A0A087Y8Q1_POEFO Loading...

Serpin peptidase inhibitor, clade D (heparin cofactor), member 1

AlphaFold DB (A0A3B3UG65), UniProt , Accession A0A087Y8Q1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 505 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	39.7	Very low	34.4	Very low	230 Å²	230	143.3 Å²	143.3	100%	1.133	78%	0.775	S	S	*	*				0	95.2	0	-81.5	159.9	55.6	0	0	106.4
2	W	31.1	Very low	34.2	Very low	239 Å²	239	144.3 Å²	144.3	91%	0.905	78%	0.778	S	S	*	*				42.5	115.7	65	-77	61.2	0	0	0	108.7
3	V	34.9	Very low	34.1	Very low	97 Å²	97	146.5 Å²	146.5	59%	0.588	79%	0.787	S	S	*	*			cis	178.2	138	38.7	132.6	0	0	0	0	108.5
4	F	37.4	Very low	34.4	Very low	171 Å²	171	142.7 Å²	142.7	75%	0.75	79%	0.787	S	S	*	*			trans	62.3	115.8	138.5	-74.5	-102.9	0	0	0	122.1
5	T	39.2	Very low	34.5	Very low	105 Å²	105	140.9 Å²	140.9	64%	0.644	79%	0.788	S	S	*	*				82.5	119.1	81.2	61.6	0	0	0	0	115.3
6	V	34.9	Very low	35	Very low	123 Å²	123	138.9 Å²	138.9	75%	0.745	78%	0.783	S	S	*	*				104.8	140.9	90.9	174.3	0	0	0	0	112.2
7	I	31.8	Very low	35.1	Very low	140 Å²	140	137.9 Å²	137.9	72%	0.718	79%	0.787	S	S	*	*			trans	86.2	106.3	161.6	-35.7	-173.5	0	0	0	120.4
8	S	31.2	Very low	35.5	Very low	108 Å²	108	139.4 Å²	139.4	76%	0.755	79%	0.792	S	S	*	*				168.3	98.3	115	-73.1	0	0	0	0	106.9
9	V	35.9	Very low	35.6	Very low	128 Å²	128	136.9 Å²	136.9	78%	0.776	79%	0.79	S	S	*	*				42.3	123.3	76	-165.9	0	0	0	0	112.7
10	V	30.9	Very low	35.8	Very low	119 Å²	119	133.9 Å²	133.9	72%	0.721	79%	0.79	S	S	*	*			trans	92.6	102	171.4	-162.5	0	0	0	0	116.8
11	C	31.8	Very low	36.4	Very low	116 Å²	116	135.4 Å²	135.4	78%	0.784	79%	0.792	S	S	*	*			trans	162.9	74.9	134.9	-88.1	0	0	0	0	106
12	L	32.1	Very low	36.9	Very low	155 Å²	155	132.1 Å²	132.1	81%	0.812	77%	0.772	S	S	*	*				30.6	101	82.5	-81.6	167	0	0	0	110.9
13	L	32.8	Very low	37.8	Very low	173 Å²	173	127.8 Å²	127.8	91%	0.906	76%	0.762	S	S	*	*				-173.1	98.9	124.4	-90.3	177.5	0	0	0	108.1
14	A	37.6	Very low	38.5	Very low	94 Å²	94	130 Å²	130	78%	0.777	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-70	134.5	162.8	0	0	0	0	0	108.9
15	S	35.7	Very low	39.2	Very low	116 Å²	116	124.9 Å²	124.9	81%	0.811	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-77.6	128	167.3	39.8	0	0	0	0	109.5
16	P	42.9	Very low	39.9	Very low	108 Å²	108	122.7 Å²	122.7	70%	0.701	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-89.2	119.9	176	32	-27.7	0	0	0	110.3	L18	P16-L18 PolarHBondContact O-N 2.89Å
17	S	37.6	Very low	40.9	Very low	122 Å²	122	123.4 Å²	123.4	85%	0.853	74%	0.739	S	S	*	*			trans	-76	107.2	154	45.5	0	0	0	0	108.1	A19	S17-A19 PolarHBondContact O-N 3.2Å; S17-A19 VanDerWaalsContact O-N 3.12Å
18	L	42.2	Very low	42	Very low	166 Å²	166	124.7 Å²	124.7	87%	0.869	74%	0.74	S	S	*	*			trans	-67.2	103.6	174.2	-90.3	110.8	0	0	0	110.5	P16	P16-L18 PolarHBondContact O-N 2.89Å
19	A	37.4	Very low	43	Very low	91 Å²	91	125.9 Å²	125.9	75%	0.752	74%	0.738	S	S	*	*			trans	-120.4	98.8	149.5	0	0	0	0	0	106.4	S17 I21	S17-A19 PolarHBondContact O-N 3.2Å; S17-A19 VanDerWaalsContact O-N 3.12Å; A19-I21 PolarHBondContact O-N 3.27Å
20	G	39.1	Very low	43.6	Very low	77 Å²	77	125.5 Å²	125.5	79%	0.794	73%	0.731	S	S	*	*			trans	-66	116	-178.2	0	0	0	0	0	110.9	K22	G20-K22 PolarHBondContact O-N 3.07Å
21	I	47.8	Very low	44.7	Very low	165 Å²	165	125.7 Å²	125.7	85%	0.846	74%	0.735	S	S	*	*			trans	-76.8	115.6	165.3	-61.7	171.1	0	0	0	106.4	A19	A19-I21 PolarHBondContact O-N 3.27Å
22	K	51.4	Low	45.5	Very low	162 Å²	162	126.7 Å²	126.7	70%	0.704	73%	0.732	S	S	*	*			trans	-72.8	131.7	170.7	-120.7	-178.8	179.3	-174.7	0	108.6	G20	G20-K22 PolarHBondContact O-N 3.07Å
23	E	49.9	Very low	46	Very low	147 Å²	147	123.9 Å²	123.9	69%	0.687	72%	0.723	S	S	*	*			trans	-66.9	139.3	174.1	-75.9	-166.4	158.2	0	0	111.4	S25 S26	E23-S25 WeakPolarHBondContact CB-OG 3.29Å; E23-S25 PolarHBondContact O-N 3.1Å; E23-S25 VanDerWaalsContact O-N 3.09Å; E23-S25 PolarHBondContact OE2-OG 3.41Å; E23-S26 WeakPolarHBondContact O-CB 3.42Å; E23-S26 PolarHBondContact O-N 2.93Å; E23-S26 PolarHBondContact O-OG 3.01Å
24	L	48.6	Very low	46.5	Very low	145 Å²	145	123 Å²	123	76%	0.759	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-56.7	-25.4	-179.5	-135	85.6	0	0	0	113.1	S26 H27 F28	L24-S26 VanDerWaalsContact C-N 3.27Å; L24-S26 PolarHBondContact O-N 3.33Å; L24-H27 PolarHBondContact O-N 2.9Å; L24-F28 WeakPolarHBondContact O-CD2 3.49Å
25	S	53.2	Low	46.8	Very low	63 Å²	63	123.4 Å²	123.4	44%	0.441	71%	0.714	S	S	.	*	G	3₁₀ helix	trans	-64.9	-27.1	176.7	54	0	0	0	0	113.2	E23 H27 F28	E23-S25 WeakPolarHBondContact CB-OG 3.29Å; E23-S25 PolarHBondContact O-N 3.1Å; E23-S25 VanDerWaalsContact O-N 3.09Å; E23-S25 PolarHBondContact OE2-OG 3.41Å; S25-H27 VanDerWaalsContact C-N 3.25Å; S25-H27 PolarHBondContact O-N 3.47Å; S25-F28 PolarHBondContact O-N 2.94Å
26	S	53.8	Low	47.1	Very low	59 Å²	59	130.1 Å²	130.1	41%	0.413	72%	0.721	S	S	.	*	G	3₁₀ helix	trans	-75.4	-10.5	-178.7	68.2	0	0	0	0	114.3	E23 L24	E23-S26 WeakPolarHBondContact O-CB 3.42Å; E23-S26 PolarHBondContact O-N 2.93Å; E23-S26 PolarHBondContact O-OG 3.01Å; L24-S26 VanDerWaalsContact C-N 3.27Å; L24-S26 PolarHBondContact O-N 3.33Å
27	H	55.4	Low	47.1	Very low	137 Å²	137	128.1 Å²	128.1	63%	0.634	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-84.3	-14.1	176.3	-83.9	-81.5	0	0	0	114	L24 S25	L24-H27 PolarHBondContact O-N 2.9Å; S25-H27 VanDerWaalsContact C-N 3.25Å; S25-H27 PolarHBondContact O-N 3.47Å
28	F	54.9	Low	47	Very low	168 Å²	168	127.7 Å²	127.7	74%	0.737	72%	0.718	S	S	*	*	S	Bend	trans	-115.5	1.9	-170.6	-64.4	-76.7	0	0	0	114.6	L24 S25	L24-F28 WeakPolarHBondContact O-CD2 3.49Å; S25-F28 PolarHBondContact O-N 2.94Å
29	N	52.1	Low	46.9	Very low	133 Å²	133	128.5 Å²	128.5	71%	0.711	72%	0.717	S	S	*	*			trans	-108.7	19.3	-175.5	-81.7	-15.3	0	0	0	114.3	P31	N29-P31 VanDerWaalsContact O-CD 3.24Å; N29-P31 WeakPolarHBondContact O-CD 3.2Å
30	D	49.4	Very low	46.8	Very low	120 Å²	120	130.6 Å²	130.6	64%	0.642	72%	0.723	S	S	*	*			trans	-81.4	111.7	172.9	-155.4	-15.5	0	0	0	109.7	N32	D30-N32 PolarHBondContact O-N 3.24Å
31	P	54.1	Low	47	Very low	122 Å²	122	130.9 Å²	130.9	79%	0.792	73%	0.726	S	S	*	*	S	Bend	trans	-75	-3.5	-173	-10.8	28	0	0	0	113.3	N29	N29-P31 VanDerWaalsContact O-CD 3.24Å; N29-P31 WeakPolarHBondContact O-CD 3.2Å
32	N	46.7	Very low	46.4	Very low	138 Å²	138	127.1 Å²	127.1	74%	0.738	71%	0.714	S	S	*	*			trans	-153.2	75.3	-177.3	-138.1	5.9	0	0	0	112.6	D30 N34	D30-N32 PolarHBondContact O-N 3.24Å; N32-N34 PolarHBondContact O-N 3.16Å
33	P	43.4	Very low	45.7	Very low	96 Å²	96	125.5 Å²	125.5	62%	0.623	72%	0.72	S	S	*	*			trans	-63.6	126.5	167.1	27.8	-30.8	0	0	0	107.5	P35	P33-P35 WeakPolarHBondContact O-CD 3.48Å
34	N	43.2	Very low	45.2	Very low	155 Å²	155	124.1 Å²	124.1	83%	0.829	72%	0.722	S	S	*	*			trans	-95.3	90.5	179.5	-153.6	-0.5	0	0	0	108.1	N32 R36	N32-N34 PolarHBondContact O-N 3.16Å; N34-R36 PolarHBondContact O-N 3.04Å; N34-R36 VanDerWaalsContact O-N 3.13Å
35	P	44.1	Very low	44.9	Very low	101 Å²	101	123.7 Å²	123.7	66%	0.656	72%	0.72	S	S	*	*			trans	-70	111.7	174.8	29.2	-33.7	0	0	0	107.7	P33 G37	P33-P35 WeakPolarHBondContact O-CD 3.48Å; P35-G37 VanDerWaalsContact C-N 3.34Å; P35-G37 PolarHBondContact O-N 3.39Å
36	R	43	Very low	44.4	Very low	257 Å²	257	126.9 Å²	126.9	97%	0.97	74%	0.736	S	S	*	*	S	Bend	trans	-62.4	100	165.6	-81.9	-176.6	172.4	-179.7	-1.8	108.2	N34	N34-R36 PolarHBondContact O-N 3.04Å; N34-R36 VanDerWaalsContact O-N 3.13Å
37	G	42.9	Very low	43.9	Very low	67 Å²	67	131.4 Å²	131.4	69%	0.691	75%	0.751	S	S	*	*	S	Bend	trans	132.8	71	164.6	0	0	0	0	0	115.2	P35	P35-G37 VanDerWaalsContact C-N 3.34Å; P35-G37 PolarHBondContact O-N 3.39Å
38	S	34.8	Very low	43.7	Very low	112 Å²	112	129.4 Å²	129.4	78%	0.783	76%	0.758	S	S	*	*			trans	176.6	127.8	139.9	39.5	0	0	0	0	109.4
39	Q	39.5	Very low	43.4	Very low	183 Å²	183	127.1 Å²	127.1	86%	0.855	75%	0.752	S	S	*	*			trans	-84.9	137.7	170.6	-71.6	-159.1	-14.1	0	0	109.7	G41	Q39-G41 PolarHBondContact O-N 2.93Å
40	P	36.2	Very low	43.6	Very low	136 Å²	136	125.1 Å²	125.1	88%	0.883	75%	0.747	S	S	*	*	S	Bend	trans	-81.7	111.7	179.4	31.3	-30.5	0	0	0	109.8
41	G	41.9	Very low	43.7	Very low	82 Å²	82	127.1 Å²	127.1	85%	0.845	76%	0.757	S	S	*	*			trans	165.3	2.7	175.3	0	0	0	0	0	118.4	Q39	Q39-G41 PolarHBondContact O-N 2.93Å
42	S	35.6	Very low	43.7	Very low	86 Å²	86	125.7 Å²	125.7	60%	0.601	74%	0.742	S	S	*	*	S	Bend	trans	-118.5	137.8	172.4	50	0	0	0	0	110	V44	S42-V44 PolarHBondContact O-N 2.83Å
43	P	37.5	Very low	43.9	Very low	129 Å²	129	126.3 Å²	126.3	84%	0.838	74%	0.739	S	S	*	*			trans	-67.8	109.1	171.5	29.1	-30.3	0	0	0	107	D45	P43-D45 PolarHBondContact O-N 3.4Å
44	V	37.9	Very low	44.1	Very low	118 Å²	118	128.5 Å²	128.5	72%	0.715	74%	0.74	S	S	*	*			trans	-78	104.4	171.1	-178.9	0	0	0	0	106.3	S42 V46	S42-V44 PolarHBondContact O-N 2.83Å; V44-V46 PolarHBondContact O-N 3.2Å; V44-V46 VanDerWaalsContact O-N 3.16Å
45	D	42.7	Very low	44.5	Very low	135 Å²	135	127.3 Å²	127.3	72%	0.722	73%	0.728	S	S	*	*			trans	-63.6	107.7	169.7	-152.8	-3.1	0	0	0	107.7	P43 E47	P43-D45 PolarHBondContact O-N 3.4Å; D45-E47 PolarHBondContact O-N 2.78Å; D45-E47 VanDerWaalsContact O-N 3.1Å
46	V	43.4	Very low	44.6	Very low	130 Å²	130	130.9 Å²	130.9	79%	0.788	74%	0.736	S	S	*	*			trans	-86.6	67.4	175.1	-166.9	0	0	0	0	107.1	V44 A48	V44-V46 PolarHBondContact O-N 3.2Å; V44-V46 VanDerWaalsContact O-N 3.16Å; V46-A48 PolarHBondContact O-N 3.06Å
47	E	44.2	Very low	44.9	Very low	155 Å²	155	126.1 Å²	126.1	72%	0.724	73%	0.73	S	S	*	*			trans	-65	123.8	160	-83.1	-170.7	150.7	0	0	107.6	D45 I49	D45-E47 PolarHBondContact O-N 2.78Å; D45-E47 VanDerWaalsContact O-N 3.1Å; E47-I49 PolarHBondContact O-N 2.8Å
48	A	50.8	Low	45.1	Very low	94 Å²	94	126.2 Å²	126.2	78%	0.777	72%	0.717	S	S	*	*			trans	-52.8	111.3	176.8	0	0	0	0	0	109.7	V46 P50	V46-A48 PolarHBondContact O-N 3.06Å; A48-P50 WeakPolarHBondContact O-CD 3.44Å
49	I	48.4	Very low	45.4	Very low	120 Å²	120	127.3 Å²	127.3	62%	0.615	72%	0.718	S	S	*	*			trans	-55.6	123.6	171.3	-59.1	171.5	0	0	0	107	E47 L51 F53	E47-I49 PolarHBondContact O-N 2.8Å; I49-L51 PolarHBondContact O-N 3.48Å; I49-F53 HydrophobicContact CG2-CB 3.56Å; I49-F53 HydrophobicContact CG2-CD1 4.21Å; I49-F53 HydrophobicContact CG2-CG 3.92Å
50	P	55.9	Low	45.8	Very low	92 Å²	92	122.8 Å²	122.8	60%	0.597	70%	0.703	S	S	*	*			trans	-57.3	140.7	178.4	-23.2	32.4	0	0	0	110.6	A48 D52 F53	A48-P50 WeakPolarHBondContact O-CD 3.44Å; P50-D52 PolarHBondContact O-N 3.39Å; P50-F53 PolarHBondContact O-N 2.92Å
51	L	52.3	Low	46.2	Very low	161 Å²	161	122 Å²	122	84%	0.843	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-51.5	-16.7	177.8	-104.6	136.1	0	0	0	114.2	I49	I49-L51 PolarHBondContact O-N 3.48Å
52	D	53.9	Low	46.4	Very low	93 Å²	93	124.9 Å²	124.9	50%	0.497	69%	0.688	S	S	.	*	G	3₁₀ helix	trans	-78.1	-16.3	179	-64.3	-48.1	0	0	0	114.3	P50 H54 K55	P50-D52 PolarHBondContact O-N 3.39Å; D52-H54 PolarHBondContact O-N 2.94Å; D52-K55 PolarHBondContact O-N 2.92Å; D52-K55 VanDerWaalsContact O-N 3.12Å; D52-K55 IonicContact OD1-NZ 3.83Å; D52-K55 PolarHBondContact OD1-NZ 3.31Å
53	F	50	Low	46.7	Very low	150 Å²	150	127.2 Å²	127.2	66%	0.658	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-64.8	-23.2	178.7	-171.8	-99.9	0	0	0	113.1	I49 P50	I49-F53 HydrophobicContact CG2-CB 3.56Å; I49-F53 HydrophobicContact CG2-CD1 4.21Å; I49-F53 HydrophobicContact CG2-CG 3.92Å; P50-F53 PolarHBondContact O-N 2.92Å
54	H	48.2	Very low	46.9	Very low	142 Å²	142	126.9 Å²	126.9	66%	0.657	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-90.1	-2.3	177.4	-68.1	-63	0	0	0	114.4	D52	D52-H54 PolarHBondContact O-N 2.94Å
55	K	51.3	Low	47	Very low	130 Å²	130	130.1 Å²	130.1	57%	0.565	69%	0.693	S	S	*	*	S	Bend	trans	-79.5	-25.4	179.3	-89.5	177	-176.3	154.6	0	114.2	D52 N61	D52-K55 PolarHBondContact O-N 2.92Å; D52-K55 VanDerWaalsContact O-N 3.12Å; D52-K55 IonicContact OD1-NZ 3.83Å; D52-K55 PolarHBondContact OD1-NZ 3.31Å; K55-N61 PolarHBondContact O-ND2 3.04Å
56	E	46.8	Very low	47.1	Very low	176 Å²	176	130.6 Å²	130.6	82%	0.822	70%	0.696	S	S	*	*	S	Bend	trans	-97.4	-6.4	-165.5	-64.8	-171.6	169.7	0	0	114.7
57	N	48.3	Very low	47.1	Very low	158 Å²	158	126.3 Å²	126.3	85%	0.845	68%	0.677	S	S	*	*	S	Bend	trans	-133.4	25.2	-173	-106.1	-14.5	0	0	0	115.3
58	T	47.3	Very low	47	Very low	69 Å²	69	127.6 Å²	127.6	42%	0.423	68%	0.681	S	S	.	*			trans	-106.9	125.5	167.9	49.9	0	0	0	0	109.6	T60	T58-T60 VanDerWaalsContact CB-OG1 3.23Å; T58-T60 WeakPolarHBondContact CB-OG1 3.28Å; T58-T60 PolarHBondContact O-N 3.14Å; T58-T60 PolarHBondContact OG1-OG1 2.77Å
59	V	41.3	Very low	47.2	Very low	134 Å²	134	130.9 Å²	130.9	81%	0.812	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-57.5	3.1	173.6	-177.6	0	0	0	0	112.9
60	T	48.4	Very low	47.2	Very low	88 Å²	88	131.6 Å²	131.6	54%	0.54	69%	0.685	S	S	.	*	G	3₁₀ helix	trans	-83.3	-6.6	-178.3	50.1	0	0	0	0	114.7	T58	T58-T60 VanDerWaalsContact CB-OG1 3.23Å; T58-T60 WeakPolarHBondContact CB-OG1 3.28Å; T58-T60 PolarHBondContact O-N 3.14Å; T58-T60 PolarHBondContact OG1-OG1 2.77Å
61	N	43.4	Very low	47.4	Very low	121 Å²	121	132.5 Å²	132.5	65%	0.647	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-84.5	-11.8	175.8	-73.3	-16.9	0	0	0	113.8	K55	K55-N61 PolarHBondContact O-ND2 3.04Å
62	D	45.9	Very low	48.1	Very low	142 Å²	142	130.7 Å²	130.7	76%	0.759	67%	0.673	S	S	*	*	S	Bend	trans	-96.3	1.8	175.9	-69.5	-26.5	0	0	0	113.2	V64	D62-V64 VanDerWaalsContact C-N 3.31Å; D62-V64 PolarHBondContact O-N 2.86Å
63	L	43.5	Very low	49.1	Very low	134 Å²	134	129.6 Å²	129.6	70%	0.702	66%	0.662	S	S	*	*			trans	-78.4	91.4	166.6	-71.1	173.3	0	0	0	108	F65	L63-F65 PolarHBondContact O-N 2.91Å; L63-F65 VanDerWaalsContact O-N 3.12Å
64	V	40.4	Very low	50.4	Low	122 Å²	122	126.8 Å²	126.8	74%	0.739	65%	0.653	S	S	*	*			trans	-42.7	120.8	160.8	-179.3	0	0	0	0	107.2	D62 D66	D62-V64 VanDerWaalsContact C-N 3.31Å; D62-V64 PolarHBondContact O-N 2.86Å; V64-D66 PolarHBondContact O-N 2.84Å; V64-D66 VanDerWaalsContact O-N 3.16Å
65	F	40.3	Very low	51.7	Low	187 Å²	187	122.9 Å²	122.9	82%	0.82	64%	0.637	S	S	*	*			trans	-50.3	126	169.5	-88.3	-94.3	0	0	0	108	L63 G67	L63-F65 PolarHBondContact O-N 2.91Å; L63-F65 VanDerWaalsContact O-N 3.12Å; F65-G67 PolarHBondContact O-N 3.45Å
66	D	44.8	Very low	52.8	Low	145 Å²	145	123 Å²	123	78%	0.775	64%	0.638	S	S	*	*	S	Bend	trans	-63.4	61.7	-178.4	-161.7	19.9	0	0	0	112.2	V64 R328	V64-D66 PolarHBondContact O-N 2.84Å; V64-D66 VanDerWaalsContact O-N 3.16Å; D66-R328 PolarHBondContact O-NH2 2.65Å
67	G	44.8	Very low	54.2	Low	39 Å²	39	119.4 Å²	119.4	40%	0.402	62%	0.624	S	S	.	*			trans	-141.4	-2.3	-163.2	0	0	0	0	0	115.1	F65	F65-G67 PolarHBondContact O-N 3.45Å
68	F	42	Very low	55.5	Low	182 Å²	182	119.1 Å²	119.1	80%	0.798	62%	0.615	S	S	*	*			trans	-140.7	27.1	-177.2	-65.4	-75.5	0	0	0	113.9
69	E	53	Low	56.9	Low	163 Å²	163	120.3 Å²	120.3	76%	0.762	62%	0.618	S	S	*	*			trans	-85.9	109.5	156	-69.7	-167.4	176.5	0	0	106.9	E71	E69-E71 VanDerWaalsContact C-N 3.3Å; E69-E71 PolarHBondContact O-N 2.7Å
70	D	50.3	Low	58.4	Low	135 Å²	135	118.2 Å²	118.2	72%	0.722	60%	0.602	S	S	*	*			trans	-61.5	97.3	167.5	-69.7	-39.6	0	0	0	107	D72	D70-D72 PolarHBondContact O-N 2.88Å
71	E	59.3	Low	59.3	Low	112 Å²	112	117 Å²	117	52%	0.523	60%	0.601	S	S	.	*			trans	-71.7	66.1	169.9	-73.2	-175.1	155.6	0	0	109.1	E69 Y73 N318	E69-E71 VanDerWaalsContact C-N 3.3Å; E69-E71 PolarHBondContact O-N 2.7Å; E71-Y73 PolarHBondContact O-N 3.34Å; E71-N318 PolarHBondContact OE2-ND2 3.43Å
72	D	67.9	Low	60.4	Low	123 Å²	123	115.5 Å²	115.5	66%	0.658	61%	0.605	S	S	*	*			trans	-68.1	130.9	-178.2	-77.5	-21.3	0	0	0	110.2	D70 I74	D70-D72 PolarHBondContact O-N 2.88Å; D72-I74 PolarHBondContact O-N 3.19Å
73	Y	74.6	Confident	60.7	Low	69 Å²	69	112 Å²	112	27%	0.271	60%	0.603	S	S	.	*			trans	-69.4	121.9	171.7	-179.3	-118.1	0	0	0	109.7	E71 D75 D323	E71-Y73 PolarHBondContact O-N 3.34Å; Y73-D75 PolarHBondContact O-N 3.19Å; Y73-D323 HydrophobicContact CD1-CB 3.93Å
74	I	77.6	Confident	61	Low	92 Å²	92	107.5 Å²	107.5	47%	0.472	58%	0.582	S	S	.	*			trans	-79.7	102.6	174.7	-56.6	179.8	0	0	0	108.4	D72 F76 I79	D72-I74 PolarHBondContact O-N 3.19Å; I74-F76 HydrophobicContact CB-CE2 4.23Å; I74-F76 HydrophobicContact CB-CZ 4.39Å; I74-F76 HydrophobicContact CG2-CD1 4.14Å; I74-F76 HydrophobicContact CG2-CD2 4.19Å; I74-F76 HydrophobicContact CG2-CE1 3.97Å; I74-F76 HydrophobicContact CG2-CE2 4.02Å; I74-F76 HydrophobicContact CG2-CG 4.25Å; I74-F76 HydrophobicContact CG2-CZ 3.91Å; I74-F76 WeakPolarHBondContact O-CD2 3.46Å; I74-F76 PolarHBondContact O-N 2.94Å; I74-F76 VanDerWaalsContact O-N 3.11Å; I74-I79 HydrophobicContact CG2-CD1 3.44Å; I74-I79 VanDerWaalsContact CG2-CD1 3.44Å
75	D	73.9	Confident	61.7	Low	59 Å²	59	109.1 Å²	109.1	32%	0.316	59%	0.587	S	S	.	*			trans	-76.5	89.6	167.9	-175.4	-7.7	0	0	0	109.3	Y73 D77 K78 I79	Y73-D75 PolarHBondContact O-N 3.19Å; D75-D77 PolarHBondContact O-N 2.98Å; D75-D77 PolarHBondContact OD1-N 3.47Å; D75-K78 HydrophobicContact CB-CB 4.04Å; D75-K78 PolarHBondContact O-N 2.95Å; D75-K78 PolarHBondContact OD1-N 2.99Å; D75-K78 VanDerWaalsContact OD1-N 3.17Å; D75-K78 WeakPolarHBondContact OD2-CB 3.37Å; D75-I79 WeakPolarHBondContact O-CG1 3.33Å; D75-I79 PolarHBondContact O-N 3.39Å; D75-I79 VanDerWaalsContact O-N 3.09Å
76	F	75.3	Confident	62.4	Low	134 Å²	134	106.8 Å²	106.8	59%	0.588	58%	0.583	S	S	*	*	H	α-helix	trans	-58.8	-34.9	179.6	-73.3	-79.6	0	0	0	112.4	I74 K78 I79 L80	I74-F76 HydrophobicContact CB-CE2 4.23Å; I74-F76 HydrophobicContact CB-CZ 4.39Å; I74-F76 HydrophobicContact CG2-CD1 4.14Å; I74-F76 HydrophobicContact CG2-CD2 4.19Å; I74-F76 HydrophobicContact CG2-CE1 3.97Å; I74-F76 HydrophobicContact CG2-CE2 4.02Å; I74-F76 HydrophobicContact CG2-CG 4.25Å; I74-F76 HydrophobicContact CG2-CZ 3.91Å; I74-F76 WeakPolarHBondContact O-CD2 3.46Å; I74-F76 PolarHBondContact O-N 2.94Å; I74-F76 VanDerWaalsContact O-N 3.11Å; F76-K78 VanDerWaalsContact C-N 3.33Å; F76-K78 PolarHBondContact O-N 2.85Å; F76-I79 PolarHBondContact O-N 2.82Å; F76-L80 WeakPolarHBondContact O-CB 3.03Å; F76-L80 VanDerWaalsContact O-CG 3.22Å; F76-L80 WeakPolarHBondContact O-CG 3.41Å; F76-L80 PolarHBondContact O-N 2.92Å
77	D	75.9	Confident	62.7	Low	100 Å²	100	105.7 Å²	105.7	54%	0.535	57%	0.569	S	S	.	*	H	α-helix	trans	-66.1	-41.3	-177.7	-60.1	-28.6	0	0	0	109.3	D75 A81 K368	D75-D77 PolarHBondContact O-N 2.98Å; D75-D77 PolarHBondContact OD1-N 3.47Å; D77-A81 VanDerWaalsContact O-CB 3.31Å; D77-A81 WeakPolarHBondContact O-CB 3.39Å; D77-A81 PolarHBondContact O-N 2.85Å; D77-A81 VanDerWaalsContact O-N 3.13Å; D77-K368 IonicContact OD1-NZ 3.89Å; D77-K368 IonicContact OD2-NZ 3.86Å; D77-K368 PolarHBondContact OD2-NZ 3.22Å; D77-K368 VanDerWaalsContact OD2-NZ 3.13Å
78	K	75.9	Confident	63.1	Low	151 Å²	151	109 Å²	109	66%	0.657	58%	0.576	S	S	*	*	H	α-helix	trans	-68.2	-37.8	174.1	-173.4	-179.8	178.8	-171.6	0	113.8	D75 F76 A82	D75-K78 HydrophobicContact CB-CB 4.04Å; D75-K78 PolarHBondContact O-N 2.95Å; D75-K78 PolarHBondContact OD1-N 2.99Å; D75-K78 VanDerWaalsContact OD1-N 3.17Å; D75-K78 WeakPolarHBondContact OD2-CB 3.37Å; F76-K78 VanDerWaalsContact C-N 3.33Å; F76-K78 PolarHBondContact O-N 2.85Å; K78-A82 WeakPolarHBondContact O-CB 3.17Å; K78-A82 PolarHBondContact O-N 3.33Å
79	I	77.1	Confident	63.4	Low	94 Å²	94	110 Å²	110	48%	0.482	58%	0.583	S	S	.	*	H	α-helix	trans	-70.6	-44.1	-179.5	-68.4	170.4	0	0	0	110.8	I74 D75 F76 A81 A82 G83	I74-I79 HydrophobicContact CG2-CD1 3.44Å; I74-I79 VanDerWaalsContact CG2-CD1 3.44Å; D75-I79 WeakPolarHBondContact O-CG1 3.33Å; D75-I79 PolarHBondContact O-N 3.39Å; D75-I79 VanDerWaalsContact O-N 3.09Å; F76-I79 PolarHBondContact O-N 2.82Å; I79-A81 VanDerWaalsContact C-N 3.32Å; I79-A81 PolarHBondContact O-N 2.85Å; I79-A82 PolarHBondContact O-N 3.19Å; I79-A82 VanDerWaalsContact O-N 3.11Å; I79-G83 PolarHBondContact O-N 3.46Å
80	L	72.5	Confident	63.3	Low	91 Å²	91	105.7 Å²	105.7	48%	0.476	58%	0.582	S	S	.	*	H	α-helix	trans	-64.9	-38.5	178.4	-68.2	170.8	0	0	0	111.3	F76 A82 G83 S84 Y87	F76-L80 WeakPolarHBondContact O-CB 3.03Å; F76-L80 VanDerWaalsContact O-CG 3.22Å; F76-L80 WeakPolarHBondContact O-CG 3.41Å; F76-L80 PolarHBondContact O-N 2.92Å; L80-A82 PolarHBondContact O-N 3.29Å; L80-G83 PolarHBondContact O-N 2.93Å; L80-S84 PolarHBondContact O-OG 3.16Å; L80-Y87 WeakPolarHBondContact O-CD2 3.4Å
81	A	67.7	Low	63.5	Low	62 Å²	62	104.9 Å²	104.9	51%	0.512	58%	0.578	S	S	.	*	H	α-helix	trans	-63.8	-24.3	173.2	0	0	0	0	0	113.9	D77 I79	D77-A81 VanDerWaalsContact O-CB 3.31Å; D77-A81 WeakPolarHBondContact O-CB 3.39Å; D77-A81 PolarHBondContact O-N 2.85Å; D77-A81 VanDerWaalsContact O-N 3.13Å; I79-A81 VanDerWaalsContact C-N 3.32Å; I79-A81 PolarHBondContact O-N 2.85Å
82	A	65.3	Low	63.5	Low	90 Å²	90	105.5 Å²	105.5	74%	0.744	58%	0.581	S	S	*	*	H	α-helix	trans	-98.9	-16.5	-177.6	0	0	0	0	0	114.3	K78 I79 L80	K78-A82 WeakPolarHBondContact O-CB 3.17Å; K78-A82 PolarHBondContact O-N 3.33Å; I79-A82 PolarHBondContact O-N 3.19Å; I79-A82 VanDerWaalsContact O-N 3.11Å; L80-A82 PolarHBondContact O-N 3.29Å
83	G	52.1	Low	63.2	Low	68 Å²	68	107.8 Å²	107.8	70%	0.701	59%	0.591	S	S	*	*	H	α-helix	trans	-117.3	-2.3	-163.3	0	0	0	0	0	116.6	I79 L80	I79-G83 PolarHBondContact O-N 3.46Å; L80-G83 PolarHBondContact O-N 2.93Å
84	S	51.2	Low	62.2	Low	39 Å²	39	110.4 Å²	110.4	27%	0.273	61%	0.61	S	S	.	*			trans	-113.2	120.2	176	0.6	0	0	0	0	109.9	L80 D86 Y87	L80-S84 PolarHBondContact O-OG 3.16Å; S84-D86 PolarHBondContact O-N 3.15Å; S84-Y87 PolarHBondContact O-N 3.02Å; S84-Y87 WeakPolarHBondContact OG-CD2 3.38Å
85	D	54.5	Low	61.1	Low	156 Å²	156	115.3 Å²	115.3	83%	0.834	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	-10.7	165.8	-92.4	-19.1	0	0	0	112.2	I88	D85-I88 WeakPolarHBondContact O-CG1 3.37Å
86	D	55.1	Low	60.2	Low	138 Å²	138	119.7 Å²	119.7	74%	0.738	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-6.4	174.7	-56.8	-25.4	0	0	0	113.4	S84 I88	S84-D86 PolarHBondContact O-N 3.15Å; D86-I88 VanDerWaalsContact C-N 3.26Å; D86-I88 PolarHBondContact O-N 2.89Å
87	Y	51.1	Low	58.7	Low	122 Å²	122	117.9 Å²	117.9	48%	0.478	66%	0.662	S	S	.	*			trans	-90.5	54.3	171.2	-87.4	-91.5	0	0	0	111	L80 S84 E92	L80-Y87 WeakPolarHBondContact O-CD2 3.4Å; S84-Y87 PolarHBondContact O-N 3.02Å; S84-Y87 WeakPolarHBondContact OG-CD2 3.38Å; Y87-E92 WeakPolarHBondContact CE1-OE1 3.36Å
88	I	52	Low	57	Low	108 Å²	108	118.6 Å²	118.6	55%	0.554	67%	0.671	S	S	*	*			trans	-81.1	123.7	166.9	-59.3	173.2	0	0	0	106.9	D85 D86 G90 D91	D85-I88 WeakPolarHBondContact O-CG1 3.37Å; D86-I88 VanDerWaalsContact C-N 3.26Å; D86-I88 PolarHBondContact O-N 2.89Å; I88-G90 PolarHBondContact O-N 3.21Å; I88-D91 PolarHBondContact O-N 3.28Å; I88-D91 VanDerWaalsContact O-N 3.16Å
89	E	48.4	Very low	55.7	Low	205 Å²	205	118 Å²	118	96%	0.958	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.3	98.7	170.2	-162	176	-154	0	0	109.5
90	G	52	Low	54.2	Low	71 Å²	71	116.6 Å²	116.6	73%	0.732	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	132.8	-12.4	-178	0	0	0	0	0	117.7	I88	I88-G90 PolarHBondContact O-N 3.21Å
91	D	54.7	Low	53.1	Low	118 Å²	118	117.9 Å²	117.9	63%	0.631	70%	0.698	S	S	*	*			trans	-97.3	-4.6	179.8	-74.9	-24	0	0	0	114.2	I88	I88-D91 PolarHBondContact O-N 3.28Å; I88-D91 VanDerWaalsContact O-N 3.16Å
92	E	57.8	Low	51.7	Low	126 Å²	126	122.5 Å²	122.5	59%	0.589	71%	0.714	S	S	*	*	S	Bend	trans	-74.7	125.5	170.1	-69.8	-173.6	163.9	0	0	110.2	Y87 D94	Y87-E92 WeakPolarHBondContact CE1-OE1 3.36Å; E92-D94 VanDerWaalsContact C-N 3.3Å; E92-D94 PolarHBondContact O-N 2.81Å
93	I	63.1	Low	50.6	Low	171 Å²	171	125.1 Å²	125.1	88%	0.877	71%	0.714	S	S	*	*			trans	-76.2	90	168.7	-57	174.9	0	0	0	107	E95	I93-E95 PolarHBondContact O-N 3.08Å
94	D	53.3	Low	50.1	Low	123 Å²	123	126.5 Å²	126.5	66%	0.658	71%	0.706	S	S	*	*			trans	-58.6	130.3	171.4	-74.4	-34.3	0	0	0	110.2	E92 I96	E92-D94 VanDerWaalsContact C-N 3.3Å; E92-D94 PolarHBondContact O-N 2.81Å; D94-I96 PolarHBondContact O-N 2.87Å
95	E	53.6	Low	49.8	Very low	195 Å²	195	130 Å²	130	91%	0.911	72%	0.72	S	S	*	*			trans	-63.2	104.9	164.8	-81.7	-170.6	161.4	0	0	108.9	I93 A97	I93-E95 PolarHBondContact O-N 3.08Å; E95-A97 PolarHBondContact O-N 2.9Å
96	I	54.9	Low	49.3	Very low	152 Å²	152	128.1 Å²	128.1	78%	0.779	71%	0.705	S	S	*	*			trans	-66.5	107.5	169.3	-57.5	173.3	0	0	0	107.1	D94 T98	D94-I96 PolarHBondContact O-N 2.87Å; I96-T98 PolarHBondContact O-N 3.35Å
97	A	43.4	Very low	48.6	Very low	95 Å²	95	123.5 Å²	123.5	79%	0.785	69%	0.686	S	S	*	*			trans	-54.6	100	177.5	0	0	0	0	0	110.3	E95	E95-A97 PolarHBondContact O-N 2.9Å
98	T	41.9	Very low	48.6	Very low	116 Å²	116	121.2 Å²	121.2	71%	0.712	68%	0.679	S	S	*	*			trans	-79.3	130	166	43.9	0	0	0	0	107	I96 A100	I96-T98 PolarHBondContact O-N 3.35Å; T98-A100 PolarHBondContact O-N 2.95Å
99	P	48	Very low	48.4	Very low	139 Å²	139	117.4 Å²	117.4	90%	0.903	66%	0.662	S	S	*	*			trans	-73.1	85.7	177.6	28.8	-32.1	0	0	0	108.8
100	A	46.6	Very low	48.7	Very low	63 Å²	63	113.4 Å²	113.4	52%	0.521	66%	0.657	S	S	.	*			trans	-103	153.4	162.3	0	0	0	0	0	108.6	T98 D102	T98-A100 PolarHBondContact O-N 2.95Å; A100-D102 PolarHBondContact O-N 2.96Å
101	P	47.8	Very low	49.3	Very low	119 Å²	119	113 Å²	113	77%	0.773	64%	0.638	S	S	*	*			trans	-77.7	103.5	-166.9	31.6	-30.5	0	0	0	109.4	I103	P101-I103 PolarHBondContact O-N 2.87Å
102	D	38.1	Very low	49.9	Very low	158 Å²	158	111.6 Å²	111.6	85%	0.845	64%	0.635	S	S	*	*			trans	-66.4	96.1	169.9	-71.3	-29.3	0	0	0	109.6	A100 D104	A100-D102 PolarHBondContact O-N 2.96Å; D102-D104 VanDerWaalsContact C-N 3.25Å; D102-D104 PolarHBondContact O-N 3.06Å
103	I	43.8	Very low	50.4	Low	145 Å²	145	113.4 Å²	113.4	74%	0.744	64%	0.641	S	S	*	*			trans	-80.1	88	155.3	-59.2	175.1	0	0	0	105.5	P101 I105	P101-I103 PolarHBondContact O-N 2.87Å; I103-I105 PolarHBondContact O-N 2.68Å
104	D	41.3	Very low	50.8	Low	98 Å²	98	108.6 Å²	108.6	52%	0.524	62%	0.617	S	S	.	*			trans	-56.6	111.2	166.3	-173.7	-15.4	0	0	0	108.5	D102 F106 A107	D102-D104 VanDerWaalsContact C-N 3.25Å; D102-D104 PolarHBondContact O-N 3.06Å; D104-F106 PolarHBondContact O-N 2.75Å; D104-F106 PolarHBondContact OD1-N 3.09Å; D104-A107 HydrophobicContact CB-CB 3.88Å; D104-A107 VanDerWaalsContact CG-N 3.34Å; D104-A107 PolarHBondContact OD1-N 3.09Å; D104-A107 VanDerWaalsContact OD2-CB 3.29Å; D104-A107 WeakPolarHBondContact OD2-CB 3.43Å
105	I	44.8	Very low	51.5	Low	111 Å²	111	106.7 Å²	106.7	57%	0.569	60%	0.6	S	S	*	*	S	Bend	trans	-68.7	-18.2	-176.3	-59	174.6	0	0	0	110.1	I103 R118	I103-I105 PolarHBondContact O-N 2.68Å; I105-R118 PolarHBondContact O-NH1 3.28Å; I105-R118 PolarHBondContact O-NH2 2.95Å
106	F	42.5	Very low	52.3	Low	118 Å²	118	103.3 Å²	103.3	52%	0.518	58%	0.579	S	S	.	*	S	Bend	trans	-122.2	-14.8	-169.1	-62.5	-79	0	0	0	115.3	D104 E108	D104-F106 PolarHBondContact O-N 2.75Å; D104-F106 PolarHBondContact OD1-N 3.09Å; F106-E108 PolarHBondContact O-N 3.5Å
107	A	42.5	Very low	53	Low	41 Å²	41	98.4 Å²	98.4	34%	0.339	56%	0.561	S	S	.	*	S	Bend	trans	-52.5	137.5	158.9	0	0	0	0	0	109.3	D104 S109 R118	D104-A107 HydrophobicContact CB-CB 3.88Å; D104-A107 VanDerWaalsContact CG-N 3.34Å; D104-A107 PolarHBondContact OD1-N 3.09Å; D104-A107 VanDerWaalsContact OD2-CB 3.29Å; D104-A107 WeakPolarHBondContact OD2-CB 3.43Å; A107-S109 PolarHBondContact O-N 3.24Å; A107-R118 PolarHBondContact O-NH1 3.2Å
108	E	50.3	Low	54.3	Low	73 Å²	73	98.3 Å²	98.3	34%	0.341	54%	0.54	S	S	.	.			trans	-57.5	100.2	158.9	-82.3	-167.5	118.8	0	0	106.1	F106 S110 R138 R145	F106-E108 PolarHBondContact O-N 3.5Å; E108-S110 PolarHBondContact O-N 2.89Å; E108-S110 VanDerWaalsContact O-N 3.14Å; E108-R138 IonicContact OE1-CZ 3.88Å; E108-R138 VanDerWaalsContact OE1-CZ 3.26Å; E108-R138 IonicContact OE1-NE 2.82Å; E108-R138 PolarHBondContact OE1-NE 3.32Å; E108-R138 IonicContact OE1-NH2 3.66Å; E108-R138 PolarHBondContact OE1-NH2 3.43Å; E108-R145 IonicContact OE2-CZ 3.22Å; E108-R145 IonicContact OE2-NH1 2.84Å; E108-R145 IonicContact OE2-NH2 2.71Å; E108-R145 PolarHBondContact OE2-NH2 2.99Å
109	S	48.5	Very low	55.8	Low	29 Å²	29	93.3 Å²	93.3	20%	0.203	51%	0.509	C	S	.	.			trans	-47.9	128.2	178.9	176.4	0	0	0	0	108.4	A107 D111 R115	A107-S109 PolarHBondContact O-N 3.24Å; S109-D111 PolarHBondContact O-N 2.83Å; S109-D111 VanDerWaalsContact O-N 3.08Å; S109-D111 WeakPolarHBondContact OG-CB 3.45Å; S109-D111 PolarHBondContact OG-N 2.96Å; S109-R115 VanDerWaalsContact O-CD 3.3Å; S109-R115 WeakPolarHBondContact O-CD 3.42Å; S109-R115 WeakPolarHBondContact O-CG 3.47Å
110	S	54.3	Low	57	Low	121 Å²	121	89.7 Å²	89.7	85%	0.846	48%	0.482	S	S	*	.	S	Bend	trans	-57.6	-19.8	174.6	51.8	0	0	0	0	111.5	E108 P112	E108-S110 PolarHBondContact O-N 2.89Å; E108-S110 VanDerWaalsContact O-N 3.14Å; S110-P112 VanDerWaalsContact O-CD 3.24Å; S110-P112 WeakPolarHBondContact O-CD 3.24Å
111	D	64.6	Low	58.5	Low	63 Å²	63	96.1 Å²	96.1	34%	0.337	49%	0.493	S	S	.	.			trans	-71.4	115	175.2	-170.7	-12.1	0	0	0	111.9	S109 K113 I114 R115	S109-D111 PolarHBondContact O-N 2.83Å; S109-D111 VanDerWaalsContact O-N 3.08Å; S109-D111 WeakPolarHBondContact OG-CB 3.45Å; S109-D111 PolarHBondContact OG-N 2.96Å; D111-K113 PolarHBondContact O-N 2.8Å; D111-K113 VanDerWaalsContact O-N 3.14Å; D111-K113 WeakPolarHBondContact OD1-CB 3.43Å; D111-K113 PolarHBondContact OD1-N 3.21Å; D111-I114 HydrophobicContact CB-CB 4.38Å; D111-I114 HydrophobicContact CB-CD1 4.1Å; D111-I114 HydrophobicContact CB-CG1 4.17Å; D111-I114 PolarHBondContact O-N 3.44Å; D111-R115 PolarHBondContact O-N 3.47Å
112	P	66.7	Low	59.8	Low	87 Å²	87	92 Å²	92	57%	0.565	46%	0.464	S	S	*	.	H	α-helix	trans	-56.8	-28.5	175.9	-23.4	34.6	0	0	0	114	S110 R116	S110-P112 VanDerWaalsContact O-CD 3.24Å; S110-P112 WeakPolarHBondContact O-CD 3.24Å; P112-R116 WeakPolarHBondContact O-CB 3.35Å; P112-R116 PolarHBondContact O-N 3.35Å
113	K	68.5	Low	61.9	Low	164 Å²	164	84.7 Å²	84.7	71%	0.713	43%	0.425	S	S	*	.	H	α-helix	trans	-70.6	-44.1	-179.4	-67	178.7	-179.7	173.9	0	111.7	D111 R116 A117	D111-K113 PolarHBondContact O-N 2.8Å; D111-K113 VanDerWaalsContact O-N 3.14Å; D111-K113 WeakPolarHBondContact OD1-CB 3.43Å; D111-K113 PolarHBondContact OD1-N 3.21Å; K113-R116 PolarHBondContact O-N 3.29Å; K113-A117 PolarHBondContact O-N 3.05Å
114	I	71.1	Confident	63.6	Low	71 Å²	71	84.7 Å²	84.7	36%	0.364	42%	0.421	S	S	.	.	H	α-helix	trans	-66	-43.3	178.9	-64.7	176.7	0	0	0	110	D111 R116 A117 R118	D111-I114 HydrophobicContact CB-CB 4.38Å; D111-I114 HydrophobicContact CB-CD1 4.1Å; D111-I114 HydrophobicContact CB-CG1 4.17Å; D111-I114 PolarHBondContact O-N 3.44Å; I114-R116 VanDerWaalsContact C-N 3.35Å; I114-R116 PolarHBondContact O-N 3.32Å; I114-A117 PolarHBondContact O-N 2.9Å; I114-R118 PolarHBondContact O-N 3.47Å
115	R	68.1	Low	65.2	Low	83 Å²	83	84.2 Å²	84.2	31%	0.313	44%	0.44	S	S	.	.	H	α-helix	trans	-54.8	-49	172.7	-74.7	170.2	25.8	148.9	-2.6	112.2	S109 D111 A117 R118 L119 E191	S109-R115 VanDerWaalsContact O-CD 3.3Å; S109-R115 WeakPolarHBondContact O-CD 3.42Å; S109-R115 WeakPolarHBondContact O-CG 3.47Å; D111-R115 PolarHBondContact O-N 3.47Å; R115-A117 PolarHBondContact O-N 3.34Å; R115-R118 PolarHBondContact O-N 3.49Å; R115-L119 PolarHBondContact O-N 3.46Å; R115-E191 IonicContact CZ-OE1 2.59Å; R115-E191 IonicContact NH2-OE1 3.77Å; R115-E191 PolarHBondContact NH2-OE1 2.96Å
116	R	69.9	Low	67	Low	124 Å²	124	80.9 Å²	80.9	47%	0.468	42%	0.421	S	S	.	.	H	α-helix	trans	-62.3	-43.9	178.7	-174.7	176.4	-179.1	172.7	1.1	111.5	P112 K113 I114 R118 L119 L120 N194	P112-R116 WeakPolarHBondContact O-CB 3.35Å; P112-R116 PolarHBondContact O-N 3.35Å; K113-R116 PolarHBondContact O-N 3.29Å; I114-R116 VanDerWaalsContact C-N 3.35Å; I114-R116 PolarHBondContact O-N 3.32Å; R116-R118 PolarHBondContact O-N 3.38Å; R116-L119 PolarHBondContact O-N 2.91Å; R116-L120 HydrophobicContact CG-CD1 4.03Å; R116-L120 HydrophobicContact CG-CG 4.37Å; R116-L120 WeakPolarHBondContact O-CB 3.44Å; R116-L120 VanDerWaalsContact O-CG 3.29Å; R116-L120 WeakPolarHBondContact O-CG 3.31Å; R116-L120 PolarHBondContact O-N 2.88Å; R116-N194 PolarHBondContact NH2-O 3.36Å; R116-N194 VanDerWaalsContact NH2-O 3.12Å
117	A	70.3	Confident	69	Low	48 Å²	48	77.9 Å²	77.9	40%	0.397	42%	0.415	S	S	.	.	H	α-helix	trans	-61.8	-42.6	178.1	0	0	0	0	0	112.3	K113 I114 R115 L120 R121	K113-A117 PolarHBondContact O-N 3.05Å; I114-A117 PolarHBondContact O-N 2.9Å; R115-A117 PolarHBondContact O-N 3.34Å; A117-L120 PolarHBondContact O-N 2.69Å; A117-R121 WeakPolarHBondContact O-CG 3.31Å; A117-R121 PolarHBondContact O-N 2.9Å
118	R	71.6	Confident	71.2	Confident	93 Å²	93	82.3 Å²	82.3	35%	0.351	42%	0.423	S	S	.	.	H	α-helix	trans	-62.1	-46.5	175	-73.7	-177.3	-177.9	-179.2	0.1	111.8	I105 A107 I114 R115 R116 L120 R121 L122	I105-R118 PolarHBondContact O-NH1 3.28Å; I105-R118 PolarHBondContact O-NH2 2.95Å; A107-R118 PolarHBondContact O-NH1 3.2Å; I114-R118 PolarHBondContact O-N 3.47Å; R115-R118 PolarHBondContact O-N 3.49Å; R116-R118 PolarHBondContact O-N 3.38Å; R118-L120 PolarHBondContact O-N 3.06Å; R118-R121 PolarHBondContact O-N 2.8Å; R118-L122 WeakPolarHBondContact O-CG 3.43Å; R118-L122 PolarHBondContact O-N 3.05Å; R118-L122 VanDerWaalsContact O-N 3.11Å
119	L	72.5	Confident	72.9	Confident	11 Å²	11	80 Å²	80	6%	0.058	41%	0.413	C	S	.	.	H	α-helix	trans	-61.5	-43.4	177.8	-174.4	71.7	0	0	0	112.1	R115 R116 R121 L122 F123 V135 E191	R115-L119 PolarHBondContact O-N 3.46Å; R116-L119 PolarHBondContact O-N 2.91Å; L119-R121 VanDerWaalsContact C-N 3.34Å; L119-R121 PolarHBondContact O-N 2.95Å; L119-L122 WeakPolarHBondContact O-CB 3.31Å; L119-L122 PolarHBondContact O-N 2.88Å; L119-F123 HydrophobicContact CD1-CD1 4.48Å; L119-F123 HydrophobicContact CD1-CE1 3.65Å; L119-F123 HydrophobicContact CD1-CZ 3.95Å; L119-F123 HydrophobicContact CD2-CE1 4.39Å; L119-F123 HydrophobicContact CD2-CE2 4.4Å; L119-F123 HydrophobicContact CD2-CZ 3.85Å; L119-F123 HydrophobicContact CG-CD1 4.43Å; L119-F123 HydrophobicContact CG-CE1 3.74Å; L119-F123 HydrophobicContact CG-CE2 4.31Å; L119-F123 HydrophobicContact CG-CZ 3.67Å; L119-F123 VanDerWaalsContact O-CD1 3.25Å; L119-F123 WeakPolarHBondContact O-CD1 3.36Å; L119-F123 WeakPolarHBondContact O-CG 3.43Å; L119-F123 PolarHBondContact O-N 2.71Å; L119-F123 VanDerWaalsContact O-N 3.15Å; L119-V135 HydrophobicContact CD1-CG2 4.21Å; L119-V135 HydrophobicContact CD2-CG2 4.13Å; L119-E191 HydrophobicContact CD2-CB 3.84Å; L119-E191 WeakPolarHBondContact CD2-OE2 3.45Å
120	L	73.1	Confident	74.8	Confident	63 Å²	63	80.5 Å²	80.5	33%	0.33	41%	0.412	S	S	.	.	H	α-helix	trans	-66	-36	177.9	-70	175.7	0	0	0	112.2	R116 A117 R118 L122 F123 A195	R116-L120 HydrophobicContact CG-CD1 4.03Å; R116-L120 HydrophobicContact CG-CG 4.37Å; R116-L120 WeakPolarHBondContact O-CB 3.44Å; R116-L120 VanDerWaalsContact O-CG 3.29Å; R116-L120 WeakPolarHBondContact O-CG 3.31Å; R116-L120 PolarHBondContact O-N 2.88Å; A117-L120 PolarHBondContact O-N 2.69Å; R118-L120 PolarHBondContact O-N 3.06Å; L120-L122 VanDerWaalsContact C-N 3.3Å; L120-L122 PolarHBondContact O-N 3.32Å; L120-F123 HydrophobicContact CD2-CD2 4.17Å; L120-F123 WeakPolarHBondContact O-CB 3.22Å; L120-F123 PolarHBondContact O-N 3.47Å; L120-F123 VanDerWaalsContact O-N 3.14Å; L120-A195 HydrophobicContact CD2-CB 3.91Å
121	R	77.8	Confident	76.4	Confident	198 Å²	198	77.5 Å²	77.5	75%	0.747	38%	0.382	S	S	*	.	H	α-helix	trans	-60.8	-42.3	173.4	-78.3	-178.3	179.9	-172.5	1.2	111.8	A117 R118 L119 F123 H124	A117-R121 WeakPolarHBondContact O-CG 3.31Å; A117-R121 PolarHBondContact O-N 2.9Å; R118-R121 PolarHBondContact O-N 2.8Å; L119-R121 VanDerWaalsContact C-N 3.34Å; L119-R121 PolarHBondContact O-N 2.95Å; R121-F123 PolarHBondContact O-N 3.47Å; R121-H124 PolarHBondContact O-CD2 3.46Å; R121-H124 PolarHBondContact O-N 3.27Å
122	L	76.3	Confident	77.7	Confident	33 Å²	33	74.5 Å²	74.5	17%	0.173	37%	0.366	C	S	.	.	H	α-helix	trans	-63.1	-27.8	175.7	-77.5	176.7	0	0	0	113.1	R118 L119 L120 H124 H126 M134 T382	R118-L122 WeakPolarHBondContact O-CG 3.43Å; R118-L122 PolarHBondContact O-N 3.05Å; R118-L122 VanDerWaalsContact O-N 3.11Å; L119-L122 WeakPolarHBondContact O-CB 3.31Å; L119-L122 PolarHBondContact O-N 2.88Å; L120-L122 VanDerWaalsContact C-N 3.3Å; L120-L122 PolarHBondContact O-N 3.32Å; L122-H124 VanDerWaalsContact C-N 3.31Å; L122-H124 PolarHBondContact O-N 3.07Å; L122-H126 PolarHBondContact O-CE1 2.89Å; L122-H126 VanDerWaalsContact O-CE1 3.23Å; L122-H126 PolarHBondContact O-ND1 2.84Å; L122-M134 HydrophobicContact CB-CE 3.53Å; L122-M134 HydrophobicContact CB-SD 4.33Å; L122-M134 HydrophobicContact CD1-CE 4.13Å; L122-M134 HydrophobicContact CD2-CE 3.95Å; L122-M134 HydrophobicContact CG-CE 4.06Å; L122-T382 HydrophobicContact CD1-CG2 3.55Å; L122-T382 HydrophobicContact CD2-CG2 4.05Å; L122-T382 HydrophobicContact CG-CG2 4.1Å
123	F	82.4	Confident	78.9	Confident	5 Å²	5	70.3 Å²	70.3	2%	0.022	34%	0.339	C	S	.	.	H	α-helix	trans	-75	-16.4	-179.2	-73.3	2.3	0	0	0	114.5	L119 L120 R121 G125 H126 R131 M134 V135 A195	L119-F123 HydrophobicContact CD1-CD1 4.48Å; L119-F123 HydrophobicContact CD1-CE1 3.65Å; L119-F123 HydrophobicContact CD1-CZ 3.95Å; L119-F123 HydrophobicContact CD2-CE1 4.39Å; L119-F123 HydrophobicContact CD2-CE2 4.4Å; L119-F123 HydrophobicContact CD2-CZ 3.85Å; L119-F123 HydrophobicContact CG-CD1 4.43Å; L119-F123 HydrophobicContact CG-CE1 3.74Å; L119-F123 HydrophobicContact CG-CE2 4.31Å; L119-F123 HydrophobicContact CG-CZ 3.67Å; L119-F123 VanDerWaalsContact O-CD1 3.25Å; L119-F123 WeakPolarHBondContact O-CD1 3.36Å; L119-F123 WeakPolarHBondContact O-CG 3.43Å; L119-F123 PolarHBondContact O-N 2.71Å; L119-F123 VanDerWaalsContact O-N 3.15Å; L120-F123 HydrophobicContact CD2-CD2 4.17Å; L120-F123 WeakPolarHBondContact O-CB 3.22Å; L120-F123 PolarHBondContact O-N 3.47Å; L120-F123 VanDerWaalsContact O-N 3.14Å; R121-F123 PolarHBondContact O-N 3.47Å; F123-G125 PolarHBondContact O-N 2.96Å; F123-H126 PolarHBondContact O-N 3.08Å; F123-R131 HydrophobicContact CB-CG 3.88Å; F123-R131 HydrophobicContact CD1-CB 3.91Å; F123-R131 HydrophobicContact CD1-CG 3.72Å; F123-R131 HydrophobicContact CD2-CB 4.22Å; F123-R131 HydrophobicContact CD2-CG 4.01Å; F123-R131 HydrophobicContact CE1-CB 3.85Å; F123-R131 HydrophobicContact CE1-CG 4.19Å; F123-R131 HydrophobicContact CE2-CB 4.15Å; F123-R131 HydrophobicContact CE2-CG 4.45Å; F123-R131 HydrophobicContact CG-CB 4.09Å; F123-R131 HydrophobicContact CG-CG 3.61Å; F123-R131 HydrophobicContact CZ-CB 3.97Å; F123-R131 PolarHBondContact O-NE 3.23Å; F123-R131 PolarHBondContact O-NH2 2.91Å; F123-M134 HydrophobicContact CD1-SD 4.11Å; F123-M134 HydrophobicContact CE1-CB 4.3Å; F123-M134 HydrophobicContact CE1-SD 4.42Å; F123-V135 HydrophobicContact CE1-CG2 4.32Å; F123-V135 HydrophobicContact CZ-CG2 3.82Å; F123-A195 HydrophobicContact CD2-CB 3.9Å; F123-A195 HydrophobicContact CE2-CB 3.58Å
124	H	78.4	Confident	80	Confident	145 Å²	145	63.1 Å²	63.1	67%	0.671	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	134	178.2	-74.6	-67.6	0	0	0	111	R121 L122 H126	R121-H124 PolarHBondContact O-CD2 3.46Å; R121-H124 PolarHBondContact O-N 3.27Å; L122-H124 VanDerWaalsContact C-N 3.31Å; L122-H124 PolarHBondContact O-N 3.07Å; H124-H126 PolarHBondContact O-N 3.46Å; H124-H126 PolarHBondContact O-ND1 2.99Å
125	G	75.3	Confident	81	Confident	88 Å²	88	59.9 Å²	59.9	91%	0.907	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	-6.9	-178.3	0	0	0	0	0	115.8	F123	F123-G125 PolarHBondContact O-N 2.96Å
