG 2.98Å; N70-S153 VanDerWaalsContact ND2-OG 3.13Å; N70-S153 PolarHBondContact O-N 3.37Å
154	R	97.6	Very high	96.6	Very high	123 Å²	123	53 Å²	53	46%	0.464	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	147.8	175.9	-66.2	-176.3	-78.1	-170	-0.4	111.8	F68 H69 L151	F68-R154 CarbonylContact O-C 3.58Å; F68-R154 VanDerWaalsContact O-CA 3.31Å; F68-R154 WeakPolarHBondContact O-CA 3.47Å; H69-R154 VanDerWaalsContact CD2-CG 3.47Å; H69-R154 WeakPolarHBondContact CD2-CG 3.22Å; L151-R154 VanDerWaalsContact CD1-CD 3.4Å; L151-R154 HydrophobicContact CD1-CG 3.66Å
155	R	97.3	Very high	96.3	Very high	88 Å²	88	48.1 Å²	48.1	33%	0.332	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	138.9	171.6	-175.7	172.2	64	94.2	5.3	110.1	Q67 F68	Q67-R155 WeakPolarHBondContact CA-O 3.31Å; F68-R155 HydrophobicContact CB-CB 4.48Å; F68-R155 VanDerWaalsContact CD2-NH2 3.28Å; F68-R155 PolarHBondContact N-O 3.01Å; F68-R155 PolarHBondContact O-N 3.41Å
156	N	96.1	Very high	95.6	Very high	81 Å²	81	47.7 Å²	47.7	43%	0.433	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	148.1	171.7	-63.3	-33.1	0	0	0	109.7	I66 Q67	I66-N156 CarbonylContact O-C 3.55Å; I66-N156 WeakPolarHBondContact O-CA 3.3Å; Q67-N156 VanDerWaalsContact CB-OD1 3.25Å; Q67-N156 WeakPolarHBondContact CB-OD1 3.48Å; Q67-N156 WeakPolarHBondContact CG-OD1 3.18Å; Q67-N156 PolarHBondContact NE2-OD1 2.89Å
157	Q	98	Very high	95.1	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.009	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	145.4	166.9	-56.5	179.1	-78	0	0	109.5	K65 I66 L159 I217 S219 H224	K65-Q157 WeakPolarHBondContact CA-O 3.49Å; I66-Q157 HydrophobicContact CG2-CB 3.78Å; I66-Q157 HydrophobicContact CG2-CG 4.39Å; I66-Q157 PolarHBondContact N-O 2.83Å; I66-Q157 PolarHBondContact O-N 3.39Å; Q157-L159 HydrophobicContact CB-CD2 3.73Å; Q157-I217 VanDerWaalsContact CA-O 3.32Å; Q157-I217 WeakPolarHBondContact CA-O 3.35Å; Q157-S219 VanDerWaalsContact NE2-CB 3.34Å; Q157-S219 PolarHBondContact NE2-O 2.97Å; Q157-S219 PolarHBondContact NE2-OG 3.1Å; Q157-H224 PolarHBondContact OE1-NE2 3.48Å
158	L	97.9	Very high	94.8	Very high	25 Å²	25	46.2 Å²	46.2	13%	0.131	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	130.6	167	-62.3	177	0	0	0	108.7	L63 Y64 K65 Y124 L127 Q216 I217	L63-L158 HydrophobicContact CD1-CB 4.23Å; L63-L158 HydrophobicContact CD2-CD1 4.4Å; L63-L158 HydrophobicContact CD2-CD2 4.36Å; Y64-L158 CarbonylContact O-C 3.55Å; Y64-L158 WeakPolarHBondContact O-CA 3.3Å; K65-L158 HydrophobicContact CB-CD2 3.77Å; K65-L158 HydrophobicContact CD-CD2 4.36Å; K65-L158 HydrophobicContact CG-CD2 3.89Å; Y124-L158 HydrophobicContact CD1-CD1 4.4Å; Y124-L158 HydrophobicContact CE1-CD1 3.89Å; L127-L158 HydrophobicContact CD2-CD1 3.72Å; L127-L158 HydrophobicContact CD2-CD2 3.68Å; L127-L158 HydrophobicContact CD2-CG 4.39Å; L158-Q216 PolarHBondContact O-N 2.8Å; L158-I217 HydrophobicContact CB-CB 4.1Å; L158-I217 HydrophobicContact CD1-CB 4.38Å; L158-I217 HydrophobicContact CD1-CD1 4.12Å; L158-I217 HydrophobicContact CG-CB 4.47Å; L158-I217 PolarHBondContact N-O 3.27Å; L158-I217 PolarHBondContact O-N 3.33Å
159	L	96.9	Very high	94.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	152.6	-170.9	-41.3	175.5	0	0	0	110.3	Y64 I66 Q157 F213 F214	Y64-L159 PolarHBondContact N-O 3.39Å; Y64-L159 PolarHBondContact O-N 3.46Å; I66-L159 HydrophobicContact CB-CD1 3.93Å; I66-L159 HydrophobicContact CG2-CD1 3.62Å; I66-L159 HydrophobicContact CG2-CD2 4.15Å; I66-L159 HydrophobicContact CG2-CG 4.02Å; Q157-L159 HydrophobicContact CB-CD2 3.73Å; L159-F213 HydrophobicContact CB-CB 3.97Å; L159-F213 HydrophobicContact CD1-CB 3.69Å; L159-F213 HydrophobicContact CD1-CG 4.1Å; L159-F213 HydrophobicContact CG-CB 4.43Å; L159-F214 VanDerWaalsContact CA-O 3.28Å; L159-F214 WeakPolarHBondContact CA-O 3.41Å
160	L	95.1	Very high	94	Very high	30 Å²	30	48 Å²	48	16%	0.157	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	151.8	160.7	-65.2	172.3	0	0	0	108.7	L63 F213 F214 Q216	L63-L160 HydrophobicContact CD1-CD2 4.34Å; L160-F213 CarbonylContact O-C 3.49Å; L160-F213 WeakPolarHBondContact O-CA 3.2Å; L160-F214 HydrophobicContact CB-CD1 4.38Å; L160-F214 HydrophobicContact CB-CE1 3.77Å; L160-F214 HydrophobicContact CB-CE2 4.06Å; L160-F214 HydrophobicContact CB-CZ 3.59Å; L160-F214 HydrophobicContact CD1-CE2 4.07Å; L160-F214 HydrophobicContact CD1-CZ 3.94Å; L160-F214 HydrophobicContact CG-CZ 4.4Å; L160-F214 PolarHBondContact N-O 2.94Å; L160-F214 WeakPolarHBondContact O-CD1 3.32Å; L160-F214 PolarHBondContact O-N 2.91Å; L160-Q216 HydrophobicContact CB-CG 4.44Å; L160-Q216 HydrophobicContact CD1-CG 3.57Å; L160-Q216 HydrophobicContact CG-CG 3.54Å
161	E	93.6	Very high	93.6	Very high	6 Å²	6	49.1 Å²	49.1	3%	0.028	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	149.4	171.8	68.5	-165.2	161.4	0	0	111.2	S56 K57 N62 Y64 G212 F213	S56-E161 VanDerWaalsContact CA-O 3.32Å; S56-E161 WeakPolarHBondContact CA-O 3.5Å; K57-E161 HydrophobicContact CB-CG 4.3Å; K57-E161 HydrophobicContact CD-CG 4.3Å; K57-E161 HydrophobicContact CG-CG 4.2Å; N62-E161 PolarHBondContact ND2-OE1 3.17Å; Y64-E161 HydrophobicContact CD2-CB 4.37Å; Y64-E161 HydrophobicContact CE2-CB 3.8Å; Y64-E161 HydrophobicContact CE2-CG 4.07Å; Y64-E161 VanDerWaalsContact CE2-OE2 3.3Å; Y64-E161 WeakPolarHBondContact CE2-OE2 3.3Å; Y64-E161 PolarHBondContact OH-OE2 3.33Å; E161-G212 WeakPolarHBondContact CA-O 3.23Å; E161-F213 HydrophobicContact CB-CD1 4.04Å; E161-F213 HydrophobicContact CB-CE1 4.24Å
162	F	93.6	Very high	93	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-71.9	141.8	170.9	-71.3	-70.2	0	0	0	111.6	L55 F164 W165 M189 W192 G212 F214 V223	L55-F162 HydrophobicContact CB-CD1 4.17Å; L55-F162 HydrophobicContact CB-CE1 4.35Å; L55-F162 HydrophobicContact CD1-CE1 4.32Å; L55-F162 CarbonylContact O-C 3.49Å; L55-F162 WeakPolarHBondContact O-CA 3.46Å; F162-F164 VanDerWaalsContact C-N 3.26Å; F162-F164 HydrophobicContact CB-CD1 4.19Å; F162-F164 HydrophobicContact CB-CD2 4.1Å; F162-F164 HydrophobicContact CB-CE1 3.86Å; F162-F164 HydrophobicContact CB-CE2 3.78Å; F162-F164 HydrophobicContact CB-CG 4.32Å; F162-F164 HydrophobicContact CB-CZ 3.65Å; F162-F164 AromaticContact CD1-CE1 3.68Å; F162-F164 HydrophobicContact CD1-CE1 3.68Å; F162-F164 HydrophobicContact CD1-CE2 4.43Å; F162-F164 AromaticContact CD1-CZ 3.53Å; F162-F164 HydrophobicContact CD1-CZ 3.53Å; F162-F164 HydrophobicContact CD2-CE2 4.33Å; F162-F164 HydrophobicContact CD2-CZ 4.11Å; F162-F164 HydrophobicContact CE1-CE1 4.47Å; F162-F164 HydrophobicContact CE1-CZ 4.16Å; F162-F164 AromaticContact CG-CE1 3.95Å; F162-F164 HydrophobicContact CG-CE1 3.95Å; F162-F164 AromaticContact CG-CE2 3.96Å; F162-F164 HydrophobicContact CG-CE2 3.96Å; F162-F164 AromaticContact CG-CZ 3.5Å; F162-F164 HydrophobicContact CG-CZ 3.5Å; F162-F164 PolarHBondContact O-N 2.78Å; F162-W165 HydrophobicContact CB-CB 4.26Å; F162-W165 PolarHBondContact O-N 2.8Å; F162-W165 VanDerWaalsContact O-N 3.17Å; F162-M189 HydrophobicContact CZ-SD 4.29Å; F162-W192 HydrophobicContact CE2-CZ3 4.33Å; F162-W192 HydrophobicContact CZ-CZ3 4.13Å; F162-G212 VanDerWaalsContact CD2-C 3.48Å; F162-G212 PolarHBondContact N-O 3.33Å; F162-F214 AromaticContact CD1-CD1 3.68Å; F162-F214 HydrophobicContact CD1-CD1 3.68Å; F162-F214 AromaticContact CD1-CE1 3.98Å; F162-F214 HydrophobicContact CD1-CE1 3.98Å; F162-F214 HydrophobicContact CD2-CD1 4.37Å; F162-F214 HydrophobicContact CE1-CB 4.23Å; F162-F214 AromaticContact CE1-CD1 3.5Å; F162-F214 HydrophobicContact CE1-CD1 3.5Å; F162-F214 VanDerWaalsContact CE1-CD1 3.5Å; F162-F214 HydrophobicContact CE1-CE1 4.13Å; F162-F214 HydrophobicContact CE1-CG 4.09Å; F162-F214 HydrophobicContact CE2-CB 4.3Å; F162-F214 HydrophobicContact CE2-CD1 4.21Å; F162-F214 HydrophobicContact CG-CD1 4.13Å; F162-F214 HydrophobicContact CZ-CB 3.78Å; F162-F214 AromaticContact CZ-CD1 3.79Å; F162-F214 HydrophobicContact CZ-CD1 3.79Å; F162-F214 HydrophobicContact CZ-CG 4.13Å; F162-V223 HydrophobicContact CE2-CG1 3.62Å; F162-V223 HydrophobicContact CE2-CG2 4.36Å; F162-V223 HydrophobicContact CZ-CG1 4Å; F162-V223 HydrophobicContact CZ-CG2 3.89Å
163	S	90.9	Very high	92.3	Very high	58 Å²	58	50.8 Å²	50.8	41%	0.406	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-33.7	179.1	56.8	0	0	0	0	113.7	L55 K57 W165	L55-S163 PolarHBondContact O-N 3.02Å; L55-S163 PolarHBondContact O-OG 2.89Å; K57-S163 WeakPolarHBondContact CE-O 3.39Å; S163-W165 VanDerWaalsContact C-N 3.33Å
164	F	90.1	Very high	91.8	Very high	41 Å²	41	53.1 Å²	53.1	18%	0.18	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	2.9	180	54	-102.2	0	0	0	113.9	F162 W196 A197 I200	F162-F164 VanDerWaalsContact C-N 3.26Å; F162-F164 HydrophobicContact CB-CD1 4.19Å; F162-F164 HydrophobicContact CB-CD2 4.1Å; F162-F164 HydrophobicContact CB-CE1 3.86Å; F162-F164 HydrophobicContact CB-CE2 3.78Å; F162-F164 HydrophobicContact CB-CG 4.32Å; F162-F164 HydrophobicContact CB-CZ 3.65Å; F162-F164 AromaticContact CD1-CE1 3.68Å; F162-F164 HydrophobicContact CD1-CE1 3.68Å; F162-F164 HydrophobicContact CD1-CE2 4.43Å; F162-F164 AromaticContact CD1-CZ 3.53Å; F162-F164 HydrophobicContact CD1-CZ 3.53Å; F162-F164 HydrophobicContact CD2-CE2 4.33Å; F162-F164 HydrophobicContact CD2-CZ 4.11Å; F162-F164 HydrophobicContact CE1-CE1 4.47Å; F162-F164 HydrophobicContact CE1-CZ 4.16Å; F162-F164 AromaticContact CG-CE1 3.95Å; F162-F164 HydrophobicContact CG-CE1 3.95Å; F162-F164 AromaticContact CG-CE2 3.96Å; F162-F164 HydrophobicContact CG-CE2 3.96Å; F162-F164 AromaticContact CG-CZ 3.5Å; F162-F164 HydrophobicContact CG-CZ 3.5Å; F162-F164 PolarHBondContact O-N 2.78Å; F164-W196 HydrophobicContact CE2-CB 4.13Å; F164-W196 HydrophobicContact CZ-CB 4.15Å; F164-A197 HydrophobicContact CB-CB 4.15Å; F164-A197 HydrophobicContact CD1-CB 3.62Å; F164-A197 HydrophobicContact CD2-CB 4.37Å; F164-A197 HydrophobicContact CE1-CB 4.04Å; F164-A197 HydrophobicContact CG-CB 3.8Å; F164-I200 HydrophobicContact CD2-CB 4.48Å; F164-I200 HydrophobicContact CD2-CG2 3.93Å
165	W	90.7	Very high	91.7	Very high	4 Å²	4	48.4 Å²	48.4	2%	0.015	28%	0.282	C	S	.	.	S	Bend	trans	-102	153.1	178	-144.3	-74	0	0	0	112	K57 F162 S163 W196 I200 A209 G211 G212 H225 W227	K57-W165 WeakPolarHBondContact CE-O 3.28Å; K57-W165 PolarHBondContact NZ-O 2.82Å; F162-W165 HydrophobicContact CB-CB 4.26Å; F162-W165 PolarHBondContact O-N 2.8Å; F162-W165 VanDerWaalsContact O-N 3.17Å; S163-W165 VanDerWaalsContact C-N 3.33Å; W165-W196 HydrophobicContact CH2-CZ3 4.41Å; W165-W196 HydrophobicContact CZ3-CE3 4.23Å; W165-I200 HydrophobicContact CD2-CD1 3.86Å; W165-I200 HydrophobicContact CD2-CG1 4Å; W165-I200 HydrophobicContact CE3-CD1 3.84Å; W165-I200 HydrophobicContact CE3-CG1 3.91Å; W165-I200 HydrophobicContact CH2-CD1 3.5Å; W165-I200 HydrophobicContact CH2-CG1 4.45Å; W165-I200 HydrophobicContact CZ2-CD1 3.5Å; W165-I200 HydrophobicContact CZ3-CD1 3.66Å; W165-I200 HydrophobicContact CZ3-CG1 4.14Å; W165-A209 HydrophobicContact CZ2-CB 4.35Å; W165-G211 VanDerWaalsContact NE1-N 3.15Å; W165-G212 VanDerWaalsContact CD1-N 3.3Å; W165-G212 VanDerWaalsContact CD2-CA 3.47Å; W165-G212 VanDerWaalsContact CG-N 3.29Å; W165-H225 HydrophobicContact CH2-CB 3.96Å; W165-H225 AromaticContact CH2-CD2 3.3Å; W165-H225 WeakPolarHBondContact CH2-CD2 3.45Å; W165-H225 AromaticContact CH2-CE1 3.75Å; W165-H225 AromaticContact CH2-CG 3.45Å; W165-H225 VanDerWaalsContact CH2-CG 3.45Å; W165-H225 AromaticContact CH2-ND1 3.74Å; W165-H225 AromaticContact CH2-NE2 3.53Å; W165-H225 HydrophobicContact CZ2-CB 4.34Å; W165-H225 AromaticContact CZ3-CD2 3.39Å; W165-H225 WeakPolarHBondContact CZ3-CD2 3.39Å; W165-H225 AromaticContact CZ3-CE1 3.74Å; W165-H225 AromaticContact CZ3-CG 3.99Å; W165-H225 AromaticContact CZ3-NE2 3.23Å; W165-H225 WeakPolarHBondContact CZ3-NE2 3.16Å; W165-W227 AromaticContact CH2-CH2 3.45Å; W165-W227 HydrophobicContact CH2-CH2 3.45Å; W165-W227 VanDerWaalsContact CH2-CH2 3.45Å; W165-W227 AromaticContact CH2-CZ2 3.58Å; W165-W227 HydrophobicContact CH2-CZ2 3.58Å; W165-W227 HydrophobicContact CH2-CZ3 4.25Å; W165-W227 HydrophobicContact CZ2-CE3 4.45Å; W165-W227 AromaticContact CZ2-CH2 3.56Å; W165-W227 HydrophobicContact CZ2-CH2 3.56Å; W165-W227 AromaticContact CZ2-CZ2 3.87Å; W165-W227 HydrophobicContact CZ2-CZ2 3.87Å; W165-W227 AromaticContact CZ2-CZ3 3.89Å; W165-W227 HydrophobicContact CZ2-CZ3 3.89Å