126	H	82.3	Confident	82.3	Confident	40 Å²	40	56.2 Å²	56.2	19%	0.185	28%	0.278	C	S	.	.			trans	-98.1	144.2	-176.3	-64.8	77.6	0	0	0	112.5	L122 F123 H124 Q130 R131 D491	L122-H126 PolarHBondContact O-CE1 2.89Å; L122-H126 VanDerWaalsContact O-CE1 3.23Å; L122-H126 PolarHBondContact O-ND1 2.84Å; F123-H126 PolarHBondContact O-N 3.08Å; H124-H126 PolarHBondContact O-N 3.46Å; H124-H126 PolarHBondContact O-ND1 2.99Å; H126-Q130 HydrophobicContact CB-CB 3.94Å; H126-R131 HydrophobicContact CB-CG 4.11Å; H126-R131 PolarHBondContact O-NE 2.89Å; H126-R131 PolarHBondContact O-NH2 3.48Å; H126-D491 IonicContact CD2-OD2 3.65Å
127	S	85.4	Confident	83.4	Confident	55 Å²	55	50.4 Å²	50.4	39%	0.385	26%	0.257	S	S	.	.			trans	-67	163.3	172.9	72.4	0	0	0	0	112.2	L129 Q130 R131	S127-L129 PolarHBondContact O-N 2.99Å; S127-Q130 VanDerWaalsContact CB-OE1 3.26Å; S127-Q130 PolarHBondContact O-N 2.63Å; S127-Q130 WeakPolarHBondContact OG-CG 3.36Å; S127-Q130 PolarHBondContact OG-N 2.91Å; S127-Q130 PolarHBondContact OG-OE1 2.81Å; S127-R131 WeakPolarHBondContact O-CG 3.48Å; S127-R131 PolarHBondContact O-N 2.82Å
128	R	87.1	Confident	84.6	Confident	134 Å²	134	49.4 Å²	49.4	51%	0.506	24%	0.243	S	C	.	.	H	α-helix	trans	-55.6	-39	178.9	-56.2	-170.8	-173.9	179.1	1.2	112.7	L132 F192 Y199 L207	R128-L132 PolarHBondContact O-N 3.07Å; R128-L132 VanDerWaalsContact O-N 3.17Å; R128-F192 WeakPolarHBondContact O-CE2 3.4Å; R128-Y199 HydrophobicContact CG-CE1 4.03Å; R128-L207 HydrophobicContact CB-CD1 4.26Å; R128-L207 HydrophobicContact CB-CD2 4.32Å
129	L	86.7	Confident	85.7	Confident	26 Å²	26	45.1 Å²	45.1	14%	0.136	23%	0.227	C	C	.	.	H	α-helix	trans	-71.8	-40.9	-179.1	-175.3	56.6	0	0	0	111.5	S127 L132 N133 L207 L211 T490	S127-L129 PolarHBondContact O-N 2.99Å; L129-L132 PolarHBondContact O-N 2.99Å; L129-N133 PolarHBondContact O-N 3.23Å; L129-N133 PolarHBondContact O-ND2 3.38Å; L129-L207 HydrophobicContact CB-CD2 4.22Å; L129-L207 HydrophobicContact CD1-CB 4.2Å; L129-L207 HydrophobicContact CD1-CD2 4.31Å; L129-L211 HydrophobicContact CD1-CB 4.19Å; L129-L211 HydrophobicContact CD1-CD1 4.44Å; L129-T490 HydrophobicContact CD2-CG2 3.44Å; L129-T490 VanDerWaalsContact CD2-CG2 3.44Å; L129-T490 HydrophobicContact CG-CG2 4.12Å
130	Q	88.1	Confident	86.8	Confident	38 Å²	38	44.6 Å²	44.6	18%	0.178	22%	0.224	C	C	.	.	H	α-helix	trans	-61.1	-44.8	173.9	-72.3	166.1	-57.2	0	0	111.2	H126 S127 L132 N133 M134 T490 D491	H126-Q130 HydrophobicContact CB-CB 3.94Å; S127-Q130 VanDerWaalsContact CB-OE1 3.26Å; S127-Q130 PolarHBondContact O-N 2.63Å; S127-Q130 WeakPolarHBondContact OG-CG 3.36Å; S127-Q130 PolarHBondContact OG-N 2.91Å; S127-Q130 PolarHBondContact OG-OE1 2.81Å; Q130-L132 VanDerWaalsContact C-N 3.34Å; Q130-L132 PolarHBondContact O-N 3.27Å; Q130-N133 CarbonylContact O-C 3.58Å; Q130-N133 WeakPolarHBondContact O-CA 3.45Å; Q130-N133 PolarHBondContact O-N 3.02Å; Q130-M134 VanDerWaalsContact O-CG 3.3Å; Q130-M134 WeakPolarHBondContact O-CG 3.37Å; Q130-M134 PolarHBondContact O-N 3.41Å; Q130-T490 WeakPolarHBondContact CA-O 3.49Å; Q130-D491 VanDerWaalsContact CD-OD2 3.28Å; Q130-D491 HydrophobicContact CG-CB 4.22Å; Q130-D491 VanDerWaalsContact CG-OD2 3.24Å; Q130-D491 WeakPolarHBondContact CG-OD2 3.29Å; Q130-D491 PolarHBondContact NE2-OD2 3.17Å
131	R	88	Confident	87.9	Confident	58 Å²	58	41.7 Å²	41.7	22%	0.219	21%	0.209	C	C	.	.	H	α-helix	trans	-57.7	-43.6	176.2	-65.6	175.9	-166.6	-167.7	-3.7	112.7	F123 H126 S127 N133 M134 V135 F192 Y199	F123-R131 HydrophobicContact CB-CG 3.88Å; F123-R131 HydrophobicContact CD1-CB 3.91Å; F123-R131 HydrophobicContact CD1-CG 3.72Å; F123-R131 HydrophobicContact CD2-CB 4.22Å; F123-R131 HydrophobicContact CD2-CG 4.01Å; F123-R131 HydrophobicContact CE1-CB 3.85Å; F123-R131 HydrophobicContact CE1-CG 4.19Å; F123-R131 HydrophobicContact CE2-CB 4.15Å; F123-R131 HydrophobicContact CE2-CG 4.45Å; F123-R131 HydrophobicContact CG-CB 4.09Å; F123-R131 HydrophobicContact CG-CG 3.61Å; F123-R131 HydrophobicContact CZ-CB 3.97Å; F123-R131 PolarHBondContact O-NE 3.23Å; F123-R131 PolarHBondContact O-NH2 2.91Å; H126-R131 HydrophobicContact CB-CG 4.11Å; H126-R131 PolarHBondContact O-NE 2.89Å; H126-R131 PolarHBondContact O-NH2 3.48Å; S127-R131 WeakPolarHBondContact O-CG 3.48Å; S127-R131 PolarHBondContact O-N 2.82Å; R131-N133 VanDerWaalsContact C-N 3.32Å; R131-M134 PolarHBondContact O-N 3.37Å; R131-V135 PolarHBondContact O-N 2.74Å; R131-F192 HydrophobicContact CB-CD2 4.28Å; R131-F192 HydrophobicContact CB-CE2 4.04Å; R131-Y199 PolarHBondContact NH1-OH 2.84Å
132	L	91.1	Very high	88.7	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.3	-41.9	174.3	179.1	64.5	0	0	0	111.2	R128 L129 Q130 M134 V135 N136 F189 F192 V204 L207 F208	R128-L132 PolarHBondContact O-N 3.07Å; R128-L132 VanDerWaalsContact O-N 3.17Å; L129-L132 PolarHBondContact O-N 2.99Å; Q130-L132 VanDerWaalsContact C-N 3.34Å; Q130-L132 PolarHBondContact O-N 3.27Å; L132-M134 VanDerWaalsContact C-N 3.34Å; L132-M134 PolarHBondContact O-N 3.31Å; L132-V135 WeakPolarHBondContact O-CB 3.47Å; L132-V135 PolarHBondContact O-N 3.12Å; L132-N136 VanDerWaalsContact O-CG 3.3Å; L132-N136 PolarHBondContact O-N 3.21Å; L132-N136 PolarHBondContact O-ND2 3.3Å; L132-F189 HydrophobicContact CD1-CD1 4.03Å; L132-F189 HydrophobicContact CD1-CE1 4.18Å; L132-F192 HydrophobicContact CB-CD2 4.11Å; L132-F192 HydrophobicContact CB-CE2 3.91Å; L132-F192 HydrophobicContact CB-CZ 4.33Å; L132-F192 HydrophobicContact CD1-CD1 4.32Å; L132-F192 HydrophobicContact CD1-CD2 4.39Å; L132-F192 HydrophobicContact CD1-CG 4.18Å; L132-V204 HydrophobicContact CD1-CG1 4.5Å; L132-L207 HydrophobicContact CB-CD1 4.22Å; L132-L207 HydrophobicContact CD2-CB 3.55Å; L132-L207 HydrophobicContact CD2-CD1 4.01Å; L132-L207 HydrophobicContact CD2-CG 4.45Å; L132-F208 HydrophobicContact CD1-CZ 4.46Å; L132-F208 HydrophobicContact CD2-CD1 4.36Å; L132-F208 HydrophobicContact CD2-CE1 4.17Å; L132-F208 HydrophobicContact CD2-CZ 4.23Å
133	N	93.3	Very high	89.6	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-70	-28.3	179.5	-75.7	-23	0	0	0	113.8	L129 Q130 R131 V135 N136 A137 L211 T490 D491 C492	L129-N133 PolarHBondContact O-N 3.23Å; L129-N133 PolarHBondContact O-ND2 3.38Å; Q130-N133 CarbonylContact O-C 3.58Å; Q130-N133 WeakPolarHBondContact O-CA 3.45Å; Q130-N133 PolarHBondContact O-N 3.02Å; R131-N133 VanDerWaalsContact C-N 3.32Å; N133-V135 VanDerWaalsContact C-N 3.33Å; N133-N136 PolarHBondContact O-N 3.19Å; N133-N136 PolarHBondContact OD1-ND2 2.85Å; N133-A137 WeakPolarHBondContact O-CB 3.48Å; N133-A137 PolarHBondContact O-N 2.89Å; N133-L211 WeakPolarHBondContact OD1-CD2 3.45Å; N133-T490 WeakPolarHBondContact CB-O 3.38Å; N133-T490 WeakPolarHBondContact ND2-CB 3.37Å; N133-T490 PolarHBondContact ND2-O 3.21Å; N133-T490 PolarHBondContact ND2-OG1 2.73Å; N133-D491 WeakPolarHBondContact CB-O 3.3Å; N133-C492 HydrophobicContact CB-CB 4.49Å; N133-C492 WeakPolarHBondContact ND2-CB 3.48Å
134	M	90.9	Very high	90.3	Very high	12 Å²	12	32.4 Å²	32.4	6%	0.059	17%	0.174	C	C	.	.	H	α-helix	trans	-65.7	-38.7	170.4	-65	178	96.6	0	0	111.6	L122 F123 Q130 R131 L132 A137 R138	L122-M134 HydrophobicContact CB-CE 3.53Å; L122-M134 HydrophobicContact CB-SD 4.33Å; L122-M134 HydrophobicContact CD1-CE 4.13Å; L122-M134 HydrophobicContact CD2-CE 3.95Å; L122-M134 HydrophobicContact CG-CE 4.06Å; F123-M134 HydrophobicContact CD1-SD 4.11Å; F123-M134 HydrophobicContact CE1-CB 4.3Å; F123-M134 HydrophobicContact CE1-SD 4.42Å; Q130-M134 VanDerWaalsContact O-CG 3.3Å; Q130-M134 WeakPolarHBondContact O-CG 3.37Å; Q130-M134 PolarHBondContact O-N 3.41Å; R131-M134 PolarHBondContact O-N 3.37Å; L132-M134 VanDerWaalsContact C-N 3.34Å; L132-M134 PolarHBondContact O-N 3.31Å; M134-A137 PolarHBondContact O-N 3.43Å; M134-R138 PolarHBondContact O-N 2.84Å
135	V	92.4	Very high	91.1	Very high	4 Å²	4	28.7 Å²	28.7	2%	0.024	16%	0.155	C	C	.	.	H	α-helix	trans	-65.2	-44.9	172.6	172.4	0	0	0	0	110.5	L119 F123 R131 L132 N133 A137 R138 F139 L187 G188 F192	L119-V135 HydrophobicContact CD1-CG2 4.21Å; L119-V135 HydrophobicContact CD2-CG2 4.13Å; F123-V135 HydrophobicContact CE1-CG2 4.32Å; F123-V135 HydrophobicContact CZ-CG2 3.82Å; R131-V135 PolarHBondContact O-N 2.74Å; L132-V135 WeakPolarHBondContact O-CB 3.47Å; L132-V135 PolarHBondContact O-N 3.12Å; N133-V135 VanDerWaalsContact C-N 3.33Å; V135-A137 VanDerWaalsContact C-N 3.33Å; V135-A137 PolarHBondContact O-N 3.48Å; V135-R138 WeakPolarHBondContact O-CB 3.5Å; V135-R138 PolarHBondContact O-N 3.19Å; V135-F139 PolarHBondContact O-N 2.89Å; V135-L187 WeakPolarHBondContact CG1-O 3.39Å; V135-G188 VanDerWaalsContact CG1-O 3.28Å; V135-G188 WeakPolarHBondContact CG1-O 3.33Å; V135-F192 HydrophobicContact CG2-CB 4.27Å
136	N	94.7	Very high	92	Very high	5 Å²	5	25 Å²	25	3%	0.027	11%	0.114	C	C	.	.	H	α-helix	trans	-61.2	-39.8	175	-65.3	-23.5	0	0	0	112.3	L132 N133 F139 G140 F189	L132-N136 VanDerWaalsContact O-CG 3.3Å; L132-N136 PolarHBondContact O-N 3.21Å; L132-N136 PolarHBondContact O-ND2 3.3Å; N133-N136 PolarHBondContact O-N 3.19Å; N133-N136 PolarHBondContact OD1-ND2 2.85Å; N136-F139 PolarHBondContact O-N 3.01Å; N136-G140 PolarHBondContact O-N 2.7Å; N136-F189 WeakPolarHBondContact OD1-CE1 3.16Å
137	A	94.4	Very high	92.5	Very high	3 Å²	3	23.1 Å²	23.1	3%	0.025	11%	0.106	C	C	.	.	H	α-helix	trans	-64.1	-43.2	177.2	0	0	0	0	0	110.7	N133 M134 V135 G140 F141 P381 L493	N133-A137 WeakPolarHBondContact O-CB 3.48Å; N133-A137 PolarHBondContact O-N 2.89Å; M134-A137 PolarHBondContact O-N 3.43Å; V135-A137 VanDerWaalsContact C-N 3.33Å; V135-A137 PolarHBondContact O-N 3.48Å; A137-G140 CarbonylContact O-C 3.56Å; A137-G140 WeakPolarHBondContact O-CA 3.06Å; A137-G140 PolarHBondContact O-N 2.88Å; A137-G140 VanDerWaalsContact O-N 3.12Å; A137-F141 HydrophobicContact CB-CE2 4.07Å; A137-F141 WeakPolarHBondContact O-CD2 3.5Å; A137-F141 WeakPolarHBondContact O-CG 3.19Å; A137-F141 PolarHBondContact O-N 3.41Å; A137-P381 HydrophobicContact CB-CG 4.31Å; A137-L493 HydrophobicContact CB-CB 4.07Å; A137-L493 HydrophobicContact CB-CD2 4.23Å
138	R	93.7	Very high	92.9	Very high	27 Å²	27	21.5 Å²	21.5	10%	0.102	9%	0.091	C	C	.	.	H	α-helix	trans	-58.7	-48.7	174.3	-169.4	179.4	-179.5	-163.5	-1.9	111.8	E108 M134 V135 G140 F141 N142 E191 P381	E108-R138 IonicContact OE1-CZ 3.88Å; E108-R138 VanDerWaalsContact OE1-CZ 3.26Å; E108-R138 IonicContact OE1-NE 2.82Å; E108-R138 PolarHBondContact OE1-NE 3.32Å; E108-R138 IonicContact OE1-NH2 3.66Å; E108-R138 PolarHBondContact OE1-NH2 3.43Å; M134-R138 PolarHBondContact O-N 2.84Å; V135-R138 WeakPolarHBondContact O-CB 3.5Å; V135-R138 PolarHBondContact O-N 3.19Å; R138-G140 VanDerWaalsContact C-N 3.28Å; R138-G140 PolarHBondContact O-N 3.04Å; R138-F141 PolarHBondContact O-N 3.08Å; R138-N142 PolarHBondContact O-N 3.31Å; R138-N142 PolarHBondContact O-OD1 3.24Å; R138-N142 VanDerWaalsContact O-OD1 3.09Å; R138-E191 IonicContact NH1-OE1 3.84Å; R138-E191 IonicContact NH1-OE2 3.13Å; R138-E191 PolarHBondContact NH1-OE2 2.96Å; R138-P381 HydrophobicContact CB-CG 3.95Å
139	F	95.4	Very high	93.1	Very high	3 Å²	3	20.4 Å²	20.4	1%	0.013	10%	0.095	C	C	.	.	H	α-helix	trans	-56.1	-44.6	172.7	165.3	-100.9	0	0	0	111.5	V135 N136 F141 N142 L143 I164 S165 L187 L415 M418	V135-F139 PolarHBondContact O-N 2.89Å; N136-F139 PolarHBondContact O-N 3.01Å; F139-F141 PolarHBondContact O-N 3.3Å; F139-N142 PolarHBondContact O-N 3.06Å; F139-L143 HydrophobicContact CE1-CD2 4.09Å; F139-L143 HydrophobicContact CZ-CB 4.46Å; F139-L143 HydrophobicContact CZ-CD2 3.85Å; F139-L143 WeakPolarHBondContact O-CB 3.37Å; F139-L143 PolarHBondContact O-N 3.26Å; F139-I164 HydrophobicContact CE1-CB 4.36Å; F139-I164 HydrophobicContact CE1-CG2 3.86Å; F139-I164 HydrophobicContact CZ-CG2 3.95Å; F139-S165 WeakPolarHBondContact CD1-OG 3.08Å; F139-L187 HydrophobicContact CD2-CB 4.44Å; F139-L187 HydrophobicContact CD2-CG 3.97Å; F139-L187 HydrophobicContact CE1-CD2 4.47Å; F139-L187 HydrophobicContact CE2-CD1 4.38Å; F139-L187 HydrophobicContact CE2-CG 3.92Å; F139-L187 HydrophobicContact CG-CG 4.3Å; F139-L187 HydrophobicContact CZ-CD2 4.47Å; F139-L187 HydrophobicContact CZ-CG 4.18Å; F139-L415 HydrophobicContact CE2-CD2 3.97Å; F139-L415 HydrophobicContact CZ-CD2 3.99Å; F139-M418 HydrophobicContact CD2-CE 3.48Å; F139-M418 VanDerWaalsContact CD2-CE 3.48Å; F139-M418 HydrophobicContact CE2-CE 3.59Å; F139-M418 HydrophobicContact CE2-SD 4.06Å
140	G	96.2	Very high	93.2	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-58.7	-43.7	177.5	0	0	0	0	0	113.9	N136 A137 R138 L143 Y144	N136-G140 PolarHBondContact O-N 2.7Å; A137-G140 CarbonylContact O-C 3.56Å; A137-G140 WeakPolarHBondContact O-CA 3.06Å; A137-G140 PolarHBondContact O-N 2.88Å; A137-G140 VanDerWaalsContact O-N 3.12Å; R138-G140 VanDerWaalsContact C-N 3.28Å; R138-G140 PolarHBondContact O-N 3.04Å; G140-L143 PolarHBondContact O-N 2.97Å; G140-Y144 VanDerWaalsContact O-CB 3.24Å; G140-Y144 WeakPolarHBondContact O-CB 3.1Å; G140-Y144 PolarHBondContact O-N 3.33Å
141	F	95.8	Very high	93.3	Very high	1 Å²	1	23.7 Å²	23.7	0%	0.004	12%	0.116	C	C	.	.	H	α-helix	trans	-67.2	-37.4	175.5	-63	-54.1	0	0	0	112.3	A137 R138 F139 R145 I379 P381 V384 L484 L493 I496	A137-F141 HydrophobicContact CB-CE2 4.07Å; A137-F141 WeakPolarHBondContact O-CD2 3.5Å; A137-F141 WeakPolarHBondContact O-CG 3.19Å; A137-F141 PolarHBondContact O-N 3.41Å; R138-F141 PolarHBondContact O-N 3.08Å; F139-F141 PolarHBondContact O-N 3.3Å; F141-R145 VanDerWaalsContact O-CG 3.31Å; F141-R145 WeakPolarHBondContact O-CG 3.18Å; F141-R145 PolarHBondContact O-N 3Å; F141-R145 PolarHBondContact O-NE 2.93Å; F141-I379 HydrophobicContact CD1-CB 4.38Å; F141-I379 HydrophobicContact CD1-CG1 3.79Å; F141-I379 HydrophobicContact CD1-CG2 3.79Å; F141-I379 HydrophobicContact CE1-CD1 4.46Å; F141-I379 HydrophobicContact CE1-CG1 3.5Å; F141-I379 HydrophobicContact CE1-CG2 4.37Å; F141-I379 HydrophobicContact CG-CG2 4.4Å; F141-I379 HydrophobicContact CZ-CG1 4.14Å; F141-P381 HydrophobicContact CD2-CG 3.96Å; F141-P381 HydrophobicContact CE2-CB 4.45Å; F141-P381 HydrophobicContact CE2-CG 3.84Å; F141-V384 HydrophobicContact CZ-CG2 3.93Å; F141-L484 HydrophobicContact CE1-CD2 3.59Å; F141-L484 HydrophobicContact CZ-CD2 3.82Å; F141-L493 HydrophobicContact CE1-CD2 4.02Å; F141-L493 HydrophobicContact CE2-CD2 4.49Å; F141-L493 HydrophobicContact CZ-CD2 3.99Å; F141-I496 HydrophobicContact CD1-CD1 3.65Å; F141-I496 HydrophobicContact CE1-CD1 3.68Å
142	N	94.9	Very high	93.3	Very high	41 Å²	41	26 Å²	26	22%	0.219	13%	0.133	C	C	.	.	H	α-helix	trans	-66.3	-44.8	176.6	-63.5	4.4	0	0	0	111.1	R138 F139 R145 S146 M418	R138-N142 PolarHBondContact O-N 3.31Å; R138-N142 PolarHBondContact O-OD1 3.24Å; R138-N142 VanDerWaalsContact O-OD1 3.09Å; F139-N142 PolarHBondContact O-N 3.06Å; N142-R145 PolarHBondContact O-N 3.3Å; N142-R145 PolarHBondContact OD1-NH2 3.19Å; N142-S146 PolarHBondContact O-N 3.03Å; N142-S146 VanDerWaalsContact O-N 3.09Å; N142-M418 HydrophobicContact CB-CE 3.67Å
143	L	95.8	Very high	93	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-66	-41.4	177.2	-178.4	58.8	0	0	0	111.5	F139 G140 R145 S146 I147 L159 I164 L411 N414 L415 M418	F139-L143 HydrophobicContact CE1-CD2 4.09Å; F139-L143 HydrophobicContact CZ-CB 4.46Å; F139-L143 HydrophobicContact CZ-CD2 3.85Å; F139-L143 WeakPolarHBondContact O-CB 3.37Å; F139-L143 PolarHBondContact O-N 3.26Å; G140-L143 PolarHBondContact O-N 2.97Å; L143-R145 VanDerWaalsContact C-N 3.29Å; L143-R145 PolarHBondContact O-N 2.97Å; L143-S146 PolarHBondContact O-N 2.79Å; L143-I147 HydrophobicContact CD1-CD1 4.27Å; L143-I147 HydrophobicContact CD1-CG1 4.37Å; L143-I147 HydrophobicContact CG-CD1 4.02Å; L143-I147 WeakPolarHBondContact O-CG1 3.4Å; L143-I147 PolarHBondContact O-N 3.01Å; L143-L159 HydrophobicContact CB-CD2 4.2Å; L143-L159 HydrophobicContact CD2-CD1 4.13Å; L143-L159 HydrophobicContact CD2-CD2 4.1Å; L143-L159 HydrophobicContact CG-CD2 4Å; L143-I164 HydrophobicContact CD2-CD1 3.72Å; L143-I164 HydrophobicContact CD2-CG2 4.21Å; L143-L411 HydrophobicContact CD1-CD2 4.5Å; L143-L411 HydrophobicContact CD2-CD1 4.36Å; L143-N414 HydrophobicContact CD1-CB 3.74Å; L143-L415 HydrophobicContact CD1-CD2 4.41Å; L143-M418 HydrophobicContact CB-SD 4.02Å; L143-M418 HydrophobicContact CD1-SD 3.96Å
144	Y	96.3	Very high	92.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-55.7	-45	173	177.2	-89.4	0	0	0	111.4	G140 S146 I147 R148 I157 E376 L482 I496 R498	G140-Y144 VanDerWaalsContact O-CB 3.24Å; G140-Y144 WeakPolarHBondContact O-CB 3.1Å; G140-Y144 PolarHBondContact O-N 3.33Å; Y144-S146 PolarHBondContact O-N 3.03Å; Y144-I147 PolarHBondContact O-N 3.07Å; Y144-R148 HydrophobicContact CE1-CB 4.42Å; Y144-R148 WeakPolarHBondContact O-CB 3.25Å; Y144-R148 PolarHBondContact O-N 3.24Å; Y144-I157 HydrophobicContact CD2-CG2 3.96Å; Y144-I157 HydrophobicContact CE2-CB 4.08Å; Y144-I157 HydrophobicContact CE2-CD1 4.28Å; Y144-I157 HydrophobicContact CE2-CG2 3.58Å; Y144-E376 HydrophobicContact CE1-CB 4.09Å; Y144-E376 HydrophobicContact CE1-CG 3.88Å; Y144-E376 PolarHBondContact OH-OE1 3.5Å; Y144-L482 HydrophobicContact CE1-CD1 4.29Å; Y144-L482 HydrophobicContact CE2-CD1 4.21Å; Y144-L482 WeakPolarHBondContact OH-CD1 3.41Å; Y144-I496 HydrophobicContact CD1-CD1 4.38Å; Y144-I496 HydrophobicContact CD2-CD1 3.99Å; Y144-I496 HydrophobicContact CD2-CG1 4.06Å; Y144-I496 HydrophobicContact CD2-CG2 4Å; Y144-I496 HydrophobicContact CE2-CD1 4.43Å; Y144-I496 HydrophobicContact CE2-CG1 4.27Å; Y144-I496 HydrophobicContact CG-CD1 3.96Å; Y144-R498 WeakPolarHBondContact OH-CB 3.45Å
145	R	94.8	Very high	92.8	Very high	68 Å²	68	37.5 Å²	37.5	26%	0.257	19%	0.193	S	C	.	.	H	α-helix	trans	-63.7	-38	177.7	-74.3	-177.2	-70.4	162.2	-4.1	113	E108 F141 N142 L143 N149 E376	E108-R145 IonicContact OE2-CZ 3.22Å; E108-R145 IonicContact OE2-NH1 2.84Å; E108-R145 IonicContact OE2-NH2 2.71Å; E108-R145 PolarHBondContact OE2-NH2 2.99Å; F141-R145 VanDerWaalsContact O-CG 3.31Å; F141-R145 WeakPolarHBondContact O-CG 3.18Å; F141-R145 PolarHBondContact O-N 3Å; F141-R145 PolarHBondContact O-NE 2.93Å; N142-R145 PolarHBondContact O-N 3.3Å; N142-R145 PolarHBondContact OD1-NH2 3.19Å; L143-R145 VanDerWaalsContact C-N 3.29Å; L143-R145 PolarHBondContact O-N 2.97Å; R145-N149 VanDerWaalsContact O-CG 3.24Å; R145-N149 PolarHBondContact O-N 3.13Å; R145-N149 PolarHBondContact O-ND2 3.45Å; R145-N149 PolarHBondContact O-OD1 2.81Å; R145-E376 WeakPolarHBondContact CG-O 3.46Å
146	S	94.5	Very high	93	Very high	9 Å²	9	37.6 Å²	37.6	6%	0.063	19%	0.193	C	C	.	.	H	α-helix	trans	-65.7	-51	174.5	174.9	0	0	0	0	110.7	N142 L143 Y144 R148 N149 D150 N414 E417	N142-S146 PolarHBondContact O-N 3.03Å; N142-S146 VanDerWaalsContact O-N 3.09Å; L143-S146 PolarHBondContact O-N 2.79Å; Y144-S146 PolarHBondContact O-N 3.03Å; S146-R148 VanDerWaalsContact C-N 3.29Å; S146-R148 PolarHBondContact O-N 3.11Å; S146-N149 WeakPolarHBondContact O-CB 3.06Å; S146-N149 PolarHBondContact O-N 3.03Å; S146-D150 PolarHBondContact O-N 3.4Å; S146-N414 WeakPolarHBondContact OG-CA 3.43Å; S146-N414 WeakPolarHBondContact OG-CB 3.5Å; S146-N414 PolarHBondContact OG-ND2 3.23Å; S146-E417 PolarHBondContact OG-OE2 3.48Å
147	I	93.9	Very high	93.1	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-58.4	-42.3	178.1	-66.4	168.8	0	0	0	111.7	L143 Y144 N149 D150 V151 I157 L159 Y409 L411	L143-I147 HydrophobicContact CD1-CD1 4.27Å; L143-I147 HydrophobicContact CD1-CG1 4.37Å; L143-I147 HydrophobicContact CG-CD1 4.02Å; L143-I147 WeakPolarHBondContact O-CG1 3.4Å; L143-I147 PolarHBondContact O-N 3.01Å; Y144-I147 PolarHBondContact O-N 3.07Å; I147-N149 PolarHBondContact O-N 2.92Å; I147-D150 PolarHBondContact O-N 3.4Å; I147-V151 HydrophobicContact CG2-CG1 4.36Å; I147-V151 WeakPolarHBondContact O-CG2 3.27Å; I147-V151 PolarHBondContact O-N 3.48Å; I147-I157 HydrophobicContact CG2-CG2 4.44Å; I147-L159 HydrophobicContact CD1-CD1 3.62Å; I147-L159 HydrophobicContact CD1-CD2 4.21Å; I147-L159 HydrophobicContact CD1-CG 4.44Å; I147-Y409 HydrophobicContact CG2-CD1 3.99Å; I147-Y409 HydrophobicContact CG2-CE1 3.63Å; I147-L411 HydrophobicContact CD1-CD2 3.77Å; I147-L411 HydrophobicContact CG1-CD2 4.33Å
148	R	93.5	Very high	93.2	Very high	20 Å²	20	37.2 Å²	37.2	8%	0.075	19%	0.191	C	C	.	.	H	α-helix	trans	-58.4	-30.3	178	179.1	-132.6	-179.8	-124.5	-14	112.7	Y144 S146 D150 I157 R373 E376	Y144-R148 HydrophobicContact CE1-CB 4.42Å; Y144-R148 WeakPolarHBondContact O-CB 3.25Å; Y144-R148 PolarHBondContact O-N 3.24Å; S146-R148 VanDerWaalsContact C-N 3.29Å; S146-R148 PolarHBondContact O-N 3.11Å; R148-D150 VanDerWaalsContact C-N 3.33Å; R148-I157 HydrophobicContact CB-CD1 4.09Å; R148-I157 HydrophobicContact CG-CD1 4.35Å; R148-R373 VanDerWaalsContact NH2-CA 3.35Å; R148-R373 VanDerWaalsContact NH2-CB 3.33Å; R148-E376 IonicContact CZ-OE2 2.74Å; R148-E376 IonicContact NE-OE1 3.82Å; R148-E376 IonicContact NE-OE2 2.8Å; R148-E376 PolarHBondContact NE-OE2 3.49Å; R148-E376 IonicContact NH2-OE2 3.52Å; R148-E376 PolarHBondContact NH2-OE2 2.7Å; R148-E376 VanDerWaalsContact NH2-OE2 3.14Å
149	N	90.8	Very high	93.3	Very high	111 Å²	111	35.9 Å²	35.9	59%	0.594	19%	0.186	S	C	*	.	H	α-helix	trans	-78	-21	177.5	-64.3	-24.2	0	0	0	112.6	R145 S146 I147	R145-N149 VanDerWaalsContact O-CG 3.24Å; R145-N149 PolarHBondContact O-N 3.13Å; R145-N149 PolarHBondContact O-ND2 3.45Å; R145-N149 PolarHBondContact O-OD1 2.81Å; S146-N149 WeakPolarHBondContact O-CB 3.06Å; S146-N149 PolarHBondContact O-N 3.03Å; I147-N149 PolarHBondContact O-N 2.92Å
150	D	89.4	Confident	93.4	Very high	98 Å²	98	35.8 Å²	35.8	52%	0.524	19%	0.185	S	C	.	.	H	α-helix	trans	-90.6	-19.8	-179.6	-64.1	-17.9	0	0	0	113.4	S146 I147 R148 N414	S146-D150 PolarHBondContact O-N 3.4Å; I147-D150 PolarHBondContact O-N 3.4Å; R148-D150 VanDerWaalsContact C-N 3.33Å; D150-N414 PolarHBondContact OD2-ND2 2.94Å
151	V	89.6	Confident	93.3	Very high	36 Å²	36	35.8 Å²	35.8	22%	0.218	19%	0.185	C	C	.	.	S	Bend	trans	-105.5	157.5	-179	-57.5	0	0	0	0	111.8	I147 I157	I147-V151 HydrophobicContact CG2-CG1 4.36Å; I147-V151 WeakPolarHBondContact O-CG2 3.27Å; I147-V151 PolarHBondContact O-N 3.48Å; V151-I157 HydrophobicContact CG2-CD1 3.6Å; V151-I157 HydrophobicContact CG2-CG1 3.92Å
152	N	88.3	Confident	93.3	Very high	107 Å²	107	35.8 Å²	35.8	57%	0.572	19%	0.186	S	C	*	.			trans	-69	154.7	177.9	-55	-66.5	0	0	0	110.6	T154 D155 R498	N152-T154 PolarHBondContact O-N 2.86Å; N152-D155 VanDerWaalsContact CB-OD2 3.29Å; N152-D155 WeakPolarHBondContact CB-OD2 3.35Å; N152-D155 PolarHBondContact N-OD2 2.98Å; N152-D155 VanDerWaalsContact N-OD2 3.11Å; N152-D155 PolarHBondContact ND2-OD2 2.94Å; N152-D155 PolarHBondContact O-N 2.82Å; N152-D155 VanDerWaalsContact O-N 3.12Å; N152-R498 PolarHBondContact O-NH2 3.34Å
153	Q	84.9	Confident	93.3	Very high	124 Å²	124	33.8 Å²	33.8	58%	0.579	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-19.6	174.9	-67.3	-176	0.9	0	0	112.8	D155 V500	Q153-D155 VanDerWaalsContact C-N 3.34Å; Q153-V500 WeakPolarHBondContact O-CG2 3.18Å
154	T	86.8	Confident	93.3	Very high	77 Å²	77	34 Å²	34	47%	0.472	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-14.7	177.1	52.1	0	0	0	0	113.6	N152 V500	N152-T154 PolarHBondContact O-N 2.86Å; T154-V500 WeakPolarHBondContact O-CB 3.25Å; T154-V500 WeakPolarHBondContact O-CG1 3.44Å
155	D	92.8	Very high	93.3	Very high	52 Å²	52	34 Å²	34	28%	0.278	18%	0.176	S	C	.	.	S	Bend	trans	-87.8	145.4	-170.5	-59.9	-22.5	0	0	0	111	N152 Q153 R498 V500	N152-D155 VanDerWaalsContact CB-OD2 3.29Å; N152-D155 WeakPolarHBondContact CB-OD2 3.35Å; N152-D155 PolarHBondContact N-OD2 2.98Å; N152-D155 VanDerWaalsContact N-OD2 3.11Å; N152-D155 PolarHBondContact ND2-OD2 2.94Å; N152-D155 PolarHBondContact O-N 2.82Å; N152-D155 VanDerWaalsContact O-N 3.12Å; Q153-D155 VanDerWaalsContact C-N 3.34Å; D155-R498 PolarHBondContact O-NE 2.87Å; D155-R498 PolarHBondContact O-NH2 3.39Å; D155-V500 WeakPolarHBondContact O-CG2 3.25Å
156	N	95.8	Very high	93.3	Very high	5 Å²	5	30.8 Å²	30.8	3%	0.027	16%	0.164	C	C	.	.			trans	-70.9	148.7	169.7	-65.9	-31	0	0	0	110.2	L405 R498 V499 V500 N501 Q504	N156-L405 HydrophobicContact CB-CD1 4.42Å; N156-L405 HydrophobicContact CB-CD2 3.75Å; N156-L405 VanDerWaalsContact ND2-CD2 3.33Å; N156-L405 WeakPolarHBondContact ND2-CD2 3.48Å; N156-R498 WeakPolarHBondContact CA-O 3.34Å; N156-V499 WeakPolarHBondContact OD1-CA 3.48Å; N156-V500 PolarHBondContact OD1-N 2.71Å; N156-N501 PolarHBondContact ND2-O 2.99Å; N156-N501 PolarHBondContact OD1-N 3.24Å; N156-Q504 PolarHBondContact ND2-O 3.23Å
157	I	96.8	Very high	93.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	137.9	176.5	-58.5	177.7	0	0	0	108.7	Y144 I147 R148 V151 Y409 G497 R498	Y144-I157 HydrophobicContact CD2-CG2 3.96Å; Y144-I157 HydrophobicContact CE2-CB 4.08Å; Y144-I157 HydrophobicContact CE2-CD1 4.28Å; Y144-I157 HydrophobicContact CE2-CG2 3.58Å; I147-I157 HydrophobicContact CG2-CG2 4.44Å; R148-I157 HydrophobicContact CB-CD1 4.09Å; R148-I157 HydrophobicContact CG-CD1 4.35Å; V151-I157 HydrophobicContact CG2-CD1 3.6Å; V151-I157 HydrophobicContact CG2-CG1 3.92Å; I157-Y409 WeakPolarHBondContact CA-OH 3.39Å; I157-G497 CarbonylContact O-C 3.57Å; I157-G497 WeakPolarHBondContact O-CA 3.36Å; I157-R498 HydrophobicContact CB-CB 4.31Å; I157-R498 PolarHBondContact N-O 2.63Å; I157-R498 PolarHBondContact O-N 3.27Å
158	L	96.8	Very high	93.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	111.2	171.9	176.9	74.1	0	0	0	110.7	L405 Q407 Y409 G447 I449 F483 F495	L158-L405 HydrophobicContact CB-CB 4.32Å; L158-L405 HydrophobicContact CB-CD1 4.26Å; L158-L405 HydrophobicContact CD2-CB 4.14Å; L158-Q407 HydrophobicContact CB-CB 4.03Å; L158-Q407 HydrophobicContact CB-CG 3.81Å; L158-Y409 PolarHBondContact N-OH 3.45Å; L158-Y409 VanDerWaalsContact O-CE2 3.29Å; L158-Y409 WeakPolarHBondContact O-CE2 3.41Å; L158-G447 WeakPolarHBondContact CD2-O 3.22Å; L158-I449 HydrophobicContact CD1-CB 4.33Å; L158-I449 HydrophobicContact CD1-CG2 3.97Å; L158-I449 HydrophobicContact CD2-CB 4.14Å; L158-I449 HydrophobicContact CD2-CG2 3.85Å; L158-F483 HydrophobicContact CD1-CE2 4.11Å; L158-F483 HydrophobicContact CD1-CZ 3.7Å; L158-F495 HydrophobicContact CD1-CB 4.38Å; L158-F495 HydrophobicContact CD1-CD1 3.72Å; L158-F495 HydrophobicContact CD1-CE1 4.46Å; L158-F495 HydrophobicContact CD1-CG 4.4Å; L158-F495 HydrophobicContact CG-CD1 4.17Å
159	L	96.2	Very high	93.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	144	178.9	-174.6	68.7	0	0	0	109.9	L143 I147 P161 I164 F495 I496	L143-L159 HydrophobicContact CB-CD2 4.2Å; L143-L159 HydrophobicContact CD2-CD1 4.13Å; L143-L159 HydrophobicContact CD2-CD2 4.1Å; L143-L159 HydrophobicContact CG-CD2 4Å; I147-L159 HydrophobicContact CD1-CD1 3.62Å; I147-L159 HydrophobicContact CD1-CD2 4.21Å; I147-L159 HydrophobicContact CD1-CG 4.44Å; L159-P161 HydrophobicContact CD2-CG 4.15Å; L159-P161 HydrophobicContact CG-CG 4.25Å; L159-P161 VanDerWaalsContact O-CD 3.31Å; L159-P161 WeakPolarHBondContact O-CD 3.27Å; L159-I164 HydrophobicContact CD1-CD1 3.3Å; L159-I164 HydrophobicContact CG-CD1 4.07Å; L159-F495 CarbonylContact O-C 3.55Å; L159-F495 VanDerWaalsContact O-CA 3.28Å; L159-F495 WeakPolarHBondContact O-CA 3.35Å; L159-I496 HydrophobicContact CB-CG2 3.83Å; L159-I496 HydrophobicContact CD2-CG2 4.18Å; L159-I496 HydrophobicContact CG-CG2 4.42Å; L159-I496 PolarHBondContact N-O 3.21Å; L159-I496 PolarHBondContact O-N 3.31Å; L159-I496 VanDerWaalsContact O-O 3.13Å
160	A	96.7	Very high	93.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.13	C	C	.	.			trans	-113.9	83.8	170	0	0	0	0	0	111.8	A162 G163 I164 L299 H445 V494 F495	A160-A162 VanDerWaalsContact C-N 3.32Å; A160-A162 PolarHBondContact O-N 3.37Å; A160-G163 PolarHBondContact O-N 2.96Å; A160-I164 PolarHBondContact O-N 3.38Å; A160-L299 HydrophobicContact CB-CB 4.28Å; A160-L299 HydrophobicContact CB-CD1 4.08Å; A160-L299 HydrophobicContact CB-CD2 3.81Å; A160-L299 HydrophobicContact CB-CG 4.27Å; A160-H445 PolarHBondContact N-NE2 3.1Å; A160-V494 VanDerWaalsContact CA-O 3.27Å; A160-V494 WeakPolarHBondContact CA-O 3.24Å; A160-V494 WeakPolarHBondContact CB-O 3.39Å; A160-F495 HydrophobicContact CB-CD1 3.61Å; A160-F495 HydrophobicContact CB-CE1 3.47Å; A160-F495 VanDerWaalsContact CB-CE1 3.47Å; A160-F495 HydrophobicContact CB-CG 4.29Å; A160-F495 HydrophobicContact CB-CZ 3.99Å
161	P	95.9	Very high	94	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-54.9	-43.2	-174.2	-29.8	37.4	0	0	0	113.8	L159 G163 I164 S165 L493 I496	L159-P161 HydrophobicContact CD2-CG 4.15Å; L159-P161 HydrophobicContact CG-CG 4.25Å; L159-P161 VanDerWaalsContact O-CD 3.31Å; L159-P161 WeakPolarHBondContact O-CD 3.27Å; P161-G163 VanDerWaalsContact C-N 3.27Å; P161-G163 PolarHBondContact O-N 3.25Å; P161-I164 PolarHBondContact O-N 2.64Å; P161-S165 PolarHBondContact O-N 3.27Å; P161-S165 PolarHBondContact O-OG 2.89Å; P161-S165 VanDerWaalsContact O-OG 3.12Å; P161-L493 HydrophobicContact CB-CD2 4.45Å; P161-L493 HydrophobicContact CG-CD2 3.92Å; P161-L493 HydrophobicContact CG-CG 4.17Å; P161-I496 HydrophobicContact CG-CG2 3.89Å
162	A	94.6	Very high	94.2	Very high	1 Å²	1	18 Å²	18	1%	0.008	10%	0.095	C	C	.	.	H	α-helix	trans	-57.6	-40.2	178.8	0	0	0	0	0	112.5	A160 I166 L493	A160-A162 VanDerWaalsContact C-N 3.32Å; A160-A162 PolarHBondContact O-N 3.37Å; A162-I166 WeakPolarHBondContact O-CB 3.16Å; A162-I166 VanDerWaalsContact O-CD1 3.28Å; A162-I166 WeakPolarHBondContact O-CD1 3.4Å; A162-I166 WeakPolarHBondContact O-CG1 3.32Å; A162-I166 PolarHBondContact O-N 2.87Å; A162-L493 WeakPolarHBondContact CB-O 3.45Å; A162-L493 PolarHBondContact N-O 3.37Å
163	G	94.6	Very high	94.5	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-63.4	-46.8	177.9	0	0	0	0	0	112.1	A160 P161 I166 A167 N297	A160-G163 PolarHBondContact O-N 2.96Å; P161-G163 VanDerWaalsContact C-N 3.27Å; P161-G163 PolarHBondContact O-N 3.25Å; G163-I166 PolarHBondContact O-N 3.38Å; G163-A167 WeakPolarHBondContact O-CB 3.47Å; G163-A167 PolarHBondContact O-N 3.19Å; G163-N297 PolarHBondContact O-ND2 3.33Å
164	I	96.1	Very high	94.9	Very high	3 Å²	3	8.1 Å²	8.1	2%	0.015	5%	0.047	C	C	.	.	H	α-helix	trans	-66.6	-44.8	-179.4	-61.2	161.4	0	0	0	110.7	F139 L143 L159 A160 P161 I166 A167 M168 L411 H445	F139-I164 HydrophobicContact CE1-CB 4.36Å; F139-I164 HydrophobicContact CE1-CG2 3.86Å; F139-I164 HydrophobicContact CZ-CG2 3.95Å; L143-I164 HydrophobicContact CD2-CD1 3.72Å; L143-I164 HydrophobicContact CD2-CG2 4.21Å; L159-I164 HydrophobicContact CD1-CD1 3.3Å; L159-I164 HydrophobicContact CG-CD1 4.07Å; A160-I164 PolarHBondContact O-N 3.38Å; P161-I164 PolarHBondContact O-N 2.64Å; I164-I166 VanDerWaalsContact C-N 3.31Å; I164-I166 PolarHBondContact O-N 2.97Å; I164-A167 PolarHBondContact O-N 3.4Å; I164-M168 HydrophobicContact CG2-CG 4.29Å; I164-M168 WeakPolarHBondContact O-CB 3.45Å; I164-M168 WeakPolarHBondContact O-CG 3.24Å; I164-M168 PolarHBondContact O-N 3.38Å; I164-L411 HydrophobicContact CD1-CD1 3.53Å; I164-L411 HydrophobicContact CG1-CD1 3.86Å; I164-L411 HydrophobicContact CG2-CD1 4.15Å; I164-H445 HydrophobicContact CD1-CB 4.47Å; I164-H445 HydrophobicContact CG1-CB 4.47Å
165	S	96.4	Very high	95.2	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-61.4	-38.8	177	-58.9	0	0	0	0	112.4	F139 P161 G169	F139-S165 WeakPolarHBondContact CD1-OG 3.08Å; P161-S165 PolarHBondContact O-N 3.27Å; P161-S165 PolarHBondContact O-OG 2.89Å; P161-S165 VanDerWaalsContact O-OG 3.12Å; S165-G169 PolarHBondContact O-N 3.46Å
166	I	95.4	Very high	95.1	Very high	2 Å²	2	3 Å²	3	1%	0.01	2%	0.02	C	C	.	.	H	α-helix	trans	-65.4	-45.7	174.8	-70.1	164.7	0	0	0	110.5	A162 G163 I164 G169 M170 F208 L211 F216 Y250	A162-I166 WeakPolarHBondContact O-CB 3.16Å; A162-I166 VanDerWaalsContact O-CD1 3.28Å; A162-I166 WeakPolarHBondContact O-CD1 3.4Å; A162-I166 WeakPolarHBondContact O-CG1 3.32Å; A162-I166 PolarHBondContact O-N 2.87Å; G163-I166 PolarHBondContact O-N 3.38Å; I164-I166 VanDerWaalsContact C-N 3.31Å; I164-I166 PolarHBondContact O-N 2.97Å; I166-G169 PolarHBondContact O-N 2.94Å; I166-M170 PolarHBondContact O-N 3.42Å; I166-F208 HydrophobicContact CB-CD1 4.49Å; I166-F208 HydrophobicContact CG1-CD1 3.55Å; I166-F208 HydrophobicContact CG1-CE1 3.91Å; I166-F208 HydrophobicContact CG1-CG 4.38Å; I166-L211 HydrophobicContact CD1-CD2 4.39Å; I166-F216 HydrophobicContact CD1-CE2 3.92Å; I166-Y250 HydrophobicContact CG2-CD1 3.71Å; I166-Y250 HydrophobicContact CG2-CE1 4.02Å; I166-Y250 WeakPolarHBondContact O-CE1 3.43Å
167	A	95.2	Very high	94.8	Very high	1 Å²	1	7.5 Å²	7.5	1%	0.008	5%	0.052	C	C	.	.	H	α-helix	trans	-63.5	-44	179.9	0	0	0	0	0	112.2	G163 I164 M170 M171 L295	G163-A167 WeakPolarHBondContact O-CB 3.47Å; G163-A167 PolarHBondContact O-N 3.19Å; I164-A167 PolarHBondContact O-N 3.4Å; A167-M170 WeakPolarHBondContact O-CB 3.33Å; A167-M170 PolarHBondContact O-N 3.29Å; A167-M171 WeakPolarHBondContact O-CG 3.32Å; A167-M171 PolarHBondContact O-N 3.38Å; A167-L295 HydrophobicContact CB-CD1 4.35Å; A167-L295 HydrophobicContact CB-CD2 3.91Å; A167-L295 HydrophobicContact CB-CG 4.43Å
168	M	95.4	Very high	94.5	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.005	8%	0.075	C	C	.	.	H	α-helix	trans	-71	-35.2	176.5	-67.3	-56.1	-64.9	0	0	112.5	I164 M170 M171 S172 I183 L187 L295 L415 L420 I423 L443	I164-M168 HydrophobicContact CG2-CG 4.29Å; I164-M168 WeakPolarHBondContact O-CB 3.45Å; I164-M168 WeakPolarHBondContact O-CG 3.24Å; I164-M168 PolarHBondContact O-N 3.38Å; M168-M170 VanDerWaalsContact C-N 3.27Å; M168-M170 PolarHBondContact O-N 3.35Å; M168-M171 PolarHBondContact O-N 2.94Å; M168-S172 PolarHBondContact O-N 3.23Å; M168-I183 HydrophobicContact CE-CG1 4.43Å; M168-L187 HydrophobicContact CB-CD1 4.03Å; M168-L187 HydrophobicContact CB-CD2 3.53Å; M168-L187 HydrophobicContact CB-CG 4.45Å; M168-L187 HydrophobicContact CG-CD1 4.43Å; M168-L187 HydrophobicContact CG-CD2 4.27Å; M168-L295 HydrophobicContact SD-CD2 4.37Å; M168-L415 HydrophobicContact CE-CD1 4.21Å; M168-L415 HydrophobicContact SD-CD1 4.13Å; M168-L420 HydrophobicContact CE-CD2 3.44Å; M168-L420 VanDerWaalsContact CE-CD2 3.44Å; M168-I423 HydrophobicContact CE-CD1 3.83Å; M168-L443 HydrophobicContact SD-CD2 4.03Å
169	G	94.9	Very high	94.4	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-59.8	-38.9	170.1	0	0	0	0	0	111.9	S165 I166 S172 H205 Y250	S165-G169 PolarHBondContact O-N 3.46Å; I166-G169 PolarHBondContact O-N 2.94Å; G169-S172 PolarHBondContact O-N 3.08Å; G169-S172 PolarHBondContact O-OG 2.94Å; G169-H205 PolarHBondContact O-CE1 3.1Å; G169-Y250 VanDerWaalsContact C-CZ 3.5Å; G169-Y250 PolarHBondContact O-OH 3.46Å
170	M	95.3	Very high	94.3	Very high	2 Å²	2	14.1 Å²	14.1	1%	0.01	8%	0.083	C	C	.	.	H	α-helix	trans	-64.2	-46	173	177.6	179.7	62.8	0	0	111.7	I166 A167 M168 S172 L173 V230 T246 Y250 A252 L295	I166-M170 PolarHBondContact O-N 3.42Å; A167-M170 WeakPolarHBondContact O-CB 3.33Å; A167-M170 PolarHBondContact O-N 3.29Å; M168-M170 VanDerWaalsContact C-N 3.27Å; M168-M170 PolarHBondContact O-N 3.35Å; M170-S172 PolarHBondContact O-N 2.74Å; M170-L173 WeakPolarHBondContact O-CB 3.46Å; M170-L173 PolarHBondContact O-N 2.88Å; M170-L173 VanDerWaalsContact O-N 3.12Å; M170-V230 HydrophobicContact CE-CG2 3.27Å; M170-V230 HydrophobicContact SD-CG2 3.97Å; M170-T246 HydrophobicContact CG-CG2 3.66Å; M170-T246 HydrophobicContact SD-CG2 3.45Å; M170-T246 WeakPolarHBondContact SD-CG2 3.41Å; M170-Y250 HydrophobicContact CB-CD1 3.76Å; M170-Y250 HydrophobicContact CB-CD2 3.87Å; M170-Y250 HydrophobicContact CB-CE1 3.96Å; M170-Y250 HydrophobicContact CB-CE2 4.08Å; M170-Y250 HydrophobicContact CB-CG 3.71Å; M170-Y250 HydrophobicContact CG-CD1 4.5Å; M170-Y250 HydrophobicContact CG-CD2 4.05Å; M170-Y250 HydrophobicContact CG-CG 4Å; M170-Y250 HydrophobicContact SD-CG 4.41Å; M170-A252 HydrophobicContact SD-CB 3.52Å; M170-A252 VanDerWaalsContact SD-CB 3.52Å; M170-L295 HydrophobicContact CE-CD1 3.71Å
171	M	94.8	Very high	94.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.1	-31.5	177.2	-65.6	-49.1	-55.4	0	0	112.9	A167 M168 L173 G174 A175 V230 L293 L295 I423 F430 M433	A167-M171 WeakPolarHBondContact O-CG 3.32Å; A167-M171 PolarHBondContact O-N 3.38Å; M168-M171 PolarHBondContact O-N 2.94Å; M171-L173 PolarHBondContact O-N 2.83Å; M171-G174 PolarHBondContact O-N 3.17Å; M171-A175 PolarHBondContact O-N 3.4Å; M171-V230 HydrophobicContact SD-CG1 4.36Å; M171-V230 HydrophobicContact SD-CG2 4.21Å; M171-L293 HydrophobicContact CE-CD1 4.39Å; M171-L293 HydrophobicContact CE-CD2 3.75Å; M171-L295 HydrophobicContact CG-CD2 3.57Å; M171-L295 HydrophobicContact SD-CD1 4.29Å; M171-L295 HydrophobicContact SD-CD2 4.17Å; M171-I423 HydrophobicContact CB-CD1 4.28Å; M171-F430 HydrophobicContact CE-CE1 4.03Å; M171-M433 HydrophobicContact CE-SD 4.44Å
172	S	95.3	Very high	94.1	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.014	11%	0.111	C	C	.	.	H	α-helix	trans	-65.1	-22.3	177	75.2	0	0	0	0	114.3	M168 G169 M170 G174 A175 H180 Y184 H205	M168-S172 PolarHBondContact O-N 3.23Å; G169-S172 PolarHBondContact O-N 3.08Å; G169-S172 PolarHBondContact O-OG 2.94Å; M170-S172 PolarHBondContact O-N 2.74Å; S172-G174 PolarHBondContact O-N 2.8Å; S172-A175 PolarHBondContact O-N 3.37Å; S172-H180 PolarHBondContact O-CD2 2.92Å; S172-H180 VanDerWaalsContact O-CD2 3.29Å; S172-Y184 WeakPolarHBondContact OG-CE2 3.14Å; S172-H205 PolarHBondContact OG-CE1 3.41Å
173	L	94.5	Very high	94.1	Very high	25 Å²	25	20.2 Å²	20.2	13%	0.131	11%	0.111	C	C	.	.	H	α-helix	trans	-64.7	-29.2	171	-70.2	173.1	0	0	0	112	M170 M171 H205 F242 E245 Y249 Y250	M170-L173 WeakPolarHBondContact O-CB 3.46Å; M170-L173 PolarHBondContact O-N 2.88Å; M170-L173 VanDerWaalsContact O-N 3.12Å; M171-L173 PolarHBondContact O-N 2.83Å; L173-H205 VanDerWaalsContact CD2-CE1 3.49Å; L173-H205 WeakPolarHBondContact CD2-CE1 3.49Å; L173-H205 WeakPolarHBondContact CD2-NE2 3.36Å; L173-F242 HydrophobicContact CB-CD2 4.09Å; L173-F242 HydrophobicContact CB-CE2 4.02Å; L173-E245 HydrophobicContact CD1-CB 3.99Å; L173-Y249 HydrophobicContact CD1-CD2 4.42Å; L173-Y250 HydrophobicContact CD1-CD2 3.83Å; L173-Y250 HydrophobicContact CD1-CE2 3.57Å; L173-Y250 HydrophobicContact CG-CE2 4.24Å
174	G	92.3	Very high	94.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-90.3	-12.6	-178.9	0	0	0	0	0	113.9	M171 S172 F430 G432 M433	M171-G174 PolarHBondContact O-N 3.17Å; S172-G174 PolarHBondContact O-N 2.8Å; G174-F430 CarbonylContact O-C 3.57Å; G174-F430 VanDerWaalsContact O-CA 3.27Å; G174-F430 WeakPolarHBondContact O-CA 3.48Å; G174-G432 CarbonylContact O-C 3.49Å; G174-G432 WeakPolarHBondContact O-CA 3.21Å; G174-G432 PolarHBondContact O-N 3.25Å; G174-G432 VanDerWaalsContact O-N 3.09Å; G174-M433 PolarHBondContact O-N 2.83Å
175	A	93.6	Very high	94	Very high	10 Å²	10	27.4 Å²	27.4	8%	0.083	14%	0.142	C	C	.	.			trans	-85.9	139.8	-176.6	0	0	0	0	0	111.5	M171 S172 T179 H180 I183 D429	M171-A175 PolarHBondContact O-N 3.4Å; S172-A175 PolarHBondContact O-N 3.37Å; A175-T179 HydrophobicContact CB-CG2 4Å; A175-H180 HydrophobicContact CB-CB 4.11Å; A175-I183 HydrophobicContact CB-CD1 3.94Å; A175-D429 CarbonylContact C-O 3.44Å; A175-D429 VanDerWaalsContact CA-O 3.29Å; A175-D429 WeakPolarHBondContact CA-O 3.18Å