166	N	82.9	Confident	91.7	Very high	83 Å²	83	45.1 Å²	45.1	44%	0.444	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-68	149.6	170.8	-63.5	-23	0	0	0	111.2	Q204	N166-Q204 PolarHBondContact ND2-NE2 2.8Å; N166-Q204 PolarHBondContact OD1-NE2 2.88Å
167	E	88	Confident	91.8	Very high	41 Å²	41	41.3 Å²	41.3	19%	0.192	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-66.6	143.8	164.4	-72.1	-158	168.1	0	0	109.6	N62 R119 R121 V169	N62-E167 PolarHBondContact ND2-OE1 2.92Å; R119-E167 IonicContact CZ-OE2 2.61Å; R119-E167 IonicContact NH1-OE1 3.87Å; R119-E167 IonicContact NH1-OE2 2.76Å; R119-E167 PolarHBondContact NH1-OE2 2.93Å; R119-E167 IonicContact NH2-OE2 3.14Å; R121-E167 IonicContact NH2-OE2 3.58Å; E167-V169 PolarHBondContact O-N 3.25Å
168	P	92.1	Very high	91.9	Very high	6 Å²	6	41.2 Å²	41.2	4%	0.039	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-62.9	121.2	170	-20.6	32.8	0	0	0	110.7	Y64 V101 V210 F213 L275	Y64-P168 HydrophobicContact CE1-CG 4.5Å; V101-P168 HydrophobicContact CG1-CB 3.5Å; V101-P168 HydrophobicContact CG1-CG 3.99Å; P168-V210 WeakPolarHBondContact CA-O 3.38Å; P168-V210 HydrophobicContact CB-CG1 4.09Å; P168-F213 HydrophobicContact CG-CE1 4.46Å; P168-F213 HydrophobicContact CG-CZ 3.79Å; P168-L275 HydrophobicContact CB-CD1 4.37Å
169	V	90.1	Very high	91.9	Very high	86 Å²	86	40.2 Å²	40.2	52%	0.521	25%	0.245	S	C	.	.			trans	-128.6	151.7	175.8	-64.3	0	0	0	0	110.7	E167 L275	E167-V169 PolarHBondContact O-N 3.25Å; V169-L275 VanDerWaalsContact C-CD2 3.5Å; V169-L275 WeakPolarHBondContact O-CD2 3.18Å
170	P	89.4	Confident	91.9	Very high	104 Å²	104	42.3 Å²	42.3	68%	0.675	25%	0.253	S	S	*	.			trans	-49.6	143.2	171.7	-27.9	36.3	0	0	0	112.1
171	R	89.4	Confident	92.1	Very high	54 Å²	54	41 Å²	41	20%	0.204	25%	0.246	C	C	.	.			trans	-138.2	151.4	-176.1	51.8	174.4	58.1	-141.8	-3.4	111.2	G173 Q207 A209	R171-G173 PolarHBondContact O-N 2.99Å; R171-Q207 PolarHBondContact NH1-O 3.26Å; R171-Q207 PolarHBondContact NH2-O 2.83Å; R171-A209 PolarHBondContact NH2-O 3.42Å
172	P	86.5	Confident	92.3	Very high	125 Å²	125	41.1 Å²	41.1	81%	0.812	25%	0.247	S	C	*	.	S	Bend	trans	-58.9	128.4	176.1	-22.9	33.8	0	0	0	111.3	N175	P172-N175 PolarHBondContact O-ND2 3.39Å
173	G	83.4	Confident	92.5	Very high	49 Å²	49	43.2 Å²	43.2	51%	0.505	26%	0.256	S	S	.	.	S	Bend	trans	-107.1	-176.5	-179.1	0	0	0	0	0	114.1	R171	R171-G173 PolarHBondContact O-N 2.99Å
174	P	89	Confident	92.9	Very high	110 Å²	110	40.5 Å²	40.5	71%	0.714	24%	0.237	S	C	*	.			cis	-76.4	144.8	1.3	30.9	-34.9	0	0	0	113
175	N	95.5	Very high	93.2	Very high	23 Å²	23	44.4 Å²	44.4	12%	0.123	25%	0.251	C	S	.	.			trans	-124.1	147.7	174	-64.3	-70.8	0	0	0	112.3	P172 Y177 A228 Y229 P269	P172-N175 PolarHBondContact O-ND2 3.39Å; N175-Y177 HydrophobicContact CB-CD2 4.46Å; N175-Y177 HydrophobicContact CB-CE2 3.76Å; N175-A228 HydrophobicContact CB-CB 4.34Å; N175-Y229 CarbonylContact C-O 3.51Å; N175-Y229 VanDerWaalsContact CA-O 3.27Å; N175-Y229 WeakPolarHBondContact CA-O 3.23Å; N175-P269 VanDerWaalsContact O-CD 3.29Å; N175-P269 WeakPolarHBondContact O-CD 3.16Å
176	I	97.4	Very high	93.4	Very high	20 Å²	20	48.2 Å²	48.2	10%	0.103	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	151.9	157	66.5	169.5	0	0	0	109.5	A228 Y229 D231 L232 I266	I176-A228 WeakPolarHBondContact O-CA 3.3Å; I176-Y229 PolarHBondContact N-O 3.16Å; I176-Y229 PolarHBondContact O-N 3.09Å; I176-D231 VanDerWaalsContact CD1-C 3.41Å; I176-L232 HydrophobicContact CD1-CD2 3.65Å; I176-L232 HydrophobicContact CD1-CG 3.88Å; I176-I266 HydrophobicContact CD1-CG2 4.08Å
177	Y	98.1	Very high	93.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	142	-177.3	-71.5	-102.7	0	0	0	110.8	W104 N175 V210 L226 W227 A228 I266 M267 P269 L275	W104-Y177 AromaticContact CD1-CD2 3.62Å; W104-Y177 AromaticContact CD1-CG 3.81Å; W104-Y177 HydrophobicContact CZ2-CD1 4.13Å; W104-Y177 HydrophobicContact CZ2-CE1 4.27Å; W104-Y177 AromaticContact NE1-CD1 3.66Å; W104-Y177 AromaticContact NE1-CD2 3.17Å; W104-Y177 AromaticContact NE1-CE2 3.62Å; W104-Y177 AromaticContact NE1-CG 3.23Å; N175-Y177 HydrophobicContact CB-CD2 4.46Å; N175-Y177 HydrophobicContact CB-CE2 3.76Å; Y177-V210 HydrophobicContact CD1-CG2 4.31Å; Y177-V210 HydrophobicContact CE1-CG1 4.47Å; Y177-V210 HydrophobicContact CE1-CG2 3.99Å; Y177-L226 HydrophobicContact CD1-CD1 4.06Å; Y177-L226 HydrophobicContact CD1-CG 4.25Å; Y177-W227 CarbonylContact C-O 3.54Å; Y177-W227 VanDerWaalsContact CA-O 3.23Å; Y177-W227 WeakPolarHBondContact CA-O 3.46Å; Y177-A228 HydrophobicContact CD1-CB 3.96Å; Y177-A228 HydrophobicContact CE1-CB 3.67Å; Y177-I266 CarbonylContact O-C 3.58Å; Y177-I266 WeakPolarHBondContact O-CA 3.37Å; Y177-M267 PolarHBondContact N-O 2.91Å; Y177-M267 PolarHBondContact O-N 3.19Å; Y177-P269 HydrophobicContact CD2-CG 4.39Å; Y177-P269 HydrophobicContact CE2-CB 4.41Å; Y177-P269 HydrophobicContact CE2-CG 4.17Å; Y177-L275 HydrophobicContact CE1-CB 4.2Å; Y177-L275 WeakPolarHBondContact CE2-O 3.27Å; Y177-L275 PolarHBondContact OH-O 3.29Å
178	E	98.5	Very high	94.2	Very high	0 Å²	0	46 Å²	46	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	117.8	168.9	-175.5	-177.5	-175.3	0	0	109.1	R180 W227 Y229 R235 R239 S264 R265 I266	E178-R180 HydrophobicContact CG-CG 3.76Å; E178-R180 VanDerWaalsContact OE1-CD 3.27Å; E178-R180 WeakPolarHBondContact OE1-CD 3.26Å; E178-R180 WeakPolarHBondContact OE1-CG 3.35Å; E178-R180 IonicContact OE1-NE 3.7Å; E178-W227 HydrophobicContact CB-CB 4.27Å; E178-W227 PolarHBondContact N-O 2.9Å; E178-W227 PolarHBondContact O-N 3.34Å; E178-Y229 HydrophobicContact CB-CD2 4.44Å; E178-Y229 HydrophobicContact CB-CE2 3.98Å; E178-R235 VanDerWaalsContact CD-NE 3.29Å; E178-R235 VanDerWaalsContact CD-NH2 3.26Å; E178-R235 IonicContact OE1-CZ 2.87Å; E178-R235 IonicContact OE1-NE 3.26Å; E178-R235 IonicContact OE1-NH2 3.94Å; E178-R235 PolarHBondContact OE1-NH2 3.39Å; E178-R235 IonicContact OE2-CZ 2.84Å; E178-R235 IonicContact OE2-NE 3.65Å; E178-R235 PolarHBondContact OE2-NE 3.35Å; E178-R235 IonicContact OE2-NH2 3.84Å; E178-R235 PolarHBondContact OE2-NH2 3.06Å; E178-R239 IonicContact OE1-NH1 3.55Å; E178-R239 IonicContact OE2-NH1 3.68Å; E178-S264 VanDerWaalsContact CD-OG 3.31Å; E178-S264 WeakPolarHBondContact CG-OG 3.2Å; E178-S264 WeakPolarHBondContact OE1-CB 3.31Å; E178-S264 PolarHBondContact OE1-OG 2.94Å; E178-R265 CarbonylContact C-O 3.53Å; E178-R265 VanDerWaalsContact CA-O 3.26Å; E178-R265 WeakPolarHBondContact CA-O 3.42Å; E178-I266 HydrophobicContact CB-CD1 4Å; E178-I266 HydrophobicContact CG-CD1 3.97Å
179	L	98.6	Very high	94.3	Very high	5 Å²	5	46.7 Å²	46.7	3%	0.026	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	111.4	168.1	-178	68	0	0	0	108.7	I66 F68 V115 H224 H225 L226 R265 M267	I66-L179 HydrophobicContact CD1-CD1 4.37Å; I66-L179 HydrophobicContact CD1-CD2 3.85Å; F68-L179 HydrophobicContact CE1-CD2 3.77Å; F68-L179 HydrophobicContact CZ-CD2 3.9Å; V115-L179 HydrophobicContact CG1-CD2 4.35Å; L179-H224 HydrophobicContact CD1-CB 4.08Å; L179-H225 WeakPolarHBondContact CA-O 3.36Å; L179-L226 HydrophobicContact CB-CD1 4.44Å; L179-L226 HydrophobicContact CD1-CD1 4.38Å; L179-R265 PolarHBondContact N-O 2.87Å; L179-R265 PolarHBondContact O-N 3.46Å; L179-M267 HydrophobicContact CB-CE 3.68Å; L179-M267 HydrophobicContact CB-SD 3.93Å; L179-M267 HydrophobicContact CD2-SD 4.43Å
180	R	98.3	Very high	94.3	Very high	43 Å²	43	44.1 Å²	44.1	16%	0.162	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	119.2	173.3	-57.7	-167.9	72.8	-178.3	-2.2	109.9	E178 Y182 H224 H225 E263	E178-R180 HydrophobicContact CG-CG 3.76Å; E178-R180 VanDerWaalsContact OE1-CD 3.27Å; E178-R180 WeakPolarHBondContact OE1-CD 3.26Å; E178-R180 WeakPolarHBondContact OE1-CG 3.35Å; E178-R180 IonicContact OE1-NE 3.7Å; R180-Y182 HydrophobicContact CB-CE2 3.78Å; R180-Y182 WeakPolarHBondContact CD-OH 3.47Å; R180-Y182 PolarHBondContact NE-OH 3.19Å; R180-Y182 VanDerWaalsContact NE-OH 3.11Å; R180-Y182 PolarHBondContact NH1-OH 3.02Å; R180-H224 CarbonylContact O-C 3.55Å; R180-H224 WeakPolarHBondContact O-CA 3.31Å; R180-H225 HydrophobicContact CB-CB 4.44Å; R180-H225 PolarHBondContact N-O 2.92Å; R180-H225 PolarHBondContact O-N 3.31Å; R180-E263 CarbonylContact C-O 3.58Å; R180-E263 WeakPolarHBondContact CA-O 3.25Å
181	S	98.3	Very high	94.6	Very high	4 Å²	4	43.4 Å²	43.4	3%	0.028	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	132.9	177	-69.1	0	0	0	0	110	V223 H224 M262 E263	S181-V223 CarbonylContact C-O 3.51Å; S181-V223 WeakPolarHBondContact CA-O 3.46Å; S181-H224 PolarHBondContact OG-CE1 3.23Å; S181-H224 PolarHBondContact OG-ND1 2.81Å; S181-M262 CarbonylContact O-C 3.58Å; S181-M262 VanDerWaalsContact O-CA 3.27Å; S181-M262 WeakPolarHBondContact O-CA 3.37Å; S181-E263 PolarHBondContact N-O 3.25Å; S181-E263 PolarHBondContact O-N 3.19Å
182	Y	98.3	Very high	94.9	Very high	8 Å²	8	40.9 Å²	40.9	3%	0.031	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	117.7	176.7	-53.2	-82.5	0	0	0	109.7	R180 L184 W192 Q222 V223 H225 I259 M262	R180-Y182 HydrophobicContact CB-CE2 3.78Å; R180-Y182 WeakPolarHBondContact CD-OH 3.47Å; R180-Y182 PolarHBondContact NE-OH 3.19Å; R180-Y182 VanDerWaalsContact NE-OH 3.11Å; R180-Y182 PolarHBondContact NH1-OH 3.02Å; Y182-L184 PolarHBondContact O-N 3.46Å; Y182-W192 HydrophobicContact CD2-CH2 4.41Å; Y182-W192 HydrophobicContact CD2-CZ2 4.06Å; Y182-W192 HydrophobicContact CE2-CZ2 4.45Å; Y182-W192 HydrophobicContact CG-CZ2 4.33Å; Y182-Q222 CarbonylContact O-C 3.56Å; Y182-Q222 VanDerWaalsContact O-CA 3.31Å; Y182-Q222 WeakPolarHBondContact O-CA 3.23Å; Y182-V223 HydrophobicContact CD2-CG1 4.45Å; Y182-V223 PolarHBondContact N-O 2.68Å; Y182-V223 PolarHBondContact O-N 3.43Å; Y182-H225 AromaticContact CE2-ND1 3.61Å; Y182-I259 HydrophobicContact CD1-CD1 3.71Å; Y182-I259 HydrophobicContact CD1-CG1 4.41Å; Y182-I259 HydrophobicContact CD1-CG2 4.38Å; Y182-I259 HydrophobicContact CE1-CD1 4.2Å; Y182-I259 HydrophobicContact CG-CD1 4.43Å; Y182-M262 HydrophobicContact CD1-CB 3.69Å; Y182-M262 HydrophobicContact CE1-CB 4.06Å
183	Q	98.3	Very high	95.2	Very high	44 Å²	44	34.9 Å²	34.9	21%	0.206	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	108.7	166.3	-177.5	60.1	54.9	0	0	107.8	L220 Q260 H261	Q183-L220 PolarHBondContact NE2-O 2.82Å; Q183-L220 PolarHBondContact OE1-O 2.82Å; Q183-Q260 HydrophobicContact CG-CB 4.39Å; Q183-Q260 PolarHBondContact O-N 3.13Å; Q183-H261 HydrophobicContact CB-CB 3.99Å; Q183-H261 PolarHBondContact N-O 3.49Å; Q183-H261 PolarHBondContact O-N 2.87Å