176	G	91.3	Very high	93.9	Very high	10 Å²	10	28.4 Å²	28.4	10%	0.103	15%	0.15	C	C	.	.			trans	-82	-172.9	168.2	0	0	0	0	0	112.2	E178 T179 H180 D429	G176-E178 PolarHBondContact O-N 3.49Å; G176-T179 PolarHBondContact O-N 3.19Å; G176-H180 WeakPolarHBondContact O-CB 3.42Å; G176-H180 PolarHBondContact O-N 3.35Å; G176-D429 VanDerWaalsContact CA-CG 3.43Å; G176-D429 VanDerWaalsContact CA-OD2 3.26Å; G176-D429 WeakPolarHBondContact CA-OD2 3.49Å; G176-D429 PolarHBondContact N-O 3.13Å
177	S	89.4	Confident	93.8	Very high	100 Å²	100	28.3 Å²	28.3	70%	0.699	15%	0.15	S	C	*	.	H	α-helix	trans	-58.1	-50.9	-156	53.6	0	0	0	0	115.2	H181	S177-H181 WeakPolarHBondContact O-CB 3.35Å; S177-H181 PolarHBondContact O-N 3.01Å
178	E	90.7	Very high	93.6	Very high	104 Å²	104	28.8 Å²	28.8	49%	0.486	15%	0.154	S	C	.	.	H	α-helix	trans	-73.4	-45.9	-175.5	-173.1	57.2	-147.4	0	0	111.7	G176 H180 H181 Q182	G176-E178 PolarHBondContact O-N 3.49Å; E178-H180 VanDerWaalsContact C-N 3.31Å; E178-H180 PolarHBondContact O-N 3.22Å; E178-H181 WeakPolarHBondContact O-CB 3.42Å; E178-H181 PolarHBondContact O-N 3.5Å; E178-H181 VanDerWaalsContact O-N 3.13Å; E178-Q182 PolarHBondContact O-N 3.18Å
179	T	93.4	Very high	93.5	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.012	15%	0.154	C	C	.	.	H	α-helix	trans	-63.2	-38.9	177.1	-55.8	0	0	0	0	111.3	A175 G176 Q182 I183 D422 I423 D429	A175-T179 HydrophobicContact CB-CG2 4Å; G176-T179 PolarHBondContact O-N 3.19Å; T179-Q182 PolarHBondContact O-N 3.11Å; T179-I183 HydrophobicContact CG2-CD1 4.36Å; T179-I183 VanDerWaalsContact O-CG1 3.29Å; T179-I183 WeakPolarHBondContact O-CG1 3.46Å; T179-I183 PolarHBondContact O-N 3.23Å; T179-I183 VanDerWaalsContact O-N 3.11Å; T179-D422 HydrophobicContact CG2-CB 4.21Å; T179-D422 WeakPolarHBondContact OG1-CB 3.22Å; T179-I423 HydrophobicContact CG2-CB 3.97Å; T179-I423 HydrophobicContact CG2-CG1 4.41Å; T179-D429 PolarHBondContact OG1-N 3.21Å
180	H	94.9	Very high	93.2	Very high	33 Å²	33	29.8 Å²	29.8	15%	0.153	16%	0.163	C	C	.	.	H	α-helix	trans	-59.8	-46.1	172.2	179.2	-72	0	0	0	111.4	S172 A175 G176 E178 Q182 I183 Y184 N201	S172-H180 PolarHBondContact O-CD2 2.92Å; S172-H180 VanDerWaalsContact O-CD2 3.29Å; A175-H180 HydrophobicContact CB-CB 4.11Å; G176-H180 WeakPolarHBondContact O-CB 3.42Å; G176-H180 PolarHBondContact O-N 3.35Å; E178-H180 VanDerWaalsContact C-N 3.31Å; E178-H180 PolarHBondContact O-N 3.22Å; H180-Q182 PolarHBondContact O-N 2.75Å; H180-I183 PolarHBondContact O-N 3Å; H180-Y184 AromaticContact CD2-CE2 3.95Å; H180-Y184 AromaticContact CE1-CD1 3.88Å; H180-Y184 AromaticContact CE1-CD2 3.23Å; H180-Y184 WeakPolarHBondContact CE1-CD2 3.31Å; H180-Y184 AromaticContact CE1-CE1 3.78Å; H180-Y184 AromaticContact CE1-CE2 3.13Å; H180-Y184 WeakPolarHBondContact CE1-CE2 3.29Å; H180-Y184 AromaticContact CE1-CG 3.62Å; H180-Y184 AromaticContact CE1-CZ 3.41Å; H180-Y184 VanDerWaalsContact CE1-CZ 3.41Å; H180-Y184 AromaticContact ND1-CD2 3.65Å; H180-Y184 AromaticContact ND1-CE2 3.96Å; H180-Y184 AromaticContact NE2-CD2 3.65Å; H180-Y184 AromaticContact NE2-CE2 3.12Å; H180-Y184 WeakPolarHBondContact NE2-CE2 3.44Å; H180-Y184 AromaticContact NE2-CZ 3.48Å; H180-Y184 PolarHBondContact O-N 3.12Å; H180-N201 PolarHBondContact CE1-ND2 3.21Å; H180-N201 VanDerWaalsContact CE1-ND2 3.28Å
181	H	93.9	Very high	92.8	Very high	95 Å²	95	31.8 Å²	31.8	44%	0.44	17%	0.172	S	C	.	.	H	α-helix	trans	-60.2	-44.1	178.3	-174.4	71.8	0	0	0	112.2	S177 E178 I183 Y184 K185	S177-H181 WeakPolarHBondContact O-CB 3.35Å; S177-H181 PolarHBondContact O-N 3.01Å; E178-H181 WeakPolarHBondContact O-CB 3.42Å; E178-H181 PolarHBondContact O-N 3.5Å; E178-H181 VanDerWaalsContact O-N 3.13Å; H181-I183 PolarHBondContact O-N 3.37Å; H181-Y184 PolarHBondContact O-N 2.88Å; H181-K185 VanDerWaalsContact O-CB 3.26Å; H181-K185 WeakPolarHBondContact O-CB 3.26Å; H181-K185 PolarHBondContact O-N 3.19Å
182	Q	94.3	Very high	92.5	Very high	33 Å²	33	31.8 Å²	31.8	15%	0.154	17%	0.172	C	C	.	.	H	α-helix	trans	-59.3	-46.4	175.3	-71.8	-172.7	10.3	0	0	111.9	E178 T179 H180 Y184 K185 A186 D422	E178-Q182 PolarHBondContact O-N 3.18Å; T179-Q182 PolarHBondContact O-N 3.11Å; H180-Q182 PolarHBondContact O-N 2.75Å; Q182-Y184 PolarHBondContact O-N 3.41Å; Q182-K185 PolarHBondContact O-N 3.29Å; Q182-A186 WeakPolarHBondContact O-CB 3.05Å; Q182-A186 PolarHBondContact O-N 3.3Å; Q182-D422 VanDerWaalsContact CD-CG 3.46Å; Q182-D422 PolarHBondContact NE2-OD1 2.97Å; Q182-D422 PolarHBondContact NE2-OD2 3.28Å; Q182-D422 PolarHBondContact OE1-OD1 3.35Å
183	I	95.1	Very high	92.2	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-59.3	-49.3	177.1	-63.3	164.3	0	0	0	110.2	M168 A175 T179 H180 H181 K185 A186 L187 L420 I423	M168-I183 HydrophobicContact CE-CG1 4.43Å; A175-I183 HydrophobicContact CB-CD1 3.94Å; T179-I183 HydrophobicContact CG2-CD1 4.36Å; T179-I183 VanDerWaalsContact O-CG1 3.29Å; T179-I183 WeakPolarHBondContact O-CG1 3.46Å; T179-I183 PolarHBondContact O-N 3.23Å; T179-I183 VanDerWaalsContact O-N 3.11Å; H180-I183 PolarHBondContact O-N 3Å; H181-I183 PolarHBondContact O-N 3.37Å; I183-K185 VanDerWaalsContact C-N 3.33Å; I183-K185 PolarHBondContact O-N 3.27Å; I183-A186 PolarHBondContact O-N 2.83Å; I183-L187 HydrophobicContact CG2-CD1 3.9Å; I183-L187 WeakPolarHBondContact O-CB 3.19Å; I183-L187 WeakPolarHBondContact O-CD1 3.4Å; I183-L187 PolarHBondContact O-N 2.92Å; I183-L420 HydrophobicContact CB-CD2 4.49Å; I183-L420 HydrophobicContact CG1-CD2 4.03Å; I183-I423 HydrophobicContact CD1-CD1 3.96Å; I183-I423 HydrophobicContact CG1-CD1 4.39Å
184	Y	94.8	Very high	91.8	Very high	6 Å²	6	36.1 Å²	36.1	2%	0.024	20%	0.196	C	C	.	.	H	α-helix	trans	-66	-34.7	-178.2	-93.3	-122.6	0	0	0	113	S172 H180 H181 Q182 G188 F189 A190 V193 N201 V204 H205	S172-Y184 WeakPolarHBondContact OG-CE2 3.14Å; H180-Y184 AromaticContact CD2-CE2 3.95Å; H180-Y184 AromaticContact CE1-CD1 3.88Å; H180-Y184 AromaticContact CE1-CD2 3.23Å; H180-Y184 WeakPolarHBondContact CE1-CD2 3.31Å; H180-Y184 AromaticContact CE1-CE1 3.78Å; H180-Y184 AromaticContact CE1-CE2 3.13Å; H180-Y184 WeakPolarHBondContact CE1-CE2 3.29Å; H180-Y184 AromaticContact CE1-CG 3.62Å; H180-Y184 AromaticContact CE1-CZ 3.41Å; H180-Y184 VanDerWaalsContact CE1-CZ 3.41Å; H180-Y184 AromaticContact ND1-CD2 3.65Å; H180-Y184 AromaticContact ND1-CE2 3.96Å; H180-Y184 AromaticContact NE2-CD2 3.65Å; H180-Y184 AromaticContact NE2-CE2 3.12Å; H180-Y184 WeakPolarHBondContact NE2-CE2 3.44Å; H180-Y184 AromaticContact NE2-CZ 3.48Å; H180-Y184 PolarHBondContact O-N 3.12Å; H181-Y184 PolarHBondContact O-N 2.88Å; Q182-Y184 PolarHBondContact O-N 3.41Å; Y184-G188 CarbonylContact O-C 3.54Å; Y184-G188 PolarHBondContact O-N 2.96Å; Y184-F189 HydrophobicContact CD1-CB 3.48Å; Y184-F189 VanDerWaalsContact CD1-CB 3.48Å; Y184-F189 HydrophobicContact CD2-CB 4.42Å; Y184-F189 HydrophobicContact CD2-CD2 4.1Å; Y184-F189 HydrophobicContact CE1-CB 3.88Å; Y184-F189 HydrophobicContact CE2-CD2 4.17Å; Y184-F189 HydrophobicContact CG-CB 3.79Å; Y184-F189 HydrophobicContact CG-CD2 4.29Å; Y184-F189 PolarHBondContact O-N 2.96Å; Y184-A190 PolarHBondContact O-N 2.75Å; Y184-V193 HydrophobicContact CE1-CG2 4.3Å; Y184-N201 HydrophobicContact CE1-CB 4.22Å; Y184-N201 WeakPolarHBondContact CE1-OD1 3.48Å; Y184-N201 PolarHBondContact OH-O 3.22Å; Y184-V204 HydrophobicContact CE1-CG2 4.27Å; Y184-H205 PolarHBondContact OH-NE2 3.16Å
185	K	93.4	Very high	91.3	Very high	149 Å²	149	37.3 Å²	37.3	65%	0.648	21%	0.206	S	C	*	.	H	α-helix	trans	-69.5	-49	177.1	-176.5	179.6	178.2	-175.8	0	111	H181 Q182 I183 G188	H181-K185 VanDerWaalsContact O-CB 3.26Å; H181-K185 WeakPolarHBondContact O-CB 3.26Å; H181-K185 PolarHBondContact O-N 3.19Å; Q182-K185 PolarHBondContact O-N 3.29Å; I183-K185 VanDerWaalsContact C-N 3.33Å; I183-K185 PolarHBondContact O-N 3.27Å; K185-G188 PolarHBondContact O-N 3.19Å
186	A	93.6	Very high	90.6	Very high	20 Å²	20	38.3 Å²	38.3	17%	0.165	21%	0.212	C	C	.	.	H	α-helix	trans	-71.2	-36.2	-174.6	0	0	0	0	0	113.5	Q182 I183 G188 L420	Q182-A186 WeakPolarHBondContact O-CB 3.05Å; Q182-A186 PolarHBondContact O-N 3.3Å; I183-A186 PolarHBondContact O-N 2.83Å; A186-G188 VanDerWaalsContact C-N 3.26Å; A186-G188 PolarHBondContact O-N 3.15Å; A186-L420 HydrophobicContact CB-CD1 3.06Å; A186-L420 HydrophobicContact CB-CG 3.74Å
187	L	93.3	Very high	90.1	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-6	172.8	-78	87.7	0	0	0	113.4	V135 F139 M168 I183 F189 L420	V135-L187 WeakPolarHBondContact CG1-O 3.39Å; F139-L187 HydrophobicContact CD2-CB 4.44Å; F139-L187 HydrophobicContact CD2-CG 3.97Å; F139-L187 HydrophobicContact CE1-CD2 4.47Å; F139-L187 HydrophobicContact CE2-CD1 4.38Å; F139-L187 HydrophobicContact CE2-CG 3.92Å; F139-L187 HydrophobicContact CG-CG 4.3Å; F139-L187 HydrophobicContact CZ-CD2 4.47Å; F139-L187 HydrophobicContact CZ-CG 4.18Å; M168-L187 HydrophobicContact CB-CD1 4.03Å; M168-L187 HydrophobicContact CB-CD2 3.53Å; M168-L187 HydrophobicContact CB-CG 4.45Å; M168-L187 HydrophobicContact CG-CD1 4.43Å; M168-L187 HydrophobicContact CG-CD2 4.27Å; I183-L187 HydrophobicContact CG2-CD1 3.9Å; I183-L187 WeakPolarHBondContact O-CB 3.19Å; I183-L187 WeakPolarHBondContact O-CD1 3.4Å; I183-L187 PolarHBondContact O-N 2.92Å; L187-F189 VanDerWaalsContact C-N 3.28Å; L187-F189 HydrophobicContact CB-CD1 4.19Å; L187-F189 HydrophobicContact CB-CD2 4.05Å; L187-F189 HydrophobicContact CB-CE1 3.93Å; L187-F189 HydrophobicContact CB-CE2 3.81Å; L187-F189 HydrophobicContact CB-CG 4.23Å; L187-F189 HydrophobicContact CB-CZ 3.74Å; L187-F189 HydrophobicContact CD2-CE1 4.28Å; L187-F189 HydrophobicContact CD2-CE2 3.67Å; L187-F189 HydrophobicContact CD2-CZ 3.42Å; L187-F189 VanDerWaalsContact CD2-CZ 3.42Å; L187-F189 HydrophobicContact CG-CE2 4.31Å; L187-F189 HydrophobicContact CG-CZ 4.22Å; L187-F189 PolarHBondContact O-N 2.78Å; L187-L420 HydrophobicContact CD1-CD2 4.28Å
188	G	91.4	Very high	89.5	Confident	10 Å²	10	49.6 Å²	49.6	10%	0.103	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	5.7	-178.8	0	0	0	0	0	115	V135 Y184 K185 A186 A190 E191 F192	V135-G188 VanDerWaalsContact CG1-O 3.28Å; V135-G188 WeakPolarHBondContact CG1-O 3.33Å; Y184-G188 CarbonylContact O-C 3.54Å; Y184-G188 PolarHBondContact O-N 2.96Å; K185-G188 PolarHBondContact O-N 3.19Å; A186-G188 VanDerWaalsContact C-N 3.26Å; A186-G188 PolarHBondContact O-N 3.15Å; G188-A190 PolarHBondContact O-N 2.84Å; G188-E191 WeakPolarHBondContact O-CA 3.45Å; G188-E191 WeakPolarHBondContact O-CB 3.33Å; G188-E191 PolarHBondContact O-N 2.97Å; G188-F192 PolarHBondContact O-N 3.06Å; G188-F192 VanDerWaalsContact O-N 3.15Å
189	F	92.8	Very high	89.2	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.2	-31	175.9	-58.1	-24	0	0	0	112.8	L132 N136 Y184 L187 E191 F192 V193 V204 F208	L132-F189 HydrophobicContact CD1-CD1 4.03Å; L132-F189 HydrophobicContact CD1-CE1 4.18Å; N136-F189 WeakPolarHBondContact OD1-CE1 3.16Å; Y184-F189 HydrophobicContact CD1-CB 3.48Å; Y184-F189 VanDerWaalsContact CD1-CB 3.48Å; Y184-F189 HydrophobicContact CD2-CB 4.42Å; Y184-F189 HydrophobicContact CD2-CD2 4.1Å; Y184-F189 HydrophobicContact CE1-CB 3.88Å; Y184-F189 HydrophobicContact CE2-CD2 4.17Å; Y184-F189 HydrophobicContact CG-CB 3.79Å; Y184-F189 HydrophobicContact CG-CD2 4.29Å; Y184-F189 PolarHBondContact O-N 2.96Å; L187-F189 VanDerWaalsContact C-N 3.28Å; L187-F189 HydrophobicContact CB-CD1 4.19Å; L187-F189 HydrophobicContact CB-CD2 4.05Å; L187-F189 HydrophobicContact CB-CE1 3.93Å; L187-F189 HydrophobicContact CB-CE2 3.81Å; L187-F189 HydrophobicContact CB-CG 4.23Å; L187-F189 HydrophobicContact CB-CZ 3.74Å; L187-F189 HydrophobicContact CD2-CE1 4.28Å; L187-F189 HydrophobicContact CD2-CE2 3.67Å; L187-F189 HydrophobicContact CD2-CZ 3.42Å; L187-F189 VanDerWaalsContact CD2-CZ 3.42Å; L187-F189 HydrophobicContact CG-CE2 4.31Å; L187-F189 HydrophobicContact CG-CZ 4.22Å; L187-F189 PolarHBondContact O-N 2.78Å; F189-E191 VanDerWaalsContact C-N 3.3Å; F189-E191 PolarHBondContact O-N 3.05Å; F189-F192 WeakPolarHBondContact O-CB 3.13Å; F189-F192 PolarHBondContact O-N 3.39Å; F189-V193 WeakPolarHBondContact O-CG2 3.23Å; F189-V193 PolarHBondContact O-N 3.01Å; F189-V204 HydrophobicContact CD1-CG1 4.44Å; F189-V204 HydrophobicContact CD2-CG1 4.22Å; F189-V204 HydrophobicContact CE2-CG1 4.48Å; F189-V204 HydrophobicContact CG-CG1 4.21Å; F189-F208 AromaticContact CE1-CE2 3.95Å; F189-F208 HydrophobicContact CE1-CE2 3.95Å; F189-F208 AromaticContact CE1-CZ 3.62Å; F189-F208 HydrophobicContact CE1-CZ 3.62Å; F189-F208 AromaticContact CE2-CE2 3.98Å; F189-F208 HydrophobicContact CE2-CE2 3.98Å; F189-F208 HydrophobicContact CE2-CZ 4.3Å; F189-F208 AromaticContact CZ-CE2 3.51Å; F189-F208 HydrophobicContact CZ-CE2 3.51Å; F189-F208 AromaticContact CZ-CZ 3.39Å; F189-F208 HydrophobicContact CZ-CZ 3.39Å
190	A	90	Very high	88.8	Confident	22 Å²	22	48.7 Å²	48.7	18%	0.182	25%	0.247	C	C	.	.	H	α-helix	trans	-60.3	-40.5	172	0	0	0	0	0	111.7	Y184 G188 N194	Y184-A190 PolarHBondContact O-N 2.75Å; G188-A190 PolarHBondContact O-N 2.84Å; A190-N194 VanDerWaalsContact O-CB 3.24Å; A190-N194 WeakPolarHBondContact O-CB 3.46Å; A190-N194 PolarHBondContact O-N 2.86Å; A190-N194 PolarHBondContact O-ND2 2.82Å; A190-N194 VanDerWaalsContact O-ND2 3.07Å
191	E	86.4	Confident	88.5	Confident	44 Å²	44	50.4 Å²	50.4	21%	0.206	26%	0.258	C	S	.	.	H	α-helix	trans	-66.6	-38.5	175.7	-60.4	-175.5	163.8	0	0	111	R115 L119 R138 G188 F189 A195	R115-E191 IonicContact CZ-OE1 2.59Å; R115-E191 IonicContact NH2-OE1 3.77Å; R115-E191 PolarHBondContact NH2-OE1 2.96Å; L119-E191 HydrophobicContact CD2-CB 3.84Å; L119-E191 WeakPolarHBondContact CD2-OE2 3.45Å; R138-E191 IonicContact NH1-OE1 3.84Å; R138-E191 IonicContact NH1-OE2 3.13Å; R138-E191 PolarHBondContact NH1-OE2 2.96Å; G188-E191 WeakPolarHBondContact O-CA 3.45Å; G188-E191 WeakPolarHBondContact O-CB 3.33Å; G188-E191 PolarHBondContact O-N 2.97Å; F189-E191 VanDerWaalsContact C-N 3.3Å; F189-E191 PolarHBondContact O-N 3.05Å; E191-A195 PolarHBondContact O-N 3.45Å
192	F	88.9	Confident	88.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-53.3	174.3	174.1	-98.1	0	0	0	111.9	R128 R131 L132 V135 G188 F189 N194 A195 Y199 T203 V204 L207	R128-F192 WeakPolarHBondContact O-CE2 3.4Å; R131-F192 HydrophobicContact CB-CD2 4.28Å; R131-F192 HydrophobicContact CB-CE2 4.04Å; L132-F192 HydrophobicContact CB-CD2 4.11Å; L132-F192 HydrophobicContact CB-CE2 3.91Å; L132-F192 HydrophobicContact CB-CZ 4.33Å; L132-F192 HydrophobicContact CD1-CD1 4.32Å; L132-F192 HydrophobicContact CD1-CD2 4.39Å; L132-F192 HydrophobicContact CD1-CG 4.18Å; V135-F192 HydrophobicContact CG2-CB 4.27Å; G188-F192 PolarHBondContact O-N 3.06Å; G188-F192 VanDerWaalsContact O-N 3.15Å; F189-F192 WeakPolarHBondContact O-CB 3.13Å; F189-F192 PolarHBondContact O-N 3.39Å; F192-N194 VanDerWaalsContact C-N 3.29Å; F192-N194 PolarHBondContact O-N 3.41Å; F192-A195 WeakPolarHBondContact O-CB 3.2Å; F192-A195 PolarHBondContact O-N 2.86Å; F192-Y199 HydrophobicContact CD1-CD2 4.45Å; F192-Y199 HydrophobicContact CE1-CD2 4.03Å; F192-Y199 HydrophobicContact CE1-CG 4.32Å; F192-Y199 HydrophobicContact CE2-CD2 4.21Å; F192-Y199 AromaticContact CE2-CE2 3.97Å; F192-Y199 HydrophobicContact CE2-CE2 3.97Å; F192-Y199 AromaticContact CZ-CD2 3.88Å; F192-Y199 HydrophobicContact CZ-CD2 3.88Å; F192-Y199 AromaticContact CZ-CE2 3.95Å; F192-Y199 HydrophobicContact CZ-CE2 3.95Å; F192-Y199 HydrophobicContact CZ-CG 4.36Å; F192-Y199 WeakPolarHBondContact O-CD2 3.43Å; F192-T203 HydrophobicContact CE1-CG2 4.1Å; F192-T203 HydrophobicContact CZ-CG2 4.32Å; F192-V204 HydrophobicContact CD1-CG2 3.77Å; F192-V204 HydrophobicContact CE1-CG2 4.04Å; F192-L207 HydrophobicContact CE1-CD1 4Å; F192-L207 HydrophobicContact CE2-CD1 4.29Å; F192-L207 HydrophobicContact CZ-CD1 3.45Å; F192-L207 VanDerWaalsContact CZ-CD1 3.45Å
193	V	88.7	Confident	88	Confident	21 Å²	21	47.3 Å²	47.3	13%	0.127	25%	0.248	C	C	.	.	H	α-helix	trans	-60.2	-41.6	-179.1	172.2	0	0	0	0	110.5	Y184 F189 A195 V204	Y184-V193 HydrophobicContact CE1-CG2 4.3Å; F189-V193 WeakPolarHBondContact O-CG2 3.23Å; F189-V193 PolarHBondContact O-N 3.01Å; V193-A195 PolarHBondContact O-N 3.48Å; V193-A195 VanDerWaalsContact O-N 3.15Å; V193-V204 HydrophobicContact CG2-CG2 3.89Å
194	N	85.8	Confident	87.9	Confident	98 Å²	98	47.3 Å²	47.3	52%	0.524	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-2.5	178.3	-69.2	-26.5	0	0	0	114.6	R116 A190 F192	R116-N194 PolarHBondContact NH2-O 3.36Å; R116-N194 VanDerWaalsContact NH2-O 3.12Å; A190-N194 VanDerWaalsContact O-CB 3.24Å; A190-N194 WeakPolarHBondContact O-CB 3.46Å; A190-N194 PolarHBondContact O-N 2.86Å; A190-N194 PolarHBondContact O-ND2 2.82Å; A190-N194 VanDerWaalsContact O-ND2 3.07Å; F192-N194 VanDerWaalsContact C-N 3.29Å; F192-N194 PolarHBondContact O-N 3.41Å
195	A	82.1	Confident	87.8	Confident	25 Å²	25	47.5 Å²	47.5	21%	0.207	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-17.4	179.4	0	0	0	0	0	113.5	L120 F123 E191 F192 V193	L120-A195 HydrophobicContact CD2-CB 3.91Å; F123-A195 HydrophobicContact CD2-CB 3.9Å; F123-A195 HydrophobicContact CE2-CB 3.58Å; E191-A195 PolarHBondContact O-N 3.45Å; F192-A195 WeakPolarHBondContact O-CB 3.2Å; F192-A195 PolarHBondContact O-N 2.86Å; V193-A195 PolarHBondContact O-N 3.48Å; V193-A195 VanDerWaalsContact O-N 3.15Å
196	S	79.2	Confident	87.7	Confident	31 Å²	31	45.3 Å²	45.3	22%	0.217	24%	0.239	C	C	.	.			trans	-153	139	177.3	-174.7	0	0	0	0	111.4	H198 Y199	S196-H198 PolarHBondContact O-N 3.33Å; S196-H198 PolarHBondContact OG-N 3.48Å; S196-Y199 PolarHBondContact O-N 2.99Å
197	H	79.4	Confident	87.6	Confident	199 Å²	199	45 Å²	45	92%	0.921	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-14.3	173.9	-61.9	-71.8	0	0	0	114.2
198	H	77.3	Confident	87.7	Confident	147 Å²	147	44.9 Å²	44.9	68%	0.681	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	0.2	176.5	-62.8	-56.3	0	0	0	113.8	S196	S196-H198 PolarHBondContact O-N 3.33Å; S196-H198 PolarHBondContact OG-N 3.48Å
199	Y	84.6	Confident	87.7	Confident	21 Å²	21	50.2 Å²	50.2	8%	0.082	25%	0.251	C	S	.	.			trans	-101.9	140.1	179.7	-58.8	-12.8	0	0	0	110	R128 R131 F192 S196 T203	R128-Y199 HydrophobicContact CG-CE1 4.03Å; R131-Y199 PolarHBondContact NH1-OH 2.84Å; F192-Y199 HydrophobicContact CD1-CD2 4.45Å; F192-Y199 HydrophobicContact CE1-CD2 4.03Å; F192-Y199 HydrophobicContact CE1-CG 4.32Å; F192-Y199 HydrophobicContact CE2-CD2 4.21Å; F192-Y199 AromaticContact CE2-CE2 3.97Å; F192-Y199 HydrophobicContact CE2-CE2 3.97Å; F192-Y199 AromaticContact CZ-CD2 3.88Å; F192-Y199 HydrophobicContact CZ-CD2 3.88Å; F192-Y199 AromaticContact CZ-CE2 3.95Å; F192-Y199 HydrophobicContact CZ-CE2 3.95Å; F192-Y199 HydrophobicContact CZ-CG 4.36Å; F192-Y199 WeakPolarHBondContact O-CD2 3.43Å; S196-Y199 PolarHBondContact O-N 2.99Å; Y199-T203 HydrophobicContact CD1-CG2 4.29Å
200	D	85.5	Confident	87.6	Confident	66 Å²	66	57 Å²	57	35%	0.353	28%	0.281	S	S	.	.			trans	-138.1	173.7	177.7	68.2	-23	0	0	0	109.1	T202 T203	D200-T202 PolarHBondContact O-N 3.13Å; D200-T202 PolarHBondContact OD1-OG1 3.05Å; D200-T202 VanDerWaalsContact OD1-OG1 3.07Å; D200-T202 WeakPolarHBondContact OD2-CB 3.33Å; D200-T202 WeakPolarHBondContact OD2-CG2 3.2Å; D200-T202 PolarHBondContact OD2-OG1 3.25Å; D200-T203 VanDerWaalsContact O-CB 3.27Å; D200-T203 WeakPolarHBondContact O-CB 3.48Å; D200-T203 PolarHBondContact O-N 2.89Å; D200-T203 VanDerWaalsContact OD1-CB 3.28Å; D200-T203 WeakPolarHBondContact OD1-CB 3.39Å; D200-T203 PolarHBondContact OD1-N 3.29Å; D200-T203 PolarHBondContact OD1-OG1 3.5Å
201	N	88.6	Confident	87.7	Confident	69 Å²	69	55.9 Å²	55.9	37%	0.369	27%	0.272	S	S	.	.	H	α-helix	trans	-57.7	-35.7	177.1	-65	-5.9	0	0	0	111.2	H180 Y184 T203 V204 H205	H180-N201 PolarHBondContact CE1-ND2 3.21Å; H180-N201 VanDerWaalsContact CE1-ND2 3.28Å; Y184-N201 HydrophobicContact CE1-CB 4.22Å; Y184-N201 WeakPolarHBondContact CE1-OD1 3.48Å; Y184-N201 PolarHBondContact OH-O 3.22Å; N201-T203 VanDerWaalsContact C-N 3.26Å; N201-T203 PolarHBondContact O-N 3.21Å; N201-V204 WeakPolarHBondContact O-CB 3.48Å; N201-V204 PolarHBondContact O-N 2.89Å; N201-H205 PolarHBondContact O-CD2 3.21Å
202	T	88.9	Confident	88	Confident	50 Å²	50	54.2 Å²	54.2	31%	0.307	27%	0.265	S	S	.	.	H	α-helix	trans	-65.2	-29.5	177.7	83.8	0	0	0	0	113	D200 V204 H205 K206	D200-T202 PolarHBondContact O-N 3.13Å; D200-T202 PolarHBondContact OD1-OG1 3.05Å; D200-T202 VanDerWaalsContact OD1-OG1 3.07Å; D200-T202 WeakPolarHBondContact OD2-CB 3.33Å; D200-T202 WeakPolarHBondContact OD2-CG2 3.2Å; D200-T202 PolarHBondContact OD2-OG1 3.25Å; T202-V204 VanDerWaalsContact C-N 3.31Å; T202-V204 PolarHBondContact O-N 3.12Å; T202-H205 PolarHBondContact O-N 3.28Å; T202-K206 WeakPolarHBondContact O-CB 3.35Å; T202-K206 WeakPolarHBondContact O-CD 3.49Å; T202-K206 VanDerWaalsContact O-CG 3.26Å; T202-K206 WeakPolarHBondContact O-CG 3.34Å; T202-K206 PolarHBondContact O-N 2.71Å; T202-K206 PolarHBondContact OG1-NZ 2.9Å
203	T	88.3	Confident	88	Confident	14 Å²	14	58.1 Å²	58.1	9%	0.086	28%	0.283	C	S	.	.	H	α-helix	trans	-61.9	-40.4	175.8	-64.9	0	0	0	0	111	F192 Y199 D200 N201 K206 L207	F192-T203 HydrophobicContact CE1-CG2 4.1Å; F192-T203 HydrophobicContact CZ-CG2 4.32Å; Y199-T203 HydrophobicContact CD1-CG2 4.29Å; D200-T203 VanDerWaalsContact O-CB 3.27Å; D200-T203 WeakPolarHBondContact O-CB 3.48Å; D200-T203 PolarHBondContact O-N 2.89Å; D200-T203 VanDerWaalsContact OD1-CB 3.28Å; D200-T203 WeakPolarHBondContact OD1-CB 3.39Å; D200-T203 PolarHBondContact OD1-N 3.29Å; D200-T203 PolarHBondContact OD1-OG1 3.5Å; N201-T203 VanDerWaalsContact C-N 3.26Å; N201-T203 PolarHBondContact O-N 3.21Å; T203-K206 PolarHBondContact O-N 2.59Å; T203-L207 HydrophobicContact CG2-CD1 3.96Å; T203-L207 HydrophobicContact CG2-CG 4.29Å; T203-L207 WeakPolarHBondContact O-CB 3.4Å; T203-L207 VanDerWaalsContact O-CG 3.24Å; T203-L207 WeakPolarHBondContact O-CG 3.29Å; T203-L207 PolarHBondContact O-N 2.91Å
204	V	92.8	Very high	88.1	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59.7	-51.2	176.8	177.6	0	0	0	0	110.3	L132 Y184 F189 F192 V193 N201 T202 K206 L207 F208	L132-V204 HydrophobicContact CD1-CG1 4.5Å; Y184-V204 HydrophobicContact CE1-CG2 4.27Å; F189-V204 HydrophobicContact CD1-CG1 4.44Å; F189-V204 HydrophobicContact CD2-CG1 4.22Å; F189-V204 HydrophobicContact CE2-CG1 4.48Å; F189-V204 HydrophobicContact CG-CG1 4.21Å; F192-V204 HydrophobicContact CD1-CG2 3.77Å; F192-V204 HydrophobicContact CE1-CG2 4.04Å; V193-V204 HydrophobicContact CG2-CG2 3.89Å; N201-V204 WeakPolarHBondContact O-CB 3.48Å; N201-V204 PolarHBondContact O-N 2.89Å; T202-V204 VanDerWaalsContact C-N 3.31Å; T202-V204 PolarHBondContact O-N 3.12Å; V204-K206 PolarHBondContact O-N 3.19Å; V204-L207 PolarHBondContact O-N 2.89Å; V204-F208 HydrophobicContact CG1-CD2 3.65Å; V204-F208 HydrophobicContact CG1-CE2 3.37Å; V204-F208 HydrophobicContact CG1-CZ 4.43Å; V204-F208 WeakPolarHBondContact O-CD2 3.28Å; V204-F208 PolarHBondContact O-N 3.29Å
205	H	93.8	Very high	88.3	Confident	10 Å²	10	53.7 Å²	53.7	5%	0.046	26%	0.257	C	S	.	.	H	α-helix	trans	-63.3	-39.9	179.1	-56	-62	0	0	0	112.9	G169 S172 L173 Y184 N201 T202 L207 F208 R209 Y249 Y250	G169-H205 PolarHBondContact O-CE1 3.1Å; S172-H205 PolarHBondContact OG-CE1 3.41Å; L173-H205 VanDerWaalsContact CD2-CE1 3.49Å; L173-H205 WeakPolarHBondContact CD2-CE1 3.49Å; L173-H205 WeakPolarHBondContact CD2-NE2 3.36Å; Y184-H205 PolarHBondContact OH-NE2 3.16Å; N201-H205 PolarHBondContact O-CD2 3.21Å; T202-H205 PolarHBondContact O-N 3.28Å; H205-L207 VanDerWaalsContact C-N 3.34Å; H205-L207 PolarHBondContact O-N 3.07Å; H205-F208 PolarHBondContact O-N 3.18Å; H205-R209 PolarHBondContact O-N 2.84Å; H205-Y249 HydrophobicContact CB-CD1 3.91Å; H205-Y249 HydrophobicContact CB-CD2 4.12Å; H205-Y249 HydrophobicContact CB-CE1 4.26Å; H205-Y249 HydrophobicContact CB-CE2 4.44Å; H205-Y249 HydrophobicContact CB-CG 3.85Å; H205-Y250 AromaticContact ND1-CE2 3.7Å; H205-Y250 AromaticContact ND1-CZ 3.69Å; H205-Y250 PolarHBondContact ND1-OH 2.93Å
206	K	90.1	Very high	88.6	Confident	103 Å²	103	53.7 Å²	53.7	45%	0.448	25%	0.252	S	S	.	.	H	α-helix	trans	-63.2	-38	174.5	-73.3	165	-177.3	154.9	0	112.2	T202 T203 V204 K210 Y249	T202-K206 WeakPolarHBondContact O-CB 3.35Å; T202-K206 WeakPolarHBondContact O-CD 3.49Å; T202-K206 VanDerWaalsContact O-CG 3.26Å; T202-K206 WeakPolarHBondContact O-CG 3.34Å; T202-K206 PolarHBondContact O-N 2.71Å; T202-K206 PolarHBondContact OG1-NZ 2.9Å; T203-K206 PolarHBondContact O-N 2.59Å; V204-K206 PolarHBondContact O-N 3.19Å; K206-K210 WeakPolarHBondContact O-CG 3.36Å; K206-K210 PolarHBondContact O-N 3.04Å; K206-Y249 HydrophobicContact CG-CE1 3.81Å
207	L	91.6	Very high	88.8	Confident	13 Å²	13	59.5 Å²	59.5	7%	0.068	27%	0.269	C	S	.	.	H	α-helix	trans	-71.9	-41.9	177.1	-71.9	175.9	0	0	0	111.4	R128 L129 L132 F192 T203 V204 H205 R209 K210 L211	R128-L207 HydrophobicContact CB-CD1 4.26Å; R128-L207 HydrophobicContact CB-CD2 4.32Å; L129-L207 HydrophobicContact CB-CD2 4.22Å; L129-L207 HydrophobicContact CD1-CB 4.2Å; L129-L207 HydrophobicContact CD1-CD2 4.31Å; L132-L207 HydrophobicContact CB-CD1 4.22Å; L132-L207 HydrophobicContact CD2-CB 3.55Å; L132-L207 HydrophobicContact CD2-CD1 4.01Å; L132-L207 HydrophobicContact CD2-CG 4.45Å; F192-L207 HydrophobicContact CE1-CD1 4Å; F192-L207 HydrophobicContact CE2-CD1 4.29Å; F192-L207 HydrophobicContact CZ-CD1 3.45Å; F192-L207 VanDerWaalsContact CZ-CD1 3.45Å; T203-L207 HydrophobicContact CG2-CD1 3.96Å; T203-L207 HydrophobicContact CG2-CG 4.29Å; T203-L207 WeakPolarHBondContact O-CB 3.4Å; T203-L207 VanDerWaalsContact O-CG 3.24Å; T203-L207 WeakPolarHBondContact O-CG 3.29Å; T203-L207 PolarHBondContact O-N 2.91Å; V204-L207 PolarHBondContact O-N 2.89Å; H205-L207 VanDerWaalsContact C-N 3.34Å; H205-L207 PolarHBondContact O-N 3.07Å; L207-R209 VanDerWaalsContact C-N 3.31Å; L207-R209 PolarHBondContact O-N 3Å; L207-K210 WeakPolarHBondContact O-CB 3.29Å; L207-K210 PolarHBondContact O-N 3.5Å; L207-K210 VanDerWaalsContact O-N 3.13Å; L207-L211 WeakPolarHBondContact O-CB 3.3Å; L207-L211 PolarHBondContact O-N 3.35Å
208	F	94.5	Very high	89.1	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.3	-40.6	172.4	-77.9	-50.3	0	0	0	112.1	L132 I166 F189 V204 H205 K210 L211 T212 Y250	L132-F208 HydrophobicContact CD1-CZ 4.46Å; L132-F208 HydrophobicContact CD2-CD1 4.36Å; L132-F208 HydrophobicContact CD2-CE1 4.17Å; L132-F208 HydrophobicContact CD2-CZ 4.23Å; I166-F208 HydrophobicContact CB-CD1 4.49Å; I166-F208 HydrophobicContact CG1-CD1 3.55Å; I166-F208 HydrophobicContact CG1-CE1 3.91Å; I166-F208 HydrophobicContact CG1-CG 4.38Å; F189-F208 AromaticContact CE1-CE2 3.95Å; F189-F208 HydrophobicContact CE1-CE2 3.95Å; F189-F208 AromaticContact CE1-CZ 3.62Å; F189-F208 HydrophobicContact CE1-CZ 3.62Å; F189-F208 AromaticContact CE2-CE2 3.98Å; F189-F208 HydrophobicContact CE2-CE2 3.98Å; F189-F208 HydrophobicContact CE2-CZ 4.3Å; F189-F208 AromaticContact CZ-CE2 3.51Å; F189-F208 HydrophobicContact CZ-CE2 3.51Å; F189-F208 AromaticContact CZ-CZ 3.39Å; F189-F208 HydrophobicContact CZ-CZ 3.39Å; V204-F208 HydrophobicContact CG1-CD2 3.65Å; V204-F208 HydrophobicContact CG1-CE2 3.37Å; V204-F208 HydrophobicContact CG1-CZ 4.43Å; V204-F208 WeakPolarHBondContact O-CD2 3.28Å; V204-F208 PolarHBondContact O-N 3.29Å; H205-F208 PolarHBondContact O-N 3.18Å; F208-K210 VanDerWaalsContact C-N 3.32Å; F208-K210 PolarHBondContact O-N 3.07Å; F208-L211 HydrophobicContact CD1-CD2 4.31Å; F208-L211 PolarHBondContact O-N 2.83Å; F208-L211 VanDerWaalsContact O-N 3.15Å; F208-T212 WeakPolarHBondContact O-CB 3.47Å; F208-T212 PolarHBondContact O-N 2.92Å; F208-T212 PolarHBondContact O-OG1 3.4Å; F208-Y250 HydrophobicContact CB-CE1 3.77Å; F208-Y250 HydrophobicContact CD2-CE1 4.24Å; F208-Y250 WeakPolarHBondContact CD2-OH 3.45Å; F208-Y250 HydrophobicContact CG-CE1 4.17Å
209	R	92.6	Very high	89.5	Confident	121 Å²	121	55.3 Å²	55.3	46%	0.457	25%	0.248	S	C	.	.	H	α-helix	trans	-55.2	-46.6	172.1	-172.9	-175.9	171.3	-174.5	-4.8	112.6	H205 L207 H213 A248 Y249 F251	H205-R209 PolarHBondContact O-N 2.84Å; L207-R209 VanDerWaalsContact C-N 3.31Å; L207-R209 PolarHBondContact O-N 3Å; R209-H213 VanDerWaalsContact O-CB 3.28Å; R209-H213 WeakPolarHBondContact O-CB 3.45Å; R209-H213 PolarHBondContact O-N 2.91Å; R209-A248 WeakPolarHBondContact CD-O 3.15Å; R209-A248 PolarHBondContact NE-O 2.79Å; R209-Y249 WeakPolarHBondContact CA-O 3.42Å; R209-Y249 HydrophobicContact CB-CD1 4.37Å; R209-Y249 WeakPolarHBondContact CB-O 3.17Å; R209-Y249 WeakPolarHBondContact CG-O 3.29Å; R209-F251 HydrophobicContact CG-CE2 4.08Å; R209-F251 HydrophobicContact CG-CZ 3.97Å
210	K	90.6	Very high	89.6	Confident	142 Å²	142	56.8 Å²	56.8	62%	0.617	26%	0.255	S	S	*	.	H	α-helix	trans	-64.6	-41.6	177.6	-72.8	179.7	178.1	-177.5	0	111.6	K206 L207 F208 R214	K206-K210 WeakPolarHBondContact O-CG 3.36Å; K206-K210 PolarHBondContact O-N 3.04Å; L207-K210 WeakPolarHBondContact O-CB 3.29Å; L207-K210 PolarHBondContact O-N 3.5Å; L207-K210 VanDerWaalsContact O-N 3.13Å; F208-K210 VanDerWaalsContact C-N 3.32Å; F208-K210 PolarHBondContact O-N 3.07Å; K210-R214 WeakPolarHBondContact O-CB 3.38Å; K210-R214 PolarHBondContact O-N 3.13Å
211	L	92.1	Very high	89.6	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.8	-52	179.3	-171.8	60.2	0	0	0	111.4	L129 N133 I166 L207 F208 H213 R214 L215 C492	L129-L211 HydrophobicContact CD1-CB 4.19Å; L129-L211 HydrophobicContact CD1-CD1 4.44Å; N133-L211 WeakPolarHBondContact OD1-CD2 3.45Å; I166-L211 HydrophobicContact CD1-CD2 4.39Å; L207-L211 WeakPolarHBondContact O-CB 3.3Å; L207-L211 PolarHBondContact O-N 3.35Å; F208-L211 HydrophobicContact CD1-CD2 4.31Å; F208-L211 PolarHBondContact O-N 2.83Å; F208-L211 VanDerWaalsContact O-N 3.15Å; L211-H213 VanDerWaalsContact C-N 3.3Å; L211-H213 PolarHBondContact O-N 3.15Å; L211-R214 WeakPolarHBondContact O-CB 3.32Å; L211-R214 PolarHBondContact O-N 2.86Å; L211-L215 HydrophobicContact CD1-CD1 3.76Å; L211-L215 HydrophobicContact CD1-CG 3.98Å; L211-L215 HydrophobicContact CD2-CD1 4.43Å; L211-L215 HydrophobicContact CG-CD1 3.76Å; L211-L215 HydrophobicContact CG-CG 4.28Å; L211-L215 WeakPolarHBondContact O-CG 3.43Å; L211-L215 PolarHBondContact O-N 3.42Å; L211-C492 HydrophobicContact CD1-CB 4.32Å
212	T	92.3	Very high	89.6	Confident	8 Å²	8	52.4 Å²	52.4	5%	0.049	24%	0.24	C	C	.	.	H	α-helix	trans	-57.5	-43.3	177.5	-57.7	0	0	0	0	111.2	F208 R214 F216 F251	F208-T212 WeakPolarHBondContact O-CB 3.47Å; F208-T212 PolarHBondContact O-N 2.92Å; F208-T212 PolarHBondContact O-OG1 3.4Å; T212-R214 PolarHBondContact O-N 3.34Å; T212-F216 HydrophobicContact CG2-CD2 3.88Å; T212-F216 PolarHBondContact O-N 2.94Å; T212-F251 HydrophobicContact CG2-CD2 3.85Å; T212-F251 HydrophobicContact CG2-CE2 4.4Å
213	H	89.7	Confident	89.7	Confident	82 Å²	82	52.4 Å²	52.4	38%	0.38	24%	0.24	S	C	.	.	H	α-helix	trans	-63.4	-41.1	175.4	-175.9	-83.6	0	0	0	112.1	R209 L211 R217 R218 F251	R209-H213 VanDerWaalsContact O-CB 3.28Å; R209-H213 WeakPolarHBondContact O-CB 3.45Å; R209-H213 PolarHBondContact O-N 2.91Å; L211-H213 VanDerWaalsContact C-N 3.3Å; L211-H213 PolarHBondContact O-N 3.15Å; H213-R217 WeakPolarHBondContact O-CB 3.44Å; H213-R217 PolarHBondContact O-N 3.43Å; H213-R218 PolarHBondContact O-N 3.4Å; H213-F251 HydrophobicContact CB-CE2 4.13Å; H213-F251 HydrophobicContact CB-CZ 4.37Å
214	R	90.2	Very high	89.9	Confident	26 Å²	26	52.1 Å²	52.1	10%	0.098	24%	0.238	C	C	.	.	H	α-helix	trans	-65.4	-53.3	176.8	-179.6	174.4	-179.4	61.8	10.8	111.2	K210 L211 T212 F220 E487	K210-R214 WeakPolarHBondContact O-CB 3.38Å; K210-R214 PolarHBondContact O-N 3.13Å; L211-R214 WeakPolarHBondContact O-CB 3.32Å; L211-R214 PolarHBondContact O-N 2.86Å; T212-R214 PolarHBondContact O-N 3.34Å; R214-F220 HydrophobicContact CG-CE2 3.96Å; R214-F220 HydrophobicContact CG-CZ 4.26Å; R214-F220 VanDerWaalsContact NH1-CZ 3.34Å; R214-F220 VanDerWaalsContact O-CE2 3.31Å; R214-F220 WeakPolarHBondContact O-CE2 3.29Å; R214-E487 IonicContact CZ-OE1 2.83Å; R214-E487 VanDerWaalsContact CZ-OE1 3.28Å; R214-E487 IonicContact NE-OE1 3.25Å; R214-E487 PolarHBondContact NE-OE1 3.46Å; R214-E487 VanDerWaalsContact NE-OE1 3.1Å; R214-E487 IonicContact NE-OE2 2.81Å; R214-E487 PolarHBondContact NE-OE2 2.9Å; R214-E487 IonicContact NH2-OE1 3.08Å; R214-E487 PolarHBondContact NH2-OE1 3.18Å
215	L	89.8	Confident	89.8	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-72.1	-44.9	-170.9	-65.7	178.4	0	0	0	113.1	L211 L224 E487	L211-L215 HydrophobicContact CD1-CD1 3.76Å; L211-L215 HydrophobicContact CD1-CG 3.98Å; L211-L215 HydrophobicContact CD2-CD1 4.43Å; L211-L215 HydrophobicContact CG-CD1 3.76Å; L211-L215 HydrophobicContact CG-CG 4.28Å; L211-L215 WeakPolarHBondContact O-CG 3.43Å; L211-L215 PolarHBondContact O-N 3.42Å; L215-L224 HydrophobicContact CB-CD2 4.04Å; L215-L224 HydrophobicContact CD2-CD2 4.46Å; L215-E487 HydrophobicContact CD2-CB 4.34Å; L215-E487 HydrophobicContact CD2-CG 4.17Å
216	F	88.6	Confident	89.6	Confident	25 Å²	25	56.3 Å²	56.3	11%	0.11	26%	0.257	C	S	.	.	H	α-helix	trans	-109.7	-17.3	-166.4	-52.9	-64.1	0	0	0	114.4	I166 T212 L224 S226 L299	I166-F216 HydrophobicContact CD1-CE2 3.92Å; T212-F216 HydrophobicContact CG2-CD2 3.88Å; T212-F216 PolarHBondContact O-N 2.94Å; F216-L224 HydrophobicContact CD1-CD2 4.09Å; F216-L224 HydrophobicContact CD1-CG 3.85Å; F216-L224 HydrophobicContact CE1-CD1 4.16Å; F216-L224 HydrophobicContact CE1-CD2 3.83Å; F216-L224 HydrophobicContact CE1-CG 3.74Å; F216-S226 VanDerWaalsContact CD1-CB 3.48Å; F216-L299 HydrophobicContact CE1-CD2 4.04Å; F216-L299 HydrophobicContact CZ-CD2 4Å
217	R	84.3	Confident	89.6	Confident	153 Å²	153	51.6 Å²	51.6	58%	0.577	24%	0.237	S	C	*	.	H	α-helix	trans	-108.7	-9.3	-176.5	-57.2	-166	66.8	172.5	1.6	114.4	H213	H213-R217 WeakPolarHBondContact O-CB 3.44Å; H213-R217 PolarHBondContact O-N 3.43Å
218	R	85.8	Confident	89.5	Confident	137 Å²	137	52 Å²	52	52%	0.517	24%	0.239	S	C	.	.	S	Bend	trans	-110.5	147.2	171.5	-62.7	-175.7	75.2	159.5	5.8	109	H213 F220	H213-R218 PolarHBondContact O-N 3.4Å; R218-F220 HydrophobicContact CB-CD2 4.34Å; R218-F220 HydrophobicContact CB-CE1 4.43Å; R218-F220 HydrophobicContact CB-CE2 3.69Å; R218-F220 HydrophobicContact CB-CZ 3.73Å; R218-F220 HydrophobicContact CG-CZ 4.4Å
219	N	85.3	Confident	89.3	Confident	121 Å²	121	52.2 Å²	52.2	65%	0.647	24%	0.24	S	C	*	.			trans	-104	125.4	171.2	-172.8	-0.9	0	0	0	108.2	G221 Y222	N219-G221 PolarHBondContact OD1-N 2.94Å; N219-Y222 PolarHBondContact OD1-O 3.46Å
220	F	87.2	Confident	89.4	Confident	51 Å²	51	46.4 Å²	46.4	22%	0.224	22%	0.219	C	C	.	.	S	Bend	trans	-115.1	10.5	177.9	-63.5	-70	0	0	0	112.9	R214 R218 Y222 G357	R214-F220 HydrophobicContact CG-CE2 3.96Å; R214-F220 HydrophobicContact CG-CZ 4.26Å; R214-F220 VanDerWaalsContact NH1-CZ 3.34Å; R214-F220 VanDerWaalsContact O-CE2 3.31Å; R214-F220 WeakPolarHBondContact O-CE2 3.29Å; R218-F220 HydrophobicContact CB-CD2 4.34Å; R218-F220 HydrophobicContact CB-CE1 4.43Å; R218-F220 HydrophobicContact CB-CE2 3.69Å; R218-F220 HydrophobicContact CB-CZ 3.73Å; R218-F220 HydrophobicContact CG-CZ 4.4Å; F220-Y222 HydrophobicContact CB-CD1 4.26Å; F220-Y222 HydrophobicContact CB-CE1 3.76Å; F220-Y222 HydrophobicContact CD2-CE1 4.38Å; F220-G357 WeakPolarHBondContact O-CA 3.37Å; F220-G357 PolarHBondContact O-N 3.24Å
221	G	85.1	Confident	89.6	Confident	36 Å²	36	40 Å²	40	37%	0.371	19%	0.19	S	C	.	.	S	Bend	trans	111.6	-11.2	-179	0	0	0	0	0	114.4	N219 T304 T356	N219-G221 PolarHBondContact OD1-N 2.94Å; G221-T304 PolarHBondContact O-OG1 3.48Å; G221-T356 PolarHBondContact O-OG1 3.37Å
222	Y	88.9	Confident	89.7	Confident	7 Å²	7	40 Å²	40	3%	0.027	19%	0.19	C	C	.	.	S	Bend	trans	-109.8	158.2	172	57.8	-98.1	0	0	0	112.1	N219 F220 L224 F301 T356 I359	N219-Y222 PolarHBondContact OD1-O 3.46Å; F220-Y222 HydrophobicContact CB-CD1 4.26Å; F220-Y222 HydrophobicContact CB-CE1 3.76Å; F220-Y222 HydrophobicContact CD2-CE1 4.38Å; Y222-L224 HydrophobicContact CD2-CB 3.67Å; Y222-L224 HydrophobicContact CE2-CB 3.57Å; Y222-L224 HydrophobicContact CE2-CD2 4.02Å; Y222-L224 HydrophobicContact CE2-CG 4.45Å; Y222-F301 HydrophobicContact CD2-CD2 4.43Å; Y222-F301 AromaticContact CD2-CE2 3.9Å; Y222-F301 HydrophobicContact CD2-CE2 3.9Å; Y222-F301 HydrophobicContact CG-CE2 4.11Å; Y222-T356 WeakPolarHBondContact CD1-O 3.31Å; Y222-I359 HydrophobicContact CD1-CG2 3.62Å; Y222-I359 HydrophobicContact CE1-CB 4.19Å; Y222-I359 HydrophobicContact CE1-CD1 4.49Å; Y222-I359 HydrophobicContact CE1-CG2 3.74Å; Y222-I359 HydrophobicContact CG-CG2 4.32Å
223	T	90.4	Very high	89.7	Confident	51 Å²	51	41.8 Å²	41.8	31%	0.313	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	102.4	173.1	-60.5	0	0	0	0	109.7	R225 L279 Y300 F301 K302	T223-R225 HydrophobicContact CG2-CG 4.16Å; T223-L279 HydrophobicContact CG2-CD1 4.07Å; T223-Y300 HydrophobicContact CG2-CD1 4.18Å; T223-Y300 HydrophobicContact CG2-CE1 4.12Å; T223-F301 WeakPolarHBondContact O-CA 3.25Å; T223-K302 PolarHBondContact N-O 3.38Å; T223-K302 PolarHBondContact O-N 3.41Å
224	L	91.9	Very high	89.7	Confident	7 Å²	7	44.7 Å²	44.7	4%	0.037	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	118.3	169.1	-177.4	62.3	0	0	0	109	L215 F216 Y222 Y300 F301 V494 F495	L215-L224 HydrophobicContact CB-CD2 4.04Å; L215-L224 HydrophobicContact CD2-CD2 4.46Å; F216-L224 HydrophobicContact CD1-CD2 4.09Å; F216-L224 HydrophobicContact CD1-CG 3.85Å; F216-L224 HydrophobicContact CE1-CD1 4.16Å; F216-L224 HydrophobicContact CE1-CD2 3.83Å; F216-L224 HydrophobicContact CE1-CG 3.74Å; Y222-L224 HydrophobicContact CD2-CB 3.67Å; Y222-L224 HydrophobicContact CE2-CB 3.57Å; Y222-L224 HydrophobicContact CE2-CD2 4.02Å; Y222-L224 HydrophobicContact CE2-CG 4.45Å; L224-Y300 WeakPolarHBondContact CA-O 3.39Å; L224-F301 HydrophobicContact CB-CD2 4.32Å; L224-F301 HydrophobicContact CD1-CB 4.19Å; L224-F301 HydrophobicContact CD1-CD2 4.02Å; L224-V494 HydrophobicContact CD1-CG1 4.2Å; L224-V494 HydrophobicContact CD2-CG1 4.12Å; L224-F495 HydrophobicContact CD1-CE2 3.93Å
225	R	90.6	Very high	89.6	Confident	72 Å²	72	49.7 Å²	49.7	27%	0.272	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	143.9	178.5	-61	-64.5	176	-157.6	-6.7	109.3	T223 L299 Y300	T223-R225 HydrophobicContact CG2-CG 4.16Å; R225-L299 WeakPolarHBondContact O-CA 3.28Å; R225-Y300 PolarHBondContact N-O 2.82Å; R225-Y300 PolarHBondContact O-N 3.4Å
226	S	90.4	Very high	89.7	Confident	27 Å²	27	50.1 Å²	50.1	19%	0.189	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	144.9	177.5	175.6	0	0	0	0	110.6	F216 N228 Y298	F216-S226 VanDerWaalsContact CD1-CB 3.48Å; S226-N228 PolarHBondContact OG-ND2 2.8Å; S226-N228 PolarHBondContact OG-OD1 3.01Å; S226-Y298 CarbonylContact C-O 3.6Å; S226-Y298 WeakPolarHBondContact CA-O 3.44Å; S226-Y298 PolarHBondContact OG-O 3.28Å
227	V	89.6	Confident	89.9	Confident	3 Å²	3	53 Å²	53	2%	0.018	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	118	169.8	-177	0	0	0	0	107.6	D229 I272 L275 T276 N297 Y298	V227-D229 HydrophobicContact CG1-CB 4.3Å; V227-D229 WeakPolarHBondContact CG1-OD2 3.36Å; V227-I272 HydrophobicContact CG1-CG1 4.28Å; V227-I272 HydrophobicContact CG2-CG2 4.36Å; V227-L275 HydrophobicContact CB-CD1 4.49Å; V227-L275 HydrophobicContact CG1-CD1 3.89Å; V227-L275 HydrophobicContact CG2-CB 3.65Å; V227-L275 HydrophobicContact CG2-CD1 3.93Å; V227-L275 HydrophobicContact CG2-CG 4.46Å; V227-T276 HydrophobicContact CG2-CG2 3.88Å; V227-N297 WeakPolarHBondContact O-CA 3.4Å; V227-Y298 HydrophobicContact CB-CD2 4.48Å; V227-Y298 PolarHBondContact N-O 2.9Å; V227-Y298 PolarHBondContact O-N 3Å