184	L	98.1	Very high	95.7	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	154.9	178.1	-54.8	-174.6	0	0	0	110.9	Y182 M189 W192 Y221 V223 I259 Q260	Y182-L184 PolarHBondContact O-N 3.46Å; L184-M189 HydrophobicContact CD1-CB 4.45Å; L184-M189 HydrophobicContact CD1-CE 4Å; L184-M189 HydrophobicContact CD1-SD 3.74Å; L184-W192 HydrophobicContact CD1-CB 3.85Å; L184-W192 HydrophobicContact CD1-CD2 3.93Å; L184-W192 HydrophobicContact CD1-CE3 4.26Å; L184-W192 HydrophobicContact CD1-CG 3.77Å; L184-W192 HydrophobicContact CD2-CD2 4.13Å; L184-W192 HydrophobicContact CD2-CG 3.92Å; L184-Y221 WeakPolarHBondContact CB-O 3.5Å; L184-Y221 PolarHBondContact N-O 2.9Å; L184-V223 HydrophobicContact CD1-CG2 3.76Å; L184-V223 HydrophobicContact CG-CG2 4.22Å; L184-I259 HydrophobicContact CD2-CG1 3.74Å; L184-Q260 PolarHBondContact O-OE1 3.26Å
185	R	97.2	Very high	95.9	Very high	123 Å²	123	33.8 Å²	33.8	46%	0.464	18%	0.179	S	C	.	.	P	Polyproline II helix	trans	-59.9	137.3	168.2	-68.1	177.3	-170.6	-83.4	-4.3	109.3	G187 T188 P257 L258 Q260	R185-G187 PolarHBondContact O-N 2.88Å; R185-T188 HydrophobicContact CB-CG2 3.84Å; R185-T188 PolarHBondContact O-N 2.82Å; R185-T188 VanDerWaalsContact O-N 3.13Å; R185-T188 PolarHBondContact O-OG1 3Å; R185-P257 PolarHBondContact NE-O 2.84Å; R185-L258 WeakPolarHBondContact CG-O 3.39Å; R185-L258 PolarHBondContact N-O 2.87Å; R185-Q260 HydrophobicContact CB-CG 4.32Å; R185-Q260 HydrophobicContact CG-CG 3.5Å; R185-Q260 VanDerWaalsContact CG-CG 3.5Å
186	P	95	Very high	95.9	Very high	85 Å²	85	33.3 Å²	33.3	55%	0.552	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	130.2	175.9	-29.2	36.3	0	0	0	111.9	Y221	P186-Y221 HydrophobicContact CB-CD2 4.13Å; P186-Y221 HydrophobicContact CB-CE1 4.49Å; P186-Y221 HydrophobicContact CB-CE2 3.81Å; P186-Y221 HydrophobicContact CG-CD2 4.21Å; P186-Y221 HydrophobicContact CG-CE2 4.26Å
187	G	91.4	Very high	95.6	Very high	59 Å²	59	33.8 Å²	33.8	61%	0.608	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	90.1	-8.9	179.8	0	0	0	0	0	116.1	R185 Y221	R185-G187 PolarHBondContact O-N 2.88Å; G187-Y221 VanDerWaalsContact N-CE1 3.31Å
188	T	95.1	Very high	95.2	Very high	19 Å²	19	39.7 Å²	39.7	12%	0.117	21%	0.205	C	C	.	.			trans	-95.8	-1.1	-176.4	67.2	0	0	0	0	114.6	R185 I190 E191 W192 L258	R185-T188 HydrophobicContact CB-CG2 3.84Å; R185-T188 PolarHBondContact O-N 2.82Å; R185-T188 VanDerWaalsContact O-N 3.13Å; R185-T188 PolarHBondContact O-OG1 3Å; T188-I190 VanDerWaalsContact C-N 3.32Å; T188-I190 PolarHBondContact O-N 2.76Å; T188-E191 PolarHBondContact O-N 2.88Å; T188-W192 WeakPolarHBondContact O-CB 3.45Å; T188-W192 PolarHBondContact O-N 3.36Å; T188-L258 HydrophobicContact CG2-CD2 4.03Å
189	M	94.1	Very high	94.8	Very high	19 Å²	19	39.7 Å²	39.7	9%	0.094	21%	0.205	C	C	.	.	H	α-helix	trans	-53.2	-44.2	-176.8	-178.2	69.5	68.8	0	0	113.4	L55 F162 L184 G193 F214 V223	L55-M189 HydrophobicContact CD1-CG 3.66Å; F162-M189 HydrophobicContact CZ-SD 4.29Å; L184-M189 HydrophobicContact CD1-CB 4.45Å; L184-M189 HydrophobicContact CD1-CE 4Å; L184-M189 HydrophobicContact CD1-SD 3.74Å; M189-G193 PolarHBondContact O-N 2.98Å; M189-F214 HydrophobicContact CE-CB 4.07Å; M189-F214 HydrophobicContact SD-CB 3.97Å; M189-V223 HydrophobicContact CE-CG2 3.73Å; M189-V223 HydrophobicContact SD-CG2 3.46Å; M189-V223 WeakPolarHBondContact SD-CG2 3.34Å
190	I	91.1	Very high	94.6	Very high	33 Å²	33	39.5 Å²	39.5	17%	0.169	20%	0.204	C	C	.	.	H	α-helix	trans	-69	-45.6	-179.4	-66.2	172.5	0	0	0	110.8	H51 L54 L55 T188 W192 G193 N194	H51-I190 HydrophobicContact CB-CD1 4.14Å; L54-I190 HydrophobicContact CD1-CD1 4.2Å; L55-I190 HydrophobicContact CD1-CG1 4.13Å; T188-I190 VanDerWaalsContact C-N 3.32Å; T188-I190 PolarHBondContact O-N 2.76Å; I190-W192 PolarHBondContact O-N 3.08Å; I190-G193 PolarHBondContact O-N 3.4Å; I190-N194 PolarHBondContact O-N 3.11Å; I190-N194 PolarHBondContact O-ND2 2.96Å; I190-N194 PolarHBondContact O-OD1 3.45Å
191	E	94.2	Very high	94.2	Very high	89 Å²	89	43.7 Å²	43.7	42%	0.416	23%	0.226	S	C	.	.	H	α-helix	trans	-58.9	-49.8	177.6	179.9	-178.8	-174.1	0	0	110.7	T188 G193 N194 Y195 L258	T188-E191 PolarHBondContact O-N 2.88Å; E191-G193 VanDerWaalsContact C-N 3.34Å; E191-G193 PolarHBondContact O-N 2.92Å; E191-N194 PolarHBondContact O-N 2.86Å; E191-Y195 HydrophobicContact CG-CD2 4.34Å; E191-Y195 HydrophobicContact CG-CE2 3.9Å; E191-Y195 WeakPolarHBondContact O-CD2 3.25Å; E191-Y195 PolarHBondContact O-N 3.46Å; E191-L258 HydrophobicContact CB-CD1 4.32Å; E191-L258 HydrophobicContact CG-CD1 3.86Å
192	W	96	Very high	93.7	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.1	-44.1	177.1	-171.5	96.3	0	0	0	111.7	F162 Y182 L184 T188 I190 N194 Y195 W196 V223 H225 L258	F162-W192 HydrophobicContact CE2-CZ3 4.33Å; F162-W192 HydrophobicContact CZ-CZ3 4.13Å; Y182-W192 HydrophobicContact CD2-CH2 4.41Å; Y182-W192 HydrophobicContact CD2-CZ2 4.06Å; Y182-W192 HydrophobicContact CE2-CZ2 4.45Å; Y182-W192 HydrophobicContact CG-CZ2 4.33Å; L184-W192 HydrophobicContact CD1-CB 3.85Å; L184-W192 HydrophobicContact CD1-CD2 3.93Å; L184-W192 HydrophobicContact CD1-CE3 4.26Å; L184-W192 HydrophobicContact CD1-CG 3.77Å; L184-W192 HydrophobicContact CD2-CD2 4.13Å; L184-W192 HydrophobicContact CD2-CG 3.92Å; T188-W192 WeakPolarHBondContact O-CB 3.45Å; T188-W192 PolarHBondContact O-N 3.36Å; I190-W192 PolarHBondContact O-N 3.08Å; W192-N194 VanDerWaalsContact C-N 3.35Å; W192-N194 PolarHBondContact O-N 3.45Å; W192-Y195 PolarHBondContact O-N 3.11Å; W192-W196 AromaticContact CD2-CD1 3.39Å; W192-W196 HydrophobicContact CD2-CG 4.36Å; W192-W196 AromaticContact CD2-NE1 3.89Å; W192-W196 AromaticContact CE2-CD1 3.24Å; W192-W196 AromaticContact CE2-NE1 3.21Å; W192-W196 HydrophobicContact CE3-CB 4.27Å; W192-W196 AromaticContact CE3-CD1 3.47Å; W192-W196 VanDerWaalsContact CE3-CD1 3.47Å; W192-W196 HydrophobicContact CE3-CG 4.03Å; W192-W196 AromaticContact CH2-CD1 3.39Å; W192-W196 HydrophobicContact CH2-CD2 4.07Å; W192-W196 AromaticContact CH2-CE2 3.88Å; W192-W196 AromaticContact CH2-CG 3.74Å; W192-W196 HydrophobicContact CH2-CG 3.74Å; W192-W196 AromaticContact CH2-NE1 3.47Å; W192-W196 AromaticContact CZ2-CD1 3.3Å; W192-W196 HydrophobicContact CZ2-CD2 4.32Å; W192-W196 AromaticContact CZ2-CE2 3.7Å; W192-W196 HydrophobicContact CZ2-CG 4.08Å; W192-W196 HydrophobicContact CZ2-CZ2 4.39Å; W192-W196 AromaticContact CZ2-NE1 3.01Å; W192-W196 HydrophobicContact CZ3-CB 4.02Å; W192-W196 AromaticContact CZ3-CD1 3.44Å; W192-W196 VanDerWaalsContact CZ3-CD1 3.44Å; W192-W196 HydrophobicContact CZ3-CD2 4.42Å; W192-W196 AromaticContact CZ3-CG 3.67Å; W192-W196 HydrophobicContact CZ3-CG 3.67Å; W192-W196 AromaticContact NE1-CD1 3.9Å; W192-W196 AromaticContact NE1-NE1 3.67Å; W192-W196 PolarHBondContact O-N 3.42Å; W192-V223 HydrophobicContact CE3-CG2 4.36Å; W192-V223 HydrophobicContact CH2-CB 4.07Å; W192-V223 HydrophobicContact CH2-CG1 3.41Å; W192-V223 VanDerWaalsContact CH2-CG1 3.41Å; W192-V223 HydrophobicContact CH2-CG2 4.33Å; W192-V223 HydrophobicContact CZ2-CG1 4.34Å; W192-V223 HydrophobicContact CZ3-CB 4.26Å; W192-V223 HydrophobicContact CZ3-CG1 3.65Å; W192-V223 HydrophobicContact CZ3-CG2 4.06Å; W192-H225 AromaticContact CH2-CE1 3.32Å; W192-H225 WeakPolarHBondContact CH2-CE1 3.31Å; W192-H225 AromaticContact CH2-NE2 3.31Å; W192-H225 VanDerWaalsContact CH2-NE2 3.31Å; W192-H225 WeakPolarHBondContact CH2-NE2 3.46Å; W192-H225 AromaticContact CZ3-NE2 3.89Å; W192-L258 HydrophobicContact CB-CD1 3.89Å; W192-L258 HydrophobicContact CG-CD1 4.48Å
193	G	94	Very high	93.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.9	-39.4	177.1	0	0	0	0	0	113	M189 I190 E191 Y195 W196 A197	M189-G193 PolarHBondContact O-N 2.98Å; I190-G193 PolarHBondContact O-N 3.4Å; E191-G193 VanDerWaalsContact C-N 3.34Å; E191-G193 PolarHBondContact O-N 2.92Å; G193-Y195 VanDerWaalsContact C-N 3.34Å; G193-Y195 PolarHBondContact O-N 3.37Å; G193-W196 PolarHBondContact O-N 2.91Å; G193-A197 WeakPolarHBondContact O-CB 3.11Å; G193-A197 PolarHBondContact O-N 3.17Å
194	N	92.4	Very high	92.9	Very high	94 Å²	94	45.1 Å²	45.1	50%	0.503	23%	0.232	S	C	.	.	H	α-helix	trans	-65.6	-34.5	178.1	-70.2	-15.3	0	0	0	112.9	I190 E191 W192	I190-N194 PolarHBondContact O-N 3.11Å; I190-N194 PolarHBondContact O-ND2 2.96Å; I190-N194 PolarHBondContact O-OD1 3.45Å; E191-N194 PolarHBondContact O-N 2.86Å; W192-N194 VanDerWaalsContact C-N 3.35Å; W192-N194 PolarHBondContact O-N 3.45Å
195	Y	94.4	Very high	92.3	Very high	42 Å²	42	50.5 Å²	50.5	17%	0.165	26%	0.257	C	S	.	.	H	α-helix	trans	-70.3	-42.5	171.2	-72.8	-72.7	0	0	0	111.1	E191 W192 G193 A197 R198 A199 Y254 T255	E191-Y195 HydrophobicContact CG-CD2 4.34Å; E191-Y195 HydrophobicContact CG-CE2 3.9Å; E191-Y195 WeakPolarHBondContact O-CD2 3.25Å; E191-Y195 PolarHBondContact O-N 3.46Å; W192-Y195 PolarHBondContact O-N 3.11Å; G193-Y195 VanDerWaalsContact C-N 3.34Å; G193-Y195 PolarHBondContact O-N 3.37Å; Y195-A197 PolarHBondContact O-N 3.35Å; Y195-R198 PolarHBondContact O-N 2.98Å; Y195-A199 PolarHBondContact O-N 3.26Å; Y195-A199 VanDerWaalsContact O-N 3.09Å; Y195-Y254 HydrophobicContact CD1-CD2 4.35Å; Y195-Y254 HydrophobicContact CD1-CG 4.46Å; Y195-Y254 AromaticContact CE1-CD2 3.56Å; Y195-Y254 HydrophobicContact CE1-CD2 3.56Å; Y195-Y254 HydrophobicContact CE1-CE2 4.42Å; Y195-Y254 AromaticContact CE1-CG 3.65Å; Y195-Y254 HydrophobicContact CE1-CG 3.65Å; Y195-Y254 HydrophobicContact CE2-CG 4.32Å; Y195-Y254 AromaticContact CZ-CD2 3.95Å; Y195-Y254 AromaticContact CZ-CG 3.58Å; Y195-T255 VanDerWaalsContact CB-CG2 3.42Å; Y195-T255 HydrophobicContact CD2-CG2 4.25Å; Y195-T255 HydrophobicContact CG-CG2 4.03Å
196	W	95.1	Very high	91.8	Very high	13 Å²	13	47.4 Å²	47.4	5%	0.049	25%	0.25	C	S	.	.	H	α-helix	trans	-69.6	-28.3	-179.4	-90	92.3	0	0	0	114.8	F164 W165 W192 G193 R198 A199 I200 H225 W227 W248	F164-W196 HydrophobicContact CE2-CB 4.13Å; F164-W196 HydrophobicContact CZ-CB 4.15Å; W165-W196 HydrophobicContact CH2-CZ3 4.41Å; W165-W196 HydrophobicContact CZ3-CE3 4.23Å; W192-W196 AromaticContact CD2-CD1 3.39Å; W192-W196 HydrophobicContact CD2-CG 4.36Å; W192-W196 AromaticContact CD2-NE1 3.89Å; W192-W196 AromaticContact CE2-CD1 3.24Å; W192-W196 AromaticContact CE2-NE1 3.21Å; W192-W196 HydrophobicContact CE3-CB 4.27Å; W192-W196 AromaticContact CE3-CD1 3.47Å; W192-W196 VanDerWaalsContact CE3-CD1 3.47Å; W192-W196 HydrophobicContact CE3-CG 4.03Å; W192-W196 AromaticContact CH2-CD1 3.39Å; W192-W196 HydrophobicContact CH2-CD2 4.07Å; W192-W196 AromaticContact CH2-CE2 3.88Å; W192-W196 AromaticContact CH2-CG 3.74Å; W192-W196 HydrophobicContact CH2-CG 3.74Å; W192-W196 AromaticContact CH2-NE1 3.47Å; W192-W196 AromaticContact CZ2-CD1 3.3Å; W192-W196 HydrophobicContact CZ2-CD2 4.32Å; W192-W196 AromaticContact CZ2-CE2 3.7Å; W192-W196 HydrophobicContact CZ2-CG 4.08Å; W192-W196 HydrophobicContact CZ2-CZ2 4.39Å; W192-W196 AromaticContact CZ2-NE1 3.01Å; W192-W196 HydrophobicContact CZ3-CB 4.02Å; W192-W196 AromaticContact CZ3-CD1 3.44Å; W192-W196 VanDerWaalsContact CZ3-CD1 3.44Å; W192-W196 HydrophobicContact CZ3-CD2 4.42Å; W192-W196 AromaticContact CZ3-CG 3.67Å; W192-W196 HydrophobicContact CZ3-CG 3.67Å; W192-W196 AromaticContact NE1-CD1 3.9Å; W192-W196 AromaticContact NE1-NE1 3.67Å; W192-W196 PolarHBondContact O-N 3.42Å; G193-W196 PolarHBondContact O-N 2.91Å; W196-R198 PolarHBondContact O-N 2.87Å; W196-A199 HydrophobicContact CD2-CB 4.21Å; W196-A199 HydrophobicContact CE3-CB 3.91Å; W196-A199 HydrophobicContact CZ3-CB 4.39Å; W196-A199 PolarHBondContact O-N 3.04Å; W196-A199 VanDerWaalsContact O-N 3.16Å; W196-I200 WeakPolarHBondContact O-CB 3.33Å; W196-I200 PolarHBondContact O-N 3.22Å; W196-H225 AromaticContact CD2-CE1 3.49Å; W196-H225 VanDerWaalsContact CD2-CE1 3.49Å; W196-H225 AromaticContact CE2-CE1 3.55Å; W196-H225 AromaticContact CE3-CE1 3.46Å; W196-H225 VanDerWaalsContact CE3-CE1 3.46Å; W196-H225 AromaticContact CH2-CE1 3.54Å; W196-H225 AromaticContact CH2-ND1 3.64Å; W196-H225 AromaticContact CZ2-CE1 3.57Å; W196-H225 AromaticContact CZ2-ND1 3.92Å; W196-H225 AromaticContact CZ3-CE1 3.49Å; W196-H225 VanDerWaalsContact CZ3-CE1 3.49Å; W196-H225 WeakPolarHBondContact CZ3-CE1 3.18Å; W196-H225 AromaticContact CZ3-ND1 3.82Å; W196-W227 HydrophobicContact CH2-CZ2 4.23Å; W196-W227 HydrophobicContact CZ3-CH2 4.11Å; W196-W227 HydrophobicContact CZ3-CZ2 4.07Å; W196-W248 HydrophobicContact CH2-CH2 4.05Å; W196-W248 HydrophobicContact CH2-CZ3 4.41Å
197	A	92.2	Very high	91.5	Very high	30 Å²	30	50.9 Å²	50.9	25%	0.248	26%	0.259	C	S	.	.	H	α-helix	trans	-57.5	-32.9	172.6	0	0	0	0	0	112.3	F164 G193 Y195 I200	F164-A197 HydrophobicContact CB-CB 4.15Å; F164-A197 HydrophobicContact CD1-CB 3.62Å; F164-A197 HydrophobicContact CD2-CB 4.37Å; F164-A197 HydrophobicContact CE1-CB 4.04Å; F164-A197 HydrophobicContact CG-CB 3.8Å; G193-A197 WeakPolarHBondContact O-CB 3.11Å; G193-A197 PolarHBondContact O-N 3.17Å; Y195-A197 PolarHBondContact O-N 3.35Å; A197-I200 WeakPolarHBondContact O-CG2 3.29Å
198	R	88.4	Confident	91.6	Very high	123 Å²	123	48.1 Å²	48.1	46%	0.464	23%	0.23	S	C	.	.	H	α-helix	trans	-83.6	-40.8	173.2	-64.5	179.3	-78.6	161.8	-3.9	111.8	Y195 W196 I200 E201	Y195-R198 PolarHBondContact O-N 2.98Å; W196-R198 PolarHBondContact O-N 2.87Å; R198-I200 VanDerWaalsContact C-N 3.29Å; R198-I200 PolarHBondContact O-N 3.34Å; R198-E201 PolarHBondContact O-N 3.44Å
199	A	90.8	Very high	91.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.3	-33	-176.6	0	0	0	0	0	113.7	Y195 W196 E201 I202 R203 W248 V251	Y195-A199 PolarHBondContact O-N 3.26Å; Y195-A199 VanDerWaalsContact O-N 3.09Å; W196-A199 HydrophobicContact CD2-CB 4.21Å; W196-A199 HydrophobicContact CE3-CB 3.91Å; W196-A199 HydrophobicContact CZ3-CB 4.39Å; W196-A199 PolarHBondContact O-N 3.04Å; W196-A199 VanDerWaalsContact O-N 3.16Å; A199-E201 VanDerWaalsContact C-N 3.27Å; A199-E201 PolarHBondContact O-N 3.26Å; A199-I202 WeakPolarHBondContact O-CB 3.4Å; A199-I202 PolarHBondContact O-N 2.87Å; A199-R203 PolarHBondContact O-N 2.92Å; A199-W248 HydrophobicContact CB-CZ3 4.2Å; A199-V251 HydrophobicContact CB-CB 4.2Å; A199-V251 HydrophobicContact CB-CG1 3.5Å; A199-V251 VanDerWaalsContact CB-CG1 3.5Å; A199-V251 HydrophobicContact CB-CG2 3.82Å
200	I	93.1	Very high	91.7	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-66.3	-32.2	-176.5	-166.3	52.7	0	0	0	111.6	F164 W165 W196 A197 R198 I202 R203 Q204 A209 W227	F164-I200 HydrophobicContact CD2-CB 4.48Å; F164-I200 HydrophobicContact CD2-CG2 3.93Å; W165-I200 HydrophobicContact CD2-CD1 3.86Å; W165-I200 HydrophobicContact CD2-CG1 4Å; W165-I200 HydrophobicContact CE3-CD1 3.84Å; W165-I200 HydrophobicContact CE3-CG1 3.91Å; W165-I200 HydrophobicContact CH2-CD1 3.5Å; W165-I200 HydrophobicContact CH2-CG1 4.45Å; W165-I200 HydrophobicContact CZ2-CD1 3.5Å; W165-I200 HydrophobicContact CZ3-CD1 3.66Å; W165-I200 HydrophobicContact CZ3-CG1 4.14Å; W196-I200 WeakPolarHBondContact O-CB 3.33Å; W196-I200 PolarHBondContact O-N 3.22Å; A197-I200 WeakPolarHBondContact O-CG2 3.29Å; R198-I200 VanDerWaalsContact C-N 3.29Å; R198-I200 PolarHBondContact O-N 3.34Å; I200-I202 VanDerWaalsContact C-N 3.28Å; I200-I202 PolarHBondContact O-N 3.11Å; I200-R203 HydrophobicContact CD1-CB 4.32Å; I200-R203 CarbonylContact O-C 3.59Å; I200-R203 PolarHBondContact O-N 3.09Å; I200-Q204 HydrophobicContact CD1-CG 4.22Å; I200-Q204 HydrophobicContact CG1-CG 4.04Å; I200-Q204 WeakPolarHBondContact O-CB 3.29Å; I200-Q204 VanDerWaalsContact O-CG 3.3Å; I200-Q204 WeakPolarHBondContact O-CG 3.47Å; I200-Q204 PolarHBondContact O-N 2.82Å; I200-A209 HydrophobicContact CD1-CB 3.96Å; I200-W227 HydrophobicContact CD1-CH2 3.9Å; I200-W227 HydrophobicContact CD1-CZ3 4.13Å
201	E	89.8	Confident	91.9	Very high	131 Å²	131	45.1 Å²	45.1	61%	0.612	22%	0.215	S	C	*	.	H	α-helix	trans	-60.7	-39.6	176.7	-62.6	179.2	-178.5	0	0	111.2	R198 A199 R203 Q204	R198-E201 PolarHBondContact O-N 3.44Å; A199-E201 VanDerWaalsContact C-N 3.27Å; A199-E201 PolarHBondContact O-N 3.26Å; E201-R203 VanDerWaalsContact C-N 3.33Å; E201-R203 PolarHBondContact O-N 3.14Å; E201-Q204 PolarHBondContact O-N 2.82Å
202	I	89.8	Confident	92.1	Very high	25 Å²	25	40.9 Å²	40.9	13%	0.128	20%	0.195	C	C	.	.	H	α-helix	trans	-63	-43.3	174.5	-57.8	171.9	0	0	0	110.3	A199 I200 R245 D246 W248	A199-I202 WeakPolarHBondContact O-CB 3.4Å; A199-I202 PolarHBondContact O-N 2.87Å; I200-I202 VanDerWaalsContact C-N 3.28Å; I200-I202 PolarHBondContact O-N 3.11Å; I202-R245 HydrophobicContact CG2-CB 3.48Å; I202-R245 VanDerWaalsContact CG2-CB 3.48Å; I202-R245 HydrophobicContact CG2-CG 3.74Å; I202-D246 WeakPolarHBondContact CD1-O 3.31Å; I202-W248 HydrophobicContact CD1-CB 4.35Å
203	R	91	Very high	92.1	Very high	6 Å²	6	41 Å²	41	2%	0.023	20%	0.196	C	C	.	.	H	α-helix	trans	-84	-6.6	-175.5	-65.9	-64.4	-54.5	-124.1	-13.2	114	A199 I200 E201 E208 W227 Y229 W248	A199-R203 PolarHBondContact O-N 2.92Å; I200-R203 HydrophobicContact CD1-CB 4.32Å; I200-R203 CarbonylContact O-C 3.59Å; I200-R203 PolarHBondContact O-N 3.09Å; E201-R203 VanDerWaalsContact C-N 3.33Å; E201-R203 PolarHBondContact O-N 3.14Å; R203-E208 IonicContact CZ-OE1 3.39Å; R203-E208 IonicContact NE-OE1 2.78Å; R203-E208 PolarHBondContact NE-OE1 2.98Å; R203-E208 IonicContact NH2-OE1 3.39Å; R203-E208 PolarHBondContact NH2-OE1 3.39Å; R203-W227 HydrophobicContact CB-CH2 4.04Å; R203-W227 HydrophobicContact CB-CZ3 3.98Å; R203-W227 HydrophobicContact CG-CH2 4.38Å; R203-Y229 PolarHBondContact NH2-OH 3.26Å; R203-W248 HydrophobicContact CG-CE3 4.29Å; R203-W248 HydrophobicContact CG-CH2 4.11Å; R203-W248 HydrophobicContact CG-CZ3 3.62Å
204	Q	88.6	Confident	92.2	Very high	55 Å²	55	41.2 Å²	41.2	26%	0.257	20%	0.197	S	C	.	.	H	α-helix	trans	-87.5	-16	174.9	-80.8	177.3	-7.8	0	0	112.3	N166 I200 E201 N206 Q207 A209	N166-Q204 PolarHBondContact ND2-NE2 2.8Å; N166-Q204 PolarHBondContact OD1-NE2 2.88Å; I200-Q204 HydrophobicContact CD1-CG 4.22Å; I200-Q204 HydrophobicContact CG1-CG 4.04Å; I200-Q204 WeakPolarHBondContact O-CB 3.29Å; I200-Q204 VanDerWaalsContact O-CG 3.3Å; I200-Q204 WeakPolarHBondContact O-CG 3.47Å; I200-Q204 PolarHBondContact O-N 2.82Å; E201-Q204 PolarHBondContact O-N 2.82Å; Q204-N206 VanDerWaalsContact C-N 3.27Å; Q204-N206 PolarHBondContact O-N 2.82Å; Q204-Q207 PolarHBondContact O-N 3.36Å; Q204-A209 HydrophobicContact CG-CB 3.86Å
205	Q	85.2	Confident	92.3	Very high	112 Å²	112	37.1 Å²	37.1	52%	0.523	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-27.5	-177.3	-64.3	179.5	8	0	0	113.9
206	N	86.4	Confident	92.3	Very high	59 Å²	59	37.5 Å²	37.5	32%	0.316	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	13.8	175.3	-26	-84.7	0	0	0	112.7	Q204 E208 I238	Q204-N206 VanDerWaalsContact C-N 3.27Å; Q204-N206 PolarHBondContact O-N 2.82Å; N206-E208 VanDerWaalsContact CA-OE2 3.29Å; N206-E208 WeakPolarHBondContact CA-OE2 3.38Å; N206-E208 WeakPolarHBondContact CB-OE2 3.33Å; N206-E208 PolarHBondContact N-OE2 3.49Å; N206-E208 PolarHBondContact ND2-OE1 3.26Å; N206-E208 PolarHBondContact ND2-OE2 3.5Å; N206-E208 PolarHBondContact O-N 3.05Å; N206-E208 VanDerWaalsContact O-N 3.07Å; N206-I238 HydrophobicContact CB-CD1 4.22Å; N206-I238 HydrophobicContact CB-CG1 4.24Å; N206-I238 HydrophobicContact CB-CG2 4.21Å
207	Q	88.8	Confident	92.4	Very high	158 Å²	158	41.3 Å²	41.3	74%	0.738	20%	0.199	S	C	*	.	S	Bend	trans	57.4	19.2	177.3	-57.6	-176	-31.3	0	0	114.6	R171 Q204	R171-Q207 PolarHBondContact NH1-O 3.26Å; R171-Q207 PolarHBondContact NH2-O 2.83Å; Q204-Q207 PolarHBondContact O-N 3.36Å
208	E	93.5	Very high	92.5	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.208	C	C	.	.			trans	-77.8	-20	-178.9	71.3	-92.8	-148	0	0	113.6	R203 N206 V210 W227 A228 Y229 I238	R203-E208 IonicContact CZ-OE1 3.39Å; R203-E208 IonicContact NE-OE1 2.78Å; R203-E208 PolarHBondContact NE-OE1 2.98Å; R203-E208 IonicContact NH2-OE1 3.39Å; R203-E208 PolarHBondContact NH2-OE1 3.39Å; N206-E208 VanDerWaalsContact CA-OE2 3.29Å; N206-E208 WeakPolarHBondContact CA-OE2 3.38Å; N206-E208 WeakPolarHBondContact CB-OE2 3.33Å; N206-E208 PolarHBondContact N-OE2 3.49Å; N206-E208 PolarHBondContact ND2-OE1 3.26Å; N206-E208 PolarHBondContact ND2-OE2 3.5Å; N206-E208 PolarHBondContact O-N 3.05Å; N206-E208 VanDerWaalsContact O-N 3.07Å; E208-V210 PolarHBondContact O-N 3.38Å; E208-W227 HydrophobicContact CB-CE3 4.43Å; E208-W227 HydrophobicContact CG-CE3 3.59Å; E208-W227 HydrophobicContact CG-CZ3 4Å; E208-W227 CarbonylContact O-C 3.56Å; E208-W227 VanDerWaalsContact O-CA 3.23Å; E208-W227 WeakPolarHBondContact O-CA 3.3Å; E208-A228 WeakPolarHBondContact CA-O 3.39Å; E208-A228 WeakPolarHBondContact CB-O 3.42Å; E208-A228 PolarHBondContact O-N 3.4Å; E208-Y229 HydrophobicContact CB-CD1 4.13Å; E208-Y229 HydrophobicContact CB-CE1 3.59Å; E208-Y229 HydrophobicContact CG-CE1 4.05Å; E208-I238 HydrophobicContact CG-CG2 4.37Å; E208-I238 WeakPolarHBondContact OE1-CG2 3.49Å
209	A	95.3	Very high	92.8	Very high	5 Å²	5	38.1 Å²	38.1	4%	0.041	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	120.9	-176	0	0	0	0	0	111.4	W165 R171 I200 Q204 W227	W165-A209 HydrophobicContact CZ2-CB 4.35Å; R171-A209 PolarHBondContact NH2-O 3.42Å; I200-A209 HydrophobicContact CD1-CB 3.96Å; Q204-A209 HydrophobicContact CG-CB 3.86Å; A209-W227 HydrophobicContact CB-CE3 4.18Å; A209-W227 HydrophobicContact CB-CZ3 3.78Å
210	V	95.9	Very high	93	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-50.2	177.6	-177	0	0	0	0	111.2	P168 Y177 E208 L226 A228 L275	P168-V210 WeakPolarHBondContact CA-O 3.38Å; P168-V210 HydrophobicContact CB-CG1 4.09Å; Y177-V210 HydrophobicContact CD1-CG2 4.31Å; Y177-V210 HydrophobicContact CE1-CG1 4.47Å; Y177-V210 HydrophobicContact CE1-CG2 3.99Å; E208-V210 PolarHBondContact O-N 3.38Å; V210-L226 WeakPolarHBondContact CA-O 3.37Å; V210-L226 HydrophobicContact CB-CB 4.17Å; V210-L226 HydrophobicContact CB-CD2 4.13Å; V210-L226 HydrophobicContact CB-CG 3.9Å; V210-L226 VanDerWaalsContact CB-O 3.29Å; V210-L226 WeakPolarHBondContact CB-O 3.42Å; V210-L226 HydrophobicContact CG1-CD2 3.68Å; V210-L226 HydrophobicContact CG1-CG 4.02Å; V210-L226 HydrophobicContact CG2-CG 4.43Å; V210-L226 PolarHBondContact N-O 3.17Å; V210-A228 HydrophobicContact CG2-CB 3.49Å; V210-A228 VanDerWaalsContact CG2-CB 3.49Å; V210-L275 HydrophobicContact CG1-CD1 4.06Å
211	G	95.9	Very high	93	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.1	149.7	-176.6	0	0	0	0	0	112.3	W165 L226	W165-G211 VanDerWaalsContact NE1-N 3.15Å; G211-L226 PolarHBondContact N-O 3.16Å; G211-L226 PolarHBondContact O-N 3.5Å
212	G	96.6	Very high	93.4	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	125.1	177.2	0	0	0	0	0	109.6	E161 F162 W165 H224	E161-G212 WeakPolarHBondContact CA-O 3.23Å; F162-G212 VanDerWaalsContact CD2-C 3.48Å; F162-G212 PolarHBondContact N-O 3.33Å; W165-G212 VanDerWaalsContact CD1-N 3.3Å; W165-G212 VanDerWaalsContact CD2-CA 3.47Å; W165-G212 VanDerWaalsContact CG-N 3.29Å; G212-H224 CarbonylContact C-O 3.57Å; G212-H224 WeakPolarHBondContact CA-O 3.3Å