228	N	90.6	Very high	90.3	Very high	21 Å²	21	46.4 Å²	46.4	11%	0.112	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	80.4	177.2	-62.8	-33.4	0	0	0	107.8	S226 A252 L296 N297	S226-N228 PolarHBondContact OG-ND2 2.8Å; S226-N228 PolarHBondContact OG-OD1 3.01Å; N228-A252 WeakPolarHBondContact O-CB 3.29Å; N228-L296 WeakPolarHBondContact CA-O 3.38Å; N228-N297 PolarHBondContact OD1-ND2 3.35Å
229	D	90.3	Very high	90.8	Very high	5 Å²	5	43.5 Å²	43.5	3%	0.027	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	138.6	-176.2	-79.1	-21.7	0	0	0	110.3	V227 Y231 R271 L296	V227-D229 HydrophobicContact CG1-CB 4.3Å; V227-D229 WeakPolarHBondContact CG1-OD2 3.36Å; D229-Y231 HydrophobicContact CB-CD2 4.13Å; D229-Y231 HydrophobicContact CB-CE2 3.38Å; D229-Y231 PolarHBondContact OD2-OH 2.89Å; D229-R271 IonicContact OD1-CZ 2.83Å; D229-R271 IonicContact OD1-NE 2.82Å; D229-R271 PolarHBondContact OD1-NE 3.07Å; D229-R271 IonicContact OD1-NH2 3.84Å; D229-R271 PolarHBondContact OD1-NH2 2.93Å; D229-R271 WeakPolarHBondContact OD2-CD 3.37Å; D229-R271 IonicContact OD2-CZ 3.14Å; D229-R271 IonicContact OD2-NE 3.91Å; D229-R271 PolarHBondContact OD2-NE 2.6Å; D229-R271 IonicContact OD2-NH2 3.1Å; D229-L296 PolarHBondContact N-O 3.47Å; D229-L296 PolarHBondContact O-N 3.46Å
230	V	93.9	Very high	91.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.9	172.7	-171.7	0	0	0	0	108	M170 M171 L232 P254 Q255 L293 L295	M170-V230 HydrophobicContact CE-CG2 3.27Å; M170-V230 HydrophobicContact SD-CG2 3.97Å; M171-V230 HydrophobicContact SD-CG1 4.36Å; M171-V230 HydrophobicContact SD-CG2 4.21Å; V230-L232 HydrophobicContact CG1-CD1 3.85Å; V230-P254 HydrophobicContact CB-CB 4.3Å; V230-P254 WeakPolarHBondContact O-CA 3.28Å; V230-Q255 PolarHBondContact O-N 2.85Å; V230-L293 HydrophobicContact CG1-CD1 3.61Å; V230-L295 HydrophobicContact CG2-CD1 3.93Å
231	Y	94.3	Very high	91.5	Very high	6 Å²	6	45.4 Å²	45.4	2%	0.024	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	127.9	177.4	-67.8	-84.8	0	0	0	109.8	D229 Q255 V257 F264 L293 M294 L296	D229-Y231 HydrophobicContact CB-CD2 4.13Å; D229-Y231 HydrophobicContact CB-CE2 3.38Å; D229-Y231 PolarHBondContact OD2-OH 2.89Å; Y231-Q255 WeakPolarHBondContact CA-O 3.45Å; Y231-Q255 HydrophobicContact CD1-CB 3.75Å; Y231-Q255 HydrophobicContact CD1-CG 4.43Å; Y231-Q255 HydrophobicContact CE1-CB 3.85Å; Y231-Q255 HydrophobicContact CE1-CG 4.09Å; Y231-V257 HydrophobicContact CD1-CB 4.45Å; Y231-V257 HydrophobicContact CD1-CG1 3.68Å; Y231-V257 HydrophobicContact CD1-CG2 3.94Å; Y231-V257 HydrophobicContact CE1-CG1 4.18Å; Y231-V257 HydrophobicContact CG-CG2 4.4Å; Y231-F264 AromaticContact CD1-CE2 3.62Å; Y231-F264 HydrophobicContact CD1-CE2 3.62Å; Y231-F264 AromaticContact CD1-CZ 3.92Å; Y231-F264 HydrophobicContact CD1-CZ 3.92Å; Y231-F264 AromaticContact CE1-CE2 3.78Å; Y231-F264 HydrophobicContact CE1-CE2 3.78Å; Y231-F264 HydrophobicContact CE1-CZ 4.28Å; Y231-F264 HydrophobicContact CG-CE2 4.3Å; Y231-F264 HydrophobicContact CG-CZ 4.13Å; Y231-L293 WeakPolarHBondContact O-CA 3.44Å; Y231-M294 HydrophobicContact CD2-CE 3.38Å; Y231-M294 HydrophobicContact CE2-CE 4.1Å; Y231-M294 HydrophobicContact CG-CE 3.69Å; Y231-M294 PolarHBondContact N-O 3.23Å; Y231-M294 PolarHBondContact O-N 3.27Å; Y231-L296 HydrophobicContact CD2-CD1 4.03Å; Y231-L296 HydrophobicContact CD2-CG 4.24Å; Y231-L296 HydrophobicContact CE2-CD1 3.64Å; Y231-L296 HydrophobicContact CE2-CG 4.23Å
232	L	93.9	Very high	91.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	147.6	176.2	-66	99.1	0	0	0	110.5	V230 K234 V236 V238 P254 Q255 S256 V257 V292 L293 M433	V230-L232 HydrophobicContact CG1-CD1 3.85Å; L232-K234 PolarHBondContact O-N 3.37Å; L232-V236 HydrophobicContact CD2-CG1 4.13Å; L232-V238 HydrophobicContact CD1-CG2 4.03Å; L232-V238 HydrophobicContact CD2-CG2 3.85Å; L232-V238 HydrophobicContact CG-CG2 4.36Å; L232-P254 HydrophobicContact CD1-CB 3.85Å; L232-Q255 PolarHBondContact N-O 3.37Å; L232-S256 CarbonylContact O-C 3.54Å; L232-S256 WeakPolarHBondContact O-CA 3.46Å; L232-V257 PolarHBondContact O-N 3.05Å; L232-V292 CarbonylContact C-O 3.55Å; L232-V292 WeakPolarHBondContact CA-O 3.26Å; L232-L293 HydrophobicContact CD1-CD1 4.29Å; L232-L293 HydrophobicContact CD2-CD1 4.17Å; L232-L293 HydrophobicContact CG-CD1 3.76Å; L232-M433 HydrophobicContact CD2-CE 3.77Å; L232-M433 HydrophobicContact CD2-CG 4.31Å; L232-M433 HydrophobicContact CD2-SD 3.77Å
233	K	93.5	Very high	92.2	Very high	46 Å²	46	46.7 Å²	46.7	20%	0.2	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	136.3	173.3	-169.3	172	-166.2	161.7	0	110.4	N235 V236 V257 F259 V292	K233-N235 PolarHBondContact O-N 3Å; K233-V236 HydrophobicContact CB-CG2 4.29Å; K233-V236 WeakPolarHBondContact O-CB 3.5Å; K233-V236 PolarHBondContact O-N 3.03Å; K233-V257 CarbonylContact C-O 3.45Å; K233-V257 WeakPolarHBondContact CA-O 3.33Å; K233-F259 HydrophobicContact CB-CD2 4.23Å; K233-F259 HydrophobicContact CB-CE2 4.03Å; K233-F259 HydrophobicContact CG-CD2 4.48Å; K233-V292 HydrophobicContact CB-CG1 4.45Å; K233-V292 PolarHBondContact N-O 2.97Å
234	K	90.1	Very high	92.4	Very high	143 Å²	143	47.6 Å²	47.6	62%	0.622	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-31.2	-173	-174.1	178.9	177.3	-175.8	0	114.6	L232 V236 V257	L232-K234 PolarHBondContact O-N 3.37Å; K234-V236 VanDerWaalsContact C-N 3.28Å; K234-V236 PolarHBondContact O-N 2.98Å; K234-V257 PolarHBondContact N-O 3.46Å
235	N	87.8	Confident	92.5	Very high	132 Å²	132	50.9 Å²	50.9	71%	0.706	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-10.4	-177.7	-63.4	-7.2	0	0	0	113.5	K233	K233-N235 PolarHBondContact O-N 3Å
236	V	90.9	Very high	92.7	Very high	9 Å²	9	47.5 Å²	47.5	6%	0.055	25%	0.245	C	C	.	.	S	Bend	trans	-86.9	117.5	180	179.9	0	0	0	0	110.3	L232 K233 K234 V238 V292 T434 E436 V438	L232-V236 HydrophobicContact CD2-CG1 4.13Å; K233-V236 HydrophobicContact CB-CG2 4.29Å; K233-V236 WeakPolarHBondContact O-CB 3.5Å; K233-V236 PolarHBondContact O-N 3.03Å; K234-V236 VanDerWaalsContact C-N 3.28Å; K234-V236 PolarHBondContact O-N 2.98Å; V236-V238 PolarHBondContact O-N 3.21Å; V236-V292 HydrophobicContact CG2-CG1 3.93Å; V236-T434 HydrophobicContact CG1-CG2 3.94Å; V236-E436 WeakPolarHBondContact CA-OE1 3.48Å; V236-E436 WeakPolarHBondContact CA-OE2 3.33Å; V236-V438 HydrophobicContact CG1-CG2 3.94Å; V236-V438 HydrophobicContact CG2-CG2 4.31Å
237	S	93	Very high	92.8	Very high	87 Å²	87	51.8 Å²	51.8	61%	0.608	26%	0.26	S	S	*	.	P	Polyproline II helix	trans	-76.3	117.1	175.5	-172.7	0	0	0	0	111.2	T434 E436	S237-T434 WeakPolarHBondContact O-CB 3.24Å; S237-T434 PolarHBondContact O-OG1 2.73Å; S237-E436 PolarHBondContact N-OE1 2.79Å
238	V	93.8	Very high	93	Very high	14 Å²	14	53.8 Å²	53.8	9%	0.085	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-91.4	128.7	179	-174.9	0	0	0	0	109.9	L232 V236 F242 R243	L232-V238 HydrophobicContact CD1-CG2 4.03Å; L232-V238 HydrophobicContact CD2-CG2 3.85Å; L232-V238 HydrophobicContact CG-CG2 4.36Å; V236-V238 PolarHBondContact O-N 3.21Å; V238-F242 HydrophobicContact CG1-CD1 3.81Å; V238-R243 HydrophobicContact CG1-CG 3.84Å
239	K	95	Very high	93.1	Very high	76 Å²	76	55 Å²	55	33%	0.33	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-62.8	137.6	177.2	-67.8	-176.8	178.1	-176.4	0	111.4	T241 F242 R243 S431 M433	K239-T241 PolarHBondContact O-N 2.83Å; K239-F242 PolarHBondContact O-N 3.11Å; K239-F242 VanDerWaalsContact O-N 3.16Å; K239-R243 PolarHBondContact O-N 2.86Å; K239-S431 WeakPolarHBondContact CE-O 3.43Å; K239-S431 PolarHBondContact NZ-O 2.93Å; K239-M433 PolarHBondContact N-O 3.05Å
240	E	93.8	Very high	93.3	Very high	128 Å²	128	55.1 Å²	55.1	60%	0.598	28%	0.28	S	S	*	.	H	α-helix	trans	-65.4	-30.3	179.5	-170.1	56.1	-150.8	0	0	112.2	F242 R243 T244	E240-F242 PolarHBondContact O-N 3.48Å; E240-R243 PolarHBondContact O-N 2.83Å; E240-R243 WeakPolarHBondContact OE2-CD 3.49Å; E240-T244 HydrophobicContact CG-CG2 4.23Å; E240-T244 WeakPolarHBondContact O-CB 3.12Å; E240-T244 WeakPolarHBondContact O-CG2 3.02Å; E240-T244 PolarHBondContact O-N 2.85Å; E240-T244 PolarHBondContact O-OG1 3.18Å
241	T	93.9	Very high	93.1	Very high	83 Å²	83	58.5 Å²	58.5	51%	0.509	30%	0.295	S	S	.	.	H	α-helix	trans	-58	-47.3	172.6	51.1	0	0	0	0	111.2	K239 R243 T244 E245	K239-T241 PolarHBondContact O-N 2.83Å; T241-R243 PolarHBondContact O-N 2.84Å; T241-T244 WeakPolarHBondContact CA-OG1 3.43Å; T241-T244 PolarHBondContact O-N 3.42Å; T241-T244 PolarHBondContact O-OG1 2.95Å; T241-E245 WeakPolarHBondContact O-CB 3.36Å; T241-E245 WeakPolarHBondContact O-CG 3.42Å; T241-E245 PolarHBondContact O-N 3.47Å
242	F	94.3	Very high	92.8	Very high	1 Å²	1	58.5 Å²	58.5	0%	0.004	30%	0.297	C	S	.	.	H	α-helix	trans	-64.7	-41	177.3	-179.3	-106.3	0	0	0	112.3	L173 V238 K239 E240 T246 P254 M433	L173-F242 HydrophobicContact CB-CD2 4.09Å; L173-F242 HydrophobicContact CB-CE2 4.02Å; V238-F242 HydrophobicContact CG1-CD1 3.81Å; K239-F242 PolarHBondContact O-N 3.11Å; K239-F242 VanDerWaalsContact O-N 3.16Å; E240-F242 PolarHBondContact O-N 3.48Å; F242-T246 WeakPolarHBondContact O-CB 3.21Å; F242-T246 PolarHBondContact O-N 3.24Å; F242-T246 PolarHBondContact O-OG1 3.2Å; F242-P254 HydrophobicContact CD1-CG 3.99Å; F242-P254 HydrophobicContact CE1-CB 4.3Å; F242-P254 HydrophobicContact CE1-CG 3.58Å; F242-M433 HydrophobicContact CD1-CB 4.35Å; F242-M433 HydrophobicContact CD1-CG 3.71Å; F242-M433 HydrophobicContact CD1-SD 4.5Å; F242-M433 HydrophobicContact CD2-CB 4.41Å; F242-M433 HydrophobicContact CE1-CG 3.74Å; F242-M433 HydrophobicContact CE1-SD 3.92Å; F242-M433 HydrophobicContact CG-CB 4.27Å; F242-M433 HydrophobicContact CG-CG 4.13Å; F242-M433 HydrophobicContact CZ-CG 4.21Å; F242-M433 HydrophobicContact CZ-SD 4.12Å
243	R	94.4	Very high	92.5	Very high	69 Å²	69	62.5 Å²	62.5	26%	0.26	32%	0.315	S	S	.	.	H	α-helix	trans	-61.3	-46.9	176.1	-68.8	-178.6	175.6	-79.8	-1.7	111.7	V238 K239 E240 T241 K247 P254 S256	V238-R243 HydrophobicContact CG1-CG 3.84Å; K239-R243 PolarHBondContact O-N 2.86Å; E240-R243 PolarHBondContact O-N 2.83Å; E240-R243 WeakPolarHBondContact OE2-CD 3.49Å; T241-R243 PolarHBondContact O-N 2.84Å; R243-K247 VanDerWaalsContact O-CB 3.27Å; R243-K247 WeakPolarHBondContact O-CB 3.44Å; R243-K247 PolarHBondContact O-N 3.35Å; R243-P254 PolarHBondContact NH1-O 3.02Å; R243-S256 PolarHBondContact NH2-OG 3.2Å
244	T	94.9	Very high	92.4	Very high	70 Å²	70	60.4 Å²	60.4	43%	0.429	31%	0.306	S	S	.	.	H	α-helix	trans	-68.1	-43.5	-178.5	51.5	0	0	0	0	112.1	E240 T241 K247 A248	E240-T244 HydrophobicContact CG-CG2 4.23Å; E240-T244 WeakPolarHBondContact O-CB 3.12Å; E240-T244 WeakPolarHBondContact O-CG2 3.02Å; E240-T244 PolarHBondContact O-N 2.85Å; E240-T244 PolarHBondContact O-OG1 3.18Å; T241-T244 WeakPolarHBondContact CA-OG1 3.43Å; T241-T244 PolarHBondContact O-N 3.42Å; T241-T244 PolarHBondContact O-OG1 2.95Å; T244-K247 PolarHBondContact O-N 3.48Å; T244-A248 WeakPolarHBondContact O-CB 3.45Å; T244-A248 PolarHBondContact O-N 2.93Å
245	E	94.2	Very high	92.5	Very high	77 Å²	77	56.4 Å²	56.4	36%	0.36	29%	0.29	S	S	.	.	H	α-helix	trans	-67.8	-43.1	177.8	-70.9	-176.1	159.7	0	0	112.5	L173 T241 K247 A248 Y249	L173-E245 HydrophobicContact CD1-CB 3.99Å; T241-E245 WeakPolarHBondContact O-CB 3.36Å; T241-E245 WeakPolarHBondContact O-CG 3.42Å; T241-E245 PolarHBondContact O-N 3.47Å; E245-K247 VanDerWaalsContact C-N 3.32Å; E245-K247 PolarHBondContact O-N 3.25Å; E245-A248 PolarHBondContact O-N 2.62Å; E245-Y249 HydrophobicContact CB-CD2 4.23Å; E245-Y249 HydrophobicContact CB-CE2 4.44Å; E245-Y249 HydrophobicContact CG-CE2 4.47Å; E245-Y249 WeakPolarHBondContact O-CB 3.49Å; E245-Y249 WeakPolarHBondContact O-CD2 3.35Å; E245-Y249 PolarHBondContact O-N 2.7Å
246	T	93.9	Very high	92.7	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.5	-42.6	176.8	-60.3	0	0	0	0	111.1	M170 F242 Y250 F251 A252 P254	M170-T246 HydrophobicContact CG-CG2 3.66Å; M170-T246 HydrophobicContact SD-CG2 3.45Å; M170-T246 WeakPolarHBondContact SD-CG2 3.41Å; F242-T246 WeakPolarHBondContact O-CB 3.21Å; F242-T246 PolarHBondContact O-N 3.24Å; F242-T246 PolarHBondContact O-OG1 3.2Å; T246-Y250 CarbonylContact O-C 3.49Å; T246-Y250 WeakPolarHBondContact O-CA 3.09Å; T246-Y250 WeakPolarHBondContact O-CB 3.46Å; T246-Y250 PolarHBondContact O-N 3.09Å; T246-F251 PolarHBondContact O-N 2.78Å; T246-A252 CarbonylContact C-O 3.58Å; T246-A252 HydrophobicContact CG2-CB 3.8Å; T246-P254 HydrophobicContact CG2-CG 4.29Å
247	K	93.6	Very high	92.8	Very high	117 Å²	117	53.4 Å²	53.4	51%	0.509	28%	0.279	S	S	.	.	H	α-helix	trans	-65.5	-41.2	174.5	-175.2	169.9	-179.5	156	0	112.3	R243 T244 E245 F251 A252 E253	R243-K247 VanDerWaalsContact O-CB 3.27Å; R243-K247 WeakPolarHBondContact O-CB 3.44Å; R243-K247 PolarHBondContact O-N 3.35Å; T244-K247 PolarHBondContact O-N 3.48Å; E245-K247 VanDerWaalsContact C-N 3.32Å; E245-K247 PolarHBondContact O-N 3.25Å; K247-F251 WeakPolarHBondContact O-CA 3.49Å; K247-F251 PolarHBondContact O-N 3.09Å; K247-A252 WeakPolarHBondContact CA-O 3.47Å; K247-A252 PolarHBondContact N-O 2.89Å; K247-E253 HydrophobicContact CD-CG 4.35Å; K247-E253 WeakPolarHBondContact CD-OE1 3.4Å; K247-E253 VanDerWaalsContact CE-OE1 3.24Å; K247-E253 WeakPolarHBondContact CE-OE1 3.48Å; K247-E253 IonicContact NZ-OE1 3.26Å; K247-E253 PolarHBondContact NZ-OE1 3.27Å
248	A	93.4	Very high	92.8	Very high	45 Å²	45	52.3 Å²	52.3	37%	0.372	27%	0.266	S	S	.	.	H	α-helix	trans	-71.6	-43.4	-177	0	0	0	0	0	113.3	R209 T244 E245	R209-A248 WeakPolarHBondContact CD-O 3.15Å; R209-A248 PolarHBondContact NE-O 2.79Å; T244-A248 WeakPolarHBondContact O-CB 3.45Å; T244-A248 PolarHBondContact O-N 2.93Å; E245-A248 PolarHBondContact O-N 2.62Å
249	Y	93.1	Very high	92.6	Very high	47 Å²	47	52.1 Å²	52.1	18%	0.184	26%	0.264	C	S	.	.	H	α-helix	trans	-92.8	-37.8	-176.2	-67.3	-63.9	0	0	0	113.3	L173 H205 K206 R209 E245	L173-Y249 HydrophobicContact CD1-CD2 4.42Å; H205-Y249 HydrophobicContact CB-CD1 3.91Å; H205-Y249 HydrophobicContact CB-CD2 4.12Å; H205-Y249 HydrophobicContact CB-CE1 4.26Å; H205-Y249 HydrophobicContact CB-CE2 4.44Å; H205-Y249 HydrophobicContact CB-CG 3.85Å; K206-Y249 HydrophobicContact CG-CE1 3.81Å; R209-Y249 WeakPolarHBondContact CA-O 3.42Å; R209-Y249 HydrophobicContact CB-CD1 4.37Å; R209-Y249 WeakPolarHBondContact CB-O 3.17Å; R209-Y249 WeakPolarHBondContact CG-O 3.29Å; E245-Y249 HydrophobicContact CB-CD2 4.23Å; E245-Y249 HydrophobicContact CB-CE2 4.44Å; E245-Y249 HydrophobicContact CG-CE2 4.47Å; E245-Y249 WeakPolarHBondContact O-CB 3.49Å; E245-Y249 WeakPolarHBondContact O-CD2 3.35Å; E245-Y249 PolarHBondContact O-N 2.7Å
250	Y	93.4	Very high	92.3	Very high	8 Å²	8	55.9 Å²	55.9	3%	0.031	28%	0.276	C	S	.	.	H	α-helix	trans	-111.4	-9.2	-169.9	-66	-85.3	0	0	0	113.9	I166 G169 M170 L173 H205 F208 T246 A252	I166-Y250 HydrophobicContact CG2-CD1 3.71Å; I166-Y250 HydrophobicContact CG2-CE1 4.02Å; I166-Y250 WeakPolarHBondContact O-CE1 3.43Å; G169-Y250 VanDerWaalsContact C-CZ 3.5Å; G169-Y250 PolarHBondContact O-OH 3.46Å; M170-Y250 HydrophobicContact CB-CD1 3.76Å; M170-Y250 HydrophobicContact CB-CD2 3.87Å; M170-Y250 HydrophobicContact CB-CE1 3.96Å; M170-Y250 HydrophobicContact CB-CE2 4.08Å; M170-Y250 HydrophobicContact CB-CG 3.71Å; M170-Y250 HydrophobicContact CG-CD1 4.5Å; M170-Y250 HydrophobicContact CG-CD2 4.05Å; M170-Y250 HydrophobicContact CG-CG 4Å; M170-Y250 HydrophobicContact SD-CG 4.41Å; L173-Y250 HydrophobicContact CD1-CD2 3.83Å; L173-Y250 HydrophobicContact CD1-CE2 3.57Å; L173-Y250 HydrophobicContact CG-CE2 4.24Å; H205-Y250 AromaticContact ND1-CE2 3.7Å; H205-Y250 AromaticContact ND1-CZ 3.69Å; H205-Y250 PolarHBondContact ND1-OH 2.93Å; F208-Y250 HydrophobicContact CB-CE1 3.77Å; F208-Y250 HydrophobicContact CD2-CE1 4.24Å; F208-Y250 WeakPolarHBondContact CD2-OH 3.45Å; F208-Y250 HydrophobicContact CG-CE1 4.17Å; T246-Y250 CarbonylContact O-C 3.49Å; T246-Y250 WeakPolarHBondContact O-CA 3.09Å; T246-Y250 WeakPolarHBondContact O-CB 3.46Å; T246-Y250 PolarHBondContact O-N 3.09Å; Y250-A252 PolarHBondContact O-N 2.97Å
251	F	90.2	Very high	92.2	Very high	70 Å²	70	53.6 Å²	53.6	31%	0.307	27%	0.265	S	S	.	.			trans	56.8	25	-173.9	-48.6	-75.2	0	0	0	113.2	R209 T212 H213 T246 K247	R209-F251 HydrophobicContact CG-CE2 4.08Å; R209-F251 HydrophobicContact CG-CZ 3.97Å; T212-F251 HydrophobicContact CG2-CD2 3.85Å; T212-F251 HydrophobicContact CG2-CE2 4.4Å; H213-F251 HydrophobicContact CB-CE2 4.13Å; H213-F251 HydrophobicContact CB-CZ 4.37Å; T246-F251 PolarHBondContact O-N 2.78Å; K247-F251 WeakPolarHBondContact O-CA 3.49Å; K247-F251 PolarHBondContact O-N 3.09Å
252	A	88.6	Confident	91.6	Very high	7 Å²	7	55.2 Å²	55.2	6%	0.058	28%	0.277	C	S	.	.			trans	-105.3	153.7	176.3	0	0	0	0	0	109.8	M170 N228 T246 K247 Y250	M170-A252 HydrophobicContact SD-CB 3.52Å; M170-A252 VanDerWaalsContact SD-CB 3.52Å; N228-A252 WeakPolarHBondContact O-CB 3.29Å; T246-A252 CarbonylContact C-O 3.58Å; T246-A252 HydrophobicContact CG2-CB 3.8Å; K247-A252 WeakPolarHBondContact CA-O 3.47Å; K247-A252 PolarHBondContact N-O 2.89Å; Y250-A252 PolarHBondContact O-N 2.97Å
253	E	86.7	Confident	91.4	Very high	84 Å²	84	56.8 Å²	56.8	39%	0.393	29%	0.291	S	S	.	.			trans	-129	111	177.4	-71	-173.4	160.2	0	0	108.8	K247 Q255	K247-E253 HydrophobicContact CD-CG 4.35Å; K247-E253 WeakPolarHBondContact CD-OE1 3.4Å; K247-E253 VanDerWaalsContact CE-OE1 3.24Å; K247-E253 WeakPolarHBondContact CE-OE1 3.48Å; K247-E253 IonicContact NZ-OE1 3.26Å; K247-E253 PolarHBondContact NZ-OE1 3.27Å; E253-Q255 PolarHBondContact O-N 3.5Å; E253-Q255 PolarHBondContact O-NE2 2.87Å
254	P	91.8	Very high	91.2	Very high	1 Å²	1	54 Å²	54	1%	0.006	28%	0.28	C	S	.	.			trans	-59.9	130.3	176.9	-23	33	0	0	0	111.6	V230 L232 F242 R243 T246	V230-P254 HydrophobicContact CB-CB 4.3Å; V230-P254 WeakPolarHBondContact O-CA 3.28Å; L232-P254 HydrophobicContact CD1-CB 3.85Å; F242-P254 HydrophobicContact CD1-CG 3.99Å; F242-P254 HydrophobicContact CE1-CB 4.3Å; F242-P254 HydrophobicContact CE1-CG 3.58Å; R243-P254 PolarHBondContact NH1-O 3.02Å; T246-P254 HydrophobicContact CG2-CG 4.29Å
255	Q	91.9	Very high	91	Very high	60 Å²	60	53 Å²	53	28%	0.28	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	132.9	-176.6	-58.9	-60	-54.1	0	0	110.6	V230 Y231 L232 E253 V257	V230-Q255 PolarHBondContact O-N 2.85Å; Y231-Q255 WeakPolarHBondContact CA-O 3.45Å; Y231-Q255 HydrophobicContact CD1-CB 3.75Å; Y231-Q255 HydrophobicContact CD1-CG 4.43Å; Y231-Q255 HydrophobicContact CE1-CB 3.85Å; Y231-Q255 HydrophobicContact CE1-CG 4.09Å; L232-Q255 PolarHBondContact N-O 3.37Å; E253-Q255 PolarHBondContact O-N 3.5Å; E253-Q255 PolarHBondContact O-NE2 2.87Å; Q255-V257 HydrophobicContact CB-CG1 4.21Å
256	S	92.6	Very high	90.8	Very high	56 Å²	56	52.6 Å²	52.6	39%	0.392	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	119.8	172.6	-62.4	0	0	0	0	109.1	L232 R243	L232-S256 CarbonylContact O-C 3.54Å; L232-S256 WeakPolarHBondContact O-CA 3.46Å; R243-S256 PolarHBondContact NH2-OG 3.2Å
257	V	92.6	Very high	90.7	Very high	22 Å²	22	58.1 Å²	58.1	13%	0.133	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	156.9	-170.2	-62.6	0	0	0	0	112.4	Y231 L232 K233 K234 Q255 F259 F264	Y231-V257 HydrophobicContact CD1-CB 4.45Å; Y231-V257 HydrophobicContact CD1-CG1 3.68Å; Y231-V257 HydrophobicContact CD1-CG2 3.94Å; Y231-V257 HydrophobicContact CE1-CG1 4.18Å; Y231-V257 HydrophobicContact CG-CG2 4.4Å; L232-V257 PolarHBondContact O-N 3.05Å; K233-V257 CarbonylContact C-O 3.45Å; K233-V257 WeakPolarHBondContact CA-O 3.33Å; K234-V257 PolarHBondContact N-O 3.46Å; Q255-V257 HydrophobicContact CB-CG1 4.21Å; V257-F259 HydrophobicContact CG2-CD1 4.17Å; V257-F259 HydrophobicContact CG2-CE1 3.73Å; V257-F259 HydrophobicContact CG2-CE2 4.22Å; V257-F259 HydrophobicContact CG2-CZ 3.77Å; V257-F264 HydrophobicContact CB-CD2 3.75Å; V257-F264 HydrophobicContact CB-CE2 3.77Å; V257-F264 HydrophobicContact CG1-CD2 3.88Å; V257-F264 HydrophobicContact CG1-CE2 3.71Å; V257-F264 HydrophobicContact CG2-CD2 4.07Å; V257-F264 HydrophobicContact CG2-CE2 3.67Å; V257-F264 HydrophobicContact CG2-CZ 4Å
258	D	91.9	Very high	90.5	Very high	64 Å²	64	52.6 Å²	52.6	34%	0.342	28%	0.278	S	S	.	.			trans	-101.3	107.9	171.1	-169.1	-11.4	0	0	0	109.3	R260 E261	D258-R260 PolarHBondContact O-N 3.19Å; D258-R260 WeakPolarHBondContact OD1-CB 3.49Å; D258-R260 PolarHBondContact OD1-N 3.12Å; D258-R260 VanDerWaalsContact OD1-N 3.07Å; D258-E261 HydrophobicContact CB-CB 4.26Å; D258-E261 WeakPolarHBondContact O-CB 3.39Å; D258-E261 PolarHBondContact O-N 3.07Å
259	F	89.8	Confident	90.5	Very high	10 Å²	10	51 Å²	51	4%	0.044	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-16.4	-178.9	-63.1	-70.9	0	0	0	113.2	K233 V257 F264 V287 M291 M294	K233-F259 HydrophobicContact CB-CD2 4.23Å; K233-F259 HydrophobicContact CB-CE2 4.03Å; K233-F259 HydrophobicContact CG-CD2 4.48Å; V257-F259 HydrophobicContact CG2-CD1 4.17Å; V257-F259 HydrophobicContact CG2-CE1 3.73Å; V257-F259 HydrophobicContact CG2-CE2 4.22Å; V257-F259 HydrophobicContact CG2-CZ 3.77Å; F259-F264 HydrophobicContact CD1-CD1 4.06Å; F259-F264 AromaticContact CD1-CE1 3.6Å; F259-F264 HydrophobicContact CD1-CE1 3.6Å; F259-F264 HydrophobicContact CD1-CZ 4.14Å; F259-F264 AromaticContact CE1-CE1 3.85Å; F259-F264 HydrophobicContact CE1-CE1 3.85Å; F259-F264 AromaticContact CE1-CZ 3.95Å; F259-F264 HydrophobicContact CE1-CZ 3.95Å; F259-V287 HydrophobicContact CD1-CG1 3.87Å; F259-V287 HydrophobicContact CE1-CG1 4.49Å; F259-M291 HydrophobicContact CD1-CB 4.49Å; F259-M291 HydrophobicContact CD2-CB 4.08Å; F259-M291 WeakPolarHBondContact CD2-O 3.42Å; F259-M291 HydrophobicContact CE2-CB 4.18Å; F259-M291 WeakPolarHBondContact CE2-O 3.5Å; F259-M291 HydrophobicContact CG-CB 4.23Å; F259-M291 HydrophobicContact CZ-CB 4.43Å; F259-M294 HydrophobicContact CE1-CB 4.25Å; F259-M294 HydrophobicContact CE1-CE 4.15Å; F259-M294 HydrophobicContact CZ-CB 4.26Å
260	R	90.2	Very high	90.4	Very high	154 Å²	154	57.8 Å²	57.8	58%	0.581	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-19.1	176.1	-63.6	174.3	175.4	-171.9	-4.6	112.6	D258 P262 P289 D290	D258-R260 PolarHBondContact O-N 3.19Å; D258-R260 WeakPolarHBondContact OD1-CB 3.49Å; D258-R260 PolarHBondContact OD1-N 3.12Å; D258-R260 VanDerWaalsContact OD1-N 3.07Å; R260-P262 VanDerWaalsContact O-CD 3.29Å; R260-P262 WeakPolarHBondContact O-CD 3.43Å; R260-P289 HydrophobicContact CG-CB 3.76Å; R260-D290 IonicContact CZ-OD1 2.7Å; R260-D290 IonicContact NE-OD1 2.78Å; R260-D290 IonicContact NH2-OD1 3.38Å; R260-D290 PolarHBondContact NH2-OD1 2.8Å
261	E	90.2	Very high	90.2	Very high	80 Å²	80	61.5 Å²	61.5	37%	0.374	30%	0.303	S	S	.	.			trans	-76.2	116.5	-179.9	-169.3	-169.7	170.2	0	0	109.6	D258 A263 F264 K267	D258-E261 HydrophobicContact CB-CB 4.26Å; D258-E261 WeakPolarHBondContact O-CB 3.39Å; D258-E261 PolarHBondContact O-N 3.07Å; E261-A263 HydrophobicContact CG-CB 4.07Å; E261-A263 PolarHBondContact O-N 3.02Å; E261-A263 VanDerWaalsContact O-N 3.1Å; E261-A263 WeakPolarHBondContact OE1-CB 3.32Å; E261-F264 WeakPolarHBondContact O-CB 3.41Å; E261-F264 PolarHBondContact O-N 2.79Å; E261-K267 IonicContact OE1-NZ 3.28Å; E261-K267 PolarHBondContact OE1-NZ 2.84Å; E261-K267 IonicContact OE2-NZ 2.66Å
262	P	83	Confident	90.2	Very high	117 Å²	117	58.2 Å²	58.2	76%	0.76	29%	0.288	S	S	*	.	H	α-helix	trans	-60.5	-27.2	179.4	-24.2	35	0	0	0	113.1	R260 F264 L265	R260-P262 VanDerWaalsContact O-CD 3.29Å; R260-P262 WeakPolarHBondContact O-CD 3.43Å; P262-F264 PolarHBondContact O-N 2.9Å; P262-L265 PolarHBondContact O-N 2.89Å
263	A	89	Confident	90.4	Very high	35 Å²	35	61.3 Å²	61.3	29%	0.289	30%	0.302	S	S	.	.	H	α-helix	trans	-70	-15	175.8	0	0	0	0	0	113.5	E261 S266 K267	E261-A263 HydrophobicContact CG-CB 4.07Å; E261-A263 PolarHBondContact O-N 3.02Å; E261-A263 VanDerWaalsContact O-N 3.1Å; E261-A263 WeakPolarHBondContact OE1-CB 3.32Å; A263-S266 PolarHBondContact O-OG 2.98Å; A263-S266 VanDerWaalsContact O-OG 3.04Å; A263-K267 WeakPolarHBondContact O-CB 3.42Å; A263-K267 WeakPolarHBondContact O-CD 3.33Å; A263-K267 WeakPolarHBondContact O-CG 2.95Å; A263-K267 PolarHBondContact O-N 3.43Å
264	F	90.5	Very high	90.5	Very high	9 Å²	9	65.6 Å²	65.6	4%	0.039	32%	0.319	C	S	.	.	H	α-helix	trans	-59.8	-47.3	172.2	166.5	-113.7	0	0	0	111.1	Y231 V257 F259 E261 P262 S266 K267 A268 V287 M294	Y231-F264 AromaticContact CD1-CE2 3.62Å; Y231-F264 HydrophobicContact CD1-CE2 3.62Å; Y231-F264 AromaticContact CD1-CZ 3.92Å; Y231-F264 HydrophobicContact CD1-CZ 3.92Å; Y231-F264 AromaticContact CE1-CE2 3.78Å; Y231-F264 HydrophobicContact CE1-CE2 3.78Å; Y231-F264 HydrophobicContact CE1-CZ 4.28Å; Y231-F264 HydrophobicContact CG-CE2 4.3Å; Y231-F264 HydrophobicContact CG-CZ 4.13Å; V257-F264 HydrophobicContact CB-CD2 3.75Å; V257-F264 HydrophobicContact CB-CE2 3.77Å; V257-F264 HydrophobicContact CG1-CD2 3.88Å; V257-F264 HydrophobicContact CG1-CE2 3.71Å; V257-F264 HydrophobicContact CG2-CD2 4.07Å; V257-F264 HydrophobicContact CG2-CE2 3.67Å; V257-F264 HydrophobicContact CG2-CZ 4Å; F259-F264 HydrophobicContact CD1-CD1 4.06Å; F259-F264 AromaticContact CD1-CE1 3.6Å; F259-F264 HydrophobicContact CD1-CE1 3.6Å; F259-F264 HydrophobicContact CD1-CZ 4.14Å; F259-F264 AromaticContact CE1-CE1 3.85Å; F259-F264 HydrophobicContact CE1-CE1 3.85Å; F259-F264 AromaticContact CE1-CZ 3.95Å; F259-F264 HydrophobicContact CE1-CZ 3.95Å; E261-F264 WeakPolarHBondContact O-CB 3.41Å; E261-F264 PolarHBondContact O-N 2.79Å; P262-F264 PolarHBondContact O-N 2.9Å; F264-S266 VanDerWaalsContact C-N 3.35Å; F264-S266 PolarHBondContact O-N 3.12Å; F264-K267 PolarHBondContact O-N 3.46Å; F264-A268 HydrophobicContact CE2-CB 4.09Å; F264-A268 HydrophobicContact CZ-CB 4.19Å; F264-A268 WeakPolarHBondContact O-CB 3.2Å; F264-A268 PolarHBondContact O-N 3.3Å; F264-V287 HydrophobicContact CE1-CG1 4.35Å; F264-V287 HydrophobicContact CE1-CG2 4.21Å; F264-M294 HydrophobicContact CE1-CE 4.02Å; F264-M294 HydrophobicContact CZ-CE 3.58Å
265	L	89.8	Confident	90.2	Very high	49 Å²	49	69.2 Å²	69.2	26%	0.257	34%	0.338	S	S	.	.	H	α-helix	trans	-60	-45.3	-177.2	-173.6	151.4	0	0	0	111.3	P262 A268 N269 L284 K285 V287	P262-L265 PolarHBondContact O-N 2.89Å; L265-A268 PolarHBondContact O-N 2.89Å; L265-N269 WeakPolarHBondContact CD2-ND2 3.5Å; L265-N269 WeakPolarHBondContact O-CB 3.35Å; L265-N269 PolarHBondContact O-N 3.4Å; L265-L284 HydrophobicContact CG-CB 4.44Å; L265-K285 WeakPolarHBondContact CD1-O 3.45Å; L265-V287 HydrophobicContact CD1-CG2 4.32Å
266	S	90.7	Very high	89.9	Confident	69 Å²	69	66.3 Å²	66.3	48%	0.483	32%	0.324	S	S	.	.	H	α-helix	trans	-67.5	-38.9	177.6	64.1	0	0	0	0	112.5	A263 F264 R270	A263-S266 PolarHBondContact O-OG 2.98Å; A263-S266 VanDerWaalsContact O-OG 3.04Å; F264-S266 VanDerWaalsContact C-N 3.35Å; F264-S266 PolarHBondContact O-N 3.12Å; S266-R270 VanDerWaalsContact O-CB 3.24Å; S266-R270 WeakPolarHBondContact O-CB 3.41Å; S266-R270 PolarHBondContact O-N 2.83Å
267	K	91.5	Very high	89.5	Confident	116 Å²	116	71 Å²	71	50%	0.504	34%	0.338	S	S	.	.	H	α-helix	trans	-62.6	-44.6	173.9	-72.2	166	-170	164	0	111.5	E261 A263 F264 R271	E261-K267 IonicContact OE1-NZ 3.28Å; E261-K267 PolarHBondContact OE1-NZ 2.84Å; E261-K267 IonicContact OE2-NZ 2.66Å; A263-K267 WeakPolarHBondContact O-CB 3.42Å; A263-K267 WeakPolarHBondContact O-CD 3.33Å; A263-K267 WeakPolarHBondContact O-CG 2.95Å; A263-K267 PolarHBondContact O-N 3.43Å; F264-K267 PolarHBondContact O-N 3.46Å; K267-R271 WeakPolarHBondContact O-CB 3.27Å; K267-R271 PolarHBondContact O-N 2.95Å
268	A	89.9	Confident	89.1	Confident	2 Å²	2	71.1 Å²	71.1	2%	0.017	34%	0.343	C	S	.	.	H	α-helix	trans	-65.2	-47.9	179.2	0	0	0	0	0	111.4	F264 L265 R270 R271 I272 L284	F264-A268 HydrophobicContact CE2-CB 4.09Å; F264-A268 HydrophobicContact CZ-CB 4.19Å; F264-A268 WeakPolarHBondContact O-CB 3.2Å; F264-A268 PolarHBondContact O-N 3.3Å; L265-A268 PolarHBondContact O-N 2.89Å; A268-R270 PolarHBondContact O-N 3.22Å; A268-R271 WeakPolarHBondContact O-CB 3.31Å; A268-R271 PolarHBondContact O-N 3.19Å; A268-I272 WeakPolarHBondContact O-CG1 3.26Å; A268-I272 PolarHBondContact O-N 3.39Å; A268-L284 HydrophobicContact CB-CD1 3.8Å
269	N	92.3	Very high	88.8	Confident	10 Å²	10	71.1 Å²	71.1	5%	0.053	34%	0.343	C	S	.	.	H	α-helix	trans	-60.7	-45.4	176.1	-78.3	-19	0	0	0	111.9	L265 R271 I272 E273 P283 L284	L265-N269 WeakPolarHBondContact CD2-ND2 3.5Å; L265-N269 WeakPolarHBondContact O-CB 3.35Å; L265-N269 PolarHBondContact O-N 3.4Å; N269-R271 VanDerWaalsContact C-N 3.28Å; N269-R271 PolarHBondContact O-N 2.82Å; N269-I272 PolarHBondContact O-N 3.49Å; N269-E273 WeakPolarHBondContact O-CB 3.23Å; N269-E273 PolarHBondContact O-N 3.18Å; N269-P283 VanDerWaalsContact OD1-CD 3.31Å; N269-P283 WeakPolarHBondContact OD1-CD 3.2Å; N269-L284 PolarHBondContact ND2-O 3.4Å; N269-L284 VanDerWaalsContact OD1-CB 3.31Å; N269-L284 WeakPolarHBondContact OD1-CB 3.46Å; N269-L284 PolarHBondContact OD1-N 2.99Å; N269-L284 VanDerWaalsContact OD1-N 3.08Å
270	R	91.7	Very high	88.5	Confident	191 Å²	191	70.7 Å²	70.7	72%	0.721	34%	0.341	S	S	*	.	H	α-helix	trans	-61.7	-35.7	176.3	-174.3	178.2	-179.1	-172.5	1.7	112.3	S266 A268 K274	S266-R270 VanDerWaalsContact O-CB 3.24Å; S266-R270 WeakPolarHBondContact O-CB 3.41Å; S266-R270 PolarHBondContact O-N 2.83Å; A268-R270 PolarHBondContact O-N 3.22Å; R270-K274 VanDerWaalsContact O-CB 3.29Å; R270-K274 WeakPolarHBondContact O-CB 3.45Å; R270-K274 PolarHBondContact O-N 2.87Å
271	R	90.2	Very high	88.1	Confident	86 Å²	86	69.9 Å²	69.9	33%	0.325	34%	0.342	S	S	.	.	H	α-helix	trans	-66.6	-47.3	175.3	178.1	178	167.9	93.5	0.2	111.1	D229 K267 A268 N269 E273 K274 L275	D229-R271 IonicContact OD1-CZ 2.83Å; D229-R271 IonicContact OD1-NE 2.82Å; D229-R271 PolarHBondContact OD1-NE 3.07Å; D229-R271 IonicContact OD1-NH2 3.84Å; D229-R271 PolarHBondContact OD1-NH2 2.93Å; D229-R271 WeakPolarHBondContact OD2-CD 3.37Å; D229-R271 IonicContact OD2-CZ 3.14Å; D229-R271 IonicContact OD2-NE 3.91Å; D229-R271 PolarHBondContact OD2-NE 2.6Å; D229-R271 IonicContact OD2-NH2 3.1Å; K267-R271 WeakPolarHBondContact O-CB 3.27Å; K267-R271 PolarHBondContact O-N 2.95Å; A268-R271 WeakPolarHBondContact O-CB 3.31Å; A268-R271 PolarHBondContact O-N 3.19Å; N269-R271 VanDerWaalsContact C-N 3.28Å; N269-R271 PolarHBondContact O-N 2.82Å; R271-E273 VanDerWaalsContact C-N 3.33Å; R271-E273 PolarHBondContact O-N 3.42Å; R271-K274 PolarHBondContact O-N 2.9Å; R271-L275 HydrophobicContact CG-CD1 4.08Å; R271-L275 WeakPolarHBondContact O-CG 3.28Å; R271-L275 PolarHBondContact O-N 3.34Å
272	I	89.9	Confident	87.7	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-61.3	-45.5	177.4	-64.1	161	0	0	0	110.1	V227 A268 N269 K274 L275 T276 I280 P283 L284 L296 Y298	V227-I272 HydrophobicContact CG1-CG1 4.28Å; V227-I272 HydrophobicContact CG2-CG2 4.36Å; A268-I272 WeakPolarHBondContact O-CG1 3.26Å; A268-I272 PolarHBondContact O-N 3.39Å; N269-I272 PolarHBondContact O-N 3.49Å; I272-K274 PolarHBondContact O-N 2.8Å; I272-L275 PolarHBondContact O-N 2.79Å; I272-T276 HydrophobicContact CG2-CG2 4.22Å; I272-T276 WeakPolarHBondContact O-CB 3.13Å; I272-T276 VanDerWaalsContact O-CG2 3.25Å; I272-T276 WeakPolarHBondContact O-CG2 3.37Å; I272-T276 PolarHBondContact O-N 3.44Å; I272-T276 PolarHBondContact O-OG1 3.26Å; I272-I280 HydrophobicContact CG2-CB 4.21Å; I272-I280 HydrophobicContact CG2-CG2 4.02Å; I272-P283 HydrophobicContact CB-CG 4.32Å; I272-P283 HydrophobicContact CD1-CG 3.61Å; I272-P283 HydrophobicContact CG2-CG 3.95Å; I272-L284 HydrophobicContact CD1-CD1 4.38Å; I272-L296 HydrophobicContact CD1-CD1 4.19Å; I272-Y298 HydrophobicContact CD1-CD2 3.94Å; I272-Y298 HydrophobicContact CD1-CE2 3.52Å; I272-Y298 HydrophobicContact CG1-CD2 4.27Å; I272-Y298 HydrophobicContact CG1-CE2 4.33Å; I272-Y298 HydrophobicContact CG2-CD2 4.32Å; I272-Y298 HydrophobicContact CG2-CG 4.3Å
273	E	91.6	Very high	87.6	Confident	73 Å²	73	67.9 Å²	67.9	34%	0.341	32%	0.323	S	S	.	.	H	α-helix	trans	-59.1	-46.1	176.6	-170	-177.1	-168	0	0	111.3	N269 R271 L275 T276 K277 G278 I280	N269-E273 WeakPolarHBondContact O-CB 3.23Å; N269-E273 PolarHBondContact O-N 3.18Å; R271-E273 VanDerWaalsContact C-N 3.33Å; R271-E273 PolarHBondContact O-N 3.42Å; E273-L275 PolarHBondContact O-N 3.41Å; E273-T276 CarbonylContact O-C 3.19Å; E273-T276 PolarHBondContact O-N 3.15Å; E273-T276 PolarHBondContact O-OG1 3.45Å; E273-K277 CarbonylContact O-C 3.59Å; E273-K277 WeakPolarHBondContact O-CA 3.44Å; E273-K277 PolarHBondContact O-N 3.07Å; E273-G278 PolarHBondContact O-N 2.88Å; E273-I280 WeakPolarHBondContact CA-O 3.13Å
274	K	89.8	Confident	87.5	Confident	173 Å²	173	66.3 Å²	66.3	75%	0.752	31%	0.31	S	S	*	.	H	α-helix	trans	-62.1	-45.8	177.9	-174.3	-178.3	179.4	-178.9	0	112.3	R270 R271 I272 T276 K277	R270-K274 VanDerWaalsContact O-CB 3.29Å; R270-K274 WeakPolarHBondContact O-CB 3.45Å; R270-K274 PolarHBondContact O-N 2.87Å; R271-K274 PolarHBondContact O-N 2.9Å; I272-K274 PolarHBondContact O-N 2.8Å; K274-T276 VanDerWaalsContact C-N 3.29Å; K274-T276 PolarHBondContact O-N 2.97Å; K274-K277 PolarHBondContact O-N 3.21Å
275	L	85.6	Confident	87.3	Confident	77 Å²	77	75.1 Å²	75.1	40%	0.403	35%	0.348	S	S	.	.	H	α-helix	trans	-68.6	-31.2	-179.4	-70	176.7	0	0	0	112.2	V227 R271 I272 E273 K277	V227-L275 HydrophobicContact CB-CD1 4.49Å; V227-L275 HydrophobicContact CG1-CD1 3.89Å; V227-L275 HydrophobicContact CG2-CB 3.65Å; V227-L275 HydrophobicContact CG2-CD1 3.93Å; V227-L275 HydrophobicContact CG2-CG 4.46Å; R271-L275 HydrophobicContact CG-CD1 4.08Å; R271-L275 WeakPolarHBondContact O-CG 3.28Å; R271-L275 PolarHBondContact O-N 3.34Å; I272-L275 PolarHBondContact O-N 2.79Å; E273-L275 PolarHBondContact O-N 3.41Å; L275-K277 VanDerWaalsContact C-N 3.34Å
276	T	84.7	Confident	87.2	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	4.7	175.7	63.9	0	0	0	0	112.8	V227 I272 E273 K274 G278 L279 I280	V227-T276 HydrophobicContact CG2-CG2 3.88Å; I272-T276 HydrophobicContact CG2-CG2 4.22Å; I272-T276 WeakPolarHBondContact O-CB 3.13Å; I272-T276 VanDerWaalsContact O-CG2 3.25Å; I272-T276 WeakPolarHBondContact O-CG2 3.37Å; I272-T276 PolarHBondContact O-N 3.44Å; I272-T276 PolarHBondContact O-OG1 3.26Å; E273-T276 CarbonylContact O-C 3.19Å; E273-T276 PolarHBondContact O-N 3.15Å; E273-T276 PolarHBondContact O-OG1 3.45Å; K274-T276 VanDerWaalsContact C-N 3.29Å; K274-T276 PolarHBondContact O-N 2.97Å; T276-G278 VanDerWaalsContact C-N 3.29Å; T276-G278 PolarHBondContact O-N 3.2Å; T276-L279 VanDerWaalsContact O-CB 3.23Å; T276-L279 WeakPolarHBondContact O-CB 3.3Å; T276-L279 WeakPolarHBondContact O-CD1 3.28Å; T276-L279 WeakPolarHBondContact O-CG 3.4Å; T276-L279 PolarHBondContact O-N 3.23Å; T276-I280 HydrophobicContact CG2-CB 4.05Å; T276-I280 HydrophobicContact CG2-CD1 3.88Å; T276-I280 HydrophobicContact CG2-CG1 3.95Å; T276-I280 PolarHBondContact OG1-N 3.02Å
277	K	85.1	Confident	87.1	Confident	154 Å²	154	74.8 Å²	74.8	67%	0.67	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	39.4	-178	-57.7	-171.5	173.9	-166.9	0	114	E273 K274 L275 L279	E273-K277 CarbonylContact O-C 3.59Å; E273-K277 WeakPolarHBondContact O-CA 3.44Å; E273-K277 PolarHBondContact O-N 3.07Å; K274-K277 PolarHBondContact O-N 3.21Å; L275-K277 VanDerWaalsContact C-N 3.34Å; K277-L279 VanDerWaalsContact C-N 3.34Å
278	G	84.4	Confident	87	Confident	25 Å²	25	73.3 Å²	73.3	26%	0.258	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	4.5	178.8	0	0	0	0	0	114.9	E273 T276 K281	E273-G278 PolarHBondContact O-N 2.88Å; T276-G278 VanDerWaalsContact C-N 3.29Å; T276-G278 PolarHBondContact O-N 3.2Å; G278-K281 VanDerWaalsContact O-CE 3.25Å; G278-K281 WeakPolarHBondContact O-CE 3.38Å
279	L	83.9	Confident	87	Confident	64 Å²	64	76.1 Å²	76.1	34%	0.335	36%	0.364	S	S	.	.	S	Bend	trans	-81.1	-32	-175.4	-63.6	167.4	0	0	0	112.8	T223 T276 K277 Y300	T223-L279 HydrophobicContact CG2-CD1 4.07Å; T276-L279 VanDerWaalsContact O-CB 3.23Å; T276-L279 WeakPolarHBondContact O-CB 3.3Å; T276-L279 WeakPolarHBondContact O-CD1 3.28Å; T276-L279 WeakPolarHBondContact O-CG 3.4Å; T276-L279 PolarHBondContact O-N 3.23Å; K277-L279 VanDerWaalsContact C-N 3.34Å; L279-Y300 HydrophobicContact CB-CD1 4.38Å; L279-Y300 HydrophobicContact CB-CD2 3.83Å; L279-Y300 HydrophobicContact CB-CE2 4.02Å; L279-Y300 HydrophobicContact CB-CG 4.03Å; L279-Y300 HydrophobicContact CD1-CD1 3.57Å; L279-Y300 HydrophobicContact CD1-CD2 4.5Å; L279-Y300 HydrophobicContact CD1-CE1 3.57Å; L279-Y300 HydrophobicContact CD1-CG 4.06Å; L279-Y300 HydrophobicContact CD2-CE1 4.15Å; L279-Y300 HydrophobicContact CD2-CE2 4.16Å; L279-Y300 HydrophobicContact CG-CD1 4.45Å; L279-Y300 HydrophobicContact CG-CE1 4.3Å; L279-Y300 HydrophobicContact CG-CE2 4.46Å
280	I	83.6	Confident	86.8	Confident	0 Å²	0	80.1 Å²	80.1	0%	0	39%	0.386	C	S	.	.	S	Bend	trans	-113.7	114.5	173.1	-56.9	-176	0	0	0	107.5	I272 E273 T276 P283 Y298	I272-I280 HydrophobicContact CG2-CB 4.21Å; I272-I280 HydrophobicContact CG2-CG2 4.02Å; E273-I280 WeakPolarHBondContact CA-O 3.13Å; T276-I280 HydrophobicContact CG2-CB 4.05Å; T276-I280 HydrophobicContact CG2-CD1 3.88Å; T276-I280 HydrophobicContact CG2-CG1 3.95Å; T276-I280 PolarHBondContact OG1-N 3.02Å; I280-P283 HydrophobicContact CG2-CB 3.94Å; I280-P283 HydrophobicContact CG2-CG 3.91Å; I280-Y298 HydrophobicContact CD1-CD1 4.46Å; I280-Y298 HydrophobicContact CG2-CD1 4.32Å
281	K	82.8	Confident	86.7	Confident	137 Å²	137	71.8 Å²	71.8	60%	0.596	36%	0.355	S	S	*	.			trans	-112.1	129.3	-176.7	-63.5	-176.3	178.5	-178	0	109.9	G278 P283	G278-K281 VanDerWaalsContact O-CE 3.25Å; G278-K281 WeakPolarHBondContact O-CE 3.38Å; K281-P283 VanDerWaalsContact C-CD 3.48Å
282	E	81.6	Confident	86.8	Confident	148 Å²	148	69.3 Å²	69.3	69%	0.692	35%	0.349	S	S	*	.			trans	46.4	50.7	173.7	-57.4	-173.7	155	0	0	116	L284	E282-L284 PolarHBondContact O-N 3.39Å
283	P	81.5	Confident	87	Confident	8 Å²	8	69.3 Å²	69.3	5%	0.052	35%	0.349	C	S	.	.			trans	-69.6	-20.9	-177.3	29.4	-36.8	0	0	0	113.9	N269 I272 I280 K281 Y298 K444 Q446	N269-P283 VanDerWaalsContact OD1-CD 3.31Å; N269-P283 WeakPolarHBondContact OD1-CD 3.2Å; I272-P283 HydrophobicContact CB-CG 4.32Å; I272-P283 HydrophobicContact CD1-CG 3.61Å; I272-P283 HydrophobicContact CG2-CG 3.95Å; I280-P283 HydrophobicContact CG2-CB 3.94Å; I280-P283 HydrophobicContact CG2-CG 3.91Å; K281-P283 VanDerWaalsContact C-CD 3.48Å; P283-Y298 HydrophobicContact CB-CD1 4.03Å; P283-Y298 HydrophobicContact CB-CE1 3.31Å; P283-Y298 HydrophobicContact CG-CD1 4.32Å; P283-Y298 HydrophobicContact CG-CE1 3.8Å; P283-Y298 HydrophobicContact CG-CE2 4.41Å; P283-K444 PolarHBondContact O-NZ 3.24Å; P283-Q446 VanDerWaalsContact CB-OE1 3.29Å
284	L	86.6	Confident	87.1	Confident	2 Å²	2	65.8 Å²	65.8	1%	0.01	33%	0.333	C	S	.	.			trans	-97.7	113.3	175.4	-56.7	174.2	0	0	0	109.6	L265 A268 N269 I272 E282 L296 Y298 W442 K444	L265-L284 HydrophobicContact CG-CB 4.44Å; A268-L284 HydrophobicContact CB-CD1 3.8Å; N269-L284 PolarHBondContact ND2-O 3.4Å; N269-L284 VanDerWaalsContact OD1-CB 3.31Å; N269-L284 WeakPolarHBondContact OD1-CB 3.46Å; N269-L284 PolarHBondContact OD1-N 2.99Å; N269-L284 VanDerWaalsContact OD1-N 3.08Å; I272-L284 HydrophobicContact CD1-CD1 4.38Å; E282-L284 PolarHBondContact O-N 3.39Å; L284-L296 HydrophobicContact CD1-CD1 3.85Å; L284-L296 HydrophobicContact CD2-CD1 4.29Å; L284-L296 HydrophobicContact CD2-CD2 4.03Å; L284-Y298 WeakPolarHBondContact CD2-OH 3.05Å; L284-W442 HydrophobicContact CD2-CH2 3.88Å; L284-W442 HydrophobicContact CD2-CZ3 3.92Å; L284-K444 HydrophobicContact CD2-CD 3.94Å