213	F	96.8	Very high	93.8	Very high	3 Å²	3	40.4 Å²	40.4	1%	0.013	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	154.2	-169.3	-46.4	-86	0	0	0	112.2	Y64 L117 L159 L160 E161 P168 V223 H224 L226	Y64-F213 HydrophobicContact CD1-CD1 4.41Å; Y64-F213 AromaticContact CD1-CE1 3.72Å; Y64-F213 HydrophobicContact CD1-CE1 3.72Å; Y64-F213 HydrophobicContact CD1-CZ 4.4Å; Y64-F213 AromaticContact CD2-CD1 4Å; Y64-F213 HydrophobicContact CD2-CD1 4Å; Y64-F213 AromaticContact CD2-CE1 3.88Å; Y64-F213 HydrophobicContact CD2-CE1 3.88Å; Y64-F213 AromaticContact CE1-CE1 3.75Å; Y64-F213 HydrophobicContact CE1-CE1 3.75Å; Y64-F213 HydrophobicContact CE1-CZ 4.36Å; Y64-F213 HydrophobicContact CE2-CD1 4.34Å; Y64-F213 AromaticContact CE2-CE1 3.91Å; Y64-F213 HydrophobicContact CE2-CE1 3.91Å; Y64-F213 HydrophobicContact CG-CD1 4.03Å; Y64-F213 AromaticContact CG-CE1 3.77Å; Y64-F213 HydrophobicContact CG-CE1 3.77Å; Y64-F213 AromaticContact CZ-CE1 3.84Å; L117-F213 HydrophobicContact CD2-CE2 4.07Å; L117-F213 HydrophobicContact CD2-CZ 3.84Å; L159-F213 HydrophobicContact CB-CB 3.97Å; L159-F213 HydrophobicContact CD1-CB 3.69Å; L159-F213 HydrophobicContact CD1-CG 4.1Å; L159-F213 HydrophobicContact CG-CB 4.43Å; L160-F213 CarbonylContact O-C 3.49Å; L160-F213 WeakPolarHBondContact O-CA 3.2Å; E161-F213 HydrophobicContact CB-CD1 4.04Å; E161-F213 HydrophobicContact CB-CE1 4.24Å; P168-F213 HydrophobicContact CG-CE1 4.46Å; P168-F213 HydrophobicContact CG-CZ 3.79Å; F213-V223 CarbonylContact O-C 3.54Å; F213-V223 WeakPolarHBondContact O-CA 3.32Å; F213-V223 WeakPolarHBondContact O-CG1 3.45Å; F213-H224 HydrophobicContact CB-CB 4.36Å; F213-H224 HydrophobicContact CD2-CB 4.36Å; F213-H224 PolarHBondContact N-O 2.85Å; F213-H224 PolarHBondContact O-N 2.81Å; F213-L226 HydrophobicContact CE2-CB 4.46Å
214	F	96.2	Very high	94.1	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.018	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	143.3	172.4	62.2	-81.8	0	0	0	111.7	L55 L159 L160 F162 M189 Q222 V223	L55-F214 HydrophobicContact CB-CE1 3.99Å; L55-F214 HydrophobicContact CB-CZ 3.96Å; L159-F214 VanDerWaalsContact CA-O 3.28Å; L159-F214 WeakPolarHBondContact CA-O 3.41Å; L160-F214 HydrophobicContact CB-CD1 4.38Å; L160-F214 HydrophobicContact CB-CE1 3.77Å; L160-F214 HydrophobicContact CB-CE2 4.06Å; L160-F214 HydrophobicContact CB-CZ 3.59Å; L160-F214 HydrophobicContact CD1-CE2 4.07Å; L160-F214 HydrophobicContact CD1-CZ 3.94Å; L160-F214 HydrophobicContact CG-CZ 4.4Å; L160-F214 PolarHBondContact N-O 2.94Å; L160-F214 WeakPolarHBondContact O-CD1 3.32Å; L160-F214 PolarHBondContact O-N 2.91Å; F162-F214 AromaticContact CD1-CD1 3.68Å; F162-F214 HydrophobicContact CD1-CD1 3.68Å; F162-F214 AromaticContact CD1-CE1 3.98Å; F162-F214 HydrophobicContact CD1-CE1 3.98Å; F162-F214 HydrophobicContact CD2-CD1 4.37Å; F162-F214 HydrophobicContact CE1-CB 4.23Å; F162-F214 AromaticContact CE1-CD1 3.5Å; F162-F214 HydrophobicContact CE1-CD1 3.5Å; F162-F214 VanDerWaalsContact CE1-CD1 3.5Å; F162-F214 HydrophobicContact CE1-CE1 4.13Å; F162-F214 HydrophobicContact CE1-CG 4.09Å; F162-F214 HydrophobicContact CE2-CB 4.3Å; F162-F214 HydrophobicContact CE2-CD1 4.21Å; F162-F214 HydrophobicContact CG-CD1 4.13Å; F162-F214 HydrophobicContact CZ-CB 3.78Å; F162-F214 AromaticContact CZ-CD1 3.79Å; F162-F214 HydrophobicContact CZ-CD1 3.79Å; F162-F214 HydrophobicContact CZ-CG 4.13Å; M189-F214 HydrophobicContact CE-CB 4.07Å; M189-F214 HydrophobicContact SD-CB 3.97Å; F214-Q222 WeakPolarHBondContact CA-O 3.5Å; F214-V223 HydrophobicContact CB-CG2 4.24Å
215	S	95.6	Very high	94.6	Very high	7 Å²	7	37.5 Å²	37.5	5%	0.049	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	131.6	-175.7	61.3	0	0	0	0	112.8	S219 Y221 Q222	S215-S219 WeakPolarHBondContact CB-O 3.43Å; S215-S219 PolarHBondContact OG-O 3.35Å; S215-Y221 PolarHBondContact OG-N 3.5Å; S215-Q222 PolarHBondContact N-O 3.24Å; S215-Q222 PolarHBondContact OG-N 2.81Å; S215-Q222 VanDerWaalsContact OG-N 3.13Å; S215-Q222 PolarHBondContact OG-O 3.23Å
216	Q	94.1	Very high	95.2	Very high	51 Å²	51	32.3 Å²	32.3	24%	0.238	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	-41.3	163	-66.7	-57.2	-75.4	0	0	112.1	S52 L158 L160 L220	S52-Q216 PolarHBondContact OG-OE1 2.73Å; L158-Q216 PolarHBondContact O-N 2.8Å; L160-Q216 HydrophobicContact CB-CG 4.44Å; L160-Q216 HydrophobicContact CD1-CG 3.57Å; L160-Q216 HydrophobicContact CG-CG 3.54Å; Q216-L220 WeakPolarHBondContact O-CD2 3.09Å
217	I	95.6	Very high	95.7	Very high	92 Å²	92	29.6 Å²	29.6	47%	0.472	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	139.8	-179.2	-55.9	-171.9	0	0	0	109.4	Y124 Q157 L158	Y124-I217 HydrophobicContact CE1-CD1 4.06Å; Q157-I217 VanDerWaalsContact CA-O 3.32Å; Q157-I217 WeakPolarHBondContact CA-O 3.35Å; L158-I217 HydrophobicContact CB-CB 4.1Å; L158-I217 HydrophobicContact CD1-CB 4.38Å; L158-I217 HydrophobicContact CD1-CD1 4.12Å; L158-I217 HydrophobicContact CG-CB 4.47Å; L158-I217 PolarHBondContact N-O 3.27Å; L158-I217 PolarHBondContact O-N 3.33Å
218	G	95.9	Very high	96.1	Very high	43 Å²	43	22.2 Å²	22.2	44%	0.443	12%	0.124	S	C	.	.	S	Bend	trans	107.3	-141.8	-170.3	0	0	0	0	0	110.3	L220	G218-L220 PolarHBondContact O-N 3.04Å; G218-L220 VanDerWaalsContact O-N 3.16Å
219	S	93.8	Very high	96.2	Very high	44 Å²	44	22.3 Å²	22.3	31%	0.308	13%	0.125	S	C	.	.	S	Bend	trans	-64.9	114.9	173	-40.2	0	0	0	0	110	Q157 S215 Q222	Q157-S219 VanDerWaalsContact NE2-CB 3.34Å; Q157-S219 PolarHBondContact NE2-O 2.97Å; Q157-S219 PolarHBondContact NE2-OG 3.1Å; S215-S219 WeakPolarHBondContact CB-O 3.43Å; S215-S219 PolarHBondContact OG-O 3.35Å; S219-Q222 VanDerWaalsContact CB-OE1 3.24Å
220	L	94.3	Very high	96.2	Very high	97 Å²	97	29.3 Å²	29.3	51%	0.508	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	159.3	-176.6	-59.8	-179.1	0	0	0	111.9	Q183 Q216 G218 Q222	Q183-L220 PolarHBondContact NE2-O 2.82Å; Q183-L220 PolarHBondContact OE1-O 2.82Å; Q216-L220 WeakPolarHBondContact O-CD2 3.09Å; G218-L220 PolarHBondContact O-N 3.04Å; G218-L220 VanDerWaalsContact O-N 3.16Å; L220-Q222 PolarHBondContact O-N 2.8Å
221	Y	94.9	Very high	96.2	Very high	92 Å²	92	32 Å²	32	36%	0.361	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	24.1	-174.7	-53.9	-81	0	0	0	113.6	L184 P186 G187 S215	L184-Y221 WeakPolarHBondContact CB-O 3.5Å; L184-Y221 PolarHBondContact N-O 2.9Å; P186-Y221 HydrophobicContact CB-CD2 4.13Å; P186-Y221 HydrophobicContact CB-CE1 4.49Å; P186-Y221 HydrophobicContact CB-CE2 3.81Å; P186-Y221 HydrophobicContact CG-CD2 4.21Å; P186-Y221 HydrophobicContact CG-CE2 4.26Å; G187-Y221 VanDerWaalsContact N-CE1 3.31Å; S215-Y221 PolarHBondContact OG-N 3.5Å
222	Q	97.2	Very high	96.3	Very high	16 Å²	16	35 Å²	35	8%	0.075	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	134.7	176.4	-169.1	170.1	7.8	0	0	110.6	Y182 F214 S215 S219 L220 H224	Y182-Q222 CarbonylContact O-C 3.56Å; Y182-Q222 VanDerWaalsContact O-CA 3.31Å; Y182-Q222 WeakPolarHBondContact O-CA 3.23Å; F214-Q222 WeakPolarHBondContact CA-O 3.5Å; S215-Q222 PolarHBondContact N-O 3.24Å; S215-Q222 PolarHBondContact OG-N 2.81Å; S215-Q222 VanDerWaalsContact OG-N 3.13Å; S215-Q222 PolarHBondContact OG-O 3.23Å; S219-Q222 VanDerWaalsContact CB-OE1 3.24Å; L220-Q222 PolarHBondContact O-N 2.8Å; Q222-H224 PolarHBondContact NE2-CE1 3.38Å
223	V	97.7	Very high	96.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	141.9	173.9	174.1	0	0	0	0	109.9	F162 S181 Y182 L184 M189 W192 F213 F214	F162-V223 HydrophobicContact CE2-CG1 3.62Å; F162-V223 HydrophobicContact CE2-CG2 4.36Å; F162-V223 HydrophobicContact CZ-CG1 4Å; F162-V223 HydrophobicContact CZ-CG2 3.89Å; S181-V223 CarbonylContact C-O 3.51Å; S181-V223 WeakPolarHBondContact CA-O 3.46Å; Y182-V223 HydrophobicContact CD2-CG1 4.45Å; Y182-V223 PolarHBondContact N-O 2.68Å; Y182-V223 PolarHBondContact O-N 3.43Å; L184-V223 HydrophobicContact CD1-CG2 3.76Å; L184-V223 HydrophobicContact CG-CG2 4.22Å; M189-V223 HydrophobicContact CE-CG2 3.73Å; M189-V223 HydrophobicContact SD-CG2 3.46Å; M189-V223 WeakPolarHBondContact SD-CG2 3.34Å; W192-V223 HydrophobicContact CE3-CG2 4.36Å; W192-V223 HydrophobicContact CH2-CB 4.07Å; W192-V223 HydrophobicContact CH2-CG1 3.41Å; W192-V223 VanDerWaalsContact CH2-CG1 3.41Å; W192-V223 HydrophobicContact CH2-CG2 4.33Å; W192-V223 HydrophobicContact CZ2-CG1 4.34Å; W192-V223 HydrophobicContact CZ3-CB 4.26Å; W192-V223 HydrophobicContact CZ3-CG1 3.65Å; W192-V223 HydrophobicContact CZ3-CG2 4.06Å; F213-V223 CarbonylContact O-C 3.54Å; F213-V223 WeakPolarHBondContact O-CA 3.32Å; F213-V223 WeakPolarHBondContact O-CG1 3.45Å; F214-V223 HydrophobicContact CB-CG2 4.24Å
224	H	98.3	Very high	96.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	124.1	176.3	-66.9	-66.6	0	0	0	110.1	Q157 L179 R180 S181 G212 F213 Q222	Q157-H224 PolarHBondContact OE1-NE2 3.48Å; L179-H224 HydrophobicContact CD1-CB 4.08Å; R180-H224 CarbonylContact O-C 3.55Å; R180-H224 WeakPolarHBondContact O-CA 3.31Å; S181-H224 PolarHBondContact OG-CE1 3.23Å; S181-H224 PolarHBondContact OG-ND1 2.81Å; G212-H224 CarbonylContact C-O 3.57Å; G212-H224 WeakPolarHBondContact CA-O 3.3Å; F213-H224 HydrophobicContact CB-CB 4.36Å; F213-H224 HydrophobicContact CD2-CB 4.36Å; F213-H224 PolarHBondContact N-O 2.85Å; F213-H224 PolarHBondContact O-N 2.81Å; Q222-H224 PolarHBondContact NE2-CE1 3.38Å
225	H	97.9	Very high	96.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	126.9	166.1	-63.8	167.6	0	0	0	109.6	W165 L179 R180 Y182 W192 W196 W227	W165-H225 HydrophobicContact CH2-CB 3.96Å; W165-H225 AromaticContact CH2-CD2 3.3Å; W165-H225 WeakPolarHBondContact CH2-CD2 3.45Å; W165-H225 AromaticContact CH2-CE1 3.75Å; W165-H225 AromaticContact CH2-CG 3.45Å; W165-H225 VanDerWaalsContact CH2-CG 3.45Å; W165-H225 AromaticContact CH2-ND1 3.74Å; W165-H225 AromaticContact CH2-NE2 3.53Å; W165-H225 HydrophobicContact CZ2-CB 4.34Å; W165-H225 AromaticContact CZ3-CD2 3.39Å; W165-H225 WeakPolarHBondContact CZ3-CD2 3.39Å; W165-H225 AromaticContact CZ3-CE1 3.74Å; W165-H225 AromaticContact CZ3-CG 3.99Å; W165-H225 AromaticContact CZ3-NE2 3.23Å; W165-H225 WeakPolarHBondContact CZ3-NE2 3.16Å; L179-H225 WeakPolarHBondContact CA-O 3.36Å; R180-H225 HydrophobicContact CB-CB 4.44Å; R180-H225 PolarHBondContact N-O 2.92Å; R180-H225 PolarHBondContact O-N 3.31Å; Y182-H225 AromaticContact CE2-ND1 3.61Å; W192-H225 AromaticContact CH2-CE1 3.32Å; W192-H225 WeakPolarHBondContact CH2-CE1 3.31Å; W192-H225 AromaticContact CH2-NE2 3.31Å; W192-H225 VanDerWaalsContact CH2-NE2 3.31Å; W192-H225 WeakPolarHBondContact CH2-NE2 3.46Å; W192-H225 AromaticContact CZ3-NE2 3.89Å; W196-H225 AromaticContact CD2-CE1 3.49Å; W196-H225 VanDerWaalsContact CD2-CE1 3.49Å; W196-H225 AromaticContact CE2-CE1 3.55Å; W196-H225 AromaticContact CE3-CE1 3.46Å; W196-H225 VanDerWaalsContact CE3-CE1 3.46Å; W196-H225 AromaticContact CH2-CE1 3.54Å; W196-H225 AromaticContact CH2-ND1 3.64Å; W196-H225 AromaticContact CZ2-CE1 3.57Å; W196-H225 AromaticContact CZ2-ND1 3.92Å; W196-H225 AromaticContact CZ3-CE1 3.49Å; W196-H225 VanDerWaalsContact CZ3-CE1 3.49Å; W196-H225 WeakPolarHBondContact CZ3-CE1 3.18Å; W196-H225 AromaticContact CZ3-ND1 3.82Å; H225-W227 HydrophobicContact CB-CZ2 3.8Å; H225-W227 AromaticContact CG-CZ2 3.97Å; H225-W227 AromaticContact ND1-CZ2 3.7Å
226	L	98	Very high	96.4	Very high	3 Å²	3	47.8 Å²	47.8	2%	0.016	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	123.2	172.6	-172.9	62.6	0	0	0	108.8	W104 L117 Y177 L179 V210 G211 F213 M267	W104-L226 HydrophobicContact CH2-CD2 3.87Å; W104-L226 HydrophobicContact CZ2-CD2 4.05Å; L117-L226 HydrophobicContact CD2-CD2 4.4Å; Y177-L226 HydrophobicContact CD1-CD1 4.06Å; Y177-L226 HydrophobicContact CD1-CG 4.25Å; L179-L226 HydrophobicContact CB-CD1 4.44Å; L179-L226 HydrophobicContact CD1-CD1 4.38Å; V210-L226 WeakPolarHBondContact CA-O 3.37Å; V210-L226 HydrophobicContact CB-CB 4.17Å; V210-L226 HydrophobicContact CB-CD2 4.13Å; V210-L226 HydrophobicContact CB-CG 3.9Å; V210-L226 VanDerWaalsContact CB-O 3.29Å; V210-L226 WeakPolarHBondContact CB-O 3.42Å; V210-L226 HydrophobicContact CG1-CD2 3.68Å; V210-L226 HydrophobicContact CG1-CG 4.02Å; V210-L226 HydrophobicContact CG2-CG 4.43Å; V210-L226 PolarHBondContact N-O 3.17Å; G211-L226 PolarHBondContact N-O 3.16Å; G211-L226 PolarHBondContact O-N 3.5Å; F213-L226 HydrophobicContact CE2-CB 4.46Å; L226-M267 HydrophobicContact CD1-CE 3.74Å
227	W	97.4	Very high	96.5	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.008	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	152.8	178.3	-48.8	95.2	0	0	0	109.9	W165 Y177 E178 W196 I200 R203 E208 A209 H225 Y229	W165-W227 AromaticContact CH2-CH2 3.45Å; W165-W227 HydrophobicContact CH2-CH2 3.45Å; W165-W227 VanDerWaalsContact CH2-CH2 3.45Å; W165-W227 AromaticContact CH2-CZ2 3.58Å; W165-W227 HydrophobicContact CH2-CZ2 3.58Å; W165-W227 HydrophobicContact CH2-CZ3 4.25Å; W165-W227 HydrophobicContact CZ2-CE3 4.45Å; W165-W227 AromaticContact CZ2-CH2 3.56Å; W165-W227 HydrophobicContact CZ2-CH2 3.56Å; W165-W227 AromaticContact CZ2-CZ2 3.87Å; W165-W227 HydrophobicContact CZ2-CZ2 3.87Å; W165-W227 AromaticContact CZ2-CZ3 3.89Å; W165-W227 HydrophobicContact CZ2-CZ3 3.89Å; Y177-W227 CarbonylContact C-O 3.54Å; Y177-W227 VanDerWaalsContact CA-O 3.23Å; Y177-W227 WeakPolarHBondContact CA-O 3.46Å; E178-W227 HydrophobicContact CB-CB 4.27Å; E178-W227 PolarHBondContact N-O 2.9Å; E178-W227 PolarHBondContact O-N 3.34Å; W196-W227 HydrophobicContact CH2-CZ2 4.23Å; W196-W227 HydrophobicContact CZ3-CH2 4.11Å; W196-W227 HydrophobicContact CZ3-CZ2 4.07Å; I200-W227 HydrophobicContact CD1-CH2 3.9Å; I200-W227 HydrophobicContact CD1-CZ3 4.13Å; R203-W227 HydrophobicContact CB-CH2 4.04Å; R203-W227 HydrophobicContact CB-CZ3 3.98Å; R203-W227 HydrophobicContact CG-CH2 4.38Å; E208-W227 HydrophobicContact CB-CE3 4.43Å; E208-W227 HydrophobicContact CG-CE3 3.59Å; E208-W227 HydrophobicContact CG-CZ3 4Å; E208-W227 CarbonylContact O-C 3.56Å; E208-W227 VanDerWaalsContact O-CA 3.23Å; E208-W227 WeakPolarHBondContact O-CA 3.3Å; A209-W227 HydrophobicContact CB-CE3 4.18Å; A209-W227 HydrophobicContact CB-CZ3 3.78Å; H225-W227 HydrophobicContact CB-CZ2 3.8Å; H225-W227 AromaticContact CG-CZ2 3.97Å; H225-W227 AromaticContact ND1-CZ2 3.7Å; W227-Y229 HydrophobicContact CB-CD2 4.43Å; W227-Y229 HydrophobicContact CB-CE2 3.57Å; W227-Y229 HydrophobicContact CG-CE2 4.44Å
228	A	96.9	Very high	96.5	Very high	4 Å²	4	45 Å²	45	3%	0.033	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	139.9	172.9	0	0	0	0	0	110.6	N175 I176 Y177 E208 V210	N175-A228 HydrophobicContact CB-CB 4.34Å; I176-A228 WeakPolarHBondContact O-CA 3.3Å; Y177-A228 HydrophobicContact CD1-CB 3.96Å; Y177-A228 HydrophobicContact CE1-CB 3.67Å; E208-A228 WeakPolarHBondContact CA-O 3.39Å; E208-A228 WeakPolarHBondContact CB-O 3.42Å; E208-A228 PolarHBondContact O-N 3.4Å; V210-A228 HydrophobicContact CG2-CB 3.49Å; V210-A228 VanDerWaalsContact CG2-CB 3.49Å
229	Y	96.6	Very high	96.5	Very high	3 Å²	3	45.8 Å²	45.8	1%	0.012	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	152.4	-177.8	-58.6	-73.7	0	0	0	109.2	N175 I176 E178 R203 E208 W227 D231 R235 I238	N175-Y229 CarbonylContact C-O 3.51Å; N175-Y229 VanDerWaalsContact CA-O 3.27Å; N175-Y229 WeakPolarHBondContact CA-O 3.23Å; I176-Y229 PolarHBondContact N-O 3.16Å; I176-Y229 PolarHBondContact O-N 3.09Å; E178-Y229 HydrophobicContact CB-CD2 4.44Å; E178-Y229 HydrophobicContact CB-CE2 3.98Å; R203-Y229 PolarHBondContact NH2-OH 3.26Å; E208-Y229 HydrophobicContact CB-CD1 4.13Å; E208-Y229 HydrophobicContact CB-CE1 3.59Å; E208-Y229 HydrophobicContact CG-CE1 4.05Å; W227-Y229 HydrophobicContact CB-CD2 4.43Å; W227-Y229 HydrophobicContact CB-CE2 3.57Å; W227-Y229 HydrophobicContact CG-CE2 4.44Å; Y229-D231 VanDerWaalsContact C-N 3.31Å; Y229-D231 PolarHBondContact O-N 3.3Å; Y229-R235 HydrophobicContact CD1-CB 3.96Å; Y229-R235 HydrophobicContact CD1-CG 4.38Å; Y229-R235 HydrophobicContact CD2-CB 3.77Å; Y229-R235 HydrophobicContact CD2-CG 3.74Å; Y229-R235 HydrophobicContact CE1-CB 4.38Å; Y229-R235 HydrophobicContact CE1-CG 4.36Å; Y229-R235 HydrophobicContact CE2-CB 4.2Å; Y229-R235 HydrophobicContact CE2-CG 3.7Å; Y229-R235 HydrophobicContact CG-CB 3.63Å; Y229-R235 HydrophobicContact CG-CG 4.09Å; Y229-I238 HydrophobicContact CD1-CD1 3.98Å; Y229-I238 HydrophobicContact CE1-CB 4.31Å; Y229-I238 HydrophobicContact CE1-CD1 4.22Å; Y229-I238 HydrophobicContact CE1-CG2 4.12Å
230	K	95.6	Very high	96.5	Very high	152 Å²	152	47.4 Å²	47.4	66%	0.661	24%	0.236	S	C	*	.	S	Bend	trans	-61	-43.9	173.5	179.8	-173.4	174.2	-174.4	0	111.3
231	D	95.8	Very high	96.5	Very high	58 Å²	58	44.8 Å²	44.8	31%	0.31	23%	0.228	S	C	.	.	S	Bend	trans	-162.2	177.3	-175.3	51.6	45.1	0	0	0	111	I176 Y229 Q233 S234 R235	I176-D231 VanDerWaalsContact CD1-C 3.41Å; Y229-D231 VanDerWaalsContact C-N 3.31Å; Y229-D231 PolarHBondContact O-N 3.3Å; D231-Q233 VanDerWaalsContact C-N 3.29Å; D231-Q233 PolarHBondContact O-N 3.19Å; D231-Q233 PolarHBondContact OD1-N 3.37Å; D231-S234 PolarHBondContact N-OG 2.89Å; D231-S234 PolarHBondContact O-OG 3.06Å; D231-S234 VanDerWaalsContact OD1-CB 3.3Å; D231-S234 WeakPolarHBondContact OD1-CB 3.19Å; D231-S234 PolarHBondContact OD1-N 2.85Å; D231-S234 PolarHBondContact OD1-OG 2.8Å; D231-R235 WeakPolarHBondContact O-CB 3.34Å; D231-R235 PolarHBondContact O-N 2.9Å
232	L	97.3	Very high	96.4	Very high	62 Å²	62	40.5 Å²	40.5	33%	0.325	21%	0.212	S	C	.	.	H	α-helix	trans	-65.7	-29.9	179.5	-70.8	175.6	0	0	0	113.3	W107 Y108 I176 R235 D236 I266	W107-L232 HydrophobicContact CH2-CD1 3.85Å; W107-L232 HydrophobicContact CZ3-CD1 3.68Å; W107-L232 HydrophobicContact CZ3-CG 4.04Å; Y108-L232 HydrophobicContact CE2-CD1 3.85Å; I176-L232 HydrophobicContact CD1-CD2 3.65Å; I176-L232 HydrophobicContact CD1-CG 3.88Å; L232-R235 WeakPolarHBondContact O-CB 3.33Å; L232-D236 PolarHBondContact O-N 2.97Å; L232-I266 HydrophobicContact CD2-CD1 4.28Å; L232-I266 HydrophobicContact CD2-CG1 4.12Å; L232-I266 HydrophobicContact CD2-CG2 4.1Å
233	Q	97.4	Very high	96.1	Very high	141 Å²	141	46.6 Å²	46.6	66%	0.659	23%	0.234	S	C	*	.	H	α-helix	trans	-71.3	-47.2	-179.8	-175.3	62.3	41	0	0	111	D231 R235 D236 A237	D231-Q233 VanDerWaalsContact C-N 3.29Å; D231-Q233 PolarHBondContact O-N 3.19Å; D231-Q233 PolarHBondContact OD1-N 3.37Å; Q233-R235 VanDerWaalsContact C-N 3.32Å; Q233-R235 PolarHBondContact O-N 3.24Å; Q233-D236 PolarHBondContact O-N 3.29Å; Q233-A237 WeakPolarHBondContact O-CB 3.37Å; Q233-A237 PolarHBondContact O-N 2.77Å
234	S	95.9	Very high	95.9	Very high	27 Å²	27	54.1 Å²	54.1	19%	0.189	27%	0.269	C	S	.	.	H	α-helix	trans	-63.1	-38.3	173.9	54.6	0	0	0	0	111.6	D231 D236 A237 I238	D231-S234 PolarHBondContact N-OG 2.89Å; D231-S234 PolarHBondContact O-OG 3.06Å; D231-S234 VanDerWaalsContact OD1-CB 3.3Å; D231-S234 WeakPolarHBondContact OD1-CB 3.19Å; D231-S234 PolarHBondContact OD1-N 2.85Å; D231-S234 PolarHBondContact OD1-OG 2.8Å; S234-D236 PolarHBondContact O-N 3.1Å; S234-A237 PolarHBondContact O-N 3.09Å; S234-I238 WeakPolarHBondContact O-CB 3.32Å; S234-I238 WeakPolarHBondContact O-CD1 3.08Å; S234-I238 VanDerWaalsContact O-CG1 3.27Å; S234-I238 WeakPolarHBondContact O-CG1 3.36Å; S234-I238 PolarHBondContact O-N 3.26Å
235	R	96.8	Very high	95.5	Very high	45 Å²	45	59 Å²	59	17%	0.17	29%	0.287	C	S	.	.	H	α-helix	trans	-54.9	-51.4	170.1	175.2	-173.9	174.8	-90.8	3.9	111.7	E178 Y229 D231 L232 Q233 R239	E178-R235 VanDerWaalsContact CD-NE 3.29Å; E178-R235 VanDerWaalsContact CD-NH2 3.26Å; E178-R235 IonicContact OE1-CZ 2.87Å; E178-R235 IonicContact OE1-NE 3.26Å; E178-R235 IonicContact OE1-NH2 3.94Å; E178-R235 PolarHBondContact OE1-NH2 3.39Å; E178-R235 IonicContact OE2-CZ 2.84Å; E178-R235 IonicContact OE2-NE 3.65Å; E178-R235 PolarHBondContact OE2-NE 3.35Å; E178-R235 IonicContact OE2-NH2 3.84Å; E178-R235 PolarHBondContact OE2-NH2 3.06Å; Y229-R235 HydrophobicContact CD1-CB 3.96Å; Y229-R235 HydrophobicContact CD1-CG 4.38Å; Y229-R235 HydrophobicContact CD2-CB 3.77Å; Y229-R235 HydrophobicContact CD2-CG 3.74Å; Y229-R235 HydrophobicContact CE1-CB 4.38Å; Y229-R235 HydrophobicContact CE1-CG 4.36Å; Y229-R235 HydrophobicContact CE2-CB 4.2Å; Y229-R235 HydrophobicContact CE2-CG 3.7Å; Y229-R235 HydrophobicContact CG-CB 3.63Å; Y229-R235 HydrophobicContact CG-CG 4.09Å; D231-R235 WeakPolarHBondContact O-CB 3.34Å; D231-R235 PolarHBondContact O-N 2.9Å; L232-R235 WeakPolarHBondContact O-CB 3.33Å; Q233-R235 VanDerWaalsContact C-N 3.32Å; Q233-R235 PolarHBondContact O-N 3.24Å; R235-R239 WeakPolarHBondContact O-CB 3.33Å; R235-R239 WeakPolarHBondContact O-CD 3.24Å; R235-R239 WeakPolarHBondContact O-CG 3.27Å; R235-R239 PolarHBondContact O-N 3.46Å
236	D	97.2	Very high	95.2	Very high	71 Å²	71	66.5 Å²	66.5	38%	0.38	33%	0.328	S	S	.	.	H	α-helix	trans	-61.9	-49.3	-180	-177.2	65.7	0	0	0	111.3	L232 Q233 S234 I238 R239 N240	L232-D236 PolarHBondContact O-N 2.97Å; Q233-D236 PolarHBondContact O-N 3.29Å; S234-D236 PolarHBondContact O-N 3.1Å; D236-I238 PolarHBondContact O-N 3.37Å; D236-R239 PolarHBondContact O-N 3.48Å; D236-N240 VanDerWaalsContact CG-ND2 3.26Å; D236-N240 WeakPolarHBondContact O-CB 3.39Å; D236-N240 PolarHBondContact O-N 3.13Å; D236-N240 PolarHBondContact O-ND2 3.42Å; D236-N240 VanDerWaalsContact O-ND2 3.17Å; D236-N240 PolarHBondContact OD1-ND2 2.9Å; D236-N240 VanDerWaalsContact OD1-ND2 3.13Å; D236-N240 PolarHBondContact OD2-ND2 2.69Å
237	A	96.8	Very high	94.9	Very high	53 Å²	53	67.7 Å²	67.7	44%	0.438	34%	0.34	S	S	.	.	H	α-helix	trans	-57.2	-48.2	178.7	0	0	0	0	0	112.6	Q233 S234 R239 N240 A241	Q233-A237 WeakPolarHBondContact O-CB 3.37Å; Q233-A237 PolarHBondContact O-N 2.77Å; S234-A237 PolarHBondContact O-N 3.09Å; A237-R239 PolarHBondContact O-N 3.12Å; A237-N240 PolarHBondContact O-N 3.38Å; A237-A241 VanDerWaalsContact O-CB 3.28Å; A237-A241 WeakPolarHBondContact O-CB 3.42Å; A237-A241 PolarHBondContact O-N 3.37Å
238	I	95.6	Very high	94.7	Very high	33 Å²	33	68.5 Å²	68.5	17%	0.169	34%	0.343	C	S	.	.	H	α-helix	trans	-63.4	-42.3	179.1	-72.5	165.5	0	0	0	111.1	N206 E208 Y229 S234 D236 A241 A242	N206-I238 HydrophobicContact CB-CD1 4.22Å; N206-I238 HydrophobicContact CB-CG1 4.24Å; N206-I238 HydrophobicContact CB-CG2 4.21Å; E208-I238 HydrophobicContact CG-CG2 4.37Å; E208-I238 WeakPolarHBondContact OE1-CG2 3.49Å; Y229-I238 HydrophobicContact CD1-CD1 3.98Å; Y229-I238 HydrophobicContact CE1-CB 4.31Å; Y229-I238 HydrophobicContact CE1-CD1 4.22Å; Y229-I238 HydrophobicContact CE1-CG2 4.12Å; S234-I238 WeakPolarHBondContact O-CB 3.32Å; S234-I238 WeakPolarHBondContact O-CD1 3.08Å; S234-I238 VanDerWaalsContact O-CG1 3.27Å; S234-I238 WeakPolarHBondContact O-CG1 3.36Å; S234-I238 PolarHBondContact O-N 3.26Å; D236-I238 PolarHBondContact O-N 3.37Å; I238-A241 PolarHBondContact O-N 3.05Å; I238-A242 PolarHBondContact O-N 2.77Å; I238-A242 VanDerWaalsContact O-N 3.1Å
239	R	94.7	Very high	94.5	Very high	59 Å²	59	73 Å²	73	22%	0.223	37%	0.367	C	S	.	.	H	α-helix	trans	-65.7	-39	178.6	-72.7	172.4	60.6	88	11.4	112.3	E178 R235 D236 A237 A242	E178-R239 IonicContact OE1-NH1 3.55Å; E178-R239 IonicContact OE2-NH1 3.68Å; R235-R239 WeakPolarHBondContact O-CB 3.33Å; R235-R239 WeakPolarHBondContact O-CD 3.24Å; R235-R239 WeakPolarHBondContact O-CG 3.27Å; R235-R239 PolarHBondContact O-N 3.46Å; D236-R239 PolarHBondContact O-N 3.48Å; A237-R239 PolarHBondContact O-N 3.12Å; R239-A242 WeakPolarHBondContact O-CB 3.34Å