285	K	87.1	Confident	87.4	Confident	194 Å²	194	57.6 Å²	57.6	84%	0.843	30%	0.297	S	S	*	.	S	Bend	trans	-91	-39.7	176.5	-64.8	-175.8	179.1	178.9	0	112.7	L265	L265-K285 WeakPolarHBondContact CD1-O 3.45Å
286	S	87.2	Confident	87.8	Confident	86 Å²	86	53.9 Å²	53.9	60%	0.601	28%	0.278	S	S	*	.			trans	-147.1	157.6	177.3	56.3	0	0	0	0	109.2	W442	S286-W442 WeakPolarHBondContact O-CH2 3.48Å
287	V	89	Confident	88.2	Confident	25 Å²	25	54 Å²	54	15%	0.152	28%	0.278	C	S	.	.			trans	-137.7	138.5	174.3	-172.6	0	0	0	0	106.7	F259 F264 L265 P289 M291 M294 W442	F259-V287 HydrophobicContact CD1-CG1 3.87Å; F259-V287 HydrophobicContact CE1-CG1 4.49Å; F264-V287 HydrophobicContact CE1-CG1 4.35Å; F264-V287 HydrophobicContact CE1-CG2 4.21Å; L265-V287 HydrophobicContact CD1-CG2 4.32Å; V287-P289 WeakPolarHBondContact O-CD 3.47Å; V287-M291 HydrophobicContact CG1-SD 3.62Å; V287-M294 HydrophobicContact CG1-SD 4.42Å; V287-W442 HydrophobicContact CG1-CZ3 4.36Å; V287-W442 HydrophobicContact CG2-CZ3 4.12Å
288	D	89.3	Confident	88.6	Confident	84 Å²	84	46.6 Å²	46.6	45%	0.449	25%	0.246	S	C	.	.			trans	-71.3	122.8	174.5	175.7	-4.3	0	0	0	109.3	D290 M291	D288-D290 PolarHBondContact O-N 3.29Å; D288-D290 VanDerWaalsContact O-N 3.16Å; D288-D290 PolarHBondContact OD1-N 3.2Å; D288-M291 HydrophobicContact CB-CE 3.67Å; D288-M291 HydrophobicContact CB-CG 3.84Å; D288-M291 HydrophobicContact CB-SD 4.29Å; D288-M291 WeakPolarHBondContact O-CB 3.48Å; D288-M291 VanDerWaalsContact O-CG 3.28Å; D288-M291 WeakPolarHBondContact O-CG 3.24Å; D288-M291 PolarHBondContact O-N 2.75Å
289	P	88.7	Confident	89	Confident	61 Å²	61	45.4 Å²	45.4	40%	0.396	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-18	-178.4	-19.3	30.8	0	0	0	115	R260 V287	R260-P289 HydrophobicContact CG-CB 3.76Å; V287-P289 WeakPolarHBondContact O-CD 3.47Å
290	D	88.6	Confident	89.5	Confident	94 Å²	94	43 Å²	43	50%	0.503	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	1.5	-178.8	-69.6	-38	0	0	0	113.9	R260 D288	R260-D290 IonicContact CZ-OD1 2.7Å; R260-D290 IonicContact NE-OD1 2.78Å; R260-D290 IonicContact NH2-OD1 3.38Å; R260-D290 PolarHBondContact NH2-OD1 2.8Å; D288-D290 PolarHBondContact O-N 3.29Å; D288-D290 VanDerWaalsContact O-N 3.16Å; D288-D290 PolarHBondContact OD1-N 3.2Å
291	M	90.6	Very high	90	Very high	17 Å²	17	43 Å²	43	8%	0.084	22%	0.221	C	C	.	.			trans	-54	145.4	172.5	-69.9	-177	177.1	0	0	112.4	F259 V287 D288 N441 W442	F259-M291 HydrophobicContact CD1-CB 4.49Å; F259-M291 HydrophobicContact CD2-CB 4.08Å; F259-M291 WeakPolarHBondContact CD2-O 3.42Å; F259-M291 HydrophobicContact CE2-CB 4.18Å; F259-M291 WeakPolarHBondContact CE2-O 3.5Å; F259-M291 HydrophobicContact CG-CB 4.23Å; F259-M291 HydrophobicContact CZ-CB 4.43Å; V287-M291 HydrophobicContact CG1-SD 3.62Å; D288-M291 HydrophobicContact CB-CE 3.67Å; D288-M291 HydrophobicContact CB-CG 3.84Å; D288-M291 HydrophobicContact CB-SD 4.29Å; D288-M291 WeakPolarHBondContact O-CB 3.48Å; D288-M291 VanDerWaalsContact O-CG 3.28Å; D288-M291 WeakPolarHBondContact O-CG 3.24Å; D288-M291 PolarHBondContact O-N 2.75Å; M291-N441 HydrophobicContact CB-CB 4.3Å; M291-N441 HydrophobicContact CG-CB 3.99Å; M291-W442 HydrophobicContact CE-CB 3.71Å; M291-W442 HydrophobicContact CE-CD2 3.8Å; M291-W442 HydrophobicContact CE-CE3 3.65Å; M291-W442 HydrophobicContact CE-CG 3.88Å; M291-W442 HydrophobicContact CE-CZ3 4.42Å; M291-W442 HydrophobicContact SD-CB 3.98Å; M291-W442 HydrophobicContact SD-CD2 4.42Å; M291-W442 HydrophobicContact SD-CE3 3.84Å
292	V	91.4	Very high	90.5	Very high	33 Å²	33	38.8 Å²	38.8	20%	0.2	20%	0.202	C	C	.	.	S	Bend	trans	-109.9	-44.8	176.8	-172.1	0	0	0	0	110.6	L232 K233 V236 V438 N441	L232-V292 CarbonylContact C-O 3.55Å; L232-V292 WeakPolarHBondContact CA-O 3.26Å; K233-V292 HydrophobicContact CB-CG1 4.45Å; K233-V292 PolarHBondContact N-O 2.97Å; V236-V292 HydrophobicContact CG2-CG1 3.93Å; V292-V438 HydrophobicContact CB-CG1 4.41Å; V292-V438 HydrophobicContact CG1-CB 4.25Å; V292-V438 HydrophobicContact CG1-CG1 3.74Å; V292-V438 HydrophobicContact CG1-CG2 3.95Å; V292-N441 WeakPolarHBondContact CA-OD1 3.33Å; V292-N441 WeakPolarHBondContact CB-OD1 3.49Å; V292-N441 PolarHBondContact N-OD1 3.12Å
293	L	93.5	Very high	90.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	128.4	-179.8	174.5	71.4	0	0	0	110.5	M171 V230 Y231 L232 F430 M433 V438 A439 L440 N441 W442	M171-L293 HydrophobicContact CE-CD1 4.39Å; M171-L293 HydrophobicContact CE-CD2 3.75Å; V230-L293 HydrophobicContact CG1-CD1 3.61Å; Y231-L293 WeakPolarHBondContact O-CA 3.44Å; L232-L293 HydrophobicContact CD1-CD1 4.29Å; L232-L293 HydrophobicContact CD2-CD1 4.17Å; L232-L293 HydrophobicContact CG-CD1 3.76Å; L293-F430 HydrophobicContact CD2-CE1 3.96Å; L293-F430 HydrophobicContact CD2-CZ 3.97Å; L293-M433 HydrophobicContact CD1-CE 4.31Å; L293-M433 HydrophobicContact CD1-SD 4.3Å; L293-M433 HydrophobicContact CD2-CE 4.02Å; L293-V438 HydrophobicContact CB-CG1 3.68Å; L293-V438 HydrophobicContact CD2-CG1 4.09Å; L293-V438 HydrophobicContact CG-CG1 4.47Å; L293-A439 WeakPolarHBondContact CB-O 3.29Å; L293-L440 HydrophobicContact CD2-CB 3.94Å; L293-L440 HydrophobicContact CD2-CD1 3.89Å; L293-L440 HydrophobicContact CG-CD1 3.76Å; L293-N441 PolarHBondContact N-OD1 3.35Å; L293-N441 VanDerWaalsContact N-OD1 3.14Å; L293-N441 PolarHBondContact O-N 2.74Å; L293-W442 PolarHBondContact O-N 3.4Å
294	M	94.3	Very high	91.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	127.2	177.9	175.3	-179	73.8	0	0	109.7	Y231 F259 F264 V287 L296 W442	Y231-M294 HydrophobicContact CD2-CE 3.38Å; Y231-M294 HydrophobicContact CE2-CE 4.1Å; Y231-M294 HydrophobicContact CG-CE 3.69Å; Y231-M294 PolarHBondContact N-O 3.23Å; Y231-M294 PolarHBondContact O-N 3.27Å; F259-M294 HydrophobicContact CE1-CB 4.25Å; F259-M294 HydrophobicContact CE1-CE 4.15Å; F259-M294 HydrophobicContact CZ-CB 4.26Å; F264-M294 HydrophobicContact CE1-CE 4.02Å; F264-M294 HydrophobicContact CZ-CE 3.58Å; V287-M294 HydrophobicContact CG1-SD 4.42Å; M294-L296 HydrophobicContact CE-CD1 3.72Å; M294-L296 HydrophobicContact CE-CD2 4.15Å; M294-L296 HydrophobicContact CE-CG 3.9Å; M294-L296 HydrophobicContact CG-CD2 3.78Å; M294-L296 HydrophobicContact CG-CG 4.09Å; M294-L296 HydrophobicContact SD-CD1 4.4Å; M294-L296 HydrophobicContact SD-CD2 3.79Å; M294-L296 HydrophobicContact SD-CG 4.19Å; M294-W442 WeakPolarHBondContact CA-O 3.24Å; M294-W442 HydrophobicContact CG-CB 4.19Å; M294-W442 HydrophobicContact CG-CD2 4.48Å; M294-W442 HydrophobicContact CG-CE3 3.87Å; M294-W442 HydrophobicContact SD-CD2 4.42Å; M294-W442 HydrophobicContact SD-CE3 3.33Å; M294-W442 HydrophobicContact SD-CZ3 3.68Å
295	L	95.1	Very high	91.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122	174	179	60.3	0	0	0	109.5	A167 M168 M170 M171 V230 L440 W442 L443 K444	A167-L295 HydrophobicContact CB-CD1 4.35Å; A167-L295 HydrophobicContact CB-CD2 3.91Å; A167-L295 HydrophobicContact CB-CG 4.43Å; M168-L295 HydrophobicContact SD-CD2 4.37Å; M170-L295 HydrophobicContact CE-CD1 3.71Å; M171-L295 HydrophobicContact CG-CD2 3.57Å; M171-L295 HydrophobicContact SD-CD1 4.29Å; M171-L295 HydrophobicContact SD-CD2 4.17Å; V230-L295 HydrophobicContact CG2-CD1 3.93Å; L295-L440 HydrophobicContact CB-CD1 3.85Å; L295-W442 PolarHBondContact N-O 2.96Å; L295-L443 HydrophobicContact CB-CD1 3.71Å; L295-L443 HydrophobicContact CD2-CD1 3.27Å; L295-L443 HydrophobicContact CG-CD1 3.51Å; L295-K444 PolarHBondContact O-N 2.95Å
296	L	93.9	Very high	92.1	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	123.7	-179.5	-66	-169.3	0	0	0	110.6	N228 D229 Y231 I272 L284 M294 Y298 K444	N228-L296 WeakPolarHBondContact CA-O 3.38Å; D229-L296 PolarHBondContact N-O 3.47Å; D229-L296 PolarHBondContact O-N 3.46Å; Y231-L296 HydrophobicContact CD2-CD1 4.03Å; Y231-L296 HydrophobicContact CD2-CG 4.24Å; Y231-L296 HydrophobicContact CE2-CD1 3.64Å; Y231-L296 HydrophobicContact CE2-CG 4.23Å; I272-L296 HydrophobicContact CD1-CD1 4.19Å; L284-L296 HydrophobicContact CD1-CD1 3.85Å; L284-L296 HydrophobicContact CD2-CD1 4.29Å; L284-L296 HydrophobicContact CD2-CD2 4.03Å; M294-L296 HydrophobicContact CE-CD1 3.72Å; M294-L296 HydrophobicContact CE-CD2 4.15Å; M294-L296 HydrophobicContact CE-CG 3.9Å; M294-L296 HydrophobicContact CG-CD2 3.78Å; M294-L296 HydrophobicContact CG-CG 4.09Å; M294-L296 HydrophobicContact SD-CD1 4.4Å; M294-L296 HydrophobicContact SD-CD2 3.79Å; M294-L296 HydrophobicContact SD-CG 4.19Å; L296-Y298 HydrophobicContact CB-CD2 4.16Å; L296-Y298 HydrophobicContact CB-CE2 3.72Å; L296-Y298 HydrophobicContact CD1-CE2 3.92Å; L296-Y298 HydrophobicContact CD2-CE2 4.17Å; L296-Y298 HydrophobicContact CG-CE2 4.15Å; L296-K444 HydrophobicContact CD2-CB 3.77Å; L296-K444 HydrophobicContact CD2-CD 4.47Å
297	N	94.4	Very high	92.2	Very high	1 Å²	1	26 Å²	26	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	98.1	178.2	-179.3	-114.9	0	0	0	110.5	G163 V227 N228 L299 K444 H445 Q446	G163-N297 PolarHBondContact O-ND2 3.33Å; V227-N297 WeakPolarHBondContact O-CA 3.4Å; N228-N297 PolarHBondContact OD1-ND2 3.35Å; N297-L299 WeakPolarHBondContact ND2-CD1 3.49Å; N297-L299 VanDerWaalsContact OD1-CD1 3.28Å; N297-L299 WeakPolarHBondContact OD1-CD1 3.24Å; N297-K444 PolarHBondContact N-O 2.8Å; N297-H445 CarbonylContact O-C 3.42Å; N297-H445 VanDerWaalsContact O-CA 3.31Å; N297-H445 WeakPolarHBondContact O-CA 3.38Å; N297-H445 PolarHBondContact O-ND1 3.35Å; N297-H445 PolarHBondContact OD1-CE1 2.93Å; N297-H445 PolarHBondContact OD1-ND1 3.08Å; N297-Q446 PolarHBondContact O-N 3.05Å
298	Y	93.3	Very high	92.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	135	177.7	-64.6	-83.7	0	0	0	110.5	S226 V227 I272 I280 P283 L284 L296 K444 Q446	S226-Y298 CarbonylContact C-O 3.6Å; S226-Y298 WeakPolarHBondContact CA-O 3.44Å; S226-Y298 PolarHBondContact OG-O 3.28Å; V227-Y298 HydrophobicContact CB-CD2 4.48Å; V227-Y298 PolarHBondContact N-O 2.9Å; V227-Y298 PolarHBondContact O-N 3Å; I272-Y298 HydrophobicContact CD1-CD2 3.94Å; I272-Y298 HydrophobicContact CD1-CE2 3.52Å; I272-Y298 HydrophobicContact CG1-CD2 4.27Å; I272-Y298 HydrophobicContact CG1-CE2 4.33Å; I272-Y298 HydrophobicContact CG2-CD2 4.32Å; I272-Y298 HydrophobicContact CG2-CG 4.3Å; I280-Y298 HydrophobicContact CD1-CD1 4.46Å; I280-Y298 HydrophobicContact CG2-CD1 4.32Å; P283-Y298 HydrophobicContact CB-CD1 4.03Å; P283-Y298 HydrophobicContact CB-CE1 3.31Å; P283-Y298 HydrophobicContact CG-CD1 4.32Å; P283-Y298 HydrophobicContact CG-CE1 3.8Å; P283-Y298 HydrophobicContact CG-CE2 4.41Å; L284-Y298 WeakPolarHBondContact CD2-OH 3.05Å; L296-Y298 HydrophobicContact CB-CD2 4.16Å; L296-Y298 HydrophobicContact CB-CE2 3.72Å; L296-Y298 HydrophobicContact CD1-CE2 3.92Å; L296-Y298 HydrophobicContact CD2-CE2 4.17Å; L296-Y298 HydrophobicContact CG-CE2 4.15Å; Y298-K444 WeakPolarHBondContact OH-CD 3.43Å; Y298-K444 WeakPolarHBondContact OH-CE 3.47Å; Y298-Q446 CarbonylContact C-O 3.55Å; Y298-Q446 WeakPolarHBondContact CA-O 3.31Å; Y298-Q446 HydrophobicContact CD1-CB 3.52Å; Y298-Q446 HydrophobicContact CD1-CG 3.96Å; Y298-Q446 HydrophobicContact CE1-CB 3.58Å; Y298-Q446 HydrophobicContact CE1-CG 4.2Å; Y298-Q446 VanDerWaalsContact CE1-OE1 3.28Å
299	L	93.3	Very high	92.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	136.5	175.4	-69.7	90.7	0	0	0	111.3	A160 F216 R225 N297 Q446 G447 T448 F495	A160-L299 HydrophobicContact CB-CB 4.28Å; A160-L299 HydrophobicContact CB-CD1 4.08Å; A160-L299 HydrophobicContact CB-CD2 3.81Å; A160-L299 HydrophobicContact CB-CG 4.27Å; F216-L299 HydrophobicContact CE1-CD2 4.04Å; F216-L299 HydrophobicContact CZ-CD2 4Å; R225-L299 WeakPolarHBondContact O-CA 3.28Å; N297-L299 WeakPolarHBondContact ND2-CD1 3.49Å; N297-L299 VanDerWaalsContact OD1-CD1 3.28Å; N297-L299 WeakPolarHBondContact OD1-CD1 3.24Å; L299-Q446 PolarHBondContact N-O 3.18Å; L299-G447 CarbonylContact O-C 3.45Å; L299-T448 PolarHBondContact O-N 3.28Å; L299-F495 HydrophobicContact CB-CE1 4.21Å; L299-F495 HydrophobicContact CB-CZ 3.75Å; L299-F495 HydrophobicContact CD2-CZ 4.41Å
300	Y	93.8	Very high	92.6	Very high	14 Å²	14	21.7 Å²	21.7	6%	0.055	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	130.9	172.3	177.4	-83.2	0	0	0	109.7	T223 L224 R225 L279 K302 T448 T450	T223-Y300 HydrophobicContact CG2-CD1 4.18Å; T223-Y300 HydrophobicContact CG2-CE1 4.12Å; L224-Y300 WeakPolarHBondContact CA-O 3.39Å; R225-Y300 PolarHBondContact N-O 2.82Å; R225-Y300 PolarHBondContact O-N 3.4Å; L279-Y300 HydrophobicContact CB-CD1 4.38Å; L279-Y300 HydrophobicContact CB-CD2 3.83Å; L279-Y300 HydrophobicContact CB-CE2 4.02Å; L279-Y300 HydrophobicContact CB-CG 4.03Å; L279-Y300 HydrophobicContact CD1-CD1 3.57Å; L279-Y300 HydrophobicContact CD1-CD2 4.5Å; L279-Y300 HydrophobicContact CD1-CE1 3.57Å; L279-Y300 HydrophobicContact CD1-CG 4.06Å; L279-Y300 HydrophobicContact CD2-CE1 4.15Å; L279-Y300 HydrophobicContact CD2-CE2 4.16Å; L279-Y300 HydrophobicContact CG-CD1 4.45Å; L279-Y300 HydrophobicContact CG-CE1 4.3Å; L279-Y300 HydrophobicContact CG-CE2 4.46Å; Y300-K302 HydrophobicContact CE1-CB 3.55Å; Y300-T448 CarbonylContact C-O 3.51Å; Y300-T448 WeakPolarHBondContact CA-O 3.26Å; Y300-T448 HydrophobicContact CD2-CG2 3.71Å; Y300-T448 HydrophobicContact CE2-CG2 3.94Å; Y300-T450 PolarHBondContact OH-OG1 3.11Å
301	F	93.9	Very high	92.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	129.9	172.8	-178.4	-104.2	0	0	0	112.1	Y222 T223 L224 Y355 I359 T448 I449 T450 I485 F495	Y222-F301 HydrophobicContact CD2-CD2 4.43Å; Y222-F301 AromaticContact CD2-CE2 3.9Å; Y222-F301 HydrophobicContact CD2-CE2 3.9Å; Y222-F301 HydrophobicContact CG-CE2 4.11Å; T223-F301 WeakPolarHBondContact O-CA 3.25Å; L224-F301 HydrophobicContact CB-CD2 4.32Å; L224-F301 HydrophobicContact CD1-CB 4.19Å; L224-F301 HydrophobicContact CD1-CD2 4.02Å; F301-Y355 HydrophobicContact CE1-CD2 4.3Å; F301-Y355 AromaticContact CE1-CE2 3.74Å; F301-Y355 HydrophobicContact CE1-CE2 3.74Å; F301-Y355 AromaticContact CE1-CZ 3.99Å; F301-Y355 AromaticContact CZ-CD2 3.98Å; F301-Y355 HydrophobicContact CZ-CD2 3.98Å; F301-Y355 AromaticContact CZ-CE2 3.9Å; F301-Y355 HydrophobicContact CZ-CE2 3.9Å; F301-I359 HydrophobicContact CE2-CD1 3.76Å; F301-I359 HydrophobicContact CZ-CD1 4.03Å; F301-T448 PolarHBondContact N-O 3.07Å; F301-I449 HydrophobicContact CD1-CD1 4.04Å; F301-I449 HydrophobicContact CD1-CG1 4.03Å; F301-I449 WeakPolarHBondContact O-CA 3.47Å; F301-T450 PolarHBondContact O-N 3.46Å; F301-T450 VanDerWaalsContact O-N 3.13Å; F301-I485 HydrophobicContact CD1-CD1 3.51Å; F301-I485 HydrophobicContact CE1-CD1 3.49Å; F301-I485 VanDerWaalsContact CE1-CD1 3.49Å; F301-I485 HydrophobicContact CE1-CG2 4.38Å; F301-I485 HydrophobicContact CG-CD1 4.42Å; F301-I485 HydrophobicContact CZ-CD1 4.34Å; F301-I485 HydrophobicContact CZ-CG2 4.28Å; F301-F495 HydrophobicContact CB-CD2 4.13Å; F301-F495 HydrophobicContact CB-CE2 3.46Å; F301-F495 VanDerWaalsContact CB-CE2 3.46Å; F301-F495 HydrophobicContact CB-CZ 3.86Å; F301-F495 HydrophobicContact CG-CD2 4.47Å; F301-F495 HydrophobicContact CG-CE2 4.16Å
302	K	92.6	Very high	92.8	Very high	47 Å²	47	30.6 Å²	30.6	20%	0.204	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	111	164.3	-177.1	178.7	179	-172.9	0	108.3	T223 Y300 E454	T223-K302 PolarHBondContact N-O 3.38Å; T223-K302 PolarHBondContact O-N 3.41Å; Y300-K302 HydrophobicContact CE1-CB 3.55Å; K302-E454 WeakPolarHBondContact CE-OE2 3.25Å; K302-E454 IonicContact NZ-OE1 3.52Å; K302-E454 PolarHBondContact NZ-OE1 2.88Å; K302-E454 IonicContact NZ-OE2 2.93Å; K302-E454 PolarHBondContact NZ-OE2 2.58Å
303	G	91.3	Very high	92.9	Very high	3 Å²	3	33.2 Å²	33.2	3%	0.031	16%	0.158	C	C	.	.			trans	-83.5	161.2	176.6	0	0	0	0	0	112.1
304	T	93.1	Very high	92.9	Very high	39 Å²	39	34.7 Å²	34.7	24%	0.239	17%	0.167	C	C	.	.			trans	-118	115.8	171.3	-52	0	0	0	0	106.5	G221 Y355 T356	G221-T304 PolarHBondContact O-OG1 3.48Å; T304-Y355 CarbonylContact O-C 3.6Å; T304-Y355 VanDerWaalsContact O-CA 3.28Å; T304-Y355 WeakPolarHBondContact O-CA 3.45Å; T304-Y355 WeakPolarHBondContact O-CB 3.3Å; T304-T356 HydrophobicContact CG2-CG2 4.27Å; T304-T356 PolarHBondContact O-N 3.43Å; T304-T356 PolarHBondContact O-OG1 2.78Å
305	W	94.5	Very high	92.9	Very high	5 Å²	5	38.9 Å²	38.9	2%	0.019	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-62.9	142.9	-175.8	-60	115.8	0	0	0	111.8	Q307 F309 L353 Y355 M361 L400 V451 N452 E454 G455 T456	W305-Q307 VanDerWaalsContact C-N 3.33Å; W305-Q307 WeakPolarHBondContact CB-O 3.33Å; W305-F309 AromaticContact CD1-CD2 3.7Å; W305-F309 AromaticContact CD1-CE2 3.96Å; W305-F309 HydrophobicContact CD2-CE2 4.11Å; W305-F309 AromaticContact CE2-CE2 3.8Å; W305-F309 HydrophobicContact CG-CD2 4.26Å; W305-F309 HydrophobicContact CG-CE2 4.2Å; W305-F309 HydrophobicContact CZ2-CE2 4.26Å; W305-F309 AromaticContact NE1-CD2 3.69Å; W305-F309 AromaticContact NE1-CE2 3.71Å; W305-L353 HydrophobicContact CE3-CB 4.12Å; W305-L353 HydrophobicContact CH2-CB 4Å; W305-L353 HydrophobicContact CH2-CD1 3.97Å; W305-L353 HydrophobicContact CZ3-CB 3.42Å; W305-L353 VanDerWaalsContact CZ3-CB 3.42Å; W305-L353 HydrophobicContact CZ3-CD1 4.21Å; W305-L353 HydrophobicContact CZ3-CG 4.45Å; W305-Y355 AromaticContact CD2-CD1 3.78Å; W305-Y355 HydrophobicContact CD2-CD1 3.78Å; W305-Y355 AromaticContact CD2-CE1 3.41Å; W305-Y355 HydrophobicContact CD2-CE1 3.41Å; W305-Y355 VanDerWaalsContact CD2-CE1 3.41Å; W305-Y355 AromaticContact CE2-CE1 3.64Å; W305-Y355 AromaticContact CE3-CD1 3.36Å; W305-Y355 HydrophobicContact CE3-CD1 3.36Å; W305-Y355 HydrophobicContact CE3-CD2 4.48Å; W305-Y355 AromaticContact CE3-CE1 3.18Å; W305-Y355 HydrophobicContact CE3-CE1 3.18Å; W305-Y355 HydrophobicContact CE3-CE2 4.35Å; W305-Y355 HydrophobicContact CE3-CG 4.04Å; W305-Y355 AromaticContact CE3-CZ 3.73Å; W305-Y355 HydrophobicContact CG-CD1 4.37Å; W305-Y355 HydrophobicContact CG-CE1 4.25Å; W305-Y355 HydrophobicContact CH2-CD1 4.47Å; W305-Y355 AromaticContact CH2-CE1 3.55Å; W305-Y355 HydrophobicContact CH2-CE1 3.55Å; W305-Y355 HydrophobicContact CH2-CE2 4.07Å; W305-Y355 AromaticContact CH2-CZ 3.29Å; W305-Y355 WeakPolarHBondContact CH2-OH 3.14Å; W305-Y355 AromaticContact CZ2-CE1 3.75Å; W305-Y355 HydrophobicContact CZ2-CE1 3.75Å; W305-Y355 AromaticContact CZ2-CZ 3.82Å; W305-Y355 WeakPolarHBondContact CZ2-OH 3.49Å; W305-Y355 AromaticContact CZ3-CD1 3.73Å; W305-Y355 HydrophobicContact CZ3-CD1 3.73Å; W305-Y355 HydrophobicContact CZ3-CD2 4.15Å; W305-Y355 AromaticContact CZ3-CE1 3.23Å; W305-Y355 HydrophobicContact CZ3-CE1 3.23Å; W305-Y355 AromaticContact CZ3-CE2 3.7Å; W305-Y355 HydrophobicContact CZ3-CE2 3.7Å; W305-Y355 HydrophobicContact CZ3-CG 4.17Å; W305-Y355 AromaticContact CZ3-CZ 3.2Å; W305-M361 HydrophobicContact CH2-CB 4.22Å; W305-M361 HydrophobicContact CH2-CE 4.49Å; W305-M361 HydrophobicContact CH2-SD 4.07Å; W305-M361 HydrophobicContact CZ3-CB 4.26Å; W305-L400 HydrophobicContact CH2-CD2 4.27Å; W305-L400 HydrophobicContact CZ2-CD2 3.97Å; W305-V451 HydrophobicContact CZ2-CG1 3.86Å; W305-N452 PolarHBondContact NE1-O 3.05Å; W305-E454 PolarHBondContact N-O 3.3Å; W305-G455 CarbonylContact O-C 3.57Å; W305-G455 WeakPolarHBondContact O-CA 3.45Å; W305-T456 PolarHBondContact O-N 2.57Å; W305-T456 PolarHBondContact O-OG1 2.78Å
306	E	91.6	Very high	92.9	Very high	82 Å²	82	46.4 Å²	46.4	38%	0.383	21%	0.213	S	C	.	.	S	Bend	trans	-68.6	-37.4	168.4	-63.2	-167.9	159.7	0	0	110.8	P354 Y355 T356 T456 A459	E306-P354 HydrophobicContact CB-CB 4.42Å; E306-P354 HydrophobicContact CB-CG 4.26Å; E306-P354 HydrophobicContact CG-CB 4.1Å; E306-P354 HydrophobicContact CG-CG 4.47Å; E306-P354 PolarHBondContact N-O 3.48Å; E306-P354 WeakPolarHBondContact OE2-CB 3.4Å; E306-Y355 VanDerWaalsContact CG-C 3.4Å; E306-T356 HydrophobicContact CG-CG2 4.33Å; E306-T456 PolarHBondContact O-OG1 3.22Å; E306-A459 WeakPolarHBondContact O-CB 3.39Å
307	Q	90.3	Very high	92.9	Very high	42 Å²	42	49.9 Å²	49.9	20%	0.196	23%	0.226	C	C	.	.	S	Bend	trans	-110.9	101.6	171	-62.8	-179	30.1	0	0	108.6	W305 N337 Y338 A459	W305-Q307 VanDerWaalsContact C-N 3.33Å; W305-Q307 WeakPolarHBondContact CB-O 3.33Å; Q307-N337 PolarHBondContact NE2-O 2.66Å; Q307-N337 VanDerWaalsContact NE2-O 3.15Å; Q307-Y338 PolarHBondContact OE1-OH 2.9Å; Q307-A459 HydrophobicContact CG-CB 4Å
308	K	91.8	Very high	92.9	Very high	47 Å²	47	51.7 Å²	51.7	20%	0.204	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-65.2	149.3	-177.6	75.4	171.2	179.8	173.7	0	112	N334 E457 A460	K308-N334 PolarHBondContact O-ND2 3.1Å; K308-E457 HydrophobicContact CD-CB 4.32Å; K308-E457 HydrophobicContact CD-CG 4.12Å; K308-E457 IonicContact NZ-OE1 2.93Å; K308-E457 PolarHBondContact NZ-OE1 3.13Å; K308-A460 HydrophobicContact CG-CB 4.11Å
309	F	92.6	Very high	93	Very high	3 Å²	3	51.7 Å²	51.7	1%	0.013	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-81	126	166.7	-65.7	-99.7	0	0	0	108.2	W305 K311 M332 N334 L353 V398 L400 E453	W305-F309 AromaticContact CD1-CD2 3.7Å; W305-F309 AromaticContact CD1-CE2 3.96Å; W305-F309 HydrophobicContact CD2-CE2 4.11Å; W305-F309 AromaticContact CE2-CE2 3.8Å; W305-F309 HydrophobicContact CG-CD2 4.26Å; W305-F309 HydrophobicContact CG-CE2 4.2Å; W305-F309 HydrophobicContact CZ2-CE2 4.26Å; W305-F309 AromaticContact NE1-CD2 3.69Å; W305-F309 AromaticContact NE1-CE2 3.71Å; F309-K311 PolarHBondContact O-N 2.91Å; F309-M332 HydrophobicContact CB-CB 3.99Å; F309-M332 HydrophobicContact CD1-CB 3.58Å; F309-M332 HydrophobicContact CD2-CE 4.42Å; F309-M332 HydrophobicContact CE1-CB 4.24Å; F309-M332 HydrophobicContact CG-CB 3.83Å; F309-N334 HydrophobicContact CD1-CB 3.5Å; F309-N334 HydrophobicContact CE1-CB 3.72Å; F309-N334 HydrophobicContact CG-CB 4.1Å; F309-N334 HydrophobicContact CZ-CB 4.46Å; F309-L353 HydrophobicContact CZ-CD1 4.44Å; F309-V398 HydrophobicContact CE1-CG1 4.37Å; F309-V398 HydrophobicContact CZ-CG1 4.41Å; F309-L400 HydrophobicContact CE1-CB 4.42Å; F309-L400 HydrophobicContact CZ-CB 4.34Å; F309-L400 HydrophobicContact CZ-CD2 4.34Å; F309-E453 HydrophobicContact CB-CB 3.99Å; F309-E453 HydrophobicContact CB-CG 3.97Å; F309-E453 PolarHBondContact N-O 3.07Å; F309-E453 WeakPolarHBondContact O-CB 3.32Å
310	P	91.3	Very high	93	Very high	29 Å²	29	54.5 Å²	54.5	19%	0.188	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-62.3	128.5	171.7	-20.2	32.7	0	0	0	109.4	E312 M313 V333	P310-E312 VanDerWaalsContact CB-OE2 3.27Å; P310-E312 WeakPolarHBondContact CB-OE2 3.21Å; P310-E312 PolarHBondContact O-N 2.85Å; P310-M313 HydrophobicContact CB-CB 4.15Å; P310-M313 HydrophobicContact CB-CG 3.88Å; P310-M313 HydrophobicContact CG-CG 4.16Å; P310-M313 PolarHBondContact O-N 2.9Å; P310-V333 WeakPolarHBondContact CD-O 3.2Å
311	K	91.9	Very high	92.9	Very high	138 Å²	138	54.8 Å²	54.8	60%	0.6	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-64	-27.7	-179	-70.8	-177.3	178.4	179.5	0	111.4	F309 M313 T314 E453	F309-K311 PolarHBondContact O-N 2.91Å; K311-M313 PolarHBondContact O-N 2.67Å; K311-T314 WeakPolarHBondContact O-CB 3.44Å; K311-T314 PolarHBondContact O-N 2.73Å; K311-E453 HydrophobicContact CG-CB 4.02Å; K311-E453 HydrophobicContact CG-CG 4.21Å
312	E	91.5	Very high	92.5	Very high	160 Å²	160	57.7 Å²	57.7	75%	0.748	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-67.6	-23.9	176.8	-50.3	72.2	-151.9	0	0	111.6	P310 T314	P310-E312 VanDerWaalsContact CB-OE2 3.27Å; P310-E312 WeakPolarHBondContact CB-OE2 3.21Å; P310-E312 PolarHBondContact O-N 2.85Å; E312-T314 VanDerWaalsContact C-N 3.33Å
313	M	92.8	Very high	91.9	Very high	87 Å²	87	58.5 Å²	58.5	43%	0.429	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-95.5	15.2	177.2	-63.2	-64.4	-67.4	0	0	112.4	P310 K311 Y315 V333	P310-M313 HydrophobicContact CB-CB 4.15Å; P310-M313 HydrophobicContact CB-CG 3.88Å; P310-M313 HydrophobicContact CG-CG 4.16Å; P310-M313 PolarHBondContact O-N 2.9Å; K311-M313 PolarHBondContact O-N 2.67Å; M313-Y315 WeakPolarHBondContact O-CD1 3.31Å; M313-Y315 WeakPolarHBondContact O-CE1 3.48Å; M313-V333 HydrophobicContact CB-CB 4.31Å; M313-V333 WeakPolarHBondContact CB-O 3.2Å; M313-V333 HydrophobicContact CE-CG1 4.49Å; M313-V333 WeakPolarHBondContact O-CB 3.4Å; M313-V333 PolarHBondContact O-N 2.81Å
314	T	94.7	Very high	91.6	Very high	31 Å²	31	67.7 Å²	67.7	19%	0.19	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.7	174.4	-55.1	0	0	0	0	110	K311 E312 P330 M331 M332 E453	K311-T314 WeakPolarHBondContact O-CB 3.44Å; K311-T314 PolarHBondContact O-N 2.73Å; E312-T314 VanDerWaalsContact C-N 3.33Å; T314-P330 HydrophobicContact CG2-CB 4.13Å; T314-M331 WeakPolarHBondContact CA-O 3.35Å; T314-M332 HydrophobicContact CG2-CG 4.3Å; T314-E453 WeakPolarHBondContact CG2-OE1 3.45Å; T314-E453 WeakPolarHBondContact OG1-CG 3.35Å; T314-E453 PolarHBondContact OG1-OE1 3.12Å
315	Y	93.8	Very high	91.4	Very high	88 Å²	88	68.9 Å²	68.9	35%	0.345	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	159.4	-179.2	50.1	-81.5	0	0	0	110.4	M313 R317 M331 V333	M313-Y315 WeakPolarHBondContact O-CD1 3.31Å; M313-Y315 WeakPolarHBondContact O-CE1 3.48Å; Y315-R317 HydrophobicContact CD2-CG 3.81Å; Y315-R317 HydrophobicContact CE2-CG 3.64Å; Y315-R317 PolarHBondContact O-N 3.18Å; Y315-R317 PolarHBondContact OH-NH1 3.14Å; Y315-R317 PolarHBondContact OH-NH2 3.31Å; Y315-M331 PolarHBondContact N-O 3.28Å; Y315-M331 WeakPolarHBondContact O-CB 3.24Å; Y315-M331 PolarHBondContact O-N 2.81Å; Y315-V333 HydrophobicContact CE1-CB 4.34Å; Y315-V333 HydrophobicContact CE1-CG2 3.63Å
316	Y	94.5	Very high	91.3	Very high	158 Å²	158	71.4 Å²	71.4	62%	0.62	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	128.3	178.3	-76.3	-84.8	0	0	0	110.2	R328 V329	Y316-R328 HydrophobicContact CD1-CB 4.34Å; Y316-V329 WeakPolarHBondContact CA-O 3.37Å
317	R	94.1	Very high	91.4	Very high	73 Å²	73	69.2 Å²	69.2	28%	0.275	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	159.5	170.4	-78.5	-173.3	154.4	159.8	6.2	110.3	Y315 R328 V329 M331 S399	Y315-R317 HydrophobicContact CD2-CG 3.81Å; Y315-R317 HydrophobicContact CE2-CG 3.64Å; Y315-R317 PolarHBondContact O-N 3.18Å; Y315-R317 PolarHBondContact OH-NH1 3.14Å; Y315-R317 PolarHBondContact OH-NH2 3.31Å; R317-R328 WeakPolarHBondContact O-CA 3.37Å; R317-V329 PolarHBondContact N-O 2.82Å; R317-V329 PolarHBondContact O-N 2.83Å; R317-M331 HydrophobicContact CB-CB 3.9Å; R317-M331 HydrophobicContact CB-CE 4.33Å; R317-M331 HydrophobicContact CB-CG 4.36Å; R317-M331 HydrophobicContact CG-CB 4.14Å; R317-S399 PolarHBondContact NH1-OG 3.24Å; R317-S399 VanDerWaalsContact NH1-OG 3.16Å
318	N	94.6	Very high	91.6	Very high	40 Å²	40	73.7 Å²	73.7	21%	0.214	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	135.2	171.1	-65.7	-23.7	0	0	0	109.7	E71 N326 R328	E71-N318 PolarHBondContact OE2-ND2 3.43Å; N318-N326 HydrophobicContact CB-CB 4.32Å; N318-R328 WeakPolarHBondContact OD1-CG 3.35Å
319	F	95.8	Very high	91.8	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	119.6	166.6	-173.9	-78	0	0	0	107.4	V321 N326 V327 V329 P401 D478 H479 F481 V500 P502	F319-V321 HydrophobicContact CD1-CG2 4.34Å; F319-V321 PolarHBondContact O-N 3.08Å; F319-N326 CarbonylContact O-C 3.58Å; F319-N326 WeakPolarHBondContact O-CA 3.39Å; F319-V327 PolarHBondContact N-O 2.99Å; F319-V327 PolarHBondContact O-N 3.31Å; F319-V329 HydrophobicContact CB-CG1 4.35Å; F319-V329 HydrophobicContact CB-CG2 3.69Å; F319-V329 HydrophobicContact CD2-CG2 4.48Å; F319-V329 HydrophobicContact CG-CG2 4.44Å; F319-P401 HydrophobicContact CD2-CG 4.23Å; F319-P401 HydrophobicContact CE2-CG 4.07Å; F319-D478 CarbonylContact C-O 3.57Å; F319-D478 WeakPolarHBondContact CA-O 3.48Å; F319-H479 WeakPolarHBondContact CZ-O 3.25Å; F319-F481 HydrophobicContact CE2-CD1 4.3Å; F319-F481 HydrophobicContact CE2-CE1 4.18Å; F319-F481 HydrophobicContact CZ-CD1 4.29Å; F319-F481 HydrophobicContact CZ-CE1 4.39Å; F319-V500 VanDerWaalsContact CE1-O 3.25Å; F319-V500 WeakPolarHBondContact CE1-O 3.41Å; F319-P502 HydrophobicContact CB-CG 4.34Å; F319-P502 HydrophobicContact CD1-CG 4.03Å; F319-P502 HydrophobicContact CD2-CG 3.63Å; F319-P502 HydrophobicContact CE1-CG 4.24Å; F319-P502 HydrophobicContact CE2-CG 3.84Å; F319-P502 HydrophobicContact CG-CG 3.72Å; F319-P502 HydrophobicContact CZ-CG 4.12Å
320	R	93.5	Very high	92	Very high	58 Å²	58	73 Å²	73	22%	0.219	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	110.3	-179	-170.2	179.9	-67.6	151.3	-2.2	109.1	N322 N326 I369 D478 H479 P480	R320-N322 WeakPolarHBondContact CG-O 3.39Å; R320-N326 WeakPolarHBondContact CA-OD1 3.39Å; R320-N326 WeakPolarHBondContact CB-OD1 3.4Å; R320-I369 HydrophobicContact CG-CD1 3.7Å; R320-D478 PolarHBondContact N-O 2.93Å; R320-H479 HydrophobicContact CB-CB 4.15Å; R320-H479 WeakPolarHBondContact O-CA 3.29Å; R320-P480 VanDerWaalsContact O-CD 3.3Å; R320-P480 WeakPolarHBondContact O-CD 3.45Å
321	V	90.4	Very high	92.2	Very high	20 Å²	20	71.6 Å²	71.6	12%	0.121	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	-36.7	177.7	178.9	0	0	0	0	110.3	F319 T325 V327 V500 N501	F319-V321 HydrophobicContact CD1-CG2 4.34Å; F319-V321 PolarHBondContact O-N 3.08Å; V321-T325 PolarHBondContact N-O 3.12Å; V321-V327 HydrophobicContact CG2-CB 4.3Å; V321-V327 HydrophobicContact CG2-CG2 3.66Å; V321-V500 HydrophobicContact CG1-CG1 4.15Å; V321-N501 HydrophobicContact CG2-CB 4.25Å
322	N	85.8	Confident	92.5	Very high	61 Å²	61	65 Å²	65	33%	0.326	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	178.2	173.2	61.1	51.5	0	0	0	109	R320 K324 T325	R320-N322 WeakPolarHBondContact CG-O 3.39Å; N322-K324 PolarHBondContact O-N 3.49Å; N322-K324 PolarHBondContact OD1-N 3.42Å; N322-T325 PolarHBondContact N-O 3.22Å; N322-T325 PolarHBondContact ND2-OG1 3.16Å; N322-T325 VanDerWaalsContact ND2-OG1 3.11Å; N322-T325 PolarHBondContact O-N 2.79Å; N322-T325 VanDerWaalsContact OD1-CB 3.24Å; N322-T325 WeakPolarHBondContact OD1-CB 2.96Å; N322-T325 PolarHBondContact OD1-N 3.02Å; N322-T325 PolarHBondContact OD1-OG1 3.35Å
323	D	80.4	Confident	92.6	Very high	65 Å²	65	57.5 Å²	57.5	35%	0.348	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-19.3	-175.4	-53.9	-27.6	0	0	0	114.8	Y73 I369	Y73-D323 HydrophobicContact CD1-CB 3.93Å; D323-I369 WeakPolarHBondContact OD1-CD1 3.46Å
324	K	85	Confident	92.6	Very high	196 Å²	196	53.8 Å²	53.8	85%	0.852	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.6	-12.8	-175.9	-58.6	-178.9	-177	177.9	0	114.2	N322	N322-K324 PolarHBondContact O-N 3.49Å; N322-K324 PolarHBondContact OD1-N 3.42Å
325	T	88.9	Confident	92.3	Very high	63 Å²	63	54.8 Å²	54.8	39%	0.387	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	119.2	-165.5	-45.3	0	0	0	0	110.5	V321 N322	V321-T325 PolarHBondContact N-O 3.12Å; N322-T325 PolarHBondContact N-O 3.22Å; N322-T325 PolarHBondContact ND2-OG1 3.16Å; N322-T325 VanDerWaalsContact ND2-OG1 3.11Å; N322-T325 PolarHBondContact O-N 2.79Å; N322-T325 VanDerWaalsContact OD1-CB 3.24Å; N322-T325 WeakPolarHBondContact OD1-CB 2.96Å; N322-T325 PolarHBondContact OD1-N 3.02Å; N322-T325 PolarHBondContact OD1-OG1 3.35Å
326	N	91.6	Very high	92	Very high	59 Å²	59	51.2 Å²	51.2	32%	0.316	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	144.8	173.8	-65.2	-31.1	0	0	0	110.2	N318 F319 R320	N318-N326 HydrophobicContact CB-CB 4.32Å; F319-N326 CarbonylContact O-C 3.58Å; F319-N326 WeakPolarHBondContact O-CA 3.39Å; R320-N326 WeakPolarHBondContact CA-OD1 3.39Å; R320-N326 WeakPolarHBondContact CB-OD1 3.4Å
327	V	93.8	Very high	91.8	Very high	35 Å²	35	47.8 Å²	47.8	21%	0.212	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	132.4	174.1	177.7	0	0	0	0	108.6	F319 V321 V329	F319-V327 PolarHBondContact N-O 2.99Å; F319-V327 PolarHBondContact O-N 3.31Å; V321-V327 HydrophobicContact CG2-CB 4.3Å; V321-V327 HydrophobicContact CG2-CG2 3.66Å; V327-V329 HydrophobicContact CG1-CG1 3.99Å; V327-V329 PolarHBondContact O-N 3.09Å
328	R	94.6	Very high	91.8	Very high	136 Å²	136	44.5 Å²	44.5	51%	0.513	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	123.1	174.2	-76.7	-160	175.9	-159.5	-0.1	110.8	D66 Y316 R317 N318	D66-R328 PolarHBondContact O-NH2 2.65Å; Y316-R328 HydrophobicContact CD1-CB 4.34Å; R317-R328 WeakPolarHBondContact O-CA 3.37Å; N318-R328 WeakPolarHBondContact OD1-CG 3.35Å
329	V	95.9	Very high	91.8	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.012	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	150.6	-179.5	-59.8	0	0	0	0	111.6	Y316 R317 F319 V327 M331 P401 P502	Y316-V329 WeakPolarHBondContact CA-O 3.37Å; R317-V329 PolarHBondContact N-O 2.82Å; R317-V329 PolarHBondContact O-N 2.83Å; F319-V329 HydrophobicContact CB-CG1 4.35Å; F319-V329 HydrophobicContact CB-CG2 3.69Å; F319-V329 HydrophobicContact CD2-CG2 4.48Å; F319-V329 HydrophobicContact CG-CG2 4.44Å; V327-V329 HydrophobicContact CG1-CG1 3.99Å; V327-V329 PolarHBondContact O-N 3.09Å; V329-M331 HydrophobicContact CG2-CE 4.32Å; V329-M331 PolarHBondContact O-N 3.04Å; V329-M331 VanDerWaalsContact O-N 3.07Å; V329-P401 HydrophobicContact CG2-CB 4.04Å; V329-P502 HydrophobicContact CB-CG 4.33Å; V329-P502 HydrophobicContact CG1-CB 4.41Å; V329-P502 HydrophobicContact CG1-CG 3.91Å; V329-P502 HydrophobicContact CG2-CG 4.13Å
330	P	96.7	Very high	91.8	Very high	33 Å²	33	45.5 Å²	45.5	21%	0.214	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	108.7	172	25.2	-33.2	0	0	0	110.1	T314 R402	T314-P330 HydrophobicContact CG2-CB 4.13Å; P330-R402 HydrophobicContact CB-CB 4.38Å; P330-R402 HydrophobicContact CG-CB 4.05Å; P330-R402 PolarHBondContact O-N 2.78Å
331	M	97	Very high	91.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	117.2	-180	-168.8	69.6	69.2	0	0	109.4	T314 Y315 R317 V329 P401 D478	T314-M331 WeakPolarHBondContact CA-O 3.35Å; Y315-M331 PolarHBondContact N-O 3.28Å; Y315-M331 WeakPolarHBondContact O-CB 3.24Å; Y315-M331 PolarHBondContact O-N 2.81Å; R317-M331 HydrophobicContact CB-CB 3.9Å; R317-M331 HydrophobicContact CB-CE 4.33Å; R317-M331 HydrophobicContact CB-CG 4.36Å; R317-M331 HydrophobicContact CG-CB 4.14Å; V329-M331 HydrophobicContact CG2-CE 4.32Å; V329-M331 PolarHBondContact O-N 3.04Å; V329-M331 VanDerWaalsContact O-N 3.07Å; M331-P401 HydrophobicContact SD-CB 4.34Å; M331-P401 VanDerWaalsContact SD-CD 3.57Å; M331-D478 HydrophobicContact CE-CB 4.41Å
332	M	96.6	Very high	92.2	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	133.4	178.6	-49	-178.9	-63.6	0	0	109.1	F309 T314 S399 L400 R402 V451 E453	F309-M332 HydrophobicContact CB-CB 3.99Å; F309-M332 HydrophobicContact CD1-CB 3.58Å; F309-M332 HydrophobicContact CD2-CE 4.42Å; F309-M332 HydrophobicContact CE1-CB 4.24Å; F309-M332 HydrophobicContact CG-CB 3.83Å; T314-M332 HydrophobicContact CG2-CG 4.3Å; M332-S399 CarbonylContact O-C 3.53Å; M332-S399 WeakPolarHBondContact O-CA 3.44Å; M332-L400 WeakPolarHBondContact CB-O 3.48Å; M332-L400 HydrophobicContact CE-CB 4.25Å; M332-L400 HydrophobicContact CE-CD2 3.85Å; M332-L400 HydrophobicContact CE-CG 4.07Å; M332-L400 PolarHBondContact N-O 2.9Å; M332-L400 PolarHBondContact O-N 3.36Å; M332-R402 HydrophobicContact CG-CB 4.11Å; M332-R402 HydrophobicContact SD-CB 4.01Å; M332-V451 HydrophobicContact CE-CG1 3.99Å; M332-E453 HydrophobicContact CB-CG 4.4Å; M332-E453 HydrophobicContact CG-CG 3.9Å; M332-E453 VanDerWaalsContact CG-OE1 3.29Å; M332-E453 WeakPolarHBondContact CG-OE1 3.29Å; M332-E453 HydrophobicContact SD-CB 4.33Å; M332-E453 VanDerWaalsContact SD-CD 3.54Å; M332-E453 HydrophobicContact SD-CG 3.65Å; M332-E453 PolarHBondContact SD-N 3.02Å; M332-E453 VanDerWaalsContact SD-N 3.4Å
333	V	94.5	Very high	92.6	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.012	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	132.1	179.9	-175.8	0	0	0	0	111.5	P310 M313 Y315 E397 V398	P310-V333 WeakPolarHBondContact CD-O 3.2Å; M313-V333 HydrophobicContact CB-CB 4.31Å; M313-V333 WeakPolarHBondContact CB-O 3.2Å; M313-V333 HydrophobicContact CE-CG1 4.49Å; M313-V333 WeakPolarHBondContact O-CB 3.4Å; M313-V333 PolarHBondContact O-N 2.81Å; Y315-V333 HydrophobicContact CE1-CB 4.34Å; Y315-V333 HydrophobicContact CE1-CG2 3.63Å; V333-E397 HydrophobicContact CG1-CG 3.71Å; V333-V398 WeakPolarHBondContact CA-O 3.37Å
334	N	92.1	Very high	93.1	Very high	9 Å²	9	46 Å²	46	5%	0.048	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	142.8	171.4	178	-70.7	0	0	0	109.8	K308 F309 Y338 E397 V398	K308-N334 PolarHBondContact O-ND2 3.1Å; F309-N334 HydrophobicContact CD1-CB 3.5Å; F309-N334 HydrophobicContact CE1-CB 3.72Å; F309-N334 HydrophobicContact CG-CB 4.1Å; F309-N334 HydrophobicContact CZ-CB 4.46Å; N334-Y338 PolarHBondContact OD1-OH 2.8Å; N334-E397 CarbonylContact O-C 3.5Å; N334-E397 WeakPolarHBondContact O-CA 3.44Å; N334-V398 PolarHBondContact N-O 3.43Å; N334-V398 PolarHBondContact O-N 2.92Å
335	K	89.9	Confident	93.3	Very high	53 Å²	53	42.1 Å²	42.1	23%	0.23	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	121.6	171.5	179.6	176.7	175.4	179.6	0	110	T395 R396 E397 Q463 Q472	K335-T395 HydrophobicContact CG-CG2 4.45Å; K335-R396 WeakPolarHBondContact CA-O 3.5Å; K335-E397 HydrophobicContact CB-CB 4.42Å; K335-Q463 PolarHBondContact O-NE2 3.03Å; K335-Q472 VanDerWaalsContact NZ-CD 3.28Å
336	G	87.1	Confident	93.4	Very high	12 Å²	12	39.6 Å²	39.6	12%	0.124	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167	-175.9	-172.4	0	0	0	0	0	112.6	Y338 T395 R396	G336-Y338 WeakPolarHBondContact O-CD2 3.5Å; G336-T395 CarbonylContact O-C 3.55Å; G336-T395 VanDerWaalsContact O-CA 3.3Å; G336-T395 WeakPolarHBondContact O-CA 3.28Å; G336-R396 PolarHBondContact N-O 3.21Å; G336-R396 PolarHBondContact O-N 3.14Å
337	N	89.8	Confident	93.6	Very high	86 Å²	86	41.9 Å²	41.9	46%	0.46	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	116.1	175.6	-74.5	-40.7	0	0	0	109.2	Q307 N393 T395	Q307-N337 PolarHBondContact NE2-O 2.66Å; Q307-N337 VanDerWaalsContact NE2-O 3.15Å; N337-N393 WeakPolarHBondContact CB-OD1 3.09Å; N337-T395 WeakPolarHBondContact OD1-CA 3.32Å; N337-T395 PolarHBondContact OD1-N 3.05Å; N337-T395 PolarHBondContact OD1-OG1 3.43Å
338	Y	93.3	Very high	93.7	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.016	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	145.9	-179	-63.5	-74.6	0	0	0	111.3	Q307 N334 G336 L351 L353 N393 R394 R396 V398	Q307-Y338 PolarHBondContact OE1-OH 2.9Å; N334-Y338 PolarHBondContact OD1-OH 2.8Å; G336-Y338 WeakPolarHBondContact O-CD2 3.5Å; Y338-L351 HydrophobicContact CG-CD1 4.33Å; Y338-L353 HydrophobicContact CD1-CD2 3.59Å; Y338-L353 HydrophobicContact CE1-CD2 3.49Å; Y338-L353 VanDerWaalsContact CE1-CD2 3.49Å; Y338-L353 HydrophobicContact CG-CD2 4.41Å; Y338-N393 PolarHBondContact N-OD1 3.23Å; Y338-N393 WeakPolarHBondContact O-CA 3.39Å; Y338-N393 PolarHBondContact O-OD1 2.93Å; Y338-R394 PolarHBondContact N-O 2.87Å; Y338-R394 PolarHBondContact O-N 3.27Å; Y338-R394 VanDerWaalsContact O-N 3.12Å; Y338-R396 PolarHBondContact O-NH1 3.35Å; Y338-V398 HydrophobicContact CD2-CG2 3.49Å; Y338-V398 VanDerWaalsContact CD2-CG2 3.49Å; Y338-V398 HydrophobicContact CE2-CB 4.36Å; Y338-V398 HydrophobicContact CE2-CG2 3.65Å; Y338-V398 HydrophobicContact CG-CG2 4.02Å
339	L	95.7	Very high	93.8	Very high	56 Å²	56	36.1 Å²	36.1	29%	0.293	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	125	168.7	-76.8	171.1	0	0	0	108.8	Q352 M391 N393	L339-Q352 HydrophobicContact CB-CB 4.04Å; L339-Q352 PolarHBondContact O-N 3.44Å; L339-M391 HydrophobicContact CB-CB 4.06Å; L339-M391 HydrophobicContact CB-CG 4.47Å; L339-M391 HydrophobicContact CB-SD 4.2Å; L339-M391 HydrophobicContact CD2-CB 4.08Å; L339-N393 HydrophobicContact CD2-CB 3.8Å; L339-N393 HydrophobicContact CG-CB 4.44Å