240	N	94.4	Very high	94.4	Very high	78 Å²	78	77 Å²	77	42%	0.417	39%	0.386	S	S	.	.	H	α-helix	trans	-72.4	-37	177	-69.4	-32.4	0	0	0	111.5	D236 A237 A242 W243 H244	D236-N240 VanDerWaalsContact CG-ND2 3.26Å; D236-N240 WeakPolarHBondContact O-CB 3.39Å; D236-N240 PolarHBondContact O-N 3.13Å; D236-N240 PolarHBondContact O-ND2 3.42Å; D236-N240 VanDerWaalsContact O-ND2 3.17Å; D236-N240 PolarHBondContact OD1-ND2 2.9Å; D236-N240 VanDerWaalsContact OD1-ND2 3.13Å; D236-N240 PolarHBondContact OD2-ND2 2.69Å; A237-N240 PolarHBondContact O-N 3.38Å; N240-A242 VanDerWaalsContact C-N 3.26Å; N240-A242 PolarHBondContact O-N 3.03Å; N240-W243 PolarHBondContact O-N 3.21Å; N240-H244 PolarHBondContact O-ND1 3.23Å; N240-H244 VanDerWaalsContact O-ND1 3.17Å
241	A	93.8	Very high	94.3	Very high	41 Å²	41	70.1 Å²	70.1	34%	0.339	36%	0.356	S	S	.	.	H	α-helix	trans	-62.2	-32.3	174.6	0	0	0	0	0	112.5	A237 I238 W243 H244	A237-A241 VanDerWaalsContact O-CB 3.28Å; A237-A241 WeakPolarHBondContact O-CB 3.42Å; A237-A241 PolarHBondContact O-N 3.37Å; I238-A241 PolarHBondContact O-N 3.05Å; A241-W243 PolarHBondContact O-N 3.13Å; A241-H244 PolarHBondContact O-N 3.36Å
242	A	92.1	Very high	94.2	Very high	3 Å²	3	68.9 Å²	68.9	3%	0.025	35%	0.351	C	S	.	.	H	α-helix	trans	-59.2	-30.5	177.9	0	0	0	0	0	113.4	I238 R239 N240 H244 R245 W248	I238-A242 PolarHBondContact O-N 2.77Å; I238-A242 VanDerWaalsContact O-N 3.1Å; R239-A242 WeakPolarHBondContact O-CB 3.34Å; N240-A242 VanDerWaalsContact C-N 3.26Å; N240-A242 PolarHBondContact O-N 3.03Å; A242-H244 PolarHBondContact O-N 2.8Å; A242-R245 WeakPolarHBondContact O-CB 3.32Å; A242-R245 PolarHBondContact O-N 2.85Å; A242-R245 VanDerWaalsContact O-N 3.14Å; A242-W248 HydrophobicContact CB-CD2 4.3Å; A242-W248 HydrophobicContact CB-CG 4.43Å; A242-W248 VanDerWaalsContact O-CB 3.31Å; A242-W248 WeakPolarHBondContact O-CB 3.49Å
243	W	92.2	Very high	94.1	Very high	143 Å²	143	74 Å²	74	54%	0.542	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-15.8	176.6	-73.3	104.5	0	0	0	114.6	N240 A241 R245 W248 D249 V252	N240-W243 PolarHBondContact O-N 3.21Å; A241-W243 PolarHBondContact O-N 3.13Å; W243-R245 VanDerWaalsContact C-N 3.33Å; W243-W248 AromaticContact CD2-CD1 3.8Å; W243-W248 AromaticContact CD2-NE1 3.83Å; W243-W248 AromaticContact CE2-NE1 3.89Å; W243-W248 AromaticContact CE3-CD1 3.76Å; W243-D249 HydrophobicContact CZ3-CB 4.38Å; W243-V252 HydrophobicContact CH2-CB 4.14Å; W243-V252 HydrophobicContact CH2-CG1 3.84Å; W243-V252 HydrophobicContact CH2-CG2 4.1Å
244	H	92.8	Very high	94.1	Very high	158 Å²	158	72 Å²	72	73%	0.731	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	7.1	176.6	-57.3	84.5	0	0	0	112	N240 A241 A242	N240-H244 PolarHBondContact O-ND1 3.23Å; N240-H244 VanDerWaalsContact O-ND1 3.17Å; A241-H244 PolarHBondContact O-N 3.36Å; A242-H244 PolarHBondContact O-N 2.8Å
245	R	91.3	Very high	94.1	Very high	103 Å²	103	71 Å²	71	39%	0.389	35%	0.347	S	S	.	.	S	Bend	trans	-99.8	130.4	177.9	-59.6	-66.9	-168.4	161.9	7.3	109.7	I202 A242 W243 G247 W248	I202-R245 HydrophobicContact CG2-CB 3.48Å; I202-R245 VanDerWaalsContact CG2-CB 3.48Å; I202-R245 HydrophobicContact CG2-CG 3.74Å; A242-R245 WeakPolarHBondContact O-CB 3.32Å; A242-R245 PolarHBondContact O-N 2.85Å; A242-R245 VanDerWaalsContact O-N 3.14Å; W243-R245 VanDerWaalsContact C-N 3.33Å; R245-G247 PolarHBondContact O-N 3.45Å; R245-W248 WeakPolarHBondContact O-CB 3.31Å; R245-W248 PolarHBondContact O-N 3.18Å
246	D	91.4	Very high	94.1	Very high	158 Å²	158	72.8 Å²	72.8	85%	0.845	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	133.8	179.5	-62.7	-19.8	0	0	0	111.7	I202 W248	I202-D246 WeakPolarHBondContact CD1-O 3.31Å; D246-W248 VanDerWaalsContact C-N 3.29Å; D246-W248 PolarHBondContact O-N 3.29Å
247	G	90.5	Very high	94.1	Very high	27 Å²	27	73 Å²	73	28%	0.278	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	-9.7	178.2	0	0	0	0	0	115.4	R245 E250 V251	R245-G247 PolarHBondContact O-N 3.45Å; G247-E250 PolarHBondContact O-N 3.44Å; G247-V251 WeakPolarHBondContact O-CG2 3.32Å; G247-V251 PolarHBondContact O-N 3.05Å; G247-V251 VanDerWaalsContact O-N 3.13Å
248	W	93.4	Very high	94.2	Very high	19 Å²	19	71.3 Å²	71.3	7%	0.072	35%	0.351	C	S	.	.	H	α-helix	trans	-66.1	-41.2	177.2	177.5	-104.2	0	0	0	112.4	W196 A199 I202 R203 A242 W243 R245 D246 V251 V252	W196-W248 HydrophobicContact CH2-CH2 4.05Å; W196-W248 HydrophobicContact CH2-CZ3 4.41Å; A199-W248 HydrophobicContact CB-CZ3 4.2Å; I202-W248 HydrophobicContact CD1-CB 4.35Å; R203-W248 HydrophobicContact CG-CE3 4.29Å; R203-W248 HydrophobicContact CG-CH2 4.11Å; R203-W248 HydrophobicContact CG-CZ3 3.62Å; A242-W248 HydrophobicContact CB-CD2 4.3Å; A242-W248 HydrophobicContact CB-CG 4.43Å; A242-W248 VanDerWaalsContact O-CB 3.31Å; A242-W248 WeakPolarHBondContact O-CB 3.49Å; W243-W248 AromaticContact CD2-CD1 3.8Å; W243-W248 AromaticContact CD2-NE1 3.83Å; W243-W248 AromaticContact CE2-NE1 3.89Å; W243-W248 AromaticContact CE3-CD1 3.76Å; R245-W248 WeakPolarHBondContact O-CB 3.31Å; R245-W248 PolarHBondContact O-N 3.18Å; D246-W248 VanDerWaalsContact C-N 3.29Å; D246-W248 PolarHBondContact O-N 3.29Å; W248-V251 PolarHBondContact O-N 2.86Å; W248-V252 HydrophobicContact CD2-CG2 4.31Å; W248-V252 HydrophobicContact CZ2-CG2 3.98Å; W248-V252 WeakPolarHBondContact O-CG2 3.28Å; W248-V252 PolarHBondContact O-N 2.92Å
249	D	93.4	Very high	94.3	Very high	99 Å²	99	71 Å²	71	53%	0.529	35%	0.35	S	S	.	.	H	α-helix	trans	-60.7	-43.6	176.4	63.8	-41.2	0	0	0	112	W243 V252 Y253	W243-D249 HydrophobicContact CZ3-CB 4.38Å; D249-V252 PolarHBondContact O-N 3.3Å; D249-Y253 WeakPolarHBondContact O-CB 3.01Å; D249-Y253 PolarHBondContact O-N 2.92Å
250	E	93.9	Very high	94.4	Very high	88 Å²	88	72.3 Å²	72.3	41%	0.411	36%	0.359	S	S	.	.	H	α-helix	trans	-60.6	-47.9	175.8	-169.5	-168.9	154	0	0	111.2	G247 V252 Y253 Y254	G247-E250 PolarHBondContact O-N 3.44Å; E250-V252 VanDerWaalsContact C-N 3.32Å; E250-V252 PolarHBondContact O-N 3.47Å; E250-Y253 WeakPolarHBondContact O-CB 3.47Å; E250-Y253 PolarHBondContact O-N 3.48Å; E250-Y254 HydrophobicContact CG-CD2 3.69Å; E250-Y254 HydrophobicContact CG-CE2 3.48Å; E250-Y254 VanDerWaalsContact CG-CE2 3.48Å; E250-Y254 WeakPolarHBondContact O-CD2 3.48Å; E250-Y254 PolarHBondContact O-N 3.44Å
251	V	94	Very high	94.6	Very high	7 Å²	7	75.1 Å²	75.1	4%	0.042	37%	0.369	C	S	.	.	H	α-helix	trans	-56.3	-47.9	176.1	167.6	0	0	0	0	110.6	A199 G247 W248 Y253 Y254 T255	A199-V251 HydrophobicContact CB-CB 4.2Å; A199-V251 HydrophobicContact CB-CG1 3.5Å; A199-V251 VanDerWaalsContact CB-CG1 3.5Å; A199-V251 HydrophobicContact CB-CG2 3.82Å; G247-V251 WeakPolarHBondContact O-CG2 3.32Å; G247-V251 PolarHBondContact O-N 3.05Å; G247-V251 VanDerWaalsContact O-N 3.13Å; W248-V251 PolarHBondContact O-N 2.86Å; V251-Y253 VanDerWaalsContact C-N 3.35Å; V251-Y254 PolarHBondContact O-N 3.29Å; V251-T255 HydrophobicContact CG1-CG2 4.11Å; V251-T255 VanDerWaalsContact O-CB 3.31Å; V251-T255 WeakPolarHBondContact O-CB 3.46Å; V251-T255 VanDerWaalsContact O-CG2 3.25Å; V251-T255 WeakPolarHBondContact O-CG2 3.46Å; V251-T255 PolarHBondContact O-N 3.44Å; V251-T255 PolarHBondContact O-OG1 2.84Å
252	V	93.6	Very high	94.7	Very high	32 Å²	32	79.3 Å²	79.3	19%	0.194	38%	0.383	C	S	.	.	H	α-helix	trans	-63.1	-44.6	-179.2	175	0	0	0	0	110.3	W243 W248 D249 E250 Y254 T255 V256	W243-V252 HydrophobicContact CH2-CB 4.14Å; W243-V252 HydrophobicContact CH2-CG1 3.84Å; W243-V252 HydrophobicContact CH2-CG2 4.1Å; W248-V252 HydrophobicContact CD2-CG2 4.31Å; W248-V252 HydrophobicContact CZ2-CG2 3.98Å; W248-V252 WeakPolarHBondContact O-CG2 3.28Å; W248-V252 PolarHBondContact O-N 2.92Å; D249-V252 PolarHBondContact O-N 3.3Å; E250-V252 VanDerWaalsContact C-N 3.32Å; E250-V252 PolarHBondContact O-N 3.47Å; V252-Y254 VanDerWaalsContact C-N 3.32Å; V252-Y254 PolarHBondContact O-N 3.04Å; V252-T255 PolarHBondContact O-N 3.14Å; V252-V256 HydrophobicContact CG1-CG2 3.73Å; V252-V256 WeakPolarHBondContact O-CB 3.46Å; V252-V256 VanDerWaalsContact O-CG2 3.27Å; V252-V256 WeakPolarHBondContact O-CG2 3.39Å; V252-V256 PolarHBondContact O-N 3.26Å
253	Y	95.8	Very high	95	Very high	170 Å²	170	82.7 Å²	82.7	67%	0.667	40%	0.398	S	S	*	.	H	α-helix	trans	-56.2	-44.1	179	179.9	-97.6	0	0	0	112.3	D249 E250 V251 P257	D249-Y253 WeakPolarHBondContact O-CB 3.01Å; D249-Y253 PolarHBondContact O-N 2.92Å; E250-Y253 WeakPolarHBondContact O-CB 3.47Å; E250-Y253 PolarHBondContact O-N 3.48Å; V251-Y253 VanDerWaalsContact C-N 3.35Å; Y253-P257 WeakPolarHBondContact O-CD 3.44Å; Y253-P257 WeakPolarHBondContact O-CG 3.33Å
254	Y	96.8	Very high	95.2	Very high	97 Å²	97	78.1 Å²	78.1	38%	0.38	39%	0.388	S	S	.	.	H	α-helix	trans	-84.5	-28.4	-178.8	-70.1	-65.3	0	0	0	114.6	Y195 E250 V251 V252 L258	Y195-Y254 HydrophobicContact CD1-CD2 4.35Å; Y195-Y254 HydrophobicContact CD1-CG 4.46Å; Y195-Y254 AromaticContact CE1-CD2 3.56Å; Y195-Y254 HydrophobicContact CE1-CD2 3.56Å; Y195-Y254 HydrophobicContact CE1-CE2 4.42Å; Y195-Y254 AromaticContact CE1-CG 3.65Å; Y195-Y254 HydrophobicContact CE1-CG 3.65Å; Y195-Y254 HydrophobicContact CE2-CG 4.32Å; Y195-Y254 AromaticContact CZ-CD2 3.95Å; Y195-Y254 AromaticContact CZ-CG 3.58Å; E250-Y254 HydrophobicContact CG-CD2 3.69Å; E250-Y254 HydrophobicContact CG-CE2 3.48Å; E250-Y254 VanDerWaalsContact CG-CE2 3.48Å; E250-Y254 WeakPolarHBondContact O-CD2 3.48Å; E250-Y254 PolarHBondContact O-N 3.44Å; V251-Y254 PolarHBondContact O-N 3.29Å; V252-Y254 VanDerWaalsContact C-N 3.32Å; V252-Y254 PolarHBondContact O-N 3.04Å; Y254-L258 WeakPolarHBondContact O-CG 3.32Å
255	T	96.3	Very high	95.5	Very high	6 Å²	6	70.7 Å²	70.7	4%	0.037	35%	0.354	C	S	.	.	H	α-helix	trans	-87	-32.6	-175.9	57	0	0	0	0	113.6	Y195 V251 V252 L258	Y195-T255 VanDerWaalsContact CB-CG2 3.42Å; Y195-T255 HydrophobicContact CD2-CG2 4.25Å; Y195-T255 HydrophobicContact CG-CG2 4.03Å; V251-T255 HydrophobicContact CG1-CG2 4.11Å; V251-T255 VanDerWaalsContact O-CB 3.31Å; V251-T255 WeakPolarHBondContact O-CB 3.46Å; V251-T255 VanDerWaalsContact O-CG2 3.25Å; V251-T255 WeakPolarHBondContact O-CG2 3.46Å; V251-T255 PolarHBondContact O-N 3.44Å; V251-T255 PolarHBondContact O-OG1 2.84Å; V252-T255 PolarHBondContact O-N 3.14Å; T255-L258 WeakPolarHBondContact O-CB 3.27Å; T255-L258 PolarHBondContact O-N 3.2Å
256	V	96.2	Very high	95.8	Very high	83 Å²	83	66.3 Å²	66.3	50%	0.503	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-60	-45.3	-177.7	168	0	0	0	0	112.8	V252 L258 I259	V252-V256 HydrophobicContact CG1-CG2 3.73Å; V252-V256 WeakPolarHBondContact O-CB 3.46Å; V252-V256 VanDerWaalsContact O-CG2 3.27Å; V252-V256 WeakPolarHBondContact O-CG2 3.39Å; V252-V256 PolarHBondContact O-N 3.26Å; V256-L258 PolarHBondContact O-N 2.88Å; V256-L258 VanDerWaalsContact O-N 3.12Å; V256-I259 PolarHBondContact O-N 3.18Å; V256-I259 VanDerWaalsContact O-N 3.1Å
257	P	97.6	Very high	96.2	Very high	76 Å²	76	58.8 Å²	58.8	49%	0.494	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-60.6	-22.9	178.4	-26	36.4	0	0	0	114.5	R185 Y253 I259	R185-P257 PolarHBondContact NE-O 2.84Å; Y253-P257 WeakPolarHBondContact O-CD 3.44Å; Y253-P257 WeakPolarHBondContact O-CG 3.33Å; P257-I259 VanDerWaalsContact C-N 3.28Å; P257-I259 PolarHBondContact O-N 3.24Å