340	A	96.2	Very high	93.9	Very high	5 Å²	5	36 Å²	36	4%	0.041	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	154.7	173.1	0	0	0	0	0	111.2	I350 L351 M391 T392 R396	A340-I350 CarbonylContact C-O 3.47Å; A340-I350 WeakPolarHBondContact CA-O 3.43Å; A340-I350 WeakPolarHBondContact CB-O 3.45Å; A340-L351 HydrophobicContact CB-CD1 4.17Å; A340-M391 WeakPolarHBondContact O-CA 3.35Å; A340-T392 PolarHBondContact N-O 2.81Å; A340-T392 VanDerWaalsContact N-O 3.14Å; A340-T392 PolarHBondContact O-N 2.76Å; A340-R396 VanDerWaalsContact CB-CZ 3.45Å; A340-R396 VanDerWaalsContact CB-NH1 3.34Å
341	A	95.6	Very high	93.9	Very high	17 Å²	17	34.5 Å²	34.5	14%	0.14	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	158	176.1	0	0	0	0	0	109.8	I350 N390 M391	A341-I350 PolarHBondContact N-O 3.15Å; A341-I350 PolarHBondContact O-N 2.98Å; A341-N390 HydrophobicContact CB-CB 4.49Å; A341-M391 HydrophobicContact CB-CG 3.86Å
342	A	94.9	Very high	93.9	Very high	51 Å²	51	35.6 Å²	35.6	42%	0.421	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	127.8	166.8	0	0	0	0	0	107.6
343	D	94.3	Very high	93.9	Very high	9 Å²	9	35.7 Å²	35.7	5%	0.048	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	108.2	171.8	-162.3	-6.6	0	0	0	109.4	E345 E347 C348 K386 W387	D343-E345 VanDerWaalsContact C-N 3.32Å; D343-E345 PolarHBondContact OD1-N 3.2Å; D343-E347 WeakPolarHBondContact O-CA 3.24Å; D343-E347 PolarHBondContact O-N 3.12Å; D343-C348 PolarHBondContact N-O 3Å; D343-C348 PolarHBondContact O-N 2.81Å; D343-K386 IonicContact OD1-NZ 3.15Å; D343-K386 PolarHBondContact OD1-NZ 3.26Å; D343-K386 VanDerWaalsContact OD1-NZ 3.15Å; D343-K386 IonicContact OD2-NZ 3.49Å; D343-W387 PolarHBondContact OD2-NE1 3.16Å
344	H	91.6	Very high	94	Very high	138 Å²	138	37.1 Å²	37.1	64%	0.639	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77	-20.4	179.6	-65.4	-86.6	0	0	0	112.5	R367	H344-R367 PolarHBondContact ND1-NH1 3.37Å
345	E	89.4	Confident	94.1	Very high	114 Å²	114	36.8 Å²	36.8	53%	0.533	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-37	178.1	-72.6	165.1	-144.5	0	0	111.7	D343 K386	D343-E345 VanDerWaalsContact C-N 3.32Å; D343-E345 PolarHBondContact OD1-N 3.2Å; E345-K386 IonicContact OE1-NZ 2.73Å; E345-K386 PolarHBondContact OE1-NZ 3.37Å; E345-K386 IonicContact OE2-NZ 2.71Å; E345-K386 PolarHBondContact OE2-NZ 3.25Å
346	L	91.5	Very high	94.2	Very high	11 Å²	11	35.4 Å²	35.4	6%	0.058	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	6	178.9	-66.5	176.5	0	0	0	113	C348 L375 Q378 V383 W387	L346-C348 PolarHBondContact O-N 2.89Å; L346-C348 VanDerWaalsContact O-N 3.17Å; L346-L375 HydrophobicContact CB-CD1 4.41Å; L346-L375 HydrophobicContact CD1-CD1 4.1Å; L346-Q378 HydrophobicContact CD2-CB 3.64Å; L346-Q378 HydrophobicContact CD2-CG 4.19Å; L346-V383 HydrophobicContact CD1-CG1 3.53Å; L346-V383 HydrophobicContact CD1-CG2 4.32Å; L346-W387 HydrophobicContact CD1-CZ2 3.76Å
347	E	94.1	Very high	94.3	Very high	106 Å²	106	35.9 Å²	35.9	50%	0.495	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.4	46.1	-177.7	-57.4	-170.5	155.5	0	0	113.5	D343 R367	D343-E347 WeakPolarHBondContact O-CA 3.24Å; D343-E347 PolarHBondContact O-N 3.12Å; E347-R367 WeakPolarHBondContact O-CB 3.28Å; E347-R367 WeakPolarHBondContact O-CG 3.48Å; E347-R367 PolarHBondContact O-N 2.99Å
348	C	96.1	Very high	94.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	152.1	-177.4	62.5	0	0	0	0	112.4	D343 L346 L365	D343-C348 PolarHBondContact N-O 3Å; D343-C348 PolarHBondContact O-N 2.81Å; L346-C348 PolarHBondContact O-N 2.89Å; L346-C348 VanDerWaalsContact O-N 3.17Å; C348-L365 CarbonylContact C-O 3.57Å; C348-L365 VanDerWaalsContact CA-O 3.26Å; C348-L365 WeakPolarHBondContact CA-O 3.27Å; C348-L365 WeakPolarHBondContact CB-O 3.13Å
349	D	96.8	Very high	94.4	Very high	51 Å²	51	35.4 Å²	35.4	27%	0.273	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	134.4	174.7	-59.6	-42.6	0	0	0	109.3	L365 R367 F475	D349-L365 PolarHBondContact N-O 2.75Å; D349-L365 PolarHBondContact O-N 3.38Å; D349-R367 IonicContact OD1-CZ 3.42Å; D349-R367 IonicContact OD1-NE 3.37Å; D349-R367 PolarHBondContact OD1-NE 2.85Å; D349-R367 IonicContact OD1-NH2 3.95Å; D349-R367 PolarHBondContact OD1-NH2 3.46Å; D349-R367 IonicContact OD2-NE 3.33Å; D349-F475 HydrophobicContact CB-CE2 3.73Å; D349-F475 HydrophobicContact CB-CZ 4.31Å
350	I	97.8	Very high	94.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130.2	-172.5	-44.4	-61.1	0	0	0	109.6	A340 A341 L362 I363 A364 W387 M391	A340-I350 CarbonylContact C-O 3.47Å; A340-I350 WeakPolarHBondContact CA-O 3.43Å; A340-I350 WeakPolarHBondContact CB-O 3.45Å; A341-I350 PolarHBondContact N-O 3.15Å; A341-I350 PolarHBondContact O-N 2.98Å; I350-L362 HydrophobicContact CG2-CD1 3.71Å; I350-L362 HydrophobicContact CG2-CD2 4.09Å; I350-L362 HydrophobicContact CG2-CG 3.78Å; I350-I363 CarbonylContact C-O 3.56Å; I350-I363 VanDerWaalsContact CA-O 3.22Å; I350-I363 WeakPolarHBondContact CA-O 3.35Å; I350-I363 WeakPolarHBondContact CG2-O 3.49Å; I350-A364 HydrophobicContact CD1-CB 3.49Å; I350-A364 VanDerWaalsContact CD1-CB 3.49Å; I350-W387 HydrophobicContact CD1-CD2 3.79Å; I350-W387 HydrophobicContact CD1-CE3 4.05Å; I350-W387 HydrophobicContact CD1-CG 4.38Å; I350-W387 HydrophobicContact CD1-CH2 3.84Å; I350-W387 HydrophobicContact CD1-CZ2 3.6Å; I350-W387 HydrophobicContact CD1-CZ3 4.08Å; I350-W387 HydrophobicContact CG1-CB 4.5Å; I350-W387 HydrophobicContact CG1-CD2 3.87Å; I350-W387 HydrophobicContact CG1-CE3 4.41Å; I350-W387 HydrophobicContact CG1-CG 3.93Å; I350-W387 HydrophobicContact CG1-CZ2 4.46Å; I350-W387 HydrophobicContact CG2-CB 4.41Å; I350-W387 HydrophobicContact CG2-CD2 4.39Å; I350-W387 HydrophobicContact CG2-CE3 4.26Å; I350-M391 HydrophobicContact CB-CE 4.32Å; I350-M391 HydrophobicContact CG2-CE 3.54Å
351	L	97.9	Very high	94.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	136.2	175.9	177.8	71.2	0	0	0	110.6	Y338 A340 L353 L362 I363 V398 F475	Y338-L351 HydrophobicContact CG-CD1 4.33Å; A340-L351 HydrophobicContact CB-CD1 4.17Å; L351-L353 HydrophobicContact CD2-CD1 4.26Å; L351-L353 HydrophobicContact CD2-CD2 3.89Å; L351-L353 HydrophobicContact CD2-CG 3.96Å; L351-L353 HydrophobicContact CG-CD2 4.19Å; L351-L353 HydrophobicContact CG-CG 4.18Å; L351-L362 CarbonylContact O-C 3.51Å; L351-L362 WeakPolarHBondContact O-CA 3.49Å; L351-I363 HydrophobicContact CB-CB 4.43Å; L351-I363 PolarHBondContact N-O 3.05Å; L351-I363 PolarHBondContact O-N 3.01Å; L351-V398 HydrophobicContact CD1-CG2 4.15Å; L351-V398 HydrophobicContact CD2-CB 4.33Å; L351-V398 HydrophobicContact CD2-CG1 3.56Å; L351-V398 HydrophobicContact CD2-CG2 3.77Å; L351-F475 HydrophobicContact CB-CD1 3.94Å; L351-F475 HydrophobicContact CB-CD2 4.03Å; L351-F475 HydrophobicContact CB-CE1 3.59Å; L351-F475 HydrophobicContact CB-CE2 3.7Å; L351-F475 HydrophobicContact CB-CG 4.14Å; L351-F475 HydrophobicContact CB-CZ 3.48Å; L351-F475 VanDerWaalsContact CB-CZ 3.48Å; L351-F475 HydrophobicContact CD1-CG 4.46Å; L351-F475 HydrophobicContact CD2-CB 4.41Å; L351-F475 HydrophobicContact CD2-CD1 3.52Å; L351-F475 HydrophobicContact CD2-CE1 3.87Å; L351-F475 HydrophobicContact CD2-CG 3.95Å; L351-F475 HydrophobicContact CG-CD1 4.27Å; L351-F475 HydrophobicContact CG-CE1 4.36Å; L351-F475 HydrophobicContact CG-CG 4.42Å
352	Q	97.6	Very high	94.6	Very high	24 Å²	24	31.8 Å²	31.8	11%	0.112	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	120.9	171.7	-173.5	-176	-23.8	0	0	110.6	L339 S360 L362 M391 H488	L339-Q352 HydrophobicContact CB-CB 4.04Å; L339-Q352 PolarHBondContact O-N 3.44Å; Q352-S360 PolarHBondContact NE2-OG 2.97Å; Q352-L362 HydrophobicContact CB-CD1 3.78Å; Q352-L362 HydrophobicContact CG-CD1 4.22Å; Q352-M391 HydrophobicContact CB-SD 3.95Å; Q352-H488 PolarHBondContact NE2-CE1 3.49Å; Q352-H488 VanDerWaalsContact NE2-CE1 3.33Å; Q352-H488 PolarHBondContact NE2-NE2 2.67Å
353	L	96.4	Very high	94.8	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.01	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	109.3	176	-65.6	178	0	0	0	110.1	W305 F309 Y338 L351 S360 M361 I363 V398 L400	W305-L353 HydrophobicContact CE3-CB 4.12Å; W305-L353 HydrophobicContact CH2-CB 4Å; W305-L353 HydrophobicContact CH2-CD1 3.97Å; W305-L353 HydrophobicContact CZ3-CB 3.42Å; W305-L353 VanDerWaalsContact CZ3-CB 3.42Å; W305-L353 HydrophobicContact CZ3-CD1 4.21Å; W305-L353 HydrophobicContact CZ3-CG 4.45Å; F309-L353 HydrophobicContact CZ-CD1 4.44Å; Y338-L353 HydrophobicContact CD1-CD2 3.59Å; Y338-L353 HydrophobicContact CE1-CD2 3.49Å; Y338-L353 VanDerWaalsContact CE1-CD2 3.49Å; Y338-L353 HydrophobicContact CG-CD2 4.41Å; L351-L353 HydrophobicContact CD2-CD1 4.26Å; L351-L353 HydrophobicContact CD2-CD2 3.89Å; L351-L353 HydrophobicContact CD2-CG 3.96Å; L351-L353 HydrophobicContact CG-CD2 4.19Å; L351-L353 HydrophobicContact CG-CG 4.18Å; L353-S360 WeakPolarHBondContact O-CA 3.45Å; L353-S360 WeakPolarHBondContact O-CB 3.4Å; L353-M361 HydrophobicContact CB-CB 4.46Å; L353-M361 PolarHBondContact N-O 2.97Å; L353-M361 PolarHBondContact O-N 3.17Å; L353-I363 HydrophobicContact CD1-CD1 3.76Å; L353-V398 HydrophobicContact CD2-CG1 4.31Å; L353-L400 HydrophobicContact CD1-CD2 3.73Å
354	P	95.6	Very high	95	Very high	32 Å²	32	28.9 Å²	28.9	21%	0.208	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	137	-177.5	30.7	-33.8	0	0	0	112.3	E306	E306-P354 HydrophobicContact CB-CB 4.42Å; E306-P354 HydrophobicContact CB-CG 4.26Å; E306-P354 HydrophobicContact CG-CB 4.1Å; E306-P354 HydrophobicContact CG-CG 4.47Å; E306-P354 PolarHBondContact N-O 3.48Å; E306-P354 WeakPolarHBondContact OE2-CB 3.4Å
355	Y	95.1	Very high	95.2	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.008	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	154.3	165.9	-66.6	-70.9	0	0	0	110.1	F301 T304 W305 E306 G357 I359 M361	F301-Y355 HydrophobicContact CE1-CD2 4.3Å; F301-Y355 AromaticContact CE1-CE2 3.74Å; F301-Y355 HydrophobicContact CE1-CE2 3.74Å; F301-Y355 AromaticContact CE1-CZ 3.99Å; F301-Y355 AromaticContact CZ-CD2 3.98Å; F301-Y355 HydrophobicContact CZ-CD2 3.98Å; F301-Y355 AromaticContact CZ-CE2 3.9Å; F301-Y355 HydrophobicContact CZ-CE2 3.9Å; T304-Y355 CarbonylContact O-C 3.6Å; T304-Y355 VanDerWaalsContact O-CA 3.28Å; T304-Y355 WeakPolarHBondContact O-CA 3.45Å; T304-Y355 WeakPolarHBondContact O-CB 3.3Å; W305-Y355 AromaticContact CD2-CD1 3.78Å; W305-Y355 HydrophobicContact CD2-CD1 3.78Å; W305-Y355 AromaticContact CD2-CE1 3.41Å; W305-Y355 HydrophobicContact CD2-CE1 3.41Å; W305-Y355 VanDerWaalsContact CD2-CE1 3.41Å; W305-Y355 AromaticContact CE2-CE1 3.64Å; W305-Y355 AromaticContact CE3-CD1 3.36Å; W305-Y355 HydrophobicContact CE3-CD1 3.36Å; W305-Y355 HydrophobicContact CE3-CD2 4.48Å; W305-Y355 AromaticContact CE3-CE1 3.18Å; W305-Y355 HydrophobicContact CE3-CE1 3.18Å; W305-Y355 HydrophobicContact CE3-CE2 4.35Å; W305-Y355 HydrophobicContact CE3-CG 4.04Å; W305-Y355 AromaticContact CE3-CZ 3.73Å; W305-Y355 HydrophobicContact CG-CD1 4.37Å; W305-Y355 HydrophobicContact CG-CE1 4.25Å; W305-Y355 HydrophobicContact CH2-CD1 4.47Å; W305-Y355 AromaticContact CH2-CE1 3.55Å; W305-Y355 HydrophobicContact CH2-CE1 3.55Å; W305-Y355 HydrophobicContact CH2-CE2 4.07Å; W305-Y355 AromaticContact CH2-CZ 3.29Å; W305-Y355 WeakPolarHBondContact CH2-OH 3.14Å; W305-Y355 AromaticContact CZ2-CE1 3.75Å; W305-Y355 HydrophobicContact CZ2-CE1 3.75Å; W305-Y355 AromaticContact CZ2-CZ 3.82Å; W305-Y355 WeakPolarHBondContact CZ2-OH 3.49Å; W305-Y355 AromaticContact CZ3-CD1 3.73Å; W305-Y355 HydrophobicContact CZ3-CD1 3.73Å; W305-Y355 HydrophobicContact CZ3-CD2 4.15Å; W305-Y355 AromaticContact CZ3-CE1 3.23Å; W305-Y355 HydrophobicContact CZ3-CE1 3.23Å; W305-Y355 AromaticContact CZ3-CE2 3.7Å; W305-Y355 HydrophobicContact CZ3-CE2 3.7Å; W305-Y355 HydrophobicContact CZ3-CG 4.17Å; W305-Y355 AromaticContact CZ3-CZ 3.2Å; E306-Y355 VanDerWaalsContact CG-C 3.4Å; Y355-G357 PolarHBondContact O-N 3.26Å; Y355-I359 WeakPolarHBondContact CA-O 3.34Å; Y355-I359 WeakPolarHBondContact CB-O 3.04Å; Y355-I359 HydrophobicContact CD2-CG2 4.13Å; Y355-I359 HydrophobicContact CG-CG2 4.26Å; Y355-I359 PolarHBondContact N-O 3.03Å; Y355-I359 VanDerWaalsContact O-O 3.13Å; Y355-M361 HydrophobicContact CE2-CB 3.9Å; Y355-M361 WeakPolarHBondContact OH-CE 3.36Å
356	T	92.3	Very high	95.6	Very high	24 Å²	24	17.5 Å²	17.5	15%	0.147	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	135.1	171.8	62.4	0	0	0	0	109.9	G221 Y222 T304 E306 T456	G221-T356 PolarHBondContact O-OG1 3.37Å; Y222-T356 WeakPolarHBondContact CD1-O 3.31Å; T304-T356 HydrophobicContact CG2-CG2 4.27Å; T304-T356 PolarHBondContact O-N 3.43Å; T304-T356 PolarHBondContact O-OG1 2.78Å; E306-T356 HydrophobicContact CG-CG2 4.33Å; T356-T456 HydrophobicContact CG2-CG2 3.79Å
357	G	88.9	Confident	95.6	Very high	22 Å²	22	22 Å²	22	23%	0.227	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.8	23.5	175.7	0	0	0	0	0	115.6	F220 Y355 I359	F220-G357 WeakPolarHBondContact O-CA 3.37Å; F220-G357 PolarHBondContact O-N 3.24Å; Y355-G357 PolarHBondContact O-N 3.26Å; G357-I359 VanDerWaalsContact C-N 3.33Å; G357-I359 PolarHBondContact O-N 2.85Å
358	N	89.9	Confident	95.4	Very high	78 Å²	78	20.7 Å²	20.7	42%	0.417	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	37.8	174.4	-161.3	48.7	0	0	0	113.4	H488 R489	N358-H488 PolarHBondContact O-N 3.39Å; N358-R489 PolarHBondContact ND2-N 3.19Å
359	I	94.7	Very high	94.8	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	145.1	173.1	-163.4	179.3	0	0	0	107.8	Y222 F301 Y355 G357 I485 Y486 E487 V494	Y222-I359 HydrophobicContact CD1-CG2 3.62Å; Y222-I359 HydrophobicContact CE1-CB 4.19Å; Y222-I359 HydrophobicContact CE1-CD1 4.49Å; Y222-I359 HydrophobicContact CE1-CG2 3.74Å; Y222-I359 HydrophobicContact CG-CG2 4.32Å; F301-I359 HydrophobicContact CE2-CD1 3.76Å; F301-I359 HydrophobicContact CZ-CD1 4.03Å; Y355-I359 WeakPolarHBondContact CA-O 3.34Å; Y355-I359 WeakPolarHBondContact CB-O 3.04Å; Y355-I359 HydrophobicContact CD2-CG2 4.13Å; Y355-I359 HydrophobicContact CG-CG2 4.26Å; Y355-I359 PolarHBondContact N-O 3.03Å; Y355-I359 VanDerWaalsContact O-O 3.13Å; G357-I359 VanDerWaalsContact C-N 3.33Å; G357-I359 PolarHBondContact O-N 2.85Å; I359-I485 HydrophobicContact CD1-CG2 3.46Å; I359-I485 VanDerWaalsContact CD1-CG2 3.46Å; I359-I485 HydrophobicContact CG1-CG2 3.69Å; I359-Y486 CarbonylContact C-O 3.4Å; I359-Y486 VanDerWaalsContact CA-O 3.22Å; I359-Y486 WeakPolarHBondContact CA-O 3.2Å; I359-Y486 WeakPolarHBondContact CG1-O 3.07Å; I359-E487 HydrophobicContact CG1-CB 4.49Å; I359-V494 HydrophobicContact CD1-CG2 4.28Å
360	S	96.3	Very high	94.3	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.007	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	155.4	176	65.6	0	0	0	0	111.7	Q352 L353 I485 Y486 H488	Q352-S360 PolarHBondContact NE2-OG 2.97Å; L353-S360 WeakPolarHBondContact O-CA 3.45Å; L353-S360 WeakPolarHBondContact O-CB 3.4Å; S360-I485 WeakPolarHBondContact O-CA 3.49Å; S360-Y486 PolarHBondContact N-O 3.03Å; S360-Y486 PolarHBondContact O-N 3.49Å; S360-H488 VanDerWaalsContact CB-NE2 3.28Å; S360-H488 WeakPolarHBondContact CB-NE2 3.39Å; S360-H488 PolarHBondContact OG-CE1 3.35Å; S360-H488 PolarHBondContact OG-NE2 3.32Å
361	M	97.9	Very high	93.8	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	124.3	163.1	-178.3	175.4	-76.1	0	0	108.3	W305 L353 Y355 I363 F403 I449 V451 F483 L484 I485	W305-M361 HydrophobicContact CH2-CB 4.22Å; W305-M361 HydrophobicContact CH2-CE 4.49Å; W305-M361 HydrophobicContact CH2-SD 4.07Å; W305-M361 HydrophobicContact CZ3-CB 4.26Å; L353-M361 HydrophobicContact CB-CB 4.46Å; L353-M361 PolarHBondContact N-O 2.97Å; L353-M361 PolarHBondContact O-N 3.17Å; Y355-M361 HydrophobicContact CE2-CB 3.9Å; Y355-M361 WeakPolarHBondContact OH-CE 3.36Å; M361-I363 HydrophobicContact CG-CG1 4.03Å; M361-I363 HydrophobicContact SD-CD1 4.31Å; M361-I363 HydrophobicContact SD-CG1 4.2Å; M361-F403 HydrophobicContact CE-CZ 4.49Å; M361-I449 HydrophobicContact CE-CD1 3.97Å; M361-V451 HydrophobicContact CE-CG2 3.73Å; M361-F483 HydrophobicContact CE-CD2 4.09Å; M361-F483 HydrophobicContact CG-CB 4.15Å; M361-F483 HydrophobicContact SD-CB 4.4Å; M361-L484 CarbonylContact C-O 3.53Å; M361-L484 WeakPolarHBondContact CA-O 3.24Å; M361-I485 HydrophobicContact CE-CD1 4.17Å
362	L	97.9	Very high	93.5	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	121.6	169.7	-163.9	71.9	0	0	0	108.7	I350 L351 Q352 V384 W387 M391 F483 L484	I350-L362 HydrophobicContact CG2-CD1 3.71Å; I350-L362 HydrophobicContact CG2-CD2 4.09Å; I350-L362 HydrophobicContact CG2-CG 3.78Å; L351-L362 CarbonylContact O-C 3.51Å; L351-L362 WeakPolarHBondContact O-CA 3.49Å; Q352-L362 HydrophobicContact CB-CD1 3.78Å; Q352-L362 HydrophobicContact CG-CD1 4.22Å; L362-V384 HydrophobicContact CD2-CG1 4.23Å; L362-W387 HydrophobicContact CD2-CE3 3.75Å; L362-W387 HydrophobicContact CD2-CZ3 4.3Å; L362-M391 HydrophobicContact CD1-CE 3.29Å; L362-M391 HydrophobicContact CD1-SD 4.1Å; L362-M391 HydrophobicContact CD2-CE 4.27Å; L362-M391 HydrophobicContact CG-CE 4.33Å; L362-F483 CarbonylContact O-C 3.55Å; L362-F483 WeakPolarHBondContact O-CA 3.29Å; L362-L484 HydrophobicContact CB-CB 4.36Å; L362-L484 HydrophobicContact CB-CD1 4.5Å; L362-L484 PolarHBondContact N-O 3.15Å; L362-L484 PolarHBondContact O-N 3.04Å
363	I	98.3	Very high	93.1	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	127.9	178.6	-62.6	171.6	0	0	0	107.4	I350 L351 L353 M361 L400 F475 V477 F481 L482	I350-I363 CarbonylContact C-O 3.56Å; I350-I363 VanDerWaalsContact CA-O 3.22Å; I350-I363 WeakPolarHBondContact CA-O 3.35Å; I350-I363 WeakPolarHBondContact CG2-O 3.49Å; L351-I363 HydrophobicContact CB-CB 4.43Å; L351-I363 PolarHBondContact N-O 3.05Å; L351-I363 PolarHBondContact O-N 3.01Å; L353-I363 HydrophobicContact CD1-CD1 3.76Å; M361-I363 HydrophobicContact CG-CG1 4.03Å; M361-I363 HydrophobicContact SD-CD1 4.31Å; M361-I363 HydrophobicContact SD-CG1 4.2Å; I363-L400 HydrophobicContact CD1-CD1 3.48Å; I363-L400 VanDerWaalsContact CD1-CD1 3.48Å; I363-F475 HydrophobicContact CG2-CE1 4.22Å; I363-V477 HydrophobicContact CD1-CG2 4.36Å; I363-V477 HydrophobicContact CG2-CG2 4.18Å; I363-F481 HydrophobicContact CG2-CB 4.24Å; I363-F481 HydrophobicContact CG2-CD2 3.88Å; I363-F481 HydrophobicContact CG2-CG 4.3Å; I363-L482 WeakPolarHBondContact CA-O 3.41Å
364	A	98	Very high	92.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	114.3	169.4	0	0	0	0	0	108.4	I350 L375 W387 L482	I350-A364 HydrophobicContact CD1-CB 3.49Å; I350-A364 VanDerWaalsContact CD1-CB 3.49Å; A364-L375 HydrophobicContact CB-CD1 4.47Å; A364-L375 HydrophobicContact CB-CD2 3.9Å; A364-W387 HydrophobicContact CB-CH2 3.78Å; A364-W387 HydrophobicContact CB-CZ3 4.08Å; A364-L482 HydrophobicContact CB-CB 4.36Å; A364-L482 PolarHBondContact N-O 2.91Å; A364-L482 PolarHBondContact O-N 2.93Å
365	L	97.7	Very high	92.8	Very high	10 Å²	10	32.3 Å²	32.3	5%	0.052	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	105	-174.6	-173.9	69.7	0	0	0	109	C348 D349 F475 T476 V477 H479 F481	C348-L365 CarbonylContact C-O 3.57Å; C348-L365 VanDerWaalsContact CA-O 3.26Å; C348-L365 WeakPolarHBondContact CA-O 3.27Å; C348-L365 WeakPolarHBondContact CB-O 3.13Å; D349-L365 PolarHBondContact N-O 2.75Å; D349-L365 PolarHBondContact O-N 3.38Å; L365-F475 HydrophobicContact CB-CE1 4.33Å; L365-F475 HydrophobicContact CB-CZ 3.98Å; L365-F475 HydrophobicContact CD2-CE1 4.1Å; L365-F475 HydrophobicContact CD2-CZ 4.24Å; L365-T476 WeakPolarHBondContact CD2-O 3.44Å; L365-V477 HydrophobicContact CD1-CG1 4.31Å; L365-H479 VanDerWaalsContact CD1-CE1 3.47Å; L365-H479 WeakPolarHBondContact CD1-CE1 3.45Å; L365-H479 VanDerWaalsContact CD1-NE2 3.28Å; L365-H479 WeakPolarHBondContact CD1-NE2 3.4Å; L365-H479 WeakPolarHBondContact CG-NE2 3.48Å; L365-F481 HydrophobicContact CD1-CB 3.81Å
366	P	96.1	Very high	92.7	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.013	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	140.4	175.4	-21.3	32.5	0	0	0	111.8	K368 M372 L375 H479	P366-K368 VanDerWaalsContact C-N 3.34Å; P366-K368 VanDerWaalsContact CB-O 3.31Å; P366-K368 WeakPolarHBondContact CB-O 3.43Å; P366-K368 PolarHBondContact O-N 2.99Å; P366-M372 HydrophobicContact CG-CB 4.3Å; P366-M372 HydrophobicContact CG-CE 3.74Å; P366-M372 HydrophobicContact CG-SD 4.34Å; P366-L375 HydrophobicContact CG-CD2 3.79Å; P366-H479 PolarHBondContact O-NE2 3.29Å
367	R	92.7	Very high	92.7	Very high	106 Å²	106	35.3 Å²	35.3	40%	0.4	18%	0.179	S	C	.	.	S	Bend	trans	-70	-31.6	178.1	-68.2	176.6	-175.6	155.9	6.6	113.3	H344 E347 D349	H344-R367 PolarHBondContact ND1-NH1 3.37Å; E347-R367 WeakPolarHBondContact O-CB 3.28Å; E347-R367 WeakPolarHBondContact O-CG 3.48Å; E347-R367 PolarHBondContact O-N 2.99Å; D349-R367 IonicContact OD1-CZ 3.42Å; D349-R367 IonicContact OD1-NE 3.37Å; D349-R367 PolarHBondContact OD1-NE 2.85Å; D349-R367 IonicContact OD1-NH2 3.95Å; D349-R367 PolarHBondContact OD1-NH2 3.46Å; D349-R367 IonicContact OD2-NE 3.33Å
368	K	89.1	Confident	92.8	Very high	79 Å²	79	38 Å²	38	34%	0.343	19%	0.186	S	C	.	.	S	Bend	trans	-112.6	140.7	171.7	-65.8	-171.3	175.8	-166.6	0	108.8	D77 P366 T370 G371	D77-K368 IonicContact OD1-NZ 3.89Å; D77-K368 IonicContact OD2-NZ 3.86Å; D77-K368 PolarHBondContact OD2-NZ 3.22Å; D77-K368 VanDerWaalsContact OD2-NZ 3.13Å; P366-K368 VanDerWaalsContact C-N 3.34Å; P366-K368 VanDerWaalsContact CB-O 3.31Å; P366-K368 WeakPolarHBondContact CB-O 3.43Å; P366-K368 PolarHBondContact O-N 2.99Å; K368-T370 PolarHBondContact O-N 3.21Å; K368-G371 PolarHBondContact O-N 3.33Å
369	I	84.4	Confident	92.9	Very high	29 Å²	29	34.4 Å²	34.4	15%	0.149	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-59.5	-38.3	179	-64.9	168.2	0	0	0	111.2	R320 D323 G371 M372 H479 P480	R320-I369 HydrophobicContact CG-CD1 3.7Å; D323-I369 WeakPolarHBondContact OD1-CD1 3.46Å; I369-G371 PolarHBondContact O-N 3.29Å; I369-M372 PolarHBondContact O-N 3.28Å; I369-H479 HydrophobicContact CG1-CB 4.31Å; I369-P480 HydrophobicContact CG2-CG 4.41Å
370	T	85.1	Confident	92.8	Very high	102 Å²	102	35.5 Å²	35.5	63%	0.626	17%	0.174	S	C	*	.	G	3₁₀ helix	trans	-61.3	-22.4	176.2	53.7	0	0	0	0	113.3	K368 M372	K368-T370 PolarHBondContact O-N 3.21Å; T370-M372 VanDerWaalsContact C-N 3.28Å; T370-M372 PolarHBondContact O-N 2.91Å
371	G	87.6	Confident	92.5	Very high	15 Å²	15	36.4 Å²	36.4	16%	0.155	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-71.2	-14.6	179.7	0	0	0	0	0	114.9	K368 I369 R373 T374 L375	K368-G371 PolarHBondContact O-N 3.33Å; I369-G371 PolarHBondContact O-N 3.29Å; G371-R373 PolarHBondContact O-N 2.78Å; G371-T374 PolarHBondContact O-N 3.43Å; G371-L375 PolarHBondContact O-N 3.09Å
372	M	91.9	Very high	92.1	Very high	14 Å²	14	39.5 Å²	39.5	7%	0.069	20%	0.198	C	C	.	.	H	α-helix	trans	-56	-40.5	179	-178.7	55.7	71.7	0	0	112.1	P366 I369 T370 T374 L375 E376 P480 F481 L482 R498	P366-M372 HydrophobicContact CG-CB 4.3Å; P366-M372 HydrophobicContact CG-CE 3.74Å; P366-M372 HydrophobicContact CG-SD 4.34Å; I369-M372 PolarHBondContact O-N 3.28Å; T370-M372 VanDerWaalsContact C-N 3.28Å; T370-M372 PolarHBondContact O-N 2.91Å; M372-T374 PolarHBondContact O-N 3.34Å; M372-L375 WeakPolarHBondContact O-CB 3.35Å; M372-L375 PolarHBondContact O-N 3.17Å; M372-L375 HydrophobicContact SD-CD2 4.32Å; M372-E376 HydrophobicContact CG-CG 4.26Å; M372-E376 WeakPolarHBondContact O-CB 3.3Å; M372-E376 VanDerWaalsContact O-CG 3.24Å; M372-E376 WeakPolarHBondContact O-CG 3.26Å; M372-E376 PolarHBondContact O-N 3.21Å; M372-E376 HydrophobicContact SD-CG 3.92Å; M372-P480 HydrophobicContact CE-CB 4.12Å; M372-P480 WeakPolarHBondContact CE-O 3.36Å; M372-F481 VanDerWaalsContact CE-C 3.5Å; M372-F481 VanDerWaalsContact CE-CA 3.43Å; M372-L482 HydrophobicContact SD-CB 4.48Å; M372-R498 HydrophobicContact SD-CG 4.44Å
373	R	90	Very high	91.8	Very high	132 Å²	132	40.2 Å²	40.2	50%	0.498	20%	0.203	S	C	.	.	H	α-helix	trans	-61.4	-44.3	179.8	170	159	-164.4	178.3	4	112.4	R148 G371 E376 Q377	R148-R373 VanDerWaalsContact NH2-CA 3.35Å; R148-R373 VanDerWaalsContact NH2-CB 3.33Å; G371-R373 PolarHBondContact O-N 2.78Å; R373-E376 PolarHBondContact O-N 3.2Å; R373-Q377 WeakPolarHBondContact O-CB 3.28Å; R373-Q377 VanDerWaalsContact O-CG 3.24Å; R373-Q377 WeakPolarHBondContact O-CG 3.27Å; R373-Q377 PolarHBondContact O-N 2.8Å; R373-Q377 VanDerWaalsContact O-N 3.08Å
374	T	91.3	Very high	91.5	Very high	60 Å²	60	40.4 Å²	40.4	37%	0.368	20%	0.204	S	C	.	.	H	α-helix	trans	-66.7	-43.6	178.7	-52.3	0	0	0	0	110.6	G371 M372 E376 Q377 Q378	G371-T374 PolarHBondContact O-N 3.43Å; M372-T374 PolarHBondContact O-N 3.34Å; T374-E376 PolarHBondContact O-N 3.26Å; T374-Q377 PolarHBondContact O-N 3.49Å; T374-Q378 WeakPolarHBondContact O-CG 3.14Å; T374-Q378 PolarHBondContact O-N 3.34Å
375	L	93.6	Very high	91.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-56.7	-48.6	175.5	178.7	62.2	0	0	0	111.8	L346 A364 P366 G371 M372 Q377 Q378 I379 W387 L482	L346-L375 HydrophobicContact CB-CD1 4.41Å; L346-L375 HydrophobicContact CD1-CD1 4.1Å; A364-L375 HydrophobicContact CB-CD1 4.47Å; A364-L375 HydrophobicContact CB-CD2 3.9Å; P366-L375 HydrophobicContact CG-CD2 3.79Å; G371-L375 PolarHBondContact O-N 3.09Å; M372-L375 WeakPolarHBondContact O-CB 3.35Å; M372-L375 PolarHBondContact O-N 3.17Å; M372-L375 HydrophobicContact SD-CD2 4.32Å; L375-Q377 VanDerWaalsContact C-N 3.32Å; L375-Q377 PolarHBondContact O-N 3.31Å; L375-Q378 PolarHBondContact O-N 3.28Å; L375-I379 WeakPolarHBondContact O-CB 3.08Å; L375-I379 PolarHBondContact O-N 3.18Å; L375-W387 HydrophobicContact CD1-CH2 3.91Å; L375-W387 HydrophobicContact CD1-CZ2 3.98Å; L375-L482 HydrophobicContact CD2-CB 4.1Å; L375-L482 HydrophobicContact CG-CD2 4.49Å
376	E	93.4	Very high	90.9	Very high	2 Å²	2	44 Å²	44	1%	0.009	22%	0.221	C	C	.	.	H	α-helix	trans	-65.9	-31.5	179.2	-69.9	177.3	124.5	0	0	113.4	Y144 R145 R148 M372 R373 T374 I379 R498	Y144-E376 HydrophobicContact CE1-CB 4.09Å; Y144-E376 HydrophobicContact CE1-CG 3.88Å; Y144-E376 PolarHBondContact OH-OE1 3.5Å; R145-E376 WeakPolarHBondContact CG-O 3.46Å; R148-E376 IonicContact CZ-OE2 2.74Å; R148-E376 IonicContact NE-OE1 3.82Å; R148-E376 IonicContact NE-OE2 2.8Å; R148-E376 PolarHBondContact NE-OE2 3.49Å; R148-E376 IonicContact NH2-OE2 3.52Å; R148-E376 PolarHBondContact NH2-OE2 2.7Å; R148-E376 VanDerWaalsContact NH2-OE2 3.14Å; M372-E376 HydrophobicContact CG-CG 4.26Å; M372-E376 WeakPolarHBondContact O-CB 3.3Å; M372-E376 VanDerWaalsContact O-CG 3.24Å; M372-E376 WeakPolarHBondContact O-CG 3.26Å; M372-E376 PolarHBondContact O-N 3.21Å; M372-E376 HydrophobicContact SD-CG 3.92Å; R373-E376 PolarHBondContact O-N 3.2Å; T374-E376 PolarHBondContact O-N 3.26Å; E376-I379 WeakPolarHBondContact O-CG2 3.46Å; E376-R498 VanDerWaalsContact OE1-CD 3.3Å; E376-R498 WeakPolarHBondContact OE1-CD 3.43Å; E376-R498 IonicContact OE1-CZ 3.63Å; E376-R498 IonicContact OE1-NE 2.71Å; E376-R498 IonicContact OE1-NH1 2.69Å; E376-R498 PolarHBondContact OE1-NH1 3.16Å; E376-R498 IonicContact OE2-NH1 2.82Å; E376-R498 PolarHBondContact OE2-NH1 2.84Å
377	Q	91.8	Very high	90.8	Very high	88 Å²	88	44 Å²	44	41%	0.411	22%	0.22	S	C	.	.	H	α-helix	trans	-74.3	-36	178.7	-77.2	173.9	-13.3	0	0	112.3	R373 T374 L375	R373-Q377 WeakPolarHBondContact O-CB 3.28Å; R373-Q377 VanDerWaalsContact O-CG 3.24Å; R373-Q377 WeakPolarHBondContact O-CG 3.27Å; R373-Q377 PolarHBondContact O-N 2.8Å; R373-Q377 VanDerWaalsContact O-N 3.08Å; T374-Q377 PolarHBondContact O-N 3.49Å; L375-Q377 VanDerWaalsContact C-N 3.32Å; L375-Q377 PolarHBondContact O-N 3.31Å
378	Q	90.5	Very high	90.7	Very high	79 Å²	79	41.8 Å²	41.8	37%	0.369	22%	0.216	S	C	.	.	H	α-helix	trans	-99	-9.6	-172.5	-61.7	-170.2	19	0	0	114.1	L346 T374 L375 S380	L346-Q378 HydrophobicContact CD2-CB 3.64Å; L346-Q378 HydrophobicContact CD2-CG 4.19Å; T374-Q378 WeakPolarHBondContact O-CG 3.14Å; T374-Q378 PolarHBondContact O-N 3.34Å; L375-Q378 PolarHBondContact O-N 3.28Å; Q378-S380 PolarHBondContact O-N 2.95Å; Q378-S380 PolarHBondContact O-OG 3.02Å
379	I	93.1	Very high	90.9	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.01	23%	0.232	C	C	.	.			trans	-57.1	127.9	178.3	-168	65.5	0	0	0	111.4	F141 L375 E376 V383 V384 W387 L482	F141-I379 HydrophobicContact CD1-CB 4.38Å; F141-I379 HydrophobicContact CD1-CG1 3.79Å; F141-I379 HydrophobicContact CD1-CG2 3.79Å; F141-I379 HydrophobicContact CE1-CD1 4.46Å; F141-I379 HydrophobicContact CE1-CG1 3.5Å; F141-I379 HydrophobicContact CE1-CG2 4.37Å; F141-I379 HydrophobicContact CG-CG2 4.4Å; F141-I379 HydrophobicContact CZ-CG1 4.14Å; L375-I379 WeakPolarHBondContact O-CB 3.08Å; L375-I379 PolarHBondContact O-N 3.18Å; E376-I379 WeakPolarHBondContact O-CG2 3.46Å; I379-V383 HydrophobicContact CD1-CG1 4.21Å; I379-V384 HydrophobicContact CD1-CG2 3.9Å; I379-W387 HydrophobicContact CD1-CH2 3.33Å; I379-W387 HydrophobicContact CD1-CZ2 4.24Å; I379-W387 HydrophobicContact CD1-CZ3 3.51Å; I379-L482 HydrophobicContact CD1-CD2 4.35Å; I379-L482 HydrophobicContact CG1-CD2 4.15Å
380	S	91.6	Very high	91.3	Very high	23 Å²	23	48.5 Å²	48.5	16%	0.161	25%	0.249	C	C	.	.			trans	-156.7	164.3	-174	59.6	0	0	0	0	111.3	Q378 T382 V383 V384	Q378-S380 PolarHBondContact O-N 2.95Å; Q378-S380 PolarHBondContact O-OG 3.02Å; S380-T382 PolarHBondContact O-N 3.07Å; S380-T382 PolarHBondContact OG-OG1 3.14Å; S380-V383 PolarHBondContact O-N 3.36Å; S380-V383 VanDerWaalsContact O-N 3.14Å; S380-V383 VanDerWaalsContact OG-CG2 3.26Å; S380-V383 WeakPolarHBondContact OG-CG2 3.47Å; S380-V383 PolarHBondContact OG-N 3.27Å; S380-V384 PolarHBondContact O-N 2.79Å
381	P	90.1	Very high	91.8	Very high	21 Å²	21	44.4 Å²	44.4	14%	0.136	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-29.8	178.6	-21	33.6	0	0	0	112.8	A137 R138 F141 N385	A137-P381 HydrophobicContact CB-CG 4.31Å; R138-P381 HydrophobicContact CB-CG 3.95Å; F141-P381 HydrophobicContact CD2-CG 3.96Å; F141-P381 HydrophobicContact CE2-CB 4.45Å; F141-P381 HydrophobicContact CE2-CG 3.84Å; P381-N385 WeakPolarHBondContact O-CB 3.33Å; P381-N385 PolarHBondContact O-N 3.27Å
382	T	89.3	Confident	92.1	Very high	64 Å²	64	46.7 Å²	46.7	39%	0.393	23%	0.234	S	C	.	.	H	α-helix	trans	-66	-45.3	174.9	37.1	0	0	0	0	112	L122 S380 N385 K386	L122-T382 HydrophobicContact CD1-CG2 3.55Å; L122-T382 HydrophobicContact CD2-CG2 4.05Å; L122-T382 HydrophobicContact CG-CG2 4.1Å; S380-T382 PolarHBondContact O-N 3.07Å; S380-T382 PolarHBondContact OG-OG1 3.14Å; T382-N385 PolarHBondContact O-N 3.41Å; T382-K386 PolarHBondContact O-N 3.44Å
383	V	92	Very high	92.1	Very high	17 Å²	17	50.9 Å²	50.9	10%	0.103	26%	0.257	C	S	.	.	H	α-helix	trans	-63.1	-48.2	178	166.9	0	0	0	0	110.2	L346 I379 S380 N385 K386 W387	L346-V383 HydrophobicContact CD1-CG1 3.53Å; L346-V383 HydrophobicContact CD1-CG2 4.32Å; I379-V383 HydrophobicContact CD1-CG1 4.21Å; S380-V383 PolarHBondContact O-N 3.36Å; S380-V383 VanDerWaalsContact O-N 3.14Å; S380-V383 VanDerWaalsContact OG-CG2 3.26Å; S380-V383 WeakPolarHBondContact OG-CG2 3.47Å; S380-V383 PolarHBondContact OG-N 3.27Å; V383-N385 VanDerWaalsContact C-N 3.33Å; V383-N385 PolarHBondContact O-N 2.77Å; V383-K386 VanDerWaalsContact O-CB 3.32Å; V383-K386 WeakPolarHBondContact O-CB 3.24Å; V383-K386 PolarHBondContact O-N 3.08Å; V383-K386 VanDerWaalsContact O-N 3.12Å; V383-W387 HydrophobicContact CG1-CD2 3.94Å; V383-W387 HydrophobicContact CG1-CE3 4.42Å; V383-W387 HydrophobicContact CG1-CH2 3.94Å; V383-W387 HydrophobicContact CG1-CZ2 3.34Å; V383-W387 HydrophobicContact CG1-CZ3 4.42Å; V383-W387 PolarHBondContact O-N 3.28Å
384	V	92.7	Very high	92.1	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.024	26%	0.258	C	S	.	.	H	α-helix	trans	-62	-40.7	178.6	178.2	0	0	0	0	111.8	F141 L362 I379 S380 K386 W387 L388 L484 Y486	F141-V384 HydrophobicContact CZ-CG2 3.93Å; L362-V384 HydrophobicContact CD2-CG1 4.23Å; I379-V384 HydrophobicContact CD1-CG2 3.9Å; S380-V384 PolarHBondContact O-N 2.79Å; V384-K386 VanDerWaalsContact C-N 3.33Å; V384-K386 PolarHBondContact O-N 2.82Å; V384-W387 HydrophobicContact CG2-CE3 4.13Å; V384-W387 HydrophobicContact CG2-CZ3 4.18Å; V384-W387 PolarHBondContact O-N 3.01Å; V384-L388 HydrophobicContact CG1-CD1 4.06Å; V384-L388 HydrophobicContact CG1-CG 4.37Å; V384-L388 WeakPolarHBondContact O-CG 3.38Å; V384-L388 PolarHBondContact O-N 3.41Å; V384-L484 HydrophobicContact CG2-CD2 4.01Å; V384-Y486 HydrophobicContact CG1-CE2 3.73Å
385	N	90	Very high	91.9	Very high	29 Å²	29	52.4 Å²	52.4	16%	0.155	27%	0.265	C	S	.	.	H	α-helix	trans	-64	-38.4	176.5	-165.4	-59.9	0	0	0	111.8	P381 T382 V383 K389	P381-N385 WeakPolarHBondContact O-CB 3.33Å; P381-N385 PolarHBondContact O-N 3.27Å; T382-N385 PolarHBondContact O-N 3.41Å; V383-N385 VanDerWaalsContact C-N 3.33Å; V383-N385 PolarHBondContact O-N 2.77Å; N385-K389 WeakPolarHBondContact O-CG 3.3Å; N385-K389 PolarHBondContact O-N 3.25Å; N385-K389 VanDerWaalsContact O-N 3.15Å; N385-K389 WeakPolarHBondContact OD1-CD 3.49Å; N385-K389 WeakPolarHBondContact OD1-CE 3.5Å; N385-K389 PolarHBondContact OD1-NZ 2.84Å
386	K	92.1	Very high	91.7	Very high	55 Å²	55	53.5 Å²	53.5	24%	0.239	27%	0.269	C	S	.	.	H	α-helix	trans	-60.5	-48	173	-178.3	-165	180	-164.5	0	110.7	D343 E345 T382 V383 V384 L388 K389 N390	D343-K386 IonicContact OD1-NZ 3.15Å; D343-K386 PolarHBondContact OD1-NZ 3.26Å; D343-K386 VanDerWaalsContact OD1-NZ 3.15Å; D343-K386 IonicContact OD2-NZ 3.49Å; E345-K386 IonicContact OE1-NZ 2.73Å; E345-K386 PolarHBondContact OE1-NZ 3.37Å; E345-K386 IonicContact OE2-NZ 2.71Å; E345-K386 PolarHBondContact OE2-NZ 3.25Å; T382-K386 PolarHBondContact O-N 3.44Å; V383-K386 VanDerWaalsContact O-CB 3.32Å; V383-K386 WeakPolarHBondContact O-CB 3.24Å; V383-K386 PolarHBondContact O-N 3.08Å; V383-K386 VanDerWaalsContact O-N 3.12Å; V384-K386 VanDerWaalsContact C-N 3.33Å; V384-K386 PolarHBondContact O-N 2.82Å; K386-L388 PolarHBondContact O-N 3.28Å; K386-K389 PolarHBondContact O-N 2.87Å; K386-N390 WeakPolarHBondContact O-CB 3.24Å; K386-N390 PolarHBondContact O-N 3.14Å
387	W	94.6	Very high	91.7	Very high	3 Å²	3	54.8 Å²	54.8	1%	0.011	28%	0.275	C	S	.	.	H	α-helix	trans	-56.9	-53.2	176.9	-62.8	-19.8	0	0	0	111.5	D343 L346 I350 L362 A364 L375 I379 V383 V384 K389 N390 M391 L484	D343-W387 PolarHBondContact OD2-NE1 3.16Å; L346-W387 HydrophobicContact CD1-CZ2 3.76Å; I350-W387 HydrophobicContact CD1-CD2 3.79Å; I350-W387 HydrophobicContact CD1-CE3 4.05Å; I350-W387 HydrophobicContact CD1-CG 4.38Å; I350-W387 HydrophobicContact CD1-CH2 3.84Å; I350-W387 HydrophobicContact CD1-CZ2 3.6Å; I350-W387 HydrophobicContact CD1-CZ3 4.08Å; I350-W387 HydrophobicContact CG1-CB 4.5Å; I350-W387 HydrophobicContact CG1-CD2 3.87Å; I350-W387 HydrophobicContact CG1-CE3 4.41Å; I350-W387 HydrophobicContact CG1-CG 3.93Å; I350-W387 HydrophobicContact CG1-CZ2 4.46Å; I350-W387 HydrophobicContact CG2-CB 4.41Å; I350-W387 HydrophobicContact CG2-CD2 4.39Å; I350-W387 HydrophobicContact CG2-CE3 4.26Å; L362-W387 HydrophobicContact CD2-CE3 3.75Å; L362-W387 HydrophobicContact CD2-CZ3 4.3Å; A364-W387 HydrophobicContact CB-CH2 3.78Å; A364-W387 HydrophobicContact CB-CZ3 4.08Å; L375-W387 HydrophobicContact CD1-CH2 3.91Å; L375-W387 HydrophobicContact CD1-CZ2 3.98Å; I379-W387 HydrophobicContact CD1-CH2 3.33Å; I379-W387 HydrophobicContact CD1-CZ2 4.24Å; I379-W387 HydrophobicContact CD1-CZ3 3.51Å; V383-W387 HydrophobicContact CG1-CD2 3.94Å; V383-W387 HydrophobicContact CG1-CE3 4.42Å; V383-W387 HydrophobicContact CG1-CH2 3.94Å; V383-W387 HydrophobicContact CG1-CZ2 3.34Å; V383-W387 HydrophobicContact CG1-CZ3 4.42Å; V383-W387 PolarHBondContact O-N 3.28Å; V384-W387 HydrophobicContact CG2-CE3 4.13Å; V384-W387 HydrophobicContact CG2-CZ3 4.18Å; V384-W387 PolarHBondContact O-N 3.01Å; W387-K389 PolarHBondContact O-N 3.06Å; W387-N390 PolarHBondContact O-N 3.26Å; W387-M391 HydrophobicContact CB-CE 3.78Å; W387-M391 WeakPolarHBondContact O-CG 3.47Å; W387-M391 PolarHBondContact O-N 2.82Å; W387-M391 VanDerWaalsContact O-N 3.1Å; W387-L484 HydrophobicContact CZ3-CD1 4.35Å
388	L	91.5	Very high	91.9	Very high	60 Å²	60	50.6 Å²	50.6	31%	0.314	26%	0.256	S	S	.	.	H	α-helix	trans	-58.5	-32.3	-178	-69.8	171.2	0	0	0	112.9	V384 K386 M391	V384-L388 HydrophobicContact CG1-CD1 4.06Å; V384-L388 HydrophobicContact CG1-CG 4.37Å; V384-L388 WeakPolarHBondContact O-CG 3.38Å; V384-L388 PolarHBondContact O-N 3.41Å; K386-L388 PolarHBondContact O-N 3.28Å; L388-M391 HydrophobicContact CD2-CE 4.23Å; L388-M391 HydrophobicContact CD2-SD 4.36Å
389	K	91.6	Very high	92.2	Very high	154 Å²	154	46.9 Å²	46.9	67%	0.67	24%	0.238	S	C	*	.	H	α-helix	trans	-76.3	-33.6	176.1	-76.2	172.8	173.5	157.9	0	113.7	N385 K386 W387	N385-K389 WeakPolarHBondContact O-CG 3.3Å; N385-K389 PolarHBondContact O-N 3.25Å; N385-K389 VanDerWaalsContact O-N 3.15Å; N385-K389 WeakPolarHBondContact OD1-CD 3.49Å; N385-K389 WeakPolarHBondContact OD1-CE 3.5Å; N385-K389 PolarHBondContact OD1-NZ 2.84Å; K386-K389 PolarHBondContact O-N 2.87Å; W387-K389 PolarHBondContact O-N 3.06Å
390	N	94.4	Very high	92.4	Very high	94 Å²	94	46.8 Å²	46.8	50%	0.503	24%	0.238	S	C	.	.	H	α-helix	trans	-89.6	-8.9	-174	-69.6	-5.1	0	0	0	113.4	A341 K386 W387	A341-N390 HydrophobicContact CB-CB 4.49Å; K386-N390 WeakPolarHBondContact O-CB 3.24Å; K386-N390 PolarHBondContact O-N 3.14Å; W387-N390 PolarHBondContact O-N 3.26Å
391	M	94.6	Very high	92.7	Very high	17 Å²	17	45.7 Å²	45.7	8%	0.084	23%	0.23	C	C	.	.			trans	-63.9	137.9	179	-78.8	169	-152.5	0	0	112.6	L339 A340 A341 I350 Q352 L362 W387 L388	L339-M391 HydrophobicContact CB-CB 4.06Å; L339-M391 HydrophobicContact CB-CG 4.47Å; L339-M391 HydrophobicContact CB-SD 4.2Å; L339-M391 HydrophobicContact CD2-CB 4.08Å; A340-M391 WeakPolarHBondContact O-CA 3.35Å; A341-M391 HydrophobicContact CB-CG 3.86Å; I350-M391 HydrophobicContact CB-CE 4.32Å; I350-M391 HydrophobicContact CG2-CE 3.54Å; Q352-M391 HydrophobicContact CB-SD 3.95Å; L362-M391 HydrophobicContact CD1-CE 3.29Å; L362-M391 HydrophobicContact CD1-SD 4.1Å; L362-M391 HydrophobicContact CD2-CE 4.27Å; L362-M391 HydrophobicContact CG-CE 4.33Å; W387-M391 HydrophobicContact CB-CE 3.78Å; W387-M391 WeakPolarHBondContact O-CG 3.47Å; W387-M391 PolarHBondContact O-N 2.82Å; W387-M391 VanDerWaalsContact O-N 3.1Å; L388-M391 HydrophobicContact CD2-CE 4.23Å; L388-M391 HydrophobicContact CD2-SD 4.36Å
392	T	94.2	Very high	93	Very high	63 Å²	63	49.5 Å²	49.5	39%	0.387	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	136.5	175.4	58	0	0	0	0	110.6	A340 R396	A340-T392 PolarHBondContact N-O 2.81Å; A340-T392 VanDerWaalsContact N-O 3.14Å; A340-T392 PolarHBondContact O-N 2.76Å; T392-R396 PolarHBondContact O-NH1 3Å
393	N	92.5	Very high	93.3	Very high	102 Å²	102	46.8 Å²	46.8	55%	0.545	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	119.6	-179.6	-165.3	-1.8	0	0	0	109.4	N337 Y338 L339	N337-N393 WeakPolarHBondContact CB-OD1 3.09Å; Y338-N393 PolarHBondContact N-OD1 3.23Å; Y338-N393 WeakPolarHBondContact O-CA 3.39Å; Y338-N393 PolarHBondContact O-OD1 2.93Å; L339-N393 HydrophobicContact CD2-CB 3.8Å; L339-N393 HydrophobicContact CG-CB 4.44Å
394	R	88.4	Confident	93.4	Very high	141 Å²	141	49.3 Å²	49.3	53%	0.532	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	154.2	177.9	-60.6	-173.3	178.6	-176.3	-1	110.1	Y338 R396	Y338-R394 PolarHBondContact N-O 2.87Å; Y338-R394 PolarHBondContact O-N 3.27Å; Y338-R394 VanDerWaalsContact O-N 3.12Å; R394-R396 PolarHBondContact O-N 2.88Å
395	T	88	Confident	93.5	Very high	83 Å²	83	49.1 Å²	49.1	51%	0.509	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	121.5	170	-47	0	0	0	0	109.7	K335 G336 N337	K335-T395 HydrophobicContact CG-CG2 4.45Å; G336-T395 CarbonylContact O-C 3.55Å; G336-T395 VanDerWaalsContact O-CA 3.3Å; G336-T395 WeakPolarHBondContact O-CA 3.28Å; N337-T395 WeakPolarHBondContact OD1-CA 3.32Å; N337-T395 PolarHBondContact OD1-N 3.05Å; N337-T395 PolarHBondContact OD1-OG1 3.43Å
396	R	89.8	Confident	93.7	Very high	23 Å²	23	51.1 Å²	51.1	9%	0.087	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	150.3	178.8	-60.6	-179.2	177.7	103.8	-7.3	110.1	K335 G336 Y338 A340 T392 R394 I473	K335-R396 WeakPolarHBondContact CA-O 3.5Å; G336-R396 PolarHBondContact N-O 3.21Å; G336-R396 PolarHBondContact O-N 3.14Å; Y338-R396 PolarHBondContact O-NH1 3.35Å; A340-R396 VanDerWaalsContact CB-CZ 3.45Å; A340-R396 VanDerWaalsContact CB-NH1 3.34Å; T392-R396 PolarHBondContact O-NH1 3Å; R394-R396 PolarHBondContact O-N 2.88Å; R396-I473 VanDerWaalsContact CA-O 3.24Å; R396-I473 WeakPolarHBondContact CA-O 3.41Å; R396-I473 WeakPolarHBondContact CB-O 3.36Å; R396-I473 HydrophobicContact CG-CB 4.14Å; R396-I473 HydrophobicContact CG-CG2 3.92Å
397	E	93.2	Very high	93.8	Very high	29 Å²	29	50.2 Å²	50.2	14%	0.136	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	119.6	166.3	-179.2	176.9	91.4	0	0	108.5	V333 N334 K335 I473 R474 F475	V333-E397 HydrophobicContact CG1-CG 3.71Å; N334-E397 CarbonylContact O-C 3.5Å; N334-E397 WeakPolarHBondContact O-CA 3.44Å; K335-E397 HydrophobicContact CB-CB 4.42Å; E397-I473 PolarHBondContact N-O 3.4Å; E397-I473 VanDerWaalsContact N-O 3.08Å; E397-R474 HydrophobicContact CB-CG 4.25Å; E397-R474 CarbonylContact O-C 3.49Å; E397-R474 VanDerWaalsContact O-CA 3.29Å; E397-R474 WeakPolarHBondContact O-CA 3.47Å; E397-R474 WeakPolarHBondContact OE1-CD 2.91Å; E397-R474 IonicContact OE1-CZ 2.85Å; E397-R474 IonicContact OE1-NE 3.91Å; E397-R474 PolarHBondContact OE1-NE 3.48Å; E397-R474 IonicContact OE1-NH2 3.67Å; E397-F475 PolarHBondContact O-N 3.47Å
398	V	95.9	Very high	93.7	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	127.1	179.9	176.3	0	0	0	0	108.6	F309 V333 N334 Y338 L351 L353 F475	F309-V398 HydrophobicContact CE1-CG1 4.37Å; F309-V398 HydrophobicContact CZ-CG1 4.41Å; V333-V398 WeakPolarHBondContact CA-O 3.37Å; N334-V398 PolarHBondContact N-O 3.43Å; N334-V398 PolarHBondContact O-N 2.92Å; Y338-V398 HydrophobicContact CD2-CG2 3.49Å; Y338-V398 VanDerWaalsContact CD2-CG2 3.49Å; Y338-V398 HydrophobicContact CE2-CB 4.36Å; Y338-V398 HydrophobicContact CE2-CG2 3.65Å; Y338-V398 HydrophobicContact CG-CG2 4.02Å; L351-V398 HydrophobicContact CD1-CG2 4.15Å; L351-V398 HydrophobicContact CD2-CB 4.33Å; L351-V398 HydrophobicContact CD2-CG1 3.56Å; L351-V398 HydrophobicContact CD2-CG2 3.77Å; L353-V398 HydrophobicContact CD2-CG1 4.31Å; V398-F475 WeakPolarHBondContact CA-O 3.48Å; V398-F475 HydrophobicContact CG2-CB 4.46Å
399	S	96.9	Very high	93.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	121.7	167.3	-56.3	0	0	0	0	109.1	R317 M332 F475 V477	R317-S399 PolarHBondContact NH1-OG 3.24Å; R317-S399 VanDerWaalsContact NH1-OG 3.16Å; M332-S399 CarbonylContact O-C 3.53Å; M332-S399 WeakPolarHBondContact O-CA 3.44Å; S399-F475 PolarHBondContact N-O 3.03Å; S399-V477 WeakPolarHBondContact O-CB 3.23Å; S399-V477 WeakPolarHBondContact O-CG2 3.18Å; S399-V477 PolarHBondContact O-N 3.32Å
400	L	97.9	Very high	93.9	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	128.9	-178	179.5	71.3	0	0	0	110	W305 F309 M332 L353 I363 V451 V477 F481	W305-L400 HydrophobicContact CH2-CD2 4.27Å; W305-L400 HydrophobicContact CZ2-CD2 3.97Å; F309-L400 HydrophobicContact CE1-CB 4.42Å; F309-L400 HydrophobicContact CZ-CB 4.34Å; F309-L400 HydrophobicContact CZ-CD2 4.34Å; M332-L400 WeakPolarHBondContact CB-O 3.48Å; M332-L400 HydrophobicContact CE-CB 4.25Å; M332-L400 HydrophobicContact CE-CD2 3.85Å; M332-L400 HydrophobicContact CE-CG 4.07Å; M332-L400 PolarHBondContact N-O 2.9Å; M332-L400 PolarHBondContact O-N 3.36Å; L353-L400 HydrophobicContact CD1-CD2 3.73Å; I363-L400 HydrophobicContact CD1-CD1 3.48Å; I363-L400 VanDerWaalsContact CD1-CD1 3.48Å; L400-V451 HydrophobicContact CD2-CG1 4.09Å; L400-V477 HydrophobicContact CD1-CB 4.23Å; L400-V477 HydrophobicContact CD1-CG1 4.25Å; L400-V477 HydrophobicContact CD1-CG2 4.17Å; L400-F481 HydrophobicContact CD1-CZ 4.43Å
401	P	97.3	Very high	93.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	142.1	175.5	24.4	-35.9	0	0	0	110.8	F319 V329 M331 F403 V477 F481 P502	F319-P401 HydrophobicContact CD2-CG 4.23Å; F319-P401 HydrophobicContact CE2-CG 4.07Å; V329-P401 HydrophobicContact CG2-CB 4.04Å; M331-P401 HydrophobicContact SD-CB 4.34Å; M331-P401 VanDerWaalsContact SD-CD 3.57Å; P401-F403 HydrophobicContact CG-CD1 4.45Å; P401-F403 VanDerWaalsContact O-CD1 3.25Å; P401-F403 WeakPolarHBondContact O-CD1 3.41Å; P401-V477 WeakPolarHBondContact CD-O 3.31Å; P401-F481 HydrophobicContact CG-CE1 3.98Å; P401-F481 HydrophobicContact CG-CZ 4.36Å; P401-P502 HydrophobicContact CB-CB 3.86Å; P401-P502 HydrophobicContact CB-CG 3.86Å; P401-P502 HydrophobicContact CG-CB 4.25Å; P401-P502 HydrophobicContact CG-CG 4.11Å
402	R	95.9	Very high	93.9	Very high	101 Å²	101	43.5 Å²	43.5	38%	0.381	21%	0.208	S	C	.	.			trans	-74.8	129.8	163.1	178	-162.2	-66.9	-175.8	-2.3	108	P330 M332 V451 N452 E453	P330-R402 HydrophobicContact CB-CB 4.38Å; P330-R402 HydrophobicContact CG-CB 4.05Å; P330-R402 PolarHBondContact O-N 2.78Å; M332-R402 HydrophobicContact CG-CB 4.11Å; M332-R402 HydrophobicContact SD-CB 4.01Å; R402-V451 WeakPolarHBondContact CG-O 3.29Å; R402-N452 HydrophobicContact CG-CB 4.18Å; R402-E453 IonicContact CZ-OE1 3.78Å; R402-E453 IonicContact CZ-OE2 2.83Å; R402-E453 VanDerWaalsContact CZ-OE2 3.25Å; R402-E453 IonicContact NE-OE1 2.96Å; R402-E453 PolarHBondContact NE-OE1 3.5Å; R402-E453 IonicContact NE-OE2 3.65Å; R402-E453 PolarHBondContact NE-OE2 2.82Å; R402-E453 IonicContact NH2-OE1 3.44Å; R402-E453 PolarHBondContact NH2-OE1 2.9Å; R402-E453 IonicContact NH2-OE2 2.78Å; R402-E453 PolarHBondContact NH2-OE2 3.4Å
403	F	95.7	Very high	93.9	Very high	8 Å²	8	45.8 Å²	45.8	4%	0.035	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	159.3	179.1	63.8	-92.5	0	0	0	112.1	M361 P401 L405 I449 V451 F481 F483 V499 P502	M361-F403 HydrophobicContact CE-CZ 4.49Å; P401-F403 HydrophobicContact CG-CD1 4.45Å; P401-F403 VanDerWaalsContact O-CD1 3.25Å; P401-F403 WeakPolarHBondContact O-CD1 3.41Å; F403-L405 HydrophobicContact CD2-CD1 4.46Å; F403-L405 HydrophobicContact CD2-CD2 4.33Å; F403-L405 HydrophobicContact CD2-CG 3.89Å; F403-L405 HydrophobicContact CE2-CD1 4.31Å; F403-L405 HydrophobicContact CE2-CG 4.17Å; F403-I449 HydrophobicContact CE2-CG2 4.17Å; F403-V451 HydrophobicContact CD1-CB 4.14Å; F403-V451 HydrophobicContact CD1-CG1 4.41Å; F403-V451 HydrophobicContact CD2-CB 4.41Å; F403-V451 HydrophobicContact CD2-CG2 4.33Å; F403-V451 HydrophobicContact CE1-CB 3.89Å; F403-V451 HydrophobicContact CE1-CG1 4Å; F403-V451 HydrophobicContact CE1-CG2 3.94Å; F403-V451 HydrophobicContact CE2-CB 4.22Å; F403-V451 HydrophobicContact CE2-CG2 3.71Å; F403-V451 HydrophobicContact CG-CB 4.39Å; F403-V451 HydrophobicContact CZ-CB 3.95Å; F403-V451 HydrophobicContact CZ-CG1 4.39Å; F403-V451 HydrophobicContact CZ-CG2 3.49Å; F403-V451 VanDerWaalsContact CZ-CG2 3.49Å; F403-V451 PolarHBondContact N-O 3.01Å; F403-V451 PolarHBondContact O-N 3.27Å; F403-F481 HydrophobicContact CD1-CZ 4.38Å; F403-F481 HydrophobicContact CE1-CE2 4.38Å; F403-F481 AromaticContact CE1-CZ 3.76Å; F403-F481 HydrophobicContact CE1-CZ 3.76Å; F403-F481 HydrophobicContact CZ-CE2 4.5Å; F403-F481 HydrophobicContact CZ-CZ 4.23Å; F403-F483 HydrophobicContact CE2-CE1 4.36Å; F403-F483 HydrophobicContact CZ-CE1 4.45Å; F403-V499 HydrophobicContact CD2-CG2 4.18Å; F403-V499 HydrophobicContact CE1-CG2 4.31Å; F403-V499 HydrophobicContact CE2-CG2 3.9Å; F403-V499 HydrophobicContact CG-CG2 4.47Å; F403-V499 HydrophobicContact CZ-CG2 3.97Å; F403-P502 HydrophobicContact CB-CB 3.89Å
404	K	95.1	Very high	94	Very high	70 Å²	70	41.3 Å²	41.3	30%	0.304	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	129.1	168	-177.9	-167.5	171.7	-149.2	0	106.5	E406 I449 N505	K404-E406 IonicContact NZ-OE2 3.86Å; K404-E406 PolarHBondContact NZ-OE2 3Å; K404-I449 VanDerWaalsContact CA-O 3.31Å; K404-I449 WeakPolarHBondContact CA-O 3.14Å; K404-I449 WeakPolarHBondContact CG-O 3.48Å; K404-N505 PolarHBondContact O-OD1 3.12Å
405	L	94.8	Very high	94.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	139.6	170.3	-52.7	178.2	0	0	0	109.7	N156 L158 F403 T448 I449 F483 V499 N505	N156-L405 HydrophobicContact CB-CD1 4.42Å; N156-L405 HydrophobicContact CB-CD2 3.75Å; N156-L405 VanDerWaalsContact ND2-CD2 3.33Å; N156-L405 WeakPolarHBondContact ND2-CD2 3.48Å; L158-L405 HydrophobicContact CB-CB 4.32Å; L158-L405 HydrophobicContact CB-CD1 4.26Å; L158-L405 HydrophobicContact CD2-CB 4.14Å; F403-L405 HydrophobicContact CD2-CD1 4.46Å; F403-L405 HydrophobicContact CD2-CD2 4.33Å; F403-L405 HydrophobicContact CD2-CG 3.89Å; F403-L405 HydrophobicContact CE2-CD1 4.31Å; F403-L405 HydrophobicContact CE2-CG 4.17Å; L405-T448 CarbonylContact O-C 3.52Å; L405-T448 VanDerWaalsContact O-CA 3.29Å; L405-T448 WeakPolarHBondContact O-CA 3.46Å; L405-I449 HydrophobicContact CB-CG2 3.81Å; L405-I449 HydrophobicContact CD1-CG2 4.35Å; L405-I449 HydrophobicContact CG-CG2 4.12Å; L405-I449 PolarHBondContact N-O 2.77Å; L405-I449 PolarHBondContact O-N 3.15Å; L405-F483 HydrophobicContact CD1-CE1 3.97Å; L405-F483 HydrophobicContact CD1-CZ 4.12Å; L405-V499 HydrophobicContact CD1-CG2 4.06Å; L405-N505 WeakPolarHBondContact CA-OXT 3.41Å
406	E	93.3	Very high	94.6	Very high	71 Å²	71	34.1 Å²	34.1	33%	0.332	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	96.1	175.7	-173.8	169.9	162.8	0	0	109.3	K404 Q446 G447 T448 N505	K404-E406 IonicContact NZ-OE2 3.86Å; K404-E406 PolarHBondContact NZ-OE2 3Å; E406-Q446 PolarHBondContact OE1-NE2 2.9Å; E406-Q446 VanDerWaalsContact OE1-NE2 3.08Å; E406-G447 WeakPolarHBondContact CA-O 3.45Å; E406-T448 HydrophobicContact CB-CG2 4.43Å; E406-T448 HydrophobicContact CG-CG2 4.5Å; E406-N505 PolarHBondContact N-OXT 3.39Å
407	Q	93.8	Very high	94.7	Very high	36 Å²	36	39.2 Å²	39.2	17%	0.168	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	140.4	-173.1	-62.7	-61.9	-33.4	0	0	110.9	L158 Y409 Q446 G447 N505	L158-Q407 HydrophobicContact CB-CB 4.03Å; L158-Q407 HydrophobicContact CB-CG 3.81Å; Q407-Y409 HydrophobicContact CB-CD2 4.47Å; Q407-Y409 HydrophobicContact CB-CE2 3.5Å; Q407-Y409 WeakPolarHBondContact CB-OH 3.48Å; Q407-Q446 CarbonylContact O-C 3.58Å; Q407-Q446 WeakPolarHBondContact O-CA 3.41Å; Q407-Q446 WeakPolarHBondContact O-CG 3.19Å; Q407-G447 PolarHBondContact N-O 3.06Å; Q407-G447 PolarHBondContact O-N 2.97Å; Q407-N505 PolarHBondContact NE2-OXT 3.28Å
408	N	92.3	Very high	94.6	Very high	70 Å²	70	39.7 Å²	39.7	37%	0.374	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	120.9	-172.5	-163.1	-16.6	0	0	0	110.1	K444 H445 Q446	N408-K444 VanDerWaalsContact CG-CE 3.5Å; N408-K444 WeakPolarHBondContact ND2-CE 3.36Å; N408-K444 WeakPolarHBondContact OD1-CE 3.26Å; N408-K444 WeakPolarHBondContact OD1-CG 3.28Å; N408-H445 CarbonylContact C-O 3.6Å; N408-H445 WeakPolarHBondContact CA-O 3.39Å; N408-H445 PolarHBondContact OD1-O 3.09Å; N408-Q446 HydrophobicContact CB-CB 4.33Å; N408-Q446 PolarHBondContact ND2-OE1 3.49Å
409	Y	93.6	Very high	94.3	Very high	24 Å²	24	41.7 Å²	41.7	9%	0.094	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	141.5	-173.1	-53.9	-78.7	0	0	0	111.1	I147 I157 L158 Q407 L411 H445	I147-Y409 HydrophobicContact CG2-CD1 3.99Å; I147-Y409 HydrophobicContact CG2-CE1 3.63Å; I157-Y409 WeakPolarHBondContact CA-OH 3.39Å; L158-Y409 PolarHBondContact N-OH 3.45Å; L158-Y409 VanDerWaalsContact O-CE2 3.29Å; L158-Y409 WeakPolarHBondContact O-CE2 3.41Å; Q407-Y409 HydrophobicContact CB-CD2 4.47Å; Q407-Y409 HydrophobicContact CB-CE2 3.5Å; Q407-Y409 WeakPolarHBondContact CB-OH 3.48Å; Y409-L411 HydrophobicContact CG-CD2 4.47Å; Y409-H445 PolarHBondContact N-O 3.46Å; Y409-H445 PolarHBondContact O-N 3.47Å
410	D	93.8	Very high	94.1	Very high	78 Å²	78	41.7 Å²	41.7	42%	0.417	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	110.5	158.4	-169	-17.6	0	0	0	108	I412 W442	D410-I412 VanDerWaalsContact C-N 3.31Å; D410-I412 PolarHBondContact O-N 3.24Å; D410-I412 VanDerWaalsContact OD1-CG1 3.32Å; D410-I412 WeakPolarHBondContact OD1-CG1 3.33Å; D410-I412 PolarHBondContact OD1-N 2.63Å; D410-W442 PolarHBondContact OD2-NE1 3.25Å
411	L	94.4	Very high	93.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.217	C	C	.	.			trans	-88.5	3.6	-170.1	-62	179.2	0	0	0	113.4	L143 I147 I164 Y409 L415 L443 H445	L143-L411 HydrophobicContact CD1-CD2 4.5Å; L143-L411 HydrophobicContact CD2-CD1 4.36Å; I147-L411 HydrophobicContact CD1-CD2 3.77Å; I147-L411 HydrophobicContact CG1-CD2 4.33Å; I164-L411 HydrophobicContact CD1-CD1 3.53Å; I164-L411 HydrophobicContact CG1-CD1 3.86Å; I164-L411 HydrophobicContact CG2-CD1 4.15Å; Y409-L411 HydrophobicContact CG-CD2 4.47Å; L411-L415 HydrophobicContact CB-CG 4.47Å; L411-L415 WeakPolarHBondContact O-CB 3.33Å; L411-L415 VanDerWaalsContact O-CG 3.28Å; L411-L415 WeakPolarHBondContact O-CG 3.42Å; L411-L415 PolarHBondContact O-N 3.15Å; L411-L443 HydrophobicContact CB-CD2 3.86Å; L411-L443 HydrophobicContact CB-CG 4.17Å; L411-L443 PolarHBondContact N-O 3.46Å; L411-H445 HydrophobicContact CD1-CB 3.45Å; L411-H445 VanDerWaalsContact CD1-CB 3.45Å; L411-H445 HydrophobicContact CG-CB 3.9Å
412	I	94.3	Very high	93.6	Very high	14 Å²	14	45.1 Å²	45.1	7%	0.072	22%	0.224	C	C	.	.	H	α-helix	trans	-59.4	-52.2	-174.5	-71	-179.5	0	0	0	111.6	D410 L415 K416 F424 N441 L443	D410-I412 VanDerWaalsContact C-N 3.31Å; D410-I412 PolarHBondContact O-N 3.24Å; D410-I412 VanDerWaalsContact OD1-CG1 3.32Å; D410-I412 WeakPolarHBondContact OD1-CG1 3.33Å; D410-I412 PolarHBondContact OD1-N 2.63Å; I412-L415 PolarHBondContact O-N 2.83Å; I412-K416 HydrophobicContact CG2-CD 4.18Å; I412-K416 WeakPolarHBondContact O-CG 3.35Å; I412-K416 PolarHBondContact O-N 3.37Å; I412-F424 HydrophobicContact CB-CD1 4.4Å; I412-F424 HydrophobicContact CB-CE1 4.22Å; I412-F424 HydrophobicContact CD1-CD1 4.24Å; I412-F424 HydrophobicContact CD1-CE1 4.4Å; I412-F424 HydrophobicContact CG1-CD1 3.94Å; I412-F424 HydrophobicContact CG1-CE1 3.69Å; I412-F424 HydrophobicContact CG1-CZ 4.4Å; I412-F424 HydrophobicContact CG2-CB 4.5Å; I412-F424 HydrophobicContact CG2-CD1 3.86Å; I412-F424 HydrophobicContact CG2-CD2 4.3Å; I412-F424 HydrophobicContact CG2-CE1 4.11Å; I412-F424 HydrophobicContact CG2-CE2 4.5Å; I412-F424 HydrophobicContact CG2-CG 3.97Å; I412-F424 HydrophobicContact CG2-CZ 4.42Å; I412-N441 WeakPolarHBondContact CD1-O 3.3Å; I412-L443 HydrophobicContact CG1-CB 3.98Å
413	E	94.7	Very high	93.5	Very high	112 Å²	112	40.4 Å²	40.4	52%	0.523	21%	0.206	S	C	.	.	H	α-helix	trans	-66	-43.4	-176.9	-62.7	-51.5	130.8	0	0	111.4	L415 K416 E417	E413-L415 VanDerWaalsContact C-N 3.3Å; E413-L415 PolarHBondContact O-N 3.39Å; E413-K416 WeakPolarHBondContact O-CB 3.43Å; E413-K416 PolarHBondContact O-N 3.33Å; E413-K416 VanDerWaalsContact O-N 3.08Å; E413-K416 IonicContact OE1-NZ 2.89Å; E413-K416 PolarHBondContact OE1-NZ 3.18Å; E413-K416 IonicContact OE2-NZ 3.81Å; E413-E417 PolarHBondContact O-N 3.14Å
414	N	94.7	Very high	93.4	Very high	7 Å²	7	41.2 Å²	41.2	4%	0.037	21%	0.21	C	C	.	.	H	α-helix	trans	-58.3	-41.6	175.2	-55.2	107.8	0	0	0	112.3	L143 S146 D150 E417 M418	L143-N414 HydrophobicContact CD1-CB 3.74Å; S146-N414 WeakPolarHBondContact OG-CA 3.43Å; S146-N414 WeakPolarHBondContact OG-CB 3.5Å; S146-N414 PolarHBondContact OG-ND2 3.23Å; D150-N414 PolarHBondContact OD2-ND2 2.94Å; N414-E417 PolarHBondContact O-N 3.35Å; N414-M418 VanDerWaalsContact O-CG 3.32Å; N414-M418 WeakPolarHBondContact O-CG 3.34Å; N414-M418 PolarHBondContact O-N 3.15Å
415	L	94.5	Very high	93.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-71.8	-29.6	177.9	-72	-176.3	0	0	0	112.9	F139 L143 M168 L411 I412 E413 M418 G419 L420 F424 L443	F139-L415 HydrophobicContact CE2-CD2 3.97Å; F139-L415 HydrophobicContact CZ-CD2 3.99Å; L143-L415 HydrophobicContact CD1-CD2 4.41Å; M168-L415 HydrophobicContact CE-CD1 4.21Å; M168-L415 HydrophobicContact SD-CD1 4.13Å; L411-L415 HydrophobicContact CB-CG 4.47Å; L411-L415 WeakPolarHBondContact O-CB 3.33Å; L411-L415 VanDerWaalsContact O-CG 3.28Å; L411-L415 WeakPolarHBondContact O-CG 3.42Å; L411-L415 PolarHBondContact O-N 3.15Å; I412-L415 PolarHBondContact O-N 2.83Å; E413-L415 VanDerWaalsContact C-N 3.3Å; E413-L415 PolarHBondContact O-N 3.39Å; L415-M418 HydrophobicContact CD2-SD 4.24Å; L415-M418 PolarHBondContact O-N 2.75Å; L415-G419 PolarHBondContact O-N 3.23Å; L415-L420 HydrophobicContact CB-CD1 4.16Å; L415-L420 HydrophobicContact CD2-CD1 4.17Å; L415-L420 VanDerWaalsContact O-CD1 3.3Å; L415-L420 WeakPolarHBondContact O-CD1 3.34Å; L415-L420 PolarHBondContact O-N 3.43Å; L415-F424 HydrophobicContact CB-CE2 3.94Å; L415-F424 HydrophobicContact CB-CZ 3.81Å; L415-F424 HydrophobicContact CD1-CZ 4.07Å; L415-L443 HydrophobicContact CD1-CD2 3.23Å; L415-L443 HydrophobicContact CG-CD2 4.45Å
416	K	94.2	Very high	92.7	Very high	74 Å²	74	50 Å²	50	32%	0.322	25%	0.251	S	S	.	.	H	α-helix	trans	-63.9	-43.9	171	-73.6	171.4	-178.1	168.8	0	111.6	I412 E413 M418 G419 L420 F424	I412-K416 HydrophobicContact CG2-CD 4.18Å; I412-K416 WeakPolarHBondContact O-CG 3.35Å; I412-K416 PolarHBondContact O-N 3.37Å; E413-K416 WeakPolarHBondContact O-CB 3.43Å; E413-K416 PolarHBondContact O-N 3.33Å; E413-K416 VanDerWaalsContact O-N 3.08Å; E413-K416 IonicContact OE1-NZ 2.89Å; E413-K416 PolarHBondContact OE1-NZ 3.18Å; E413-K416 IonicContact OE2-NZ 3.81Å; K416-M418 PolarHBondContact O-N 3.29Å; K416-G419 WeakPolarHBondContact O-CA 3.47Å; K416-G419 PolarHBondContact O-N 3.41Å; K416-L420 VanDerWaalsContact CA-O 3.29Å; K416-L420 WeakPolarHBondContact CA-O 3.4Å; K416-F424 HydrophobicContact CD-CD2 4.41Å; K416-F424 HydrophobicContact CG-CD2 3.6Å; K416-F424 HydrophobicContact CG-CE2 3.93Å
417	E	92	Very high	92.2	Very high	129 Å²	129	51.2 Å²	51.2	60%	0.603	27%	0.267	S	S	*	.	H	α-helix	trans	-59.7	-34.2	174.3	-65.9	-176	158.1	0	0	112.2	S146 E413 N414 G419	S146-E417 PolarHBondContact OG-OE2 3.48Å; E413-E417 PolarHBondContact O-N 3.14Å; N414-E417 PolarHBondContact O-N 3.35Å; E417-G419 PolarHBondContact O-N 2.88Å
418	M	90.7	Very high	91.9	Very high	40 Å²	40	50 Å²	50	20%	0.197	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	0.5	175.3	-64.3	-178.5	73	0	0	113.9	F139 N142 L143 N414 L415 K416 L420	F139-M418 HydrophobicContact CD2-CE 3.48Å; F139-M418 VanDerWaalsContact CD2-CE 3.48Å; F139-M418 HydrophobicContact CE2-CE 3.59Å; F139-M418 HydrophobicContact CE2-SD 4.06Å; N142-M418 HydrophobicContact CB-CE 3.67Å; L143-M418 HydrophobicContact CB-SD 4.02Å; L143-M418 HydrophobicContact CD1-SD 3.96Å; N414-M418 VanDerWaalsContact O-CG 3.32Å; N414-M418 WeakPolarHBondContact O-CG 3.34Å; N414-M418 PolarHBondContact O-N 3.15Å; L415-M418 HydrophobicContact CD2-SD 4.24Å; L415-M418 PolarHBondContact O-N 2.75Å; K416-M418 PolarHBondContact O-N 3.29Å; M418-L420 HydrophobicContact CB-CD1 4.33Å
419	G	90.6	Very high	91.8	Very high	41 Å²	41	49.1 Å²	49.1	42%	0.423	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.5	9.6	173.5	0	0	0	0	0	115.6	L415 K416 E417	L415-G419 PolarHBondContact O-N 3.23Å; K416-G419 WeakPolarHBondContact O-CA 3.47Å; K416-G419 PolarHBondContact O-N 3.41Å; E417-G419 PolarHBondContact O-N 2.88Å
420	L	92.4	Very high	91.8	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	26%	0.256	C	S	.	.			trans	-89.3	104.6	169.2	-62.5	88.5	0	0	0	109	M168 I183 A186 L187 L415 K416 M418 I423 F424	M168-L420 HydrophobicContact CE-CD2 3.44Å; M168-L420 VanDerWaalsContact CE-CD2 3.44Å; I183-L420 HydrophobicContact CB-CD2 4.49Å; I183-L420 HydrophobicContact CG1-CD2 4.03Å; A186-L420 HydrophobicContact CB-CD1 3.06Å; A186-L420 HydrophobicContact CB-CG 3.74Å; L187-L420 HydrophobicContact CD1-CD2 4.28Å; L415-L420 HydrophobicContact CB-CD1 4.16Å; L415-L420 HydrophobicContact CD2-CD1 4.17Å; L415-L420 VanDerWaalsContact O-CD1 3.3Å; L415-L420 WeakPolarHBondContact O-CD1 3.34Å; L415-L420 PolarHBondContact O-N 3.43Å; K416-L420 VanDerWaalsContact CA-O 3.29Å; K416-L420 WeakPolarHBondContact CA-O 3.4Å; M418-L420 HydrophobicContact CB-CD1 4.33Å; L420-I423 HydrophobicContact CB-CG2 4.29Å; L420-F424 HydrophobicContact CB-CE2 4.02Å; L420-F424 WeakPolarHBondContact O-CD2 3.47Å; L420-F424 WeakPolarHBondContact O-CE2 3.4Å
421	T	93.3	Very high	91.8	Very high	44 Å²	44	47.1 Å²	47.1	27%	0.27	25%	0.254	S	S	.	.			trans	-117.8	-31.3	177.6	75.5	0	0	0	0	113	I423 F424 K425	T421-I423 PolarHBondContact O-N 3.28Å; T421-F424 PolarHBondContact O-N 3.17Å; T421-K425 WeakPolarHBondContact O-CG 3.42Å; T421-K425 PolarHBondContact OG1-NZ 3.13Å
422	D	92.7	Very high	91.7	Very high	28 Å²	28	48.2 Å²	48.2	15%	0.15	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-69.2	-38.7	-172.1	-67.8	6.6	0	0	0	112	T179 Q182 F424 K425 G428	T179-D422 HydrophobicContact CG2-CB 4.21Å; T179-D422 WeakPolarHBondContact OG1-CB 3.22Å; Q182-D422 VanDerWaalsContact CD-CG 3.46Å; Q182-D422 PolarHBondContact NE2-OD1 2.97Å; Q182-D422 PolarHBondContact NE2-OD2 3.28Å; Q182-D422 PolarHBondContact OE1-OD1 3.35Å; D422-F424 PolarHBondContact O-N 3.48Å; D422-F424 VanDerWaalsContact O-N 3.07Å; D422-K425 PolarHBondContact O-N 3.27Å; D422-G428 WeakPolarHBondContact O-CA 3.46Å
423	I	93.6	Very high	91.6	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-58.9	-24.9	-179.5	-162.5	178.8	0	0	0	112.8	M168 M171 T179 I183 L420 T421 F430 L440	M168-I423 HydrophobicContact CE-CD1 3.83Å; M171-I423 HydrophobicContact CB-CD1 4.28Å; T179-I423 HydrophobicContact CG2-CB 3.97Å; T179-I423 HydrophobicContact CG2-CG1 4.41Å; I183-I423 HydrophobicContact CD1-CD1 3.96Å; I183-I423 HydrophobicContact CG1-CD1 4.39Å; L420-I423 HydrophobicContact CB-CG2 4.29Å; T421-I423 PolarHBondContact O-N 3.28Å; I423-F430 HydrophobicContact CB-CZ 4.39Å; I423-F430 HydrophobicContact CD1-CZ 4.45Å; I423-F430 HydrophobicContact CG1-CE1 3.93Å; I423-F430 HydrophobicContact CG1-CE2 4.38Å; I423-F430 HydrophobicContact CG1-CZ 3.42Å; I423-F430 VanDerWaalsContact CG1-CZ 3.42Å; I423-F430 WeakPolarHBondContact O-CZ 3.17Å; I423-L440 HydrophobicContact CD1-CD2 3.97Å; I423-L440 HydrophobicContact CG1-CB 4.19Å; I423-L440 HydrophobicContact CG1-CD2 4.3Å; I423-L440 WeakPolarHBondContact O-CB 3.28Å; I423-L440 PolarHBondContact O-N 3.09Å
424	F	93.4	Very high	91.5	Very high	25 Å²	25	42.3 Å²	42.3	11%	0.11	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-98.8	-2.6	-178.1	-51.7	-61.5	0	0	0	113.3	I412 L415 K416 L420 T421 D422 L440	I412-F424 HydrophobicContact CB-CD1 4.4Å; I412-F424 HydrophobicContact CB-CE1 4.22Å; I412-F424 HydrophobicContact CD1-CD1 4.24Å; I412-F424 HydrophobicContact CD1-CE1 4.4Å; I412-F424 HydrophobicContact CG1-CD1 3.94Å; I412-F424 HydrophobicContact CG1-CE1 3.69Å; I412-F424 HydrophobicContact CG1-CZ 4.4Å; I412-F424 HydrophobicContact CG2-CB 4.5Å; I412-F424 HydrophobicContact CG2-CD1 3.86Å; I412-F424 HydrophobicContact CG2-CD2 4.3Å; I412-F424 HydrophobicContact CG2-CE1 4.11Å; I412-F424 HydrophobicContact CG2-CE2 4.5Å; I412-F424 HydrophobicContact CG2-CG 3.97Å; I412-F424 HydrophobicContact CG2-CZ 4.42Å; L415-F424 HydrophobicContact CB-CE2 3.94Å; L415-F424 HydrophobicContact CB-CZ 3.81Å; L415-F424 HydrophobicContact CD1-CZ 4.07Å; K416-F424 HydrophobicContact CD-CD2 4.41Å; K416-F424 HydrophobicContact CG-CD2 3.6Å; K416-F424 HydrophobicContact CG-CE2 3.93Å; L420-F424 HydrophobicContact CB-CE2 4.02Å; L420-F424 WeakPolarHBondContact O-CD2 3.47Å; L420-F424 WeakPolarHBondContact O-CE2 3.4Å; T421-F424 PolarHBondContact O-N 3.17Å; D422-F424 PolarHBondContact O-N 3.48Å; D422-F424 VanDerWaalsContact O-N 3.07Å; F424-L440 HydrophobicContact CD1-CB 4.15Å; F424-L440 HydrophobicContact CD1-CD2 4.32Å; F424-L440 HydrophobicContact CD1-CG 4.32Å; F424-L440 HydrophobicContact CE1-CB 4.48Å; F424-L440 HydrophobicContact CE1-CD2 3.81Å; F424-L440 HydrophobicContact CE1-CG 4.24Å
425	K	90.1	Very high	91.3	Very high	100 Å²	100	47.2 Å²	47.2	44%	0.435	27%	0.272	S	S	.	.	S	Bend	trans	-105	151.4	179.7	-68.7	169.1	-176.8	165.1	0	109.9	T421 D422 S427 G428 A439	T421-K425 WeakPolarHBondContact O-CG 3.42Å; T421-K425 PolarHBondContact OG1-NZ 3.13Å; D422-K425 PolarHBondContact O-N 3.27Å; K425-S427 WeakPolarHBondContact CB-OG 3.3Å; K425-S427 PolarHBondContact O-N 3.11Å; K425-G428 WeakPolarHBondContact O-CA 3.34Å; K425-G428 PolarHBondContact O-N 3.33Å; K425-A439 WeakPolarHBondContact O-CB 3.46Å
426	E	83.6	Confident	91.1	Very high	155 Å²	155	51.1 Å²	51.1	72%	0.724	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-18.9	171.5	-64.5	-171.6	169.2	0	0	113.1	A439	E426-A439 HydrophobicContact CG-CB 4.46Å
427	S	84.1	Confident	90.8	Very high	97 Å²	97	56.2 Å²	56.2	68%	0.678	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-4.6	170.7	64.2	0	0	0	0	113.4	K425	K425-S427 WeakPolarHBondContact CB-OG 3.3Å; K425-S427 PolarHBondContact O-N 3.11Å
428	G	86.6	Confident	90.8	Very high	9 Å²	9	50.2 Å²	50.2	9%	0.093	29%	0.285	C	S	.	.	S	Bend	trans	-60.7	140.1	177.5	0	0	0	0	0	111.9	D422 K425 F430	D422-G428 WeakPolarHBondContact O-CA 3.46Å; K425-G428 WeakPolarHBondContact O-CA 3.34Å; K425-G428 PolarHBondContact O-N 3.33Å; G428-F430 PolarHBondContact O-N 3.48Å
429	D	91.1	Very high	90.9	Very high	53 Å²	53	48.7 Å²	48.7	28%	0.283	28%	0.278	S	S	.	.			trans	-89	101.4	-179.9	-173	-5.9	0	0	0	109.9	A175 G176 T179 S431	A175-D429 CarbonylContact C-O 3.44Å; A175-D429 VanDerWaalsContact CA-O 3.29Å; A175-D429 WeakPolarHBondContact CA-O 3.18Å; G176-D429 VanDerWaalsContact CA-CG 3.43Å; G176-D429 VanDerWaalsContact CA-OD2 3.26Å; G176-D429 WeakPolarHBondContact CA-OD2 3.49Å; G176-D429 PolarHBondContact N-O 3.13Å; T179-D429 PolarHBondContact OG1-N 3.21Å; D429-S431 WeakPolarHBondContact OD1-CB 3.34Å; D429-S431 PolarHBondContact OD1-N 3.2Å; D429-S431 PolarHBondContact OD1-OG 3.2Å
430	F	93.3	Very high	91	Very high	6 Å²	6	46.8 Å²	46.8	3%	0.026	26%	0.259	C	S	.	.			trans	-106.3	28.2	170.9	-71.5	-82.1	0	0	0	112.7	M171 G174 L293 I423 G428 G432 M433 T434 V438 L440	M171-F430 HydrophobicContact CE-CE1 4.03Å; G174-F430 CarbonylContact O-C 3.57Å; G174-F430 VanDerWaalsContact O-CA 3.27Å; G174-F430 WeakPolarHBondContact O-CA 3.48Å; L293-F430 HydrophobicContact CD2-CE1 3.96Å; L293-F430 HydrophobicContact CD2-CZ 3.97Å; I423-F430 HydrophobicContact CB-CZ 4.39Å; I423-F430 HydrophobicContact CD1-CZ 4.45Å; I423-F430 HydrophobicContact CG1-CE1 3.93Å; I423-F430 HydrophobicContact CG1-CE2 4.38Å; I423-F430 HydrophobicContact CG1-CZ 3.42Å; I423-F430 VanDerWaalsContact CG1-CZ 3.42Å; I423-F430 WeakPolarHBondContact O-CZ 3.17Å; G428-F430 PolarHBondContact O-N 3.48Å; F430-G432 PolarHBondContact O-N 3.01Å; F430-G432 VanDerWaalsContact O-N 3.09Å; F430-M433 HydrophobicContact CB-CB 4.43Å; F430-M433 HydrophobicContact CB-CE 4.01Å; F430-M433 HydrophobicContact CD1-CE 3.72Å; F430-M433 HydrophobicContact CE1-CE 4.38Å; F430-M433 HydrophobicContact CG-CE 3.98Å; F430-M433 PolarHBondContact O-N 3.17Å; F430-T434 PolarHBondContact O-N 3.05Å; F430-T434 VanDerWaalsContact O-O 3.13Å; F430-V438 HydrophobicContact CD2-CB 4.29Å; F430-V438 WeakPolarHBondContact CD2-O 3.14Å; F430-V438 VanDerWaalsContact CE2-O 3.25Å; F430-V438 WeakPolarHBondContact CE2-O 3.31Å; F430-L440 HydrophobicContact CZ-CB 4.38Å
431	S	93.3	Very high	91.1	Very high	53 Å²	53	49.9 Å²	49.9	37%	0.371	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-23.3	-178.5	57.4	0	0	0	0	113.9	K239 D429 M433 T434	K239-S431 WeakPolarHBondContact CE-O 3.43Å; K239-S431 PolarHBondContact NZ-O 2.93Å; D429-S431 WeakPolarHBondContact OD1-CB 3.34Å; D429-S431 PolarHBondContact OD1-N 3.2Å; D429-S431 PolarHBondContact OD1-OG 3.2Å; S431-M433 VanDerWaalsContact C-N 3.35Å; S431-T434 WeakPolarHBondContact CA-O 3.36Å
432	G	91.9	Very high	91.1	Very high	23 Å²	23	49.3 Å²	49.3	24%	0.237	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-30.3	172.2	0	0	0	0	0	113.2	G174 F430	G174-G432 CarbonylContact O-C 3.49Å; G174-G432 WeakPolarHBondContact O-CA 3.21Å; G174-G432 PolarHBondContact O-N 3.25Å; G174-G432 VanDerWaalsContact O-N 3.09Å; F430-G432 PolarHBondContact O-N 3.01Å; F430-G432 VanDerWaalsContact O-N 3.09Å
433	M	93.3	Very high	91.2	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-44.5	-175.9	-175.1	174.3	68.5	0	0	113.2	M171 G174 L232 K239 F242 L293 F430 S431 V438	M171-M433 HydrophobicContact CE-SD 4.44Å; G174-M433 PolarHBondContact O-N 2.83Å; L232-M433 HydrophobicContact CD2-CE 3.77Å; L232-M433 HydrophobicContact CD2-CG 4.31Å; L232-M433 HydrophobicContact CD2-SD 3.77Å; K239-M433 PolarHBondContact N-O 3.05Å; F242-M433 HydrophobicContact CD1-CB 4.35Å; F242-M433 HydrophobicContact CD1-CG 3.71Å; F242-M433 HydrophobicContact CD1-SD 4.5Å; F242-M433 HydrophobicContact CD2-CB 4.41Å; F242-M433 HydrophobicContact CE1-CG 3.74Å; F242-M433 HydrophobicContact CE1-SD 3.92Å; F242-M433 HydrophobicContact CG-CB 4.27Å; F242-M433 HydrophobicContact CG-CG 4.13Å; F242-M433 HydrophobicContact CZ-CG 4.21Å; F242-M433 HydrophobicContact CZ-SD 4.12Å; L293-M433 HydrophobicContact CD1-CE 4.31Å; L293-M433 HydrophobicContact CD1-SD 4.3Å; L293-M433 HydrophobicContact CD2-CE 4.02Å; F430-M433 HydrophobicContact CB-CB 4.43Å; F430-M433 HydrophobicContact CB-CE 4.01Å; F430-M433 HydrophobicContact CD1-CE 3.72Å; F430-M433 HydrophobicContact CE1-CE 4.38Å; F430-M433 HydrophobicContact CG-CE 3.98Å; F430-M433 PolarHBondContact O-N 3.17Å; S431-M433 VanDerWaalsContact C-N 3.35Å; M433-V438 HydrophobicContact CE-CB 4.39Å; M433-V438 HydrophobicContact CE-CG1 4.01Å
434	T	93.1	Very high	91.2	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.012	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-149.7	165.3	-176.5	-176.8	0	0	0	0	111	V236 S237 F430 S431 E436 V438	V236-T434 HydrophobicContact CG1-CG2 3.94Å; S237-T434 WeakPolarHBondContact O-CB 3.24Å; S237-T434 PolarHBondContact O-OG1 2.73Å; F430-T434 PolarHBondContact O-N 3.05Å; F430-T434 VanDerWaalsContact O-O 3.13Å; S431-T434 WeakPolarHBondContact CA-O 3.36Å; T434-E436 HydrophobicContact CG2-CB 4.41Å; T434-E436 VanDerWaalsContact CG2-O 3.31Å; T434-E436 WeakPolarHBondContact CG2-O 3.38Å; T434-E436 PolarHBondContact OG1-N 3.38Å; T434-V438 HydrophobicContact CG2-CB 4.36Å; T434-V438 HydrophobicContact CG2-CG2 3.57Å
435	S	90.5	Very high	91.3	Very high	110 Å²	110	47.7 Å²	47.7	77%	0.769	26%	0.259	S	S	*	.	S	Bend	trans	-90.4	-9.8	170.1	-58	0	0	0	0	112.4
436	E	89.9	Confident	91.4	Very high	82 Å²	82	43 Å²	43	38%	0.383	24%	0.239	S	C	.	.	S	Bend	trans	-87.3	157	179.5	-65.7	168.2	-126.6	0	0	111.2	V236 S237 T434 V438	V236-E436 WeakPolarHBondContact CA-OE1 3.48Å; V236-E436 WeakPolarHBondContact CA-OE2 3.33Å; S237-E436 PolarHBondContact N-OE1 2.79Å; T434-E436 HydrophobicContact CG2-CB 4.41Å; T434-E436 VanDerWaalsContact CG2-O 3.31Å; T434-E436 WeakPolarHBondContact CG2-O 3.38Å; T434-E436 PolarHBondContact OG1-N 3.38Å; E436-V438 PolarHBondContact O-N 2.83Å
437	K	88.4	Confident	91.9	Very high	182 Å²	182	35.7 Å²	35.7	79%	0.791	21%	0.205	S	C	*	.			trans	-74.9	124.1	173.2	-65.8	-173.4	179.5	-176.8	0	109.4
438	V	91	Very high	92.4	Very high	3 Å²	3	31 Å²	31	2%	0.018	17%	0.173	C	C	.	.			trans	-136.6	149.1	-177.2	177.3	0	0	0	0	108.4	V236 V292 L293 F430 M433 T434 E436	V236-V438 HydrophobicContact CG1-CG2 3.94Å; V236-V438 HydrophobicContact CG2-CG2 4.31Å; V292-V438 HydrophobicContact CB-CG1 4.41Å; V292-V438 HydrophobicContact CG1-CB 4.25Å; V292-V438 HydrophobicContact CG1-CG1 3.74Å; V292-V438 HydrophobicContact CG1-CG2 3.95Å; L293-V438 HydrophobicContact CB-CG1 3.68Å; L293-V438 HydrophobicContact CD2-CG1 4.09Å; L293-V438 HydrophobicContact CG-CG1 4.47Å; F430-V438 HydrophobicContact CD2-CB 4.29Å; F430-V438 WeakPolarHBondContact CD2-O 3.14Å; F430-V438 VanDerWaalsContact CE2-O 3.25Å; F430-V438 WeakPolarHBondContact CE2-O 3.31Å; M433-V438 HydrophobicContact CE-CB 4.39Å; M433-V438 HydrophobicContact CE-CG1 4.01Å; T434-V438 HydrophobicContact CG2-CB 4.36Å; T434-V438 HydrophobicContact CG2-CG2 3.57Å; E436-V438 PolarHBondContact O-N 2.83Å
439	A	92.1	Very high	92.8	Very high	7 Å²	7	30.6 Å²	30.6	6%	0.058	17%	0.168	C	C	.	.			trans	-128.7	145.3	169.8	0	0	0	0	0	108.6	L293 K425 E426 N441	L293-A439 WeakPolarHBondContact CB-O 3.29Å; K425-A439 WeakPolarHBondContact O-CB 3.46Å; E426-A439 HydrophobicContact CG-CB 4.46Å; A439-N441 PolarHBondContact O-N 2.94Å; A439-N441 VanDerWaalsContact O-N 3.15Å; A439-N441 PolarHBondContact O-OD1 3Å
440	L	93.5	Very high	92.9	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.01	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	104.3	169.4	179.9	60	0	0	0	108.7	L293 L295 I423 F424 F430 W442 L443	L293-L440 HydrophobicContact CD2-CB 3.94Å; L293-L440 HydrophobicContact CD2-CD1 3.89Å; L293-L440 HydrophobicContact CG-CD1 3.76Å; L295-L440 HydrophobicContact CB-CD1 3.85Å; I423-L440 HydrophobicContact CD1-CD2 3.97Å; I423-L440 HydrophobicContact CG1-CB 4.19Å; I423-L440 HydrophobicContact CG1-CD2 4.3Å; I423-L440 WeakPolarHBondContact O-CB 3.28Å; I423-L440 PolarHBondContact O-N 3.09Å; F424-L440 HydrophobicContact CD1-CB 4.15Å; F424-L440 HydrophobicContact CD1-CD2 4.32Å; F424-L440 HydrophobicContact CD1-CG 4.32Å; F424-L440 HydrophobicContact CE1-CB 4.48Å; F424-L440 HydrophobicContact CE1-CD2 3.81Å; F424-L440 HydrophobicContact CE1-CG 4.24Å; F430-L440 HydrophobicContact CZ-CB 4.38Å; L440-W442 WeakPolarHBondContact CD1-O 3.46Å; L440-L443 HydrophobicContact CD2-CB 4.31Å
441	N	93.9	Very high	93.1	Very high	65 Å²	65	29.1 Å²	29.1	35%	0.348	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-26.9	-176.2	-57.3	102.9	0	0	0	112.6	M291 V292 L293 I412 A439	M291-N441 HydrophobicContact CB-CB 4.3Å; M291-N441 HydrophobicContact CG-CB 3.99Å; V292-N441 WeakPolarHBondContact CA-OD1 3.33Å; V292-N441 WeakPolarHBondContact CB-OD1 3.49Å; V292-N441 PolarHBondContact N-OD1 3.12Å; L293-N441 PolarHBondContact N-OD1 3.35Å; L293-N441 VanDerWaalsContact N-OD1 3.14Å; L293-N441 PolarHBondContact O-N 2.74Å; I412-N441 WeakPolarHBondContact CD1-O 3.3Å; A439-N441 PolarHBondContact O-N 2.94Å; A439-N441 VanDerWaalsContact O-N 3.15Å; A439-N441 PolarHBondContact O-OD1 3Å
442	W	93.3	Very high	93.1	Very high	33 Å²	33	27.8 Å²	27.8	13%	0.125	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	124.8	-178	-161.3	24.9	0	0	0	112.3	L284 S286 V287 M291 L293 M294 L295 D410 L440 K444	L284-W442 HydrophobicContact CD2-CH2 3.88Å; L284-W442 HydrophobicContact CD2-CZ3 3.92Å; S286-W442 WeakPolarHBondContact O-CH2 3.48Å; V287-W442 HydrophobicContact CG1-CZ3 4.36Å; V287-W442 HydrophobicContact CG2-CZ3 4.12Å; M291-W442 HydrophobicContact CE-CB 3.71Å; M291-W442 HydrophobicContact CE-CD2 3.8Å; M291-W442 HydrophobicContact CE-CE3 3.65Å; M291-W442 HydrophobicContact CE-CG 3.88Å; M291-W442 HydrophobicContact CE-CZ3 4.42Å; M291-W442 HydrophobicContact SD-CB 3.98Å; M291-W442 HydrophobicContact SD-CD2 4.42Å; M291-W442 HydrophobicContact SD-CE3 3.84Å; L293-W442 PolarHBondContact O-N 3.4Å; M294-W442 WeakPolarHBondContact CA-O 3.24Å; M294-W442 HydrophobicContact CG-CB 4.19Å; M294-W442 HydrophobicContact CG-CD2 4.48Å; M294-W442 HydrophobicContact CG-CE3 3.87Å; M294-W442 HydrophobicContact SD-CD2 4.42Å; M294-W442 HydrophobicContact SD-CE3 3.33Å; M294-W442 HydrophobicContact SD-CZ3 3.68Å; L295-W442 PolarHBondContact N-O 2.96Å; D410-W442 PolarHBondContact OD2-NE1 3.25Å; L440-W442 WeakPolarHBondContact CD1-O 3.46Å; W442-K444 HydrophobicContact CD2-CB 4.49Å; W442-K444 HydrophobicContact CH2-CD 3.82Å; W442-K444 HydrophobicContact CZ2-CD 3.45Å; W442-K444 VanDerWaalsContact CZ2-CD 3.45Å
443	L	94.6	Very high	93.2	Very high	3 Å²	3	27 Å²	27	2%	0.016	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	94.2	172.8	177.7	63	0	0	0	109.5	M168 L295 L411 I412 L415 L440	M168-L443 HydrophobicContact SD-CD2 4.03Å; L295-L443 HydrophobicContact CB-CD1 3.71Å; L295-L443 HydrophobicContact CD2-CD1 3.27Å; L295-L443 HydrophobicContact CG-CD1 3.51Å; L411-L443 HydrophobicContact CB-CD2 3.86Å; L411-L443 HydrophobicContact CB-CG 4.17Å; L411-L443 PolarHBondContact N-O 3.46Å; I412-L443 HydrophobicContact CG1-CB 3.98Å; L415-L443 HydrophobicContact CD1-CD2 3.23Å; L415-L443 HydrophobicContact CG-CD2 4.45Å; L440-L443 HydrophobicContact CD2-CB 4.31Å
444	K	94.1	Very high	93	Very high	16 Å²	16	30.8 Å²	30.8	7%	0.07	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	122.2	-177	-172.6	158.2	176.8	169.8	0	111.2	P283 L284 L295 L296 N297 Y298 N408 W442	P283-K444 PolarHBondContact O-NZ 3.24Å; L284-K444 HydrophobicContact CD2-CD 3.94Å; L295-K444 PolarHBondContact O-N 2.95Å; L296-K444 HydrophobicContact CD2-CB 3.77Å; L296-K444 HydrophobicContact CD2-CD 4.47Å; N297-K444 PolarHBondContact N-O 2.8Å; Y298-K444 WeakPolarHBondContact OH-CD 3.43Å; Y298-K444 WeakPolarHBondContact OH-CE 3.47Å; N408-K444 VanDerWaalsContact CG-CE 3.5Å; N408-K444 WeakPolarHBondContact ND2-CE 3.36Å; N408-K444 WeakPolarHBondContact OD1-CE 3.26Å; N408-K444 WeakPolarHBondContact OD1-CG 3.28Å; W442-K444 HydrophobicContact CD2-CB 4.49Å; W442-K444 HydrophobicContact CH2-CD 3.82Å; W442-K444 HydrophobicContact CZ2-CD 3.45Å; W442-K444 VanDerWaalsContact CZ2-CD 3.45Å
445	H	94.9	Very high	92.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	127.2	171.8	175.7	62.3	0	0	0	110.4	A160 I164 N297 N408 Y409 L411	A160-H445 PolarHBondContact N-NE2 3.1Å; I164-H445 HydrophobicContact CD1-CB 4.47Å; I164-H445 HydrophobicContact CG1-CB 4.47Å; N297-H445 CarbonylContact O-C 3.42Å; N297-H445 VanDerWaalsContact O-CA 3.31Å; N297-H445 WeakPolarHBondContact O-CA 3.38Å; N297-H445 PolarHBondContact O-ND1 3.35Å; N297-H445 PolarHBondContact OD1-CE1 2.93Å; N297-H445 PolarHBondContact OD1-ND1 3.08Å; N408-H445 CarbonylContact C-O 3.6Å; N408-H445 WeakPolarHBondContact CA-O 3.39Å; N408-H445 PolarHBondContact OD1-O 3.09Å; Y409-H445 PolarHBondContact N-O 3.46Å; Y409-H445 PolarHBondContact O-N 3.47Å; L411-H445 HydrophobicContact CD1-CB 3.45Å; L411-H445 VanDerWaalsContact CD1-CB 3.45Å; L411-H445 HydrophobicContact CG-CB 3.9Å
446	Q	93.6	Very high	90.9	Very high	3 Å²	3	29.2 Å²	29.2	1%	0.014	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	126.7	168.8	165.2	177.4	-9.3	0	0	111	P283 N297 Y298 L299 E406 Q407 N408	P283-Q446 VanDerWaalsContact CB-OE1 3.29Å; N297-Q446 PolarHBondContact O-N 3.05Å; Y298-Q446 CarbonylContact C-O 3.55Å; Y298-Q446 WeakPolarHBondContact CA-O 3.31Å; Y298-Q446 HydrophobicContact CD1-CB 3.52Å; Y298-Q446 HydrophobicContact CD1-CG 3.96Å; Y298-Q446 HydrophobicContact CE1-CB 3.58Å; Y298-Q446 HydrophobicContact CE1-CG 4.2Å; Y298-Q446 VanDerWaalsContact CE1-OE1 3.28Å; L299-Q446 PolarHBondContact N-O 3.18Å; E406-Q446 PolarHBondContact OE1-NE2 2.9Å; E406-Q446 VanDerWaalsContact OE1-NE2 3.08Å; Q407-Q446 CarbonylContact O-C 3.58Å; Q407-Q446 WeakPolarHBondContact O-CA 3.41Å; Q407-Q446 WeakPolarHBondContact O-CG 3.19Å; N408-Q446 HydrophobicContact CB-CB 4.33Å; N408-Q446 PolarHBondContact ND2-OE1 3.49Å