258	L	97.9	Very high	96.5	Very high	18 Å²	18	61.2 Å²	61.2	9%	0.094	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-80.2	-9.3	-179.2	-51	179.6	0	0	0	113	R185 T188 E191 W192 Y254 T255 V256	R185-L258 WeakPolarHBondContact CG-O 3.39Å; R185-L258 PolarHBondContact N-O 2.87Å; T188-L258 HydrophobicContact CG2-CD2 4.03Å; E191-L258 HydrophobicContact CB-CD1 4.32Å; E191-L258 HydrophobicContact CG-CD1 3.86Å; W192-L258 HydrophobicContact CB-CD1 3.89Å; W192-L258 HydrophobicContact CG-CD1 4.48Å; Y254-L258 WeakPolarHBondContact O-CG 3.32Å; T255-L258 WeakPolarHBondContact O-CB 3.27Å; T255-L258 PolarHBondContact O-N 3.2Å; V256-L258 PolarHBondContact O-N 2.88Å; V256-L258 VanDerWaalsContact O-N 3.12Å
259	I	98.1	Very high	96.7	Very high	26 Å²	26	61.1 Å²	61.1	13%	0.133	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	134.5	-177.5	-59.8	165	0	0	0	109.6	Y182 L184 V256 P257 H261 M262	Y182-I259 HydrophobicContact CD1-CD1 3.71Å; Y182-I259 HydrophobicContact CD1-CG1 4.41Å; Y182-I259 HydrophobicContact CD1-CG2 4.38Å; Y182-I259 HydrophobicContact CE1-CD1 4.2Å; Y182-I259 HydrophobicContact CG-CD1 4.43Å; L184-I259 HydrophobicContact CD2-CG1 3.74Å; V256-I259 PolarHBondContact O-N 3.18Å; V256-I259 VanDerWaalsContact O-N 3.1Å; P257-I259 VanDerWaalsContact C-N 3.28Å; P257-I259 PolarHBondContact O-N 3.24Å; I259-H261 VanDerWaalsContact CG2-O 3.24Å; I259-H261 WeakPolarHBondContact CG2-O 3.4Å; I259-M262 HydrophobicContact CG2-CB 4.16Å
260	Q	97.7	Very high	96.8	Very high	87 Å²	87	56.8 Å²	56.8	41%	0.407	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	-46.8	172.7	-61.5	-175.2	-76.5	0	0	111.5	Q183 L184 R185	Q183-Q260 HydrophobicContact CG-CB 4.39Å; Q183-Q260 PolarHBondContact O-N 3.13Å; L184-Q260 PolarHBondContact O-OE1 3.26Å; R185-Q260 HydrophobicContact CB-CG 4.32Å; R185-Q260 HydrophobicContact CG-CG 3.5Å; R185-Q260 VanDerWaalsContact CG-CG 3.5Å
261	H	97.6	Very high	96.8	Very high	136 Å²	136	59.6 Å²	59.6	63%	0.63	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.9	145.1	178.4	-57.9	-73.4	0	0	0	109.4	Q183 I259	Q183-H261 HydrophobicContact CB-CB 3.99Å; Q183-H261 PolarHBondContact N-O 3.49Å; Q183-H261 PolarHBondContact O-N 2.87Å; I259-H261 VanDerWaalsContact CG2-O 3.24Å; I259-H261 WeakPolarHBondContact CG2-O 3.4Å
262	M	97	Very high	96.8	Very high	130 Å²	130	61.6 Å²	61.6	64%	0.64	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.4	144.9	171.8	62.5	176.3	177.5	0	0	110.4	S181 Y182 I259	S181-M262 CarbonylContact O-C 3.58Å; S181-M262 VanDerWaalsContact O-CA 3.27Å; S181-M262 WeakPolarHBondContact O-CA 3.37Å; Y182-M262 HydrophobicContact CD1-CB 3.69Å; Y182-M262 HydrophobicContact CE1-CB 4.06Å; I259-M262 HydrophobicContact CG2-CB 4.16Å
263	E	97.2	Very high	96.8	Very high	74 Å²	74	60.5 Å²	60.5	35%	0.346	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	143.5	177.9	-168.5	-169.3	147.6	0	0	108.3	R180 S181 R265	R180-E263 CarbonylContact C-O 3.58Å; R180-E263 WeakPolarHBondContact CA-O 3.25Å; S181-E263 PolarHBondContact N-O 3.25Å; S181-E263 PolarHBondContact O-N 3.19Å; E263-R265 IonicContact OE1-CZ 3.17Å; E263-R265 IonicContact OE1-NH1 2.87Å; E263-R265 PolarHBondContact OE1-NH1 3.42Å; E263-R265 IonicContact OE1-NH2 3.4Å; E263-R265 PolarHBondContact OE1-NH2 2.86Å
264	S	97.8	Very high	96.8	Very high	47 Å²	47	54.3 Å²	54.3	33%	0.329	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	138.8	170.6	172	0	0	0	0	108.7	E178	E178-S264 VanDerWaalsContact CD-OG 3.31Å; E178-S264 WeakPolarHBondContact CG-OG 3.2Å; E178-S264 WeakPolarHBondContact OE1-CB 3.31Å; E178-S264 PolarHBondContact OE1-OG 2.94Å
265	R	98.1	Very high	96.5	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.008	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	125.4	-179.3	-178.7	-170.8	-86.1	80.7	6.3	109.4	T106 Y108 E110 E178 L179 E263 M267	T106-R265 HydrophobicContact CG2-CG 3.39Å; T106-R265 WeakPolarHBondContact OG1-CD 3.32Å; T106-R265 PolarHBondContact OG1-NE 2.94Å; Y108-R265 CarbonylContact O-C 3.51Å; Y108-R265 WeakPolarHBondContact O-CA 3.44Å; E110-R265 IonicContact OE2-NH2 2.68Å; E110-R265 PolarHBondContact OE2-NH2 3.2Å; E178-R265 CarbonylContact C-O 3.53Å; E178-R265 VanDerWaalsContact CA-O 3.26Å; E178-R265 WeakPolarHBondContact CA-O 3.42Å; L179-R265 PolarHBondContact N-O 2.87Å; L179-R265 PolarHBondContact O-N 3.46Å; E263-R265 IonicContact OE1-CZ 3.17Å; E263-R265 IonicContact OE1-NH1 2.87Å; E263-R265 PolarHBondContact OE1-NH1 3.42Å; E263-R265 IonicContact OE1-NH2 3.4Å; E263-R265 PolarHBondContact OE1-NH2 2.86Å; R265-M267 HydrophobicContact CB-CG 4.47Å; R265-M267 HydrophobicContact CG-CG 3.69Å; R265-M267 HydrophobicContact CG-SD 4.3Å
266	I	98.6	Very high	95.9	Very high	11 Å²	11	55.3 Å²	55.3	6%	0.056	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	129.2	170.1	-53.3	-58.7	0	0	0	107.9	W107 Y108 I176 Y177 E178 L232	W107-I266 HydrophobicContact CE3-CG2 4.03Å; W107-I266 PolarHBondContact N-O 3.32Å; Y108-I266 HydrophobicContact CD2-CB 4.08Å; Y108-I266 HydrophobicContact CD2-CG1 4.31Å; Y108-I266 HydrophobicContact CD2-CG2 4.38Å; Y108-I266 PolarHBondContact N-O 3.3Å; Y108-I266 PolarHBondContact O-N 3.15Å; I176-I266 HydrophobicContact CD1-CG2 4.08Å; Y177-I266 CarbonylContact O-C 3.58Å; Y177-I266 WeakPolarHBondContact O-CA 3.37Å; E178-I266 HydrophobicContact CB-CD1 4Å; E178-I266 HydrophobicContact CG-CD1 3.97Å; L232-I266 HydrophobicContact CD2-CD1 4.28Å; L232-I266 HydrophobicContact CD2-CG1 4.12Å; L232-I266 HydrophobicContact CD2-CG2 4.1Å
267	M	98.4	Very high	95.9	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	145.5	-173.5	-46.8	-178.3	-58.5	0	0	110.4	W104 N105 V115 Y177 L179 L226 R265	W104-M267 HydrophobicContact CB-CB 3.63Å; W104-M267 HydrophobicContact CB-CE 4.36Å; W104-M267 HydrophobicContact CB-CG 4.47Å; W104-M267 HydrophobicContact CB-SD 4.27Å; W104-M267 HydrophobicContact CD2-CE 4.02Å; W104-M267 HydrophobicContact CE3-CE 4.22Å; W104-M267 HydrophobicContact CG-CB 4.09Å; W104-M267 HydrophobicContact CG-CE 4.08Å; N105-M267 CarbonylContact O-C 3.56Å; N105-M267 WeakPolarHBondContact O-CA 3.37Å; V115-M267 HydrophobicContact CB-SD 3.96Å; V115-M267 HydrophobicContact CG1-SD 4.33Å; V115-M267 HydrophobicContact CG2-SD 3.8Å; Y177-M267 PolarHBondContact N-O 2.91Å; Y177-M267 PolarHBondContact O-N 3.19Å; L179-M267 HydrophobicContact CB-CE 3.68Å; L179-M267 HydrophobicContact CB-SD 3.93Å; L179-M267 HydrophobicContact CD2-SD 4.43Å; L226-M267 HydrophobicContact CD1-CE 3.74Å; R265-M267 HydrophobicContact CB-CG 4.47Å; R265-M267 HydrophobicContact CG-CG 3.69Å; R265-M267 HydrophobicContact CG-SD 4.3Å
268	I	97.6	Very high	95.8	Very high	78 Å²	78	52.8 Å²	52.8	40%	0.4	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	128	176.3	-61.3	172.8	0	0	0	107.4	W104 N105 W107	W104-I268 CarbonylContact C-O 3.58Å; W104-I268 VanDerWaalsContact CA-O 3.25Å; W104-I268 WeakPolarHBondContact CA-O 3.35Å; W104-I268 WeakPolarHBondContact CB-O 3.39Å; N105-I268 PolarHBondContact N-O 2.92Å; N105-I268 PolarHBondContact O-N 2.93Å; W107-I268 HydrophobicContact CB-CD1 3.87Å; W107-I268 HydrophobicContact CB-CG1 4.02Å; W107-I268 HydrophobicContact CD2-CD1 3.91Å; W107-I268 HydrophobicContact CE3-CD1 4.1Å; W107-I268 HydrophobicContact CE3-CG1 4.37Å; W107-I268 HydrophobicContact CG-CD1 3.82Å; W107-I268 HydrophobicContact CG-CG1 4.41Å
269	P	97	Very high	95.7	Very high	17 Å²	17	54.7 Å²	54.7	11%	0.11	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	137.7	179.2	26.2	-32.6	0	0	0	110.5	T103 W104 N175 Y177 K276	T103-P269 WeakPolarHBondContact O-CA 3.5Å; W104-P269 VanDerWaalsContact CD1-CA 3.4Å; N175-P269 VanDerWaalsContact O-CD 3.29Å; N175-P269 WeakPolarHBondContact O-CD 3.16Å; Y177-P269 HydrophobicContact CD2-CG 4.39Å; Y177-P269 HydrophobicContact CE2-CB 4.41Å; Y177-P269 HydrophobicContact CE2-CG 4.17Å; P269-K276 HydrophobicContact CB-CB 4.36Å; P269-K276 HydrophobicContact CG-CB 4.49Å; P269-K276 HydrophobicContact CG-CG 4.24Å
270	M	95.9	Very high	95.5	Very high	7 Å²	7	56.4 Å²	56.4	3%	0.034	28%	0.28	C	S	.	.			trans	-67.2	164.4	172.2	-61	177.7	56.8	0	0	110.4	N80 C83 E84 T103 T272 S273	N80-M270 HydrophobicContact CB-CE 3.75Å; N80-M270 WeakPolarHBondContact OD1-CE 3.31Å; C83-M270 HydrophobicContact CB-CE 3.97Å; E84-M270 HydrophobicContact CG-CE 3.89Å; T103-M270 HydrophobicContact CG2-CB 3.98Å; T103-M270 HydrophobicContact CG2-CG 4.39Å; T103-M270 HydrophobicContact CG2-SD 4.22Å; T103-M270 PolarHBondContact O-N 2.99Å; T103-M270 PolarHBondContact OG1-SD 2.96Å; M270-T272 PolarHBondContact O-N 3.08Å; M270-T272 VanDerWaalsContact O-N 3.12Å; M270-S273 VanDerWaalsContact O-CB 3.28Å; M270-S273 WeakPolarHBondContact O-CB 3.41Å; M270-S273 PolarHBondContact O-N 3.17Å
271	K	93.8	Very high	95.4	Very high	148 Å²	148	54.5 Å²	54.5	64%	0.643	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-36.4	-170.6	-174.5	-177	174.2	-175.3	0	112.9	E84 K276	E84-K271 WeakPolarHBondContact OE1-CB 3.13Å; E84-K271 PolarHBondContact OE1-N 3.28Å; E84-K271 VanDerWaalsContact OE1-N 3.11Å; K271-K276 WeakPolarHBondContact O-CD 3.03Å
272	T	93.1	Very high	95.2	Very high	49 Å²	49	49.1 Å²	49.1	30%	0.301	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	11.8	-177.9	61.3	0	0	0	0	113.5	E84 P88 M270 P274	E84-T272 HydrophobicContact CB-CG2 3.98Å; E84-T272 HydrophobicContact CG-CG2 4.13Å; P88-T272 HydrophobicContact CG-CG2 4.15Å; M270-T272 PolarHBondContact O-N 3.08Å; M270-T272 VanDerWaalsContact O-N 3.12Å; T272-P274 WeakPolarHBondContact O-CD 3.45Å
273	S	95.4	Very high	95.1	Very high	8 Å²	8	43.3 Å²	43.3	6%	0.056	22%	0.221	C	C	.	.			trans	-62.5	128.2	175.4	-170.5	0	0	0	0	110.9	T103 M270 L275 K276	T103-S273 PolarHBondContact N-OG 3.49Å; T103-S273 VanDerWaalsContact O-CB 3.25Å; T103-S273 WeakPolarHBondContact O-CB 3.25Å; T103-S273 PolarHBondContact O-OG 2.82Å; T103-S273 VanDerWaalsContact O-OG 3.1Å; M270-S273 VanDerWaalsContact O-CB 3.28Å; M270-S273 WeakPolarHBondContact O-CB 3.41Å; M270-S273 PolarHBondContact O-N 3.17Å; S273-L275 PolarHBondContact O-N 2.91Å; S273-K276 WeakPolarHBondContact O-CB 2.89Å; S273-K276 PolarHBondContact O-N 3.06Å
274	P	93.9	Very high	94.9	Very high	41 Å²	41	40.9 Å²	40.9	27%	0.266	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-19.4	175	-30.4	41.9	0	0	0	114.1	L100 T272	L100-P274 HydrophobicContact CB-CG 4.39Å; L100-P274 HydrophobicContact CD2-CG 4.3Å; L100-P274 HydrophobicContact CG-CG 4.25Å; L100-P274 WeakPolarHBondContact O-CG 3.49Å; T272-P274 WeakPolarHBondContact O-CD 3.45Å
275	L	91.1	Very high	94.7	Very high	3 Å²	3	40.4 Å²	40.4	2%	0.016	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	52.3	174.2	-72.2	174.7	0	0	0	111.1	V101 W104 P168 V169 Y177 V210 S273	V101-L275 HydrophobicContact CG1-CD1 3.8Å; V101-L275 VanDerWaalsContact O-CD1 3.26Å; V101-L275 WeakPolarHBondContact O-CD1 3.45Å; V101-L275 WeakPolarHBondContact O-CG 3.49Å; W104-L275 HydrophobicContact CH2-CD1 4.08Å; W104-L275 HydrophobicContact CZ2-CB 4.1Å; W104-L275 HydrophobicContact CZ2-CD1 3.74Å; P168-L275 HydrophobicContact CB-CD1 4.37Å; V169-L275 VanDerWaalsContact C-CD2 3.5Å; V169-L275 WeakPolarHBondContact O-CD2 3.18Å; Y177-L275 HydrophobicContact CE1-CB 4.2Å; Y177-L275 WeakPolarHBondContact CE2-O 3.27Å; Y177-L275 PolarHBondContact OH-O 3.29Å; V210-L275 HydrophobicContact CG1-CD1 4.06Å; S273-L275 PolarHBondContact O-N 2.91Å
276	K	83.8	Confident	94.4	Very high	121 Å²	121	43.9 Å²	43.9	53%	0.526	22%	0.219	S	C	.	.			trans	-92	0	175.9	-177.2	177.5	178.9	-176.9	0	112.5	P269 K271 S273	P269-K276 HydrophobicContact CB-CB 4.36Å; P269-K276 HydrophobicContact CG-CB 4.49Å; P269-K276 HydrophobicContact CG-CG 4.24Å; K271-K276 WeakPolarHBondContact O-CD 3.03Å; S273-K276 WeakPolarHBondContact O-CB 2.89Å; S273-K276 PolarHBondContact O-N 3.06Å

Retrieved 276 of 276 residues in 172.1 ms (Link to these results)

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