447	G	93.7	Very high	89.1	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	142.5	171.4	0	0	0	0	0	110.5	L158 L299 E406 Q407	L158-G447 WeakPolarHBondContact CD2-O 3.22Å; L299-G447 CarbonylContact O-C 3.45Å; E406-G447 WeakPolarHBondContact CA-O 3.45Å; Q407-G447 PolarHBondContact N-O 3.06Å; Q407-G447 PolarHBondContact O-N 2.97Å
448	T	94.4	Very high	86.9	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	127.3	168.1	-53	0	0	0	0	109.7	L299 Y300 F301 L405 E406	L299-T448 PolarHBondContact O-N 3.28Å; Y300-T448 CarbonylContact C-O 3.51Å; Y300-T448 WeakPolarHBondContact CA-O 3.26Å; Y300-T448 HydrophobicContact CD2-CG2 3.71Å; Y300-T448 HydrophobicContact CE2-CG2 3.94Å; F301-T448 PolarHBondContact N-O 3.07Å; L405-T448 CarbonylContact O-C 3.52Å; L405-T448 VanDerWaalsContact O-CA 3.29Å; L405-T448 WeakPolarHBondContact O-CA 3.46Å; E406-T448 HydrophobicContact CB-CG2 4.43Å; E406-T448 HydrophobicContact CG-CG2 4.5Å
449	I	94.9	Very high	84.9	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	140.5	173.9	-170.7	170.8	0	0	0	110.1	L158 F301 M361 F403 K404 L405 V451 F483 I485	L158-I449 HydrophobicContact CD1-CB 4.33Å; L158-I449 HydrophobicContact CD1-CG2 3.97Å; L158-I449 HydrophobicContact CD2-CB 4.14Å; L158-I449 HydrophobicContact CD2-CG2 3.85Å; F301-I449 HydrophobicContact CD1-CD1 4.04Å; F301-I449 HydrophobicContact CD1-CG1 4.03Å; F301-I449 WeakPolarHBondContact O-CA 3.47Å; M361-I449 HydrophobicContact CE-CD1 3.97Å; F403-I449 HydrophobicContact CE2-CG2 4.17Å; K404-I449 VanDerWaalsContact CA-O 3.31Å; K404-I449 WeakPolarHBondContact CA-O 3.14Å; K404-I449 WeakPolarHBondContact CG-O 3.48Å; L405-I449 HydrophobicContact CB-CG2 3.81Å; L405-I449 HydrophobicContact CD1-CG2 4.35Å; L405-I449 HydrophobicContact CG-CG2 4.12Å; L405-I449 PolarHBondContact N-O 2.77Å; L405-I449 PolarHBondContact O-N 3.15Å; I449-V451 HydrophobicContact CD1-CG2 3.98Å; I449-V451 HydrophobicContact CG1-CG2 4.04Å; I449-F483 HydrophobicContact CD1-CE2 3.83Å; I449-F483 HydrophobicContact CD1-CZ 4.3Å; I449-F483 HydrophobicContact CG2-CZ 4.42Å; I449-I485 HydrophobicContact CD1-CD1 3.44Å; I449-I485 VanDerWaalsContact CD1-CD1 3.44Å
450	T	94.2	Very high	82.7	Confident	27 Å²	27	30.3 Å²	30.3	17%	0.166	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	122.3	170.3	-54.8	0	0	0	0	109.3	Y300 F301	Y300-T450 PolarHBondContact OH-OG1 3.11Å; F301-T450 PolarHBondContact O-N 3.46Å; F301-T450 VanDerWaalsContact O-N 3.13Å
451	V	96.2	Very high	80.4	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	116.5	178.4	178	0	0	0	0	108.8	W305 M332 M361 L400 R402 F403 I449	W305-V451 HydrophobicContact CZ2-CG1 3.86Å; M332-V451 HydrophobicContact CE-CG1 3.99Å; M361-V451 HydrophobicContact CE-CG2 3.73Å; L400-V451 HydrophobicContact CD2-CG1 4.09Å; R402-V451 WeakPolarHBondContact CG-O 3.29Å; F403-V451 HydrophobicContact CD1-CB 4.14Å; F403-V451 HydrophobicContact CD1-CG1 4.41Å; F403-V451 HydrophobicContact CD2-CB 4.41Å; F403-V451 HydrophobicContact CD2-CG2 4.33Å; F403-V451 HydrophobicContact CE1-CB 3.89Å; F403-V451 HydrophobicContact CE1-CG1 4Å; F403-V451 HydrophobicContact CE1-CG2 3.94Å; F403-V451 HydrophobicContact CE2-CB 4.22Å; F403-V451 HydrophobicContact CE2-CG2 3.71Å; F403-V451 HydrophobicContact CG-CB 4.39Å; F403-V451 HydrophobicContact CZ-CB 3.95Å; F403-V451 HydrophobicContact CZ-CG1 4.39Å; F403-V451 HydrophobicContact CZ-CG2 3.49Å; F403-V451 VanDerWaalsContact CZ-CG2 3.49Å; F403-V451 PolarHBondContact N-O 3.01Å; F403-V451 PolarHBondContact O-N 3.27Å; I449-V451 HydrophobicContact CD1-CG2 3.98Å; I449-V451 HydrophobicContact CG1-CG2 4.04Å
452	N	94.3	Very high	78.2	Confident	25 Å²	25	40.2 Å²	40.2	13%	0.134	24%	0.24	C	C	.	.			trans	-144.7	-171.5	178.7	70.3	4.1	0	0	0	110.9	W305 R402 E454	W305-N452 PolarHBondContact NE1-O 3.05Å; R402-N452 HydrophobicContact CG-CB 4.18Å; N452-E454 PolarHBondContact ND2-OE1 3.31Å; N452-E454 PolarHBondContact O-N 2.86Å; N452-E454 VanDerWaalsContact OD1-CB 3.3Å; N452-E454 WeakPolarHBondContact OD1-CB 3.39Å; N452-E454 WeakPolarHBondContact OD1-CG 3.34Å; N452-E454 PolarHBondContact OD1-N 2.78Å
453	E	92.9	Very high	76	Confident	7 Å²	7	44.8 Å²	44.8	3%	0.033	26%	0.263	C	S	.	.	S	Bend	trans	-74.9	-10	-173	-61.8	77.7	-170.3	0	0	113.9	F309 K311 T314 M332 R402 G455	F309-E453 HydrophobicContact CB-CB 3.99Å; F309-E453 HydrophobicContact CB-CG 3.97Å; F309-E453 PolarHBondContact N-O 3.07Å; F309-E453 WeakPolarHBondContact O-CB 3.32Å; K311-E453 HydrophobicContact CG-CB 4.02Å; K311-E453 HydrophobicContact CG-CG 4.21Å; T314-E453 WeakPolarHBondContact CG2-OE1 3.45Å; T314-E453 WeakPolarHBondContact OG1-CG 3.35Å; T314-E453 PolarHBondContact OG1-OE1 3.12Å; M332-E453 HydrophobicContact CB-CG 4.4Å; M332-E453 HydrophobicContact CG-CG 3.9Å; M332-E453 VanDerWaalsContact CG-OE1 3.29Å; M332-E453 WeakPolarHBondContact CG-OE1 3.29Å; M332-E453 HydrophobicContact SD-CB 4.33Å; M332-E453 VanDerWaalsContact SD-CD 3.54Å; M332-E453 HydrophobicContact SD-CG 3.65Å; M332-E453 PolarHBondContact SD-N 3.02Å; M332-E453 VanDerWaalsContact SD-N 3.4Å; R402-E453 IonicContact CZ-OE1 3.78Å; R402-E453 IonicContact CZ-OE2 2.83Å; R402-E453 VanDerWaalsContact CZ-OE2 3.25Å; R402-E453 IonicContact NE-OE1 2.96Å; R402-E453 PolarHBondContact NE-OE1 3.5Å; R402-E453 IonicContact NE-OE2 3.65Å; R402-E453 PolarHBondContact NE-OE2 2.82Å; R402-E453 IonicContact NH2-OE1 3.44Å; R402-E453 PolarHBondContact NH2-OE1 2.9Å; R402-E453 IonicContact NH2-OE2 2.78Å; R402-E453 PolarHBondContact NH2-OE2 3.4Å; E453-G455 PolarHBondContact O-N 3.14Å
454	E	88.6	Confident	73.5	Confident	78 Å²	78	52 Å²	52	36%	0.364	31%	0.306	S	S	.	.			trans	-61.6	127.9	-170.9	-69.4	174	-146.5	0	0	112.2	K302 W305 N452	K302-E454 WeakPolarHBondContact CE-OE2 3.25Å; K302-E454 IonicContact NZ-OE1 3.52Å; K302-E454 PolarHBondContact NZ-OE1 2.88Å; K302-E454 IonicContact NZ-OE2 2.93Å; K302-E454 PolarHBondContact NZ-OE2 2.58Å; W305-E454 PolarHBondContact N-O 3.3Å; N452-E454 PolarHBondContact ND2-OE1 3.31Å; N452-E454 PolarHBondContact O-N 2.86Å; N452-E454 VanDerWaalsContact OD1-CB 3.3Å; N452-E454 WeakPolarHBondContact OD1-CB 3.39Å; N452-E454 WeakPolarHBondContact OD1-CG 3.34Å; N452-E454 PolarHBondContact OD1-N 2.78Å
455	G	79.2	Confident	71.6	Confident	18 Å²	18	54.4 Å²	54.4	19%	0.186	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-170	-178	-178.6	0	0	0	0	0	111.6	W305 E453	W305-G455 CarbonylContact O-C 3.57Å; W305-G455 WeakPolarHBondContact O-CA 3.45Å; E453-G455 PolarHBondContact O-N 3.14Å
456	T	60.4	Low	69.4	Low	61 Å²	61	63.9 Å²	63.9	37%	0.374	38%	0.377	S	S	.	.			trans	-75.1	130.9	177	40.9	0	0	0	0	112.1	W305 E306 T356 A458	W305-T456 PolarHBondContact O-N 2.57Å; W305-T456 PolarHBondContact O-OG1 2.78Å; E306-T456 PolarHBondContact O-OG1 3.22Å; T356-T456 HydrophobicContact CG2-CG2 3.79Å; T456-A458 PolarHBondContact O-N 2.84Å
457	E	52.5	Low	67.7	Low	130 Å²	130	69.7 Å²	69.7	61%	0.607	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-72	-30.5	-173.4	-49.7	-158.2	117.6	0	0	114.1	K308 A459 A460	K308-E457 HydrophobicContact CD-CB 4.32Å; K308-E457 HydrophobicContact CD-CG 4.12Å; K308-E457 IonicContact NZ-OE1 2.93Å; K308-E457 PolarHBondContact NZ-OE1 3.13Å; E457-A459 PolarHBondContact O-N 3.46Å; E457-A459 VanDerWaalsContact O-N 3.09Å; E457-A460 PolarHBondContact O-N 3.37Å
458	A	43.3	Very low	66	Low	93 Å²	93	72.7 Å²	72.7	77%	0.769	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-64.3	-17.7	-170.7	0	0	0	0	0	114.5	T456	T456-A458 PolarHBondContact O-N 2.84Å
459	A	47.4	Very low	64.6	Low	43 Å²	43	81.5 Å²	81.5	36%	0.355	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-93.7	-8.9	-177.2	0	0	0	0	0	114.4	E306 Q307 E457	E306-A459 WeakPolarHBondContact O-CB 3.39Å; Q307-A459 HydrophobicContact CG-CB 4Å; E457-A459 PolarHBondContact O-N 3.46Å; E457-A459 VanDerWaalsContact O-N 3.09Å
460	A	46.1	Very low	63.4	Low	32 Å²	32	85.4 Å²	85.4	26%	0.264	50%	0.498	S	S	.	.	S	Bend	trans	-92.9	-12.6	-175.6	0	0	0	0	0	114.2	K308 E457	K308-A460 HydrophobicContact CG-CB 4.11Å; E457-A460 PolarHBondContact O-N 3.37Å
461	L	45.4	Very low	61.9	Low	150 Å²	150	89.7 Å²	89.7	79%	0.785	53%	0.529	S	S	*	.	S	Bend	trans	-100.1	-0.2	-167.3	-77.8	162.2	0	0	0	115.4	Q463	L461-Q463 PolarHBondContact O-N 3.26Å
462	T	47.8	Very low	60.6	Low	125 Å²	125	92.2 Å²	92.2	77%	0.767	54%	0.541	S	S	*	.			trans	-96.2	68.7	175.8	36.9	0	0	0	0	111.6
463	Q	47.3	Very low	60.1	Low	129 Å²	129	95.1 Å²	95.1	60%	0.603	56%	0.556	S	S	*	*			trans	-117.2	64	164.5	-79.1	-167.4	1.5	0	0	110.8	K335 L461	K335-Q463 PolarHBondContact O-NE2 3.03Å; L461-Q463 PolarHBondContact O-N 3.26Å
464	V	42.2	Very low	60	Low	155 Å²	155	102 Å²	102	94%	0.939	58%	0.581	S	S	*	*			trans	-126.7	96.2	157.4	-168.9	0	0	0	0	106.9
465	G	55.2	Low	60.4	Low	65 Å²	65	99.1 Å²	99.1	67%	0.67	57%	0.568	S	S	*	*	S	Bend	trans	-164.4	160.8	-179.9	0	0	0	0	0	110.3	M467	G465-M467 PolarHBondContact O-N 3.18Å
466	F	48.7	Very low	61.2	Low	200 Å²	200	100.1 Å²	100.1	88%	0.877	57%	0.57	S	S	*	*			trans	-52.3	111.6	-179.1	-173.5	-96	0	0	0	110.9	P468	F466-P468 WeakPolarHBondContact O-CD 3.44Å
467	M	56.8	Low	62.9	Low	125 Å²	125	97.2 Å²	97.2	62%	0.616	55%	0.552	S	S	*	*			trans	-90.4	114.5	177.9	-166.7	157.3	71.9	0	0	108.8	G465	G465-M467 PolarHBondContact O-N 3.18Å
468	P	58.3	Low	65	Low	62 Å²	62	93.8 Å²	93.8	40%	0.403	54%	0.538	S	S	.	.			trans	-63.1	139.8	176.1	24.5	-31	0	0	0	110	F466 S470	F466-P468 WeakPolarHBondContact O-CD 3.44Å; P468-S470 PolarHBondContact O-N 3.45Å
469	L	65.1	Low	67.5	Low	186 Å²	186	90.3 Å²	90.3	97%	0.974	51%	0.506	S	S	*	.	S	Bend	trans	-77.1	-6.6	177.9	-65.8	171.2	0	0	0	113
470	S	68.4	Low	69.8	Low	81 Å²	81	88.6 Å²	88.6	57%	0.566	49%	0.491	S	S	*	.	S	Bend	trans	-76.3	158.8	175.8	62.4	0	0	0	0	111.7	P468 Q472	P468-S470 PolarHBondContact O-N 3.45Å; S470-Q472 PolarHBondContact O-N 3.09Å; S470-Q472 VanDerWaalsContact O-N 3.17Å
471	S	63.7	Low	72.3	Confident	117 Å²	117	87 Å²	87	82%	0.818	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-52.4	125	171.1	-173.2	0	0	0	0	109.7
472	Q	68.1	Low	74.8	Confident	55 Å²	55	79.9 Å²	79.9	26%	0.257	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-81.5	138	-177.7	-70.5	150.3	24.4	0	0	108.3	K335 S470 R474	K335-Q472 VanDerWaalsContact NZ-CD 3.28Å; S470-Q472 PolarHBondContact O-N 3.09Å; S470-Q472 VanDerWaalsContact O-N 3.17Å; Q472-R474 PolarHBondContact O-N 3.44Å; Q472-R474 VanDerWaalsContact O-N 3.09Å
473	I	84.7	Confident	77.2	Confident	86 Å²	86	74 Å²	74	44%	0.441	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-64	116.6	179.6	-60	172.3	0	0	0	108	R396 E397	R396-I473 VanDerWaalsContact CA-O 3.24Å; R396-I473 WeakPolarHBondContact CA-O 3.41Å; R396-I473 WeakPolarHBondContact CB-O 3.36Å; R396-I473 HydrophobicContact CG-CB 4.14Å; R396-I473 HydrophobicContact CG-CG2 3.92Å; E397-I473 PolarHBondContact N-O 3.4Å; E397-I473 VanDerWaalsContact N-O 3.08Å
474	R	91	Very high	79.6	Confident	152 Å²	152	67.8 Å²	67.8	57%	0.574	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	144.9	175.2	-60.1	-171.5	167.5	141.5	5.1	110	E397 Q472	E397-R474 HydrophobicContact CB-CG 4.25Å; E397-R474 CarbonylContact O-C 3.49Å; E397-R474 VanDerWaalsContact O-CA 3.29Å; E397-R474 WeakPolarHBondContact O-CA 3.47Å; E397-R474 WeakPolarHBondContact OE1-CD 2.91Å; E397-R474 IonicContact OE1-CZ 2.85Å; E397-R474 IonicContact OE1-NE 3.91Å; E397-R474 PolarHBondContact OE1-NE 3.48Å; E397-R474 IonicContact OE1-NH2 3.67Å; Q472-R474 PolarHBondContact O-N 3.44Å; Q472-R474 VanDerWaalsContact O-N 3.09Å
475	F	95.6	Very high	82.2	Confident	17 Å²	17	60.4 Å²	60.4	8%	0.075	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	100.5	167.2	-165.9	-76.8	0	0	0	107.3	D349 L351 I363 L365 E397 V398 S399 V477	D349-F475 HydrophobicContact CB-CE2 3.73Å; D349-F475 HydrophobicContact CB-CZ 4.31Å; L351-F475 HydrophobicContact CB-CD1 3.94Å; L351-F475 HydrophobicContact CB-CD2 4.03Å; L351-F475 HydrophobicContact CB-CE1 3.59Å; L351-F475 HydrophobicContact CB-CE2 3.7Å; L351-F475 HydrophobicContact CB-CG 4.14Å; L351-F475 HydrophobicContact CB-CZ 3.48Å; L351-F475 VanDerWaalsContact CB-CZ 3.48Å; L351-F475 HydrophobicContact CD1-CG 4.46Å; L351-F475 HydrophobicContact CD2-CB 4.41Å; L351-F475 HydrophobicContact CD2-CD1 3.52Å; L351-F475 HydrophobicContact CD2-CE1 3.87Å; L351-F475 HydrophobicContact CD2-CG 3.95Å; L351-F475 HydrophobicContact CG-CD1 4.27Å; L351-F475 HydrophobicContact CG-CE1 4.36Å; L351-F475 HydrophobicContact CG-CG 4.42Å; I363-F475 HydrophobicContact CG2-CE1 4.22Å; L365-F475 HydrophobicContact CB-CE1 4.33Å; L365-F475 HydrophobicContact CB-CZ 3.98Å; L365-F475 HydrophobicContact CD2-CE1 4.1Å; L365-F475 HydrophobicContact CD2-CZ 4.24Å; E397-F475 PolarHBondContact O-N 3.47Å; V398-F475 WeakPolarHBondContact CA-O 3.48Å; V398-F475 HydrophobicContact CG2-CB 4.46Å; S399-F475 PolarHBondContact N-O 3.03Å; F475-V477 HydrophobicContact CD1-CG2 3.8Å; F475-V477 HydrophobicContact CE1-CG2 3.62Å
476	T	96.3	Very high	84.1	Confident	39 Å²	39	58.1 Å²	58.1	24%	0.239	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	117.4	-174.8	-53.5	0	0	0	0	109.5	L365 D478	L365-T476 WeakPolarHBondContact CD2-O 3.44Å; T476-D478 HydrophobicContact CG2-CB 3.82Å; T476-D478 WeakPolarHBondContact CG2-OD2 3.42Å; T476-D478 PolarHBondContact O-N 3.28Å
477	V	97.6	Very high	86.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.26	C	S	.	.			trans	-94.8	75.1	177.3	-173.4	0	0	0	0	108.9	I363 L365 S399 L400 P401 F475 F481	I363-V477 HydrophobicContact CD1-CG2 4.36Å; I363-V477 HydrophobicContact CG2-CG2 4.18Å; L365-V477 HydrophobicContact CD1-CG1 4.31Å; S399-V477 WeakPolarHBondContact O-CB 3.23Å; S399-V477 WeakPolarHBondContact O-CG2 3.18Å; S399-V477 PolarHBondContact O-N 3.32Å; L400-V477 HydrophobicContact CD1-CB 4.23Å; L400-V477 HydrophobicContact CD1-CG1 4.25Å; L400-V477 HydrophobicContact CD1-CG2 4.17Å; P401-V477 WeakPolarHBondContact CD-O 3.31Å; F475-V477 HydrophobicContact CD1-CG2 3.8Å; F475-V477 HydrophobicContact CE1-CG2 3.62Å; V477-F481 HydrophobicContact CG1-CB 4.11Å; V477-F481 HydrophobicContact CG1-CD1 3.13Å; V477-F481 HydrophobicContact CG1-CD2 4.14Å; V477-F481 HydrophobicContact CG1-CE1 3.37Å; V477-F481 HydrophobicContact CG1-CE2 4.33Å; V477-F481 HydrophobicContact CG1-CG 3.54Å; V477-F481 HydrophobicContact CG1-CZ 3.98Å
478	D	95.6	Very high	87.9	Confident	57 Å²	57	45 Å²	45	31%	0.305	24%	0.242	S	C	.	.			trans	-111.2	10.9	-174	58.3	4.8	0	0	0	114.1	F319 R320 M331 T476	F319-D478 CarbonylContact C-O 3.57Å; F319-D478 WeakPolarHBondContact CA-O 3.48Å; R320-D478 PolarHBondContact N-O 2.93Å; M331-D478 HydrophobicContact CE-CB 4.41Å; T476-D478 HydrophobicContact CG2-CB 3.82Å; T476-D478 WeakPolarHBondContact CG2-OD2 3.42Å; T476-D478 PolarHBondContact O-N 3.28Å
479	H	95.5	Very high	89.3	Confident	20 Å²	20	49.9 Å²	49.9	9%	0.093	25%	0.252	C	S	.	.	S	Bend	trans	-151.7	174.7	177.8	60.9	-86.5	0	0	0	110	F319 R320 L365 P366 I369 F481	F319-H479 WeakPolarHBondContact CZ-O 3.25Å; R320-H479 HydrophobicContact CB-CB 4.15Å; R320-H479 WeakPolarHBondContact O-CA 3.29Å; L365-H479 VanDerWaalsContact CD1-CE1 3.47Å; L365-H479 WeakPolarHBondContact CD1-CE1 3.45Å; L365-H479 VanDerWaalsContact CD1-NE2 3.28Å; L365-H479 WeakPolarHBondContact CD1-NE2 3.4Å; L365-H479 WeakPolarHBondContact CG-NE2 3.48Å; P366-H479 PolarHBondContact O-NE2 3.29Å; I369-H479 HydrophobicContact CG1-CB 4.31Å; H479-F481 PolarHBondContact O-N 3.11Å
480	P	96.9	Very high	90.5	Very high	7 Å²	7	41.3 Å²	41.3	5%	0.045	21%	0.208	C	C	.	.			trans	-57.1	132.4	-167.7	-27.6	38.3	0	0	0	112.4	R320 I369 M372 V499 V500	R320-P480 VanDerWaalsContact O-CD 3.3Å; R320-P480 WeakPolarHBondContact O-CD 3.45Å; I369-P480 HydrophobicContact CG2-CG 4.41Å; M372-P480 HydrophobicContact CE-CB 4.12Å; M372-P480 WeakPolarHBondContact CE-O 3.36Å; P480-V499 WeakPolarHBondContact CA-O 3.48Å; P480-V500 HydrophobicContact CG-CG1 4.15Å
481	F	97.6	Very high	91.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	152.5	-175.9	66.5	-86.3	0	0	0	111.7	F319 I363 L365 M372 L400 P401 F403 V477 H479 F483 R498 V499	F319-F481 HydrophobicContact CE2-CD1 4.3Å; F319-F481 HydrophobicContact CE2-CE1 4.18Å; F319-F481 HydrophobicContact CZ-CD1 4.29Å; F319-F481 HydrophobicContact CZ-CE1 4.39Å; I363-F481 HydrophobicContact CG2-CB 4.24Å; I363-F481 HydrophobicContact CG2-CD2 3.88Å; I363-F481 HydrophobicContact CG2-CG 4.3Å; L365-F481 HydrophobicContact CD1-CB 3.81Å; M372-F481 VanDerWaalsContact CE-C 3.5Å; M372-F481 VanDerWaalsContact CE-CA 3.43Å; L400-F481 HydrophobicContact CD1-CZ 4.43Å; P401-F481 HydrophobicContact CG-CE1 3.98Å; P401-F481 HydrophobicContact CG-CZ 4.36Å; F403-F481 HydrophobicContact CD1-CZ 4.38Å; F403-F481 HydrophobicContact CE1-CE2 4.38Å; F403-F481 AromaticContact CE1-CZ 3.76Å; F403-F481 HydrophobicContact CE1-CZ 3.76Å; F403-F481 HydrophobicContact CZ-CE2 4.5Å; F403-F481 HydrophobicContact CZ-CZ 4.23Å; V477-F481 HydrophobicContact CG1-CB 4.11Å; V477-F481 HydrophobicContact CG1-CD1 3.13Å; V477-F481 HydrophobicContact CG1-CD2 4.14Å; V477-F481 HydrophobicContact CG1-CE1 3.37Å; V477-F481 HydrophobicContact CG1-CE2 4.33Å; V477-F481 HydrophobicContact CG1-CG 3.54Å; V477-F481 HydrophobicContact CG1-CZ 3.98Å; H479-F481 PolarHBondContact O-N 3.11Å; F481-F483 HydrophobicContact CD2-CB 4.35Å; F481-F483 HydrophobicContact CE2-CB 4.23Å; F481-F483 HydrophobicContact CE2-CD1 4.06Å; F481-R498 WeakPolarHBondContact O-CA 3.47Å; F481-V499 HydrophobicContact CD1-CB 4Å; F481-V499 HydrophobicContact CD1-CG1 4.49Å; F481-V499 HydrophobicContact CE1-CB 3.49Å; F481-V499 VanDerWaalsContact CE1-CB 3.49Å; F481-V499 HydrophobicContact CE1-CG1 3.73Å; F481-V499 HydrophobicContact CE1-CG2 4.01Å; F481-V499 HydrophobicContact CE2-CB 4.14Å; F481-V499 HydrophobicContact CE2-CG2 3.91Å; F481-V499 HydrophobicContact CZ-CB 3.57Å; F481-V499 HydrophobicContact CZ-CG1 4.05Å; F481-V499 HydrophobicContact CZ-CG2 3.52Å; F481-V499 PolarHBondContact N-O 3.04Å; F481-V499 VanDerWaalsContact N-O 3.09Å; F481-V499 PolarHBondContact O-N 3Å
482	L	97.9	Very high	93	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	140.9	170	-172.1	78.3	0	0	0	108.3	Y144 I363 A364 M372 L375 I379 L484 I496 G497 R498	Y144-L482 HydrophobicContact CE1-CD1 4.29Å; Y144-L482 HydrophobicContact CE2-CD1 4.21Å; Y144-L482 WeakPolarHBondContact OH-CD1 3.41Å; I363-L482 WeakPolarHBondContact CA-O 3.41Å; A364-L482 HydrophobicContact CB-CB 4.36Å; A364-L482 PolarHBondContact N-O 2.91Å; A364-L482 PolarHBondContact O-N 2.93Å; M372-L482 HydrophobicContact SD-CB 4.48Å; L375-L482 HydrophobicContact CD2-CB 4.1Å; L375-L482 HydrophobicContact CG-CD2 4.49Å; I379-L482 HydrophobicContact CD1-CD2 4.35Å; I379-L482 HydrophobicContact CG1-CD2 4.15Å; L482-L484 HydrophobicContact CD2-CD1 4.24Å; L482-L484 HydrophobicContact CG-CD1 4.48Å; L482-I496 HydrophobicContact CD1-CD1 4.48Å; L482-I496 HydrophobicContact CD1-CG1 4.25Å; L482-G497 CarbonylContact C-O 3.48Å; L482-G497 WeakPolarHBondContact CA-O 3.49Å; L482-G497 WeakPolarHBondContact CD1-O 3.32Å; L482-R498 HydrophobicContact CD1-CB 4.44Å
483	F	98.1	Very high	94.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	150	170.6	72.2	-86.8	0	0	0	112.1	L158 M361 L362 F403 L405 I449 F481 I485 I496 G497 V499	L158-F483 HydrophobicContact CD1-CE2 4.11Å; L158-F483 HydrophobicContact CD1-CZ 3.7Å; M361-F483 HydrophobicContact CE-CD2 4.09Å; M361-F483 HydrophobicContact CG-CB 4.15Å; M361-F483 HydrophobicContact SD-CB 4.4Å; L362-F483 CarbonylContact O-C 3.55Å; L362-F483 WeakPolarHBondContact O-CA 3.29Å; F403-F483 HydrophobicContact CE2-CE1 4.36Å; F403-F483 HydrophobicContact CZ-CE1 4.45Å; L405-F483 HydrophobicContact CD1-CE1 3.97Å; L405-F483 HydrophobicContact CD1-CZ 4.12Å; I449-F483 HydrophobicContact CD1-CE2 3.83Å; I449-F483 HydrophobicContact CD1-CZ 4.3Å; I449-F483 HydrophobicContact CG2-CZ 4.42Å; F481-F483 HydrophobicContact CD2-CB 4.35Å; F481-F483 HydrophobicContact CE2-CB 4.23Å; F481-F483 HydrophobicContact CE2-CD1 4.06Å; F483-I485 HydrophobicContact CD2-CG1 4.25Å; F483-I485 HydrophobicContact CE2-CD1 4.49Å; F483-I485 HydrophobicContact CE2-CG1 4.45Å; F483-I496 CarbonylContact O-C 3.55Å; F483-I496 WeakPolarHBondContact O-CA 3.22Å; F483-G497 VanDerWaalsContact CD1-O 3.29Å; F483-G497 WeakPolarHBondContact CD1-O 3.46Å; F483-G497 PolarHBondContact N-O 3.39Å; F483-G497 PolarHBondContact O-N 3Å; F483-V499 HydrophobicContact CD1-CG2 4.07Å; F483-V499 HydrophobicContact CE1-CG2 3.85Å
484	L	98.1	Very high	94.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	138.4	177.4	-52.8	92	0	0	0	108.8	F141 M361 L362 V384 W387 L482 Y486 L493 F495 I496	F141-L484 HydrophobicContact CE1-CD2 3.59Å; F141-L484 HydrophobicContact CZ-CD2 3.82Å; M361-L484 CarbonylContact C-O 3.53Å; M361-L484 WeakPolarHBondContact CA-O 3.24Å; L362-L484 HydrophobicContact CB-CB 4.36Å; L362-L484 HydrophobicContact CB-CD1 4.5Å; L362-L484 PolarHBondContact N-O 3.15Å; L362-L484 PolarHBondContact O-N 3.04Å; V384-L484 HydrophobicContact CG2-CD2 4.01Å; W387-L484 HydrophobicContact CZ3-CD1 4.35Å; L482-L484 HydrophobicContact CD2-CD1 4.24Å; L482-L484 HydrophobicContact CG-CD1 4.48Å; L484-Y486 HydrophobicContact CB-CD2 3.88Å; L484-Y486 HydrophobicContact CB-CE2 3.62Å; L484-Y486 HydrophobicContact CD2-CE2 3.77Å; L484-Y486 HydrophobicContact CG-CE2 4.32Å; L484-L493 HydrophobicContact CB-CD1 3.92Å; L484-L493 HydrophobicContact CD2-CD1 4.06Å; L484-L493 HydrophobicContact CG-CD1 4.43Å; L484-F495 CarbonylContact C-O 3.59Å; L484-F495 WeakPolarHBondContact CA-O 3.35Å; L484-I496 HydrophobicContact CD2-CD1 4.38Å; L484-I496 HydrophobicContact CG-CG1 4.32Å
485	I	97.4	Very high	95.2	Very high	0 Å²	0	20 Å²	20	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	115.4	175	-58.1	-168	0	0	0	109	F301 I359 S360 M361 I449 F483 V494 F495	F301-I485 HydrophobicContact CD1-CD1 3.51Å; F301-I485 HydrophobicContact CE1-CD1 3.49Å; F301-I485 VanDerWaalsContact CE1-CD1 3.49Å; F301-I485 HydrophobicContact CE1-CG2 4.38Å; F301-I485 HydrophobicContact CG-CD1 4.42Å; F301-I485 HydrophobicContact CZ-CD1 4.34Å; F301-I485 HydrophobicContact CZ-CG2 4.28Å; I359-I485 HydrophobicContact CD1-CG2 3.46Å; I359-I485 VanDerWaalsContact CD1-CG2 3.46Å; I359-I485 HydrophobicContact CG1-CG2 3.69Å; S360-I485 WeakPolarHBondContact O-CA 3.49Å; M361-I485 HydrophobicContact CE-CD1 4.17Å; I449-I485 HydrophobicContact CD1-CD1 3.44Å; I449-I485 VanDerWaalsContact CD1-CD1 3.44Å; F483-I485 HydrophobicContact CD2-CG1 4.25Å; F483-I485 HydrophobicContact CE2-CD1 4.49Å; F483-I485 HydrophobicContact CE2-CG1 4.45Å; I485-V494 HydrophobicContact CB-CB 4.49Å; I485-V494 HydrophobicContact CG2-CB 4.29Å; I485-V494 PolarHBondContact O-N 3Å; I485-F495 HydrophobicContact CB-CB 4.07Å; I485-F495 HydrophobicContact CD1-CB 4.23Å; I485-F495 HydrophobicContact CD1-CD2 4.39Å; I485-F495 HydrophobicContact CG1-CB 4.11Å; I485-F495 PolarHBondContact N-O 2.72Å
486	Y	94.8	Very high	95.3	Very high	16 Å²	16	19.2 Å²	19.2	6%	0.063	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131.6	-175.7	-87.1	-82.4	0	0	0	112.6	I359 S360 V384 L484 C492 L493	I359-Y486 CarbonylContact C-O 3.4Å; I359-Y486 VanDerWaalsContact CA-O 3.22Å; I359-Y486 WeakPolarHBondContact CA-O 3.2Å; I359-Y486 WeakPolarHBondContact CG1-O 3.07Å; S360-Y486 PolarHBondContact N-O 3.03Å; S360-Y486 PolarHBondContact O-N 3.49Å; V384-Y486 HydrophobicContact CG1-CE2 3.73Å; L484-Y486 HydrophobicContact CB-CD2 3.88Å; L484-Y486 HydrophobicContact CB-CE2 3.62Å; L484-Y486 HydrophobicContact CD2-CE2 3.77Å; L484-Y486 HydrophobicContact CG-CE2 4.32Å; Y486-C492 WeakPolarHBondContact CA-O 3.42Å; Y486-L493 HydrophobicContact CD1-CB 4.49Å; Y486-L493 HydrophobicContact CD2-CD1 4.25Å; Y486-L493 HydrophobicContact CE1-CB 3.85Å; Y486-L493 HydrophobicContact CE1-CD1 4.28Å; Y486-L493 HydrophobicContact CE2-CD1 3.69Å
487	E	94.4	Very high	95.4	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	108.8	166.9	-163.4	-75.4	144.1	0	0	109.6	R214 L215 I359 R489 T490 D491 C492 V494	R214-E487 IonicContact CZ-OE1 2.83Å; R214-E487 VanDerWaalsContact CZ-OE1 3.28Å; R214-E487 IonicContact NE-OE1 3.25Å; R214-E487 PolarHBondContact NE-OE1 3.46Å; R214-E487 VanDerWaalsContact NE-OE1 3.1Å; R214-E487 IonicContact NE-OE2 2.81Å; R214-E487 PolarHBondContact NE-OE2 2.9Å; R214-E487 IonicContact NH2-OE1 3.08Å; R214-E487 PolarHBondContact NH2-OE1 3.18Å; L215-E487 HydrophobicContact CD2-CB 4.34Å; L215-E487 HydrophobicContact CD2-CG 4.17Å; I359-E487 HydrophobicContact CG1-CB 4.49Å; E487-R489 VanDerWaalsContact C-N 3.33Å; E487-R489 PolarHBondContact O-N 3.15Å; E487-R489 WeakPolarHBondContact OE1-CB 3.41Å; E487-R489 PolarHBondContact OE1-N 2.71Å; E487-R489 PolarHBondContact OE2-N 3.05Å; E487-T490 PolarHBondContact O-N 2.79Å; E487-T490 VanDerWaalsContact OE2-CB 3.26Å; E487-T490 WeakPolarHBondContact OE2-CB 3.34Å; E487-T490 VanDerWaalsContact OE2-CG2 3.3Å; E487-T490 WeakPolarHBondContact OE2-CG2 3.46Å; E487-T490 PolarHBondContact OE2-N 3.33Å; E487-T490 PolarHBondContact OE2-OG1 3.5Å; E487-D491 WeakPolarHBondContact O-CA 3.41Å; E487-D491 PolarHBondContact O-N 3.04Å; E487-C492 HydrophobicContact CB-CB 4.22Å; E487-C492 PolarHBondContact N-O 3.07Å; E487-C492 PolarHBondContact O-N 2.95Å; E487-V494 HydrophobicContact CB-CG2 4.25Å
488	H	90.1	Very high	95.3	Very high	49 Å²	49	17.5 Å²	17.5	23%	0.227	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-19.9	-166	-66.6	-71.9	0	0	0	114.8	Q352 N358 S360 T490	Q352-H488 PolarHBondContact NE2-CE1 3.49Å; Q352-H488 VanDerWaalsContact NE2-CE1 3.33Å; Q352-H488 PolarHBondContact NE2-NE2 2.67Å; N358-H488 PolarHBondContact O-N 3.39Å; S360-H488 VanDerWaalsContact CB-NE2 3.28Å; S360-H488 WeakPolarHBondContact CB-NE2 3.39Å; S360-H488 PolarHBondContact OG-CE1 3.35Å; S360-H488 PolarHBondContact OG-NE2 3.32Å; H488-T490 VanDerWaalsContact C-N 3.31Å
489	R	88.7	Confident	95.4	Very high	165 Å²	165	14.8 Å²	14.8	62%	0.623	6%	0.064	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-30.3	179	-166.9	-177.8	178.5	155.4	-4.8	111.5	N358 E487	N358-R489 PolarHBondContact ND2-N 3.19Å; E487-R489 VanDerWaalsContact C-N 3.33Å; E487-R489 PolarHBondContact O-N 3.15Å; E487-R489 WeakPolarHBondContact OE1-CB 3.41Å; E487-R489 PolarHBondContact OE1-N 2.71Å; E487-R489 PolarHBondContact OE2-N 3.05Å
490	T	89.4	Confident	95.4	Very high	6 Å²	6	14.1 Å²	14.1	4%	0.037	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-0	-174.9	65.4	0	0	0	0	113	L129 Q130 N133 E487 H488 C492	L129-T490 HydrophobicContact CD2-CG2 3.44Å; L129-T490 VanDerWaalsContact CD2-CG2 3.44Å; L129-T490 HydrophobicContact CG-CG2 4.12Å; Q130-T490 WeakPolarHBondContact CA-O 3.49Å; N133-T490 WeakPolarHBondContact CB-O 3.38Å; N133-T490 WeakPolarHBondContact ND2-CB 3.37Å; N133-T490 PolarHBondContact ND2-O 3.21Å; N133-T490 PolarHBondContact ND2-OG1 2.73Å; E487-T490 PolarHBondContact O-N 2.79Å; E487-T490 VanDerWaalsContact OE2-CB 3.26Å; E487-T490 WeakPolarHBondContact OE2-CB 3.34Å; E487-T490 VanDerWaalsContact OE2-CG2 3.3Å; E487-T490 WeakPolarHBondContact OE2-CG2 3.46Å; E487-T490 PolarHBondContact OE2-N 3.33Å; E487-T490 PolarHBondContact OE2-OG1 3.5Å; H488-T490 VanDerWaalsContact C-N 3.31Å; T490-C492 PolarHBondContact O-N 3.28Å; T490-C492 WeakPolarHBondContact OG1-CB 3.04Å
491	D	90.6	Very high	95.2	Very high	39 Å²	39	14.4 Å²	14.4	21%	0.209	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	36.6	-172.7	-57.9	-38.9	0	0	0	112.5	H126 Q130 N133 E487	H126-D491 IonicContact CD2-OD2 3.65Å; Q130-D491 VanDerWaalsContact CD-OD2 3.28Å; Q130-D491 HydrophobicContact CG-CB 4.22Å; Q130-D491 VanDerWaalsContact CG-OD2 3.24Å; Q130-D491 WeakPolarHBondContact CG-OD2 3.29Å; Q130-D491 PolarHBondContact NE2-OD2 3.17Å; N133-D491 WeakPolarHBondContact CB-O 3.3Å; E487-D491 WeakPolarHBondContact O-CA 3.41Å; E487-D491 PolarHBondContact O-N 3.04Å
492	C	94.8	Very high	95	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.007	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	120.9	-177.7	-170	0	0	0	0	110.6	N133 L211 Y486 E487 T490 V494	N133-C492 HydrophobicContact CB-CB 4.49Å; N133-C492 WeakPolarHBondContact ND2-CB 3.48Å; L211-C492 HydrophobicContact CD1-CB 4.32Å; Y486-C492 WeakPolarHBondContact CA-O 3.42Å; E487-C492 HydrophobicContact CB-CB 4.22Å; E487-C492 PolarHBondContact N-O 3.07Å; E487-C492 PolarHBondContact O-N 2.95Å; T490-C492 PolarHBondContact O-N 3.28Å; T490-C492 WeakPolarHBondContact OG1-CB 3.04Å; C492-V494 PolarHBondContact O-N 3.34Å
493	L	96.7	Very high	94.6	Very high	4 Å²	4	18.2 Å²	18.2	2%	0.021	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	99.4	166.3	179.1	62.6	0	0	0	108.9	A137 F141 P161 A162 L484 Y486 F495 I496	A137-L493 HydrophobicContact CB-CB 4.07Å; A137-L493 HydrophobicContact CB-CD2 4.23Å; F141-L493 HydrophobicContact CE1-CD2 4.02Å; F141-L493 HydrophobicContact CE2-CD2 4.49Å; F141-L493 HydrophobicContact CZ-CD2 3.99Å; P161-L493 HydrophobicContact CB-CD2 4.45Å; P161-L493 HydrophobicContact CG-CD2 3.92Å; P161-L493 HydrophobicContact CG-CG 4.17Å; A162-L493 WeakPolarHBondContact CB-O 3.45Å; A162-L493 PolarHBondContact N-O 3.37Å; L484-L493 HydrophobicContact CB-CD1 3.92Å; L484-L493 HydrophobicContact CD2-CD1 4.06Å; L484-L493 HydrophobicContact CG-CD1 4.43Å; Y486-L493 HydrophobicContact CD1-CB 4.49Å; Y486-L493 HydrophobicContact CD2-CD1 4.25Å; Y486-L493 HydrophobicContact CE1-CB 3.85Å; Y486-L493 HydrophobicContact CE1-CD1 4.28Å; Y486-L493 HydrophobicContact CE2-CD1 3.69Å; L493-F495 WeakPolarHBondContact CD1-O 3.37Å; L493-I496 HydrophobicContact CD1-CB 4.45Å
494	V	96.3	Very high	94	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	-49.2	-177.8	-169.4	0	0	0	0	110.3	A160 L224 I359 I485 E487 C492	A160-V494 VanDerWaalsContact CA-O 3.27Å; A160-V494 WeakPolarHBondContact CA-O 3.24Å; A160-V494 WeakPolarHBondContact CB-O 3.39Å; L224-V494 HydrophobicContact CD1-CG1 4.2Å; L224-V494 HydrophobicContact CD2-CG1 4.12Å; I359-V494 HydrophobicContact CD1-CG2 4.28Å; I485-V494 HydrophobicContact CB-CB 4.49Å; I485-V494 HydrophobicContact CG2-CB 4.29Å; I485-V494 PolarHBondContact O-N 3Å; E487-V494 HydrophobicContact CB-CG2 4.25Å; C492-V494 PolarHBondContact O-N 3.34Å
495	F	97.4	Very high	92.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	150.7	177	-70.8	-91.8	0	0	0	111.2	L158 L159 A160 L224 L299 F301 L484 I485 L493	L158-F495 HydrophobicContact CD1-CB 4.38Å; L158-F495 HydrophobicContact CD1-CD1 3.72Å; L158-F495 HydrophobicContact CD1-CE1 4.46Å; L158-F495 HydrophobicContact CD1-CG 4.4Å; L158-F495 HydrophobicContact CG-CD1 4.17Å; L159-F495 CarbonylContact O-C 3.55Å; L159-F495 VanDerWaalsContact O-CA 3.28Å; L159-F495 WeakPolarHBondContact O-CA 3.35Å; A160-F495 HydrophobicContact CB-CD1 3.61Å; A160-F495 HydrophobicContact CB-CE1 3.47Å; A160-F495 VanDerWaalsContact CB-CE1 3.47Å; A160-F495 HydrophobicContact CB-CG 4.29Å; A160-F495 HydrophobicContact CB-CZ 3.99Å; L224-F495 HydrophobicContact CD1-CE2 3.93Å; L299-F495 HydrophobicContact CB-CE1 4.21Å; L299-F495 HydrophobicContact CB-CZ 3.75Å; L299-F495 HydrophobicContact CD2-CZ 4.41Å; F301-F495 HydrophobicContact CB-CD2 4.13Å; F301-F495 HydrophobicContact CB-CE2 3.46Å; F301-F495 VanDerWaalsContact CB-CE2 3.46Å; F301-F495 HydrophobicContact CB-CZ 3.86Å; F301-F495 HydrophobicContact CG-CD2 4.47Å; F301-F495 HydrophobicContact CG-CE2 4.16Å; L484-F495 CarbonylContact C-O 3.59Å; L484-F495 WeakPolarHBondContact CA-O 3.35Å; I485-F495 HydrophobicContact CB-CB 4.07Å; I485-F495 HydrophobicContact CD1-CB 4.23Å; I485-F495 HydrophobicContact CD1-CD2 4.39Å; I485-F495 HydrophobicContact CG1-CB 4.11Å; I485-F495 PolarHBondContact N-O 2.72Å; L493-F495 WeakPolarHBondContact CD1-O 3.37Å
496	I	97.9	Very high	92.2	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	140.6	164	-177.6	173.2	0	0	0	107.5	F141 Y144 L159 P161 L482 F483 L484 L493	F141-I496 HydrophobicContact CD1-CD1 3.65Å; F141-I496 HydrophobicContact CE1-CD1 3.68Å; Y144-I496 HydrophobicContact CD1-CD1 4.38Å; Y144-I496 HydrophobicContact CD2-CD1 3.99Å; Y144-I496 HydrophobicContact CD2-CG1 4.06Å; Y144-I496 HydrophobicContact CD2-CG2 4Å; Y144-I496 HydrophobicContact CE2-CD1 4.43Å; Y144-I496 HydrophobicContact CE2-CG1 4.27Å; Y144-I496 HydrophobicContact CG-CD1 3.96Å; L159-I496 HydrophobicContact CB-CG2 3.83Å; L159-I496 HydrophobicContact CD2-CG2 4.18Å; L159-I496 HydrophobicContact CG-CG2 4.42Å; L159-I496 PolarHBondContact N-O 3.21Å; L159-I496 PolarHBondContact O-N 3.31Å; L159-I496 VanDerWaalsContact O-O 3.13Å; P161-I496 HydrophobicContact CG-CG2 3.89Å; L482-I496 HydrophobicContact CD1-CD1 4.48Å; L482-I496 HydrophobicContact CD1-CG1 4.25Å; F483-I496 CarbonylContact O-C 3.55Å; F483-I496 WeakPolarHBondContact O-CA 3.22Å; L484-I496 HydrophobicContact CD2-CD1 4.38Å; L484-I496 HydrophobicContact CG-CG1 4.32Å; L493-I496 HydrophobicContact CD1-CB 4.45Å
497	G	96.8	Very high	92.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	163.2	176.9	0	0	0	0	0	113.2	I157 L482 F483	I157-G497 CarbonylContact O-C 3.57Å; I157-G497 WeakPolarHBondContact O-CA 3.36Å; L482-G497 CarbonylContact C-O 3.48Å; L482-G497 WeakPolarHBondContact CA-O 3.49Å; L482-G497 WeakPolarHBondContact CD1-O 3.32Å; F483-G497 VanDerWaalsContact CD1-O 3.29Å; F483-G497 WeakPolarHBondContact CD1-O 3.46Å; F483-G497 PolarHBondContact N-O 3.39Å; F483-G497 PolarHBondContact O-N 3Å
498	R	96.6	Very high	91.9	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.015	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	131.8	173	175.8	-175.4	68.2	-164.6	11.5	108.4	Y144 N152 D155 N156 I157 M372 E376 F481 L482 V500	Y144-R498 WeakPolarHBondContact OH-CB 3.45Å; N152-R498 PolarHBondContact O-NH2 3.34Å; D155-R498 PolarHBondContact O-NE 2.87Å; D155-R498 PolarHBondContact O-NH2 3.39Å; N156-R498 WeakPolarHBondContact CA-O 3.34Å; I157-R498 HydrophobicContact CB-CB 4.31Å; I157-R498 PolarHBondContact N-O 2.63Å; I157-R498 PolarHBondContact O-N 3.27Å; M372-R498 HydrophobicContact SD-CG 4.44Å; E376-R498 VanDerWaalsContact OE1-CD 3.3Å; E376-R498 WeakPolarHBondContact OE1-CD 3.43Å; E376-R498 IonicContact OE1-CZ 3.63Å; E376-R498 IonicContact OE1-NE 2.71Å; E376-R498 IonicContact OE1-NH1 2.69Å; E376-R498 PolarHBondContact OE1-NH1 3.16Å; E376-R498 IonicContact OE2-NH1 2.82Å; E376-R498 PolarHBondContact OE2-NH1 2.84Å; F481-R498 WeakPolarHBondContact O-CA 3.47Å; L482-R498 HydrophobicContact CD1-CB 4.44Å; R498-V500 HydrophobicContact CG-CG2 3.72Å; R498-V500 VanDerWaalsContact NE-CG2 3.26Å
499	V	97	Very high	92.1	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	111.6	169.6	-179.9	0	0	0	0	107.3	N156 F403 L405 P480 F481 F483 P502	N156-V499 WeakPolarHBondContact OD1-CA 3.48Å; F403-V499 HydrophobicContact CD2-CG2 4.18Å; F403-V499 HydrophobicContact CE1-CG2 4.31Å; F403-V499 HydrophobicContact CE2-CG2 3.9Å; F403-V499 HydrophobicContact CG-CG2 4.47Å; F403-V499 HydrophobicContact CZ-CG2 3.97Å; L405-V499 HydrophobicContact CD1-CG2 4.06Å; P480-V499 WeakPolarHBondContact CA-O 3.48Å; F481-V499 HydrophobicContact CD1-CB 4Å; F481-V499 HydrophobicContact CD1-CG1 4.49Å; F481-V499 HydrophobicContact CE1-CB 3.49Å; F481-V499 VanDerWaalsContact CE1-CB 3.49Å; F481-V499 HydrophobicContact CE1-CG1 3.73Å; F481-V499 HydrophobicContact CE1-CG2 4.01Å; F481-V499 HydrophobicContact CE2-CB 4.14Å; F481-V499 HydrophobicContact CE2-CG2 3.91Å; F481-V499 HydrophobicContact CZ-CB 3.57Å; F481-V499 HydrophobicContact CZ-CG1 4.05Å; F481-V499 HydrophobicContact CZ-CG2 3.52Å; F481-V499 PolarHBondContact N-O 3.04Å; F481-V499 VanDerWaalsContact N-O 3.09Å; F481-V499 PolarHBondContact O-N 3Å; F483-V499 HydrophobicContact CD1-CG2 4.07Å; F483-V499 HydrophobicContact CE1-CG2 3.85Å; V499-P502 HydrophobicContact CG1-CB 4Å; V499-P502 HydrophobicContact CG1-CG 4.22Å
500	V	95.5	Very high	92.3	Very high	6 Å²	6	22.1 Å²	22.1	4%	0.036	12%	0.123	C	C	.	.	S	Bend	trans	-99.5	-35.6	172.5	-174.1	0	0	0	0	110.4	Q153 T154 D155 N156 F319 V321 P480 R498	Q153-V500 WeakPolarHBondContact O-CG2 3.18Å; T154-V500 WeakPolarHBondContact O-CB 3.25Å; T154-V500 WeakPolarHBondContact O-CG1 3.44Å; D155-V500 WeakPolarHBondContact O-CG2 3.25Å; N156-V500 PolarHBondContact OD1-N 2.71Å; F319-V500 VanDerWaalsContact CE1-O 3.25Å; F319-V500 WeakPolarHBondContact CE1-O 3.41Å; V321-V500 HydrophobicContact CG1-CG1 4.15Å; P480-V500 HydrophobicContact CG-CG1 4.15Å; R498-V500 HydrophobicContact CG-CG2 3.72Å; R498-V500 VanDerWaalsContact NE-CG2 3.26Å
501	N	94.1	Very high	92.5	Very high	12 Å²	12	23.2 Å²	23.2	6%	0.064	13%	0.129	C	C	.	.			trans	-139	109.2	172.9	-173.9	-9.6	0	0	0	110.7	N156 V321 S503 Q504	N156-N501 PolarHBondContact ND2-O 2.99Å; N156-N501 PolarHBondContact OD1-N 3.24Å; V321-N501 HydrophobicContact CG2-CB 4.25Å; N501-S503 PolarHBondContact ND2-OG 2.96Å; N501-S503 PolarHBondContact O-N 3.41Å; N501-S503 WeakPolarHBondContact OD1-CB 3.5Å; N501-S503 PolarHBondContact OD1-N 2.81Å; N501-S503 PolarHBondContact OD1-OG 3.43Å; N501-Q504 HydrophobicContact CB-CB 4.4Å; N501-Q504 HydrophobicContact CB-CG 4.08Å; N501-Q504 PolarHBondContact O-N 3.45Å; N501-Q504 VanDerWaalsContact O-N 3.15Å
502	P	92.8	Very high	92.6	Very high	8 Å²	8	22.1 Å²	22.1	5%	0.052	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-12.3	-179.4	12.7	-11.2	0	0	0	114.3	F319 V329 P401 F403 V499 Q504	F319-P502 HydrophobicContact CB-CG 4.34Å; F319-P502 HydrophobicContact CD1-CG 4.03Å; F319-P502 HydrophobicContact CD2-CG 3.63Å; F319-P502 HydrophobicContact CE1-CG 4.24Å; F319-P502 HydrophobicContact CE2-CG 3.84Å; F319-P502 HydrophobicContact CG-CG 3.72Å; F319-P502 HydrophobicContact CZ-CG 4.12Å; V329-P502 HydrophobicContact CB-CG 4.33Å; V329-P502 HydrophobicContact CG1-CB 4.41Å; V329-P502 HydrophobicContact CG1-CG 3.91Å; V329-P502 HydrophobicContact CG2-CG 4.13Å; P401-P502 HydrophobicContact CB-CB 3.86Å; P401-P502 HydrophobicContact CB-CG 3.86Å; P401-P502 HydrophobicContact CG-CB 4.25Å; P401-P502 HydrophobicContact CG-CG 4.11Å; F403-P502 HydrophobicContact CB-CB 3.89Å; V499-P502 HydrophobicContact CG1-CB 4Å; V499-P502 HydrophobicContact CG1-CG 4.22Å; P502-Q504 VanDerWaalsContact C-N 3.35Å
503	S	89.9	Confident	92.4	Very high	72 Å²	72	23.7 Å²	23.7	50%	0.503	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-8.2	174.5	82.4	0	0	0	0	113.6	N501	N501-S503 PolarHBondContact ND2-OG 2.96Å; N501-S503 PolarHBondContact O-N 3.41Å; N501-S503 WeakPolarHBondContact OD1-CB 3.5Å; N501-S503 PolarHBondContact OD1-N 2.81Å; N501-S503 PolarHBondContact OD1-OG 3.43Å
504	Q	85.2	Confident	92.1	Very high	86 Å²	86	25.3 Å²	25.3	40%	0.402	14%	0.141	S	C	.	.			trans	-98.7	136.5	176.5	-68.4	176.5	-10.6	0	0	110.2	N156 N501 P502	N156-Q504 PolarHBondContact ND2-O 3.23Å; N501-Q504 HydrophobicContact CB-CB 4.4Å; N501-Q504 HydrophobicContact CB-CG 4.08Å; N501-Q504 PolarHBondContact O-N 3.45Å; N501-Q504 VanDerWaalsContact O-N 3.15Å; P502-Q504 VanDerWaalsContact C-N 3.35Å
505	N	65.3	Low	91.7	Very high	116 Å²	116	27.6 Å²	27.6	62%	0.62	15%	0.154	S	C	*	.			trans	-87.1	0	176.8	-71	-39.3	0	0	0	111.7	K404 L405 E406 Q407	K404-N505 PolarHBondContact O-OD1 3.12Å; L405-N505 WeakPolarHBondContact CA-OXT 3.41Å; E406-N505 PolarHBondContact N-OXT 3.39Å; Q407-N505 PolarHBondContact NE2-OXT 3.28Å

Retrieved 505 of 505 residues in 502.8 ms (Link to these results)

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